data_6ufr_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6ufr _Structure_validation_residue.Date_analyzed 2020-02-14 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 ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.711 0 N-CA-C 112.291 -0.324 . . . . 40.39 112.291 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.17 124.98 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.528 -0.916 . . . . 39.01 108.528 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 15.9 tp -113.09 115.83 28.93 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.739 -1.208 . . . . 35.45 107.739 171.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.31 119.2 27.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.472 -0.566 . . . . 35.94 109.472 -173.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 37.3 t -124.2 118.35 53.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 108.425 -0.954 . . . . 34.76 108.425 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.14 127.45 5.9 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.684 -0.77 . . . . 36.61 113.13 176.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.59 128.57 23.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 117.995 0.898 . . . . 37.27 111.43 -167.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.72 122.08 42.56 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.745 0.818 . . . . 39.17 109.1 172.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.57 138.22 32.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 36.8 111.355 178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.45 -61.09 2.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.671 -0.695 . . . . 37.39 110.872 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.49 126.59 35.36 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.636 -0.665 . . . . 37.06 111.416 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.63 135.0 8.04 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 115.645 1.018 . . . . 32.87 115.645 172.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.78 121.52 63.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.423 -0.954 . . . . 30.14 108.423 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -133.73 127.35 52.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 C-N-CA 122.189 0.195 . . . . 28.72 110.707 -169.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.49 119.48 36.33 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.921 0.889 . . . . 30.14 109.831 171.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.17 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.287 0 N-CA-C 119.125 2.41 . . . . 29.64 119.125 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.52 124.79 25.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 118.096 0.948 . . . . 30.96 108.774 -171.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.71 129.13 43.8 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 122.218 0.207 . . . . 33.52 111.041 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 98.5 m -120.76 118.24 29.54 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.564 -1.273 . . . . 35.43 107.564 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 93.2 t -129.41 122.11 54.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 N-CA-C 109.657 -0.497 . . . . 36.61 109.657 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.84 132.54 38.73 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 111.729 0.27 . . . . 38.73 111.729 -177.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.09 124.23 36.49 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.383 -0.599 . . . . 42.66 109.383 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.07 37.41 28.62 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.887 0.875 . . . . 42.43 113.079 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -111.74 152.26 28.0 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 124.472 1.109 . . . . 42.68 109.751 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.11 -64.71 1.03 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 118.167 -1.413 . . . . 43.74 114.164 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.06 109.04 13.57 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.196 -0.94 . . . . 42.33 109.605 -177.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.1 126.22 42.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.286 -0.635 . . . . 36.49 109.286 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.52 57.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.449 -0.574 . . . . 33.16 109.449 -173.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.27 118.16 34.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.123 -1.066 . . . . 30.88 108.123 163.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.69 122.9 26.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.76 -0.459 . . . . 28.22 109.76 -168.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.73 119.62 58.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 108.594 -0.891 . . . . 27.29 108.594 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . 0.429 ' O ' ' O ' ' A' ' 201' ' ' HOH . . . -70.73 -37.4 66.84 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.317 -0.944 . . . . 26.78 114.196 -177.92 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.9 -135.92 7.48 Favored Glycine 0 N--CA 1.45 -0.42 0 O-C-N 121.895 -0.768 . . . . 27.35 114.701 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.64 162.09 13.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.708 0.754 . . . . 28.65 110.711 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.42 114.05 44.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.484 -1.673 . . . . 29.1 106.484 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -125.68 122.42 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 108.187 -1.042 . . . . 29.41 108.187 -173.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.12 127.37 35.85 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 122.307 0.243 . . . . 29.84 110.544 -175.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.44 176.45 41.95 Favored Glycine 0 CA--C 1.499 -0.949 0 C-N-CA 119.124 -1.512 . . . . 30.33 110.991 165.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.0 124.26 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.244 -1.762 . . . . 32.13 106.244 159.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.8 m 60.42 81.33 0.18 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.237 -0.585 . . . . 33.05 111.862 -169.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.74 56.51 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.368 0.667 . . . . 31.72 111.009 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -133.48 128.73 55.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 122.867 0.467 . . . . 31.36 109.895 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.45 130.18 48.81 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 122.354 0.262 . . . . 31.08 110.298 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.36 132.35 37.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 122.267 0.227 . . . . 33.03 110.891 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.84 137.22 41.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 111.662 0.245 . . . . 33.64 111.662 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.48 128.99 44.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 123.542 0.737 . . . . 37.23 110.657 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.16 116.75 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.056 -0.72 . . . . 39.19 109.056 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.68 108.84 16.9 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 118.29 -0.862 . . . . 44.56 110.016 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.16 7.51 Favored Glycine 0 CA--C 1.504 -0.596 0 O-C-N 124.796 1.31 . . . . 43.14 113.261 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.01 152.1 29.63 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.625 0.712 . . . . 41.86 110.307 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.52 47.45 89.88 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 116.403 1.321 . . . . 39.23 116.403 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.97 143.92 26.52 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 117.501 0.651 . . . . 38.46 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 63.2 mt -124.53 120.79 59.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.618 -0.882 . . . . 36.58 108.618 -176.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.59 115.92 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.135 -1.061 . . . . 34.07 108.135 169.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.18 34.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.454 -0.202 . . . . 33.16 110.454 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.63 127.4 42.16 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.768 -0.456 . . . . 30.92 109.768 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.86 130.5 33.97 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 123.083 0.239 . . . . 31.4 110.598 -175.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.14 -72.21 0.59 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.776 -1.202 . . . . 32.81 113.35 175.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 23.0 p90 -149.87 157.19 42.94 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.8 -0.76 . . . . 36.13 109.657 174.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.0 125.35 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 115.281 -0.872 . . . . 38.53 108.684 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.15 119.4 35.12 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.605 -0.887 . . . . 41.79 108.605 174.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.12 123.26 28.21 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.754 -0.462 . . . . 49.58 109.754 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.534 0 O-C-N 123.217 0.323 . . . . 56.02 110.785 171.043 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.732 0 N-CA-C 112.257 -0.337 . . . . 40.39 112.257 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.14 124.97 65.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.52 -0.919 . . . . 39.01 108.52 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 15.8 tp -113.1 115.8 28.88 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.769 -1.197 . . . . 35.45 107.769 171.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -125.29 119.15 27.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.401 -0.592 . . . . 35.94 109.401 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 37.4 t -124.23 118.37 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 108.424 -0.954 . . . . 34.76 108.424 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.06 127.43 5.91 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.756 -0.735 . . . . 36.61 113.162 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.59 23.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 117.993 0.896 . . . . 37.27 111.366 -167.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.14 42.7 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.695 0.798 . . . . 39.17 109.111 172.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.66 138.2 32.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.11 0.481 . . . . 36.8 111.334 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.42 -61.1 2.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.639 -0.71 . . . . 37.39 110.874 175.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.54 126.56 35.19 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.558 -0.714 . . . . 37.06 111.409 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.59 135.0 8.04 Favored Glycine 0 C--N 1.333 0.394 0 N-CA-C 115.682 1.033 . . . . 32.87 115.682 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.83 121.46 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.4 -0.963 . . . . 30.14 108.4 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -133.7 127.42 52.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 C-N-CA 122.176 0.191 . . . . 28.72 110.713 -169.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -115.56 119.52 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.927 0.891 . . . . 30.14 109.809 171.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.82 0.96 Allowed Glycine 0 C--N 1.331 0.288 0 N-CA-C 119.109 2.404 . . . . 29.64 119.109 -175.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.48 124.88 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 118.067 0.934 . . . . 30.96 108.722 -171.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.79 129.15 43.71 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 122.218 0.207 . . . . 33.52 111.081 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 98.4 m -120.77 118.18 29.37 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.595 -1.261 . . . . 35.43 107.595 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.42 122.11 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 109.629 -0.508 . . . . 36.61 109.629 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.83 132.62 38.84 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 111.679 0.251 . . . . 38.73 111.679 -177.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.15 36.26 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.458 -0.571 . . . . 42.66 109.458 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.1 37.42 28.57 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.878 0.871 . . . . 42.43 113.058 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.83 152.27 28.09 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.478 1.111 . . . . 42.68 109.736 -172.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.15 -64.66 1.03 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 118.162 -1.415 . . . . 43.74 114.177 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.04 109.01 13.55 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.184 -0.947 . . . . 42.33 109.697 -177.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.23 42.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.236 -0.653 . . . . 36.49 109.236 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 17.4 t -130.65 124.44 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 109.439 -0.578 . . . . 33.16 109.439 -173.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.19 118.24 34.79 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.097 -1.075 . . . . 30.88 108.097 163.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.74 122.89 26.61 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.735 -0.468 . . . . 28.22 109.735 -168.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 t -122.7 119.59 58.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 108.6 -0.889 . . . . 27.29 108.6 -175.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' C' ' 201' ' ' HOH . . . -70.73 -37.43 66.88 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.374 -0.917 . . . . 26.78 114.144 -177.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.96 -135.9 7.49 Favored Glycine 0 C--O 1.225 -0.411 0 O-C-N 121.932 -0.746 . . . . 27.35 114.688 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.62 162.09 13.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 117.69 0.745 . . . . 28.65 110.66 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.44 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 106.434 -1.691 . . . . 29.1 106.434 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' VAL . . . . . . . . . . . . . 19.1 t -125.68 122.44 62.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.17 -1.048 . . . . 29.41 108.17 -173.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.17 127.38 35.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.249 0.22 . . . . 29.84 110.474 -175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.45 176.44 41.94 Favored Glycine 0 CA--C 1.499 -0.956 0 C-N-CA 119.129 -1.51 . . . . 30.33 111.027 165.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.98 124.24 23.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.253 -1.758 . . . . 32.13 106.253 159.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.2 -0.6 . . . . 33.05 111.839 -169.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.17 128.76 56.52 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 123.36 0.664 . . . . 31.72 111.053 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.48 128.75 55.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 C-N-CA 122.894 0.478 . . . . 31.36 109.877 -176.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.44 130.1 48.69 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 122.359 0.264 . . . . 31.08 110.314 172.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.29 132.37 37.66 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 122.257 0.223 . . . . 33.03 110.899 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.82 137.21 41.31 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 111.686 0.254 . . . . 33.64 111.686 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.44 128.95 43.99 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 123.556 0.742 . . . . 37.23 110.735 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.16 116.82 51.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.988 -0.745 . . . . 39.19 108.988 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.77 108.79 16.79 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 118.305 -0.855 . . . . 44.56 110.0 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.59 0 O-C-N 124.786 1.304 . . . . 43.14 113.234 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.91 152.01 29.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 117.584 0.692 . . . . 41.86 110.387 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.63 47.4 90.35 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 116.402 1.321 . . . . 39.23 116.402 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.02 143.97 26.48 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 117.512 0.656 . . . . 38.46 110.265 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' ILE . . . . . . . . . . . . . 63.4 mt -124.53 120.73 59.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.605 -0.887 . . . . 36.58 108.605 -176.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 115.94 26.71 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.149 -1.056 . . . . 34.07 108.149 169.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.59 127.16 34.42 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.47 -0.196 . . . . 33.16 110.47 -174.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.57 127.4 42.24 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 122.845 0.458 . . . . 30.92 109.784 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.53 33.91 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 123.059 0.224 . . . . 31.4 110.603 -175.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.12 -72.18 0.6 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 119.745 -1.217 . . . . 32.81 113.357 175.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -149.87 157.22 42.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.808 -0.757 . . . . 36.13 109.675 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 14.9 t -126.07 125.37 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 CA-C-N 115.275 -0.875 . . . . 38.53 108.65 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.17 119.41 35.12 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.592 -0.892 . . . . 41.79 108.592 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.14 123.27 28.19 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.735 -0.469 . . . . 49.58 109.735 -174.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.502 -0.317 . . . . 56.02 110.822 171.0 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.719 0 N-CA-C 112.276 -0.329 . . . . 40.39 112.276 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.13 124.96 65.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 108.534 -0.913 . . . . 39.01 108.534 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' LEU . . . . . . . . . . . . . 15.8 tp -113.09 115.85 28.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.791 -1.189 . . . . 35.45 107.791 171.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.29 119.2 27.76 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.414 -0.588 . . . . 35.94 109.414 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' VAL . . . . . . . . . . . . . 36.5 t -124.21 118.31 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 108.476 -0.935 . . . . 34.76 108.476 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.05 127.5 5.93 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.723 -0.751 . . . . 36.61 113.118 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.56 23.48 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.982 0.891 . . . . 37.27 111.345 -167.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.67 122.1 42.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 123.739 0.816 . . . . 39.17 109.135 172.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.56 138.2 32.5 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.024 0.44 . . . . 36.8 111.353 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.46 -61.04 2.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.694 -0.684 . . . . 37.39 110.891 175.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.55 126.59 35.26 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.617 -0.677 . . . . 37.06 111.41 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.63 135.01 8.04 Favored Glycine 0 C--N 1.333 0.391 0 N-CA-C 115.665 1.026 . . . . 32.87 115.665 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.77 121.53 63.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 108.406 -0.961 . . . . 30.14 108.406 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.76 127.37 52.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 122.153 0.181 . . . . 28.72 110.652 -169.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 50' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -115.53 119.48 36.3 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.948 0.899 . . . . 30.14 109.825 171.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.18 -74.77 0.96 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 119.123 2.409 . . . . 29.64 119.123 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.56 124.88 25.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.184 0 CA-C-N 118.082 0.941 . . . . 30.96 108.724 -171.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.79 129.18 43.74 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.177 0.191 . . . . 33.52 111.048 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.77 118.19 29.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.614 -1.254 . . . . 35.43 107.614 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.42 122.08 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.635 -0.506 . . . . 36.61 109.635 -173.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.78 132.57 38.89 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.723 0.268 . . . . 38.73 111.723 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.16 36.29 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.454 -0.572 . . . . 42.66 109.454 175.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.15 37.39 28.44 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.895 0.878 . . . . 42.43 113.032 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 59' ' ' THR . . . . . . . . . . . . . 53.0 m -111.79 152.27 28.04 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.504 1.121 . . . . 42.68 109.772 -172.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.13 -64.71 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 118.14 -1.424 . . . . 43.74 114.154 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.0 109.06 13.63 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.21 -0.931 . . . . 42.33 109.665 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.15 126.17 42.41 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.275 -0.639 . . . . 36.49 109.275 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.5 57.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 109.453 -0.573 . . . . 33.16 109.453 -173.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.23 118.2 34.64 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.09 -1.078 . . . . 30.88 108.09 163.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.68 122.87 26.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.828 -0.434 . . . . 28.22 109.828 -168.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -122.72 119.62 58.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 108.556 -0.905 . . . . 27.29 108.556 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 67' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' E' ' 201' ' ' HOH . . . -70.8 -37.35 66.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.337 -0.935 . . . . 26.78 114.139 -177.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.93 -135.94 7.5 Favored Glycine 0 N--CA 1.45 -0.431 0 O-C-N 121.879 -0.777 . . . . 27.35 114.712 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.65 162.1 13.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.719 0.76 . . . . 28.65 110.662 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 70' ' ' VAL . . . . . . . . . . . . . 50.8 t -116.46 114.09 44.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 106.39 -1.707 . . . . 29.1 106.39 175.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 71' ' ' VAL . . . . . . . . . . . . . 19.1 t -125.68 122.42 62.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 108.187 -1.042 . . . . 29.41 108.187 -173.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -132.14 127.41 35.89 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.292 0.237 . . . . 29.84 110.517 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.42 176.44 41.91 Favored Glycine 0 CA--C 1.499 -0.928 0 C-N-CA 119.145 -1.502 . . . . 30.33 111.05 165.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.99 124.28 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 106.257 -1.757 . . . . 32.13 106.257 159.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 75' ' ' THR . . . . . . . . . . . . . 23.7 m 60.46 81.26 0.19 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.198 -0.601 . . . . 33.05 111.861 -169.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.76 56.52 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.32 0.648 . . . . 31.72 111.071 176.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 77' ' ' VAL . . . . . . . . . . . . . 50.7 t -133.46 128.74 55.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 122.832 0.453 . . . . 31.36 109.858 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.47 130.11 48.64 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 110.278 -0.268 . . . . 31.08 110.278 172.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.29 132.39 37.68 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 123.12 0.263 . . . . 33.03 110.871 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.8 137.17 41.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 111.698 0.258 . . . . 33.64 111.698 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.47 128.99 44.03 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 123.603 0.761 . . . . 37.23 110.674 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.09 116.72 51.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.043 -0.725 . . . . 39.19 109.043 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.68 108.78 16.82 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 118.246 -0.883 . . . . 44.56 110.08 -178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.91 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 124.82 1.325 . . . . 43.14 113.217 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.1 29.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 117.564 0.682 . . . . 41.86 110.297 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.58 47.41 90.17 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 116.395 1.318 . . . . 39.23 116.395 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.05 143.95 26.49 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 117.537 0.668 . . . . 38.46 110.278 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.54 120.72 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.636 -0.876 . . . . 36.58 108.636 -176.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.51 115.92 26.67 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.127 -1.064 . . . . 34.07 108.127 169.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.57 127.17 34.48 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.479 -0.193 . . . . 33.16 110.479 -174.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.54 127.44 42.37 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.752 -0.462 . . . . 30.92 109.752 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.92 130.53 33.9 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.114 0.259 . . . . 31.4 110.621 -175.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.16 -72.19 0.6 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.729 -1.224 . . . . 32.81 113.346 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.84 157.19 42.95 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.802 -0.759 . . . . 36.13 109.677 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.05 125.38 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 108.663 -0.865 . . . . 38.53 108.663 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.25 119.42 35.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.584 -0.895 . . . . 41.79 108.584 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.07 123.29 28.33 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.751 -0.462 . . . . 49.58 109.751 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 120.761 0.315 . . . . 56.02 110.827 171.019 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.702 0 N-CA-C 112.218 -0.353 . . . . 40.39 112.218 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.14 124.98 65.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.547 -0.908 . . . . 39.01 108.547 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.06 115.76 28.85 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.769 -1.197 . . . . 35.45 107.769 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.3 119.21 27.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.409 -0.589 . . . . 35.94 109.409 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.22 118.37 53.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 108.438 -0.949 . . . . 34.76 108.438 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.11 127.49 5.92 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.747 -0.74 . . . . 36.61 113.094 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.61 23.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.926 0.863 . . . . 37.27 111.384 -167.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 43' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -117.77 122.09 42.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 123.678 0.791 . . . . 39.17 109.142 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.59 138.13 32.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 36.8 111.401 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.37 -61.13 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.661 -0.7 . . . . 37.39 110.861 175.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.51 126.55 35.21 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.597 -0.689 . . . . 37.06 111.434 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.61 135.02 8.05 Favored Glycine 0 C--N 1.333 0.399 0 N-CA-C 115.646 1.018 . . . . 32.87 115.646 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.83 121.47 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 108.409 -0.96 . . . . 30.14 108.409 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 49' ' ' VAL . . . . . . . . . . . . . 58.3 t -133.72 127.39 52.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.118 0 C-N-CA 122.196 0.198 . . . . 28.72 110.731 -169.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.51 119.44 36.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.925 0.89 . . . . 30.14 109.853 171.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.73 0.96 Allowed Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 119.139 2.416 . . . . 29.64 119.139 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.52 124.84 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 118.096 0.948 . . . . 30.96 108.771 -171.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.76 129.08 43.67 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.243 0.217 . . . . 33.52 111.088 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 54' ' ' THR . . . . . . . . . . . . . 98.2 m -120.69 118.2 29.47 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 107.607 -1.257 . . . . 35.43 107.607 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 55' ' ' VAL . . . . . . . . . . . . . 92.8 t -129.48 122.13 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.583 -0.525 . . . . 36.61 109.583 -173.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.59 38.83 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 111.716 0.265 . . . . 38.73 111.716 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.11 124.21 36.4 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.394 -0.595 . . . . 42.66 109.394 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.04 37.44 28.71 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 123.88 0.872 . . . . 42.43 113.05 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -111.79 152.23 28.1 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 124.538 1.135 . . . . 42.68 109.768 -172.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.12 -64.65 1.03 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 118.156 -1.418 . . . . 43.74 114.209 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.04 109.05 13.6 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.235 -0.916 . . . . 42.33 109.682 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.1 126.15 42.49 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.285 -0.635 . . . . 36.49 109.285 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.6 124.52 57.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.409 -0.589 . . . . 33.16 109.409 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 64' ' ' THR . . . . . . . . . . . . . 3.6 m -112.24 118.1 34.37 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.121 -1.066 . . . . 30.88 108.121 163.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.66 122.89 26.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.78 -0.452 . . . . 28.22 109.78 -168.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 t -122.74 119.62 58.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.549 -0.908 . . . . 27.29 108.549 -175.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 67' ' ' GLY . . . . . 0.448 ' O ' ' O ' ' G' ' 201' ' ' HOH . . . -70.82 -37.39 66.06 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.342 -0.932 . . . . 26.78 114.092 -177.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.89 -135.93 7.47 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 117.709 0.754 . . . . 27.35 114.727 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.6 162.11 13.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 117.718 0.759 . . . . 28.65 110.691 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.5 114.05 44.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.42 -1.696 . . . . 29.1 106.42 175.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -125.68 122.44 62.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.181 -1.044 . . . . 29.41 108.181 -173.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -132.11 127.4 35.95 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.288 0.235 . . . . 29.84 110.535 -175.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.42 176.47 41.94 Favored Glycine 0 CA--C 1.5 -0.868 0 C-N-CA 119.062 -1.542 . . . . 30.33 110.954 165.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.05 124.28 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.232 -1.766 . . . . 32.13 106.232 159.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 75' ' ' THR . . . . . . . . . . . . . 23.8 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.196 -0.602 . . . . 33.05 111.859 -169.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.18 128.75 56.52 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.364 0.666 . . . . 31.72 111.022 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 77' ' ' VAL . . . . . . . . . . . . . 50.6 t -133.48 128.79 55.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 C-N-CA 122.855 0.462 . . . . 31.36 109.852 -176.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.48 130.11 48.64 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 122.377 0.271 . . . . 31.08 110.279 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.34 132.42 37.6 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.026 0.204 . . . . 33.03 110.864 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.81 137.16 41.29 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 111.702 0.26 . . . . 33.64 111.702 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -129.46 128.96 43.97 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.582 0.753 . . . . 37.23 110.685 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.13 116.79 51.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 108.991 -0.744 . . . . 39.19 108.991 176.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.75 108.84 16.85 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 118.309 -0.853 . . . . 44.56 110.024 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.86 154.15 7.5 Favored Glycine 0 N--CA 1.447 -0.603 0 O-C-N 124.764 1.29 . . . . 43.14 113.203 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.1 29.7 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 117.543 0.672 . . . . 41.86 110.357 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.54 47.49 89.7 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 116.408 1.323 . . . . 39.23 116.408 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.04 143.9 26.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.544 0.672 . . . . 38.46 110.253 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.51 120.7 59.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 108.633 -0.877 . . . . 36.58 108.633 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 115.94 26.7 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.099 -1.074 . . . . 34.07 108.099 169.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.19 34.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.461 -0.2 . . . . 33.16 110.461 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.6 127.46 42.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.711 -0.478 . . . . 