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 bmr18765_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.11 _LACS_plot.Line_1_terminator_val_y_1 -2.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.21 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 4.92 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 HIS -3.63 1.73 0 79 MET 1.99 -1.52 0 12 SER 0.33 0.26 1 13 GLN 0.34 0.09 1 14 LYS -0.63 -0.25 1 15 THR -2.95 -1.43 1 16 SER -3.63 -1.04 1 17 ASP 2.09 1.31 1 18 LEU -2.38 -1.93 1 19 ILE -4.08 -1.61 1 20 VAL -1.62 -1.74 1 21 LEU -3.33 -0.84 1 23 LEU -0.63 -0.05 1 25 TRP 2.29 1.52 1 26 LYS 1.66 0.63 1 27 THR 4.97 3.70 1 28 THR -5.24 -1.84 1 29 GLU 5.46 4.38 1 30 GLN 5.28 3.53 1 31 ASP 3.10 3.14 1 32 LEU 2.34 2.54 1 33 LYS 5.36 4.43 1 34 GLU 3.47 2.99 1 35 TYR 4.47 4.03 1 36 PHE 6.39 5.01 1 37 SER 3.81 3.12 1 38 THR 3.81 2.72 1 39 PHE 2.04 2.20 1 41 GLU 1.24 1.55 1 42 VAL -1.41 -0.34 1 43 LEU -1.12 0.78 1 44 MET -2.12 -0.40 1 45 VAL -4.26 -1.59 1 46 GLN -5.61 -0.58 1 47 VAL -0.50 0.67 1 48 LYS 0.78 -0.97 1 49 LYS -4.04 -1.69 1 50 ASP -2.03 -0.25 1 51 LEU 2.76 2.19 1 52 LYS 2.54 2.14 1 53 THR -0.85 -0.03 1 55 HIS -1.77 0.28 1 56 SER -0.26 0.19 1 57 LYS 0.16 -0.13 1 59 PHE -4.44 -2.41 1 61 PHE -7.11 -1.75 1 62 VAL -5.31 -2.97 1 63 ARG -5.09 -1.65 1 64 PHE -0.62 0.98 1 65 THR 4.85 3.61 1 66 GLU -3.48 -1.88 1 67 TYR 4.60 4.42 1 68 GLU 4.32 3.42 1 69 THR 5.73 3.78 1 70 GLN 4.29 4.08 1 71 VAL 5.41 4.14 1 72 LYS 4.25 3.31 1 73 VAL 6.21 4.50 1 74 MET 1.80 2.74 1 75 SER 0.99 1.29 1 76 GLN -6.00 -2.00 1 77 ARG -0.67 0.31 1 80 ILE -0.98 -0.69 1 81 ASP 1.59 0.89 1 83 ARG -4.89 -2.73 1 84 TRP -0.24 -0.05 1 86 ASP -4.83 -0.40 1 88 LYS -5.42 -2.05 1 89 LEU 0.24 0.05 1 91 ASN 0.04 -0.02 1 92 SER 0.89 0.63 1 93 LYS 0.86 0.50 1 94 GLN 0.52 0.36 1 95 SER 0.40 0.39 1 96 GLN 0.44 0.31 1 97 ASP -0.16 0.11 1 98 GLU -0.42 0.34 1 100 LEU 0.56 0.28 1 101 ARG -0.22 -0.18 1 102 SER 0.04 0.10 1 103 ARG 1.01 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18765_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.11 _LACS_plot.Line_1_terminator_val_y_1 4.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.79 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -1.47 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 HIS -3.63 5.36 0 79 MET 1.99 -3.51 0 12 SER 0.33 -0.07 1 13 GLN 0.34 -0.25 1 14 LYS -0.63 0.38 1 15 THR -2.95 1.52 1 16 SER -3.63 2.59 1 17 ASP 2.09 -0.78 1 18 LEU -2.38 0.45 1 19 ILE -4.08 2.47 1 20 VAL -1.62 -0.12 1 21 LEU -3.33 2.49 1 23 LEU -0.63 0.58 