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 bmr5862_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 -2.82 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 9.40 _LACS_plot.Line_2_terminator_val_y_2 6.72 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 HIS 9.40 11.98 0 10 PHE -2.69 -0.27 1 11 GLN 4.32 0.77 1 13 GLN -3.45 -1.57 1 15 VAL -3.48 -1.91 1 16 VAL 2.38 1.70 1 17 ASN -2.45 -1.58 1 18 ARG 1.52 0.04 1 20 LEU -0.85 0.04 1 21 SER -6.24 -2.42 1 22 LEU 4.32 3.32 1 23 LYS 4.31 3.40 1 24 ASP 2.76 3.57 1 25 GLN 3.61 3.62 1 26 GLN 4.19 3.70 1 27 THR 6.68 5.33 1 28 PHE 3.42 3.71 1 29 ALA 2.88 2.28 1 30 ARG 2.43 2.60 1 31 SER -0.70 1.50 1 32 VAL 4.06 2.25 1 34 LEU 2.42 2.44 1 35 LYS 1.95 1.49 1 36 TRP 5.84 3.60 1 37 ARG 5.11 3.75 1 38 LYS 4.52 3.17 1 39 VAL 6.11 4.79 1 41 ARG 4.96 3.62 1 42 SER 6.39 5.34 1 43 LEU 1.96 1.23 1 44 GLN 3.09 2.66 1 45 ARG 4.55 3.47 1 48 ARG 4.66 3.53 1 49 ALA 1.46 1.69 1 50 LEU -2.02 -1.46 1 51 ARG 1.76 1.36 1 52 ASP 4.13 2.39 1 54 ALA 3.35 3.94 1 55 LEU 5.06 3.13 1 56 ASP 3.66 3.17 1 57 SER 4.41 3.40 1 58 LEU 2.74 3.63 1 59 ALA 3.43 2.87 1 60 TYR 2.76 2.62 1 61 GLU 3.01 2.26 1 62 TYR 0.63 0.11 1 63 GLU 4.50 3.51 1 64 ARG 3.56 2.28 1 65 GLU 1.75 1.64 1 67 LEU 2.77 3.37 1 68 TYR 4.35 3.25 1 69 GLU 4.44 2.10 1 70 GLN 6.20 4.10 1 71 ALA 1.74 2.70 1 72 PHE 3.80 4.10 1 73 GLN 4.70 2.10 1 74 LEU 5.60 3.80 1 75 LEU 3.00 1.40 1 76 ARG 5.10 3.50 1 77 ARG 4.33 2.70 1 78 PHE 2.21 2.73 1 79 VAL 5.11 3.95 1 80 GLN 4.07 3.34 1 81 ALA 0.90 1.99 1 82 GLU -2.66 -0.96 1 84 ARG 3.38 2.15 1 85 ARG 2.15 0.61 1 86 ALA -0.05 -1.50 1 87 THR -4.03 -1.96 1 88 LEU 1.35 2.79 1 89 GLN 4.92 3.84 1 90 ARG 2.41 2.90 1 91 LEU 2.23 2.55 1 92 VAL 7.44 5.68 1 93 GLU 4.30 3.36 1 94 ALA 2.82 2.55 1 95 LEU 5.68 3.36 1 96 GLU 3.30 3.20 1 97 GLU 1.90 1.80 1 98 ASN -1.30 0.70 1 99 GLU 4.74 1.30 1 100 LEU -0.72 -1.68 1 101 THR 7.00 5.50 1 102 SER -0.95 3.55 1 103 LEU 3.00 2.37 1 104 ALA 4.10 3.33 1 105 GLU 5.03 3.58 1 106 ASP 3.60 2.88 1 107 LEU 2.60 2.70 1 108 LEU 0.03 0.32 1 110 LEU -0.60 -0.30 1 111 THR -0.40 -0.30 1 112 ASP -0.82 -0.13 1 114 ASN 0.27 0.40 1 117 LEU 0.88 0.71 1 118 ALA 0.70 0.51 1 119 HIS 0.58 0.30 1 120 HIS 0.23 0.39 1 121 HIS 1.62 4.45 