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 bmr26947_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -2.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 9.98 _LACS_plot.Line_2_terminator_val_y_2 7.50 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 TYR 9.99 8.95 0 10 ASP 0.57 0.67 1 11 ALA 0.78 0.84 1 12 ALA 0.19 0.37 1 13 LEU 0.28 0.15 1 14 LEU 1.01 0.16 1 15 LEU 0.26 0.41 1 16 ASN 1.20 0.31 1 17 VAL -1.49 -0.94 1 18 GLU 0.54 0.64 1 20 VAL -3.98 -1.44 1 21 LYS -3.84 -0.92 1 22 LYS -4.11 -1.00 1 23 THR -1.66 -0.06 1 24 ILE 3.68 2.57 1 25 LEU 1.13 0.75 1 26 HIS -3.14 0.89 1 29 THR -2.09 -0.92 1 31 GLU -2.05 -1.22 1 32 LEU 0.01 -0.51 1 34 ASN -0.46 -1.48 1 35 PHE 1.73 1.03 1 36 ILE -5.39 -1.69 1 37 THR 4.38 3.98 1 39 SER 4.11 3.79 1 40 ARG -2.54 -1.03 1 41 VAL -0.76 -0.22 1 42 ILE -1.17 -0.40 1 43 PHE -3.40 -1.42 1 44 HIS -6.89 -0.24 1 45 PHE -6.39 -1.45 1 46 ARG -5.08 -1.21 1 47 THR -1.57 -0.73 1 48 MET -5.62 -1.55 1 49 LYS -0.87 0.37 1 51 ASP -1.71 -2.36 1 52 GLU 4.06 3.51 1 53 GLU 0.42 0.02 1 54 ARG 3.37 -0.03 1 55 THR 4.07 3.32 1 56 VAL 1.41 1.04 1 57 ILE 0.72 0.39 1 58 ASP -5.30 0.01 1 59 ASP -2.49 -0.58 1 60 SER 6.74 4.37 1 61 ARG 4.91 3.27 1 62 GLN 3.33 2.26 1 63 VAL 3.11 2.06 1 65 GLN -2.91 -1.08 1 67 MET -2.89 -2.43 1 68 HIS -4.79 -0.21 1 69 ILE -6.63 -2.53 1 70 ILE -2.66 -2.58 1 71 ILE 1.82 -1.00 1 84 LEU 3.06 3.21 1 85 THR 2.01 0.60 1 86 SER -1.65 0.11 1 87 MET -1.14 1.50 1 88 ARG -2.78 -1.08 1 89 VAL 6.83 4.55 1 90 HIS 4.77 3.70 1 91 GLU -4.06 0.02 1 92 VAL -1.59 -1.37 1 93 ALA -6.83 -1.95 1 94 GLU -5.69 -2.31 1 95 PHE -3.84 -1.81 1 96 TRP -0.22 0.63 1 98 ASP -3.62 -1.00 1 99 THR 4.13 2.82 1 100 ILE 3.73 2.54 1 101 HIS -3.33 1.53 1 102 THR 1.99 1.54 1 104 VAL -0.67 -0.82 1 107 ILE 4.20 3.26 1 108 LEU 3.45 2.24 1 110 ARG 5.37 4.44 1 111 SER 3.80 3.08 1 112 LEU 3.74 3.00 1 113 ARG 4.07 3.78 1 114 GLN 3.24 2.49 1 115 MET 2.31 2.36 1 116 ALA 0.80 0.98 1 117 GLN 0.75 0.56 1 125 TYR -1.82 -1.67 1 126 GLU 3.99 3.52 1 127 ASP 4.77 1.93 1 128 LEU 2.64 1.72 1 129 ASP 4.52 3.27 1 130 GLU 3.10 2.58 1 131 LEU 2.49 2.03 1 132 GLN 3.07 2.51 1 133 LYS 1.64 1.85 1 134 GLU -2.60 -1.22 1 136 GLN -2.33 -0.17 1 138 LEU -6.95 -1.70 1 139 VAL -4.27 -2.58 1 140 PHE -5.60 -2.47 1 141 VAL -0.56 -0.19 1 142 ILE -4.09 -1.08 1 143 GLU -6.57 -3.03 1 144 LEU 1.79 0.37 1 145 LEU 0.96 1.53 1 146 GLN -1.63 0.87 1 147 VAL -2.50 -0.85 1 148 ASP -3.94 -1.59 1 149 ALA 0.57 -0.02 1 151 SER -0.68 -0.15 1 152 ASP 0.72 1.84 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26947_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 4.