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 bmr11591_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.12 _LACS_plot.Line_1_terminator_val_y_1 -3.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 3.11 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ARG -9.12 -1.73 0 10 ALA -7.99 -2.64 1 11 SER 5.62 1.74 1 12 SER -1.38 -0.15 1 13 ILE -6.40 -2.25 1 14 GLU 2.18 1.80 1 16 ALA 1.98 0.82 1 18 PHE -1.09 -1.02 1 19 GLU 3.12 2.53 1 20 ALA 3.50 2.50 1 21 SER 3.60 2.11 1 22 ARG 1.95 0.33 1 23 ALA 1.05 -0.32 1 24 PHE -1.75 -1.63 1 25 ASP -2.01 -2.18 1 27 SER -2.15 -3.07 1 28 SER 3.19 1.51 1 29 THR 2.06 0.13 1 30 THR -5.17 -3.81 1 31 ARG -4.24 -2.49 1 32 TRP -2.14 -1.48 1 33 ALA -3.66 -1.19 1 34 SER -3.27 -1.07 1 35 ALA 1.14 0.24 1 36 GLU -1.53 -0.17 1 38 VAL -3.66 -0.51 1 39 ASP -3.38 -0.41 1 41 GLN -2.75 -1.62 1 42 TRP -7.81 -3.39 1 43 ILE -2.69 -1.67 1 44 TYR -7.88 -2.78 1 45 VAL -6.13 -4.67 1 46 ASN -2.87 -2.70 1 47 LEU 2.25 1.03 1 49 SER -1.81 -1.85 1 50 SER 3.30 1.79 1 51 GLN -5.63 -2.13 1 52 THR 3.12 2.01 1 53 VAL -5.39 -2.44 1 54 ASN -2.53 -1.06 1 55 ARG -3.52 -1.38 1 56 VAL -6.66 -2.44 1 57 LYS -4.76 -1.77 1 58 LEU -2.95 -2.66 1 59 ASN -1.73 -2.01 1 60 TRP 0.23 0.91 1 61 GLU 1.69 -0.85 1 62 ALA 3.85 2.95 1 63 ALA 1.27 -1.76 1 64 TYR -4.38 -2.95 1 65 ALA -4.26 -2.41 1 66 SER 0.08 0.41 1 67 SER -2.03 -0.95 1 68 TYR -1.75 -0.79 1 69 THR -6.25 -3.05 1 70 ILE -1.62 -2.04 1 71 GLN -8.07 -3.03 1 72 VAL -6.50 -4.01 1 73 SER -3.03 -1.56 1 74 ASN -2.17 -1.13 1 75 ASP 1.09 1.29 1 76 SER 1.65 1.23 1 78 THR 1.53 0.89 1 80 THR -0.80 0.15 1 81 ASN 0.19 -0.18 1 82 TRP -5.19 -2.53 1 83 THR -1.07 -0.23 1 84 THR 3.83 2.86 1 85 VAL -2.00 -2.14 1 86 TYR -2.39 0.69 1 87 THR -2.83 -1.38 1 88 THR -1.84 -1.85 1 89 THR 0.51 -0.06 1 90 THR -0.37 -2.12 1 92 ASP -3.09 -2.61 1 95 ILE -0.52 -1.63 1 96 ASP -2.03 -0.81 1 97 ASP -1.48 -0.95 1 98 ILE -2.59 -1.13 1 99 THR -2.56 -1.57 1 100 PHE -3.92 -2.95 1 101 THR 3.53 2.67 1 102 ALA 0.49 0.47 1 103 ARG -6.03 -2.59 1 104 THR 1.06 0.35 1 105 ALA -4.54 -0.42 1 106 LYS -2.60 -0.06 1 107 TYR -7.40 -3.30 1 108 VAL -2.20 -1.01 1 110 VAL -0.97 -0.73 1 113 THR -0.83 -0.20 1 114 VAL -2.94 -0.71 1 115 ARG -1.97 -0.07 1 117 THR -0.35 0.06 1 119 TYR 2.05 -1.47 1 121 TYR -4.24 -1.78 1 122 SER -1.80 -2.38 1 123 LEU -6.97 -1.90 1 124 TRP -0.67 0.57 1 125 GLU -4.69 -4.17 1 126 PHE -6.31 -2.95 1 127 GLU -3.80 -1.00 1 128 VAL -6.58 -1.