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 bmr11333_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.11 _LACS_plot.Line_1_terminator_val_y_1 -2.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.15 _LACS_plot.Line_2_terminator_val_x_2 8.09 _LACS_plot.Line_2_terminator_val_y_2 5.15 _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 21 HIS 0.02 4.29 0 10 ARG 0.00 0.02 1 11 ASN 0.14 0.09 1 12 LEU 0.40 0.26 1 13 ALA 0.24 0.18 1 14 GLN -0.37 0.07 1 17 ARG -0.96 -0.52 1 20 GLU 1.01 0.25 1 22 TYR -6.52 -0.06 1 23 ASP -1.08 -0.83 1 24 ARG -4.80 -1.71 1 25 ALA -2.17 -2.05 1 27 LEU -4.25 -2.05 1 28 LEU -0.94 -0.57 1 29 LYS -0.43 -1.12 1 30 ALA -4.26 -0.41 1 34 ASP 3.73 2.27 1 35 LYS -3.75 0.06 1 36 LEU -1.93 -1.75 1 37 TYR -7.44 -0.28 1 38 THR 6.96 5.45 1 40 ARG 4.22 2.90 1 41 LEU 6.34 2.96 1 43 HIS 4.85 3.92 1 44 ASP 4.62 2.85 1 45 THR 3.07 2.94 1 46 ASN -2.52 1.35 1 47 GLU -4.87 -2.39 1 48 ASP -0.30 -1.00 1 49 HIS -2.63 -0.88 1 50 GLN -2.29 -0.64 1 51 LEU 1.16 0.31 1 52 ASP -0.07 -1.35 1 53 ARG 3.83 1.80 1 54 PHE 3.39 1.54 1 55 LYS -1.01 -0.49 1 56 VAL 3.46 3.13 1 57 LYS -3.80 -0.28 1 58 GLU -6.99 -1.69 1 59 VAL -7.02 -4.68 1 60 GLN -6.81 -2.37 1 62 ILE 2.38 2.21 1 63 ASN 1.12 2.69 1 65 GLU 4.99 1.99 1 66 LYS -0.17 0.96 1 67 LEU 0.05 -0.13 1 68 GLN -7.62 -1.77 1 69 HIS 0.55 1.22 1 70 ALA 3.37 2.13 1 71 GLN -0.11 -1.26 1 72 GLN 5.06 4.52 1 73 THR -4.82 -3.10 1 75 GLU 1.42 0.97 1 76 ASP -0.30 1.43 1 78 SER 4.51 2.22 1 79 THR 3.60 3.91 1 80 LEU -0.35 -0.49 1 81 PHE 0.39 -0.36 1 83 GLU 1.96 2.96 1 84 TYR -2.70 -0.50 1 85 TYR -6.65 -4.28 1 87 SER 1.48 0.68 1 88 ILE 2.00 2.56 1 90 HIS 8.09 4.02 1 91 LEU -4.17 -1.13 1 92 PHE -5.46 -2.08 1 93 ASP -4.30 -0.88 1 94 LYS -0.27 0.36 1 95 ASP 1.67 1.59 1 96 LYS -1.49 -1.25 1 97 ARG 4.83 0.58 1 98 GLN 3.93 1.95 1 99 TYR -4.29 -1.87 1 100 HIS -1.05 1.24 1 102 GLU 3.18 2.68 1 103 SER 5.63 3.36 1 106 ILE -8.11 -2.38 1 108 ARG -5.56 -2.80 1 109 ILE 3.01 1.41 1 112 LYS 4.78 3.85 1 113 GLU 3.93 2.42 1 114 ASP 0.99 0.74 1 115 PHE -5.43 -0.03 1 116 PHE -4.80 -2.09 1 117 HIS -1.19 0.70 1 119 LEU 2.60 2.46 1 120 LYS 2.83 2.70 1 122 ASN 2.21 0.51 1 123 LEU -5.25 -1.20 1 125 LEU -6.07 -2.25 1 126 THR 0.96 -0.12 1 127 THR 5.23 3.73 1 128 ASN 4.33 2.28 1 129 LEU 0.26 -0.35 1 130 ARG 4.50 3.26 1 132 LYS -1.94 -0.72 1 133 HIS -0.46 0.93 1 134 LYS -0.31 -0.81 1 136 ILE 0.04 0.26 1 137 GLU -0.94 -0.34 1 138 SER -0.27 0.02 1 141 SER 0.00 0.09 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11333_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.11 _LACS_plot.Line_1_terminator_val_y_1 5.