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 9.98 _LACS_plot.Line_2_terminator_val_y_2 -2.48 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 TYR 9.99 -1.04 0 10 ASP 0.57 0.10 1 11 ALA 0.78 0.06 1 12 ALA 0.19 0.18 1 13 LEU 0.28 -0.13 1 14 LEU 1.01 -0.85 1 15 LEU 0.26 0.15 1 16 ASN 1.20 -0.89 1 17 VAL -1.49 0.55 1 18 GLU 0.54 0.10 1 20 VAL -3.98 2.54 1 21 LYS -3.84 2.92 1 22 LYS -4.11 3.11 1 23 THR -1.66 1.60 1 24 ILE 3.68 -1.11 1 25 LEU 1.13 -0.38 1 26 HIS -3.14 4.03 1 29 THR -2.09 1.17 1 31 GLU -2.05 0.83 1 32 LEU 0.01 -0.52 1 34 ASN -0.46 -1.02 1 35 PHE 1.73 -0.70 1 36 ILE -5.39 3.70 1 37 THR 4.38 -0.40 1 39 SER 4.11 -0.32 1 40 ARG -2.54 1.51 1 41 VAL -0.76 0.54 1 42 ILE -1.17 0.77 1 43 PHE -3.40 1.98 1 44 HIS -6.89 6.65 1 45 PHE -6.39 4.94 1 46 ARG -5.08 3.87 1 47 THR -1.57 0.84 1 48 MET -5.62 4.07 1 49 LYS -0.87 1.24 1 51 ASP -1.71 -0.65 1 52 GLU 4.06 -0.55 1 53 GLU 0.42 -0.40 1 54 ARG 3.37 -3.40 1 55 THR 4.07 -0.75 1 56 VAL 1.41 -0.37 1 57 ILE 0.72 -0.33 1 58 ASP -5.30 5.31 1 59 ASP -2.49 1.91 1 60 SER 6.74 -2.37 1 61 ARG 4.91 -1.64 1 62 GLN 3.33 -1.07 1 63 VAL 3.11 -1.05 1 65 GLN -2.91 1.83 1 67 MET -2.89 0.46 1 68 HIS -4.79 4.58 1 69 ILE -6.63 4.10 1 70 ILE -2.66 0.08 1 71 ILE 1.82 -2.82 1 84 LEU 3.06 0.15 1 85 THR 2.01 -1.41 1 86 SER -1.65 1.76 1 87 MET -1.14 2.64 1 88 ARG -2.78 1.70 1 89 VAL 6.83 -2.28 1 90 HIS 4.77 -1.07 1 91 GLU -4.06 4.08 1 92 VAL -1.59 0.22 1 93 ALA -6.83 4.88 1 94 GLU -5.69 3.38 1 95 PHE -3.84 2.03 1 96 TRP -0.22 0.85 1 98 ASP -3.62 2.62 1 99 THR 4.13 -1.31 1 100 ILE 3.73 -1.19 1 101 HIS -3.33 4.86 1 102 THR 1.99 -0.45 1 104 VAL -0.67 -0.15 1 107 ILE 4.20 -0.94 1 108 LEU 3.45 -1.21 1 110 ARG 5.37 -0.93 1 111 SER 3.80 -0.72 1 112 LEU 3.74 -0.74 1 113 ARG 4.07 -0.29 1 114 GLN 3.24 -0.75 1 115 MET 2.31 0.05 1 116 ALA 0.80 0.18 1 117 GLN 0.75 -0.19 1 125 TYR -1.82 0.15 1 126 GLU 3.99 -0.47 1 127 ASP 4.77 -2.84 1 128 LEU 2.64 -0.92 1 129 ASP 4.52 -1.25 1 130 GLU 3.10 -0.52 1 131 LEU 2.49 -0.46 1 132 GLN 3.07 -0.56 1 133 LYS 1.64 0.21 1 134 GLU -2.60 1.38 1 136 GLN -2.33 2.16 1 138 LEU -6.95 5.25 1 139 VAL -4.27 1.69 1 140 PHE -5.60 3.13 1 141 VAL -0.56 0.37 1 142 ILE -4.09 3.01 1 143 GLU -6.57 3.54 1 144 LEU 1.79 -1.42 1 145 LEU 0.96 0.57 1 146 GLN -1.63 2.50 1 147 VAL -2.50 1.65 1 148 ASP -3.94 2.35 1 149 ALA 0.57 -0.59 1 151 SER -0.68 0.53 1 152 ASP 0.72 1.12 