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 bmr30127_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -0.14 _LACS_plot.Line_1_terminator_val_y_1 0.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.59 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 5.99 _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 29 GLU 0.69 -2.38 0 10 ARG 5.40 3.81 1 11 TRP 3.26 3.35 1 12 GLN 4.99 4.10 1 13 ARG 5.26 3.67 1 14 ILE 2.94 2.06 1 15 ALA 5.29 4.06 1 16 LEU 4.22 3.25 1 17 LEU 3.34 3.01 1 18 SER 4.44 5.02 1 19 GLN 4.30 3.57 1 20 SER 4.43 3.53 1 21 LEU 5.26 3.10 1 22 LEU 5.03 3.42 1 23 GLU 4.34 3.29 1 24 LEU 3.92 3.11 1 25 ALA 2.96 2.47 1 26 GLN 4.67 3.43 1 27 ARG 0.51 0.55 1 30 TRP 2.71 2.70 1 31 ASP 4.81 4.01 1 32 LEU 3.55 2.87 1 33 LEU 5.34 4.91 1 34 LEU 4.80 2.99 1 35 GLN 3.61 2.65 1 36 GLN 0.73 -0.44 1 37 GLU 2.93 4.31 1 38 VAL 6.85 4.73 1 39 SER 3.81 2.98 1 40 TYR 2.70 3.38 1 41 LEU 6.43 3.15 1 42 GLN 4.85 3.34 1 43 SER 4.86 4.51 1 44 ILE 5.45 3.28 1 45 GLU 3.66 3.06 1 46 THR 4.07 3.71 1 47 VAL 4.65 2.60 1 48 MET 2.17 1.69 1 49 GLU 0.57 0.73 1 50 LYS 0.55 -0.14 1 51 GLN 0.07 0.22 1 52 THR 1.17 1.09 1 56 ILE 2.08 0.56 1 59 SER 4.36 3.60 1 60 ILE 5.21 3.17 1 61 GLN 5.53 4.33 1 62 ASP 4.51 3.49 1 63 MET 3.20 3.49 1 64 VAL 5.80 4.18 1 65 ALA 4.39 3.03 1 67 TYR 3.08 1.73 1 68 ILE 6.86 5.56 1 69 LYS 4.89 3.66 1 70 GLN 4.17 3.76 1 71 THR 7.61 6.94 1 72 LEU 5.19 3.74 1 73 ASP 4.68 3.65 1 74 ASN 3.85 3.26 1 75 GLU 7.45 4.05 1 76 GLN 4.88 4.04 1 77 LEU 3.01 2.64 1 78 LEU 3.87 3.44 1 79 LYS 5.81 4.63 1 81 LEU 4.03 3.24 1 82 LEU 4.37 3.59 1 83 GLN 4.26 3.24 1 84 GLN 4.64 3.61 1 85 ARG 3.74 1.52 1 86 LEU 4.85 3.52 1 87 ASP 4.67 3.80 1 88 GLU 3.35 2.88 1 89 LEU 3.36 2.65 1 90 SER 4.25 3.49 1 91 SER 2.58 2.26 1 92 LEU 1.85 1.40 1 93 ILE 3.09 2.14 1 95 GLN 0.97 0.79 1 96 VAL 1.92 1.17 1 97 LEU 0.70 0.44 1 98 PHE 0.74 0.50 1 99 GLN -0.14 0.18 1 102 SER 0.89 0.70 1 103 ALA 1.15 1.01 1 105 LEU 0.68 0.42 1 106 VAL 0.43 0.23 1 108 ARG 1.20 0.75 1 113 ILE 3.97 2.95 1 114 GLU 3.78 2.86 1 116 MET 4.46 3.23 1 117 THR 6.84 5.12 1 118 THR 6.41 5.24 1 119 ARG 4.91 4.18 1 120 LEU 4.54 3.78 1 121 THR 6.95 6.06 1 122 ARG 5.81 4.45 1 123 TRP 5.60 4.64 1 124 LEU 5.47 4.37 1 125 THR 5.57 5.09 1 126 ALA 3.41 2.95 1 127 LEU 6.93 3.64 1 128 ASP 4.98 4.22 1 129 ASN 3.90 3.43 1 130 PHE 3.34 2.82 1 131 GLU 4.13 3.44 1 132 ALA 3.84 2.60 1 133 LYS 3.63 2.63 1 134 MET 3.22 1.22 1 135 ALA 2.27 1.31 1 136 LEU 0.30 0.02 1 137 LEU 1.18 0.75 1 139 ALA 0.17 0.19 1 140 VAL 1.53 1.