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 bmr18505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.58 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.26 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 3.95 _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 70 TYR -6.34 -0.88 0 36 ILE -0.06 -2.45 0 118 THR 5.77 4.09 0 113 HIS -3.59 1.14 0 10 PHE -4.33 -1.00 1 11 SER -0.09 0.42 1 13 ILE -1.64 -0.21 1 14 THR 0.22 0.90 1 15 GLN 0.82 0.21 1 16 PHE -2.15 -0.79 1 17 GLN -3.23 -1.51 1 18 LYS 1.78 1.44 1 20 LYS -3.03 -2.91 1 22 PHE -3.74 -3.56 1 23 GLN -2.49 -1.74 1 24 PHE -5.40 -0.59 1 25 ALA -1.11 -0.98 1 26 GLU 2.30 2.16 1 28 GLN -3.37 -1.56 1 32 ILE -0.94 -0.39 1 33 ALA -4.56 -1.71 1 34 ASN 2.31 1.60 1 38 ALA 3.81 3.08 1 39 SER 3.60 2.17 1 40 GLU -1.53 -1.84 1 41 GLN 2.21 -0.13 1 42 LYS -2.47 -1.75 1 44 TYR -3.56 -2.97 1 45 TRP -4.51 -1.29 1 46 TYR -6.58 -2.31 1 49 ASN 0.45 0.26 1 50 ARG -1.39 0.18 1 51 ARG -0.48 0.20 1 52 SER -1.29 -0.45 1 53 PHE -2.14 -1.06 1 54 LYS -1.32 -0.77 1 57 ASP 0.07 -0.73 1 59 GLN -0.32 -0.17 1 60 GLN -0.30 -0.06 1 61 LYS -1.66 -0.88 1 62 GLN -0.42 -0.12 1 63 LEU -2.07 -1.11 1 66 ARG 2.12 0.52 1 67 TRP -4.32 -2.52 1 68 TYR -1.89 -0.22 1 69 PHE 2.07 1.94 1 71 TYR -1.20 -0.83 1 72 LEU 0.05 2.13 1 74 THR -3.71 0.16 1 77 HIS -0.64 -1.05 1 78 ALA 3.32 3.01 1 80 ALA -1.77 -0.56 1 81 SER -0.98 -0.98 1 84 ASP 1.65 1.43 1 85 SER 1.59 0.09 1 86 ILE -4.17 -0.71 1 87 GLU 1.92 1.29 1 89 VAL -2.95 -1.23 1 90 PHE -3.77 0.09 1 91 TRP 1.46 0.74 1 92 VAL -5.75 -2.30 1 93 ALA -1.81 0.37 1 94 ASN -1.53 0.51 1 95 SER 4.32 3.37 1 96 GLN 0.25 0.22 1 97 ALA -1.85 -0.38 1 98 ASP -1.08 -1.68 1 99 THR 3.11 0.93 1 100 ASN 0.49 1.01 1 101 THR -3.79 -2.30 1 103 SER -0.49 0.95 1 104 ASP -0.17 -0.59 1 105 ILE 0.10 -0.47 1 106 VAL -0.71 -0.76 1 107 GLU -1.19 -0.14 1 108 ARG 0.33 1.44 1 111 SER 2.76 2.11 1 112 SER -1.48 0.13 1 114 GLU -2.12 -1.09 1 115 ALA 0.44 -0.14 1 116 ILE -0.41 0.54 1 119 ARG -4.05 -1.52 1 120 PHE -5.60 -1.98 1 125 VAL -0.42 -0.77 1 126 LEU -1.35 -2.39 1 128 GLN 2.00 1.26 1 130 PHE -3.29 -1.32 1 131 TYR -4.50 -1.85 1 132 VAL 1.12 0.39 1 133 GLU 0.64 0.91 1 135 SER -0.25 0.29 1 137 ARG -0.05 -0.04 1 138 SER 0.67 1.67 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.58 _LACS_plot.Line_1_terminator_val_y_1 4.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.74 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -1.81 _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 70 TYR -6.34 5.46 0 36 ILE -0.06 -2.39 0 118 THR 5.77 -1.68 0 113 HIS -3.59 4.73 0 10 PHE -4.33 3.33 1 11 SER -0.09 0.51 1 13 ILE -1.64 1.43 1 14 THR 0.22 0.68 1 15 GLN 0.82 -0.61 1 16 PHE -2.15 1.36 1 17 GLN -3.23 1.72 1 18 LYS 1.78 -0.34 1 20 LYS -3.03 0.12 1 22 PHE -3.74 0.18 1 23 GLN -2.49 