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26947_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 0.90 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 9.98 _LACS_plot.Line_2_terminator_val_y_2 -1.14 _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 85 THR 2.01 -1.52 0 10 ASP 0.57 -0.08 1 11 ALA 0.78 -0.11 1 12 ALA 0.19 0.02 1 13 LEU 0.28 -0.02 1 14 LEU 1.01 -0.09 1 15 LEU 0.26 -0.07 1 16 ASN 1.20 -0.02 1 17 VAL -1.49 0.05 1 18 GLU 0.54 -0.03 1 20 VAL -3.98 1.52 1 21 LYS -3.84 0.60 1 22 LYS -4.11 0.69 1 23 THR -1.66 0.03 1 24 ILE 3.68 -0.36 1 25 LEU 1.13 0.00 1 26 HIS -3.14 -0.09 1 29 THR -2.09 0.25 1 31 GLU -2.05 -0.01 1 32 LEU 0.01 -0.03 1 34 ASN -0.46 -0.08 1 35 PHE 1.73 -0.46 1 36 ILE -5.39 0.45 1 37 THR 4.38 -0.80 1 39 SER 4.11 -0.08 1 40 ARG -2.54 0.79 1 41 VAL -0.76 0.55 1 42 ILE -1.17 1.08 1 43 PHE -3.40 0.92 1 44 HIS -6.89 0.73 1 45 PHE -6.39 1.56 1 46 ARG -5.08 0.68 1 47 THR -1.57 0.65 1 48 MET -5.62 0.82 1 49 LYS -0.87 -0.03 1 51 ASP -1.71 0.02 1 52 GLU 4.06 -0.46 1 53 GLU 0.42 -0.30 1 54 ARG 3.37 -0.24 1 55 THR 4.07 -0.77 1 56 VAL 1.41 -0.04 1 57 ILE 0.72 -0.07 1 58 ASP -5.30 0.38 1 59 ASP -2.49 0.33 1 60 SER 6.74 -0.50 1 61 ARG 4.91 -0.74 1 62 GLN 3.33 -0.34 1 63 VAL 3.11 -0.18 1 65 GLN -2.91 0.20 1 67 MET -2.89 -0.03 1 68 HIS -4.79 1.06 1 69 ILE -6.63 0.51 1 70 ILE -2.66 0.86 1 71 ILE 1.82 -0.06 1 84 LEU 3.06 -0.78 1 86 SER -1.65 0.06 1 87 MET -1.14 0.03 1 88 ARG -2.78 -0.03 1 89 VAL 6.83 -0.94 1 90 HIS 4.77 -0.31 1 91 GLU -4.06 0.10 1 92 VAL -1.59 1.15 1 93 ALA -6.83 0.69 1 94 GLU -5.69 0.98 1 95 PHE -3.84 0.97 1 96 TRP -0.22 0.29 1 98 ASP -3.62 -0.63 1 99 THR 4.13 -0.49 1 100 ILE 3.73 -0.23 1 101 HIS -3.33 0.37 1 102 THR 1.99 -0.15 1 104 VAL -0.67 0.25 1 105 TYR 9.99 -0.50 1 107 ILE 4.20 -0.55 1 108 LEU 3.45 -0.55 1 110 ARG 5.37 -0.75 1 111 SER 3.80 -0.56 1 112 LEU 3.74 -0.22 1 113 ARG 4.07 -0.37 1 114 GLN 3.24 -0.22 1 115 MET 2.31 -0.26 1 116 ALA 0.80 -0.04 1 117 GLN 0.75 0.00 1 125 TYR -1.82 0.26 1 126 GLU 3.99 -0.26 1 127 ASP 4.77 -0.31 1 128 LEU 2.64 -0.17 1 129 ASP 4.52 -0.32 1 130 GLU 3.10 -0.34 1 131 LEU 2.49 -0.25 1 132 GLN 3.07 -0.30 1 133 LYS 1.64 -0.21 1 134 GLU -2.60 0.03 1 136 GLN -2.33 0.20 1 138 LEU -6.95 0.34 1 139 VAL -4.27 0.86 1 140 PHE -5.60 1.24 1 141 VAL -0.56 1.17 1 142 ILE -4.09 1.09 1 143 GLU -6.57 1.29 1 144 LEU 1.79 0.23 1 145 LEU 0.96 0.19 1 146 GLN -1.63 -0.08 1 147 VAL -2.50 0.86 1 148 ASP -3.94 0.44 1 149 ALA 0.57 -0.08 1 151 SER -0.68 -0.06 1 152 ASP 0.72 -0.29 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26947_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -2.