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 bmr18488_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.68 _LACS_plot.Line_1_terminator_val_y_1 -3.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 8.64 _LACS_plot.Line_2_terminator_val_y_2 5.88 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 PHE 6.08 -1.26 0 37 THR 2.46 -3.38 0 11 THR 2.85 -3.28 0 12 GLU -0.91 -0.35 1 13 ILE 3.57 2.90 1 15 LEU 3.75 2.95 1 16 SER 2.39 0.93 1 17 GLU -4.40 -0.45 1 18 ILE 4.87 3.81 1 22 LEU 1.10 0.62 1 23 ALA 0.00 -0.17 1 25 VAL 0.45 -0.24 1 26 LEU 0.88 0.96 1 27 ASP -1.48 -1.64 1 29 GLN 0.12 0.61 1 30 LYS 0.41 0.19 1 31 ILE 8.64 2.00 1 32 ASP 0.31 0.25 1 33 ALA 0.58 0.52 1 34 MET 2.84 0.48 1 35 VAL 0.59 0.40 1 36 ALA 0.14 0.27 1 38 MET 6.50 0.11 1 39 LYS 0.64 0.30 1 41 ILE 0.24 0.04 1 43 THR 0.80 0.18 1 44 ALA 0.13 0.30 1 45 SER 0.39 0.40 1 46 LYS 0.12 -0.41 1 47 THR 0.16 0.25 1 49 SER 0.04 0.07 1 50 LEU 0.46 0.53 1 51 GLU 0.18 0.37 1 52 GLN 0.66 0.62 1 53 ALA 0.57 0.45 1 54 GLU 0.16 0.33 1 55 ALA 0.53 0.49 1 56 ALA 0.57 0.52 1 57 ALA 0.82 0.55 1 58 SER 0.27 0.31 1 59 ALA 0.18 0.26 1 61 GLU -0.94 -0.32 1 62 LEU -0.42 -0.36 1 65 VAL -1.59 -0.61 1 66 ASP 0.73 0.76 1 67 VAL -6.68 -4.04 1 68 LEU -2.98 -1.81 1 70 VAL -3.62 -2.05 1 71 ARG -0.02 -0.70 1 72 VAL -1.88 -0.32 1 73 LYS 3.94 0.71 1 75 GLN -1.69 -1.55 1 76 THR 2.60 1.27 1 77 LEU -3.67 -2.23 1 78 TYR -3.08 -1.15 1 79 TYR -3.82 -1.72 1 80 ALA 1.11 0.72 1 87 LEU -3.78 -2.45 1 88 GLN 5.05 3.16 1 89 ALA 3.36 2.69 1 90 TYR 4.74 4.26 1 91 ASP 4.53 3.54 1 92 ARG 4.59 3.58 1 93 ARG 5.05 1.81 1 94 ALA 2.54 2.82 1 95 ARG 4.71 2.92 1 96 GLU 2.76 2.76 1 97 THR -0.43 -0.07 1 98 GLN 5.76 1.87 1 99 ASN -2.17 -2.08 1 100 ALA 2.20 1.49 1 101 ALA -0.82 -2.19 1 102 PHE 0.65 1.80 1 104 VAL -2.03 -2.14 1 105 ARG 1.80 0.15 1 107 ARG -0.54 0.87 1 108 VAL -4.47 0.37 1 109 LEU 3.98 2.66 1 111 ALA -4.85 -1.70 1 112 THR 4.69 -0.74 1 114 ARG 4.57 3.13 1 115 GLN 5.16 2.93 1 116 ILE 4.51 2.68 1 118 MET 1.99 0.42 1 120 LEU 0.33 0.37 1 122 SER 0.37 0.37 1 123 SER 0.13 0.20 1 124 LEU 0.30 0.19 1 125 ASP -0.19 0.11 1 126 ILE 0.09 1.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18488_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.68 _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 -0.67 _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 8.64 _LACS_plot.Line_2_terminator_val_y_2 -2.76 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 PHE 6.08 -7.34 0 37 THR 2.46 -5.84 0 11 THR 2.85 -6.13 0 12 GLU -0.91 0.56 1 13 ILE 3.57 -0.67 1 15 LEU 3.75 -0.80 1 16 SER 2.39 -1.46 1 17 GLU -4.40 3.95 1 18 ILE 4.87 -1.06 1 22 LEU 1.10 -0.48 1 23 ALA 0.00 -0.17 1 25 VAL 0.45 -0.69 1 26 LEU 0.88 0.08 1 