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 bmr18489_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 -1.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.60 _LACS_plot.Line_2_terminator_val_x_2 6.49 _LACS_plot.Line_2_terminator_val_y_2 4.87 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 MET -3.53 1.00 0 66 PHE -4.98 -4.99 0 11 MET 1.56 0.19 1 12 PHE -0.81 -0.46 1 13 ILE -0.52 -0.68 1 14 GLN -2.72 -0.84 1 15 THR -3.57 -1.92 1 16 GLN -4.83 -1.10 1 17 ASP 0.36 0.39 1 18 THR 0.69 0.20 1 20 ASN -3.35 -2.01 1 22 ASN 0.98 0.39 1 23 SER -1.92 -0.46 1 24 LEU -4.95 -1.37 1 25 LYS -2.04 -0.55 1 26 PHE -1.72 -1.13 1 27 ILE -0.95 -0.41 1 30 LYS -3.17 -1.50 1 32 VAL 3.21 0.57 1 33 LEU -1.46 -0.84 1 34 GLU 4.08 4.11 1 35 THR -0.53 -0.21 1 36 ARG -1.97 -0.93 1 37 THR -4.24 -2.40 1 39 ASP -4.06 -1.15 1 40 PHE -1.55 -2.00 1 42 THR -3.46 -2.38 1 44 ALA 3.37 2.08 1 45 ALA 0.81 0.46 1 46 ALA 0.87 0.41 1 47 PHE 3.91 2.41 1 48 ARG 0.47 -0.10 1 49 SER -5.17 -3.00 1 51 LEU 5.44 1.61 1 52 ALA 5.99 3.19 1 53 ARG 4.98 3.92 1 54 GLN 3.92 2.83 1 55 LEU 3.32 2.73 1 56 PHE 4.47 3.78 1 57 ARG 2.56 1.17 1 58 ILE 1.91 0.14 1 59 GLU 2.70 1.53 1 61 VAL 4.38 2.64 1 62 LYS -1.98 0.42 1 63 SER -2.56 -0.38 1 64 VAL -5.17 -1.50 1 65 PHE -4.58 -1.28 1 69 ASP -2.29 -1.94 1 70 SER -3.77 -0.88 1 71 ILE -4.69 -0.64 1 72 THR 0.57 0.25 1 73 VAL -2.17 -0.68 1 74 THR -1.33 -0.98 1 75 LYS -4.41 -2.56 1 76 GLU 1.56 2.75 1 77 ASN -1.83 -0.81 1 78 GLU 2.05 2.01 1 79 GLU 2.06 1.14 1 80 LEU -1.10 -0.96 1 81 ASP -2.22 -0.64 1 82 TRP 2.29 3.13 1 83 ASN 4.52 3.14 1 84 LEU 1.85 0.90 1 85 LEU -1.30 1.44 1 86 LYS 3.18 2.95 1 88 ASP 5.89 4.82 1 89 ILE 3.28 2.21 1 90 TYR 3.67 2.64 1 91 ALA 6.49 4.99 1 92 THR 6.13 5.31 1 93 ILE 4.98 3.57 1 94 MET 3.87 2.85 1 95 ASP 4.48 4.30 1 96 PHE 6.41 4.68 1 97 PHE 1.89 0.96 1 98 ALA 1.70 2.13 1 99 SER 0.77 0.35 1 101 LEU 2.27 2.55 1 103 LEU -4.13 -1.93 1 104 VAL -0.40 -0.56 1 105 THR -1.08 -0.37 1 106 GLU 0.23 1.45 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18489_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 3.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.40 _LACS_plot.Line_2_terminator_val_x_2 6.49 _LACS_plot.Line_2_terminator_val_y_2 -1.62 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 MET -3.53 4.53 0 66 PHE -4.98 -0.01 0 11 MET 1.56 -1.37 1 12 PHE -0.81 0.35 1 13 ILE -0.52 -0.16 1 14 GLN -2.72 1.88 1 15 THR -3.57 1.65 1 16 GLN -4.83 3.73 1 17 ASP 0.36 0.03 1 18 THR 0.69 -0.49 1 20 ASN -3.35 1.34 1 22 ASN 0.98 -0.59 