1 25 TRP 2.29 -0.77 1 26 LYS 1.66 -1.03 1 27 THR 4.97 -1.27 1 28 THR -5.24 3.40 1 29 GLU 5.46 -1.08 1 30 GLN 5.28 -1.75 1 31 ASP 3.10 0.04 1 32 LEU 2.34 0.20 1 33 LYS 5.36 -0.93 1 34 GLU 3.47 -0.48 1 35 TYR 4.47 -0.44 1 36 PHE 6.39 -1.38 1 37 SER 3.81 -0.69 1 38 THR 3.81 -1.09 1 39 PHE 2.04 0.16 1 41 GLU 1.24 0.31 1 42 VAL -1.41 1.07 1 43 LEU -1.12 1.90 1 44 MET -2.12 1.72 1 45 VAL -4.26 2.67 1 46 GLN -5.61 5.03 1 47 VAL -0.50 1.17 1 48 LYS 0.78 -1.75 1 49 LYS -4.04 2.35 1 50 ASP -2.03 1.78 1 51 LEU 2.76 -0.57 1 52 LYS 2.54 -0.40 1 53 THR -0.85 0.82 1 55 HIS -1.77 2.05 1 56 SER -0.26 0.45 1 57 LYS 0.16 -0.29 1 59 PHE -4.44 2.03 1 61 PHE -7.11 5.36 1 62 VAL -5.31 2.34 1 63 ARG -5.09 3.44 1 64 PHE -0.62 1.60 1 65 THR 4.85 -1.24 1 66 GLU -3.48 1.60 1 67 TYR 4.60 -0.18 1 68 GLU 4.32 -0.90 1 69 THR 5.73 -1.95 1 70 GLN 4.29 -0.21 1 71 VAL 5.41 -1.27 1 72 LYS 4.25 -0.94 1 73 VAL 6.21 -1.71 1 74 MET 1.80 0.94 1 75 SER 0.99 0.30 1 76 GLN -6.00 4.00 1 77 ARG -0.67 0.98 1 80 ILE -0.98 0.29 1 81 ASP 1.59 -0.70 1 83 ARG -4.89 2.16 1 84 TRP -0.24 0.19 1 86 ASP -4.83 4.43 1 88 LYS -5.42 3.37 1 89 LEU 0.24 -0.19 1 91 ASN 0.04 -0.06 1 92 SER 0.89 -0.26 1 93 LYS 0.86 -0.36 1 94 GLN 0.52 -0.16 1 95 SER 0.40 -0.01 1 96 GLN 0.44 -0.13 1 97 ASP -0.16 0.27 1 98 GLU -0.42 0.76 1 100 LEU 0.56 -0.28 1 101 ARG -0.22 0.04 1 102 SER 0.04 0.06 1 103 ARG 1.01 0.62 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18765_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.11 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _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 SER 3.81 0.72 0 12 SER 0.33 -0.07 1 13 GLN 0.34 -0.23 1 14 LYS -0.63 0.13 1 15 THR -2.95 0.39 1 16 SER -3.63 0.24 1 17 ASP 2.09 -0.17 1 18 LEU -2.38 0.50 1 19 ILE -4.08 0.62 1 20 VAL -1.62 0.69 1 21 LEU -3.33 0.42 1 23 LEU -0.63 -0.58 1 25 TRP 2.29 -0.09 1 26 LYS 1.66 -0.31 1 27 THR 4.97 -0.30 1 28 THR -5.24 0.35 1 29 GLU 5.46 -0.66 1 30 GLN 5.28 -0.33 1 31 ASP 3.10 -0.32 1 32 LEU 2.34 -0.30 1 33 LYS 5.36 -0.44 1 34 GLU 3.47 -0.35 1 35 TYR 4.47 -0.35 1 36 PHE 6.39 -0.08 1 38 THR 3.81 -0.37 1 39 PHE 2.04 -0.35 1 41 GLU 1.24 -0.05 1 42 VAL -1.41 -0.18 1 43 LEU -1.12 -0.04 1 44 MET -2.12 0.07 1 45 VAL -4.26 0.95 1 46 GLN -5.61 0.45 1 47 VAL -0.50 0.01 1 48 LYS 0.78 -0.03 1 49 LYS -4.04 0.46 1 50 ASP -2.03 -0.08 1 51 LEU 2.76 -0.26 1 52 LYS 2.54 -0.07 1 53 THR -0.85 -0.08 1 55 HIS -1.77 -0.08 1 57 LYS 0.16 0.16 1 59 PHE -4.44 0.78 1 61 PHE -7.11 1.49 1 62 VAL -5.31 0.83 1 63 ARG -5.09 0.30 1 64 PHE -0.62 0.26 1 65 THR 