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5862_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 3.42 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.08 _LACS_plot.Line_2_terminator_val_x_2 9.40 _LACS_plot.Line_2_terminator_val_y_2 -2.68 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 HIS 9.40 2.58 0 10 PHE -2.69 2.42 1 11 GLN 4.32 -3.55 1 13 GLN -3.45 1.88 1 15 VAL -3.48 1.57 1 16 VAL 2.38 -0.68 1 17 ASN -2.45 0.87 1 18 ARG 1.52 -1.48 1 20 LEU -0.85 0.89 1 21 SER -6.24 3.82 1 22 LEU 4.32 -1.00 1 23 LYS 4.31 -0.91 1 24 ASP 2.76 0.81 1 25 GLN 3.61 0.01 1 26 GLN 4.19 -0.49 1 27 THR 6.68 -1.35 1 28 PHE 3.42 0.29 1 29 ALA 2.88 -0.60 1 30 ARG 2.43 0.17 1 31 SER -0.70 2.20 1 32 VAL 4.06 -1.81 1 34 LEU 2.42 0.02 1 35 LYS 1.95 -0.46 1 36 TRP 5.84 -2.24 1 37 ARG 5.11 -1.36 1 38 LYS 4.52 -1.35 1 39 VAL 6.11 -1.32 1 41 ARG 4.96 -1.34 1 42 SER 6.39 -1.05 1 43 LEU 1.96 -0.73 1 44 GLN 3.09 -0.43 1 45 ARG 4.55 -1.08 1 48 ARG 4.66 -1.13 1 49 ALA 1.46 0.23 1 50 LEU -2.02 0.56 1 51 ARG 1.76 -0.40 1 52 ASP 4.13 -1.74 1 54 ALA 3.35 0.59 1 55 LEU 5.06 -1.93 1 56 ASP 3.66 -0.49 1 57 SER 4.41 -1.01 1 58 LEU 2.74 0.89 1 59 ALA 3.43 -0.56 1 60 TYR 2.76 -0.14 1 61 GLU 3.01 -0.75 1 62 TYR 0.63 -0.52 1 63 GLU 4.50 -0.99 1 64 ARG 3.56 -1.28 1 65 GLU 1.75 -0.11 1 67 LEU 2.77 0.60 1 68 TYR 4.35 -1.10 1 69 GLU 4.44 -2.34 1 70 GLN 6.20 -2.10 1 71 ALA 1.74 0.96 1 72 PHE 3.80 0.30 1 73 GLN 4.70 -2.60 1 74 LEU 5.60 -1.80 1 75 LEU 3.00 -1.60 1 76 ARG 5.10 -1.60 1 77 ARG 4.33 -1.63 1 78 PHE 2.21 0.52 1 79 VAL 5.11 -1.16 1 80 GLN 4.07 -0.73 1 81 ALA 0.90 1.09 1 82 GLU -2.66 1.70 1 84 ARG 3.38 -1.23 1 85 ARG 2.15 -1.54 1 86 ALA -0.05 -1.45 1 87 THR -4.03 2.07 1 88 LEU 1.35 1.44 1 89 GLN 4.92 -1.08 1 90 ARG 2.41 0.49 1 91 LEU 2.23 0.32 1 92 VAL 7.44 -1.76 1 93 GLU 4.30 -0.94 1 94 ALA 2.82 -0.27 1 95 LEU 5.68 -2.32 1 96 GLU 3.30 -0.10 1 97 GLU 1.90 -0.10 1 98 ASN -1.30 2.00 1 99 GLU 4.74 -3.44 1 100 LEU -0.72 -0.96 1 101 THR 7.00 -1.50 1 102 SER -0.95 4.50 1 103 LEU 3.00 -0.63 1 104 ALA 4.10 -0.77 1 105 GLU 5.03 -1.45 1 106 ASP 3.60 -0.72 1 107 LEU 2.60 0.10 1 108 LEU 0.03 0.29 1 110 LEU -0.60 0.30 1 111 THR -0.40 0.10 1 112 ASP -0.82 0.69 1 114 ASN 0.27 0.13 1 117 LEU 0.88 -0.17 1 118 ALA 0.70 -0.19 1 119 HIS 0.58 -0.28 1 120 HIS 0.23 0.16 1 121 HIS 