1 23 SER -1.92 1.46 1 24 LEU -4.95 3.58 1 25 LYS -2.04 1.49 1 26 PHE -1.72 0.59 1 27 ILE -0.95 0.54 1 30 LYS -3.17 1.67 1 32 VAL 3.21 -2.64 1 33 LEU -1.46 0.62 1 34 GLU 4.08 0.03 1 35 THR -0.53 0.32 1 36 ARG -1.97 1.04 1 37 THR -4.24 1.84 1 39 ASP -4.06 2.91 1 40 PHE -1.55 -0.45 1 42 THR -3.46 1.08 1 44 ALA 3.37 -1.29 1 45 ALA 0.81 -0.35 1 46 ALA 0.87 -0.46 1 47 PHE 3.91 -1.50 1 48 ARG 0.47 -0.57 1 49 SER -5.17 2.17 1 51 LEU 5.44 -3.83 1 52 ALA 5.99 -2.80 1 53 ARG 4.98 -1.06 1 54 GLN 3.92 -1.09 1 55 LEU 3.32 -0.59 1 56 PHE 4.47 -0.69 1 57 ARG 2.56 -1.39 1 58 ILE 1.91 -1.77 1 59 GLU 2.70 -1.17 1 61 VAL 4.38 -1.74 1 62 LYS -1.98 2.40 1 63 SER -2.56 2.18 1 64 VAL -5.17 3.67 1 65 PHE -4.58 3.30 1 69 ASP -2.29 0.35 1 70 SER -3.77 2.89 1 71 ILE -4.69 4.05 1 72 THR 0.57 -0.32 1 73 VAL -2.17 1.49 1 74 THR -1.33 0.35 1 75 LYS -4.41 1.85 1 76 GLU 1.56 1.19 1 77 ASN -1.83 1.02 1 78 GLU 2.05 -0.04 1 79 GLU 2.06 -0.92 1 80 LEU -1.10 0.14 1 81 ASP -2.22 1.58 1 82 TRP 2.29 0.84 1 83 ASN 4.52 -1.38 1 84 LEU 1.85 -0.95 1 85 LEU -1.30 2.74 1 86 LYS 3.18 -0.23 1 88 ASP 5.89 -1.07 1 89 ILE 3.28 -1.07 1 90 TYR 3.67 -1.03 1 91 ALA 6.49 -1.50 1 92 THR 6.13 -0.82 1 93 ILE 4.98 -1.41 1 94 MET 3.87 -1.02 1 95 ASP 4.48 -0.18 1 96 PHE 6.41 -1.73 1 97 PHE 1.89 -0.93 1 98 ALA 1.70 0.43 1 99 SER 0.77 -0.42 1 101 LEU 2.27 0.28 1 103 LEU -4.13 2.20 1 104 VAL -0.40 -0.16 1 105 THR -1.08 0.71 1 106 GLU 0.23 1.22 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18489_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 0.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 6.49 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 SER -1.92 1.70 0 11 MET 1.56 -0.23 1 12 PHE -0.81 0.02 1 13 ILE -0.52 -0.02 1 14 GLN -2.72 0.25 1 15 THR -3.57 0.87 1 16 GLN -4.83 0.14 1 17 ASP 0.36 -0.02 1 18 THR 0.69 0.33 1 20 ASN -3.35 0.13 1 22 ASN 0.98 0.14 1 24 LEU -4.95 0.12 1 25 LYS -2.04 0.53 1 26 PHE -1.72 0.21 1 27 ILE -0.95 0.24 1 30 LYS -3.17 0.04 1 32 VAL 3.21 0.10 1 33 LEU -1.46 0.29 1 34 GLU 4.08 -0.30 1 35 THR -0.53 0.04 1 36 ARG -1.97 0.40 1 37 THR -4.24 0.56 1 38 MET -3.53 -0.30 1 39 ASP -4.06 0.40 1 40 PHE -1.55 0.02 1 42 THR -3.46 0.37 1 44 ALA 3.37 -0.31 1 45 ALA 0.81 0.15 1 46 ALA 0.87 -0.26 1 47 PHE 3.91 -0.41 1 48 ARG 0.47 -0.12 1 49 SER -5.17 0.74 1 51 LEU 5.44 -0.68 1 52 ALA 5.99 -0.70 1 53 ARG 4.98 -0.54 1 54 GLN 3.92 -0.34 1 55 LEU 3.32 -0.31 1 56 PHE 4.47 -0.51 1 57 ARG 2.56 -0.13 1 58 ILE 1.91 -0.31 1 59 GLU 2.70 -0.36 1 61 VAL 4.38 -0.52 1 62 LYS -1.98 0.19 1 63 SER -2.56 