30.92 109.711 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.51 33.87 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.065 0.228 . . . . 31.4 110.606 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.17 -72.2 0.6 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.737 -1.22 . . . . 32.81 113.346 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 94' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.84 157.22 42.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.849 -0.741 . . . . 36.13 109.689 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.04 125.36 67.85 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.266 -0.879 . . . . 38.53 108.685 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.16 119.45 35.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.569 -0.9 . . . . 41.79 108.569 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.16 123.23 28.09 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.775 -0.454 . . . . 49.58 109.775 -174.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 56.02 110.828 171.031 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.727 0 N-CA-C 112.205 -0.358 . . . . 40.39 112.205 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 37' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.18 125.0 65.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.523 -0.917 . . . . 39.01 108.523 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 38' ' ' LEU . . . . . . . . . . . . . 16.1 tp -113.08 115.83 28.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.77 -1.196 . . . . 35.45 107.77 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.34 119.21 27.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.421 -0.585 . . . . 35.94 109.421 -173.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 40' ' ' VAL . . . . . . . . . . . . . 36.7 t -124.2 118.32 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.457 -0.942 . . . . 34.76 108.457 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.1 127.44 5.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.715 -0.755 . . . . 36.61 113.072 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.58 23.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.981 0.89 . . . . 37.27 111.38 -167.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.12 42.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.684 0.794 . . . . 39.17 109.126 172.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.59 138.21 32.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.042 0.449 . . . . 36.8 111.358 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.43 -61.07 2.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 37.39 110.925 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.56 126.59 35.22 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.595 -0.691 . . . . 37.06 111.399 -179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.61 134.98 8.03 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 115.671 1.029 . . . . 32.87 115.671 172.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.84 121.49 63.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 108.406 -0.961 . . . . 30.14 108.406 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.75 127.39 52.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 C-N-CA 122.162 0.185 . . . . 28.72 110.676 -169.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 50' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -115.51 119.45 36.23 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.962 0.905 . . . . 30.14 109.881 171.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.12 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 119.1 2.4 . . . . 29.64 119.1 -175.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -138.53 124.8 25.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 118.087 0.943 . . . . 30.96 108.765 -171.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.72 129.17 43.85 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 122.225 0.21 . . . . 33.52 111.083 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.75 118.14 29.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.63 -1.248 . . . . 35.43 107.63 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.41 122.11 54.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 109.614 -0.513 . . . . 36.61 109.614 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.63 38.88 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 111.717 0.266 . . . . 38.73 111.717 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.09 124.14 36.27 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.445 -0.576 . . . . 42.66 109.445 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.11 37.45 28.55 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.888 0.875 . . . . 42.43 113.04 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' THR . . . . . . . . . . . . . 52.6 m -111.8 152.21 28.13 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 124.534 1.134 . . . . 42.68 109.76 -172.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.11 -64.67 1.03 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 118.18 -1.408 . . . . 43.74 114.187 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.08 109.09 13.63 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 121.185 -0.947 . . . . 42.33 109.614 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.16 42.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.287 -0.634 . . . . 36.49 109.287 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.53 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.439 -0.578 . . . . 33.16 109.439 -173.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.29 118.21 34.63 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.093 -1.076 . . . . 30.88 108.093 163.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.69 122.9 26.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.723 -0.473 . . . . 28.22 109.723 -168.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 t -122.75 119.63 58.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 N-CA-C 108.568 -0.901 . . . . 27.29 108.568 -175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 67' ' ' GLY . . . . . 0.454 ' O ' ' O ' ' I' ' 201' ' ' HOH . . . -70.74 -37.35 66.76 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.359 -0.924 . . . . 26.78 114.195 -177.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.96 -135.92 7.5 Favored Glycine 0 C--O 1.225 -0.446 0 O-C-N 121.936 -0.744 . . . . 27.35 114.689 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.6 162.14 13.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.663 0.732 . . . . 28.65 110.646 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 70' ' ' VAL . . . . . . . . . . . . . 51.3 t -116.46 114.03 44.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 106.43 -1.692 . . . . 29.1 106.43 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -125.65 122.45 62.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 108.167 -1.049 . . . . 29.41 108.167 -173.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.19 127.42 35.8 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.263 0.225 . . . . 29.84 110.546 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.44 176.41 41.91 Favored Glycine 0 CA--C 1.499 -0.919 0 C-N-CA 119.099 -1.524 . . . . 30.33 110.965 165.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.08 124.28 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 106.201 -1.777 . . . . 32.13 106.201 159.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 75' ' ' THR . . . . . . . . . . . . . 24.0 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.228 -0.589 . . . . 33.05 111.834 -169.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.72 56.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.365 0.666 . . . . 31.72 111.021 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -133.45 128.73 55.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 122.859 0.464 . . . . 31.36 109.862 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.47 130.16 48.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.272 -0.27 . . . . 31.08 110.272 172.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.33 132.35 37.56 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 122.26 0.224 . . . . 33.03 110.904 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.75 137.22 41.44 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 111.701 0.26 . . . . 33.64 111.701 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 81' ' ' THR . . . . . . . . . . . . . 98.5 m -129.52 128.98 43.92 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 123.525 0.73 . . . . 37.23 110.65 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.11 116.75 51.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.988 -0.745 . . . . 39.19 108.988 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.7 108.79 16.82 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 118.263 -0.875 . . . . 44.56 110.062 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.92 154.15 7.51 Favored Glycine 0 N--CA 1.447 -0.618 0 O-C-N 124.752 1.283 . . . . 43.14 113.24 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.92 152.11 29.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.566 0.683 . . . . 41.86 110.333 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.51 47.44 89.93 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 116.426 1.33 . . . . 39.23 116.426 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 87' ' ' SER . . . . . . . . . . . . . 42.9 t -89.03 143.89 26.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.48 0.64 . . . . 38.46 110.282 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.5 120.76 59.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.637 -0.875 . . . . 36.58 108.637 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.56 115.95 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.101 -1.074 . . . . 34.07 108.101 169.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.17 34.45 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.538 -0.171 . . . . 33.16 110.538 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.61 127.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 122.897 0.479 . . . . 30.92 109.751 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.57 33.98 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.09 0.244 . . . . 31.4 110.614 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.18 -72.21 0.6 Allowed Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.751 -1.214 . . . . 32.81 113.331 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 94' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -149.85 157.19 42.94 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.802 -0.759 . . . . 36.13 109.682 174.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.03 125.38 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.692 -0.855 . . . . 38.53 108.692 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.24 119.44 35.18 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.532 -0.914 . . . . 41.79 108.532 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.11 123.23 28.16 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.738 -0.467 . . . . 49.58 109.738 -174.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.529 -0.305 . . . . 56.02 110.798 170.971 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.674 0 N-CA-C 112.237 -0.345 . . . . 40.39 112.237 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' VAL . . . . . . . . . . . . . 40.5 t -127.1 124.99 65.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.555 -0.906 . . . . 39.01 108.555 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.11 115.83 28.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.745 -1.205 . . . . 35.45 107.745 171.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -125.35 119.18 27.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.416 -0.587 . . . . 35.94 109.416 -173.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 40' ' ' VAL . . . . . . . . . . . . . 36.5 t -124.19 118.34 53.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.441 -0.948 . . . . 34.76 108.441 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.07 127.45 5.92 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.74 -0.743 . . . . 36.61 113.126 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.57 23.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.979 0.89 . . . . 37.27 111.413 -167.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.08 42.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.679 0.792 . . . . 39.17 109.142 172.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.56 138.13 32.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.036 0.446 . . . . 36.8 111.366 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.01 2.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.685 -0.689 . . . . 37.39 110.9 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.53 126.52 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.558 -0.714 . . . . 37.06 111.414 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.64 135.04 8.06 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 115.671 1.028 . . . . 32.87 115.671 172.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.79 121.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 108.356 -0.979 . . . . 30.14 108.356 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 49' ' ' VAL . . . . . . . . . . . . . 58.3 t -133.74 127.33 52.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 C-N-CA 122.203 0.201 . . . . 28.72 110.708 -169.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.48 119.45 36.25 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.97 0.908 . . . . 30.14 109.832 171.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.77 0.96 Allowed Glycine 0 C--N 1.331 0.264 0 N-CA-C 119.107 2.403 . . . . 29.64 119.107 -175.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.56 124.83 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 118.108 0.954 . . . . 30.96 108.702 -171.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.73 129.11 43.75 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 122.253 0.221 . . . . 33.52 111.088 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 54' ' ' THR . . . . . . . . . . . . . 98.2 m -120.71 118.19 29.44 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 107.578 -1.267 . . . . 35.43 107.578 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 55' ' ' VAL . . . . . . . . . . . . . 92.9 t -129.45 122.09 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.614 -0.513 . . . . 36.61 109.614 -173.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.81 132.62 38.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.701 0.26 . . . . 38.73 111.701 -177.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.1 124.18 36.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.428 -0.582 . . . . 42.66 109.428 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.1 37.38 28.55 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.874 0.87 . . . . 42.43 113.087 -178.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.8 152.28 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.469 1.108 . . . . 42.68 109.76 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.16 -64.65 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 118.123 -1.431 . . . . 43.74 114.132 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.07 109.02 13.55 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.202 -0.936 . . . . 42.33 109.61 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.06 126.14 42.53 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.316 -0.624 . . . . 36.49 109.316 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.59 124.49 57.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 109.421 -0.585 . . . . 33.16 109.421 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.24 118.19 34.6 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.151 -1.055 . . . . 30.88 108.151 163.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 65' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -131.73 122.89 26.61 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.744 -0.465 . . . . 28.22 109.744 -168.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.74 119.62 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 108.533 -0.914 . . . . 27.29 108.533 -175.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 67' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' F' ' 201' ' ' HOH . . . -70.76 -37.42 66.61 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.349 -0.929 . . . . 26.78 114.123 -177.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.91 -135.97 7.5 Favored Glycine 0 N--CA 1.45 -0.423 0 O-C-N 121.93 -0.747 . . . . 27.35 114.686 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.57 162.06 13.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 117.694 0.747 . . . . 28.65 110.717 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 70' ' ' VAL . . . . . . . . . . . . . 51.4 t -116.43 114.08 44.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.455 -1.683 . . . . 29.1 106.455 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -125.68 122.39 62.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.177 -1.046 . . . . 29.41 108.177 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.16 127.46 35.96 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 122.272 0.229 . . . . 29.84 110.525 -175.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.4 176.44 41.9 Favored Glycine 0 CA--C 1.499 -0.95 0 C-N-CA 119.136 -1.507 . . . . 30.33 111.036 165.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.04 124.27 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.265 -1.754 . . . . 32.13 106.265 159.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 75' ' ' THR . . . . . . . . . . . . . 24.0 m 60.4 81.33 0.18 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.263 -0.575 . . . . 33.05 111.831 -169.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.15 128.76 56.52 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.36 0.664 . . . . 31.72 111.048 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.48 128.77 55.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 C-N-CA 122.874 0.47 . . . . 31.36 109.856 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.5 130.08 48.54 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 122.384 0.274 . . . . 31.08 110.287 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.31 132.33 37.57 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 122.26 0.224 . . . . 33.03 110.925 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.83 137.15 41.24 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 111.684 0.253 . . . . 33.64 111.684 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.4 129.03 44.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 123.541 0.736 . . . . 37.23 110.678 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.18 116.79 51.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.018 -0.734 . . . . 39.19 109.018 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.73 108.8 16.82 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 118.299 -0.858 . . . . 44.56 110.043 -178.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.91 154.18 7.52 Favored Glycine 0 N--CA 1.446 -0.638 0 O-C-N 124.77 1.294 . . . . 43.14 113.225 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.98 152.09 29.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.592 0.696 . . . . 41.86 110.34 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.48 47.52 89.4 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 116.398 1.319 . . . . 39.23 116.398 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 87' ' ' SER . . . . . . . . . . . . . 43.1 t -89.02 143.89 26.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 117.548 0.674 . . . . 38.46 110.283 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.54 120.72 59.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 108.628 -0.879 . . . . 36.58 108.628 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.52 115.91 26.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.137 -1.06 . . . . 34.07 108.137 169.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.55 127.15 34.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.505 -0.183 . . . . 33.16 110.505 -174.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.56 127.35 42.16 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 122.869 0.467 . . . . 30.92 109.775 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.81 130.54 34.15 Favored 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 123.085 0.24 . . . . 31.4 110.621 -175.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.22 -72.14 0.61 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.721 -1.228 . . . . 32.81 113.336 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.88 157.23 42.97 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.808 -0.757 . . . . 36.13 109.657 174.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.1 125.4 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 CA-C-N 115.249 -0.887 . . . . 38.53 108.638 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.2 119.47 35.29 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.581 -0.896 . . . . 41.79 108.581 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.15 123.23 28.09 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 109.778 -0.453 . . . . 49.58 109.778 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.517 0 O-C-N 123.201 0.313 . . . . 56.02 110.789 171.002 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.751 0 N-CA-C 112.247 -0.341 . . . . 40.39 112.247 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.11 125.01 65.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.517 -0.92 . . . . 39.01 108.517 -177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.13 115.81 28.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.745 -1.206 . . . . 35.45 107.745 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.32 119.18 27.66 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.391 -0.596 . . . . 35.94 109.391 -173.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.19 118.39 53.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.435 -0.95 . . . . 34.76 108.435 -178.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.11 127.49 5.92 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.685 -0.769 . . . . 36.61 113.087 176.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 42' ' ' SER . . . . . . . . . . . . . 4.4 t -139.65 128.57 23.5 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.007 0.903 . . . . 37.27 111.386 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.08 42.54 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 123.694 0.798 . . . . 39.17 109.141 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 44' ' ' THR . . . . . . . . . . . . . 7.3 t -141.57 138.21 32.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 36.8 111.316 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.44 -61.07 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.644 -0.707 . . . . 37.39 110.889 175.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.53 126.5 35.04 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.618 -0.676 . . . . 37.06 111.463 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.01 8.05 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 115.623 1.009 . . . . 32.87 115.623 172.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.75 121.52 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 108.426 -0.953 . . . . 30.14 108.426 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -133.77 127.35 52.39 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 122.194 0.198 . . . . 28.72 110.728 -169.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.51 119.44 36.2 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 123.913 0.885 . . . . 30.14 109.822 171.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.14 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 119.115 2.406 . . . . 29.64 119.115 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 52' ' ' VAL . . . . . . . . . . . . . 54.8 t -138.55 124.81 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 118.076 0.938 . . . . 30.96 108.698 -171.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.72 129.15 43.82 Favored 'General case' 0 CA--C 1.518 -0.258 0 C-N-CA 122.23 0.212 . . . . 33.52 111.111 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.73 118.21 29.46 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.59 -1.263 . . . . 35.43 107.59 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.4 122.13 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 109.613 -0.514 . . . . 36.61 109.613 -173.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.88 132.6 38.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 111.729 0.27 . . . . 38.73 111.729 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.07 124.16 36.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.421 -0.585 . . . . 42.66 109.421 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.09 37.45 28.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.898 0.879 . . . . 42.43 113.018 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 59' ' ' THR . . . . . . . . . . . . . 53.1 m -111.82 152.25 28.11 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.47 1.108 . . . . 42.68 109.748 -172.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.15 -64.62 1.03 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 118.135 -1.426 . . . . 43.74 114.199 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.06 109.04 13.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.185 -0.947 . . . . 42.33 109.614 -177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.09 126.25 42.66 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.28 -0.637 . . . . 36.49 109.28 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.65 124.49 56.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 109.401 -0.592 . . . . 33.16 109.401 -173.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.25 118.14 34.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.109 -1.071 . . . . 30.88 108.109 163.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.65 122.93 26.79 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.756 -0.461 . . . . 28.22 109.756 -168.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 t -122.8 119.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.555 -0.905 . . . . 27.29 108.555 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 67' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' J' ' 201' ' ' HOH . . . -70.68 -37.52 67.31 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.4 -0.905 . . . . 26.78 114.128 -177.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.89 -135.93 7.47 Favored Glycine 0 N--CA 1.45 -0.428 0 O-C-N 121.898 -0.766 . . . . 27.35 114.745 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.56 162.14 13.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.736 0.768 . . . . 28.65 110.705 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 70' ' ' VAL . . . . . . . . . . . . . 50.9 t -116.51 114.09 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 106.376 -1.713 . . . . 29.1 106.376 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 71' ' ' VAL . . . . . . . . . . . . . 18.9 t -125.68 122.44 62.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.198 -1.038 . . . . 29.41 108.198 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.16 127.44 35.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.733 -0.212 . . . . 29.84 110.485 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.39 176.45 41.9 Favored Glycine 0 CA--C 1.5 -0.885 0 C-N-CA 119.076 -1.535 . . . . 30.33 110.971 165.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.08 124.26 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 106.236 -1.765 . . . . 32.13 106.236 159.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.48 81.33 0.18 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.256 -0.578 . . . . 33.05 111.823 -169.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.2 128.74 56.51 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.37 0.668 . . . . 31.72 111.024 176.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 77' ' ' VAL . . . . . . . . . . . . . 50.2 t -133.47 128.77 55.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 C-N-CA 122.833 0.453 . . . . 31.36 109.909 -176.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.44 130.13 48.74 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.287 -0.264 . . . . 31.08 110.287 172.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.32 132.35 37.56 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 122.282 0.233 . . . . 33.03 110.864 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.82 137.23 41.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 111.613 0.227 . . . . 33.64 111.613 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 81' ' ' THR . . . . . . . . . . . . . 98.4 m -129.51 128.96 43.9 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.549 0.739 . . . . 37.23 110.655 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.11 116.73 51.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.061 -0.718 . . . . 39.19 109.061 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.7 108.81 16.84 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 118.319 -0.848 . . . . 44.56 110.021 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.89 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 124.758 1.286 . . . . 43.14 113.221 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.91 152.06 29.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 117.54 0.67 . . . . 41.86 110.372 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.58 47.37 90.42 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 116.414 1.326 . . . . 39.23 116.414 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.96 143.95 26.51 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 117.51 0.655 . . . . 38.46 110.266 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.54 120.72 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.6 -0.889 . . . . 36.58 108.6 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.51 115.94 26.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.11 -1.07 . . . . 34.07 108.11 169.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.56 127.1 34.34 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.526 -0.176 . . . . 33.16 110.526 -174.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.55 127.43 42.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 30.92 109.756 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.94 130.5 33.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.133 0.271 . . . . 31.4 110.597 -175.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.13 -72.15 0.61 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.713 -1.232 . . . . 32.81 113.388 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 94' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -149.86 157.18 42.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 119.867 -0.733 . . . . 36.13 109.681 174.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.01 125.42 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.644 -0.873 . . . . 38.53 108.644 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.22 119.44 35.19 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.543 -0.91 . . . . 41.79 108.543 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.1 123.31 28.34 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.727 -0.471 . . . . 49.58 109.727 -174.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.526 0 CA-C-O 120.731 0.3 . . . . 56.02 110.795 170.994 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.701 0 N-CA-C 112.224 -0.351 . . . . 40.39 112.224 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.12 124.92 65.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 108.529 -0.915 . . . . 39.01 108.529 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.07 115.75 28.81 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.809 -1.182 . . . . 35.45 107.809 171.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.29 119.21 27.78 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.454 -0.572 . . . . 35.94 109.454 -173.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' VAL . . . . . . . . . . . . . 37.7 t -124.28 118.35 53.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.415 -0.957 . . . . 34.76 108.415 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.14 127.47 5.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.666 -0.778 . . . . 36.61 113.065 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.58 23.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.937 0.868 . . . . 37.27 111.404 -167.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.12 42.67 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.734 0.813 . . . . 39.17 109.102 172.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.57 138.2 32.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.453 . . . . 36.8 111.315 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.05 2.09 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.679 -0.691 . . . . 37.39 110.933 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.55 126.52 35.08 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.613 -0.679 . . . . 37.06 111.426 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.59 135.0 8.04 Favored Glycine 0 C--N 1.333 0.403 0 N-CA-C 115.714 1.045 . . . . 32.87 115.714 172.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.76 121.48 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.429 -0.952 . . . . 30.14 108.429 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.75 127.37 52.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 122.195 0.198 . . . . 28.72 110.702 -169.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.53 119.5 36.37 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.949 0.9 . . . . 30.14 109.84 171.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.17 -74.79 0.96 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 119.094 2.397 . . . . 29.64 119.094 -175.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -138.54 124.78 25.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 118.079 0.94 . . . . 30.96 108.745 -171.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.7 129.14 43.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 122.227 0.211 . . . . 33.52 111.078 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.74 118.22 29.5 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.603 -1.258 . . . . 35.43 107.603 176.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 93.0 t -129.45 122.1 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 109.573 -0.529 . . . . 36.61 109.573 -173.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.85 132.64 38.83 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 111.697 0.258 . . . . 38.73 111.697 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.14 124.19 36.29 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.38 -0.6 . . . . 42.66 109.38 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.06 37.43 28.66 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.912 0.885 . . . . 42.43 113.063 -178.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.82 152.27 28.1 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.472 1.109 . . . . 42.68 109.759 -172.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.16 -64.63 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 118.154 -1.418 . . . . 43.74 114.182 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.05 109.06 13.61 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.229 -0.92 . . . . 42.33 109.599 -177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.19 42.53 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.244 -0.65 . . . . 36.49 109.244 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.67 124.48 56.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.464 -0.569 . . . . 33.16 109.464 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.22 118.11 34.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.116 -1.068 . . . . 30.88 108.116 163.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.66 122.91 26.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.766 -0.457 . . . . 28.22 109.766 -168.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.77 119.61 58.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 108.588 -0.893 . . . . 27.29 108.588 -175.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' GLY . . . . . 0.447 ' O ' ' O ' ' D' ' 201' ' ' HOH . . . -70.78 -37.4 66.39 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.368 -0.92 . . . . 26.78 114.087 -177.841 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.91 -135.89 7.47 Favored Glycine 0 C--O 1.225 -0.442 0 O-C-N 121.958 -0.731 . . . . 27.35 114.726 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.59 162.08 13.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.684 0.742 . . . . 28.65 110.73 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' VAL . . . . . . . . . . . . . 51.3 t -116.41 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 106.415 -1.698 . . . . 29.1 106.415 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -125.69 122.43 62.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 108.189 -1.041 . . . . 29.41 108.189 -173.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.14 127.38 35.83 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.298 0.239 . . . . 29.84 110.528 -175.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.41 176.46 41.92 Favored Glycine 0 CA--C 1.499 -0.937 0 C-N-CA 119.134 -1.508 . . . . 30.33 111.008 165.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.01 124.2 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 106.252 -1.759 . . . . 32.13 106.252 159.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.58 81.2 0.19 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.185 -0.606 . . . . 33.05 111.827 -169.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.14 128.75 56.52 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.401 0.68 . . . . 31.72 111.045 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' VAL . . . . . . . . . . . . . 50.0 t -133.45 128.74 55.36 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 C-N-CA 122.925 0.49 . . . . 31.36 109.908 -176.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.49 130.19 48.76 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 110.237 -0.283 . . . . 31.08 110.237 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.37 132.37 37.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.726 -0.215 . . . . 33.03 110.839 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.8 137.2 41.35 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.678 0.251 . . . . 33.64 111.678 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 98.4 m -129.44 129.03 44.13 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.502 0.721 . . . . 37.23 110.68 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.17 116.74 51.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 108.989 -0.745 . . . . 