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30127_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -0.14 _LACS_plot.Line_1_terminator_val_y_1 0.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.41 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 -1.62 _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 29 GLU 0.69 -3.07 0 10 ARG 5.40 -1.59 1 11 TRP 3.26 0.09 1 12 GLN 4.99 -0.89 1 13 ARG 5.26 -1.59 1 14 ILE 2.94 -0.88 1 15 ALA 5.29 -1.23 1 16 LEU 4.22 -0.97 1 17 LEU 3.34 -0.33 1 18 SER 4.44 0.58 1 19 GLN 4.30 -0.73 1 20 SER 4.43 -0.90 1 21 LEU 5.26 -2.16 1 22 LEU 5.03 -1.61 1 23 GLU 4.34 -1.05 1 24 LEU 3.92 -0.81 1 25 ALA 2.96 -0.49 1 26 GLN 4.67 -1.24 1 27 ARG 0.51 0.04 1 30 TRP 2.71 -0.01 1 31 ASP 4.81 -0.80 1 32 LEU 3.55 -0.68 1 33 LEU 5.34 -0.43 1 34 LEU 4.80 -1.81 1 35 GLN 3.61 -0.96 1 36 GLN 0.73 -1.17 1 37 GLU 2.93 1.38 1 38 VAL 6.85 -2.12 1 39 SER 3.81 -0.83 1 40 TYR 2.70 0.68 1 41 LEU 6.43 -3.28 1 42 GLN 4.85 -1.51 1 43 SER 4.86 -0.35 1 44 ILE 5.45 -2.17 1 45 GLU 3.66 -0.60 1 46 THR 4.07 -0.36 1 47 VAL 4.65 -2.05 1 48 MET 2.17 -0.48 1 49 GLU 0.57 0.16 1 50 LYS 0.55 -0.69 1 51 GLN 0.07 0.15 1 52 THR 1.17 -0.08 1 56 ILE 2.08 -1.52 1 59 SER 4.36 -0.76 1 60 ILE 5.21 -2.04 1 61 GLN 5.53 -1.20 1 62 ASP 4.51 -1.02 1 63 MET 3.20 0.29 1 64 VAL 5.80 -1.62 1 65 ALA 4.39 -1.36 1 67 TYR 3.08 -1.35 1 68 ILE 6.86 -1.30 1 69 LYS 4.89 -1.23 1 70 GLN 4.17 -0.41 1 71 THR 7.61 -0.67 1 72 LEU 5.19 -1.45 1 73 ASP 4.68 -1.03 1 74 ASN 3.85 -0.59 1 75 GLU 7.45 -3.40 1 76 GLN 4.88 -0.84 1 77 LEU 3.01 -0.37 1 78 LEU 3.87 -0.43 1 79 LYS 5.81 -1.18 1 81 LEU 4.03 -0.79 1 82 LEU 4.37 -0.78 1 83 GLN 4.26 -1.02 1 84 GLN 4.64 -1.03 1 85 ARG 3.74 -2.22 1 86 LEU 4.85 -1.33 1 87 ASP 4.67 -0.87 1 88 GLU 3.35 -0.47 1 89 LEU 3.36 -0.71 1 90 SER 4.25 -0.76 1 91 SER 2.58 -0.32 1 92 LEU 1.85 -0.45 1 93 ILE 3.09 -0.95 1 95 GLN 0.97 -0.18 1 96 VAL 1.92 -0.75 1 97 LEU 0.70 -0.26 1 98 PHE 0.74 -0.24 1 99 GLN -0.14 0.32 1 102 SER 0.89 -0.19 1 103 ALA 1.15 -0.14 1 105 LEU 0.68 -0.26 1 106 VAL 0.43 -0.20 1 108 ARG 1.20 -0.45 1 113 ILE 3.97 -1.02 1 114 GLU 3.78 -0.92 1 116 MET 4.46 -1.23 1 117 THR 6.84 -1.72 1 118 THR 6.41 -1.17 1 119 ARG 4.91 -0.73 1 120 LEU 4.54 -0.76 1 121 THR 6.95 -0.89 1 122 ARG 5.81 -1.36 1 123 TRP 5.60 -0.96 1 124 LEU 5.47 -1.10 1 125 THR 5.57 -0.48 1 126 ALA 3.41 -0.46 1 127 LEU 6.93 -3.29 1 128 ASP 4.98 -0.76 1 129 ASN 3.90 -0.47 1 130 PHE 3.34 -0.52 1 131 GLU 4.13 -0.69 1 132 ALA 3.84 -1.24 1 133 LYS 3.63 -1.00 1 134 MET 3.22 -2.00 1 135 ALA 2.27 -0.96 1 136 LEU 0.30 -0.28 1 137 LEU 1.18 -0.43 1 139 ALA 0.17 0.02 1 140 VAL 1.53 0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30127_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -0.14 _LACS_plot.Line_1_terminator_val_y_1 -0.