27 ASP -1.48 -0.16 1 29 GLN 0.12 0.49 1 30 LYS 0.41 -0.22 1 31 ILE 8.64 -6.64 1 32 ASP 0.31 -0.06 1 33 ALA 0.58 -0.06 1 34 MET 2.84 -2.36 1 35 VAL 0.59 -0.19 1 36 ALA 0.14 0.13 1 38 MET 6.50 -6.39 1 39 LYS 0.64 -0.34 1 41 ILE 0.24 -0.20 1 43 THR 0.80 -0.62 1 44 ALA 0.13 0.17 1 45 SER 0.39 0.01 1 46 LYS 0.12 -0.53 1 47 THR 0.16 0.09 1 49 SER 0.04 0.03 1 50 LEU 0.46 0.07 1 51 GLU 0.18 0.19 1 52 GLN 0.66 -0.04 1 53 ALA 0.57 -0.12 1 54 GLU 0.16 0.17 1 55 ALA 0.53 -0.04 1 56 ALA 0.57 -0.05 1 57 ALA 0.82 -0.27 1 58 SER 0.27 0.04 1 59 ALA 0.18 0.08 1 61 GLU -0.94 0.62 1 62 LEU -0.42 0.06 1 65 VAL -1.59 0.98 1 66 ASP 0.73 0.03 1 67 VAL -6.68 2.64 1 68 LEU -2.98 1.17 1 70 VAL -3.62 1.57 1 71 ARG -0.02 -0.68 1 72 VAL -1.88 1.56 1 73 LYS 3.94 -3.23 1 75 GLN -1.69 0.14 1 76 THR 2.60 -1.33 1 77 LEU -3.67 1.44 1 78 TYR -3.08 1.93 1 79 TYR -3.82 2.10 1 80 ALA 1.11 -0.39 1 87 LEU -3.78 1.33 1 88 GLN 5.05 -1.89 1 89 ALA 3.36 -0.67 1 90 TYR 4.74 -0.48 1 91 ASP 4.53 -0.99 1 92 ARG 4.59 -1.01 1 93 ARG 5.05 -3.24 1 94 ALA 2.54 0.28 1 95 ARG 4.71 -1.79 1 96 GLU 2.76 0.00 1 97 THR -0.43 0.36 1 98 GLN 5.76 -3.89 1 99 ASN -2.17 0.09 1 100 ALA 2.20 -0.71 1 101 ALA -0.82 -1.37 1 102 PHE 0.65 1.15 1 104 VAL -2.03 -0.11 1 105 ARG 1.80 -1.65 1 107 ARG -0.54 1.41 1 108 VAL -4.47 4.84 1 109 LEU 3.98 -1.32 1 111 ALA -4.85 3.15 1 112 THR 4.69 -5.43 1 114 ARG 4.57 -1.44 1 115 GLN 5.16 -2.23 1 116 ILE 4.51 -1.83 1 118 MET 1.99 -1.57 1 120 LEU 0.33 0.04 1 122 SER 0.37 0.00 1 123 SER 0.13 0.07 1 124 LEU 0.30 -0.11 1 125 ASP -0.19 0.30 1 126 ILE 0.09 1.39 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18488_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.40 _LACS_plot.Line_1_terminator_val_y_1 0.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.01 _LACS_plot.Line_2_terminator_val_x_2 8.64 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset 0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 LEU -2.98 0.84 0 31 ILE 8.64 -0.26 0 78 TYR -3.08 0.95 0 12 GLU -0.91 -0.19 1 13 ILE 3.57 -0.46 1 16 SER 2.39 -0.49 1 17 GLU -4.40 -0.09 1 18 ILE 4.87 -0.68 1 23 ALA 0.00 -0.14 1 26 LEU 0.88 -0.09 1 30 LYS 0.41 -0.11 1 33 ALA 0.58 -0.19 1 34 MET 2.84 -0.13 1 35 VAL 0.59 -0.16 1 36 ALA 0.14 -0.08 1 37 THR 2.46 -0.16 1 39 LYS 0.64 -0.13 1 41 ILE 0.24 -0.08 1 43 THR 0.80 -0.16 1 44 ALA 0.13 -0.08 1 45 SER 0.39 -0.14 1 46 LYS 0.12 -0.04 1 47 THR 0.16 -0.10 1 49 SER 0.04 -0.16 1 50 LEU 0.46 -0.13 1 51 GLU 0.18 -0.24 1 52 GLN 0.66 -0.19 1 53 ALA 0.57 -0.19 1 54 GLU 0.16 -0.25 1 55 ALA 0.53 -0.20 1 56 ALA 0.57 -0.19 1 58 SER 0.27 -0.20 1 59 ALA 0.18 -0.12 1 61 GLU -0.94 -0.15 1 62 LEU -0.42 -0.27 1 65 VAL -1.59 -0.18 1 66 ASP 0.73 0.48 1 70 VAL -3.62 0.27 1 71 ARG -0.02 