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 bmr17826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.89 _LACS_plot.Line_1_terminator_val_y_1 -2.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.09 _LACS_plot.Line_2_terminator_val_x_2 4.49 _LACS_plot.Line_2_terminator_val_y_2 2.18 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 HIS -5.69 1.33 0 11 GLU -1.74 -2.15 1 14 ARG -1.24 -0.77 1 17 THR 2.40 2.04 1 18 VAL -4.38 -1.47 1 19 LEU -2.56 -1.87 1 20 ARG -4.43 -1.55 1 21 ILE -2.92 -0.98 1 22 ARG -4.11 -1.80 1 24 LEU -3.70 -0.85 1 25 VAL 1.50 0.21 1 29 ALA -2.16 0.70 1 31 ARG -4.66 -0.93 1 32 PHE -1.78 -1.37 1 33 HIS -5.25 -0.55 1 34 VAL -2.93 -1.42 1 35 ASN -5.12 -2.41 1 36 LEU 0.22 -1.26 1 37 LEU -5.19 -1.82 1 40 GLU -0.59 -0.26 1 41 GLU -0.58 -0.87 1 42 GLN 3.43 1.86 1 44 SER 0.37 1.17 1 45 ASP 1.64 0.71 1 46 ALA -3.00 -2.43 1 47 ALA 0.88 0.73 1 48 LEU -1.95 -0.05 1 49 HIS -1.87 0.02 1 50 PHE -3.15 -3.19 1 51 ASN -5.14 -2.46 1 53 ARG -0.26 -1.55 1 54 LEU 4.03 0.58 1 55 ASP 4.18 1.53 1 56 THR 1.58 -1.10 1 57 SER 2.86 -0.10 1 58 GLU -5.46 -2.76 1 59 VAL 0.08 -0.86 1 60 VAL -2.99 -1.47 1 61 PHE -5.64 -2.68 1 62 ASN -5.72 -2.06 1 63 SER -3.77 -1.35 1 64 LYS -3.15 -1.13 1 65 GLU -4.85 -1.87 1 66 GLN 3.74 0.62 1 68 SER -1.93 -1.33 1 69 TRP -0.31 0.01 1 71 ARG 0.71 -0.27 1 72 GLU 0.40 0.96 1 73 GLU -4.74 -2.15 1 74 ARG -3.89 -1.55 1 78 VAL -1.89 -1.57 1 80 PHE -4.85 -1.37 1 81 GLN -4.47 -1.86 1 82 ARG 2.97 2.23 1 84 GLN -2.55 -1.75 1 86 PHE -5.76 -1.97 1 87 GLU -3.80 -0.87 1 88 VAL -5.89 -2.75 1 89 LEU -4.03 -2.48 1 90 ILE -1.02 -1.65 1 91 ILE -3.79 -1.29 1 92 ALA -1.32 -0.80 1 93 SER -4.80 -2.62 1 94 ASP 3.78 2.75 1 95 ASP -1.33 -0.97 1 97 PHE -3.73 -2.00 1 98 LYS -1.73 -1.08 1 99 ALA -2.27 -2.48 1 100 VAL -1.20 -0.86 1 101 VAL -1.48 -1.37 1 103 ASP -0.79 -0.38 1 104 ALA -4.58 -1.77 1 105 GLN 3.38 1.86 1 106 TYR -1.08 1.50 1 108 HIS -3.18 -0.55 1 109 PHE -5.50 -3.19 1 110 ARG 2.01 0.60 1 111 HIS 1.02 3.23 1 112 ARG 0.19 0.90 1 113 LEU -1.28 -0.53 1 115 LEU 2.87 1.85 1 116 ALA 1.91 1.29 1 117 ARG 0.69 1.10 1 118 VAL 4.49 2.92 1 119 ARG -4.55 -1.55 1 120 LEU -3.88 0.02 1 121 VAL -2.97 -2.14 1 122 GLU -0.09 -1.55 1 126 ASP -3.28 -2.73 1 127 VAL -1.75 -1.91 1 128 GLN -3.49 -1.51 1 129 LEU 0.38 1.48 1 130 ASP -1.53 -1.14 1 131 SER -1.66 -0.81 1 132 VAL -5.09 -2.21 1 133 ARG -1.26 -1.04 1 134 ILE -3.49 -0.75 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.89 _LACS_plot.Line_1_terminator_val_y_1 3.