39.19 108.989 176.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.72 108.83 16.87 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 118.276 -0.868 . . . . 44.56 110.03 -178.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.2 7.52 Favored Glycine 0 N--CA 1.447 -0.629 0 O-C-N 124.781 1.301 . . . . 43.14 113.247 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.01 152.03 29.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 117.583 0.691 . . . . 41.86 110.315 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.59 47.46 89.96 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 116.387 1.315 . . . . 39.23 116.387 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.06 143.94 26.5 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 117.503 0.652 . . . . 38.46 110.251 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.54 120.73 59.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.571 -0.9 . . . . 36.58 108.571 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.52 115.93 26.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.161 -1.052 . . . . 34.07 108.161 169.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.53 127.19 34.6 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 110.526 -0.175 . . . . 33.16 110.526 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.59 127.45 42.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.748 -0.464 . . . . 30.92 109.748 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.93 130.5 33.82 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 123.069 0.23 . . . . 31.4 110.631 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.19 -72.19 0.6 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.75 -1.214 . . . . 32.81 113.331 175.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' PHE . . . . . . . . . . . . . 23.0 p90 -149.85 157.16 42.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.822 -0.751 . . . . 36.13 109.694 174.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -125.98 125.39 67.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.3 -0.864 . . . . 38.53 108.68 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.17 119.4 35.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.572 -0.899 . . . . 41.79 108.572 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.08 123.27 28.29 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.795 -0.446 . . . . 49.58 109.795 -174.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.541 0 O-C-N 123.185 0.303 . . . . 56.02 110.835 170.998 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.72 0 N-CA-C 112.253 -0.339 . . . . 40.39 112.253 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.1 124.93 65.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.523 -0.917 . . . . 39.01 108.523 -177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.06 115.79 28.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.84 -1.17 . . . . 35.45 107.84 171.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.3 119.18 27.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.469 -0.567 . . . . 35.94 109.469 -173.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' VAL . . . . . . . . . . . . . 36.7 t -124.25 118.29 53.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.432 -0.951 . . . . 34.76 108.432 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.06 127.47 5.93 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.683 -0.77 . . . . 36.61 113.079 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.62 128.62 23.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.986 0.893 . . . . 37.27 111.423 -167.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.08 42.54 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.705 0.802 . . . . 39.17 109.103 172.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.54 138.17 32.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.979 0.418 . . . . 36.8 111.361 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' LYS . . . . . . . . . . . . . 24.8 tttt -76.42 -61.08 2.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 37.39 110.936 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.52 126.56 35.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.535 -0.728 . . . . 37.06 111.427 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.6 135.02 8.05 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 115.661 1.024 . . . . 32.87 115.661 172.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.81 121.48 63.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 108.404 -0.962 . . . . 30.14 108.404 177.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -133.7 127.41 52.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 C-N-CA 122.146 0.178 . . . . 28.72 110.678 -169.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -115.62 119.44 36.13 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.942 0.897 . . . . 30.14 109.825 171.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.15 -74.79 0.96 Allowed Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 119.121 2.408 . . . . 29.64 119.121 -175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.54 124.81 25.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 118.115 0.957 . . . . 30.96 108.727 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.75 129.16 43.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 122.21 0.204 . . . . 33.52 111.061 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 98.4 m -120.77 118.15 29.28 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.591 -1.262 . . . . 35.43 107.591 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.39 122.15 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.573 -0.529 . . . . 36.61 109.573 -173.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.59 38.82 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 111.715 0.265 . . . . 38.73 111.715 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.13 36.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.434 -0.58 . . . . 42.66 109.434 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.16 37.4 28.44 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.924 0.889 . . . . 42.43 113.013 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' THR . . . . . . . . . . . . . 53.1 m -111.82 152.26 28.1 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.479 1.112 . . . . 42.68 109.741 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.14 -64.64 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 118.107 -1.437 . . . . 43.74 114.164 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.09 109.0 13.5 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.184 -0.947 . . . . 42.33 109.637 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.07 126.14 42.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.282 -0.636 . . . . 36.49 109.282 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 124.48 57.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.428 -0.582 . . . . 33.16 109.428 -173.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.23 118.2 34.65 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.095 -1.076 . . . . 30.88 108.095 163.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.75 122.9 26.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.785 -0.45 . . . . 28.22 109.785 -168.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 26.6 t -122.76 119.6 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 108.598 -0.89 . . . . 27.29 108.598 -175.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' GLY . . . . . 0.431 ' O ' ' O ' ' H' ' 201' ' ' HOH . . . -70.76 -37.4 66.54 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.363 -0.923 . . . . 26.78 114.118 -177.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.95 -135.94 7.51 Favored Glycine 0 C--O 1.226 -0.385 0 O-C-N 121.917 -0.755 . . . . 27.35 114.685 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.55 162.08 13.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.682 0.741 . . . . 28.65 110.706 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.47 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 106.424 -1.695 . . . . 29.1 106.424 175.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -125.66 122.44 62.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.186 -1.042 . . . . 29.41 108.186 -173.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.14 127.43 35.94 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 122.273 0.229 . . . . 29.84 110.545 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.39 176.43 41.88 Favored Glycine 0 CA--C 1.5 -0.897 0 C-N-CA 119.108 -1.52 . . . . 30.33 110.979 165.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.03 124.27 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 106.237 -1.764 . . . . 32.13 106.237 159.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' THR . . . . . . . . . . . . . 24.1 m 60.51 81.28 0.19 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.248 -0.581 . . . . 33.05 111.823 -169.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.2 128.81 56.54 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 123.329 0.652 . . . . 31.72 111.054 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.49 128.77 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 C-N-CA 122.871 0.468 . . . . 31.36 109.889 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.5 130.15 48.68 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 110.276 -0.268 . . . . 31.08 110.276 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.32 132.35 37.57 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 123.058 0.223 . . . . 33.03 110.906 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.75 137.18 41.41 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 111.73 0.27 . . . . 33.64 111.73 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -129.52 128.96 43.88 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.566 0.746 . . . . 37.23 110.703 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.13 116.8 51.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.996 -0.742 . . . . 39.19 108.996 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.73 108.85 16.89 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 118.298 -0.858 . . . . 44.56 110.014 -178.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.84 154.15 7.5 Favored Glycine 0 N--CA 1.447 -0.625 0 O-C-N 124.702 1.251 . . . . 43.14 113.254 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.99 152.11 29.65 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 117.542 0.671 . . . . 41.86 110.339 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.54 47.44 89.97 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 116.437 1.335 . . . . 39.23 116.437 176.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.03 143.85 26.56 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 117.493 0.646 . . . . 38.46 110.273 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.47 120.74 59.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 108.618 -0.882 . . . . 36.58 108.618 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 116.0 26.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.102 -1.073 . . . . 34.07 108.102 169.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.63 127.16 34.33 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.464 -0.199 . . . . 33.16 110.464 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.58 127.46 42.34 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.74 -0.467 . . . . 30.92 109.74 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.95 130.54 33.86 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 123.144 0.278 . . . . 31.4 110.601 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.18 -72.17 0.6 Allowed Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 119.732 -1.223 . . . . 32.81 113.351 175.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.87 157.17 42.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.844 -0.742 . . . . 36.13 109.707 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.03 125.36 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.295 -0.866 . . . . 38.53 108.676 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.2 119.4 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.57 -0.9 . . . . 41.79 108.57 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.1 123.2 28.11 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.804 -0.443 . . . . 49.58 109.804 -174.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 116.571 -0.286 . . . . 56.02 110.825 171.016 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.69 0 N-CA-C 112.273 -0.331 . . . . 40.39 112.273 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.12 124.99 65.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 108.506 -0.924 . . . . 39.01 108.506 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 15.9 tp -113.08 115.78 28.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.776 -1.194 . . . . 35.45 107.776 171.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.32 119.22 27.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.414 -0.587 . . . . 35.94 109.414 -173.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.22 118.35 53.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.459 -0.941 . . . . 34.76 108.459 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.1 127.5 5.93 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.729 -0.748 . . . . 36.61 113.089 176.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.66 128.59 23.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 117.974 0.887 . . . . 37.27 111.363 -167.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.79 122.11 42.55 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.699 0.8 . . . . 39.17 109.106 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 7.2 t -141.55 138.2 32.52 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.994 0.425 . . . . 36.8 111.374 178.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.12 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.708 -0.678 . . . . 37.39 110.866 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.47 126.58 35.37 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.608 -0.683 . . . . 37.06 111.438 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.69 135.01 8.04 Favored Glycine 0 C--N 1.333 0.384 0 N-CA-C 115.645 1.018 . . . . 32.87 115.645 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.77 121.52 63.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.42 -0.955 . . . . 30.14 108.42 177.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 58.5 t -133.76 127.36 52.44 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 C-N-CA 122.169 0.188 . . . . 28.72 110.689 -169.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -115.51 119.54 36.52 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.887 0.875 . . . . 30.14 109.825 171.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.2 -74.83 0.96 Allowed Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 119.101 2.4 . . . . 29.64 119.101 -175.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.5 124.79 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 118.052 0.926 . . . . 30.96 108.78 -171.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.71 129.15 43.84 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.253 0.221 . . . . 33.52 111.079 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.77 118.26 29.58 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.587 -1.264 . . . . 35.43 107.587 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 93.0 t -129.44 122.1 54.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.633 -0.506 . . . . 36.61 109.633 -173.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.83 132.6 38.82 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 111.717 0.266 . . . . 38.73 111.717 -177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.12 124.19 36.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.412 -0.588 . . . . 42.66 109.412 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.07 37.42 28.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.881 0.872 . . . . 42.43 113.051 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 52.8 m -111.76 152.26 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.509 1.123 . . . . 42.68 109.786 -172.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.14 -64.69 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 118.149 -1.42 . . . . 43.74 114.189 -177.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.03 109.11 13.68 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 121.185 -0.947 . . . . 42.33 109.63 -177.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.14 126.15 42.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.275 -0.639 . . . . 36.49 109.275 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.6 124.53 57.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 109.404 -0.591 . . . . 33.16 109.404 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.25 118.2 34.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.093 -1.077 . . . . 30.88 108.093 163.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.68 122.92 26.74 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.754 -0.461 . . . . 28.22 109.754 -168.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.77 119.68 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.327 0 N-CA-C 108.58 -0.896 . . . . 27.29 108.58 -175.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . 0.437 ' O ' ' O ' ' B' ' 201' ' ' HOH . . . -70.82 -37.36 66.02 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.334 -0.936 . . . . 26.78 114.112 -177.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.9 -135.94 7.49 Favored Glycine 0 C--O 1.225 -0.444 0 O-C-N 121.9 -0.765 . . . . 27.35 114.727 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.63 162.08 13.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 117.683 0.742 . . . . 28.65 110.71 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 50.9 t -116.48 114.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.37 -1.715 . . . . 29.1 106.37 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 19.1 t -125.73 122.41 62.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.17 -1.048 . . . . 29.41 108.17 -173.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.13 127.46 36.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.712 -0.222 . . . . 29.84 110.505 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . 173.38 176.42 41.87 Favored Glycine 0 CA--C 1.499 -0.91 0 C-N-CA 119.142 -1.504 . . . . 30.33 110.975 165.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 t -68.05 124.24 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.25 -1.759 . . . . 32.13 106.25 159.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.47 81.29 0.19 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.249 -0.58 . . . . 33.05 111.832 -169.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.14 128.73 56.51 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.41 0.684 . . . . 31.72 111.045 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 49.8 t -133.45 128.74 55.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 122.88 0.472 . . . . 31.36 109.926 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -127.49 130.11 48.62 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 110.266 -0.272 . . . . 31.08 110.266 172.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.27 132.34 37.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 122.296 0.238 . . . . 33.03 110.919 -179.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.77 137.2 41.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.704 0.261 . . . . 33.64 111.704 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.52 128.92 43.8 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.535 0.734 . . . . 37.23 110.686 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.13 116.72 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.05 -0.722 . . . . 39.19 109.05 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.66 108.79 16.84 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 118.273 -0.87 . . . . 44.56 110.074 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.92 154.19 7.53 Favored Glycine 0 N--CA 1.447 -0.632 0 O-C-N 124.758 1.287 . . . . 43.14 113.252 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.02 152.07 29.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 117.557 0.678 . . . . 41.86 110.301 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.57 47.42 90.11 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 116.41 1.324 . . . . 39.23 116.41 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.99 143.89 26.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.53 0.665 . . . . 38.46 110.289 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.52 120.79 59.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.59 -0.892 . . . . 36.58 108.59 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.58 115.98 26.74 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.125 -1.065 . . . . 34.07 108.125 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.62 127.17 34.38 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.453 -0.203 . . . . 33.16 110.453 -174.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.57 127.42 42.28 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 122.817 0.447 . . . . 30.92 109.796 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.92 130.52 33.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.094 0.247 . . . . 31.4 110.634 -175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.12 -72.15 0.6 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.719 -1.229 . . . . 32.81 113.405 175.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -149.89 157.18 42.92 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.85 -0.74 . . . . 36.13 109.681 174.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.04 125.39 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.25 -0.886 . . . . 38.53 108.635 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.18 119.39 35.06 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.572 -0.899 . . . . 41.79 108.572 174.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.1 123.28 28.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.798 -0.445 . . . . 49.58 109.798 -174.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.554 -0.293 . . . . 56.02 110.794 171.055 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.429 ' O ' ' O ' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . 0.436 ' O ' ' O ' ' C' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' HOH . . . . . 0.446 ' O ' ' O ' ' E' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 201' ' ' HOH . . . . . 0.448 ' O ' ' O ' ' G' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 201' ' ' HOH . . . . . 0.454 ' O ' ' O ' ' I' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 201' ' ' HOH . . . . . 0.434 ' O ' ' O ' ' F' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 201' ' ' HOH . . . . . 0.455 ' O ' ' O ' ' J' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . 0.447 ' O ' ' O ' ' D' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' HOH . . . . . 0.431 ' O ' ' O ' ' H' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . 0.437 ' O ' ' O ' ' B' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.711 0 N-CA-C 112.291 -0.324 . . . . 40.39 112.291 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.17 124.98 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.528 -0.916 . . . . 39.01 108.528 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 15.9 tp -113.09 115.83 28.93 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.739 -1.208 . . . . 35.45 107.739 171.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.31 119.2 27.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.472 -0.566 . . . . 35.94 109.472 -173.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 37.3 t -124.2 118.35 53.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 108.425 -0.954 . . . . 34.76 108.425 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.14 127.45 5.9 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.684 -0.77 . . . . 36.61 113.13 176.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.59 128.57 23.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 117.995 0.898 . . . . 37.27 111.43 -167.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.72 122.08 42.56 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.745 0.818 . . . . 39.17 109.1 172.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . 0.524 ' O ' ' HA ' ' H' ' 44' ' ' THR . 7.2 t -141.57 138.22 32.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 36.8 111.355 178.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.45 -61.09 2.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.671 -0.695 . . . . 37.39 110.872 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.49 126.59 35.36 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.636 -0.665 . . . . 37.06 111.416 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.63 135.0 8.04 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 115.645 1.018 . . . . 32.87 115.645 172.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.78 121.52 63.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.423 -0.954 . . . . 30.14 108.423 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -133.73 127.35 52.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 C-N-CA 122.189 0.195 . . . . 28.72 110.707 -169.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.49 119.48 36.33 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.921 0.889 . . . . 30.14 109.831 171.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.17 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.287 0 N-CA-C 119.125 2.41 . . . . 29.64 119.125 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.52 124.79 25.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 118.096 0.948 . . . . 30.96 108.774 -171.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.71 129.13 43.8 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 122.218 0.207 . . . . 33.52 111.041 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 98.5 m -120.76 118.24 29.54 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.564 -1.273 . . . . 35.43 107.564 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 93.2 t -129.41 122.11 54.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 N-CA-C 109.657 -0.497 . . . . 36.61 109.657 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.84 132.54 38.73 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 111.729 0.27 . . . . 38.73 111.729 -177.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.09 124.23 36.49 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.383 -0.599 . . . . 42.66 109.383 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.07 37.41 28.62 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.887 0.875 . . . . 42.43 113.079 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -111.74 152.26 28.0 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 124.472 1.109 . . . . 42.68 109.751 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.11 -64.71 1.03 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 118.167 -1.413 . . . . 43.74 114.164 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.06 109.04 13.57 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.196 -0.94 . . . . 42.33 109.605 -177.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.1 126.22 42.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.286 -0.635 . . . . 36.49 109.286 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.52 57.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.449 -0.574 . . . . 33.16 109.449 -173.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.27 118.16 34.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.123 -1.066 . . . . 30.88 108.123 163.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.69 122.9 26.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.76 -0.459 . . . . 28.22 109.76 -168.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.73 119.62 58.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 108.594 -0.891 . . . . 27.29 108.594 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.429 ' O ' ' O ' ' A' ' 201' ' ' HOH . . . -70.73 -37.4 66.84 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.317 -0.944 . . . . 26.78 114.196 -177.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.9 -135.92 7.48 Favored Glycine 0 N--CA 1.45 -0.42 0 O-C-N 121.895 -0.768 . . . . 27.35 114.701 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.64 162.09 13.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.708 0.754 . . . . 28.65 110.711 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.42 114.05 44.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.484 -1.673 . . . . 29.1 106.484 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . 0.476 HG21 ' HB2' ' A' ' 78' ' ' ALA . 19.0 t -125.68 122.42 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 108.187 -1.042 . . . . 29.41 108.187 -173.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.12 127.37 35.85 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 122.307 0.243 . . . . 29.84 110.544 -175.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . 0.596 ' HA3' ' O ' ' H' ' 73' ' ' GLY . . . 173.44 176.45 41.95 Favored Glycine 0 CA--C 1.499 -0.949 0 C-N-CA 119.124 -1.512 . . . . 30.33 110.991 165.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . 0.453 HG11 HG21 ' A' ' 44' ' ' THR . 2.8 t -68.0 124.26 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.244 -1.762 . . . . 32.13 106.244 159.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.8 m 60.42 81.33 0.18 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.237 -0.585 . . . . 33.05 111.862 -169.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.74 56.51 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.368 0.667 . . . . 31.72 111.009 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -133.48 128.73 55.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 122.867 0.467 . . . . 31.36 109.895 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . 0.476 ' HB2' HG21 ' A' ' 71' ' ' VAL . . . -127.45 130.18 48.81 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 122.354 0.262 . . . . 31.08 110.298 172.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.36 132.35 37.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 122.267 0.227 . . . . 33.03 110.891 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.84 137.22 41.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 111.662 0.245 . . . . 33.64 111.662 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.48 128.99 44.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 123.542 0.737 . . . . 37.23 110.657 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.16 116.75 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.056 -0.72 . . . . 39.19 109.056 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.68 108.84 16.9 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 118.29 -0.862 . . . . 44.56 110.016 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.16 7.51 Favored Glycine 0 CA--C 1.504 -0.596 0 O-C-N 124.796 1.31 . . . . 43.14 113.261 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.01 152.1 29.63 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.625 0.712 . . . . 41.86 110.307 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.52 47.45 89.88 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 116.403 1.321 . . . . 39.23 116.403 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.97 143.92 26.52 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 117.501 0.651 . . . . 38.46 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 63.2 mt -124.53 120.79 59.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.618 -0.882 . . . . 36.58 108.618 -176.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.59 115.92 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.135 -1.061 . . . . 34.07 108.135 169.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.18 34.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.454 -0.202 . . . . 33.16 110.454 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.63 127.4 42.16 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.768 -0.456 . . . . 30.92 109.768 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.86 130.5 33.97 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 123.083 0.239 . . . . 31.4 110.598 -175.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.14 -72.21 0.59 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.776 -1.202 . . . . 32.81 113.35 175.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 23.0 p90 -149.87 157.19 42.94 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.8 -0.76 . . . . 36.13 109.657 174.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.0 125.35 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 115.281 -0.872 . . . . 38.53 108.684 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.15 119.4 35.12 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.605 -0.887 . . . . 41.79 108.605 174.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.12 123.26 28.21 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.754 -0.462 . . . . 49.58 109.754 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.534 0 O-C-N 123.217 0.323 . . . . 56.02 110.785 171.043 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.732 0 N-CA-C 112.257 -0.337 . . . . 40.39 112.257 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.14 124.97 65.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.52 -0.919 . . . . 39.01 108.52 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 15.8 tp -113.1 115.8 28.88 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.769 -1.197 . . . . 35.45 107.769 171.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -125.29 119.15 27.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.401 -0.592 . . . . 35.94 109.401 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 37.4 t -124.23 118.37 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 108.424 -0.954 . . . . 34.76 108.424 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.06 127.43 5.91 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.756 -0.735 . . . . 36.61 113.162 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.59 23.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 117.993 0.896 . . . . 37.27 111.366 -167.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.14 42.7 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.695 0.798 . . . . 39.17 109.111 172.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' THR . . . . . 0.537 ' O ' ' HA ' ' B' ' 44' ' ' THR . 7.2 t -141.66 138.2 32.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.11 0.481 . . . . 36.8 111.334 178.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.42 -61.1 2.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.639 -0.71 . . . . 37.39 110.874 175.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.54 126.56 35.19 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.558 -0.714 . . . . 37.06 111.409 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.59 135.0 8.04 Favored Glycine 0 C--N 1.333 0.394 0 N-CA-C 115.682 1.033 . . . . 32.87 115.682 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.83 121.46 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.4 -0.963 . . . . 30.14 108.4 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -133.7 127.42 52.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 C-N-CA 122.176 0.191 . . . . 28.72 110.713 -169.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -115.56 119.52 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.927 0.891 . . . . 30.14 109.809 171.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.82 0.96 Allowed Glycine 0 C--N 1.331 0.288 0 N-CA-C 119.109 2.404 . . . . 29.64 119.109 -175.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.48 124.88 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 118.067 0.934 . . . . 30.96 108.722 -171.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.79 129.15 43.71 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 122.218 0.207 . . . . 33.52 111.081 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 98.4 m -120.77 118.18 29.37 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.595 -1.261 . . . . 35.43 107.595 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.42 122.11 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 109.629 -0.508 . . . . 36.61 109.629 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.83 132.62 38.84 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 111.679 0.251 . . . . 38.73 111.679 -177.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.15 36.26 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.458 -0.571 . . . . 42.66 109.458 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.1 37.42 28.57 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.878 0.871 . . . . 42.43 113.058 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.83 152.27 28.09 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.478 1.111 . . . . 42.68 109.736 -172.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.15 -64.66 1.03 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 118.162 -1.415 . . . . 43.74 114.177 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.04 109.01 13.55 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.184 -0.947 . . . . 42.33 109.697 -177.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.23 42.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.236 -0.653 . . . . 36.49 109.236 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 17.4 t -130.65 124.44 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 109.439 -0.578 . . . . 33.16 109.439 -173.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.19 118.24 34.79 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.097 -1.075 . . . . 30.88 108.097 163.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.74 122.89 26.61 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.735 -0.468 . . . . 28.22 109.735 -168.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 t -122.7 119.59 58.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 108.6 -0.889 . . . . 27.29 108.6 -175.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' C' ' 201' ' ' HOH . . . -70.73 -37.43 66.88 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.374 -0.917 . . . . 26.78 114.144 -177.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.96 -135.9 7.49 Favored Glycine 0 C--O 1.225 -0.411 0 O-C-N 121.932 -0.746 . . . . 27.35 114.688 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.62 162.09 13.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 117.69 0.745 . . . . 28.65 110.66 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.44 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 106.434 -1.691 . . . . 29.1 106.434 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' C' ' 78' ' ' ALA . 19.1 t -125.68 122.44 62.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.17 -1.048 . . . . 29.41 108.17 -173.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.17 127.38 35.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.249 0.22 . . . . 