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 bmr6332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 -3.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.51 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 5.27 _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 137 ILE -6.06 -2.40 0 15 ASP -0.25 -2.30 0 10 ILE 4.29 2.50 1 11 PHE 5.57 5.30 1 12 THR 5.16 4.30 1 13 LEU 3.20 2.00 1 14 PHE 1.10 1.70 1 16 LYS 3.35 2.30 1 17 LYS 0.80 -0.50 1 19 GLN -0.90 -0.20 1 21 ALA -4.30 -1.30 1 22 ILE -5.06 -2.70 1 23 ALA 0.60 -0.10 1 24 LYS 5.45 4.10 1 25 ASP 2.57 1.50 1 26 SER 0.20 0.70 1 27 LEU 4.69 3.23 1 29 ASP 4.16 2.86 1 30 TYR 5.31 4.00 1 31 LEU 3.32 2.20 1 32 ARG 1.99 1.60 1 33 ALA 2.60 2.00 1 34 ILE 2.30 0.30 1 36 TYR -1.29 -0.96 1 37 ASN -0.52 0.10 1 39 THR -2.24 -1.40 1 40 ASN 4.74 2.87 1 41 GLN 4.07 2.80 1 42 LEU 4.38 2.70 1 43 VAL 7.13 5.20 1 44 GLN 4.10 2.70 1 45 ASP 4.59 3.20 1 46 ILE 5.60 4.30 1 47 ILE 3.96 2.90 1 48 ASN 2.20 1.40 1 49 ALA 0.70 0.60 1 50 ASP -3.30 -1.90 1 51 SER 4.33 3.11 1 52 SER 3.24 2.44 1 53 LEU 0.56 0.00 1 54 ARG 4.15 3.60 1 55 ASP -0.26 -0.40 1 56 ALA -0.80 -0.40 1 57 SER 0.70 0.70 1 58 SER -3.10 -1.60 1 59 LEU -5.69 -2.20 1 60 THR -2.98 -1.80 1 61 LEU 5.80 2.80 1 62 ASP 4.03 3.00 1 63 GLN 3.95 2.80 1 64 ILE 5.34 4.50 1 65 THR 6.97 5.40 1 67 LEU 3.15 2.50 1 68 ILE 5.47 4.43 1 69 GLU 3.48 3.10 1 70 VAL 3.54 2.95 1 71 ASN -0.40 0.10 1 72 GLU 4.54 4.70 1 73 LYS 5.02 3.40 1 74 GLU 4.00 2.90 1 75 LEU 4.56 2.00 1 76 ASP 3.64 3.00 1 77 ALA 2.70 1.70 1 78 THR 1.45 1.00 1 79 THR 0.76 0.70 1 80 LYS 0.30 0.00 1 81 ALA 0.30 0.20 1 82 LYS 0.50 0.00 1 83 THR 3.64 2.84 1 84 GLU 2.04 1.60 1 85 ASP 2.47 1.50 1 86 PHE 2.76 2.40 1 87 VAL 5.96 4.70 1 88 LYS 3.80 2.60 1 89 ALA 2.90 1.90 1 90 PHE 4.21 3.10 1 91 GLN 4.20 2.90 1 92 VAL 3.57 2.30 1 93 PHE 0.32 0.60 1 94 ASP -0.99 -2.10 1 95 LYS 3.70 2.80 1 96 GLU -0.17 -1.10 1 97 SER 3.24 0.44 1 98 THR -0.23 0.60 1 100 LYS -5.58 -2.40 1 101 VAL -6.86 -3.60 1 102 SER -1.08 -0.50 1 103 VAL 5.23 3.90 1 105 ASP 4.01 2.50 1 106 LEU 4.53 3.13 1 107 ARG 5.74 4.50 1 108 TYR 3.86 2.90 1 109 MET 3.34 2.80 1 110 LEU 2.05 2.00 1 111 THR 2.06 2.00 1 113 LEU -0.22 -0.10 1 115 GLU 0.40 -0.10 1 116 LYS 2.47 0.50 1 117 LEU -2.36 -0.90 1 118 THR -2.70 -1.40 1 119 ASP 4.73 3.70 1 120 ALA 3.10 2.10 1 121 GLU 1.87 2.30 1 122 VAL 6.61 5.00 1 123 ASP 4.70 3.30 1 124 GLU 2.91 2.30 1 125 LEU 2.33 2.30 1 126 LEU 1.24 0.40 1 127 LYS 4.00 2.60 1 129 VAL -0.65 -0.80 1 130 GLU -0.10 -0.20 1 131 VAL -1.77 -1.54 1 132 ASP -1.39 -1.40 1 133 SER 3.33 2.48 1 134 ASN -0.82 -0.70 1 136 GLU -4.68 -1.60 1 138 ASP -1.29 -1.60 1 139 TYR 3.60 1.50 1 140 LYS 6.31 4.30 1 141 LYS 3.35 2.40 1 142 PHE 3.72 3.60 1 143 ILE 4.48 3.90 1 144 GLU 2.58 2.40 1 145 ASP 1.94 1.80 1 146 VAL 2.49 1.90 1 147 LEU 1.87 0.90 1 148 ARG 1.57 0.10 1 149 GLN 0.40 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 3.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.49 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 -1.86 _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 137 ILE -6.06 3.66 0 15 ASP -0.25 -2.05 0 10 ILE 4.29 -1.79 1 11 PHE 5.57 -0.27 1 12 THR 5.16 -0.86 1 13 LEU 3.20 -1.20 1 14 PHE 1.10 0.60 1 16 LYS 3.35 -1.05 1 17 LYS 0.80 -1.30 1 19 GLN -0.90 0.70 1 21 ALA -4.30 3.00 1 22 ILE -5.06 2.36 1 23 ALA 0.60 -0.70 1 24 LYS 5.45 -1.35 1 25 ASP 2.57 -1.07 1 26 SER 0.20 0.50 1 27 LEU 4.69 -1.46 1 29 ASP 4.16 -1.30 1 30 TYR 5.31 -1.31 1 31 LEU 3.32 -1.12 1 32 ARG 1.99 -0.39 1 33 ALA 2.60 -0.60 1 34 ILE 2.30 -2.00 1 36 TYR -1.29 0.33 1 37 ASN -0.52 0.62 1 39 THR -2.24 0.84 1 40 ASN 4.74 -1.87 1 41 GLN 4.07 -1.27 1 42 LEU 4.38 -1.68 1 43 VAL 7.13 -1.93 1 44 GLN 4.10 -1.40 1 45 ASP 4.59 -1.39 1 46 ILE 5.60 -1.30 1 47 ILE 3.96 -1.06 1 48 ASN 2.20 -0.80 1 49 ALA 0.70 -0.10 1 50 ASP -3.30 1.40 1 51 SER 4.33 -1.22 1 52 SER 3.24 -0.80 1 53 LEU 0.56 -0.56 1 54 ARG 4.15 -0.55 1 55 ASP -0.26 -0.14 1 56 ALA -0.80 0.40 1 57 SER 0.70 0.00 1 58 SER -3.10 1.50 1 59 LEU -5.69 3.49 1 60 THR -2.98 1.18 1 61 LEU 5.80 -3.00 1 62 ASP 4.03 -1.03 1 63 GLN 3.95 -1.15 1 64 ILE 5.34 -0.84 1 65 THR 6.97 -1.57 1 67 LEU 3.15 -0.65 1 68 ILE 5.47 -1.04 1 69 GLU 3.48 -0.38 1 70 VAL 3.54 -0.59 1 71 ASN -0.40 0.50 1 72 GLU 4.54 0.16 1 73 LYS 5.02 -1.62 1 74 GLU 4.00 -1.10 1 75 LEU 4.56 -2.56 1 76 ASP 3.64 -0.64 1 77 ALA 2.70 -1.00 1 78 THR 1.45 -0.45 1 79 THR 0.76 -0.06 1 80 LYS 0.30 -0.30 1 81 ALA 0.30 -0.10 1 82 LYS 0.50 -0.50 1 83 THR 3.64 -0.80 1 84 GLU 2.04 -0.44 1 85 ASP 2.47 -0.97 1 86 PHE 2.76 -0.36 