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 bmr5813_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 -5.35 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.19 _LACS_plot.Line_2_terminator_val_x_2 7.02 _LACS_plot.Line_2_terminator_val_y_2 2.77 _LACS_plot.Y_axis_chem_shift_offset 2.65 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 ASN -4.80 -3.25 0 112 GLU 3.68 -2.05 0 55 THR -0.15 -4.44 0 10 MET -4.96 -3.67 1 11 GLN -0.94 -3.66 1 12 VAL -4.88 -4.84 1 13 SER -3.27 -4.07 1 15 MET 0.36 -1.48 1 16 THR -0.46 -1.93 1 19 ALA 3.87 0.17 1 21 ALA 3.55 -0.15 1 22 ALA 3.24 -0.46 1 23 ARG 4.34 0.74 1 24 ILE 4.94 1.90 1 25 GLU 4.30 1.70 1 26 LYS 4.15 0.54 1 28 LEU 2.64 -0.24 1 29 LYS 3.83 0.54 1 30 ARG -0.36 -3.02 1 31 MET 0.08 -1.57 1 34 VAL 2.33 -1.39 1 35 THR 2.36 -0.99 1 37 ALA -4.90 -3.59 1 39 VAL -0.80 -3.58 1 40 ASN -1.98 -4.50 1 41 LEU 2.64 0.07 1 42 ALA 3.24 -0.15 1 43 THR -0.45 -4.12 1 44 GLU 3.99 -1.43 1 45 THR -2.33 -2.87 1 46 VAL -3.94 -4.84 1 47 ASN -2.93 -3.25 1 49 ILE -1.32 -3.74 1 50 TYR -5.95 -5.23 1 51 ASP -3.79 -5.17 1 53 ALA 1.05 -2.02 1 54 GLU -4.78 -3.31 1 57 THR 6.12 1.51 1 58 ALA 4.49 0.17 1 59 ALA 3.24 -0.77 1 60 ILE 4.94 1.90 1 61 GLN 5.64 1.35 1 62 GLU 3.04 -0.18 1 63 LYS 4.77 -1.03 1 64 ILE 6.51 2.53 1 66 LYS 3.21 -0.40 1 67 LEU 0.45 -2.12 1 69 TYR -2.50 -4.29 1 70 HIS -2.51 -3.27 1 71 VAL 1.70 -2.02 1 72 VAL 2.02 -1.39 1 73 THR -3.90 -5.06 1 74 GLU -5.72 -5.19 1 75 LYS -4.31 -4.47 1 76 ALA -5.22 -4.53 1 77 GLU -3.53 -4.25 1 78 PHE -4.32 -4.09 1 79 ASP -1.51 -2.16 1 80 ILE -3.20 -3.74 1 84 THR -0.77 -2.24 1 89 ALA 2.92 -0.15 1 90 ASN 3.03 0.51 1 91 ARG 3.71 0.74 1 92 ILE 4.94 2.21 1 93 GLU 3.68 1.08 1 94 LYS 3.83 0.54 1 96 LEU 2.95 0.07 1 97 ASN 1.77 -0.43 1 98 LYS 0.08 -2.59 1 99 ILE 2.44 -1.86 1 100 GLU 3.36 -0.49 1 102 VAL 2.96 -0.76 1 103 ALA -0.51 -2.02 1 105 ALA -2.65 -2.53 1 107 VAL 1.08 -2.33 1 108 ASN -1.98 -4.50 1 109 PHE 3.50 0.60 1 110 ALA 3.24 -0.46 1 111 LEU -0.80 -4.00 1 113 THR -6.10 -5.38 1 115 THR -0.14 -3.18 1 117 GLU -3.52 -4.87 1 118 TYR -5.95 -5.55 1 119 ASN -5.08 -4.58 1 121 LYS 1.64 -2.91 1 122 GLU -4.78 -3.31 1 123 ALA -3.97 -4.22 1 124 SER -6.71 -5.63 1 125 VAL 7.03 2.68 1 126 SER 5.50 1.26 1 127 ASP 3.50 0.66 1 128 LEU 4.52 -0.24 1 129 LYS 4.15 1.48 1 131 ALA 3.24 -0.46 1 132 VAL 5.15 1.43 1 133 ASP 2.24 0.03 1 137 TYR -3.75 -5.23 1 139 LEU -2.99 -4.62 1 141 LEU 0.45 -2.12 1 142 LYS 2.27 -1.34 1 144 GLU -0.08 -2.37 1 145 GLN -0.00 -2.72 1 146 ASP 0.68 -2.16 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5813_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 1.36 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -3.