29.84 110.474 -175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' GLY . . . . . 0.584 ' HA3' ' O ' ' B' ' 73' ' ' GLY . . . 173.45 176.44 41.94 Favored Glycine 0 CA--C 1.499 -0.956 0 C-N-CA 119.129 -1.51 . . . . 30.33 111.027 165.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 74' ' ' VAL . . . . . 0.447 HG11 HG21 ' C' ' 44' ' ' THR . 2.8 t -67.98 124.24 23.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.253 -1.758 . . . . 32.13 106.253 159.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.2 -0.6 . . . . 33.05 111.839 -169.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.17 128.76 56.52 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 123.36 0.664 . . . . 31.72 111.053 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.48 128.75 55.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 C-N-CA 122.894 0.478 . . . . 31.36 109.877 -176.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' ALA . . . . . 0.49 ' HB2' HG21 ' C' ' 71' ' ' VAL . . . -127.44 130.1 48.69 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 122.359 0.264 . . . . 31.08 110.314 172.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.29 132.37 37.66 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 122.257 0.223 . . . . 33.03 110.899 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.82 137.21 41.31 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 111.686 0.254 . . . . 33.64 111.686 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.44 128.95 43.99 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 123.556 0.742 . . . . 37.23 110.735 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.16 116.82 51.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.988 -0.745 . . . . 39.19 108.988 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.77 108.79 16.79 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 118.305 -0.855 . . . . 44.56 110.0 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.59 0 O-C-N 124.786 1.304 . . . . 43.14 113.234 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.91 152.01 29.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 117.584 0.692 . . . . 41.86 110.387 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.63 47.4 90.35 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 116.402 1.321 . . . . 39.23 116.402 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.02 143.97 26.48 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 117.512 0.656 . . . . 38.46 110.265 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' ILE . . . . . . . . . . . . . 63.4 mt -124.53 120.73 59.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.605 -0.887 . . . . 36.58 108.605 -176.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 115.94 26.71 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.149 -1.056 . . . . 34.07 108.149 169.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.59 127.16 34.42 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.47 -0.196 . . . . 33.16 110.47 -174.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.57 127.4 42.24 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 122.845 0.458 . . . . 30.92 109.784 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.53 33.91 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 123.059 0.224 . . . . 31.4 110.603 -175.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.12 -72.18 0.6 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 119.745 -1.217 . . . . 32.81 113.357 175.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -149.87 157.22 42.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.808 -0.757 . . . . 36.13 109.675 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 14.9 t -126.07 125.37 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 CA-C-N 115.275 -0.875 . . . . 38.53 108.65 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.17 119.41 35.12 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.592 -0.892 . . . . 41.79 108.592 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.14 123.27 28.19 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.735 -0.469 . . . . 49.58 109.735 -174.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.502 -0.317 . . . . 56.02 110.822 171.0 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.719 0 N-CA-C 112.276 -0.329 . . . . 40.39 112.276 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.13 124.96 65.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 108.534 -0.913 . . . . 39.01 108.534 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' LEU . . . . . 0.428 HD23 HD13 ' D' ' 38' ' ' LEU . 15.8 tp -113.09 115.85 28.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.791 -1.189 . . . . 35.45 107.791 171.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.29 119.2 27.76 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.414 -0.588 . . . . 35.94 109.414 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 40' ' ' VAL . . . . . . . . . . . . . 36.5 t -124.21 118.31 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 108.476 -0.935 . . . . 34.76 108.476 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.05 127.5 5.93 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.723 -0.751 . . . . 36.61 113.118 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.56 23.48 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.982 0.891 . . . . 37.27 111.345 -167.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.67 122.1 42.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 123.739 0.816 . . . . 39.17 109.135 172.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 44' ' ' THR . . . . . 0.579 ' O ' ' HA ' ' D' ' 44' ' ' THR . 7.2 t -141.56 138.2 32.5 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.024 0.44 . . . . 36.8 111.353 178.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.46 -61.04 2.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.694 -0.684 . . . . 37.39 110.891 175.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.55 126.59 35.26 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.617 -0.677 . . . . 37.06 111.41 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.63 135.01 8.04 Favored Glycine 0 C--N 1.333 0.391 0 N-CA-C 115.665 1.026 . . . . 32.87 115.665 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.77 121.53 63.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 108.406 -0.961 . . . . 30.14 108.406 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.76 127.37 52.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 122.153 0.181 . . . . 28.72 110.652 -169.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 50' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -115.53 119.48 36.3 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.948 0.899 . . . . 30.14 109.825 171.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.18 -74.77 0.96 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 119.123 2.409 . . . . 29.64 119.123 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.56 124.88 25.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.184 0 CA-C-N 118.082 0.941 . . . . 30.96 108.724 -171.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.79 129.18 43.74 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.177 0.191 . . . . 33.52 111.048 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.77 118.19 29.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.614 -1.254 . . . . 35.43 107.614 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.42 122.08 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.635 -0.506 . . . . 36.61 109.635 -173.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.78 132.57 38.89 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.723 0.268 . . . . 38.73 111.723 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.16 36.29 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.454 -0.572 . . . . 42.66 109.454 175.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.15 37.39 28.44 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.895 0.878 . . . . 42.43 113.032 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 59' ' ' THR . . . . . . . . . . . . . 53.0 m -111.79 152.27 28.04 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.504 1.121 . . . . 42.68 109.772 -172.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.13 -64.71 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 118.14 -1.424 . . . . 43.74 114.154 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.0 109.06 13.63 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.21 -0.931 . . . . 42.33 109.665 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.15 126.17 42.41 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.275 -0.639 . . . . 36.49 109.275 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.5 57.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 109.453 -0.573 . . . . 33.16 109.453 -173.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.23 118.2 34.64 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.09 -1.078 . . . . 30.88 108.09 163.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.68 122.87 26.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.828 -0.434 . . . . 28.22 109.828 -168.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -122.72 119.62 58.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 108.556 -0.905 . . . . 27.29 108.556 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 67' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' E' ' 201' ' ' HOH . . . -70.8 -37.35 66.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.337 -0.935 . . . . 26.78 114.139 -177.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.93 -135.94 7.5 Favored Glycine 0 N--CA 1.45 -0.431 0 O-C-N 121.879 -0.777 . . . . 27.35 114.712 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.65 162.1 13.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.719 0.76 . . . . 28.65 110.662 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 70' ' ' VAL . . . . . . . . . . . . . 50.8 t -116.46 114.09 44.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 106.39 -1.707 . . . . 29.1 106.39 175.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 71' ' ' VAL . . . . . 0.477 HG21 ' HB2' ' E' ' 78' ' ' ALA . 19.1 t -125.68 122.42 62.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 108.187 -1.042 . . . . 29.41 108.187 -173.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -132.14 127.41 35.89 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.292 0.237 . . . . 29.84 110.517 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 73' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' D' ' 73' ' ' GLY . . . 173.42 176.44 41.91 Favored Glycine 0 CA--C 1.499 -0.928 0 C-N-CA 119.145 -1.502 . . . . 30.33 111.05 165.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 74' ' ' VAL . . . . . 0.45 HG11 HG21 ' E' ' 44' ' ' THR . 2.8 t -67.99 124.28 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 106.257 -1.757 . . . . 32.13 106.257 159.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 75' ' ' THR . . . . . . . . . . . . . 23.7 m 60.46 81.26 0.19 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.198 -0.601 . . . . 33.05 111.861 -169.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.76 56.52 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.32 0.648 . . . . 31.72 111.071 176.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 77' ' ' VAL . . . . . . . . . . . . . 50.7 t -133.46 128.74 55.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 122.832 0.453 . . . . 31.36 109.858 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 78' ' ' ALA . . . . . 0.477 ' HB2' HG21 ' E' ' 71' ' ' VAL . . . -127.47 130.11 48.64 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 110.278 -0.268 . . . . 31.08 110.278 172.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.29 132.39 37.68 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 123.12 0.263 . . . . 33.03 110.871 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.8 137.17 41.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 111.698 0.258 . . . . 33.64 111.698 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.47 128.99 44.03 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 123.603 0.761 . . . . 37.23 110.674 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.09 116.72 51.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.043 -0.725 . . . . 39.19 109.043 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.68 108.78 16.82 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 118.246 -0.883 . . . . 44.56 110.08 -178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.91 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 124.82 1.325 . . . . 43.14 113.217 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.1 29.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 117.564 0.682 . . . . 41.86 110.297 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.58 47.41 90.17 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 116.395 1.318 . . . . 39.23 116.395 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.05 143.95 26.49 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 117.537 0.668 . . . . 38.46 110.278 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.54 120.72 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.636 -0.876 . . . . 36.58 108.636 -176.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.51 115.92 26.67 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.127 -1.064 . . . . 34.07 108.127 169.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.57 127.17 34.48 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.479 -0.193 . . . . 33.16 110.479 -174.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.54 127.44 42.37 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.752 -0.462 . . . . 30.92 109.752 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.92 130.53 33.9 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.114 0.259 . . . . 31.4 110.621 -175.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.16 -72.19 0.6 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.729 -1.224 . . . . 32.81 113.346 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.84 157.19 42.95 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.802 -0.759 . . . . 36.13 109.677 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.05 125.38 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 108.663 -0.865 . . . . 38.53 108.663 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.25 119.42 35.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.584 -0.895 . . . . 41.79 108.584 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.07 123.29 28.33 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.751 -0.462 . . . . 49.58 109.751 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 120.761 0.315 . . . . 56.02 110.827 171.019 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.702 0 N-CA-C 112.218 -0.353 . . . . 40.39 112.218 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.14 124.98 65.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.547 -0.908 . . . . 39.01 108.547 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.06 115.76 28.85 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.769 -1.197 . . . . 35.45 107.769 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.3 119.21 27.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.409 -0.589 . . . . 35.94 109.409 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.22 118.37 53.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 108.438 -0.949 . . . . 34.76 108.438 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.11 127.49 5.92 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.747 -0.74 . . . . 36.61 113.094 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.61 23.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.926 0.863 . . . . 37.27 111.384 -167.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 43' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -117.77 122.09 42.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 123.678 0.791 . . . . 39.17 109.142 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 44' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' B' ' 44' ' ' THR . 7.2 t -141.59 138.13 32.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 36.8 111.401 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.37 -61.13 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.661 -0.7 . . . . 37.39 110.861 175.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.51 126.55 35.21 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.597 -0.689 . . . . 37.06 111.434 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.61 135.02 8.05 Favored Glycine 0 C--N 1.333 0.399 0 N-CA-C 115.646 1.018 . . . . 32.87 115.646 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.83 121.47 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 108.409 -0.96 . . . . 30.14 108.409 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 49' ' ' VAL . . . . . . . . . . . . . 58.3 t -133.72 127.39 52.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.118 0 C-N-CA 122.196 0.198 . . . . 28.72 110.731 -169.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.51 119.44 36.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.925 0.89 . . . . 30.14 109.853 171.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.73 0.96 Allowed Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 119.139 2.416 . . . . 29.64 119.139 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.52 124.84 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 118.096 0.948 . . . . 30.96 108.771 -171.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.76 129.08 43.67 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.243 0.217 . . . . 33.52 111.088 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 54' ' ' THR . . . . . . . . . . . . . 98.2 m -120.69 118.2 29.47 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 107.607 -1.257 . . . . 35.43 107.607 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 55' ' ' VAL . . . . . . . . . . . . . 92.8 t -129.48 122.13 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.583 -0.525 . . . . 36.61 109.583 -173.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.59 38.83 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 111.716 0.265 . . . . 38.73 111.716 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.11 124.21 36.4 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.394 -0.595 . . . . 42.66 109.394 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.04 37.44 28.71 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 123.88 0.872 . . . . 42.43 113.05 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -111.79 152.23 28.1 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 124.538 1.135 . . . . 42.68 109.768 -172.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.12 -64.65 1.03 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 118.156 -1.418 . . . . 43.74 114.209 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.04 109.05 13.6 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.235 -0.916 . . . . 42.33 109.682 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.1 126.15 42.49 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.285 -0.635 . . . . 36.49 109.285 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.6 124.52 57.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.409 -0.589 . . . . 33.16 109.409 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 64' ' ' THR . . . . . . . . . . . . . 3.6 m -112.24 118.1 34.37 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.121 -1.066 . . . . 30.88 108.121 163.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.66 122.89 26.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.78 -0.452 . . . . 28.22 109.78 -168.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 t -122.74 119.62 58.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.549 -0.908 . . . . 27.29 108.549 -175.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 67' ' ' GLY . . . . . 0.448 ' O ' ' O ' ' G' ' 201' ' ' HOH . . . -70.82 -37.39 66.06 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.342 -0.932 . . . . 26.78 114.092 -177.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.89 -135.93 7.47 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 117.709 0.754 . . . . 27.35 114.727 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.6 162.11 13.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 117.718 0.759 . . . . 28.65 110.691 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.5 114.05 44.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.42 -1.696 . . . . 29.1 106.42 175.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 71' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' G' ' 78' ' ' ALA . 19.0 t -125.68 122.44 62.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.181 -1.044 . . . . 29.41 108.181 -173.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -132.11 127.4 35.95 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.288 0.235 . . . . 29.84 110.535 -175.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 73' ' ' GLY . . . . . 0.596 ' O ' ' HA3' ' B' ' 73' ' ' GLY . . . 173.42 176.47 41.94 Favored Glycine 0 CA--C 1.5 -0.868 0 C-N-CA 119.062 -1.542 . . . . 30.33 110.954 165.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' G' ' 44' ' ' THR . 2.8 t -68.05 124.28 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.232 -1.766 . . . . 32.13 106.232 159.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 75' ' ' THR . . . . . . . . . . . . . 23.8 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.196 -0.602 . . . . 33.05 111.859 -169.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.18 128.75 56.52 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.364 0.666 . . . . 31.72 111.022 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 77' ' ' VAL . . . . . . . . . . . . . 50.6 t -133.48 128.79 55.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 C-N-CA 122.855 0.462 . . . . 31.36 109.852 -176.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 78' ' ' ALA . . . . . 0.489 ' HB2' HG21 ' G' ' 71' ' ' VAL . . . -127.48 130.11 48.64 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 122.377 0.271 . . . . 31.08 110.279 172.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.34 132.42 37.6 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.026 0.204 . . . . 33.03 110.864 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.81 137.16 41.29 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 111.702 0.26 . . . . 33.64 111.702 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -129.46 128.96 43.97 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.582 0.753 . . . . 37.23 110.685 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.13 116.79 51.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 108.991 -0.744 . . . . 39.19 108.991 176.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.75 108.84 16.85 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 118.309 -0.853 . . . . 44.56 110.024 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.86 154.15 7.5 Favored Glycine 0 N--CA 1.447 -0.603 0 O-C-N 124.764 1.29 . . . . 43.14 113.203 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.1 29.7 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 117.543 0.672 . . . . 41.86 110.357 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.54 47.49 89.7 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 116.408 1.323 . . . . 39.23 116.408 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.04 143.9 26.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.544 0.672 . . . . 38.46 110.253 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.51 120.7 59.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 108.633 -0.877 . . . . 36.58 108.633 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 115.94 26.7 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.099 -1.074 . . . . 34.07 108.099 169.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.19 34.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.461 -0.2 . . . . 33.16 110.461 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.6 127.46 42.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.711 -0.478 . . . . 30.92 109.711 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.51 33.87 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.065 0.228 . . . . 31.4 110.606 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.17 -72.2 0.6 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.737 -1.22 . . . . 32.81 113.346 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 94' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.84 157.22 42.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.849 -0.741 . . . . 36.13 109.689 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.04 125.36 67.85 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.266 -0.879 . . . . 38.53 108.685 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.16 119.45 35.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.569 -0.9 . . . . 41.79 108.569 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.16 123.23 28.09 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.775 -0.454 . . . . 49.58 109.775 -174.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 56.02 110.828 171.031 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.727 0 N-CA-C 112.205 -0.358 . . . . 40.39 112.205 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 37' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.18 125.0 65.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.523 -0.917 . . . . 39.01 108.523 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 38' ' ' LEU . . . . . . . . . . . . . 16.1 tp -113.08 115.83 28.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.77 -1.196 . . . . 35.45 107.77 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.34 119.21 27.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.421 -0.585 . . . . 35.94 109.421 -173.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 40' ' ' VAL . . . . . . . . . . . . . 36.7 t -124.2 118.32 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.457 -0.942 . . . . 34.76 108.457 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.1 127.44 5.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.715 -0.755 . . . . 36.61 113.072 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.58 23.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.981 0.89 . . . . 37.27 111.38 -167.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.12 42.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.684 0.794 . . . . 39.17 109.126 172.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 44' ' ' THR . . . . . 0.451 HG21 HG11 ' I' ' 74' ' ' VAL . 7.2 t -141.59 138.21 32.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.042 0.449 . . . . 36.8 111.358 178.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.43 -61.07 2.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 37.39 110.925 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.56 126.59 35.22 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.595 -0.691 . . . . 37.06 111.399 -179.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.61 134.98 8.03 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 115.671 1.029 . . . . 32.87 115.671 172.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.84 121.49 63.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 108.406 -0.961 . . . . 30.14 108.406 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.75 127.39 52.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 C-N-CA 122.162 0.185 . . . . 28.72 110.676 -169.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 50' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -115.51 119.45 36.23 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.962 0.905 . . . . 30.14 109.881 171.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.12 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 119.1 2.4 . . . . 29.64 119.1 -175.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -138.53 124.8 25.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 118.087 0.943 . . . . 30.96 108.765 -171.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.72 129.17 43.85 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 122.225 0.21 . . . . 33.52 111.083 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.75 118.14 29.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.63 -1.248 . . . . 35.43 107.63 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.41 122.11 54.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 109.614 -0.513 . . . . 36.61 109.614 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.63 38.88 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 111.717 0.266 . . . . 38.73 111.717 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.09 124.14 36.27 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.445 -0.576 . . . . 42.66 109.445 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.11 37.45 28.55 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.888 0.875 . . . . 42.43 113.04 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 59' ' ' THR . . . . . 0.431 HG23 ' O ' ' H' ' 59' ' ' THR . 52.6 m -111.8 152.21 28.13 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 124.534 1.134 . . . . 42.68 109.76 -172.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.11 -64.67 1.03 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 118.18 -1.408 . . . . 43.74 114.187 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.08 109.09 13.63 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 121.185 -0.947 . . . . 42.33 109.614 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.16 42.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.287 -0.634 . . . . 36.49 109.287 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.53 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.439 -0.578 . . . . 33.16 109.439 -173.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.29 118.21 34.63 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.093 -1.076 . . . . 30.88 108.093 163.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.69 122.9 26.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.723 -0.473 . . . . 28.22 109.723 -168.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 t -122.75 119.63 58.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 N-CA-C 108.568 -0.901 . . . . 27.29 108.568 -175.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 67' ' ' GLY . . . . . 0.454 ' O ' ' O ' ' I' ' 201' ' ' HOH . . . -70.74 -37.35 66.76 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.359 -0.924 . . . . 26.78 114.195 -177.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.96 -135.92 7.5 Favored Glycine 0 C--O 1.225 -0.446 0 O-C-N 121.936 -0.744 . . . . 27.35 114.689 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.6 162.14 13.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.663 0.732 . . . . 28.65 110.646 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 70' ' ' VAL . . . . . . . . . . . . . 51.3 t -116.46 114.03 44.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 106.43 -1.692 . . . . 29.1 106.43 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 71' ' ' VAL . . . . . 0.474 HG21 ' HB2' ' I' ' 78' ' ' ALA . 19.0 t -125.65 122.45 62.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 108.167 -1.049 . . . . 29.41 108.167 -173.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.19 127.42 35.8 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.263 0.225 . . . . 29.84 110.546 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 73' ' ' GLY . . . . . 0.526 ' O ' ' HA3' ' H' ' 73' ' ' GLY . . . 173.44 176.41 41.91 Favored Glycine 0 CA--C 1.499 -0.919 0 C-N-CA 119.099 -1.524 . . . . 30.33 110.965 165.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' I' ' 44' ' ' THR . 2.8 t -68.08 124.28 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 106.201 -1.777 . . . . 32.13 106.201 159.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 75' ' ' THR . . . . . . . . . . . . . 24.0 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.228 -0.589 . . . . 33.05 111.834 -169.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.72 56.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.365 0.666 . . . . 31.72 111.021 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -133.45 128.73 55.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 122.859 0.464 . . . . 31.36 109.862 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 78' ' ' ALA . . . . . 0.474 ' HB2' HG21 ' I' ' 71' ' ' VAL . . . -127.47 130.16 48.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.272 -0.27 . . . . 31.08 110.272 172.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.33 132.35 37.56 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 122.26 0.224 . . . . 33.03 110.904 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.75 137.22 41.44 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 111.701 0.26 . . . . 33.64 111.701 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 81' ' ' THR . . . . . . . . . . . . . 98.5 m -129.52 128.98 43.92 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 123.525 0.73 . . . . 37.23 110.65 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.11 116.75 51.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.988 -0.745 . . . . 39.19 108.988 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.7 108.79 16.82 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 118.263 -0.875 . . . . 44.56 110.062 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.92 154.15 7.51 Favored Glycine 0 N--CA 1.447 -0.618 0 O-C-N 124.752 1.283 . . . . 43.14 113.24 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.92 152.11 29.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.566 0.683 . . . . 41.86 110.333 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.51 47.44 89.93 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 116.426 1.33 . . . . 39.23 116.426 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 87' ' ' SER . . . . . . . . . . . . . 42.9 t -89.03 143.89 26.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.48 0.64 . . . . 38.46 110.282 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.5 120.76 59.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.637 -0.875 . . . . 36.58 108.637 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.56 115.95 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.101 -1.074 . . . . 34.07 108.101 169.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.17 34.45 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.538 -0.171 . . . . 33.16 110.538 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.61 127.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 122.897 0.479 . . . . 30.92 109.751 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.57 33.98 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.09 0.244 . . . . 31.4 110.614 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 93' ' ' GLY . . . . . 0.427 ' HA3' ' O ' ' H' ' 93' ' ' GLY . . . -55.18 -72.21 0.6 Allowed Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.751 -1.214 . . . . 32.81 113.331 175.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 94' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -149.85 157.19 42.94 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.802 -0.759 . . . . 36.13 109.682 174.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.03 125.38 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.692 -0.855 . . . . 38.53 108.692 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.24 119.44 35.18 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.532 -0.914 . . . . 41.79 108.532 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.11 123.23 28.16 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.738 -0.467 . . . . 49.58 109.738 -174.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.529 -0.305 . . . . 56.02 110.798 170.971 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.674 0 N-CA-C 112.237 -0.345 . . . . 40.39 112.237 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 37' ' ' VAL . . . . . . . . . . . . . 40.5 t -127.1 124.99 65.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.555 -0.906 . . . . 39.01 108.555 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.11 115.83 28.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.745 -1.205 . . . . 35.45 107.745 171.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 39' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -125.35 119.18 27.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.416 -0.587 . . . . 35.94 109.416 -173.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 40' ' ' VAL . . . . . . . . . . . . . 36.5 t -124.19 118.34 53.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.441 -0.948 . . . . 34.76 108.441 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.07 127.45 5.92 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.74 -0.743 . . . . 36.61 113.126 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.57 23.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.979 0.89 . . . . 37.27 111.413 -167.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.08 42.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.679 0.792 . . . . 39.17 109.142 172.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 44' ' ' THR . . . . . 0.48 ' O ' ' HA ' ' C' ' 44' ' ' THR . 7.2 t -141.56 138.13 32.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.036 0.446 . . . . 36.8 111.366 178.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.01 2.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.685 -0.689 . . . . 37.39 110.9 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.53 126.52 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.558 -0.714 . . . . 37.06 111.414 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.64 135.04 8.06 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 115.671 1.028 . . . . 32.87 115.671 172.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.79 121.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 108.356 -0.979 . . . . 30.14 108.356 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 49' ' ' VAL . . . . . . . . . . . . . 58.3 t -133.74 127.33 52.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 C-N-CA 122.203 0.201 . . . . 28.72 110.708 -169.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.48 119.45 36.25 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.97 0.908 . . . . 30.14 109.832 171.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.77 0.96 Allowed Glycine 0 C--N 1.331 0.264 0 N-CA-C 119.107 2.403 . . . . 29.64 119.107 -175.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.56 124.83 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 118.108 0.954 . . . . 30.96 108.702 -171.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.73 129.11 43.75 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 122.253 0.221 . . . . 33.52 111.088 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 54' ' ' THR . . . . . . . . . . . . . 98.2 m -120.71 118.19 29.44 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 107.578 -1.267 . . . . 35.43 107.578 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 55' ' ' VAL . . . . . . . . . . . . . 