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.85 _LACS_plot.Line_2_terminator_val_x_2 8.09 _LACS_plot.Line_2_terminator_val_y_2 -2.94 _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 21 HIS 0.02 4.27 0 10 ARG 0.00 0.02 1 11 ASN 0.14 -0.05 1 12 LEU 0.40 -0.14 1 13 ALA 0.24 -0.06 1 14 GLN -0.37 0.44 1 17 ARG -0.96 0.44 1 20 GLU 1.01 -0.76 1 22 TYR -6.52 6.46 1 23 ASP -1.08 0.25 1 24 ARG -4.80 3.09 1 25 ALA -2.17 0.12 1 27 LEU -4.25 2.20 1 28 LEU -0.94 0.37 1 29 LYS -0.43 -0.69 1 30 ALA -4.26 3.85 1 34 ASP 3.73 -1.46 1 35 LYS -3.75 3.81 1 36 LEU -1.93 0.18 1 37 TYR -7.44 7.16 1 38 THR 6.96 -1.51 1 40 ARG 4.22 -1.32 1 41 LEU 6.34 -3.38 1 43 HIS 4.85 -0.93 1 44 ASP 4.62 -1.77 1 45 THR 3.07 -0.13 1 46 ASN -2.52 3.87 1 47 GLU -4.87 2.48 1 48 ASP -0.30 -0.70 1 49 HIS -2.63 1.75 1 50 GLN -2.29 1.65 1 51 LEU 1.16 -0.85 1 52 ASP -0.07 -1.28 1 53 ARG 3.83 -2.03 1 54 PHE 3.39 -1.85 1 55 LYS -1.01 0.52 1 56 VAL 3.46 -0.33 1 57 LYS -3.80 3.52 1 58 GLU -6.99 5.30 1 59 VAL -7.02 2.34 1 60 GLN -6.81 4.44 1 62 ILE 2.38 -0.17 1 63 ASN 1.12 1.57 1 65 GLU 4.99 -3.00 1 66 LYS -0.17 1.13 1 67 LEU 0.05 -0.18 1 68 GLN -7.62 5.85 1 69 HIS 0.55 0.67 1 70 ALA 3.37 -1.24 1 71 GLN -0.11 -1.15 1 72 GLN 5.06 -0.54 1 73 THR -4.82 1.72 1 75 GLU 1.42 -0.45 1 76 ASP -0.30 1.73 1 78 SER 4.51 -2.29 1 79 THR 3.60 0.31 1 80 LEU -0.35 -0.14 1 81 PHE 0.39 -0.75 1 83 GLU 1.96 1.00 1 84 TYR -2.70 2.20 1 85 TYR -6.65 2.37 1 87 SER 1.48 -0.80 1 88 ILE 2.00 0.56 1 90 HIS 8.09 -4.07 1 91 LEU -4.17 3.04 1 92 PHE -5.46 3.38 1 93 ASP -4.30 3.42 1 94 LYS -0.27 0.63 1 95 ASP 1.67 -0.08 1 96 LYS -1.49 0.24 1 97 ARG 4.83 -4.25 1 98 GLN 3.93 -1.98 1 99 TYR -4.29 2.42 1 100 HIS -1.05 2.29 1 102 GLU 3.18 -0.50 1 103 SER 5.63 -2.27 1 106 ILE -8.11 5.73 1 108 ARG -5.56 2.76 1 109 ILE 3.01 -1.60 1 112 LYS 4.78 -0.93 1 113 GLU 3.93 -1.51 1 114 ASP 0.99 -0.25 1 115 PHE -5.43 5.40 1 116 PHE -4.80 2.71 1 117 HIS -1.19 1.89 1 119 LEU 2.60 -0.14 1 120 LYS 2.83 -0.13 1 122 ASN 2.21 -1.70 1 123 LEU -5.25 4.05 1 125 LEU -6.07 3.82 1 126 THR 0.96 -1.08 1 127 THR 5.23 -1.50 1 128 ASN 4.33 -2.05 1 129 LEU 0.26 -0.61 1 130 ARG 4.50 -1.24 1 132 LYS -1.94 1.22 1 133 HIS -0.46 1.39 1 134 LYS -0.31 -0.50 1 136 ILE 0.04 0.22 1 137 GLU -0.94 0.60 1 138 SER -0.27 0.29 1 141 SER 0.00 0.