0.52 1 64 VAL -5.17 0.64 1 65 PHE -4.58 0.73 1 66 PHE -4.98 0.89 1 69 ASP -2.29 0.06 1 70 SER -3.77 0.63 1 71 ILE -4.69 1.00 1 72 THR 0.57 1.24 1 73 VAL -2.17 0.60 1 74 THR -1.33 1.49 1 75 LYS -4.41 0.98 1 76 GLU 1.56 -0.57 1 77 ASN -1.83 -0.06 1 78 GLU 2.05 -0.33 1 79 GLU 2.06 -0.35 1 80 LEU -1.10 -0.13 1 81 ASP -2.22 -0.07 1 82 TRP 2.29 -0.06 1 83 ASN 4.52 -0.17 1 84 LEU 1.85 0.07 1 85 LEU -1.30 0.26 1 86 LYS 3.18 -0.02 1 88 ASP 5.89 -0.96 1 89 ILE 3.28 -0.57 1 90 TYR 3.67 -0.28 1 91 ALA 6.49 -0.37 1 92 THR 6.13 -0.65 1 93 ILE 4.98 -0.20 1 94 MET 3.87 -0.23 1 95 ASP 4.48 -0.56 1 96 PHE 6.41 -0.59 1 97 PHE 1.89 -0.07 1 98 ALA 1.70 -0.33 1 99 SER 0.77 -0.32 1 101 LEU 2.27 -0.35 1 103 LEU -4.13 0.80 1 104 VAL -0.40 0.09 1 105 THR -1.08 0.07 1 106 GLU 0.23 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18489_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 -2.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 6.49 _LACS_plot.Line_2_terminator_val_y_2 1.74 _LACS_plot.Y_axis_chem_shift_offset 0.72 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 ASP -2.22 1.93 0 96 PHE 4.48 4.77 0 12 PHE -0.81 -1.94 1 13 ILE -0.52 -1.92 1 14 GLN -2.72 -1.00 1 15 THR -3.57 -0.87 1 16 GLN -4.83 -2.53 1 17 ASP 0.36 -0.78 1 22 ASN 0.98 -1.19 1 23 SER -1.92 -2.77 1 24 LEU -4.95 -4.08 1 25 LYS -2.04 -2.51 1 26 PHE -1.72 -0.67 1 32 VAL 3.21 -2.34 1 33 LEU -1.46 -0.07 1 35 THR -0.53 -1.28 1 36 ARG -1.97 -3.90 1 37 THR -4.24 -0.53 1 38 MET -3.53 -5.12 1 39 ASP -4.06 -1.82 1 44 ALA 3.37 1.80 1 45 ALA 0.81 0.61 1 46 ALA 0.87 -1.52 1 47 PHE 3.91 -0.12 1 48 ARG 0.47 -1.40 1 51 LEU 5.44 -0.44 1 52 ALA 5.99 0.27 1 53 ARG 4.98 2.24 1 54 GLN 3.92 3.71 1 55 LEU 3.32 -0.13 1 56 PHE 4.47 0.63 1 57 ARG 2.56 -0.34 1 58 ILE 1.91 -1.61 1 59 GLU 2.70 -0.25 1 61 VAL 4.38 -1.90 1 62 LYS -1.98 -1.75 1 63 SER -2.56 -3.26 1 64 VAL -5.17 -4.73 1 65 PHE -4.58 -1.19 1 66 PHE -4.98 -2.25 1 69 ASP -2.29 -1.79 1 70 SER -3.77 -3.19 1 71 ILE -4.69 -1.03 1 72 THR 0.57 -0.30 1 73 VAL -2.17 -2.55 1 74 THR -1.33 -0.71 1 75 LYS -4.41 -0.25 1 76 GLU 1.56 -1.52 1 78 GLU 2.05 -0.19 1 79 GLU 2.06 0.25 1 80 LEU -1.10 -2.52 1 82 TRP 2.29 3.12 1 83 ASN 4.52 1.55 1 84 LEU 1.85 0.55 1 85 LEU -1.30 -0.13 1 88 ASP 3.18 2.84 1 89 ILE 5.89 0.81 1 90 TYR 3.28 1.78 1 91 ALA 3.67 1.54 1 92 THR 6.49 2.12 1 93 ILE 6.13 0.73 1 94 MET 4.98 3.15 1 95 ASP 3.87 2.60 1 97 PHE 6.41 1.26 1 98 ALA 1.89 0.92 1 99 SER 1.70 0.77 1 103 LEU 2.27 -0.57 1 104 VAL -4.13 -1.17 1 105 THR -0.40 -0.63 1 106 GLU -1.08 -1.57 1 stop_ save_