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 bmr30397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.45 _LACS_plot.Line_1_terminator_val_y_1 -1.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.57 _LACS_plot.Line_2_terminator_val_x_2 7.19 _LACS_plot.Line_2_terminator_val_y_2 5.65 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 LEU 5.87 2.51 0 91 MET 4.08 5.28 0 37 LEU 6.76 3.27 0 11 PHE -0.13 0.17 1 12 ARG 0.06 0.23 1 13 ILE 0.45 0.23 1 14 VAL 0.80 0.37 1 15 ASN 0.31 0.28 1 16 MET 0.68 0.62 1 17 LEU 0.54 0.34 1 18 LYS 0.66 0.20 1 19 ARG 0.42 0.44 1 21 VAL 0.23 -0.07 1 22 ALA -0.20 0.02 1 23 ARG 0.32 0.08 1 24 VAL -0.17 -0.22 1 25 SER -1.05 -0.43 1 27 PHE 0.24 0.26 1 30 LEU 0.26 0.80 1 31 LYS 0.77 0.86 1 32 ARG -2.45 -1.15 1 33 LEU 0.71 0.44 1 35 ALA 2.17 1.57 1 38 LEU 2.38 1.62 1 39 LEU -0.07 -0.80 1 41 HIS -2.14 -0.38 1 44 ILE -1.73 -0.95 1 45 ARG -1.01 0.44 1 46 MET 6.61 5.91 1 47 VAL -1.39 -2.43 1 48 LEU 4.98 3.28 1 49 ALA 2.31 3.26 1 50 ILE 0.80 -0.52 1 51 LEU 3.83 3.22 1 52 ALA 4.32 2.91 1 53 PHE 4.45 4.35 1 55 ARG 5.00 3.00 1 56 PHE 0.01 -1.54 1 57 THR -0.30 -0.74 1 58 ALA 2.98 0.57 1 59 ILE 0.41 -0.39 1 60 LYS 1.67 0.63 1 62 SER -2.28 -1.14 1 63 LEU 3.69 2.82 1 65 LEU 3.33 2.86 1 66 ILE 4.94 3.12 1 67 ASN 3.82 2.86 1 68 ARG -0.88 1.07 1 69 TRP 0.90 1.38 1 71 SER -0.76 0.38 1 72 VAL 0.65 -0.35 1 74 LYS 4.68 4.42 1 75 LYS 5.02 3.82 1 76 GLU 3.20 2.67 1 77 ALA 2.42 2.64 1 78 MET 5.03 4.68 1 79 GLU 3.13 2.77 1 80 ILE 5.27 4.06 1 81 ILE 5.80 3.97 1 83 LYS 7.20 6.52 1 84 PHE 7.14 5.04 1 85 LYS 5.10 4.94 1 86 LYS 4.28 2.40 1 87 ASP 4.20 3.85 1 88 LEU 3.54 2.89 1 89 ALA 3.89 2.91 1 90 ALA 3.87 2.92 1 92 LEU 4.01 2.96 1 93 ARG 4.48 3.89 1 94 ILE 4.38 3.94 1 95 ILE 3.76 1.95 1 96 ASN 2.81 3.00 1 97 ALA -0.16 0.03 1 98 ARG 1.47 1.16 1 99 LYS -0.49 -0.44 1 100 GLU -0.81 -0.22 1 101 LYS 0.25 0.19 1 102 LYS 0.38 0.23 1 103 ARG 0.37 0.28 1 104 ARG 1.16 1.62 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.45 _LACS_plot.Line_1_terminator_val_y_1 1.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.43 _LACS_plot.Line_2_terminator_val_x_2 7.19 _LACS_plot.Line_2_terminator_val_y_2 -1.54 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 LEU 5.87 -3.36 0 91 MET 4.08 1.20 0 37 LEU 6.76 -3.49 0 11 PHE -0.13 0.30 1 12 ARG 0.06 0.17 1 13 ILE 0.45 -0.22 1 14 VAL 0.80 -0.43 1 15 ASN 0.31 -0.03 1 16 MET 0.68 -0.06 1 17 LEU 0.54 -0.20 1 18 LYS 0.66 -0.46 1 19 ARG 0.42 0.02 1 21 VAL 0.23 -0.30 1 22 ALA -0.20 0.22 1 