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.19 _LACS_plot.Line_2_terminator_val_x_2 7.02 _LACS_plot.Line_2_terminator_val_y_2 -4.25 _LACS_plot.Y_axis_chem_shift_offset 2.65 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 ASN -4.80 1.55 0 112 GLU 3.68 -5.73 0 55 THR -0.15 -4.29 0 10 MET -4.96 1.29 1 11 GLN -0.94 -2.72 1 12 VAL -4.88 0.04 1 13 SER -3.27 -0.80 1 15 MET 0.36 -1.84 1 16 THR -0.46 -1.47 1 19 ALA 3.87 -3.70 1 21 ALA 3.55 -3.70 1 22 ALA 3.24 -3.70 1 23 ARG 4.34 -3.60 1 24 ILE 4.94 -3.04 1 25 GLU 4.30 -2.60 1 26 LYS 4.15 -3.61 1 28 LEU 2.64 -2.88 1 29 LYS 3.83 -3.29 1 30 ARG -0.36 -2.66 1 31 MET 0.08 -1.65 1 34 VAL 2.33 -3.72 1 35 THR 2.36 -3.35 1 37 ALA -4.90 1.31 1 39 VAL -0.80 -2.78 1 40 ASN -1.98 -2.52 1 41 LEU 2.64 -2.57 1 42 ALA 3.24 -3.39 1 43 THR -0.45 -3.67 1 44 GLU 3.99 -5.42 1 45 THR -2.33 -0.54 1 46 VAL -3.94 -0.90 1 47 ASN -2.93 -0.32 1 49 ILE -1.32 -2.42 1 50 TYR -5.95 0.72 1 51 ASP -3.79 -1.38 1 53 ALA 1.05 -3.07 1 54 GLU -4.78 1.47 1 57 THR 6.12 -4.61 1 58 ALA 4.49 -4.32 1 59 ALA 3.24 -4.01 1 60 ILE 4.94 -3.04 1 61 GLN 5.64 -4.29 1 62 GLU 3.04 -3.22 1 63 LYS 4.77 -5.80 1 64 ILE 6.51 -3.98 1 66 LYS 3.21 -3.61 1 67 LEU 0.45 -2.57 1 69 TYR -2.50 -1.79 1 70 HIS -2.51 -0.76 1 71 VAL 1.70 -3.72 1 72 VAL 2.02 -3.41 1 73 THR -3.90 -1.16 1 74 GLU -5.72 0.53 1 75 LYS -4.31 -0.16 1 76 ALA -5.22 0.69 1 77 GLU -3.53 -0.72 1 78 PHE -4.32 0.23 1 79 ASP -1.51 -0.65 1 80 ILE -3.20 -0.54 1 84 THR -0.77 -1.47 1 89 ALA 2.92 -3.07 1 90 ASN 3.03 -2.52 1 91 ARG 3.71 -2.97 1 92 ILE 4.94 -2.73 1 93 GLU 3.68 -2.60 1 94 LYS 3.83 -3.29 1 96 LEU 2.95 -2.88 1 97 ASN 1.77 -2.20 1 98 LYS 0.08 -2.67 1 99 ILE 2.44 -4.30 1 100 GLU 3.36 -3.85 1 102 VAL 2.96 -3.72 1 103 ALA -0.51 -1.51 1 105 ALA -2.65 0.12 1 107 VAL 1.08 -3.41 1 108 ASN -1.98 -2.52 1 109 PHE 3.50 -2.90 1 110 ALA 3.24 -3.70 1 111 LEU -0.80 -3.20 1 113 THR -6.10 0.72 1 115 THR -0.14 -3.04 1 117 GLU -3.52 -1.35 1 118 TYR -5.95 0.40 1 119 ASN -5.08 0.50 1 121 LYS 1.64 -4.55 1 122 GLU -4.78 1.47 1 123 ALA -3.97 -0.25 1 124 SER -6.71 1.08 1 125 VAL 7.03 -4.35 1 126 SER 5.50 -4.24 1 127 ASP 3.50 -2.84 1 128 LEU 4.52 -4.76 1 129 LYS 4.15 -2.67 1 131 ALA 3.24 -3.70 1 132 VAL 5.15 -3.72 1 133 ASP 2.24 -2.21 1 137 TYR -3.75 -1.48 1 139 LEU -2.99 -1.63 1 141 LEU 0.45 -2.57 1 142 LYS 