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11591_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.12 _LACS_plot.Line_1_terminator_val_y_1 5.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 -2.50 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ARG -9.12 7.39 0 10 ALA -7.99 5.35 1 11 SER 5.62 -3.88 1 12 SER -1.38 1.23 1 13 ILE -6.40 4.15 1 14 GLU 2.18 -0.38 1 16 ALA 1.98 -1.16 1 18 PHE -1.09 0.07 1 19 GLU 3.12 -0.59 1 20 ALA 3.50 -1.00 1 21 SER 3.60 -1.49 1 22 ARG 1.95 -1.62 1 23 ALA 1.05 -1.37 1 24 PHE -1.75 0.12 1 25 ASP -2.01 -0.17 1 27 SER -2.15 -0.92 1 28 SER 3.19 -1.68 1 29 THR 2.06 -1.93 1 30 THR -5.17 1.36 1 31 ARG -4.24 1.75 1 32 TRP -2.14 0.66 1 33 ALA -3.66 2.47 1 34 SER -3.27 2.20 1 35 ALA 1.14 -0.90 1 36 GLU -1.53 1.36 1 38 VAL -3.66 3.15 1 39 ASP -3.38 2.97 1 41 GLN -2.75 1.13 1 42 TRP -7.81 4.42 1 43 ILE -2.69 1.02 1 44 TYR -7.88 5.10 1 45 VAL -6.13 1.46 1 46 ASN -2.87 0.17 1 47 LEU 2.25 -1.22 1 49 SER -1.81 -0.04 1 50 SER 3.30 -1.51 1 51 GLN -5.63 3.50 1 52 THR 3.12 -1.11 1 53 VAL -5.39 2.95 1 54 ASN -2.53 1.47 1 55 ARG -3.52 2.14 1 56 VAL -6.66 4.22 1 57 LYS -4.76 2.99 1 58 LEU -2.95 0.29 1 59 ASN -1.73 -0.28 1 60 TRP 0.23 0.68 1 61 GLU 1.69 -2.54 1 62 ALA 3.85 -0.90 1 63 ALA 1.27 -3.03 1 64 TYR -4.38 1.43 1 65 ALA -4.26 1.85 1 66 SER 0.08 0.33 1 67 SER -2.03 1.08 1 68 TYR -1.75 0.96 1 69 THR -6.25 3.20 1 70 ILE -1.62 -0.42 1 71 GLN -8.07 5.04 1 72 VAL -6.50 2.49 1 73 SER -3.03 1.47 1 74 ASN -2.17 1.04 1 75 ASP 1.09 0.20 1 76 SER 1.65 -0.42 1 78 THR 1.53 -0.64 1 80 THR -0.80 0.95 1 81 ASN 0.19 -0.37 1 82 TRP -5.19 2.66 1 83 THR -1.07 0.84 1 84 THR 3.83 -0.97 1 85 VAL -2.00 -0.14 1 86 TYR -2.39 3.08 1 87 THR -2.83 1.45 1 88 THR -1.84 -0.01 1 89 THR 0.51 -0.57 1 90 THR -0.37 -1.75 1 92 ASP -3.09 0.48 1 95 ILE -0.52 -1.11 1 96 ASP -2.03 1.22 1 97 ASP -1.48 0.53 1 98 ILE -2.59 1.46 1 99 THR -2.56 0.99 1 100 PHE -3.92 0.97 1 101 THR 3.53 -0.86 1 102 ALA 0.49 -0.02 1 103 ARG -6.03 3.44 1 104 THR 1.06 -0.71 1 105 ALA -4.54 4.12 1 106 LYS -2.60 2.54 1 107 TYR -7.40 4.10 1 108 VAL -2.20 1.19 1 110 VAL -0.97 0.24 1 113 THR -0.83 0.63 1 114 VAL -2.94 2.23 1 115 ARG -1.97 1.90 1 117 THR -0.35 0.41 1 119 TYR 2.05 -3.52 1 121 TYR -4.24 2.46 1 122 SER -1.80 -0.58 1 123 LEU -6.97 5.07 1 124 TRP -0.67 1.24 1 125 GLU -4.69 0.52 1 126 PHE -6.31 3.36 1 127 GLU -3.80 2.80 1 128 VAL -6.58 4.88 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11591_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.12 _LACS_plot.Line_1_terminator_val_y_1 1.