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11333_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.11 _LACS_plot.Line_1_terminator_val_y_1 0.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 8.09 _LACS_plot.Line_2_terminator_val_y_2 -0.54 _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 43 HIS 4.85 -2.76 0 10 ARG 0.00 0.02 1 11 ASN 0.14 -0.02 1 12 LEU 0.40 -0.04 1 13 ALA 0.24 -0.03 1 14 GLN -0.37 0.04 1 17 ARG -0.96 0.14 1 20 GLU 1.01 -0.21 1 21 HIS 0.02 -0.55 1 22 TYR -6.52 0.22 1 23 ASP -1.08 0.57 1 24 ARG -4.80 0.99 1 25 ALA -2.17 0.53 1 27 LEU -4.25 0.25 1 28 LEU -0.94 -0.05 1 29 LYS -0.43 0.28 1 30 ALA -4.26 -0.15 1 34 ASP 3.73 -0.23 1 35 LYS -3.75 0.10 1 36 LEU -1.93 0.91 1 37 TYR -7.44 0.40 1 38 THR 6.96 -0.28 1 40 ARG 4.22 -0.38 1 41 LEU 6.34 -0.27 1 44 ASP 4.62 -0.53 1 45 THR 3.07 -0.21 1 46 ASN -2.52 0.07 1 47 GLU -4.87 0.18 1 48 ASP -0.30 -0.11 1 49 HIS -2.63 0.15 1 50 GLN -2.29 0.47 1 51 LEU 1.16 -0.17 1 52 ASP -0.07 0.12 1 53 ARG 3.83 -0.51 1 54 PHE 3.39 0.08 1 55 LYS -1.01 0.06 1 56 VAL 3.46 -0.75 1 57 LYS -3.80 0.17 1 58 GLU -6.99 0.84 1 59 VAL -7.02 0.85 1 60 GLN -6.81 0.85 1 62 ILE 2.38 -0.10 1 63 ASN 1.12 0.06 1 65 GLU 4.99 -0.30 1 66 LYS -0.17 -0.02 1 67 LEU 0.05 0.59 1 68 GLN -7.62 0.68 1 69 HIS 0.55 0.06 1 70 ALA 3.37 -0.36 1 71 GLN -0.11 0.03 1 72 GLN 5.06 -0.80 1 73 THR -4.82 -0.14 1 75 GLU 1.42 -0.22 1 76 ASP -0.30 0.33 1 78 SER 4.51 -0.43 1 79 THR 3.60 -0.51 1 80 LEU -0.35 -0.19 1 81 PHE 0.39 -0.01 1 83 GLU 1.96 -0.27 1 84 TYR -2.70 0.04 1 85 TYR -6.65 0.73 1 87 SER 1.48 -0.99 1 88 ILE 2.00 -0.50 1 90 HIS 8.09 -1.27 1 91 LEU -4.17 -0.17 1 92 PHE -5.46 1.02 1 93 ASP -4.30 1.10 1 94 LYS -0.27 0.18 1 95 ASP 1.67 0.07 1 96 LYS -1.49 0.14 1 97 ARG 4.83 -0.22 1 98 GLN 3.93 0.09 1 99 TYR -4.29 0.37 1 100 HIS -1.05 -0.23 1 102 GLU 3.18 -0.36 1 103 SER 5.63 -0.29 1 106 ILE -8.11 0.68 1 108 ARG -5.56 -0.13 1 109 ILE 3.01 -0.67 1 112 LYS 4.78 -1.17 1 113 GLU 3.93 -0.18 1 114 ASP 0.99 -0.06 1 115 PHE -5.43 0.72 1 116 PHE -4.80 0.39 1 117 HIS -1.19 0.02 1 119 LEU 2.60 -0.08 1 120 LYS 2.83 -0.05 1 122 ASN 2.21 -0.38 1 123 LEU -5.25 0.20 1 125 LEU -6.07 0.39 1 126 THR 0.96 -0.02 1 127 THR 5.23 -0.37 1 128 ASN 4.33 -0.23 1 129 LEU 0.26 0.13 1 130 ARG 4.50 -0.50 1 132 LYS -1.94 0.27 1 133 HIS -0.46 0.06 1 134 LYS -0.31 -0.01 1 136 ILE 0.04 -0.09 1 137 GLU -0.94 0.02 1 138 SER -0.27 0.04 1 141 SER 0.00 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11333_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.11 _LACS_plot.Line_1_terminator_val_y_1 -2.