92.9 t -129.45 122.09 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.614 -0.513 . . . . 36.61 109.614 -173.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.81 132.62 38.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.701 0.26 . . . . 38.73 111.701 -177.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.1 124.18 36.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.428 -0.582 . . . . 42.66 109.428 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.1 37.38 28.55 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.874 0.87 . . . . 42.43 113.087 -178.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.8 152.28 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.469 1.108 . . . . 42.68 109.76 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.16 -64.65 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 118.123 -1.431 . . . . 43.74 114.132 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.07 109.02 13.55 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.202 -0.936 . . . . 42.33 109.61 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.06 126.14 42.53 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.316 -0.624 . . . . 36.49 109.316 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.59 124.49 57.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 109.421 -0.585 . . . . 33.16 109.421 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.24 118.19 34.6 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.151 -1.055 . . . . 30.88 108.151 163.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 65' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -131.73 122.89 26.61 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.744 -0.465 . . . . 28.22 109.744 -168.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.74 119.62 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 108.533 -0.914 . . . . 27.29 108.533 -175.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 67' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' F' ' 201' ' ' HOH . . . -70.76 -37.42 66.61 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.349 -0.929 . . . . 26.78 114.123 -177.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.91 -135.97 7.5 Favored Glycine 0 N--CA 1.45 -0.423 0 O-C-N 121.93 -0.747 . . . . 27.35 114.686 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.57 162.06 13.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 117.694 0.747 . . . . 28.65 110.717 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 70' ' ' VAL . . . . . . . . . . . . . 51.4 t -116.43 114.08 44.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.455 -1.683 . . . . 29.1 106.455 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 71' ' ' VAL . . . . . 0.492 HG21 ' HB2' ' F' ' 78' ' ' ALA . 19.0 t -125.68 122.39 62.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.177 -1.046 . . . . 29.41 108.177 -173.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.16 127.46 35.96 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 122.272 0.229 . . . . 29.84 110.525 -175.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 73' ' ' GLY . . . . . 0.571 ' HA3' ' O ' ' C' ' 73' ' ' GLY . . . 173.4 176.44 41.9 Favored Glycine 0 CA--C 1.499 -0.95 0 C-N-CA 119.136 -1.507 . . . . 30.33 111.036 165.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 74' ' ' VAL . . . . . 0.45 HG11 HG21 ' F' ' 44' ' ' THR . 2.8 t -68.04 124.27 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.265 -1.754 . . . . 32.13 106.265 159.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 75' ' ' THR . . . . . . . . . . . . . 24.0 m 60.4 81.33 0.18 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.263 -0.575 . . . . 33.05 111.831 -169.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.15 128.76 56.52 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.36 0.664 . . . . 31.72 111.048 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.48 128.77 55.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 C-N-CA 122.874 0.47 . . . . 31.36 109.856 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 78' ' ' ALA . . . . . 0.492 ' HB2' HG21 ' F' ' 71' ' ' VAL . . . -127.5 130.08 48.54 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 122.384 0.274 . . . . 31.08 110.287 172.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.31 132.33 37.57 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 122.26 0.224 . . . . 33.03 110.925 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.83 137.15 41.24 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 111.684 0.253 . . . . 33.64 111.684 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.4 129.03 44.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 123.541 0.736 . . . . 37.23 110.678 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.18 116.79 51.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.018 -0.734 . . . . 39.19 109.018 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.73 108.8 16.82 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 118.299 -0.858 . . . . 44.56 110.043 -178.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.91 154.18 7.52 Favored Glycine 0 N--CA 1.446 -0.638 0 O-C-N 124.77 1.294 . . . . 43.14 113.225 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.98 152.09 29.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.592 0.696 . . . . 41.86 110.34 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.48 47.52 89.4 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 116.398 1.319 . . . . 39.23 116.398 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 87' ' ' SER . . . . . . . . . . . . . 43.1 t -89.02 143.89 26.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 117.548 0.674 . . . . 38.46 110.283 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.54 120.72 59.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 108.628 -0.879 . . . . 36.58 108.628 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.52 115.91 26.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.137 -1.06 . . . . 34.07 108.137 169.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.55 127.15 34.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.505 -0.183 . . . . 33.16 110.505 -174.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.56 127.35 42.16 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 122.869 0.467 . . . . 30.92 109.775 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.81 130.54 34.15 Favored 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 123.085 0.24 . . . . 31.4 110.621 -175.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.22 -72.14 0.61 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.721 -1.228 . . . . 32.81 113.336 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.88 157.23 42.97 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.808 -0.757 . . . . 36.13 109.657 174.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.1 125.4 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 CA-C-N 115.249 -0.887 . . . . 38.53 108.638 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.2 119.47 35.29 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.581 -0.896 . . . . 41.79 108.581 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.15 123.23 28.09 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 109.778 -0.453 . . . . 49.58 109.778 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.517 0 O-C-N 123.201 0.313 . . . . 56.02 110.789 171.002 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.751 0 N-CA-C 112.247 -0.341 . . . . 40.39 112.247 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.11 125.01 65.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.517 -0.92 . . . . 39.01 108.517 -177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.13 115.81 28.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.745 -1.206 . . . . 35.45 107.745 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.32 119.18 27.66 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.391 -0.596 . . . . 35.94 109.391 -173.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.19 118.39 53.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.435 -0.95 . . . . 34.76 108.435 -178.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.11 127.49 5.92 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.685 -0.769 . . . . 36.61 113.087 176.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 42' ' ' SER . . . . . . . . . . . . . 4.4 t -139.65 128.57 23.5 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.007 0.903 . . . . 37.27 111.386 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.08 42.54 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 123.694 0.798 . . . . 39.17 109.141 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 44' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' G' ' 44' ' ' THR . 7.3 t -141.57 138.21 32.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 36.8 111.316 178.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.44 -61.07 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.644 -0.707 . . . . 37.39 110.889 175.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.53 126.5 35.04 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.618 -0.676 . . . . 37.06 111.463 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.01 8.05 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 115.623 1.009 . . . . 32.87 115.623 172.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.75 121.52 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 108.426 -0.953 . . . . 30.14 108.426 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -133.77 127.35 52.39 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 122.194 0.198 . . . . 28.72 110.728 -169.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.51 119.44 36.2 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 123.913 0.885 . . . . 30.14 109.822 171.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.14 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 119.115 2.406 . . . . 29.64 119.115 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 52' ' ' VAL . . . . . . . . . . . . . 54.8 t -138.55 124.81 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 118.076 0.938 . . . . 30.96 108.698 -171.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.72 129.15 43.82 Favored 'General case' 0 CA--C 1.518 -0.258 0 C-N-CA 122.23 0.212 . . . . 33.52 111.111 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.73 118.21 29.46 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.59 -1.263 . . . . 35.43 107.59 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.4 122.13 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 109.613 -0.514 . . . . 36.61 109.613 -173.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.88 132.6 38.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 111.729 0.27 . . . . 38.73 111.729 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.07 124.16 36.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.421 -0.585 . . . . 42.66 109.421 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.09 37.45 28.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.898 0.879 . . . . 42.43 113.018 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 59' ' ' THR . . . . . . . . . . . . . 53.1 m -111.82 152.25 28.11 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.47 1.108 . . . . 42.68 109.748 -172.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.15 -64.62 1.03 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 118.135 -1.426 . . . . 43.74 114.199 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.06 109.04 13.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.185 -0.947 . . . . 42.33 109.614 -177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.09 126.25 42.66 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.28 -0.637 . . . . 36.49 109.28 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.65 124.49 56.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 109.401 -0.592 . . . . 33.16 109.401 -173.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.25 118.14 34.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.109 -1.071 . . . . 30.88 108.109 163.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.65 122.93 26.79 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.756 -0.461 . . . . 28.22 109.756 -168.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 t -122.8 119.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.555 -0.905 . . . . 27.29 108.555 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 67' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' J' ' 201' ' ' HOH . . . -70.68 -37.52 67.31 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.4 -0.905 . . . . 26.78 114.128 -177.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.89 -135.93 7.47 Favored Glycine 0 N--CA 1.45 -0.428 0 O-C-N 121.898 -0.766 . . . . 27.35 114.745 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.56 162.14 13.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.736 0.768 . . . . 28.65 110.705 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 70' ' ' VAL . . . . . . . . . . . . . 50.9 t -116.51 114.09 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 106.376 -1.713 . . . . 29.1 106.376 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 71' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' J' ' 78' ' ' ALA . 18.9 t -125.68 122.44 62.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.198 -1.038 . . . . 29.41 108.198 -173.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.16 127.44 35.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.733 -0.212 . . . . 29.84 110.485 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 73' ' ' GLY . . . . . 0.572 ' O ' ' HA3' ' G' ' 73' ' ' GLY . . . 173.39 176.45 41.9 Favored Glycine 0 CA--C 1.5 -0.885 0 C-N-CA 119.076 -1.535 . . . . 30.33 110.971 165.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' J' ' 44' ' ' THR . 2.8 t -68.08 124.26 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 106.236 -1.765 . . . . 32.13 106.236 159.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.48 81.33 0.18 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.256 -0.578 . . . . 33.05 111.823 -169.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.2 128.74 56.51 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.37 0.668 . . . . 31.72 111.024 176.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 77' ' ' VAL . . . . . . . . . . . . . 50.2 t -133.47 128.77 55.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 C-N-CA 122.833 0.453 . . . . 31.36 109.909 -176.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 78' ' ' ALA . . . . . 0.49 ' HB2' HG21 ' J' ' 71' ' ' VAL . . . -127.44 130.13 48.74 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.287 -0.264 . . . . 31.08 110.287 172.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.32 132.35 37.56 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 122.282 0.233 . . . . 33.03 110.864 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.82 137.23 41.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 111.613 0.227 . . . . 33.64 111.613 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 81' ' ' THR . . . . . . . . . . . . . 98.4 m -129.51 128.96 43.9 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.549 0.739 . . . . 37.23 110.655 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.11 116.73 51.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.061 -0.718 . . . . 39.19 109.061 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.7 108.81 16.84 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 118.319 -0.848 . . . . 44.56 110.021 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.89 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 124.758 1.286 . . . . 43.14 113.221 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.91 152.06 29.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 117.54 0.67 . . . . 41.86 110.372 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.58 47.37 90.42 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 116.414 1.326 . . . . 39.23 116.414 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.96 143.95 26.51 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 117.51 0.655 . . . . 38.46 110.266 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.54 120.72 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.6 -0.889 . . . . 36.58 108.6 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.51 115.94 26.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.11 -1.07 . . . . 34.07 108.11 169.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.56 127.1 34.34 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.526 -0.176 . . . . 33.16 110.526 -174.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.55 127.43 42.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 30.92 109.756 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.94 130.5 33.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.133 0.271 . . . . 31.4 110.597 -175.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.13 -72.15 0.61 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.713 -1.232 . . . . 32.81 113.388 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 94' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -149.86 157.18 42.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 119.867 -0.733 . . . . 36.13 109.681 174.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.01 125.42 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.644 -0.873 . . . . 38.53 108.644 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.22 119.44 35.19 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.543 -0.91 . . . . 41.79 108.543 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.1 123.31 28.34 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.727 -0.471 . . . . 49.58 109.727 -174.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.526 0 CA-C-O 120.731 0.3 . . . . 56.02 110.795 170.994 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.701 0 N-CA-C 112.224 -0.351 . . . . 40.39 112.224 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.12 124.92 65.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 108.529 -0.915 . . . . 39.01 108.529 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' LEU . . . . . 0.428 HD13 HD23 ' E' ' 38' ' ' LEU . 16.0 tp -113.07 115.75 28.81 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.809 -1.182 . . . . 35.45 107.809 171.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.29 119.21 27.78 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.454 -0.572 . . . . 35.94 109.454 -173.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' VAL . . . . . . . . . . . . . 37.7 t -124.28 118.35 53.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.415 -0.957 . . . . 34.76 108.415 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.14 127.47 5.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.666 -0.778 . . . . 36.61 113.065 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.58 23.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.937 0.868 . . . . 37.27 111.404 -167.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.12 42.67 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.734 0.813 . . . . 39.17 109.102 172.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' THR . . . . . 0.579 ' HA ' ' O ' ' E' ' 44' ' ' THR . 7.2 t -141.57 138.2 32.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.453 . . . . 36.8 111.315 178.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.05 2.09 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.679 -0.691 . . . . 37.39 110.933 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.55 126.52 35.08 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.613 -0.679 . . . . 37.06 111.426 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.59 135.0 8.04 Favored Glycine 0 C--N 1.333 0.403 0 N-CA-C 115.714 1.045 . . . . 32.87 115.714 172.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 48' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.76 121.48 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.429 -0.952 . . . . 30.14 108.429 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.75 127.37 52.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 122.195 0.198 . . . . 28.72 110.702 -169.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.53 119.5 36.37 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.949 0.9 . . . . 30.14 109.84 171.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.17 -74.79 0.96 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 119.094 2.397 . . . . 29.64 119.094 -175.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -138.54 124.78 25.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 118.079 0.94 . . . . 30.96 108.745 -171.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.7 129.14 43.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 122.227 0.211 . . . . 33.52 111.078 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.74 118.22 29.5 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.603 -1.258 . . . . 35.43 107.603 176.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 93.0 t -129.45 122.1 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 109.573 -0.529 . . . . 36.61 109.573 -173.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.85 132.64 38.83 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 111.697 0.258 . . . . 38.73 111.697 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.14 124.19 36.29 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.38 -0.6 . . . . 42.66 109.38 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.06 37.43 28.66 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.912 0.885 . . . . 42.43 113.063 -178.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.82 152.27 28.1 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.472 1.109 . . . . 42.68 109.759 -172.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.16 -64.63 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 118.154 -1.418 . . . . 43.74 114.182 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.05 109.06 13.61 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.229 -0.92 . . . . 42.33 109.599 -177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.19 42.53 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.244 -0.65 . . . . 36.49 109.244 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.67 124.48 56.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.464 -0.569 . . . . 33.16 109.464 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.22 118.11 34.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.116 -1.068 . . . . 30.88 108.116 163.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.66 122.91 26.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.766 -0.457 . . . . 28.22 109.766 -168.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.77 119.61 58.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 108.588 -0.893 . . . . 27.29 108.588 -175.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' GLY . . . . . 0.447 ' O ' ' O ' ' D' ' 201' ' ' HOH . . . -70.78 -37.4 66.39 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.368 -0.92 . . . . 26.78 114.087 -177.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.91 -135.89 7.47 Favored Glycine 0 C--O 1.225 -0.442 0 O-C-N 121.958 -0.731 . . . . 27.35 114.726 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.59 162.08 13.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.684 0.742 . . . . 28.65 110.73 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' VAL . . . . . . . . . . . . . 51.3 t -116.41 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 106.415 -1.698 . . . . 29.1 106.415 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' D' ' 78' ' ' ALA . 19.0 t -125.69 122.43 62.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 108.189 -1.041 . . . . 29.41 108.189 -173.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.14 127.38 35.83 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.298 0.239 . . . . 29.84 110.528 -175.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' GLY . . . . . 0.621 ' O ' ' HA3' ' E' ' 73' ' ' GLY . . . 173.41 176.46 41.92 Favored Glycine 0 CA--C 1.499 -0.937 0 C-N-CA 119.134 -1.508 . . . . 30.33 111.008 165.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 74' ' ' VAL . . . . . 0.453 HG11 HG21 ' D' ' 44' ' ' THR . 2.8 t -68.01 124.2 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 106.252 -1.759 . . . . 32.13 106.252 159.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.58 81.2 0.19 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.185 -0.606 . . . . 33.05 111.827 -169.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.14 128.75 56.52 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.401 0.68 . . . . 31.72 111.045 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' VAL . . . . . . . . . . . . . 50.0 t -133.45 128.74 55.36 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 C-N-CA 122.925 0.49 . . . . 31.36 109.908 -176.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 78' ' ' ALA . . . . . 0.478 ' HB2' HG21 ' D' ' 71' ' ' VAL . . . -127.49 130.19 48.76 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 110.237 -0.283 . . . . 31.08 110.237 172.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.37 132.37 37.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.726 -0.215 . . . . 33.03 110.839 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.8 137.2 41.35 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.678 0.251 . . . . 33.64 111.678 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 98.4 m -129.44 129.03 44.13 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.502 0.721 . . . . 37.23 110.68 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.17 116.74 51.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 108.989 -0.745 . . . . 39.19 108.989 176.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.72 108.83 16.87 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 118.276 -0.868 . . . . 44.56 110.03 -178.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.2 7.52 Favored Glycine 0 N--CA 1.447 -0.629 0 O-C-N 124.781 1.301 . . . . 43.14 113.247 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.01 152.03 29.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 117.583 0.691 . . . . 41.86 110.315 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.59 47.46 89.96 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 116.387 1.315 . . . . 39.23 116.387 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.06 143.94 26.5 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 117.503 0.652 . . . . 38.46 110.251 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.54 120.73 59.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.571 -0.9 . . . . 36.58 108.571 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.52 115.93 26.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.161 -1.052 . . . . 34.07 108.161 169.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.53 127.19 34.6 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 110.526 -0.175 . . . . 33.16 110.526 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.59 127.45 42.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.748 -0.464 . . . . 30.92 109.748 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.93 130.5 33.82 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 123.069 0.23 . . . . 31.4 110.631 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.19 -72.19 0.6 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.75 -1.214 . . . . 32.81 113.331 175.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' PHE . . . . . . . . . . . . . 23.0 p90 -149.85 157.16 42.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.822 -0.751 . . . . 36.13 109.694 174.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -125.98 125.39 67.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.3 -0.864 . . . . 38.53 108.68 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.17 119.4 35.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.572 -0.899 . . . . 41.79 108.572 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.08 123.27 28.29 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.795 -0.446 . . . . 49.58 109.795 -174.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.541 0 O-C-N 123.185 0.303 . . . . 56.02 110.835 170.998 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.72 0 N-CA-C 112.253 -0.339 . . . . 40.39 112.253 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.1 124.93 65.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.523 -0.917 . . . . 39.01 108.523 -177.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.06 115.79 28.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.84 -1.17 . . . . 35.45 107.84 171.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.3 119.18 27.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.469 -0.567 . . . . 35.94 109.469 -173.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 40' ' ' VAL . . . . . . . . . . . . . 36.7 t -124.25 118.29 53.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.432 -0.951 . . . . 34.76 108.432 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.06 127.47 5.93 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.683 -0.77 . . . . 36.61 113.079 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.62 128.62 23.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.986 0.893 . . . . 37.27 111.423 -167.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.08 42.54 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.705 0.802 . . . . 39.17 109.103 172.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 44' ' ' THR . 7.2 t -141.54 138.17 32.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.979 0.418 . . . . 36.8 111.361 178.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 45' ' ' LYS . . . . . . . . . . . . . 24.8 tttt -76.42 -61.08 2.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 37.39 110.936 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.52 126.56 35.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.535 -0.728 . . . . 37.06 111.427 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.6 135.02 8.05 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 115.661 1.024 . . . . 32.87 115.661 172.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.81 121.48 63.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 108.404 -0.962 . . . . 30.14 108.404 177.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -133.7 127.41 52.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 C-N-CA 122.146 0.178 . . . . 28.72 110.678 -169.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 50' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -115.62 119.44 36.13 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.942 0.897 . . . . 30.14 109.825 171.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.15 -74.79 0.96 Allowed Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 119.121 2.408 . . . . 29.64 119.121 -175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.54 124.81 25.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 118.115 0.957 . . . . 30.96 108.727 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.75 129.16 43.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 122.21 0.204 . . . . 33.52 111.061 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 98.4 m -120.77 118.15 29.28 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.591 -1.262 . . . . 35.43 107.591 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.39 122.15 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.573 -0.529 . . . . 36.61 109.573 -173.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.59 38.82 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 111.715 0.265 . . . . 38.73 111.715 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.13 36.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.434 -0.58 . . . . 42.66 109.434 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.16 37.4 28.44 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.924 0.889 . . . . 42.43 113.013 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' THR . . . . . 0.431 ' O ' HG23 ' I' ' 59' ' ' THR . 53.1 m -111.82 152.26 28.1 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.479 1.112 . . . . 42.68 109.741 -172.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.14 -64.64 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 118.107 -1.437 . . . . 43.74 114.164 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.09 109.0 13.5 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.184 -0.947 . . . . 42.33 109.637 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.07 126.14 42.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.282 -0.636 . . . . 36.49 109.282 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 124.48 57.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.428 -0.582 . . . . 33.16 109.428 -173.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.23 118.2 34.65 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.095 -1.076 . . . . 30.88 108.095 163.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.75 122.9 26.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.785 -0.45 . . . . 28.22 109.785 -168.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 26.6 t -122.76 119.6 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 108.598 -0.89 . . . . 27.29 108.598 -175.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 67' ' ' GLY . . . . . 0.431 ' O ' ' O ' ' H' ' 201' ' ' HOH . . . -70.76 -37.4 66.54 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.363 -0.923 . . . . 26.78 114.118 -177.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.95 -135.94 7.51 Favored Glycine 0 C--O 1.226 -0.385 0 O-C-N 121.917 -0.755 . . . . 27.35 114.685 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.55 162.08 13.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.682 0.741 . . . . 28.65 110.706 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.47 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 106.424 -1.695 . . . . 29.1 106.424 175.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 71' ' ' VAL . . . . . 0.474 HG21 ' HB2' ' H' ' 78' ' ' ALA . 19.0 t -125.66 122.44 62.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.186 -1.042 . . . . 29.41 108.186 -173.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.14 127.43 35.94 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 122.273 0.229 . . . . 29.84 110.545 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 73' ' ' GLY . . . . . 0.596 ' O ' ' HA3' ' A' ' 73' ' ' GLY . . . 173.39 176.43 41.88 Favored Glycine 0 CA--C 1.5 -0.897 0 C-N-CA 119.108 -1.52 . . . . 30.33 110.979 165.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' H' ' 44' ' ' THR . 2.8 t -68.03 124.27 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 106.237 -1.764 . . . . 32.13 106.237 159.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 75' ' ' THR . . . . . . . . . . . . . 24.1 m 60.51 81.28 0.19 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.248 -0.581 . . . . 33.05 111.823 -169.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.2 128.81 56.54 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 123.329 0.652 . . . . 31.72 111.054 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.49 128.77 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 C-N-CA 122.871 0.468 . . . . 31.36 109.889 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ALA . . . . . 0.474 ' HB2' HG21 ' H' ' 71' ' ' VAL . . . -127.5 130.15 48.68 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 110.276 -0.268 . . . . 31.08 110.276 172.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.32 132.35 37.57 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 123.058 0.223 . . . . 33.03 110.906 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.75 137.18 41.41 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 111.73 0.27 . . . . 33.64 111.73 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -129.52 128.96 43.88 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.566 0.746 . . . . 37.23 110.703 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.13 116.8 51.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.996 -0.742 . . . . 39.19 108.996 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.73 108.85 16.89 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 118.298 -0.858 . . . . 44.56 110.014 -178.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.84 154.15 7.5 Favored Glycine 0 N--CA 1.447 -0.625 0 O-C-N 124.702 1.251 . . . . 43.14 113.254 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.99 152.11 29.65 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 117.542 0.671 . . . . 41.86 110.339 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.54 47.44 89.97 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 116.437 1.335 . . . . 39.23 116.437 176.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.03 143.85 26.56 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 117.493 0.646 . . . . 38.46 110.273 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.47 120.74 59.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 108.618 -0.882 . . . . 36.58 108.618 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 116.0 26.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.102 -1.073 . . . . 34.07 108.102 169.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.63 127.16 34.33 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.464 -0.199 . . . . 33.16 110.464 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.58 127.46 42.34 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.74 -0.467 . . . . 30.92 109.74 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.95 130.54 33.86 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 123.144 0.278 . . . . 31.4 110.601 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' GLY . . . . . 0.427 ' O ' ' HA3' ' I' ' 93' ' ' GLY . . . -55.18 -72.17 0.6 Allowed Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 119.732 -1.223 . . . . 32.81 113.351 175.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.87 157.17 42.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.844 -0.742 . . . . 36.13 109.707 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.03 125.36 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.295 -0.866 . . . . 38.53 108.676 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.2 119.4 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.57 -0.9 . . . . 41.79 108.57 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.1 123.2 28.11 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.804 -0.443 . . . . 49.58 109.804 -174.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 116.571 -0.286 . . . . 56.02 110.825 171.016 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.69 0 N-CA-C 112.273 -0.331 . . . . 40.39 112.273 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.12 124.99 65.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 108.506 -0.924 . . . . 39.01 108.506 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 15.9 tp -113.08 115.78 28.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.776 -1.194 . . . . 35.45 107.776 171.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.32 119.22 27.