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.81 _LACS_plot.Line_2_terminator_val_x_2 9.98 _LACS_plot.Line_2_terminator_val_y_2 2.72 _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 105 TYR 9.99 -2.26 0 10 ASP 0.57 0.38 1 11 ALA 0.78 0.02 1 12 ALA 0.19 -0.09 1 13 LEU 0.28 -0.47 1 14 LEU 1.01 -0.88 1 15 LEU 0.26 -0.79 1 16 ASN 1.20 -1.19 1 17 VAL -1.49 -1.61 1 18 GLU 0.54 1.61 1 20 VAL -3.98 -0.67 1 21 LYS -3.84 -1.73 1 22 LYS -4.11 -1.54 1 23 THR -1.66 -1.17 1 24 ILE 3.68 -1.22 1 25 LEU 1.13 -0.39 1 26 HIS -3.14 0.27 1 29 THR -2.09 -0.16 1 31 GLU -2.05 0.05 1 32 LEU 0.01 -2.32 1 34 ASN -0.46 -0.94 1 35 PHE 1.73 -1.54 1 37 THR 4.38 -0.04 1 39 SER 4.11 -2.68 1 40 ARG -2.54 -1.52 1 41 VAL -0.76 -2.08 1 42 ILE -1.17 -0.32 1 43 PHE -3.40 -3.51 1 44 HIS -6.89 1.97 1 45 PHE -6.39 -4.12 1 46 ARG -5.08 -2.01 1 47 THR -1.57 -0.27 1 48 MET -5.62 -1.60 1 49 LYS -0.87 -0.53 1 51 ASP -1.71 0.83 1 52 GLU 4.06 1.83 1 53 GLU 0.42 -1.37 1 54 ARG 3.37 -0.80 1 55 THR 4.07 0.53 1 56 VAL 1.41 -0.15 1 57 ILE 0.72 -1.57 1 58 ASP -5.30 -1.95 1 59 ASP -2.49 1.00 1 60 SER 6.74 2.09 1 61 ARG 4.91 2.96 1 62 GLN 3.33 1.61 1 63 VAL 3.11 1.14 1 65 GLN -2.91 -2.88 1 67 MET -2.89 -2.50 1 68 HIS -4.79 0.77 1 69 ILE -6.63 -2.53 1 70 ILE -2.66 0.66 1 71 ILE 1.82 1.65 1 84 LEU 3.06 -0.44 1 85 THR 2.01 -1.63 1 86 SER -1.65 -0.50 1 87 MET -1.14 -2.84 1 88 ARG -2.78 0.57 1 89 VAL 6.83 -0.06 1 90 HIS 4.77 0.14 1 91 GLU -4.06 -1.62 1 92 VAL -1.59 -0.45 1 93 ALA -6.83 -4.74 1 94 GLU -5.69 -1.50 1 95 PHE -3.84 -0.96 1 96 TRP -0.22 0.03 1 98 ASP -3.62 -0.09 1 99 THR 4.13 1.13 1 100 ILE 3.73 -0.09 1 101 HIS -3.33 3.76 1 102 THR 1.99 2.61 1 104 VAL -0.67 0.32 1 107 ILE 4.20 2.09 1 108 LEU 3.45 1.05 1 110 ARG 5.37 2.00 1 111 SER 3.80 2.11 1 112 LEU 3.74 2.00 1 113 ARG 4.07 2.88 1 114 GLN 3.24 2.21 1 115 MET 2.31 1.17 1 116 ALA 0.80 0.46 1 117 GLN 0.75 0.98 1 125 TYR -1.82 -0.06 1 126 GLU 3.99 1.51 1 127 ASP 4.77 2.73 1 128 LEU 2.64 1.26 1 129 ASP 4.52 2.91 1 130 GLU 3.10 2.09 1 131 LEU 2.49 1.12 1 132 GLN 3.07 1.32 1 133 LYS 1.64 -0.29 1 134 GLU -2.60 -4.30 1 136 GLN -2.33 -2.47 1 138 LEU -6.95 -3.96 1 139 VAL -4.27 -2.57 1 140 PHE -5.60 0.76 1 141 VAL -0.56 0.12 1 142 ILE -4.09 -2.99 1 143 GLU -6.57 -1.12 1 144 LEU 1.79 -1.52 1 145 LEU 0.96 -0.37 1 146 GLN -1.63 -3.53 1 147 VAL -2.50 -1.57 1 148 ASP -3.94 -0.97 1 149 ALA 0.57 -0.03 1 151 SER -0.68 -1.13 1 152 ASP 0.72 4.52 1 stop_ save_