data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36185_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.48 _LACS_plot.Line_1_terminator_val_y_1 -6.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.46 _LACS_plot.Line_2_terminator_val_x_2 6.43 _LACS_plot.Line_2_terminator_val_y_2 1.76 _LACS_plot.Y_axis_chem_shift_offset 2.98 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 ALA -7.28 -5.29 0 48 SER 4.33 2.92 0 82 GLU -7.48 -4.91 0 11 VAL 1.87 -1.45 1 14 THR -0.09 -3.85 1 15 ALA 0.57 -3.07 1 16 THR -2.84 -4.70 1 17 LEU 4.43 0.17 1 18 GLU 5.03 0.99 1 19 GLN 4.31 0.12 1 20 LEU 2.88 -0.41 1 21 THR 1.06 -3.64 1 22 GLU 3.66 0.06 1 23 PHE 4.95 1.17 1 24 PHE 6.43 2.58 1 25 SER 3.41 -0.38 1 26 LYS 3.06 -1.73 1 27 HIS -2.41 -2.09 1 29 THR 2.94 -2.04 1 30 VAL 0.00 -2.86 1 31 GLN 0.75 -1.88 1 32 ALA -3.09 -3.44 1 33 VAL -1.64 -3.86 1 34 TRP 0.94 -0.42 1 35 ARG -0.98 -4.76 1 36 ARG -2.86 -4.19 1 37 TYR -3.67 -3.70 1 38 PHE -0.05 -2.48 1 39 ALA 0.22 -2.75 1 41 LYS -0.34 -3.56 1 42 LYS 3.01 -0.82 1 43 ASP 0.89 -3.17 1 44 ALA -0.72 -3.19 1 47 GLU 3.98 -0.59 1 49 ARG -0.13 -2.68 1 50 THR 2.06 -1.32 1 51 LYS 0.89 -1.92 1 53 SER -5.85 -6.67 1 54 VAL -6.83 -6.95 1 55 PHE 1.13 -0.10 1 56 VAL -1.25 -4.28 1 57 VAL -0.18 -4.25 1 58 PHE 1.95 0.79 1 59 ASN 0.18 -1.60 1 60 SER -4.64 -4.85 1 61 SER 4.33 -0.03 1 62 GLU 5.16 0.97 1 63 GLU 1.26 -0.88 1 64 ALA 2.82 -0.38 1 65 GLU 2.77 -0.57 1 66 ALA 3.50 -0.59 1 67 PHE 3.42 0.22 1 68 GLN 5.31 0.23 1 69 LYS 1.43 -1.58 1 70 ALA -1.18 -3.71 1 73 MET -1.38 -3.60 1 74 TYR -2.37 -4.29 1 75 ASP 4.38 -0.85 1 76 ASP 2.12 -2.14 1 77 VAL -2.06 -3.87 1 78 GLN 0.81 -2.69 1 79 LEU 0.26 -2.78 1 80 THR -1.56 -3.59 1 83 MET -1.42 -3.76 1 84 LYS 5.02 1.78 1 85 THR 6.30 1.23 1 86 THR 5.41 0.83 1 87 TYR 4.40 0.38 1 88 LEU 3.61 -0.53 1 89 GLU 3.13 -0.45 1 90 ARG 4.73 0.05 1 91 LYS 3.93 -2.42 1 92 ALA 3.17 -1.03 1 93 GLU 2.09 -1.27 1 94 GLU 1.99 -1.27 1 95 ILE 2.27 -1.37 1 96 ALA 1.20 -2.19 1 97 ALA 0.36 -2.81 1 98 LYS 0.67 -2.79 1 99 LYS 1.27 -1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36185_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.48 _LACS_plot.Line_1_terminator_val_y_1 1.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -4.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.46 _LACS_plot.Line_2_terminator_val_x_2 6.43 _LACS_plot.Line_2_terminator_val_y_2 -4.67 _LACS_plot.Y_axis_chem_shift_offset 2.98 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 ALA -7.28 1.99 0 48 SER 4.33 -1.41 0 82 GLU -7.48 2.57 0 11 VAL 1.87 -3.32 1 14 THR -0.09 -3.76 1 15 ALA 0.57 -3.64 1 16 THR -2.84 -1.86 1 17 LEU 4.43 -4.26 1 18 GLU 5.03 -4.04 1 19 GLN 4.31 -4.19 1 20 LEU 2.88 -3.29 1 21 THR 1.06 -4.70 1 22 GLU 3.66 -3.60 1 23 PHE 4.95 -3.78 1 24 PHE 6.43 -3.85 1 25 SER 3.41 -3.79 1 26 LYS 3.06 -4.79 1 27 HIS -2.41 0.32 1 29 THR 2.94 -4.98 1 30 VAL 0.00 -2.86 1 31 GLN 0.75 -2.63 1 32 ALA -3.09 -0.35 1 33 VAL -1.64 -2.22 1 34 TRP 0.94 -1.36 1 35 ARG -0.98 -3.78 1 36 ARG -2.86 -1.33 1 37 TYR -3.67 -0.03 1 38 PHE -0.05 -2.43 1 39 ALA 0.22 -2.97 1 41 LYS -0.34 -3.22 1 42 LYS 3.01 -3.83 1 43 ASP 0.89 -4.06 1 44 ALA -0.72 -2.47 1 47 GLU 3.98 -4.57 1 49 ARG -0.13 -2.55 1 50 THR 2.06 -3.38 1 51 LYS 0.89 -2.81 1 53 SER -5.85 -0.82 1 54 VAL -6.83 -0.12 1 55 PHE 1.13 -1.23 1 56 VAL -1.25 -3.03 1 57 VAL -0.18 -4.07 1 58 PHE 1.95 -1.16 1 59 ASN 0.18 -1.78 1 60 SER -4.64 -0.21 1 61 SER 4.33 -4.36 1 62 GLU 5.16 -4.19 1 63 GLU 1.26 -2.14 1 64 ALA 2.82 -3.20 1 65 GLU 2.77 -3.34 1 66 ALA 3.50 -4.09 1 67 PHE 3.42 -3.20 1 68 GLN 5.31 -5.08 1 69 LYS 1.43 -3.01 1 70 ALA -1.18 -2.53 1 73 MET -1.38 -2.22 1 74 TYR -2.37 -1.92 1 75 ASP 4.38 -5.23 1 76 ASP 2.12 -4.26 1 77 VAL -2.06 -1.81 1 78 GLN 0.81 -3.50 1 79 LEU 0.26 -3.04 1 80 THR -1.56 -2.03 1 83 MET -1.42 -2.34 1 84 LYS 5.02 -3.24 1 85 THR 6.30 -5.07 1 86 THR 5.41 -4.58 1 87 TYR 4.40 -4.02 1 88 LEU 3.61 -4.14 1 89 GLU 3.13 -3.58 1 90 ARG 4.73 -4.68 1 91 LYS 3.93 -6.35 1 92 ALA 3.17 -4.20 1 93 GLU 2.09 -3.36 1 94 GLU 1.99 -3.26 1 95 ILE 2.27 -3.64 1 96 ALA 1.20 -3.39 1 97 ALA 0.36 -3.17 1 98 LYS 0.67 -3.46 1 99 LYS 1.27 -2.73 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36185_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.48 _LACS_plot.Line_1_terminator_val_y_1 0.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.43 _LACS_plot.Line_2_terminator_val_y_2 -0.49 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 SER -5.85 -0.58 0 70 ALA -1.18 -1.10 0 55 PHE 1.13 1.11 0 11 VAL 1.87 -0.01 1 14 THR -0.09 0.11 1 15 ALA 0.57 0.19 1 16 THR -2.84 0.51 1 17 LEU 4.43 -0.34 1 18 GLU 5.03 -0.32 1 19 GLN 4.31 -0.22 1 20 LEU 2.88 -0.22 1 21 THR 1.06 -0.05 1 22 GLU 3.66 -0.36 1 23 PHE 4.95 -0.47 1 24 PHE 6.43 -0.48 1 25 SER 3.41 0.61 1 26 LYS 3.06 -0.22 1 27 HIS -2.41 -0.05 1 29 THR 2.94 0.06 1 30 VAL 0.00 -0.46 1 31 GLN 0.75 -0.12 1 32 ALA -3.09 -0.18 1 33 VAL -1.64 0.15 1 34 TRP 0.94 -0.13 1 35 ARG -0.98 -0.08 1 36 ARG -2.86 0.17 1 37 TYR -3.67 0.56 1 38 PHE -0.05 0.02 1 39 ALA 0.22 0.06 1 41 LYS -0.34 0.10 1 42 LYS 3.01 -0.32 1 43 ASP 0.89 -0.09 1 44 ALA -0.72 -0.03 1 47 GLU 3.98 -0.22 1 48 SER 4.33 0.13 1 49 ARG -0.13 0.34 1 50 THR 2.06 0.00 1 51 LYS 0.89 -0.05 1 54 VAL -6.83 0.46 1 56 VAL -1.25 -0.05 1 57 VAL -0.18 0.24 1 58 PHE 1.95 0.51 1 59 ASN 0.18 -0.14 1 60 SER -4.64 0.37 1 61 SER 4.33 -0.21 1 62 GLU 5.16 -0.47 1 63 GLU 1.26 -0.37 1 64 ALA 2.82 -0.76 1 65 GLU 2.77 0.00 1 66 ALA 3.50 -0.28 1 67 PHE 3.42 -0.66 1 68 GLN 5.31 -0.79 1 69 LYS 1.43 -0.40 1 73 MET -1.38 0.37 1 74 TYR -2.37 -0.16 1 75 ASP 4.38 -0.63 1 76 ASP 2.12 -0.24 1 77 VAL -2.06 0.06 1 78 GLN 0.81 -0.29 1 79 LEU 0.26 0.45 1 80 THR -1.56 0.23 1 81 ALA -7.28 0.12 1 82 GLU -7.48 0.44 1 83 MET -1.42 0.42 1 84 LYS 5.02 -0.29 1 85 THR 6.30 -0.27 1 86 THR 5.41 0.07 1 87 TYR 4.40 -0.49 1 88 LEU 3.61 -0.43 1 89 GLU 3.13 -0.37 1 90 ARG 4.73 -0.21 1 91 LYS 3.93 -0.44 1 92 ALA 3.17 -0.22 1 93 GLU 2.09 -0.25 1 94 GLU 1.99 -0.29 1 95 ILE 2.27 -0.20 1 96 ALA 1.20 -0.11 1 97 ALA 0.36 -0.05 1 98 LYS 0.67 -0.03 1 stop_ save_