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.91 _LACS_plot.Line_2_terminator_val_x_2 4.49 _LACS_plot.Line_2_terminator_val_y_2 -2.31 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 HIS -5.69 7.02 0 11 GLU -1.74 -0.41 1 14 ARG -1.24 0.47 1 17 THR 2.40 -0.36 1 18 VAL -4.38 2.91 1 19 LEU -2.56 0.69 1 20 ARG -4.43 2.88 1 21 ILE -2.92 1.94 1 22 ARG -4.11 2.31 1 24 LEU -3.70 2.85 1 25 VAL 1.50 -1.29 1 29 ALA -2.16 2.86 1 31 ARG -4.66 3.73 1 32 PHE -1.78 0.41 1 33 HIS -5.25 4.70 1 34 VAL -2.93 1.51 1 35 ASN -5.12 2.71 1 36 LEU 0.22 -1.48 1 37 LEU -5.19 3.37 1 40 GLU -0.59 0.33 1 41 GLU -0.58 -0.29 1 42 GLN 3.43 -1.57 1 44 SER 0.37 0.80 1 45 ASP 1.64 -0.93 1 46 ALA -3.00 0.57 1 47 ALA 0.88 -0.15 1 48 LEU -1.95 1.90 1 49 HIS -1.87 1.89 1 50 PHE -3.15 -0.04 1 51 ASN -5.14 2.68 1 53 ARG -0.26 -1.29 1 54 LEU 4.03 -3.45 1 55 ASP 4.18 -2.65 1 56 THR 1.58 -2.68 1 57 SER 2.86 -2.96 1 58 GLU -5.46 2.70 1 59 VAL 0.08 -0.94 1 60 VAL -2.99 1.52 1 61 PHE -5.64 2.96 1 62 ASN -5.72 3.66 1 63 SER -3.77 2.42 1 64 LYS -3.15 2.02 1 65 GLU -4.85 2.98 1 66 GLN 3.74 -3.12 1 68 SER -1.93 0.60 1 69 TRP -0.31 0.32 1 71 ARG 0.71 -0.98 1 72 GLU 0.40 0.56 1 73 GLU -4.74 2.59 1 74 ARG -3.89 2.34 1 78 VAL -1.89 0.32 1 80 PHE -4.85 3.48 1 81 GLN -4.47 2.61 1 82 ARG 2.97 -0.74 1 84 GLN -2.55 0.80 1 86 PHE -5.76 3.79 1 87 GLU -3.80 2.93 1 88 VAL -5.89 3.14 1 89 LEU -4.03 1.55 1 90 ILE -1.02 -0.63 1 91 ILE -3.79 2.50 1 92 ALA -1.32 0.52 1 93 SER -4.80 2.18 1 94 ASP 3.78 -1.03 1 95 ASP -1.33 0.36 1 97 PHE -3.73 1.73 1 98 LYS -1.73 0.65 1 99 ALA -2.27 -0.21 1 100 VAL -1.20 0.34 1 101 VAL -1.48 0.11 1 103 ASP -0.79 0.41 1 104 ALA -4.58 2.81 1 105 GLN 3.38 -1.52 1 106 TYR -1.08 2.58 1 108 HIS -3.18 2.63 1 109 PHE -5.50 2.31 1 110 ARG 2.01 -1.41 1 111 HIS 1.02 2.21 1 112 ARG 0.19 0.71 1 113 LEU -1.28 0.75 1 115 LEU 2.87 -1.02 1 116 ALA 1.91 -0.62 1 117 ARG 0.69 0.41 1 118 VAL 4.49 -1.57 1 119 ARG -4.55 3.00 1 120 LEU -3.88 3.90 1 121 VAL -2.97 0.83 1 122 GLU -0.09 -1.46 1 126 ASP -3.28 0.55 1 127 VAL -1.75 -0.16 1 128 GLN -3.49 1.98 1 129 LEU 0.38 1.10 1 130 ASP -1.53 0.39 1 131 SER -1.66 0.85 1 132 VAL -5.09 2.88 1 133 ARG -1.26 0.22 1 134 ILE -3.49 2.74 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.89 _LACS_plot.Line_1_terminator_val_y_1 0.