1 87 VAL 5.96 -1.26 1 88 LYS 3.80 -1.20 1 89 ALA 2.90 -1.00 1 90 PHE 4.21 -1.11 1 91 GLN 4.20 -1.30 1 92 VAL 3.57 -1.27 1 93 PHE 0.32 0.28 1 94 ASP -0.99 -1.11 1 95 LYS 3.70 -0.90 1 96 GLU -0.17 -0.93 1 97 SER 3.24 -2.80 1 98 THR -0.23 0.83 1 100 LYS -5.58 3.18 1 101 VAL -6.86 3.26 1 102 SER -1.08 0.58 1 103 VAL 5.23 -1.33 1 105 ASP 4.01 -1.51 1 106 LEU 4.53 -1.40 1 107 ARG 5.74 -1.24 1 108 TYR 3.86 -0.96 1 109 MET 3.34 -0.54 1 110 LEU 2.05 -0.05 1 111 THR 2.06 -0.06 1 113 LEU -0.22 0.12 1 115 GLU 0.40 -0.50 1 116 LYS 2.47 -1.97 1 117 LEU -2.36 1.46 1 118 THR -2.70 1.30 1 119 ASP 4.73 -1.03 1 120 ALA 3.10 -1.00 1 121 GLU 1.87 0.43 1 122 VAL 6.61 -1.61 1 123 ASP 4.70 -1.40 1 124 GLU 2.91 -0.61 1 125 LEU 2.33 -0.03 1 126 LEU 1.24 -0.84 1 127 LYS 4.00 -1.40 1 129 VAL -0.65 -0.15 1 130 GLU -0.10 -0.10 1 131 VAL -1.77 0.23 1 132 ASP -1.39 -0.01 1 133 SER 3.33 -0.85 1 134 ASN -0.82 0.12 1 136 GLU -4.68 3.08 1 138 ASP -1.29 -0.31 1 139 TYR 3.60 -2.10 1 140 LYS 6.31 -2.01 1 141 LYS 3.35 -0.95 1 142 PHE 3.72 -0.12 1 143 ILE 4.48 -0.58 1 144 GLU 2.58 -0.18 1 145 ASP 1.94 -0.14 1 146 VAL 2.49 -0.59 1 147 LEU 1.87 -0.97 1 148 ARG 1.57 -1.47 1 149 GLN 0.40 0.90 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 0.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _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 32 ARG 1.99 0.61 0 10 ILE 4.29 -0.29 1 11 PHE 5.57 -0.61 1 12 THR 5.16 -0.45 1 13 LEU 3.20 -0.41 1 14 PHE 1.10 -0.46 1 15 ASP -0.25 0.06 1 16 LYS 3.35 -0.31 1 17 LYS 0.80 0.01 1 19 GLN -0.90 -0.01 1 21 ALA -4.30 0.66 1 22 ILE -5.06 0.42 1 23 ALA 0.60 -0.04 1 24 LYS 5.45 -0.66 1 25 ASP 2.57 -0.19 1 26 SER 0.20 0.28 1 27 LEU 4.69 -0.51 1 29 ASP 4.16 -0.29 1 30 TYR 5.31 -1.15 1 31 LEU 3.32 -0.47 1 33 ALA 2.60 -0.18 1 34 ILE 2.30 0.06 1 36 TYR -1.29 0.07 1 37 ASN -0.52 0.21 1 39 THR -2.24 0.02 1 40 ASN 4.74 -0.43 1 41 GLN 4.07 -0.55 1 42 LEU 4.38 -0.20 1 43 VAL 7.13 -1.00 1 44 GLN 4.10 -0.52 1 45 ASP 4.59 -0.37 1 46 ILE 5.60 -0.44 1 47 ILE 3.96 -0.54 1 48 ASN 2.20 -0.42 1 49 ALA 0.70 -0.18 1 50 ASP -3.30 0.20 1 51 SER 4.33 -0.53 1 52 SER 3.24 -0.13 1 53 LEU 0.56 -0.03 1 54 ARG 4.15 -0.56 1 55 ASP -0.26 0.05 1 56 ALA -0.80 0.08 1 57 SER 0.70 0.10 1 58 SER -3.10 0.54 1 59 LEU -5.69 0.80 1 60 THR -2.98 0.44 