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.414 -0.587 . . . . 35.94 109.414 -173.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.22 118.35 53.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.459 -0.941 . . . . 34.76 108.459 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.1 127.5 5.93 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.729 -0.748 . . . . 36.61 113.089 176.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.66 128.59 23.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 117.974 0.887 . . . . 37.27 111.363 -167.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.79 122.11 42.55 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.699 0.8 . . . . 39.17 109.106 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' THR . . . . . 0.551 ' O ' ' HA ' ' G' ' 44' ' ' THR . 7.2 t -141.55 138.2 32.52 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.994 0.425 . . . . 36.8 111.374 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.12 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.708 -0.678 . . . . 37.39 110.866 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.47 126.58 35.37 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.608 -0.683 . . . . 37.06 111.438 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.69 135.01 8.04 Favored Glycine 0 C--N 1.333 0.384 0 N-CA-C 115.645 1.018 . . . . 32.87 115.645 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.77 121.52 63.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.42 -0.955 . . . . 30.14 108.42 177.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 58.5 t -133.76 127.36 52.44 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 C-N-CA 122.169 0.188 . . . . 28.72 110.689 -169.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -115.51 119.54 36.52 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.887 0.875 . . . . 30.14 109.825 171.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.2 -74.83 0.96 Allowed Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 119.101 2.4 . . . . 29.64 119.101 -175.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.5 124.79 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 118.052 0.926 . . . . 30.96 108.78 -171.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.71 129.15 43.84 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.253 0.221 . . . . 33.52 111.079 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.77 118.26 29.58 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.587 -1.264 . . . . 35.43 107.587 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 93.0 t -129.44 122.1 54.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.633 -0.506 . . . . 36.61 109.633 -173.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.83 132.6 38.82 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 111.717 0.266 . . . . 38.73 111.717 -177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.12 124.19 36.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.412 -0.588 . . . . 42.66 109.412 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.07 37.42 28.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.881 0.872 . . . . 42.43 113.051 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 52.8 m -111.76 152.26 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.509 1.123 . . . . 42.68 109.786 -172.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.14 -64.69 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 118.149 -1.42 . . . . 43.74 114.189 -177.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.03 109.11 13.68 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 121.185 -0.947 . . . . 42.33 109.63 -177.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.14 126.15 42.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.275 -0.639 . . . . 36.49 109.275 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.6 124.53 57.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 109.404 -0.591 . . . . 33.16 109.404 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.25 118.2 34.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.093 -1.077 . . . . 30.88 108.093 163.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.68 122.92 26.74 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.754 -0.461 . . . . 28.22 109.754 -168.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.77 119.68 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.327 0 N-CA-C 108.58 -0.896 . . . . 27.29 108.58 -175.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . 0.437 ' O ' ' O ' ' B' ' 201' ' ' HOH . . . -70.82 -37.36 66.02 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.334 -0.936 . . . . 26.78 114.112 -177.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.9 -135.94 7.49 Favored Glycine 0 C--O 1.225 -0.444 0 O-C-N 121.9 -0.765 . . . . 27.35 114.727 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.63 162.08 13.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 117.683 0.742 . . . . 28.65 110.71 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 50.9 t -116.48 114.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.37 -1.715 . . . . 29.1 106.37 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' B' ' 78' ' ' ALA . 19.1 t -125.73 122.41 62.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.17 -1.048 . . . . 29.41 108.17 -173.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.13 127.46 36.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.712 -0.222 . . . . 29.84 110.505 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . 0.596 ' HA3' ' O ' ' G' ' 73' ' ' GLY . . . 173.38 176.42 41.87 Favored Glycine 0 CA--C 1.499 -0.91 0 C-N-CA 119.142 -1.504 . . . . 30.33 110.975 165.417 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' VAL . . . . . 0.449 HG11 HG21 ' B' ' 44' ' ' THR . 2.8 t -68.05 124.24 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.25 -1.759 . . . . 32.13 106.25 159.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.47 81.29 0.19 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.249 -0.58 . . . . 33.05 111.832 -169.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.14 128.73 56.51 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.41 0.684 . . . . 31.72 111.045 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 49.8 t -133.45 128.74 55.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 122.88 0.472 . . . . 31.36 109.926 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ALA . . . . . 0.488 ' HB2' HG21 ' B' ' 71' ' ' VAL . . . -127.49 130.11 48.62 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 110.266 -0.272 . . . . 31.08 110.266 172.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.27 132.34 37.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 122.296 0.238 . . . . 33.03 110.919 -179.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.77 137.2 41.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.704 0.261 . . . . 33.64 111.704 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.52 128.92 43.8 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.535 0.734 . . . . 37.23 110.686 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.13 116.72 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.05 -0.722 . . . . 39.19 109.05 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.66 108.79 16.84 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 118.273 -0.87 . . . . 44.56 110.074 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.92 154.19 7.53 Favored Glycine 0 N--CA 1.447 -0.632 0 O-C-N 124.758 1.287 . . . . 43.14 113.252 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.02 152.07 29.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 117.557 0.678 . . . . 41.86 110.301 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.57 47.42 90.11 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 116.41 1.324 . . . . 39.23 116.41 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.99 143.89 26.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.53 0.665 . . . . 38.46 110.289 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.52 120.79 59.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.59 -0.892 . . . . 36.58 108.59 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.58 115.98 26.74 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.125 -1.065 . . . . 34.07 108.125 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.62 127.17 34.38 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.453 -0.203 . . . . 33.16 110.453 -174.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.57 127.42 42.28 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 122.817 0.447 . . . . 30.92 109.796 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.92 130.52 33.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.094 0.247 . . . . 31.4 110.634 -175.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.12 -72.15 0.6 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.719 -1.229 . . . . 32.81 113.405 175.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -149.89 157.18 42.92 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.85 -0.74 . . . . 36.13 109.681 174.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.04 125.39 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.25 -0.886 . . . . 38.53 108.635 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.18 119.39 35.06 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.572 -0.899 . . . . 41.79 108.572 174.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.1 123.28 28.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.798 -0.445 . . . . 49.58 109.798 -174.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.554 -0.293 . . . . 56.02 110.794 171.055 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.429 ' O ' ' O ' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . 0.436 ' O ' ' O ' ' C' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' HOH . . . . . 0.446 ' O ' ' O ' ' E' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 201' ' ' HOH . . . . . 0.448 ' O ' ' O ' ' G' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 201' ' ' HOH . . . . . 0.454 ' O ' ' O ' ' I' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 201' ' ' HOH . . . . . 0.434 ' O ' ' O ' ' F' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 201' ' ' HOH . . . . . 0.455 ' O ' ' O ' ' J' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . 0.447 ' O ' ' O ' ' D' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 201' ' ' HOH . . . . . 0.431 ' O ' ' O ' ' H' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . 0.437 ' O ' ' O ' ' B' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.711 0 N-CA-C 112.291 -0.324 . . . . 40.39 112.291 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.17 124.98 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 108.528 -0.916 . . . . 39.01 108.528 -177.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 15.9 tp -113.09 115.83 28.93 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.739 -1.208 . . . . 35.45 107.739 171.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.31 119.2 27.74 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.472 -0.566 . . . . 35.94 109.472 -173.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 37.3 t -124.2 118.35 53.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 108.425 -0.954 . . . . 34.76 108.425 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.14 127.45 5.9 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.684 -0.77 . . . . 36.61 113.13 176.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.59 128.57 23.59 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 117.995 0.898 . . . . 37.27 111.43 -167.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.72 122.08 42.56 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.745 0.818 . . . . 39.17 109.1 172.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . 0.524 ' O ' ' HA ' ' H' ' 44' ' ' THR . 7.2 t -141.57 138.22 32.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.02 0.438 . . . . 36.8 111.355 178.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.45 -61.09 2.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.671 -0.695 . . . . 37.39 110.872 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.49 126.59 35.36 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 121.636 -0.665 . . . . 37.06 111.416 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.63 135.0 8.04 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 115.645 1.018 . . . . 32.87 115.645 172.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.78 121.52 63.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.423 -0.954 . . . . 30.14 108.423 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.6 t -133.73 127.35 52.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 C-N-CA 122.189 0.195 . . . . 28.72 110.707 -169.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.49 119.48 36.33 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.921 0.889 . . . . 30.14 109.831 171.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.17 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.287 0 N-CA-C 119.125 2.41 . . . . 29.64 119.125 -175.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.52 124.79 25.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 118.096 0.948 . . . . 30.96 108.774 -171.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.71 129.13 43.8 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 122.218 0.207 . . . . 33.52 111.041 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 98.5 m -120.76 118.24 29.54 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.564 -1.273 . . . . 35.43 107.564 176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 93.2 t -129.41 122.11 54.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 N-CA-C 109.657 -0.497 . . . . 36.61 109.657 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.84 132.54 38.73 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 111.729 0.27 . . . . 38.73 111.729 -177.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.09 124.23 36.49 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.383 -0.599 . . . . 42.66 109.383 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.07 37.41 28.62 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 123.887 0.875 . . . . 42.43 113.079 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -111.74 152.26 28.0 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 124.472 1.109 . . . . 42.68 109.751 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.11 -64.71 1.03 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 118.167 -1.413 . . . . 43.74 114.164 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.06 109.04 13.57 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.196 -0.94 . . . . 42.33 109.605 -177.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.1 126.22 42.61 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.286 -0.635 . . . . 36.49 109.286 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.52 57.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.449 -0.574 . . . . 33.16 109.449 -173.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.27 118.16 34.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.123 -1.066 . . . . 30.88 108.123 163.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.69 122.9 26.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.76 -0.459 . . . . 28.22 109.76 -168.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.73 119.62 58.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 108.594 -0.891 . . . . 27.29 108.594 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.429 ' O ' ' O ' ' A' ' 201' ' ' HOH . . . -70.73 -37.4 66.84 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.317 -0.944 . . . . 26.78 114.196 -177.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.9 -135.92 7.48 Favored Glycine 0 N--CA 1.45 -0.42 0 O-C-N 121.895 -0.768 . . . . 27.35 114.701 179.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.64 162.09 13.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.708 0.754 . . . . 28.65 110.711 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.42 114.05 44.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 106.484 -1.673 . . . . 29.1 106.484 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.476 HG21 ' HB2' ' A' ' 78' ' ' ALA . 19.0 t -125.68 122.42 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 108.187 -1.042 . . . . 29.41 108.187 -173.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.12 127.37 35.85 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 122.307 0.243 . . . . 29.84 110.544 -175.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.596 ' HA3' ' O ' ' H' ' 73' ' ' GLY . . . 173.44 176.45 41.95 Favored Glycine 0 CA--C 1.499 -0.949 0 C-N-CA 119.124 -1.512 . . . . 30.33 110.991 165.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.453 HG11 HG21 ' A' ' 44' ' ' THR . 2.8 t -68.0 124.26 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.244 -1.762 . . . . 32.13 106.244 159.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.8 m 60.42 81.33 0.18 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.237 -0.585 . . . . 33.05 111.862 -169.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.74 56.51 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.368 0.667 . . . . 31.72 111.009 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -133.48 128.73 55.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 C-N-CA 122.867 0.467 . . . . 31.36 109.895 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.476 ' HB2' HG21 ' A' ' 71' ' ' VAL . . . -127.45 130.18 48.81 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 122.354 0.262 . . . . 31.08 110.298 172.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.36 132.35 37.5 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 122.267 0.227 . . . . 33.03 110.891 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.84 137.22 41.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 111.662 0.245 . . . . 33.64 111.662 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.48 128.99 44.01 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 123.542 0.737 . . . . 37.23 110.657 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.16 116.75 51.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 109.056 -0.72 . . . . 39.19 109.056 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.68 108.84 16.9 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 118.29 -0.862 . . . . 44.56 110.016 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.16 7.51 Favored Glycine 0 CA--C 1.504 -0.596 0 O-C-N 124.796 1.31 . . . . 43.14 113.261 178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.01 152.1 29.63 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.625 0.712 . . . . 41.86 110.307 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.52 47.45 89.88 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 116.403 1.321 . . . . 39.23 116.403 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.97 143.92 26.52 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 117.501 0.651 . . . . 38.46 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 63.2 mt -124.53 120.79 59.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.618 -0.882 . . . . 36.58 108.618 -176.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.59 115.92 26.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.135 -1.061 . . . . 34.07 108.135 169.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.18 34.48 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.454 -0.202 . . . . 33.16 110.454 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.63 127.4 42.16 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.768 -0.456 . . . . 30.92 109.768 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.86 130.5 33.97 Favored 'General case' 0 CA--C 1.516 -0.332 0 O-C-N 123.083 0.239 . . . . 31.4 110.598 -175.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.14 -72.21 0.59 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.776 -1.202 . . . . 32.81 113.35 175.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 23.0 p90 -149.87 157.19 42.94 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.8 -0.76 . . . . 36.13 109.657 174.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.0 125.35 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 115.281 -0.872 . . . . 38.53 108.684 179.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.15 119.4 35.12 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.605 -0.887 . . . . 41.79 108.605 174.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.12 123.26 28.21 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.754 -0.462 . . . . 49.58 109.754 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.534 0 O-C-N 123.217 0.323 . . . . 56.02 110.785 171.043 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.732 0 N-CA-C 112.257 -0.337 . . . . 40.39 112.257 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.14 124.97 65.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.52 -0.919 . . . . 39.01 108.52 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 15.8 tp -113.1 115.8 28.88 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.769 -1.197 . . . . 35.45 107.769 171.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -125.29 119.15 27.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.401 -0.592 . . . . 35.94 109.401 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' VAL . . . . . . . . . . . . . 37.4 t -124.23 118.37 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 108.424 -0.954 . . . . 34.76 108.424 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.06 127.43 5.91 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.756 -0.735 . . . . 36.61 113.162 176.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.59 23.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 117.993 0.896 . . . . 37.27 111.366 -167.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.14 42.7 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 123.695 0.798 . . . . 39.17 109.111 172.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' THR . . . . . 0.537 ' O ' ' HA ' ' B' ' 44' ' ' THR . 7.2 t -141.66 138.2 32.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.11 0.481 . . . . 36.8 111.334 178.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.42 -61.1 2.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.639 -0.71 . . . . 37.39 110.874 175.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.54 126.56 35.19 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.558 -0.714 . . . . 37.06 111.409 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.59 135.0 8.04 Favored Glycine 0 C--N 1.333 0.394 0 N-CA-C 115.682 1.033 . . . . 32.87 115.682 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.83 121.46 63.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 108.4 -0.963 . . . . 30.14 108.4 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -133.7 127.42 52.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 C-N-CA 122.176 0.191 . . . . 28.72 110.713 -169.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -115.56 119.52 36.42 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.927 0.891 . . . . 30.14 109.809 171.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.82 0.96 Allowed Glycine 0 C--N 1.331 0.288 0 N-CA-C 119.109 2.404 . . . . 29.64 119.109 -175.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.48 124.88 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 118.067 0.934 . . . . 30.96 108.722 -171.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.79 129.15 43.71 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 122.218 0.207 . . . . 33.52 111.081 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 98.4 m -120.77 118.18 29.37 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.595 -1.261 . . . . 35.43 107.595 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.42 122.11 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 N-CA-C 109.629 -0.508 . . . . 36.61 109.629 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.83 132.62 38.84 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 111.679 0.251 . . . . 38.73 111.679 -177.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.15 36.26 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.458 -0.571 . . . . 42.66 109.458 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.1 37.42 28.57 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.878 0.871 . . . . 42.43 113.058 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.83 152.27 28.09 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 124.478 1.111 . . . . 42.68 109.736 -172.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.15 -64.66 1.03 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 118.162 -1.415 . . . . 43.74 114.177 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.04 109.01 13.55 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.184 -0.947 . . . . 42.33 109.697 -177.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.23 42.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.236 -0.653 . . . . 36.49 109.236 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' VAL . . . . . . . . . . . . . 17.4 t -130.65 124.44 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 109.439 -0.578 . . . . 33.16 109.439 -173.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.19 118.24 34.79 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.097 -1.075 . . . . 30.88 108.097 163.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.74 122.89 26.61 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.735 -0.468 . . . . 28.22 109.735 -168.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 t -122.7 119.59 58.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 108.6 -0.889 . . . . 27.29 108.6 -175.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLY . . . . . 0.436 ' O ' ' O ' ' C' ' 201' ' ' HOH . . . -70.73 -37.43 66.88 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.374 -0.917 . . . . 26.78 114.144 -177.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.96 -135.9 7.49 Favored Glycine 0 C--O 1.225 -0.411 0 O-C-N 121.932 -0.746 . . . . 27.35 114.688 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.62 162.09 13.57 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 117.69 0.745 . . . . 28.65 110.66 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.44 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 106.434 -1.691 . . . . 29.1 106.434 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' C' ' 78' ' ' ALA . 19.1 t -125.68 122.44 62.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.17 -1.048 . . . . 29.41 108.17 -173.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.17 127.38 35.78 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.249 0.22 . . . . 29.84 110.474 -175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' GLY . . . . . 0.584 ' HA3' ' O ' ' B' ' 73' ' ' GLY . . . 173.45 176.44 41.94 Favored Glycine 0 CA--C 1.499 -0.956 0 C-N-CA 119.129 -1.51 . . . . 30.33 111.027 165.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' VAL . . . . . 0.447 HG11 HG21 ' C' ' 44' ' ' THR . 2.8 t -67.98 124.24 23.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 106.253 -1.758 . . . . 32.13 106.253 159.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.2 -0.6 . . . . 33.05 111.839 -169.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.17 128.76 56.52 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 123.36 0.664 . . . . 31.72 111.053 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.48 128.75 55.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 C-N-CA 122.894 0.478 . . . . 31.36 109.877 -176.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' ALA . . . . . 0.49 ' HB2' HG21 ' C' ' 71' ' ' VAL . . . -127.44 130.1 48.69 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 122.359 0.264 . . . . 31.08 110.314 172.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.29 132.37 37.66 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 122.257 0.223 . . . . 33.03 110.899 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.82 137.21 41.31 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 111.686 0.254 . . . . 33.64 111.686 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.44 128.95 43.99 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 123.556 0.742 . . . . 37.23 110.735 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.16 116.82 51.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.988 -0.745 . . . . 39.19 108.988 176.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.77 108.79 16.79 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 118.305 -0.855 . . . . 44.56 110.0 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.59 0 O-C-N 124.786 1.304 . . . . 43.14 113.234 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.91 152.01 29.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 117.584 0.692 . . . . 41.86 110.387 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.63 47.4 90.35 Favored Glycine 0 N--CA 1.447 -0.602 0 N-CA-C 116.402 1.321 . . . . 39.23 116.402 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.02 143.97 26.48 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 117.512 0.656 . . . . 38.46 110.265 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' ILE . . . . . . . . . . . . . 63.4 mt -124.53 120.73 59.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 108.605 -0.887 . . . . 36.58 108.605 -176.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 115.94 26.71 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.149 -1.056 . . . . 34.07 108.149 169.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.59 127.16 34.42 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.47 -0.196 . . . . 33.16 110.47 -174.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.57 127.4 42.24 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 122.845 0.458 . . . . 30.92 109.784 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.53 33.91 Favored 'General case' 0 CA--C 1.516 -0.338 0 O-C-N 123.059 0.224 . . . . 31.4 110.603 -175.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.12 -72.18 0.6 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 119.745 -1.217 . . . . 32.81 113.357 175.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -149.87 157.22 42.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.808 -0.757 . . . . 36.13 109.675 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' VAL . . . . . . . . . . . . . 14.9 t -126.07 125.37 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 CA-C-N 115.275 -0.875 . . . . 38.53 108.65 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.17 119.41 35.12 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.592 -0.892 . . . . 41.79 108.592 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.14 123.27 28.19 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.735 -0.469 . . . . 49.58 109.735 -174.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.502 -0.317 . . . . 56.02 110.822 171.0 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.719 0 N-CA-C 112.276 -0.329 . . . . 40.39 112.276 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.13 124.96 65.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 108.534 -0.913 . . . . 39.01 108.534 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' LEU . . . . . 0.428 HD23 HD13 ' D' ' 38' ' ' LEU . 15.8 tp -113.09 115.85 28.96 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.791 -1.189 . . . . 35.45 107.791 171.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.29 119.2 27.76 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.414 -0.588 . . . . 35.94 109.414 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' VAL . . . . . . . . . . . . . 36.5 t -124.21 118.31 53.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 108.476 -0.935 . . . . 34.76 108.476 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.05 127.5 5.93 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.723 -0.751 . . . . 36.61 113.118 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.56 23.48 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.982 0.891 . . . . 37.27 111.345 -167.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.67 122.1 42.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 123.739 0.816 . . . . 39.17 109.135 172.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 44' ' ' THR . . . . . 0.579 ' O ' ' HA ' ' D' ' 44' ' ' THR . 7.2 t -141.56 138.2 32.5 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.024 0.44 . . . . 36.8 111.353 178.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.46 -61.04 2.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.694 -0.684 . . . . 37.39 110.891 175.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.55 126.59 35.26 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.617 -0.677 . . . . 37.06 111.41 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.63 135.01 8.04 Favored Glycine 0 C--N 1.333 0.391 0 N-CA-C 115.665 1.026 . . . . 32.87 115.665 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.77 121.53 63.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 108.406 -0.961 . . . . 30.14 108.406 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.76 127.37 52.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 122.153 0.181 . . . . 28.72 110.652 -169.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 50' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -115.53 119.48 36.3 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.948 0.899 . . . . 30.14 109.825 171.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.18 -74.77 0.96 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 119.123 2.409 . . . . 29.64 119.123 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.56 124.88 25.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.184 0 CA-C-N 118.082 0.941 . . . . 30.96 108.724 -171.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.79 129.18 43.74 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.177 0.191 . . . . 33.52 111.048 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.77 118.19 29.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.614 -1.254 . . . . 35.43 107.614 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.42 122.08 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.635 -0.506 . . . . 36.61 109.635 -173.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.78 132.57 38.89 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.723 0.268 . . . . 38.73 111.723 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.16 36.29 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.454 -0.572 . . . . 42.66 109.454 175.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.15 37.39 28.44 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.895 0.878 . . . . 42.43 113.032 -178.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 59' ' ' THR . . . . . . . . . . . . . 53.0 m -111.79 152.27 28.04 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.504 1.121 . . . . 42.68 109.772 -172.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.13 -64.71 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 118.14 -1.424 . . . . 43.74 114.154 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.0 109.06 13.63 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.21 -0.931 . . . . 42.33 109.665 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.15 126.17 42.41 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.275 -0.639 . . . . 36.49 109.275 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.5 57.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 109.453 -0.573 . . . . 33.16 109.453 -173.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.23 118.2 34.64 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.09 -1.078 . . . . 30.88 108.09 163.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.68 122.87 26.66 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.828 -0.434 . . . . 28.22 109.828 -168.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -122.72 119.62 58.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 108.556 -0.905 . . . . 27.29 108.556 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 67' ' ' GLY . . . . . 0.446 ' O ' ' O ' ' E' ' 201' ' ' HOH . . . -70.8 -37.35 66.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.337 -0.935 . . . . 26.78 114.139 -177.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.93 -135.94 7.5 Favored Glycine 0 N--CA 1.45 -0.431 0 O-C-N 121.879 -0.777 . . . . 27.35 114.712 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.65 162.1 13.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.719 0.76 . . . . 28.65 110.662 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 70' ' ' VAL . . . . . . . . . . . . . 50.8 t -116.46 114.09 44.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 106.39 -1.707 . . . . 29.1 106.39 175.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 71' ' ' VAL . . . . . 0.477 HG21 ' HB2' ' E' ' 78' ' ' ALA . 19.1 t -125.68 122.42 62.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 108.187 -1.042 . . . . 29.41 108.187 -173.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -132.14 127.41 35.89 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 122.292 0.237 . . . . 29.84 110.517 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 73' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' D' ' 73' ' ' GLY . . . 173.42 176.44 41.91 Favored Glycine 0 CA--C 1.499 -0.928 0 C-N-CA 119.145 -1.502 . . . . 30.33 111.05 165.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 74' ' ' VAL . . . . . 0.45 HG11 HG21 ' E' ' 44' ' ' THR . 2.8 t -67.99 124.28 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 106.257 -1.757 . . . . 32.13 106.257 159.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 75' ' ' THR . . . . . . . . . . . . . 23.7 m 60.46 81.26 0.19 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 120.198 -0.601 . . . . 33.05 111.861 -169.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.76 56.52 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.32 0.648 . . . . 31.72 111.071 176.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 77' ' ' VAL . . . . . . . . . . . . . 50.7 t -133.46 128.74 55.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 122.832 0.453 . . . . 31.36 109.858 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 78' ' ' ALA . . . . . 0.477 ' HB2' HG21 ' E' ' 71' ' ' VAL . . . -127.47 130.11 48.64 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 110.278 -0.268 . . . . 31.08 110.278 172.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.29 132.39 37.68 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 123.12 0.263 . . . . 33.03 110.871 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.8 137.17 41.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 111.698 0.258 . . . . 33.64 111.698 178.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.47 128.99 44.03 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 123.603 0.761 . . . . 37.23 110.674 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.09 116.72 51.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.043 -0.725 . . . . 39.19 109.043 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.68 108.78 16.82 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 118.246 -0.883 . . . . 