1.62 2.83 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5862_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 0.43 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 7.43 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _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 89 GLN 4.92 -1.69 0 10 PHE -2.69 0.12 1 11 GLN 4.32 -0.79 1 13 GLN -3.45 0.29 1 15 VAL -3.48 0.05 1 16 VAL 2.38 -0.16 1 17 ASN -2.45 0.38 1 18 ARG 1.52 0.29 1 20 LEU -0.85 0.16 1 21 SER -6.24 0.32 1 22 LEU 4.32 -0.10 1 23 LYS 4.31 -0.12 1 24 ASP 2.76 -0.46 1 25 GLN 3.61 -0.47 1 26 GLN 4.19 -0.08 1 27 THR 6.68 -0.46 1 28 PHE 3.42 -0.45 1 29 ALA 2.88 -0.65 1 30 ARG 2.43 0.07 1 31 SER -0.70 0.27 1 32 VAL 4.06 -0.43 1 34 LEU 2.42 -0.11 1 35 LYS 1.95 -0.03 1 36 TRP 5.84 -0.68 1 37 ARG 5.11 -1.27 1 38 LYS 4.52 -0.41 1 39 VAL 6.11 -0.57 1 41 ARG 4.96 -0.30 1 42 SER 6.39 -0.16 1 43 LEU 1.96 -0.33 1 44 GLN 3.09 -0.31 1 45 ARG 4.55 -0.28 1 48 ARG 4.66 -0.28 1 49 ALA 1.46 -0.06 1 50 LEU -2.02 0.10 1 51 ARG 1.76 -0.28 1 52 ASP 4.13 -0.07 1 54 ALA 3.35 -0.15 1 55 LEU 5.06 -0.04 1 56 ASP 3.66 -0.19 1 57 SER 4.41 -0.07 1 58 LEU 2.74 -0.08 1 59 ALA 3.43 -0.17 1 60 TYR 2.76 -0.16 1 61 GLU 3.01 -0.59 1 62 TYR 0.63 0.45 1 63 GLU 4.50 -0.41 1 64 ARG 3.56 -0.22 1 65 GLU 1.75 -0.01 1 67 LEU 2.77 -0.30 1 68 TYR 4.35 -0.44 1 69 GLU 4.44 -0.46 1 70 GLN 6.20 -1.26 1 71 ALA 1.74 -0.73 1 72 PHE 3.80 -0.83 1 73 GLN 4.70 -0.68 1 74 LEU 5.60 -0.41 1 75 LEU 3.00 -0.26 1 76 ARG 5.10 -0.63 1 77 ARG 4.33 -0.28 1 78 PHE 2.21 -0.26 1 79 VAL 5.11 -0.85 1 80 GLN 4.07 -0.42 1 81 ALA 0.90 -0.14 1 82 GLU -2.66 -0.12 1 84 ARG 3.38 -0.29 1 85 ARG 2.15 -0.11 1 86 ALA -0.05 -0.29 1 87 THR -4.03 0.36 1 88 LEU 1.35 -0.31 1 90 ARG 2.41 -0.40 1 91 LEU 2.23 -0.35 1 92 VAL 7.44 -0.68 1 93 GLU 4.30 -0.18 1 94 ALA 2.82 -0.15 1 95 LEU 5.68 -0.25 1 96 GLU 3.30 -0.33 1 97 GLU 1.90 -0.13 1 98 ASN -1.30 0.21 1 99 GLU 4.74 -0.24 1 100 LEU -0.72 0.67 1 101 THR 7.00 -0.52 1 102 SER -0.95 -0.20 1 103 LEU 3.00 0.03 1 104 ALA 4.10 -0.54 1 105 GLU 5.03 -0.69 1 106 ASP 3.60 -0.17 1 107 LEU 2.60 -0.28 1 108 LEU 0.03 -0.19 1 110 LEU -0.60 0.10 1 111 THR -0.40 -0.07 1 112 ASP -0.82 -0.03 1 114 ASN 0.27 0.02 1 117 LEU 0.88 -0.12 1 118 ALA 0.70 -0.16 1 119 HIS 0.58 -0.14 1 stop_ save_