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.66 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 3.20 _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 71 THR 7.61 1.78 0 68 ILE 6.86 0.90 0 67 TYR 3.08 3.89 0 75 GLU 7.45 1.24 0 10 ARG 5.40 2.91 1 11 TRP 3.26 1.73 1 12 GLN 4.99 2.42 1 13 ARG 5.26 3.14 1 15 ALA 5.29 3.37 1 16 LEU 4.22 2.84 1 17 LEU 3.34 1.55 1 18 SER 4.44 0.67 1 19 GLN 4.30 1.60 1 20 SER 4.43 2.75 1 21 LEU 5.26 0.73 1 22 LEU 5.03 0.52 1 23 GLU 4.34 2.67 1 24 LEU 3.92 1.40 1 25 ALA 2.96 2.95 1 26 GLN 4.67 2.18 1 27 ARG 0.51 0.02 1 29 GLU 0.69 0.18 1 30 TRP 2.71 1.67 1 31 ASP 4.81 2.88 1 32 LEU 3.55 2.11 1 33 LEU 5.34 1.23 1 34 LEU 4.80 2.70 1 35 GLN 3.61 1.70 1 36 GLN 0.73 -1.12 1 37 GLU 2.93 0.07 1 38 VAL 6.85 2.13 1 39 SER 3.81 2.56 1 41 LEU 6.43 2.66 1 42 GLN 4.85 3.03 1 43 SER 4.86 1.83 1 44 ILE 5.45 0.61 1 45 GLU 3.66 2.47 1 46 THR 4.07 2.07 1 48 MET 2.17 0.55 1 49 GLU 0.57 0.34 1 50 LYS 0.55 -0.18 1 51 GLN 0.07 -0.13 1 59 SER 4.36 2.84 1 60 ILE 5.21 1.34 1 61 GLN 5.53 2.82 1 62 ASP 4.51 2.64 1 63 MET 3.20 2.50 1 64 VAL 5.80 0.71 1 65 ALA 4.39 3.08 1 69 LYS 4.89 1.61 1 70 GLN 4.17 2.86 1 72 LEU 5.19 1.97 1 73 ASP 4.68 3.48 1 74 ASN 3.85 2.68 1 76 GLN 4.88 3.90 1 77 LEU 3.01 2.46 1 78 LEU 3.87 0.19 1 79 LYS 5.81 2.01 1 81 LEU 4.03 2.81 1 82 LEU 4.37 1.14 1 83 GLN 4.26 1.96 1 84 GLN 4.64 2.44 1 85 ARG 3.74 1.34 1 86 LEU 4.85 1.67 1 87 ASP 4.67 2.94 1 88 GLU 3.35 3.21 1 89 LEU 3.36 1.52 1 90 SER 4.25 1.67 1 91 SER 2.58 0.67 1 92 LEU 1.85 0.71 1 93 ILE 3.09 0.88 1 95 GLN 0.97 0.37 1 96 VAL 1.92 0.00 1 97 LEU 0.70 -0.55 1 98 PHE 0.74 -0.30 1 99 GLN -0.14 -0.25 1 102 SER 0.89 -0.03 1 103 ALA 1.15 0.39 1 105 LEU 0.68 -0.49 1 113 ILE 3.97 1.39 1 114 GLU 3.78 2.20 1 117 THR 6.84 3.12 1 118 THR 6.41 2.08 1 119 ARG 4.91 2.52 1 120 LEU 4.54 1.46 1 121 THR 6.95 1.73 1 122 ARG 5.81 3.55 1 123 TRP 5.60 2.27 1 124 LEU 5.47 1.41 1 125 THR 5.57 1.71 1 126 ALA 3.41 3.65 1 127 LEU 6.93 1.32 1 128 ASP 4.98 3.47 1 129 ASN 3.90 2.05 1 130 PHE 3.34 1.18 1 131 GLU 4.13 2.98 1 132 ALA 3.84 2.76 1 133 LYS 3.63 3.22 1 134 MET 3.22 2.01 1 135 ALA 2.27 0.24 1 136 LEU 0.30 -0.15 1 139 ALA 0.17 -0.82 1 stop_ save_