0.75 1 24 PHE -5.40 4.81 1 25 ALA -1.11 0.13 1 26 GLU 2.30 -0.14 1 28 GLN -3.37 1.81 1 32 ILE -0.94 0.55 1 33 ALA -4.56 2.85 1 34 ASN 2.31 -0.71 1 38 ALA 3.81 -0.73 1 39 SER 3.60 -1.43 1 40 GLU -1.53 -0.31 1 41 GLN 2.21 -2.34 1 42 LYS -2.47 0.72 1 44 TYR -3.56 0.59 1 45 TRP -4.51 3.22 1 46 TYR -6.58 4.27 1 49 ASN 0.45 -0.19 1 50 ARG -1.39 1.57 1 51 ARG -0.48 0.68 1 52 SER -1.29 0.84 1 53 PHE -2.14 1.08 1 54 LYS -1.32 0.55 1 57 ASP 0.07 -0.80 1 59 GLN -0.32 0.15 1 60 GLN -0.30 0.24 1 61 LYS -1.66 0.78 1 62 GLN -0.42 0.30 1 63 LEU -2.07 0.96 1 66 ARG 2.12 -1.60 1 67 TRP -4.32 1.80 1 68 TYR -1.89 1.67 1 69 PHE 2.07 -0.13 1 71 TYR -1.20 0.37 1 72 LEU 0.05 2.08 1 74 THR -3.71 3.87 1 77 HIS -0.64 -0.41 1 78 ALA 3.32 -0.31 1 80 ALA -1.77 1.21 1 81 SER -0.98 0.00 1 84 ASP 1.65 -0.22 1 85 SER 1.59 -1.50 1 86 ILE -4.17 3.46 1 87 GLU 1.92 -0.63 1 89 VAL -2.95 1.72 1 90 PHE -3.77 3.86 1 91 TRP 1.46 -0.72 1 92 VAL -5.75 3.45 1 93 ALA -1.81 2.18 1 94 ASN -1.53 2.04 1 95 SER 4.32 -0.95 1 96 GLN 0.25 -0.03 1 97 ALA -1.85 1.47 1 98 ASP -1.08 -0.60 1 99 THR 3.11 -2.18 1 100 ASN 0.49 0.52 1 101 THR -3.79 1.49 1 103 SER -0.49 1.44 1 104 ASP -0.17 -0.42 1 105 ILE 0.10 -0.57 1 106 VAL -0.71 -0.05 1 107 GLU -1.19 1.05 1 108 ARG 0.33 1.11 1 111 SER 2.76 -0.65 1 112 SER -1.48 1.61 1 114 GLU -2.12 1.03 1 115 ALA 0.44 -0.58 1 116 ILE -0.41 0.95 1 119 ARG -4.05 2.53 1 120 PHE -5.60 3.62 1 125 VAL -0.42 -0.35 1 126 LEU -1.35 -1.04 1 128 GLN 2.00 -0.74 1 130 PHE -3.29 1.97 1 131 TYR -4.50 2.65 1 132 VAL 1.12 -0.73 1 133 GLU 0.64 0.27 1 135 SER -0.25 0.54 1 137 ARG -0.05 0.01 1 138 SER 0.67 1.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.58 _LACS_plot.Line_1_terminator_val_y_1 0.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 -0.56 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 VAL -2.95 1.27 0 10 PHE -4.33 1.41 0 24 PHE -5.40 -0.44 0 11 SER -0.09 0.15 1 14 THR 0.22 0.34 1 15 GLN 0.82 -0.49 1 16 PHE -2.15 0.39 1 17 GLN -3.23 0.22 1 18 LYS 1.78 -0.43 1 20 LYS -3.03 0.22 1 22 PHE -3.74 0.04 1 25 ALA -1.11 -0.03 1 26 GLU 2.30 -0.15 1 28 GLN -3.37 0.47 1 32 ILE -0.94 -0.23 1 33 ALA -4.56 0.41 1 34 ASN 2.31 -0.32 1 36 ILE -0.06 0.19 1 38 ALA 3.81 -0.46 1 39 SER 3.60 -0.64 1 40 GLU -1.53 0.32 1 41 GLN 2.21 -0.04 1 42 LYS -2.47 1.00 1 44 TYR -3.56 1.07 1 45 TRP -4.51 0.60 1 46 TYR -6.58 0.42 1 49 ASN 0.45 -0.23 1 50 ARG -1.39 0.04 1 51 ARG -0.48 0.08 1 52 SER -1.29 0.31 1 53 PHE -2.14 0.23 1 54 LYS -1.32 0.51 1 57 ASP 0.07 -0.04 1 59 GLN -0.32 0.02 1 60 GLN -0.30 0.21 1 61 LYS -1.66 0.11 1 62 GLN -0.42 0.09 1 63 LEU -2.07 0.24 1 66 ARG 2.12 -0.24 1 67 TRP -4.32 -0.04 1 68 TYR -1.89 -0.09 1 69 PHE 2.07 -0.01 1 72 LEU 0.05 0.15 1 74 THR -3.71 0.57 1 77 HIS -0.64 0.10 1 78 ALA 3.32 -0.60 1 80 ALA -1.77 0.06 1 81 SER -0.98 -0.16 1 84 