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.30 _LACS_plot.Line_2_terminator_val_x_2 4.49 _LACS_plot.Line_2_terminator_val_y_2 -0.45 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 ASN -5.12 1.38 0 17 THR 2.40 0.50 0 40 GLU -0.59 -0.75 0 51 ASN -5.14 -0.20 0 107 HIS -5.69 -0.13 0 11 GLU -1.74 0.10 1 14 ARG -1.24 0.07 1 18 VAL -4.38 0.60 1 19 LEU -2.56 0.80 1 20 ARG -4.43 0.99 1 21 ILE -2.92 0.65 1 22 ARG -4.11 0.55 1 24 LEU -3.70 0.25 1 25 VAL 1.50 -0.25 1 29 ALA -2.16 -0.34 1 32 PHE -1.78 0.35 1 33 HIS -5.25 0.82 1 34 VAL -2.93 0.71 1 36 LEU 0.22 0.85 1 37 LEU -5.19 0.90 1 41 GLU -0.58 0.39 1 42 GLN 3.43 -0.34 1 44 SER 0.37 -0.44 1 45 ASP 1.64 -0.56 1 46 ALA -3.00 0.79 1 47 ALA 0.88 -0.09 1 48 LEU -1.95 0.14 1 49 HIS -1.87 0.80 1 50 PHE -3.15 -0.22 1 53 ARG -0.26 0.35 1 54 LEU 4.03 -0.15 1 55 ASP 4.18 -0.34 1 56 THR 1.58 -0.04 1 57 SER 2.86 -0.54 1 58 GLU -5.46 0.24 1 59 VAL 0.08 -0.02 1 60 VAL -2.99 0.50 1 61 PHE -5.64 0.94 1 62 ASN -5.72 0.53 1 63 SER -3.77 0.24 1 65 GLU -4.85 0.14 1 66 GLN 3.74 -0.50 1 68 SER -1.93 0.28 1 69 TRP -0.31 0.13 1 71 ARG 0.71 0.09 1 72 GLU 0.40 0.07 1 73 GLU -4.74 0.51 1 74 ARG -3.89 1.19 1 78 VAL -1.89 0.11 1 80 PHE -4.85 -0.08 1 81 GLN -4.47 0.41 1 82 ARG 2.97 -0.72 1 84 GLN -2.55 0.36 1 86 PHE -5.76 0.69 1 87 GLU -3.80 0.71 1 88 VAL -5.89 1.16 1 89 LEU -4.03 1.25 1 90 ILE -1.02 0.72 1 91 ILE -3.79 0.59 1 92 ALA -1.32 0.48 1 93 SER -4.80 0.44 1 94 ASP 3.78 -0.27 1 95 ASP -1.33 0.11 1 97 PHE -3.73 0.89 1 98 LYS -1.73 0.44 1 99 ALA -2.27 1.06 1 100 VAL -1.20 0.25 1 101 VAL -1.48 0.61 1 103 ASP -0.79 0.05 1 104 ALA -4.58 0.62 1 105 GLN 3.38 -0.20 1 106 TYR -1.08 0.28 1 108 HIS -3.18 0.31 1 109 PHE -5.50 0.10 1 110 ARG 2.01 -0.36 1 111 HIS 1.02 -0.12 1 112 ARG 0.19 0.14 1 113 LEU -1.28 0.07 1 115 LEU 2.87 -0.58 1 116 ALA 1.91 -0.08 1 117 ARG 0.69 -0.19 1 118 VAL 4.49 -0.56 1 119 ARG -4.55 0.75 1 120 LEU -3.88 0.66 1 121 VAL -2.97 1.00 1 122 GLU -0.09 -0.03 1 126 ASP -3.28 -0.10 1 127 VAL -1.75 0.22 1 128 GLN -3.49 -0.05 1 129 LEU 0.38 0.06 1 130 ASP -1.53 -0.06 1 131 SER -1.66 0.39 1 132 VAL -5.09 0.23 1 133 ARG -1.26 0.53 1 134 ILE -3.49 0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.89 _LACS_plot.Line_1_terminator_val_y_1 -2.