1 61 LEU 5.80 -0.89 1 62 ASP 4.03 -0.41 1 63 GLN 3.95 -0.41 1 64 ILE 5.34 -0.71 1 65 THR 6.97 -0.64 1 67 LEU 3.15 -0.29 1 68 ILE 5.47 -0.93 1 69 GLU 3.48 -0.46 1 70 VAL 3.54 -0.31 1 71 ASN -0.40 0.31 1 72 GLU 4.54 -0.81 1 73 LYS 5.02 -0.30 1 74 GLU 4.00 -0.36 1 75 LEU 4.56 -0.55 1 76 ASP 3.64 -0.03 1 77 ALA 2.70 -0.12 1 78 THR 1.45 0.08 1 79 THR 0.76 -0.01 1 80 LYS 0.30 -0.03 1 81 ALA 0.30 -0.11 1 82 LYS 0.50 0.02 1 83 THR 3.64 -0.34 1 84 GLU 2.04 -0.28 1 85 ASP 2.47 -0.20 1 86 PHE 2.76 -0.30 1 87 VAL 5.96 -0.50 1 88 LYS 3.80 -0.27 1 89 ALA 2.90 -0.27 1 90 PHE 4.21 -0.53 1 91 GLN 4.20 -0.39 1 92 VAL 3.57 -0.54 1 93 PHE 0.32 -0.15 1 94 ASP -0.99 0.45 1 95 LYS 3.70 -0.26 1 96 GLU -0.17 0.08 1 97 SER 3.24 -0.40 1 98 THR -0.23 -0.11 1 100 LYS -5.58 1.14 1 101 VAL -6.86 0.69 1 102 SER -1.08 0.15 1 103 VAL 5.23 -0.61 1 105 ASP 4.01 -0.32 1 106 LEU 4.53 -0.49 1 107 ARG 5.74 -0.74 1 108 TYR 3.86 -0.43 1 109 MET 3.34 -0.73 1 110 LEU 2.05 -0.28 1 111 THR 2.06 -0.05 1 113 LEU -0.22 -0.04 1 115 GLU 0.40 -0.17 1 116 LYS 2.47 -0.29 1 117 LEU -2.36 0.20 1 118 THR -2.70 0.06 1 119 ASP 4.73 -0.48 1 120 ALA 3.10 -0.20 1 121 GLU 1.87 -0.40 1 122 VAL 6.61 -0.70 1 123 ASP 4.70 -0.45 1 124 GLU 2.91 -0.37 1 125 LEU 2.33 -0.29 1 126 LEU 1.24 -0.24 1 127 LYS 4.00 -0.31 1 129 VAL -0.65 -0.02 1 130 GLU -0.10 -0.15 1 131 VAL -1.77 0.11 1 132 ASP -1.39 -0.01 1 133 SER 3.33 -0.34 1 134 ASN -0.82 0.15 1 136 GLU -4.68 0.51 1 137 ILE -6.06 0.27 1 138 ASP -1.29 0.12 1 139 TYR 3.60 -0.42 1 140 LYS 6.31 -0.43 1 141 LYS 3.35 -0.37 1 142 PHE 3.72 -0.45 1 143 ILE 4.48 -0.87 1 144 GLU 2.58 -0.49 1 145 ASP 1.94 -0.18 1 146 VAL 2.49 -0.27 1 147 LEU 1.87 -0.27 1 148 ARG 1.57 -0.14 1 149 GLN 0.40 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 -1.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.48 _LACS_plot.Line_2_terminator_val_x_2 7.13 _LACS_plot.Line_2_terminator_val_y_2 2.01 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 149 GLN 0.40 4.30 0 10 ILE 4.29 1.10 1 11 PHE 5.57 1.00 1 12 THR 5.16 0.90 1 13 LEU 3.20 0.70 1 14 PHE 1.10 -0.30 1 15 ASP -0.25 0.20 1 16 LYS 3.35 1.80 1 17 LYS 0.80 0.30 1 19 GLN -0.90 0.90 1 21 ALA -4.30 -2.80 1 22 ILE -5.06 -1.70 1 23 ALA 0.60 1.50 1 24 LYS 5.45 1.40 1 25 ASP 2.57 0.70 1 26 SER 0.20 -1.10 