0.49 1 72 VAL -1.88 0.05 1 73 LYS 3.94 -0.57 1 75 GLN -1.69 0.19 1 76 THR 2.60 0.12 1 77 LEU -3.67 -0.03 1 79 TYR -3.82 -0.37 1 80 ALA 1.11 -0.17 1 81 PHE 6.08 -0.35 1 89 ALA 3.36 -0.35 1 90 TYR 4.74 -0.83 1 92 ARG 4.59 -0.50 1 94 ALA 2.54 -0.51 1 96 GLU 2.76 -0.41 1 97 THR -0.43 -0.04 1 98 GLN 5.76 -0.58 1 99 ASN -2.17 0.22 1 100 ALA 2.20 -0.28 1 101 ALA -0.82 0.09 1 104 VAL -2.03 -0.30 1 105 ARG 1.80 -0.56 1 112 THR 4.69 0.10 1 114 ARG 4.57 -0.46 1 115 GLN 1.99 0.04 1 120 LEU 0.33 -0.14 1 122 SER 0.37 -0.16 1 123 SER 0.13 -0.14 1 124 LEU 0.30 -0.12 1 125 ASP -0.19 -0.06 1 126 ILE 0.09 -0.34 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18488_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.85 _LACS_plot.Line_1_terminator_val_y_1 -1.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.45 _LACS_plot.Line_2_terminator_val_x_2 8.64 _LACS_plot.Line_2_terminator_val_y_2 3.58 _LACS_plot.Y_axis_chem_shift_offset -0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 ILE 0.09 4.78 0 31 ILE 8.64 -0.43 0 11 THR 2.85 0.46 1 12 GLU -0.91 0.17 1 13 ILE 3.57 1.72 1 15 LEU 3.75 1.30 1 16 SER 2.39 1.59 1 17 GLU -4.40 -0.28 1 18 ILE 4.87 1.21 1 22 LEU 1.10 -0.31 1 23 ALA 0.00 -0.06 1 25 VAL 0.45 0.30 1 26 LEU 0.88 -1.06 1 27 ASP -1.48 0.27 1 29 GLN 0.12 0.79 1 30 LYS 0.41 0.93 1 32 ASP 0.31 0.50 1 33 ALA 0.58 0.92 1 34 MET 2.84 0.18 1 35 VAL 0.59 0.51 1 36 ALA 0.14 0.87 1 37 THR 2.46 0.44 1 38 MET 6.50 -0.54 1 39 LYS 0.64 0.78 1 41 ILE 0.24 0.13 1 43 THR 0.80 0.33 1 44 ALA 0.13 0.49 1 45 SER 0.39 0.69 1 46 LYS 0.12 0.79 1 47 THR 0.16 0.43 1 49 SER 0.04 0.64 1 50 LEU 0.46 0.56 1 51 GLU 0.18 0.78 1 52 GLN 0.66 0.16 1 53 ALA 0.57 0.90 1 54 GLU 0.16 0.72 1 55 ALA 0.53 0.71 1 56 ALA 0.57 0.53 1 57 ALA 0.82 1.18 1 58 SER 0.27 0.45 1 59 ALA 0.18 0.60 1 61 GLU -0.94 0.24 1 62 LEU -0.42 -0.58 1 65 VAL -1.59 -0.28 1 66 ASP 0.73 -0.27 1 68 LEU -2.98 -0.01 1 70 VAL -3.62 -2.31 1 71 ARG -0.02 -0.02 1 72 VAL -1.88 -0.43 1 73 LYS 3.94 0.69 1 75 GLN -1.69 -1.17 1 76 THR 2.60 -1.69 1 77 LEU -3.67 -2.21 1 78 TYR -3.08 -0.55 1 79 TYR -3.82 0.23 1 80 ALA 1.11 1.23 1 81 PHE 6.08 1.82 1 87 LEU -3.78 -2.22 1 88 GLN 5.05 3.04 1 89 ALA 3.36 3.34 1 90 TYR 4.74 1.88 1 91 ASP 4.53 3.57 1 92 ARG 4.59 2.62 1 93 ARG 5.05 3.76 1 94 ALA 2.54 2.96 1 95 ARG 4.71 4.27 1 96 GLU 2.76 2.57 1 97 THR -0.43 -0.14 1 98 GLN 5.76 -1.20 1 99 ASN -2.17 -0.40 1 100 ALA 2.20 -0.23 1 101 ALA -0.82 -2.27 1 102 PHE 0.65 -1.17 1 104 VAL -2.03 0.64 1 105 ARG 1.80 -0.35 1 107 ARG -0.54 1.74 1 111 ALA -4.85 -0.52 1 114 ARG 4.57 2.85 1 115 GLN 4.51 2.12 1 118 MET 1.99 1.27 1 120 LEU 0.33 0.47 1 122 SER 0.37 0.15 1 123 SER 0.13 -0.60 1 124 LEU 0.30 -0.14 1 125 ASP -0.19 -0.87 1 stop_ save_