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 ASN -2.53 -0.73 0 44 TYR -7.88 1.59 0 68 TYR -1.75 1.29 0 11 SER 5.62 -1.08 0 72 VAL -6.50 1.72 0 10 ALA -7.99 0.49 1 12 SER -1.38 -0.02 1 13 ILE -6.40 1.19 1 14 GLU 2.18 -0.81 1 16 ALA 1.98 -0.17 1 18 PHE -1.09 1.04 1 19 GLU 3.12 -0.18 1 20 ALA 3.50 -0.41 1 21 SER 3.60 -0.49 1 22 ARG 1.95 -0.30 1 23 ALA 1.05 0.06 1 24 PHE -1.75 0.85 1 25 ASP -2.01 0.28 1 27 SER -2.15 0.47 1 28 SER 3.19 -0.28 1 29 THR 2.06 -0.16 1 30 THR -5.17 0.58 1 31 ARG -4.24 0.80 1 32 TRP -2.14 0.01 1 33 ALA -3.66 -0.31 1 34 SER -3.27 -0.42 1 35 ALA 1.14 -0.26 1 36 GLU -1.53 -0.68 1 38 VAL -3.66 0.13 1 39 ASP -3.38 1.03 1 41 GLN -2.75 -0.19 1 42 TRP -7.81 0.77 1 43 ILE -2.69 0.68 1 45 VAL -6.13 0.36 1 46 ASN -2.87 0.01 1 47 LEU 2.25 -0.60 1 49 SER -1.81 -0.24 1 50 SER 3.30 -0.39 1 51 GLN -5.63 0.25 1 52 THR 3.12 0.03 1 53 VAL -5.39 0.55 1 55 ARG -3.52 0.79 1 56 VAL -6.66 1.08 1 57 LYS -4.76 1.03 1 58 LEU -2.95 0.16 1 59 ASN -1.73 0.27 1 60 TRP 0.23 -0.04 1 61 GLU 1.69 0.18 1 62 ALA 3.85 -0.38 1 63 ALA 1.27 0.01 1 65 ALA -4.26 0.18 1 66 SER 0.08 0.07 1 67 SER -2.03 1.23 1 69 THR -6.25 0.95 1 70 ILE -1.62 1.08 1 71 GLN -8.07 1.27 1 74 ASN -2.17 0.41 1 75 ASP 1.09 -0.46 1 76 SER 1.65 -0.34 1 78 THR 1.53 -0.71 1 80 THR -0.80 -0.39 1 81 ASN 0.19 -0.14 1 82 TRP -5.19 0.15 1 83 THR -1.07 0.13 1 84 THR 3.83 -0.05 1 85 VAL -2.00 0.31 1 86 TYR -2.39 0.01 1 87 THR -2.83 0.13 1 88 THR -1.84 0.17 1 89 THR 0.51 0.86 1 90 THR -0.37 0.16 1 95 ILE -0.52 0.92 1 96 ASP -2.03 0.40 1 97 ASP -1.48 0.38 1 98 ILE -2.59 -0.05 1 99 THR -2.56 0.56 1 100 PHE -3.92 0.36 1 101 THR 3.53 -0.46 1 102 ALA 0.49 0.22 1 103 ARG -6.03 0.37 1 104 THR 1.06 0.22 1 105 ALA -4.54 -0.02 1 106 LYS -2.60 0.22 1 107 TYR -7.40 1.40 1 108 VAL -2.20 1.04 1 109 ARG -9.12 1.26 1 110 VAL -0.97 0.69 1 113 THR -0.83 0.11 1 114 VAL -2.94 0.24 1 115 ARG -1.97 -0.78 1 117 THR -0.35 0.09 1 119 TYR 2.05 -0.14 1 121 TYR -4.24 -0.14 1 122 SER -1.80 0.15 1 123 LEU -6.97 0.29 1 124 TRP -0.67 0.12 1 125 GLU -4.69 0.24 1 126 PHE -6.31 0.36 1 127 GLU -3.80 0.74 1 128 VAL -6.58 0.51 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11591_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.12 