44.56 110.08 -178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.91 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 124.82 1.325 . . . . 43.14 113.217 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.1 29.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 117.564 0.682 . . . . 41.86 110.297 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.58 47.41 90.17 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 116.395 1.318 . . . . 39.23 116.395 176.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.05 143.95 26.49 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 117.537 0.668 . . . . 38.46 110.278 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.54 120.72 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.636 -0.876 . . . . 36.58 108.636 -176.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.51 115.92 26.67 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.127 -1.064 . . . . 34.07 108.127 169.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.57 127.17 34.48 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.479 -0.193 . . . . 33.16 110.479 -174.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.54 127.44 42.37 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.752 -0.462 . . . . 30.92 109.752 179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.92 130.53 33.9 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.114 0.259 . . . . 31.4 110.621 -175.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.16 -72.19 0.6 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.729 -1.224 . . . . 32.81 113.346 175.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.84 157.19 42.95 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.802 -0.759 . . . . 36.13 109.677 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.05 125.38 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.309 0 N-CA-C 108.663 -0.865 . . . . 38.53 108.663 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.25 119.42 35.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.584 -0.895 . . . . 41.79 108.584 174.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.07 123.29 28.33 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.751 -0.462 . . . . 49.58 109.751 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 120.761 0.315 . . . . 56.02 110.827 171.019 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.702 0 N-CA-C 112.218 -0.353 . . . . 40.39 112.218 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.14 124.98 65.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.547 -0.908 . . . . 39.01 108.547 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.06 115.76 28.85 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.769 -1.197 . . . . 35.45 107.769 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.3 119.21 27.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.409 -0.589 . . . . 35.94 109.409 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.22 118.37 53.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 108.438 -0.949 . . . . 34.76 108.438 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.11 127.49 5.92 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.747 -0.74 . . . . 36.61 113.094 176.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.61 23.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.926 0.863 . . . . 37.27 111.384 -167.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 43' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -117.77 122.09 42.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 123.678 0.791 . . . . 39.17 109.142 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 44' ' ' THR . . . . . 0.551 ' HA ' ' O ' ' B' ' 44' ' ' THR . 7.2 t -141.59 138.13 32.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.059 0.457 . . . . 36.8 111.401 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.37 -61.13 2.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.661 -0.7 . . . . 37.39 110.861 175.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.51 126.55 35.21 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.597 -0.689 . . . . 37.06 111.434 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.61 135.02 8.05 Favored Glycine 0 C--N 1.333 0.399 0 N-CA-C 115.646 1.018 . . . . 32.87 115.646 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.83 121.47 63.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 108.409 -0.96 . . . . 30.14 108.409 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 49' ' ' VAL . . . . . . . . . . . . . 58.3 t -133.72 127.39 52.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.118 0 C-N-CA 122.196 0.198 . . . . 28.72 110.731 -169.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.51 119.44 36.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.925 0.89 . . . . 30.14 109.853 171.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.73 0.96 Allowed Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 119.139 2.416 . . . . 29.64 119.139 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.52 124.84 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 118.096 0.948 . . . . 30.96 108.771 -171.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.76 129.08 43.67 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.243 0.217 . . . . 33.52 111.088 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 54' ' ' THR . . . . . . . . . . . . . 98.2 m -120.69 118.2 29.47 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 107.607 -1.257 . . . . 35.43 107.607 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 55' ' ' VAL . . . . . . . . . . . . . 92.8 t -129.48 122.13 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.583 -0.525 . . . . 36.61 109.583 -173.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.59 38.83 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 111.716 0.265 . . . . 38.73 111.716 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.11 124.21 36.4 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.394 -0.595 . . . . 42.66 109.394 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.04 37.44 28.71 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 123.88 0.872 . . . . 42.43 113.05 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 59' ' ' THR . . . . . . . . . . . . . 52.7 m -111.79 152.23 28.1 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 124.538 1.135 . . . . 42.68 109.768 -172.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.12 -64.65 1.03 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 118.156 -1.418 . . . . 43.74 114.209 -177.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.04 109.05 13.6 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 121.235 -0.916 . . . . 42.33 109.682 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.1 126.15 42.49 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.285 -0.635 . . . . 36.49 109.285 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.6 124.52 57.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.409 -0.589 . . . . 33.16 109.409 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 64' ' ' THR . . . . . . . . . . . . . 3.6 m -112.24 118.1 34.37 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.121 -1.066 . . . . 30.88 108.121 163.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.66 122.89 26.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.78 -0.452 . . . . 28.22 109.78 -168.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 t -122.74 119.62 58.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.549 -0.908 . . . . 27.29 108.549 -175.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 67' ' ' GLY . . . . . 0.448 ' O ' ' O ' ' G' ' 201' ' ' HOH . . . -70.82 -37.39 66.06 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.342 -0.932 . . . . 26.78 114.092 -177.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.89 -135.93 7.47 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 117.709 0.754 . . . . 27.35 114.727 179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.6 162.11 13.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 117.718 0.759 . . . . 28.65 110.691 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.5 114.05 44.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 106.42 -1.696 . . . . 29.1 106.42 175.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 71' ' ' VAL . . . . . 0.489 HG21 ' HB2' ' G' ' 78' ' ' ALA . 19.0 t -125.68 122.44 62.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.181 -1.044 . . . . 29.41 108.181 -173.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 72' ' ' THR . . . . . . . . . . . . . 4.7 m -132.11 127.4 35.95 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.288 0.235 . . . . 29.84 110.535 -175.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 73' ' ' GLY . . . . . 0.596 ' O ' ' HA3' ' B' ' 73' ' ' GLY . . . 173.42 176.47 41.94 Favored Glycine 0 CA--C 1.5 -0.868 0 C-N-CA 119.062 -1.542 . . . . 30.33 110.954 165.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' G' ' 44' ' ' THR . 2.8 t -68.05 124.28 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.232 -1.766 . . . . 32.13 106.232 159.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 75' ' ' THR . . . . . . . . . . . . . 23.8 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 120.196 -0.602 . . . . 33.05 111.859 -169.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.18 128.75 56.52 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.364 0.666 . . . . 31.72 111.022 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 77' ' ' VAL . . . . . . . . . . . . . 50.6 t -133.48 128.79 55.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 C-N-CA 122.855 0.462 . . . . 31.36 109.852 -176.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 78' ' ' ALA . . . . . 0.489 ' HB2' HG21 ' G' ' 71' ' ' VAL . . . -127.48 130.11 48.64 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 122.377 0.271 . . . . 31.08 110.279 172.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.34 132.42 37.6 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.026 0.204 . . . . 33.03 110.864 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.81 137.16 41.29 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 111.702 0.26 . . . . 33.64 111.702 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -129.46 128.96 43.97 Favored 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.582 0.753 . . . . 37.23 110.685 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.13 116.79 51.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 108.991 -0.744 . . . . 39.19 108.991 176.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.75 108.84 16.85 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 118.309 -0.853 . . . . 44.56 110.024 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.86 154.15 7.5 Favored Glycine 0 N--CA 1.447 -0.603 0 O-C-N 124.764 1.29 . . . . 43.14 113.203 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.96 152.1 29.7 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 117.543 0.672 . . . . 41.86 110.357 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.54 47.49 89.7 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 116.408 1.323 . . . . 39.23 116.408 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.04 143.9 26.53 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.544 0.672 . . . . 38.46 110.253 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.51 120.7 59.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 108.633 -0.877 . . . . 36.58 108.633 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 115.94 26.7 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.099 -1.074 . . . . 34.07 108.099 169.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.19 34.51 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.461 -0.2 . . . . 33.16 110.461 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.6 127.46 42.31 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.711 -0.478 . . . . 30.92 109.711 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.51 33.87 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.065 0.228 . . . . 31.4 110.606 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.17 -72.2 0.6 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.737 -1.22 . . . . 32.81 113.346 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 94' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -149.84 157.22 42.98 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.849 -0.741 . . . . 36.13 109.689 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.04 125.36 67.85 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.266 -0.879 . . . . 38.53 108.685 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.16 119.45 35.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.569 -0.9 . . . . 41.79 108.569 174.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.16 123.23 28.09 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.775 -0.454 . . . . 49.58 109.775 -174.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 56.02 110.828 171.031 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.727 0 N-CA-C 112.205 -0.358 . . . . 40.39 112.205 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 37' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.18 125.0 65.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.523 -0.917 . . . . 39.01 108.523 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 38' ' ' LEU . . . . . . . . . . . . . 16.1 tp -113.08 115.83 28.93 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 107.77 -1.196 . . . . 35.45 107.77 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.34 119.21 27.73 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.421 -0.585 . . . . 35.94 109.421 -173.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 40' ' ' VAL . . . . . . . . . . . . . 36.7 t -124.2 118.32 53.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 108.457 -0.942 . . . . 34.76 108.457 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.1 127.44 5.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.715 -0.755 . . . . 36.61 113.072 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.58 23.54 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.981 0.89 . . . . 37.27 111.38 -167.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.12 42.66 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 123.684 0.794 . . . . 39.17 109.126 172.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 44' ' ' THR . . . . . 0.451 HG21 HG11 ' I' ' 74' ' ' VAL . 7.2 t -141.59 138.21 32.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.042 0.449 . . . . 36.8 111.358 178.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.43 -61.07 2.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.689 -0.687 . . . . 37.39 110.925 175.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.56 126.59 35.22 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 121.595 -0.691 . . . . 37.06 111.399 -179.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.61 134.98 8.03 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 115.671 1.029 . . . . 32.87 115.671 172.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.84 121.49 63.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 108.406 -0.961 . . . . 30.14 108.406 177.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.75 127.39 52.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 C-N-CA 122.162 0.185 . . . . 28.72 110.676 -169.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 50' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -115.51 119.45 36.23 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.962 0.905 . . . . 30.14 109.881 171.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.12 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.271 0 N-CA-C 119.1 2.4 . . . . 29.64 119.1 -175.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -138.53 124.8 25.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 118.087 0.943 . . . . 30.96 108.765 -171.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.72 129.17 43.85 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 122.225 0.21 . . . . 33.52 111.083 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.75 118.14 29.27 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.63 -1.248 . . . . 35.43 107.63 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.41 122.11 54.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 109.614 -0.513 . . . . 36.61 109.614 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.63 38.88 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 111.717 0.266 . . . . 38.73 111.717 -177.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.09 124.14 36.27 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.445 -0.576 . . . . 42.66 109.445 175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.11 37.45 28.55 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.888 0.875 . . . . 42.43 113.04 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' THR . . . . . 0.431 HG23 ' O ' ' H' ' 59' ' ' THR . 52.6 m -111.8 152.21 28.13 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 124.534 1.134 . . . . 42.68 109.76 -172.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.11 -64.67 1.03 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 118.18 -1.408 . . . . 43.74 114.187 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.08 109.09 13.63 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 121.185 -0.947 . . . . 42.33 109.614 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.16 42.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.287 -0.634 . . . . 36.49 109.287 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.62 124.53 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.225 0 N-CA-C 109.439 -0.578 . . . . 33.16 109.439 -173.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.29 118.21 34.63 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.093 -1.076 . . . . 30.88 108.093 163.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.69 122.9 26.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.723 -0.473 . . . . 28.22 109.723 -168.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 t -122.75 119.63 58.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 N-CA-C 108.568 -0.901 . . . . 27.29 108.568 -175.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 67' ' ' GLY . . . . . 0.454 ' O ' ' O ' ' I' ' 201' ' ' HOH . . . -70.74 -37.35 66.76 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.359 -0.924 . . . . 26.78 114.195 -177.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.96 -135.92 7.5 Favored Glycine 0 C--O 1.225 -0.446 0 O-C-N 121.936 -0.744 . . . . 27.35 114.689 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.6 162.14 13.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 117.663 0.732 . . . . 28.65 110.646 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 70' ' ' VAL . . . . . . . . . . . . . 51.3 t -116.46 114.03 44.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 106.43 -1.692 . . . . 29.1 106.43 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 71' ' ' VAL . . . . . 0.474 HG21 ' HB2' ' I' ' 78' ' ' ALA . 19.0 t -125.65 122.45 62.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 108.167 -1.049 . . . . 29.41 108.167 -173.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.19 127.42 35.8 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.263 0.225 . . . . 29.84 110.546 -175.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 73' ' ' GLY . . . . . 0.526 ' O ' ' HA3' ' H' ' 73' ' ' GLY . . . 173.44 176.41 41.91 Favored Glycine 0 CA--C 1.499 -0.919 0 C-N-CA 119.099 -1.524 . . . . 30.33 110.965 165.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' I' ' 44' ' ' THR . 2.8 t -68.08 124.28 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 106.201 -1.777 . . . . 32.13 106.201 159.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 75' ' ' THR . . . . . . . . . . . . . 24.0 m 60.48 81.27 0.19 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 120.228 -0.589 . . . . 33.05 111.834 -169.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.21 128.72 56.5 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.365 0.666 . . . . 31.72 111.021 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -133.45 128.73 55.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 C-N-CA 122.859 0.464 . . . . 31.36 109.862 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 78' ' ' ALA . . . . . 0.474 ' HB2' HG21 ' I' ' 71' ' ' VAL . . . -127.47 130.16 48.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.272 -0.27 . . . . 31.08 110.272 172.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.33 132.35 37.56 Favored 'General case' 0 CA--C 1.518 -0.261 0 C-N-CA 122.26 0.224 . . . . 33.03 110.904 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.75 137.22 41.44 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 111.701 0.26 . . . . 33.64 111.701 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 81' ' ' THR . . . . . . . . . . . . . 98.5 m -129.52 128.98 43.92 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 123.525 0.73 . . . . 37.23 110.65 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.11 116.75 51.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 108.988 -0.745 . . . . 39.19 108.988 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.7 108.79 16.82 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 118.263 -0.875 . . . . 44.56 110.062 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.92 154.15 7.51 Favored Glycine 0 N--CA 1.447 -0.618 0 O-C-N 124.752 1.283 . . . . 43.14 113.24 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.92 152.11 29.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 117.566 0.683 . . . . 41.86 110.333 178.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.51 47.44 89.93 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 116.426 1.33 . . . . 39.23 116.426 176.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 87' ' ' SER . . . . . . . . . . . . . 42.9 t -89.03 143.89 26.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.48 0.64 . . . . 38.46 110.282 178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.5 120.76 59.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.637 -0.875 . . . . 36.58 108.637 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.56 115.95 26.69 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.101 -1.074 . . . . 34.07 108.101 169.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.58 127.17 34.45 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.538 -0.171 . . . . 33.16 110.538 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.61 127.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 122.897 0.479 . . . . 30.92 109.751 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.91 130.57 33.98 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.09 0.244 . . . . 31.4 110.614 -175.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 93' ' ' GLY . . . . . 0.427 ' HA3' ' O ' ' H' ' 93' ' ' GLY . . . -55.18 -72.21 0.6 Allowed Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.751 -1.214 . . . . 32.81 113.331 175.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 94' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -149.85 157.19 42.94 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.802 -0.759 . . . . 36.13 109.682 174.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.03 125.38 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.692 -0.855 . . . . 38.53 108.692 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.24 119.44 35.18 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.532 -0.914 . . . . 41.79 108.532 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.11 123.23 28.16 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.738 -0.467 . . . . 49.58 109.738 -174.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.529 -0.305 . . . . 56.02 110.798 170.971 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.674 0 N-CA-C 112.237 -0.345 . . . . 40.39 112.237 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' VAL . . . . . . . . . . . . . 40.5 t -127.1 124.99 65.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 108.555 -0.906 . . . . 39.01 108.555 -177.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.11 115.83 28.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 107.745 -1.205 . . . . 35.45 107.745 171.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -125.35 119.18 27.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.416 -0.587 . . . . 35.94 109.416 -173.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 40' ' ' VAL . . . . . . . . . . . . . 36.5 t -124.19 118.34 53.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.441 -0.948 . . . . 34.76 108.441 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.07 127.45 5.92 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.74 -0.743 . . . . 36.61 113.126 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.65 128.57 23.5 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 117.979 0.89 . . . . 37.27 111.413 -167.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.08 42.55 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.679 0.792 . . . . 39.17 109.142 172.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 44' ' ' THR . . . . . 0.48 ' O ' ' HA ' ' C' ' 44' ' ' THR . 7.2 t -141.56 138.13 32.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.036 0.446 . . . . 36.8 111.366 178.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.01 2.1 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.685 -0.689 . . . . 37.39 110.9 175.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.53 126.52 35.12 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.558 -0.714 . . . . 37.06 111.414 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.64 135.04 8.06 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 115.671 1.028 . . . . 32.87 115.671 172.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 48' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.79 121.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 108.356 -0.979 . . . . 30.14 108.356 177.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 49' ' ' VAL . . . . . . . . . . . . . 58.3 t -133.74 127.33 52.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 C-N-CA 122.203 0.201 . . . . 28.72 110.708 -169.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.48 119.45 36.25 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.97 0.908 . . . . 30.14 109.832 171.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.21 -74.77 0.96 Allowed Glycine 0 C--N 1.331 0.264 0 N-CA-C 119.107 2.403 . . . . 29.64 119.107 -175.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 52' ' ' VAL . . . . . . . . . . . . . 54.7 t -138.56 124.83 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 118.108 0.954 . . . . 30.96 108.702 -171.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.73 129.11 43.75 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 122.253 0.221 . . . . 33.52 111.088 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 54' ' ' THR . . . . . . . . . . . . . 98.2 m -120.71 118.19 29.44 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 107.578 -1.267 . . . . 35.43 107.578 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 55' ' ' VAL . . . . . . . . . . . . . 92.9 t -129.45 122.09 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.614 -0.513 . . . . 36.61 109.614 -173.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.81 132.62 38.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 111.701 0.26 . . . . 38.73 111.701 -177.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.1 124.18 36.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.428 -0.582 . . . . 42.66 109.428 175.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.1 37.38 28.55 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 123.874 0.87 . . . . 42.43 113.087 -178.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.8 152.28 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.469 1.108 . . . . 42.68 109.76 -172.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.16 -64.65 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 118.123 -1.431 . . . . 43.74 114.132 -177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.07 109.02 13.55 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.202 -0.936 . . . . 42.33 109.61 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.06 126.14 42.53 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.316 -0.624 . . . . 36.49 109.316 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.59 124.49 57.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 N-CA-C 109.421 -0.585 . . . . 33.16 109.421 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.24 118.19 34.6 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.151 -1.055 . . . . 30.88 108.151 163.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 65' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -131.73 122.89 26.61 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.744 -0.465 . . . . 28.22 109.744 -168.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.74 119.62 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 108.533 -0.914 . . . . 27.29 108.533 -175.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 67' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' F' ' 201' ' ' HOH . . . -70.76 -37.42 66.61 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.349 -0.929 . . . . 26.78 114.123 -177.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.91 -135.97 7.5 Favored Glycine 0 N--CA 1.45 -0.423 0 O-C-N 121.93 -0.747 . . . . 27.35 114.686 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.57 162.06 13.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 117.694 0.747 . . . . 28.65 110.717 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 70' ' ' VAL . . . . . . . . . . . . . 51.4 t -116.43 114.08 44.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.455 -1.683 . . . . 29.1 106.455 175.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 71' ' ' VAL . . . . . 0.492 HG21 ' HB2' ' F' ' 78' ' ' ALA . 19.0 t -125.68 122.39 62.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 108.177 -1.046 . . . . 29.41 108.177 -173.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.16 127.46 35.96 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 122.272 0.229 . . . . 29.84 110.525 -175.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 73' ' ' GLY . . . . . 0.571 ' HA3' ' O ' ' C' ' 73' ' ' GLY . . . 173.4 176.44 41.9 Favored Glycine 0 CA--C 1.499 -0.95 0 C-N-CA 119.136 -1.507 . . . . 30.33 111.036 165.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 74' ' ' VAL . . . . . 0.45 HG11 HG21 ' F' ' 44' ' ' THR . 2.8 t -68.04 124.27 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.265 -1.754 . . . . 32.13 106.265 159.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 75' ' ' THR . . . . . . . . . . . . . 24.0 m 60.4 81.33 0.18 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.263 -0.575 . . . . 33.05 111.831 -169.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.15 128.76 56.52 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.36 0.664 . . . . 31.72 111.048 176.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.48 128.77 55.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 C-N-CA 122.874 0.47 . . . . 31.36 109.856 -176.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 78' ' ' ALA . . . . . 0.492 ' HB2' HG21 ' F' ' 71' ' ' VAL . . . -127.5 130.08 48.54 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 122.384 0.274 . . . . 31.08 110.287 172.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.31 132.33 37.57 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 122.26 0.224 . . . . 33.03 110.925 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.83 137.15 41.24 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 111.684 0.253 . . . . 33.64 111.684 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.4 129.03 44.2 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 123.541 0.736 . . . . 37.23 110.678 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.18 116.79 51.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.018 -0.734 . . . . 39.19 109.018 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.73 108.8 16.82 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 118.299 -0.858 . . . . 44.56 110.043 -178.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.91 154.18 7.52 Favored Glycine 0 N--CA 1.446 -0.638 0 O-C-N 124.77 1.294 . . . . 43.14 113.225 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.98 152.09 29.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.592 0.696 . . . . 41.86 110.34 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.48 47.52 89.4 Favored Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 116.398 1.319 . . . . 39.23 116.398 176.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 87' ' ' SER . . . . . . . . . . . . . 43.1 t -89.02 143.89 26.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 117.548 0.674 . . . . 38.46 110.283 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.54 120.72 59.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 108.628 -0.879 . . . . 36.58 108.628 -176.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.52 115.91 26.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.137 -1.06 . . . . 34.07 108.137 169.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.55 127.15 34.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.505 -0.183 . . . . 33.16 110.505 -174.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.56 127.35 42.16 Favored 'General case' 0 CA--C 1.518 -0.277 0 C-N-CA 122.869 0.467 . . . . 30.92 109.775 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.81 130.54 34.15 Favored 'General case' 0 CA--C 1.517 -0.309 0 O-C-N 123.085 0.24 . . . . 31.4 110.621 -175.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.22 -72.14 0.61 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.721 -1.228 . . . . 32.81 113.336 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.88 157.23 42.97 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.808 -0.757 . . . . 36.13 109.657 174.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.1 125.4 67.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 CA-C-N 115.249 -0.887 . . . . 38.53 108.638 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.2 119.47 35.29 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.581 -0.896 . . . . 41.79 108.581 174.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.15 123.23 28.09 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 109.778 -0.453 . . . . 49.58 109.778 -174.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.517 0 O-C-N 123.201 0.313 . . . . 56.02 110.789 171.002 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.751 0 N-CA-C 112.247 -0.341 . . . . 40.39 112.247 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.11 125.01 65.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 108.517 -0.92 . . . . 39.01 108.517 -177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.13 115.81 28.86 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.745 -1.206 . . . . 35.45 107.745 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.32 119.18 27.66 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.391 -0.596 . . . . 35.94 109.391 -173.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.19 118.39 53.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.435 -0.95 . . . . 34.76 108.435 -178.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.11 127.49 5.92 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.685 -0.769 . . . . 36.61 113.087 176.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 42' ' ' SER . . . . . . . . . . . . . 4.4 t -139.65 128.57 23.5 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.007 0.903 . . . . 37.27 111.386 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.08 42.54 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 123.694 0.798 . . . . 39.17 109.141 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 44' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' G' ' 44' ' ' THR . 7.3 t -141.57 138.21 32.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 36.8 111.316 178.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -76.44 -61.07 2.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.644 -0.707 . . . . 37.39 110.889 175.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.53 126.5 35.04 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.618 -0.676 . . . . 37.06 111.463 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.62 135.01 8.05 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 115.623 1.009 . . . . 32.87 115.623 172.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.75 121.52 63.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 108.426 -0.953 . . . . 30.14 108.426 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 49' ' ' VAL . . . . . . . . . . . . . 58.7 t -133.77 127.35 52.39 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 122.194 0.198 . . . . 28.72 110.728 -169.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.51 119.44 36.2 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 123.913 0.885 . . . . 30.14 109.822 171.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.14 -74.83 0.95 Allowed Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 119.115 2.406 . . . . 29.64 119.115 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 52' ' ' VAL . . . . . . . . . . . . . 54.8 t -138.55 124.81 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 118.076 0.938 . . . . 30.96 108.698 -171.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.72 129.15 43.82 Favored 'General case' 0 CA--C 1.518 -0.258 0 C-N-CA 122.23 0.212 . . . . 33.52 111.111 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.73 118.21 29.46 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.59 -1.263 . . . . 35.43 107.59 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.4 122.13 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 109.613 -0.514 . . . . 36.61 109.613 -173.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.88 132.6 38.73 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 111.729 0.27 . . . . 38.73 111.729 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 57' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -128.07 124.16 36.35 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.421 -0.585 . . . . 42.66 109.421 175.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.09 37.45 28.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.898 0.879 . . . . 42.43 113.018 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 59' ' ' THR . . . . . . . . . . . . . 53.1 m -111.82 152.25 28.11 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 124.47 1.108 . . . . 42.68 109.748 -172.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 60' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -96.15 -64.62 1.03 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 118.135 -1.426 . . . . 43.74 114.199 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.06 109.04 13.57 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.185 -0.947 . . . . 42.33 109.614 -177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.09 126.25 42.66 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.28 -0.637 . . . . 