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.53 _LACS_plot.Line_2_terminator_val_x_2 4.49 _LACS_plot.Line_2_terminator_val_y_2 0.05 _LACS_plot.Y_axis_chem_shift_offset 1.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 134 ILE -3.49 4.75 0 51 ASN -5.14 4.68 0 11 GLU -1.74 0.18 1 17 THR 2.40 -1.77 1 18 VAL -4.38 -3.39 1 19 LEU -2.56 -3.32 1 20 ARG -4.43 -1.20 1 21 ILE -2.92 -3.90 1 22 ARG -4.11 -0.98 1 24 LEU -3.70 -2.59 1 29 ALA -2.16 -1.09 1 31 ARG -4.66 -2.71 1 32 PHE -1.78 -3.88 1 33 HIS -5.25 -1.23 1 34 VAL -2.93 -2.22 1 35 ASN -5.12 -0.78 1 36 LEU 0.22 -1.81 1 37 LEU -5.19 0.93 1 40 GLU -0.59 0.07 1 41 GLU -0.58 0.95 1 44 SER 0.37 -2.61 1 45 ASP 1.64 -0.17 1 46 ALA -3.00 -2.04 1 47 ALA 0.88 -1.38 1 48 LEU -1.95 -5.38 1 49 HIS -1.87 -2.65 1 50 PHE -3.15 -3.14 1 53 ARG -0.26 -3.80 1 54 LEU 4.03 0.74 1 55 ASP 4.18 1.89 1 56 THR 1.58 -0.69 1 57 SER 2.86 -2.11 1 58 GLU -5.46 -3.33 1 59 VAL 0.08 -2.44 1 60 VAL -2.99 -3.22 1 61 PHE -5.64 -0.63 1 62 ASN -5.72 -3.33 1 63 SER -3.77 -2.61 1 64 LYS -3.15 -2.44 1 65 GLU -4.85 -0.89 1 66 GLN 3.74 0.33 1 68 SER -1.93 -0.61 1 69 TRP -0.31 1.17 1 71 ARG 0.71 -0.08 1 72 GLU 0.40 0.68 1 73 GLU -4.74 -1.87 1 74 ARG -3.89 0.46 1 80 PHE -4.85 -2.58 1 81 GLN -4.47 -0.15 1 82 ARG 2.97 0.61 1 84 GLN -2.55 0.20 1 86 PHE -5.76 -2.42 1 87 GLU -3.80 -2.20 1 88 VAL -5.89 -1.60 1 89 LEU -4.03 -1.43 1 90 ILE -1.02 -1.75 1 91 ILE -3.79 -0.54 1 92 ALA -1.32 -2.70 1 93 SER -4.80 2.69 1 94 ASP 3.78 0.60 1 95 ASP -1.33 0.35 1 97 PHE -3.73 -0.62 1 98 LYS -1.73 -1.68 1 99 ALA -2.27 -2.87 1 100 VAL -1.20 -1.63 1 101 VAL -1.48 -0.08 1 103 ASP -0.79 -2.26 1 104 ALA -4.58 -3.27 1 105 GLN 3.38 -1.66 1 106 TYR -1.08 -2.30 1 107 HIS -5.69 -2.33 1 108 HIS -3.18 -2.08 1 109 PHE -5.50 -2.48 1 110 ARG 2.01 -0.49 1 111 HIS 1.02 3.11 1 112 ARG 0.19 -0.70 1 113 LEU -1.28 -2.18 1 115 LEU 2.87 1.13 1 116 ALA 1.91 0.32 1 117 ARG 0.69 0.69 1 118 VAL 4.49 -0.25 1 119 ARG -4.55 -0.83 1 120 LEU -3.88 -3.93 1 121 VAL -2.97 -2.98 1 122 GLU -0.09 -5.49 1 126 ASP -3.28 -4.85 1 127 VAL -1.75 -1.52 1 128 GLN -3.49 -3.10 1 129 LEU 0.38 -0.32 1 130 ASP -1.53 -2.31 1 131 SER -1.66 -1.72 1 132 VAL -5.09 -3.22 1 133 ARG -1.26 -2.12 1 stop_ save_