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.10 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 0.78 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ALA 1.05 -4.26 0 27 SER -2.15 3.28 0 28 SER 3.19 -3.66 0 10 ALA -7.99 -1.06 1 11 SER 5.62 0.68 1 12 SER -1.38 -2.41 1 13 ILE -6.40 -0.06 1 14 GLU 2.18 -0.19 1 16 ALA 1.98 0.73 1 18 PHE -1.09 -0.60 1 19 GLU 3.12 0.45 1 20 ALA 3.50 0.95 1 21 SER 3.60 2.41 1 22 ARG 1.95 1.63 1 24 PHE -1.75 0.04 1 25 ASP -2.01 1.56 1 29 THR 2.06 0.14 1 30 THR -5.17 0.78 1 31 ARG -4.24 -1.56 1 32 TRP -2.14 1.33 1 33 ALA -3.66 -3.10 1 34 SER -3.27 -1.42 1 35 ALA 1.14 1.54 1 36 GLU -1.53 0.35 1 38 VAL -3.66 -1.89 1 39 ASP -3.38 -1.31 1 41 GLN -2.75 -3.33 1 42 TRP -7.81 -2.73 1 43 ILE -2.69 -3.56 1 44 TYR -7.88 -4.64 1 45 VAL -6.13 -4.14 1 46 ASN -2.87 0.34 1 47 LEU 2.25 0.80 1 49 SER -1.81 -1.94 1 50 SER 3.30 -0.47 1 51 GLN -5.63 -1.84 1 52 THR 3.12 -1.14 1 53 VAL -5.39 -1.83 1 54 ASN -2.53 -2.54 1 55 ARG -3.52 -1.99 1 56 VAL -6.66 -3.23 1 57 LYS -4.76 -2.01 1 58 LEU -2.95 -3.53 1 59 ASN -1.73 -0.44 1 60 TRP 0.23 0.98 1 61 GLU 1.69 -0.84 1 62 ALA 3.85 0.01 1 63 ALA 1.27 -3.95 1 64 TYR -4.38 -0.31 1 65 ALA -4.26 -2.72 1 66 SER 0.08 1.21 1 67 SER -2.03 -1.22 1 68 TYR -1.75 -3.03 1 69 THR -6.25 0.49 1 70 ILE -1.62 -0.48 1 71 GLN -8.07 -1.06 1 72 VAL -6.50 -1.10 1 73 SER -3.03 0.49 1 74 ASN -2.17 -0.94 1 75 ASP 1.09 -1.68 1 76 SER 1.65 1.89 1 78 THR 1.53 -0.34 1 80 THR -0.80 -1.77 1 81 ASN 0.19 -1.69 1 82 TRP -5.19 0.38 1 83 THR -1.07 0.06 1 84 THR 3.83 -0.33 1 85 VAL -2.00 -1.63 1 86 TYR -2.39 -3.53 1 87 THR -2.83 -3.41 1 88 THR -1.84 -1.52 1 89 THR 0.51 1.66 1 90 THR -0.37 0.47 1 92 ASP -3.09 0.66 1 95 ILE -0.52 2.00 1 96 ASP -2.03 -3.37 1 97 ASP -1.48 -1.55 1 98 ILE -2.59 -1.82 1 99 THR -2.56 -1.19 1 100 PHE -3.92 -1.19 1 101 THR 3.53 -0.12 1 102 ALA 0.49 0.13 1 103 ARG -6.03 -1.62 1 104 THR 1.06 -0.83 1 105 ALA -4.54 -3.53 1 106 LYS -2.60 -3.41 1 107 TYR -7.40 0.56 1 108 VAL -2.20 -2.74 1 109 ARG -9.12 -1.37 1 110 VAL -0.97 -2.65 1 113 THR -0.83 0.34 1 114 VAL -2.94 -0.04 1 115 ARG -1.97 0.61 1 117 THR -0.35 -0.17 1 119 TYR 2.05 -1.29 1 121 TYR -4.24 -0.13 1 122 SER -1.80 -1.72 1 123 LEU -6.97 -2.13 1 124 TRP -0.67 2.29 1 125 GLU -4.69 -2.85 1 126 PHE -6.31 -0.96 1 127 GLU -3.80 -4.29 1 128 VAL -6.58 -2.00 1 stop_ save_