1 27 LEU 4.69 0.01 1 29 ASP 4.16 2.46 1 30 TYR 5.31 -0.17 1 31 LEU 3.32 1.00 1 32 ARG 1.99 3.90 1 33 ALA 2.60 1.50 1 34 ILE 2.30 -0.60 1 36 TYR -1.29 -2.90 1 37 ASN -0.52 -1.80 1 39 THR -2.24 0.50 1 40 ASN 4.74 2.65 1 41 GLN 4.07 0.30 1 42 LEU 4.38 0.40 1 43 VAL 7.13 0.30 1 44 GLN 4.10 1.83 1 45 ASP 4.59 3.35 1 46 ILE 5.60 1.50 1 47 ILE 3.96 0.50 1 48 ASN 2.20 1.20 1 49 ALA 0.70 -1.30 1 50 ASP -3.30 -0.20 1 51 SER 4.33 0.90 1 52 SER 3.24 1.00 1 53 LEU 0.56 0.73 1 54 ARG 4.15 0.50 1 55 ASP -0.26 -0.70 1 56 ALA -0.80 -0.50 1 57 SER 0.70 0.11 1 58 SER -3.10 -3.32 1 59 LEU -5.69 -1.50 1 60 THR -2.98 0.10 1 61 LEU 5.80 1.40 1 62 ASP 4.03 2.90 1 63 GLN 3.95 3.44 1 64 ILE 5.34 0.30 1 65 THR 6.97 1.80 1 67 LEU 3.15 2.42 1 68 ILE 5.47 0.06 1 69 GLU 3.48 3.66 1 70 VAL 3.54 0.65 1 71 ASN -0.40 -0.60 1 72 GLU 4.54 0.78 1 73 LYS 5.02 3.00 1 74 GLU 4.00 2.87 1 75 LEU 4.56 2.20 1 76 ASP 3.64 2.20 1 77 ALA 2.70 0.90 1 78 THR 1.45 0.50 1 79 THR 0.76 -0.40 1 80 LYS 0.30 -0.35 1 81 ALA 0.30 -0.20 1 82 LYS 0.50 0.72 1 83 THR 3.64 0.63 1 84 GLU 2.04 0.59 1 85 ASP 2.47 1.60 1 86 PHE 2.76 1.00 1 87 VAL 5.96 1.60 1 88 LYS 3.80 1.70 1 89 ALA 2.90 1.50 1 90 PHE 4.21 1.70 1 91 GLN 4.20 1.50 1 92 VAL 3.57 0.00 1 93 PHE 0.32 -0.60 1 94 ASP -0.99 0.20 1 95 LYS 3.70 1.60 1 96 GLU -0.17 -1.20 1 97 SER 3.24 0.40 1 98 THR -0.23 2.30 1 100 LYS -5.58 -1.10 1 101 VAL -6.86 -2.20 1 102 SER -1.08 0.60 1 103 VAL 5.23 1.00 1 105 ASP 4.01 1.20 1 106 LEU 4.53 0.20 1 107 ARG 5.74 2.00 1 108 TYR 3.86 2.10 1 109 MET 3.34 2.10 1 110 LEU 2.05 0.80 1 111 THR 2.06 1.40 1 113 LEU -0.22 -0.20 1 115 GLU 0.40 -0.90 1 116 LYS 2.47 -0.90 1 117 LEU -2.36 -0.30 1 118 THR -2.70 0.40 1 119 ASP 4.73 1.40 1 120 ALA 3.10 2.80 1 121 GLU 1.87 3.00 1 122 VAL 6.61 0.60 1 123 ASP 4.70 2.80 1 124 GLU 2.91 2.45 1 125 LEU 2.33 1.10 1 126 LEU 1.24 0.60 1 127 LYS 4.00 1.00 1 129 VAL -0.65 -1.60 1 130 GLU -0.10 -1.80 1 131 VAL -1.77 -0.20 1 132 ASP -1.39 2.10 1 133 SER 3.33 0.20 1 134 ASN -0.82 0.10 1 136 GLU -4.68 -1.70 1 137 ILE -6.06 -1.90 1 138 ASP -1.29 0.00 1 139 TYR 3.60 0.20 1 140 LYS 6.31 2.00 1 141 LYS 3.35 0.90 1 142 PHE 3.72 1.10 1 143 ILE 4.48 0.20 1 144 GLU 2.58 1.30 1 145 ASP 1.94 1.20 1 146 VAL 2.49 0.30 1 147 LEU 1.87 -0.50 1 148 ARG 1.57 -1.30 1 stop_ save_