4.85 -0.30 1 66 GLU -3.48 0.50 1 67 TYR 4.60 -0.72 1 68 GLU 4.32 -0.54 1 69 THR 5.73 -0.37 1 70 GLN 4.29 -0.92 1 71 VAL 5.41 -0.69 1 72 LYS 4.25 -0.29 1 73 VAL 6.21 -0.85 1 74 MET 1.80 -0.11 1 75 SER 0.99 -0.01 1 76 GLN -6.00 0.57 1 77 ARG -0.67 0.44 1 78 HIS -3.63 0.11 1 79 MET 1.99 -0.23 1 80 ILE -0.98 -0.60 1 81 ASP 1.59 -0.59 1 83 ARG -4.89 0.20 1 84 TRP -0.24 0.24 1 86 ASP -4.83 0.78 1 88 LYS -5.42 0.48 1 89 LEU 0.24 0.13 1 91 ASN 0.04 -0.02 1 93 LYS 0.86 -0.02 1 94 GLN 0.52 -0.02 1 95 SER 0.40 -0.06 1 96 GLN 0.44 -0.01 1 97 ASP -0.16 -0.04 1 98 GLU -0.42 -0.09 1 100 LEU 0.56 -0.06 1 101 ARG -0.22 0.04 1 102 SER 0.04 -0.04 1 103 ARG 1.01 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18765_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.11 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 2.05 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 103 ARG 1.01 4.67 0 12 SER 0.33 -0.09 1 13 GLN 0.34 -0.68 1 14 LYS -0.63 0.50 1 15 THR -2.95 -0.26 1 16 SER -3.63 -2.37 1 17 ASP 2.09 -1.02 1 18 LEU -2.38 -0.79 1 19 ILE -4.08 -3.05 1 20 VAL -1.62 -1.26 1 21 LEU -3.33 -0.12 1 23 LEU -0.63 -0.22 1 25 TRP 2.29 1.08 1 26 LYS 1.66 -0.02 1 27 THR 4.97 0.72 1 28 THR -5.24 1.04 1 29 GLU 5.46 1.35 1 30 GLN 5.28 2.15 1 31 ASP 3.10 3.55 1 32 LEU 2.34 0.89 1 33 LYS 5.36 2.85 1 34 GLU 3.47 2.18 1 35 TYR 4.47 2.42 1 36 PHE 6.39 2.26 1 37 SER 3.81 0.66 1 38 THR 3.81 0.99 1 39 PHE 2.04 -0.24 1 41 GLU 1.24 0.37 1 42 VAL -1.41 -0.76 1 43 LEU -1.12 -0.77 1 44 MET -2.12 -3.04 1 45 VAL -4.26 -1.96 1 46 GLN -5.61 -1.29 1 47 VAL -0.50 -0.50 1 48 LYS 0.78 -1.56 1 49 LYS -4.04 -0.59 1 50 ASP -2.03 1.13 1 51 LEU 2.76 0.77 1 52 LYS 2.54 1.86 1 53 THR -0.85 1.69 1 55 HIS -1.77 1.32 1 56 SER -0.26 1.56 1 57 LYS 0.16 1.07 1 59 PHE -4.44 -3.03 1 61 PHE -7.11 -1.66 1 62 VAL -5.31 -5.04 1 63 ARG -5.09 -1.56 1 64 PHE -0.62 -0.94 1 65 THR 4.85 1.01 1 66 GLU -3.48 0.21 1 67 TYR 4.60 0.73 1 68 GLU 4.32 2.39 1 69 THR 5.73 -0.07 1 70 GLN 4.29 0.73 1 71 VAL 5.41 2.75 1 72 LYS 4.25 3.65 1 73 VAL 6.21 2.16 1 74 MET 1.80 0.72 1 75 SER 0.99 -2.44 1 76 GLN -6.00 -2.11 1 77 ARG -0.67 -0.28 1 78 HIS -3.63 -0.68 1 79 MET 1.99 -2.85 1 80 ILE -0.98 -2.14 1 81 ASP 1.59 -0.74 1 83 ARG -4.89 -1.91 1 84 TRP -0.24 0.91 1 86 ASP -4.83 -1.76 1 88 LYS -5.42 -1.83 1 89 LEU 0.24 0.22 1 91 ASN 0.04 0.33 1 92 SER 0.89 0.25 1 93 LYS 0.86 0.27 1 94 GLN 0.52 0.21 1 95 SER 0.40 0.04 1 96 GLN 0.44 -0.47 1 97 ASP -0.16 -0.53 1 98 GLU -0.42 -0.43 1 100 LEU 0.56 -0.14 1 101 ARG -0.22 -1.00 1 102 SER 0.04 -1.08 1 stop_ save_