ASP 1.65 -0.33 1 85 SER 1.59 0.07 1 86 ILE -4.17 -0.08 1 87 GLU 1.92 -0.18 1 90 PHE -3.77 0.37 1 91 TRP 1.46 0.18 1 92 VAL -5.75 0.98 1 93 ALA -1.81 0.33 1 94 ASN -1.53 -0.15 1 95 SER 4.32 -0.17 1 96 GLN 0.25 -0.05 1 97 ALA -1.85 -0.05 1 98 ASP -1.08 0.11 1 99 THR 3.11 -0.73 1 100 ASN 0.49 -0.08 1 101 THR -3.79 0.24 1 104 ASP -0.17 0.18 1 105 ILE 0.10 -0.20 1 106 VAL -0.71 0.25 1 107 GLU -1.19 -0.31 1 108 ARG 0.33 -0.16 1 111 SER 2.76 -0.26 1 112 SER -1.48 0.07 1 113 HIS -3.59 0.10 1 114 GLU -2.12 -0.02 1 115 ALA 0.44 -0.35 1 116 ILE -0.41 -0.08 1 118 THR 5.77 -0.52 1 119 ARG -4.05 -0.10 1 120 PHE -5.60 0.34 1 125 VAL -0.42 -0.06 1 126 LEU -1.35 -0.48 1 128 GLN 2.00 -0.25 1 130 PHE -3.29 0.74 1 131 TYR -4.50 0.51 1 132 VAL 1.12 0.05 1 133 GLU 0.64 0.31 1 135 SER -0.25 0.07 1 137 ARG -0.05 0.10 1 138 SER 0.67 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18505_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.58 _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 -0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.69 _LACS_plot.Line_2_terminator_val_x_2 5.76 _LACS_plot.Line_2_terminator_val_y_2 0.56 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 GLN -2.49 -4.02 0 10 PHE -4.33 1.94 0 118 THR 5.77 -1.12 0 11 SER -0.09 1.97 1 14 THR 0.22 -1.08 1 15 GLN 0.82 -1.90 1 17 GLN -3.23 -1.23 1 18 LYS 1.78 0.60 1 22 PHE -3.74 1.83 1 24 PHE -5.40 -0.97 1 25 ALA -1.11 -1.39 1 26 GLU 2.30 1.31 1 28 GLN -3.37 0.01 1 33 ALA -4.56 -1.03 1 34 ASN 2.31 1.17 1 38 ALA 3.81 1.50 1 39 SER 3.60 1.18 1 41 GLN 2.21 -2.80 1 42 LYS -2.47 -0.65 1 44 TYR -3.56 -3.40 1 45 TRP -4.51 -0.39 1 46 TYR -6.58 -2.16 1 49 ASN 0.45 1.21 1 50 ARG -1.39 -0.63 1 51 ARG -0.48 -0.63 1 53 PHE -2.14 -1.85 1 54 LYS -1.32 0.22 1 57 ASP 0.07 0.47 1 60 GLN -0.30 -0.39 1 61 LYS -1.66 -2.39 1 62 GLN -0.42 -0.36 1 63 LEU -2.07 -0.70 1 66 ARG 2.12 -2.57 1 67 TRP -4.32 -2.18 1 68 TYR -1.89 -3.70 1 69 PHE 2.07 1.51 1 70 TYR -6.34 -0.58 1 71 TYR -1.20 -0.61 1 72 LEU 0.05 -1.03 1 74 THR -3.71 1.61 1 78 ALA 3.32 -0.49 1 80 ALA -1.77 -0.24 1 81 SER -0.98 -3.21 1 84 ASP 1.65 0.99 1 85 SER 1.59 -0.69 1 87 GLU 1.92 0.76 1 89 VAL -2.95 -0.38 1 90 PHE -3.77 -0.90 1 91 TRP 1.46 -0.57 1 92 VAL -5.75 -1.82 1 93 ALA -1.81 -0.99 1 94 ASN -1.53 2.19 1 95 SER 4.32 0.72 1 96 GLN 0.25 -0.05 1 99 THR 3.11 -1.64 1 100 ASN 0.49 -0.06 1 103 SER -0.49 0.15 1 104 ASP -0.17 -0.83 1 105 ILE 0.10 -0.62 1 106 VAL -0.71 -2.36 1 107 GLU -1.19 -0.22 1 111 SER 2.76 0.11 1 112 SER -1.48 -0.86 1 113 HIS -3.59 0.42 1 114 GLU -2.12 -0.32 1 115 ALA 0.44 -0.29 1 119 ARG -4.05 -3.47 1 120 PHE -5.60 -0.10 1 125 VAL -0.42 -0.97 1 128 GLN 2.00 1.19 1 130 PHE -3.29 -1.47 1 131 TYR -4.50 -2.55 1 132 VAL 1.12 -1.00 1 133 GLU 0.64 1.33 1 135 SER -0.25 0.59 1 137 ARG -0.05 -0.75 1 stop_ save_