23 ARG 0.32 -0.24 1 24 VAL -0.17 -0.05 1 25 SER -1.05 0.62 1 27 PHE 0.24 0.02 1 30 LEU 0.26 0.54 1 31 LYS 0.77 0.09 1 32 ARG -2.45 1.30 1 33 LEU 0.71 -0.27 1 35 ALA 2.17 -0.60 1 38 LEU 2.38 -0.76 1 39 LEU -0.07 -0.73 1 41 HIS -2.14 1.76 1 44 ILE -1.73 0.78 1 45 ARG -1.01 1.45 1 46 MET 6.61 -0.70 1 47 VAL -1.39 -1.04 1 48 LEU 4.98 -1.70 1 49 ALA 2.31 0.95 1 50 ILE 0.80 -1.32 1 51 LEU 3.83 -0.61 1 52 ALA 4.32 -1.41 1 53 PHE 4.45 -0.10 1 55 ARG 5.00 -2.00 1 56 PHE 0.01 -1.55 1 57 THR -0.30 -0.44 1 58 ALA 2.98 -2.41 1 59 ILE 0.41 -0.80 1 60 LYS 1.67 -1.04 1 62 SER -2.28 1.14 1 63 LEU 3.69 -0.87 1 65 LEU 3.33 -0.47 1 66 ILE 4.94 -1.82 1 67 ASN 3.82 -0.96 1 68 ARG -0.88 1.95 1 69 TRP 0.90 0.48 1 71 SER -0.76 1.14 1 72 VAL 0.65 -1.00 1 74 LYS 4.68 -0.26 1 75 LYS 5.02 -1.20 1 76 GLU 3.20 -0.53 1 77 ALA 2.42 0.22 1 78 MET 5.03 -0.35 1 79 GLU 3.13 -0.36 1 80 ILE 5.27 -1.21 1 81 ILE 5.80 -1.83 1 83 LYS 7.20 -0.68 1 84 PHE 7.14 -2.10 1 85 LYS 5.10 -0.16 1 86 LYS 4.28 -1.88 1 87 ASP 4.20 -0.35 1 88 LEU 3.54 -0.65 1 89 ALA 3.89 -0.98 1 90 ALA 3.87 -0.95 1 92 LEU 4.01 -1.05 1 93 ARG 4.48 -0.59 1 94 ILE 4.38 -0.44 1 95 ILE 3.76 -1.81 1 96 ASN 2.81 0.19 1 97 ALA -0.16 0.19 1 98 ARG 1.47 -0.31 1 99 LYS -0.49 0.05 1 100 GLU -0.81 0.59 1 101 LYS 0.25 -0.06 1 102 LYS 0.38 -0.15 1 103 ARG 0.37 -0.09 1 104 ARG 1.16 0.46 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.45 _LACS_plot.Line_1_terminator_val_y_1 0.15 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 7.14 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 LEU 6.76 0.05 0 81 ILE 5.80 -0.96 0 11 PHE -0.13 0.05 1 12 ARG 0.06 -0.01 1 13 ILE 0.45 0.01 1 14 VAL 0.80 0.00 1 15 ASN 0.31 0.00 1 16 MET 0.68 -0.32 1 17 LEU 0.54 0.00 1 18 LYS 0.66 0.02 1 19 ARG 0.42 0.04 1 21 VAL 0.23 0.06 1 22 ALA -0.20 0.08 1 23 ARG 0.32 0.05 1 24 VAL -0.17 0.10 1 25 SER -1.05 0.05 1 27 PHE 0.24 0.03 1 30 LEU 0.26 0.02 1 31 LYS 0.77 0.01 1 32 ARG -2.45 -0.08 1 33 LEU 0.71 -0.25 1 35 ALA 2.17 -0.14 1 38 LEU 2.38 -0.27 1 39 LEU -0.07 0.07 1 41 HIS -2.14 0.11 1 44 ILE -1.73 -0.05 1 45 ARG -1.01 0.08 1 46 MET 6.61 -0.52 1 47 VAL -1.39 0.14 1 48 LEU 4.98 0.05 1 49 ALA 2.31 -0.19 1 50 ILE 0.80 -0.02 1 51 LEU 3.83 -0.38 1 52 ALA 4.32 -0.70 1 53 PHE 4.45 -0.22 1 54 LEU 5.87 -0.15 1 55 ARG 5.00 -0.30 1 56 PHE 0.01 0.17 1 57 THR -0.30 -0.31 1 58 ALA 2.98 -0.31 1 59 ILE 0.41 -0.03 1 60 LYS 1.67 -0.17 1 62 SER -2.28 -0.08 1 63 LEU 3.69 -0.25 1 65 LEU 3.33 -0.11 1 66 ILE 4.94 -0.34 1 67 ASN 3.82 -0.13 1 68 ARG -0.88 