2.27 -3.61 1 144 GLU -0.08 -2.29 1 145 GLN -0.00 -2.72 1 146 ASP 0.68 -2.84 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5813_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 0.80 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.28 _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 7.02 _LACS_plot.Line_2_terminator_val_y_2 -0.91 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 10 MET -4.96 0.01 0 115 THR -0.14 0.76 0 74 GLU -5.72 0.10 0 75 LYS -4.31 1.22 0 119 ASN -5.08 -0.05 0 49 ILE -1.32 0.95 0 117 GLU -3.52 1.17 0 11 GLN -0.94 0.65 1 12 VAL -4.88 0.92 1 13 SER -3.27 0.36 1 15 MET 0.36 0.33 1 16 THR -0.46 0.16 1 19 ALA 3.87 -0.17 1 21 ALA 3.55 -0.64 1 22 ALA 3.24 -0.25 1 23 ARG 4.34 -0.40 1 24 ILE 4.94 -0.74 1 25 GLU 4.30 -0.98 1 26 LYS 4.15 -0.51 1 28 LEU 2.64 -0.30 1 29 LYS 3.83 -0.61 1 30 ARG -0.36 -0.13 1 31 MET 0.08 -0.29 1 34 VAL 2.33 -0.06 1 35 THR 2.36 -0.22 1 37 ALA -4.90 0.77 1 38 ASN -4.80 0.21 1 39 VAL -0.80 0.22 1 40 ASN -1.98 0.02 1 41 LEU 2.64 -0.63 1 42 ALA 3.24 -0.30 1 43 THR -0.45 -0.01 1 44 GLU 3.99 -0.98 1 45 THR -2.33 0.74 1 46 VAL -3.94 0.47 1 47 ASN -2.93 0.84 1 50 TYR -5.95 0.94 1 51 ASP -3.79 0.08 1 53 ALA 1.05 -0.07 1 54 GLU -4.78 0.04 1 55 THR -0.15 0.13 1 57 THR 6.12 -1.02 1 58 ALA 4.49 -0.32 1 59 ALA 3.24 -0.32 1 60 ILE 4.94 -0.96 1 61 GLN 5.64 -0.72 1 62 GLU 3.04 -0.41 1 63 LYS 4.77 -0.37 1 64 ILE 6.51 -0.87 1 66 LYS 3.21 -0.36 1 67 LEU 0.45 -0.20 1 69 TYR -2.50 0.03 1 70 HIS -2.51 0.32 1 71 VAL 1.70 0.11 1 72 VAL 2.02 -0.36 1 73 THR -3.90 0.17 1 76 ALA -5.22 0.24 1 77 GLU -3.53 0.50 1 78 PHE -4.32 0.65 1 79 ASP -1.51 0.56 1 80 ILE -3.20 0.62 1 84 THR -0.77 0.31 1 89 ALA 2.92 -0.56 1 90 ASN 3.03 -0.37 1 91 ARG 3.71 -0.44 1 92 ILE 4.94 -0.97 1 93 GLU 3.68 -0.64 1 94 LYS 3.83 -0.41 1 96 LEU 2.95 -0.49 1 97 ASN 1.77 -0.52 1 98 LYS 0.08 -0.11 1 99 ILE 2.44 -0.35 1 100 GLU 3.36 -0.41 1 102 VAL 2.96 -0.19 1 103 ALA -0.51 0.06 1 105 ALA -2.65 0.28 1 107 VAL 1.08 -0.32 1 108 ASN -1.98 0.02 1 109 PHE 3.50 -0.69 1 110 ALA 3.24 -0.72 1 111 LEU -0.80 -0.15 1 112 GLU 3.68 -1.04 1 113 THR -6.10 1.13 1 118 TYR -5.95 0.94 1 121 LYS 1.64 -0.08 1 122 GLU -4.78 0.15 1 123 ALA -3.97 0.43 1 124 SER -6.71 0.41 1 125 VAL 7.03 -0.78 1 126 SER 5.50 -0.48 1 127 ASP 3.50 -0.42 1 128 LEU 4.52 -0.80 1 129 LYS 4.15 -0.84 1 131 ALA 3.24 -0.40 1 132 VAL 5.15 -0.60 1 133 ASP 2.24 0.24 1 137 TYR -3.75 0.35 1 139 LEU -2.99 0.57 1 141 LEU 0.45 -0.31 1 142 LYS 2.27 -0.25 1 144 GLU -0.08 -0.20 1 145 GLN -0.00 -0.08 1 146 ASP 0.68 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5813_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 -5.38 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -2.