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 8.09 _LACS_plot.Line_2_terminator_val_y_2 0.70 _LACS_plot.Y_axis_chem_shift_offset 0.62 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 HIS 8.09 -3.71 0 10 ARG 0.00 -0.52 1 11 ASN 0.14 -0.04 1 12 LEU 0.40 -0.37 1 13 ALA 0.24 -0.21 1 14 GLN -0.37 0.06 1 17 ARG -0.96 -0.31 1 20 GLU 1.01 -0.46 1 21 HIS 0.02 0.99 1 22 TYR -6.52 -2.90 1 23 ASP -1.08 -2.21 1 24 ARG -4.80 -1.45 1 25 ALA -2.17 -4.07 1 27 LEU -4.25 -0.72 1 28 LEU -0.94 -2.00 1 29 LYS -0.43 -1.60 1 30 ALA -4.26 0.69 1 34 ASP 3.73 -1.92 1 35 LYS -3.75 -1.15 1 36 LEU -1.93 -1.03 1 37 TYR -7.44 0.38 1 38 THR 6.96 -1.12 1 40 ARG 4.22 -1.15 1 41 LEU 6.34 3.47 1 43 HIS 4.85 2.23 1 44 ASP 4.62 1.39 1 45 THR 3.07 -0.22 1 46 ASN -2.52 -1.41 1 47 GLU -4.87 -0.99 1 52 ASP -0.07 0.18 1 53 ARG 3.83 0.02 1 54 PHE 3.39 1.81 1 55 LYS -1.01 -0.65 1 56 VAL 3.46 -2.33 1 57 LYS -3.80 0.47 1 58 GLU -6.99 -2.61 1 59 VAL -7.02 -2.79 1 60 GLN -6.81 -1.05 1 62 ILE 2.38 -1.03 1 63 ASN 1.12 0.80 1 65 GLU 4.99 -1.77 1 66 LYS -0.17 0.51 1 67 LEU 0.05 -1.95 1 68 GLN -7.62 -2.31 1 69 HIS 0.55 0.74 1 70 ALA 3.37 -2.12 1 71 GLN -0.11 -2.99 1 72 GLN 5.06 -2.00 1 73 THR -4.82 -2.56 1 75 GLU 1.42 -1.07 1 76 ASP -0.30 1.02 1 78 SER 4.51 -0.04 1 79 THR 3.60 -2.39 1 80 LEU -0.35 -0.83 1 81 PHE 0.39 1.60 1 83 GLU 1.96 0.64 1 84 TYR -2.70 -2.65 1 85 TYR -6.65 -3.01 1 87 SER 1.48 -2.09 1 88 ILE 2.00 0.82 1 91 LEU -4.17 -3.44 1 92 PHE -5.46 -0.10 1 94 LYS -0.27 -0.82 1 97 ARG 4.83 0.58 1 98 GLN 3.93 -1.00 1 99 TYR -4.29 -4.49 1 100 HIS -1.05 0.87 1 102 GLU 3.18 0.55 1 103 SER 5.63 1.00 1 106 ILE -8.11 -1.45 1 108 ARG -5.56 -1.97 1 109 ILE 3.01 -0.88 1 112 LYS 4.78 1.05 1 113 GLU 3.93 0.29 1 114 ASP 0.99 1.24 1 115 PHE -5.43 -1.45 1 116 PHE -4.80 -4.50 1 117 HIS -1.19 0.76 1 119 LEU 2.60 -1.11 1 122 ASN 2.21 -2.59 1 123 LEU -5.25 -1.73 1 125 LEU -6.07 -1.86 1 126 THR 0.96 2.70 1 127 THR 5.23 2.29 1 128 ASN 4.33 0.77 1 129 LEU 0.26 1.43 1 130 ARG 4.50 1.20 1 132 LYS -1.94 -1.24 1 136 ILE 0.04 -0.63 1 137 GLU -0.94 -0.16 1 138 SER -0.27 0.00 1 141 SER 0.00 -0.60 1 stop_ save_