0.05 1 69 TRP 0.90 -0.16 1 71 SER -0.76 0.16 1 72 VAL 0.65 0.08 1 74 LYS 4.68 -0.57 1 75 LYS 5.02 -0.36 1 76 GLU 3.20 -0.31 1 77 ALA 2.42 -0.42 1 78 MET 5.03 -0.64 1 79 GLU 3.13 -0.39 1 80 ILE 5.27 -0.73 1 84 PHE 7.14 -0.56 1 85 LYS 5.10 -0.21 1 86 LYS 4.28 -0.13 1 87 ASP 4.20 -0.23 1 88 LEU 3.54 -0.10 1 89 ALA 3.89 -0.16 1 90 ALA 3.87 -0.06 1 92 LEU 4.01 0.02 1 93 ARG 4.48 -0.18 1 94 ILE 4.38 -0.34 1 95 ILE 3.76 -0.61 1 96 ASN 2.81 -0.33 1 97 ALA -0.16 0.03 1 98 ARG 1.47 0.05 1 99 LYS -0.49 0.16 1 100 GLU -0.81 0.04 1 101 LYS 0.25 0.04 1 102 LYS 0.38 0.05 1 103 ARG 0.37 0.05 1 104 ARG 1.16 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.45 _LACS_plot.Line_1_terminator_val_y_1 -0.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.73 _LACS_plot.Line_2_terminator_val_x_2 7.19 _LACS_plot.Line_2_terminator_val_y_2 2.64 _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 104 ARG 1.16 4.57 0 47 VAL -1.39 3.67 0 11 PHE -0.13 -0.30 1 12 ARG 0.06 -0.63 1 13 ILE 0.45 -0.18 1 14 VAL 0.80 -0.56 1 15 ASN 0.31 0.07 1 16 MET 0.68 -0.09 1 17 LEU 0.54 -0.25 1 18 LYS 0.66 -0.15 1 19 ARG 0.42 0.47 1 21 VAL 0.23 -0.54 1 22 ALA -0.20 -0.41 1 23 ARG 0.32 -0.22 1 24 VAL -0.17 -0.62 1 25 SER -1.05 0.40 1 27 PHE 0.24 0.57 1 30 LEU 0.26 -0.61 1 31 LYS 0.77 -0.40 1 32 ARG -2.45 -1.15 1 33 LEU 0.71 0.80 1 35 ALA 2.17 1.60 1 37 LEU 6.76 2.09 1 38 LEU 2.38 -0.19 1 39 LEU -0.07 -1.28 1 41 HIS -2.14 0.12 1 44 ILE -1.73 2.72 1 45 ARG -1.01 2.68 1 46 MET 6.61 3.35 1 48 LEU 4.98 1.00 1 49 ALA 2.31 1.85 1 50 ILE 0.80 0.64 1 51 LEU 3.83 1.28 1 52 ALA 4.32 -1.40 1 53 PHE 4.45 1.24 1 54 LEU 5.87 0.49 1 55 ARG 5.00 3.91 1 56 PHE 0.01 3.24 1 57 THR -0.30 -1.43 1 58 ALA 2.98 -2.14 1 59 ILE 0.41 -1.06 1 60 LYS 1.67 -0.06 1 62 SER -2.28 -0.30 1 63 LEU 3.69 1.78 1 65 LEU 3.33 1.02 1 66 ILE 4.94 3.16 1 67 ASN 3.82 3.70 1 68 ARG -0.88 3.15 1 69 TRP 0.90 1.42 1 71 SER -0.76 -0.07 1 72 VAL 0.65 -1.89 1 74 LYS 4.68 1.09 1 75 LYS 5.02 2.40 1 76 GLU 3.20 1.98 1 77 ALA 2.42 1.54 1 78 MET 5.03 1.62 1 79 GLU 3.13 3.04 1 80 ILE 5.27 0.47 1 81 ILE 5.80 1.75 1 83 LYS 7.20 2.62 1 84 PHE 7.14 0.27 1 85 LYS 5.10 1.16 1 86 LYS 4.28 1.21 1 87 ASP 4.20 3.46 1 88 LEU 3.54 1.77 1 89 ALA 3.89 2.99 1 90 ALA 3.87 2.66 1 91 MET 4.08 1.73 1 92 LEU 4.01 0.70 1 93 ARG 4.48 3.28 1 94 ILE 4.38 2.49 1 95 ILE 3.76 1.71 1 96 ASN 2.81 1.01 1 97 ALA -0.16 0.30 1 98 ARG 1.47 -0.03 1 99 LYS -0.49 0.12 1 100 GLU -0.81 -0.42 1 101 LYS 0.25 -0.25 1 102 LYS 0.38 -0.27 1 103 ARG 0.37 -0.94 1 stop_ save_