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.70 _LACS_plot.Line_2_terminator_val_x_2 7.02 _LACS_plot.Line_2_terminator_val_y_2 -0.32 _LACS_plot.Y_axis_chem_shift_offset 2.92 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 74 GLU -5.72 0.34 0 10 MET -4.96 -5.23 1 11 GLN -0.94 -3.79 1 12 VAL -4.88 -3.58 1 13 SER -3.27 -3.03 1 15 MET 0.36 -1.09 1 16 THR -0.46 -2.64 1 19 ALA 3.87 0.20 1 21 ALA 3.55 -1.71 1 22 ALA 3.24 -0.71 1 23 ARG 4.34 0.84 1 24 ILE 4.94 -3.05 1 25 GLU 4.30 -1.15 1 26 LYS 4.15 0.01 1 28 LEU 2.64 -1.85 1 29 LYS 3.83 -1.72 1 30 ARG -0.36 -2.40 1 34 VAL 2.33 -3.00 1 35 THR 2.36 -3.02 1 37 ALA -4.90 -5.90 1 38 ASN -4.80 -4.43 1 39 VAL -0.80 -4.77 1 40 ASN -1.98 -2.79 1 41 LEU 2.64 -1.53 1 42 ALA 3.24 -0.75 1 43 THR -0.45 -2.70 1 44 GLU 3.99 -5.89 1 45 THR -2.33 -4.39 1 46 VAL -3.94 -6.22 1 47 ASN -2.93 -3.24 1 49 ILE -1.32 -3.59 1 50 TYR -5.95 -7.30 1 53 ALA 1.05 -1.98 1 54 GLU -4.78 -3.79 1 55 THR -0.15 -5.52 1 57 THR 6.12 -0.94 1 58 ALA 4.49 -0.40 1 59 ALA 3.24 0.34 1 60 ILE 4.94 -2.45 1 61 GLN 5.64 -1.12 1 62 GLU 3.04 -1.05 1 63 LYS 4.77 -1.47 1 64 ILE 6.51 -1.39 1 66 LYS 3.21 -0.08 1 67 LEU 0.45 -4.01 1 69 TYR -2.50 -5.71 1 70 HIS -2.51 -3.00 1 71 VAL 1.70 -3.48 1 72 VAL 2.02 -3.46 1 73 THR -3.90 -4.00 1 75 LYS -4.31 -3.30 1 76 ALA -5.22 -6.61 1 77 GLU -3.53 -4.87 1 78 PHE -4.32 -1.66 1 79 ASP -1.51 -3.40 1 80 ILE -3.20 -2.32 1 84 THR -0.77 -2.67 1 89 ALA 2.92 -1.46 1 90 ASN 3.03 -1.09 1 93 GLU 3.68 -0.30 1 94 LYS 3.83 0.01 1 96 LEU 2.95 -2.31 1 97 ASN 1.77 -2.10 1 98 LYS 0.08 -2.22 1 99 ILE 2.44 -2.42 1 100 GLU 3.36 -2.92 1 102 VAL 2.96 -4.11 1 103 ALA -0.51 -3.21 1 107 VAL 1.08 -3.87 1 108 ASN -1.98 -4.12 1 109 PHE 3.50 -2.23 1 110 ALA 3.24 -0.99 1 111 LEU -0.80 -2.88 1 112 GLU 3.68 -4.62 1 113 THR -6.10 -4.59 1 115 THR -0.14 -3.69 1 117 GLU -3.52 -3.33 1 118 TYR -5.95 -6.88 1 121 LYS 1.64 -2.35 1 122 GLU -4.78 -3.13 1 123 ALA -3.97 -6.55 1 124 SER -6.71 -2.04 1 125 VAL 7.03 -0.94 1 126 SER 5.50 -0.79 1 127 ASP 3.50 0.09 1 128 LEU 4.52 -2.72 1 129 LYS 4.15 -5.38 1 131 ALA 3.24 -0.25 1 132 VAL 5.15 -1.72 1 133 ASP 2.24 2.04 1 137 TYR -3.75 -5.29 1 139 LEU -2.99 -4.09 1 141 LEU 0.45 -2.75 1 142 LYS 2.27 -1.65 1 144 GLU -0.08 -2.68 1 145 GLN -0.00 -3.01 1 146 ASP 0.68 -2.79 1 stop_ save_