36.49 109.28 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.65 124.49 56.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 109.401 -0.592 . . . . 33.16 109.401 -173.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.25 118.14 34.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.109 -1.071 . . . . 30.88 108.109 163.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 65' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -131.65 122.93 26.79 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.756 -0.461 . . . . 28.22 109.756 -168.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 66' ' ' VAL . . . . . . . . . . . . . 27.2 t -122.8 119.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.555 -0.905 . . . . 27.29 108.555 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 67' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' J' ' 201' ' ' HOH . . . -70.68 -37.52 67.31 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.4 -0.905 . . . . 26.78 114.128 -177.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.89 -135.93 7.47 Favored Glycine 0 N--CA 1.45 -0.428 0 O-C-N 121.898 -0.766 . . . . 27.35 114.745 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.56 162.14 13.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.736 0.768 . . . . 28.65 110.705 179.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 70' ' ' VAL . . . . . . . . . . . . . 50.9 t -116.51 114.09 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 106.376 -1.713 . . . . 29.1 106.376 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 71' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' J' ' 78' ' ' ALA . 18.9 t -125.68 122.44 62.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.198 -1.038 . . . . 29.41 108.198 -173.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.16 127.44 35.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.733 -0.212 . . . . 29.84 110.485 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 73' ' ' GLY . . . . . 0.572 ' O ' ' HA3' ' G' ' 73' ' ' GLY . . . 173.39 176.45 41.9 Favored Glycine 0 CA--C 1.5 -0.885 0 C-N-CA 119.076 -1.535 . . . . 30.33 110.971 165.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' J' ' 44' ' ' THR . 2.8 t -68.08 124.26 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 106.236 -1.765 . . . . 32.13 106.236 159.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.48 81.33 0.18 Allowed 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 120.256 -0.578 . . . . 33.05 111.823 -169.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.2 128.74 56.51 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.37 0.668 . . . . 31.72 111.024 176.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 77' ' ' VAL . . . . . . . . . . . . . 50.2 t -133.47 128.77 55.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 C-N-CA 122.833 0.453 . . . . 31.36 109.909 -176.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 78' ' ' ALA . . . . . 0.49 ' HB2' HG21 ' J' ' 71' ' ' VAL . . . -127.44 130.13 48.74 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 110.287 -0.264 . . . . 31.08 110.287 172.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 79' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -135.32 132.35 37.56 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 122.282 0.233 . . . . 33.03 110.864 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.82 137.23 41.32 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 111.613 0.227 . . . . 33.64 111.613 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 81' ' ' THR . . . . . . . . . . . . . 98.4 m -129.51 128.96 43.9 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.549 0.739 . . . . 37.23 110.655 178.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.11 116.73 51.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.061 -0.718 . . . . 39.19 109.061 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.7 108.81 16.84 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 118.319 -0.848 . . . . 44.56 110.021 -178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.89 154.16 7.51 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 124.758 1.286 . . . . 43.14 113.221 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.91 152.06 29.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 117.54 0.67 . . . . 41.86 110.372 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.58 47.37 90.42 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 116.414 1.326 . . . . 39.23 116.414 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.96 143.95 26.51 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 117.51 0.655 . . . . 38.46 110.266 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.54 120.72 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.6 -0.889 . . . . 36.58 108.6 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.51 115.94 26.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.11 -1.07 . . . . 34.07 108.11 169.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.56 127.1 34.34 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.526 -0.176 . . . . 33.16 110.526 -174.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.55 127.43 42.34 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 30.92 109.756 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.94 130.5 33.82 Favored 'General case' 0 CA--C 1.517 -0.317 0 O-C-N 123.133 0.271 . . . . 31.4 110.597 -175.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.13 -72.15 0.61 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.713 -1.232 . . . . 32.81 113.388 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 94' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -149.86 157.18 42.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 119.867 -0.733 . . . . 36.13 109.681 174.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.01 125.42 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 N-CA-C 108.644 -0.873 . . . . 38.53 108.644 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.22 119.44 35.19 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.543 -0.91 . . . . 41.79 108.543 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.1 123.31 28.34 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.727 -0.471 . . . . 49.58 109.727 -174.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.526 0 CA-C-O 120.731 0.3 . . . . 56.02 110.795 170.994 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.701 0 N-CA-C 112.224 -0.351 . . . . 40.39 112.224 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.12 124.92 65.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 108.529 -0.915 . . . . 39.01 108.529 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' LEU . . . . . 0.428 HD13 HD23 ' E' ' 38' ' ' LEU . 16.0 tp -113.07 115.75 28.81 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.809 -1.182 . . . . 35.45 107.809 171.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.29 119.21 27.78 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.454 -0.572 . . . . 35.94 109.454 -173.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' VAL . . . . . . . . . . . . . 37.7 t -124.28 118.35 53.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.415 -0.957 . . . . 34.76 108.415 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.14 127.47 5.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.666 -0.778 . . . . 36.61 113.065 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.63 128.58 23.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.937 0.868 . . . . 37.27 111.404 -167.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.7 122.12 42.67 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.734 0.813 . . . . 39.17 109.102 172.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' THR . . . . . 0.579 ' HA ' ' O ' ' E' ' 44' ' ' THR . 7.2 t -141.57 138.2 32.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.05 0.453 . . . . 36.8 111.315 178.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.05 2.09 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.679 -0.691 . . . . 37.39 110.933 175.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.55 126.52 35.08 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.613 -0.679 . . . . 37.06 111.426 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.59 135.0 8.04 Favored Glycine 0 C--N 1.333 0.403 0 N-CA-C 115.714 1.045 . . . . 32.87 115.714 172.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.76 121.48 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.429 -0.952 . . . . 30.14 108.429 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -133.75 127.37 52.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 122.195 0.198 . . . . 28.72 110.702 -169.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -115.53 119.5 36.37 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.949 0.9 . . . . 30.14 109.84 171.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.17 -74.79 0.96 Allowed Glycine 0 C--N 1.331 0.291 0 N-CA-C 119.094 2.397 . . . . 29.64 119.094 -175.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -138.54 124.78 25.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 118.079 0.94 . . . . 30.96 108.745 -171.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.7 129.14 43.83 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 122.227 0.211 . . . . 33.52 111.078 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.74 118.22 29.5 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 107.603 -1.258 . . . . 35.43 107.603 176.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 93.0 t -129.45 122.1 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 109.573 -0.529 . . . . 36.61 109.573 -173.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.85 132.64 38.83 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 111.697 0.258 . . . . 38.73 111.697 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.14 124.19 36.29 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.38 -0.6 . . . . 42.66 109.38 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.06 37.43 28.66 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 123.912 0.885 . . . . 42.43 113.063 -178.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' THR . . . . . . . . . . . . . 52.9 m -111.82 152.27 28.1 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 124.472 1.109 . . . . 42.68 109.759 -172.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.16 -64.63 1.03 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 118.154 -1.418 . . . . 43.74 114.182 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.05 109.06 13.61 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.229 -0.92 . . . . 42.33 109.599 -177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.11 126.19 42.53 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.244 -0.65 . . . . 36.49 109.244 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.67 124.48 56.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 109.464 -0.569 . . . . 33.16 109.464 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.22 118.11 34.4 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.116 -1.068 . . . . 30.88 108.116 163.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.66 122.91 26.76 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.766 -0.457 . . . . 28.22 109.766 -168.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.77 119.61 58.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 108.588 -0.893 . . . . 27.29 108.588 -175.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' GLY . . . . . 0.447 ' O ' ' O ' ' D' ' 201' ' ' HOH . . . -70.78 -37.4 66.39 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.368 -0.92 . . . . 26.78 114.087 -177.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.91 -135.89 7.47 Favored Glycine 0 C--O 1.225 -0.442 0 O-C-N 121.958 -0.731 . . . . 27.35 114.726 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.59 162.08 13.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.684 0.742 . . . . 28.65 110.73 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' VAL . . . . . . . . . . . . . 51.3 t -116.41 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 106.415 -1.698 . . . . 29.1 106.415 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' D' ' 78' ' ' ALA . 19.0 t -125.69 122.43 62.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 108.189 -1.041 . . . . 29.41 108.189 -173.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.14 127.38 35.83 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.298 0.239 . . . . 29.84 110.528 -175.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' GLY . . . . . 0.621 ' O ' ' HA3' ' E' ' 73' ' ' GLY . . . 173.41 176.46 41.92 Favored Glycine 0 CA--C 1.499 -0.937 0 C-N-CA 119.134 -1.508 . . . . 30.33 111.008 165.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' VAL . . . . . 0.453 HG11 HG21 ' D' ' 44' ' ' THR . 2.8 t -68.01 124.2 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 106.252 -1.759 . . . . 32.13 106.252 159.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.58 81.2 0.19 Allowed 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.185 -0.606 . . . . 33.05 111.827 -169.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.14 128.75 56.52 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.401 0.68 . . . . 31.72 111.045 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' VAL . . . . . . . . . . . . . 50.0 t -133.45 128.74 55.36 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.168 0 C-N-CA 122.925 0.49 . . . . 31.36 109.908 -176.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' ALA . . . . . 0.478 ' HB2' HG21 ' D' ' 71' ' ' VAL . . . -127.49 130.19 48.76 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 110.237 -0.283 . . . . 31.08 110.237 172.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.37 132.37 37.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.726 -0.215 . . . . 33.03 110.839 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -135.8 137.2 41.35 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 111.678 0.251 . . . . 33.64 111.678 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 98.4 m -129.44 129.03 44.13 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 123.502 0.721 . . . . 37.23 110.68 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.17 116.74 51.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 108.989 -0.745 . . . . 39.19 108.989 176.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -115.72 108.83 16.87 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 118.276 -0.868 . . . . 44.56 110.03 -178.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.87 154.2 7.52 Favored Glycine 0 N--CA 1.447 -0.629 0 O-C-N 124.781 1.301 . . . . 43.14 113.247 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.01 152.03 29.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 117.583 0.691 . . . . 41.86 110.315 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.59 47.46 89.96 Favored Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 116.387 1.315 . . . . 39.23 116.387 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.06 143.94 26.5 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 117.503 0.652 . . . . 38.46 110.251 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' ILE . . . . . . . . . . . . . 63.1 mt -124.54 120.73 59.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.571 -0.9 . . . . 36.58 108.571 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.52 115.93 26.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.161 -1.052 . . . . 34.07 108.161 169.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.53 127.19 34.6 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 110.526 -0.175 . . . . 33.16 110.526 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.59 127.45 42.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.748 -0.464 . . . . 30.92 109.748 179.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.93 130.5 33.82 Favored 'General case' 0 CA--C 1.517 -0.312 0 O-C-N 123.069 0.23 . . . . 31.4 110.631 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.19 -72.19 0.6 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.75 -1.214 . . . . 32.81 113.331 175.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' PHE . . . . . . . . . . . . . 23.0 p90 -149.85 157.16 42.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.822 -0.751 . . . . 36.13 109.694 174.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -125.98 125.39 67.99 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-N 115.3 -0.864 . . . . 38.53 108.68 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -117.17 119.4 35.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.572 -0.899 . . . . 41.79 108.572 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.08 123.27 28.29 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.795 -0.446 . . . . 49.58 109.795 -174.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.541 0 O-C-N 123.185 0.303 . . . . 56.02 110.835 170.998 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.72 0 N-CA-C 112.253 -0.339 . . . . 40.39 112.253 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.1 124.93 65.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.523 -0.917 . . . . 39.01 108.523 -177.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' LEU . . . . . . . . . . . . . 16.0 tp -113.06 115.79 28.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.84 -1.17 . . . . 35.45 107.84 171.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -125.3 119.18 27.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.469 -0.567 . . . . 35.94 109.469 -173.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' VAL . . . . . . . . . . . . . 36.7 t -124.25 118.29 53.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.432 -0.951 . . . . 34.76 108.432 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.06 127.47 5.93 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.683 -0.77 . . . . 36.61 113.079 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.62 128.62 23.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.986 0.893 . . . . 37.27 111.423 -167.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.73 122.08 42.54 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.705 0.802 . . . . 39.17 109.103 172.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 44' ' ' THR . 7.2 t -141.54 138.17 32.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.979 0.418 . . . . 36.8 111.361 178.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' LYS . . . . . . . . . . . . . 24.8 tttt -76.42 -61.08 2.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.688 -0.687 . . . . 37.39 110.936 175.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.52 126.56 35.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.535 -0.728 . . . . 37.06 111.427 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.6 135.02 8.05 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 115.661 1.024 . . . . 32.87 115.661 172.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.81 121.48 63.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 108.404 -0.962 . . . . 30.14 108.404 177.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' VAL . . . . . . . . . . . . . 57.9 t -133.7 127.41 52.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 C-N-CA 122.146 0.178 . . . . 28.72 110.678 -169.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -115.62 119.44 36.13 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.942 0.897 . . . . 30.14 109.825 171.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.15 -74.79 0.96 Allowed Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 119.121 2.408 . . . . 29.64 119.121 -175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.54 124.81 25.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 118.115 0.957 . . . . 30.96 108.727 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.75 129.16 43.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 122.21 0.204 . . . . 33.52 111.061 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 98.4 m -120.77 118.15 29.28 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.591 -1.262 . . . . 35.43 107.591 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' VAL . . . . . . . . . . . . . 93.1 t -129.39 122.15 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.573 -0.529 . . . . 36.61 109.573 -173.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.82 132.59 38.82 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 111.715 0.265 . . . . 38.73 111.715 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.1 124.13 36.22 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.434 -0.58 . . . . 42.66 109.434 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.16 37.4 28.44 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.924 0.889 . . . . 42.43 113.013 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' THR . . . . . 0.431 ' O ' HG23 ' I' ' 59' ' ' THR . 53.1 m -111.82 152.26 28.1 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.479 1.112 . . . . 42.68 109.741 -172.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.14 -64.64 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 118.107 -1.437 . . . . 43.74 114.164 -177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.09 109.0 13.5 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 121.184 -0.947 . . . . 42.33 109.637 -177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.07 126.14 42.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.282 -0.636 . . . . 36.49 109.282 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' VAL . . . . . . . . . . . . . 17.6 t -130.63 124.48 57.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.428 -0.582 . . . . 33.16 109.428 -173.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.23 118.2 34.65 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.095 -1.076 . . . . 30.88 108.095 163.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.75 122.9 26.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.785 -0.45 . . . . 28.22 109.785 -168.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 26.6 t -122.76 119.6 58.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 108.598 -0.89 . . . . 27.29 108.598 -175.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' GLY . . . . . 0.431 ' O ' ' O ' ' H' ' 201' ' ' HOH . . . -70.76 -37.4 66.54 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.363 -0.923 . . . . 26.78 114.118 -177.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.95 -135.94 7.51 Favored Glycine 0 C--O 1.226 -0.385 0 O-C-N 121.917 -0.755 . . . . 27.35 114.685 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.55 162.08 13.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.682 0.741 . . . . 28.65 110.706 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' VAL . . . . . . . . . . . . . 51.1 t -116.47 114.06 44.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 106.424 -1.695 . . . . 29.1 106.424 175.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' VAL . . . . . 0.474 HG21 ' HB2' ' H' ' 78' ' ' ALA . 19.0 t -125.66 122.44 62.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.186 -1.042 . . . . 29.41 108.186 -173.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.14 127.43 35.94 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 122.273 0.229 . . . . 29.84 110.545 -175.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' GLY . . . . . 0.596 ' O ' ' HA3' ' A' ' 73' ' ' GLY . . . 173.39 176.43 41.88 Favored Glycine 0 CA--C 1.5 -0.897 0 C-N-CA 119.108 -1.52 . . . . 30.33 110.979 165.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' VAL . . . . . 0.451 HG11 HG21 ' H' ' 44' ' ' THR . 2.8 t -68.03 124.27 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 106.237 -1.764 . . . . 32.13 106.237 159.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' THR . . . . . . . . . . . . . 24.1 m 60.51 81.28 0.19 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.248 -0.581 . . . . 33.05 111.823 -169.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.2 128.81 56.54 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 123.329 0.652 . . . . 31.72 111.054 176.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' VAL . . . . . . . . . . . . . 50.4 t -133.49 128.77 55.26 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 C-N-CA 122.871 0.468 . . . . 31.36 109.889 -176.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ALA . . . . . 0.474 ' HB2' HG21 ' H' ' 71' ' ' VAL . . . -127.5 130.15 48.68 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 110.276 -0.268 . . . . 31.08 110.276 172.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.32 132.35 37.57 Favored 'General case' 0 CA--C 1.518 -0.254 0 O-C-N 123.058 0.223 . . . . 33.03 110.906 -179.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.75 137.18 41.41 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 111.73 0.27 . . . . 33.64 111.73 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -129.52 128.96 43.88 Favored 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 123.566 0.746 . . . . 37.23 110.703 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' VAL . . . . . . . . . . . . . 21.8 t -120.13 116.8 51.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.996 -0.742 . . . . 39.19 108.996 176.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.73 108.85 16.89 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 118.298 -0.858 . . . . 44.56 110.014 -178.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.84 154.15 7.5 Favored Glycine 0 N--CA 1.447 -0.625 0 O-C-N 124.702 1.251 . . . . 43.14 113.254 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.99 152.11 29.65 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 117.542 0.671 . . . . 41.86 110.339 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.54 47.44 89.97 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 116.437 1.335 . . . . 39.23 116.437 176.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -89.03 143.85 26.56 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 117.493 0.646 . . . . 38.46 110.273 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.47 120.74 59.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 108.618 -0.882 . . . . 36.58 108.618 -176.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.53 116.0 26.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.102 -1.073 . . . . 34.07 108.102 169.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.63 127.16 34.33 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.464 -0.199 . . . . 33.16 110.464 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.58 127.46 42.34 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.74 -0.467 . . . . 30.92 109.74 179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -135.95 130.54 33.86 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 123.144 0.278 . . . . 31.4 110.601 -175.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' GLY . . . . . 0.427 ' O ' ' HA3' ' I' ' 93' ' ' GLY . . . -55.18 -72.17 0.6 Allowed Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 119.732 -1.223 . . . . 32.81 113.351 175.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -149.87 157.17 42.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.844 -0.742 . . . . 36.13 109.707 174.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' VAL . . . . . . . . . . . . . 14.7 t -126.03 125.36 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.295 -0.866 . . . . 38.53 108.676 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.2 119.4 35.08 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.57 -0.9 . . . . 41.79 108.57 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' LYS . . . . . . . . . . . . . 72.3 mttt -131.1 123.2 28.11 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.804 -0.443 . . . . 49.58 109.804 -174.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 116.571 -0.286 . . . . 56.02 110.825 171.016 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.69 0 N-CA-C 112.273 -0.331 . . . . 40.39 112.273 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.12 124.99 65.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 108.506 -0.924 . . . . 39.01 108.506 -177.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 15.9 tp -113.08 115.78 28.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.776 -1.194 . . . . 35.45 107.776 171.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -125.32 119.22 27.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.414 -0.587 . . . . 35.94 109.414 -173.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 37.1 t -124.22 118.35 53.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.459 -0.941 . . . . 34.76 108.459 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.1 127.5 5.93 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.729 -0.748 . . . . 36.61 113.089 176.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' SER . . . . . . . . . . . . . 4.3 t -139.66 128.59 23.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 117.974 0.887 . . . . 37.27 111.363 -167.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -117.79 122.11 42.55 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.699 0.8 . . . . 39.17 109.106 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' THR . . . . . 0.551 ' O ' ' HA ' ' G' ' 44' ' ' THR . 7.2 t -141.55 138.2 32.52 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.994 0.425 . . . . 36.8 111.374 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -76.44 -61.12 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.708 -0.678 . . . . 37.39 110.866 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -131.47 126.58 35.37 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.608 -0.683 . . . . 37.06 111.438 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.69 135.01 8.04 Favored Glycine 0 C--N 1.333 0.384 0 N-CA-C 115.645 1.018 . . . . 32.87 115.645 172.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.77 121.52 63.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 108.42 -0.955 . . . . 30.14 108.42 177.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 58.5 t -133.76 127.36 52.44 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 C-N-CA 122.169 0.188 . . . . 28.72 110.689 -169.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -115.51 119.54 36.52 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 123.887 0.875 . . . . 30.14 109.825 171.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -77.2 -74.83 0.96 Allowed Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 119.101 2.4 . . . . 29.64 119.101 -175.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 54.6 t -138.5 124.79 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 118.052 0.926 . . . . 30.96 108.78 -171.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -129.71 129.15 43.84 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.253 0.221 . . . . 33.52 111.079 179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 98.3 m -120.77 118.26 29.58 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.587 -1.264 . . . . 35.43 107.587 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 93.0 t -129.44 122.1 54.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 109.633 -0.506 . . . . 36.61 109.633 -173.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.83 132.6 38.82 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 111.717 0.266 . . . . 38.73 111.717 -177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.12 124.19 36.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.412 -0.588 . . . . 42.66 109.412 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 57.07 37.42 28.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 123.881 0.872 . . . . 42.43 113.051 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' THR . . . . . . . . . . . . . 52.8 m -111.76 152.26 28.02 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.509 1.123 . . . . 42.68 109.786 -172.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -96.14 -64.69 1.03 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 118.149 -1.42 . . . . 43.74 114.189 -177.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -123.03 109.11 13.68 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 121.185 -0.947 . . . . 42.33 109.63 -177.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -127.14 126.15 42.41 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.275 -0.639 . . . . 36.49 109.275 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 t -130.6 124.53 57.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 N-CA-C 109.404 -0.591 . . . . 33.16 109.404 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' THR . . . . . . . . . . . . . 3.5 m -112.25 118.2 34.64 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.093 -1.077 . . . . 30.88 108.093 163.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -131.68 122.92 26.74 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.754 -0.461 . . . . 28.22 109.754 -168.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 26.9 t -122.77 119.68 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.327 0 N-CA-C 108.58 -0.896 . . . . 27.29 108.58 -175.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . 0.437 ' O ' ' O ' ' B' ' 201' ' ' HOH . . . -70.82 -37.36 66.02 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.334 -0.936 . . . . 26.78 114.112 -177.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -92.9 -135.94 7.49 Favored Glycine 0 C--O 1.225 -0.444 0 O-C-N 121.9 -0.765 . . . . 27.35 114.727 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -104.63 162.08 13.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 117.683 0.742 . . . . 28.65 110.71 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 50.9 t -116.48 114.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 106.37 -1.715 . . . . 29.1 106.37 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' B' ' 78' ' ' ALA . 19.1 t -125.73 122.41 62.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 108.17 -1.048 . . . . 29.41 108.17 -173.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -132.13 127.46 36.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.712 -0.222 . . . . 29.84 110.505 -175.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . 0.596 ' HA3' ' O ' ' G' ' 73' ' ' GLY . . . 173.38 176.42 41.87 Favored Glycine 0 CA--C 1.499 -0.91 0 C-N-CA 119.142 -1.504 . . . . 30.33 110.975 165.417 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.449 HG11 HG21 ' B' ' 44' ' ' THR . 2.8 t -68.05 124.24 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.25 -1.759 . . . . 32.13 106.25 159.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.9 m 60.47 81.29 0.19 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.249 -0.58 . . . . 33.05 111.832 -169.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.14 128.73 56.51 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 123.41 0.684 . . . . 31.72 111.045 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 49.8 t -133.45 128.74 55.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 122.88 0.472 . . . . 31.36 109.926 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.488 ' HB2' HG21 ' B' ' 71' ' ' VAL . . . -127.49 130.11 48.62 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 110.266 -0.272 . . . . 31.08 110.266 172.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -135.27 132.34 37.67 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 122.296 0.238 . . . . 33.03 110.919 -179.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -135.77 137.2 41.4 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 111.704 0.261 . . . . 33.64 111.704 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -129.52 128.92 43.8 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 123.535 0.734 . . . . 37.23 110.686 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 21.7 t -120.13 116.72 51.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.05 -0.722 . . . . 39.19 109.05 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -115.66 108.79 16.84 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 118.273 -0.87 . . . . 44.56 110.074 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.92 154.19 7.53 Favored Glycine 0 N--CA 1.447 -0.632 0 O-C-N 124.758 1.287 . . . . 43.14 113.252 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.02 152.07 29.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 117.557 0.678 . . . . 41.86 110.301 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . 58.57 47.42 90.11 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 116.41 1.324 . . . . 39.23 116.41 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 43.0 t -88.99 143.89 26.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.53 0.665 . . . . 38.46 110.289 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.52 120.79 59.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.59 -0.892 . . . . 36.58 108.59 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -116.58 115.98 26.74 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.125 -1.065 . . . . 34.07 108.125 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -132.62 127.17 34.38 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.453 -0.203 . . . . 33.16 110.453 -174.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -128.57 127.42 42.28 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 122.817 0.447 . . . . 30.92 109.796 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -135.92 130.52 33.9 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.094 0.247 . . . . 31.4 110.634 -175.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.12 -72.15 0.6 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.719 -1.229 . . . . 32.81 113.405 175.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -149.89 157.18 42.92 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.85 -0.74 . . . . 36.13 109.681 174.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 14.8 t -126.04 125.39 67.9 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 CA-C-N 115.25 -0.886 . . . . 38.53 108.635 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -117.18 119.39 35.06 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.572 -0.899 . . . . 41.79 108.572 174.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -131.1 123.28 28.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.798 -0.445 . . . . 49.58 109.798 -174.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.554 -0.293 . . . . 56.02 110.794 171.055 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.429 ' O ' ' O ' ' A' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . 0.436 ' O ' ' O ' ' C' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' HOH . . . . . 0.446 ' O ' ' O ' ' E' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 201' ' ' HOH . . . . . 0.448 ' O ' ' O ' ' G' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 201' ' ' HOH . . . . . 0.454 ' O ' ' O ' ' I' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 201' ' ' HOH . . . . . 0.434 ' O ' ' O ' ' F' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 201' ' ' HOH . . . . . 0.455 ' O ' ' O ' ' J' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . 0.447 ' O ' ' O ' ' D' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' HOH . . . . . 0.431 ' O ' ' O ' ' H' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . 0.437 ' O ' ' O ' ' B' ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_