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 bmr11587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.07 _LACS_plot.Line_1_terminator_val_y_1 -2.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 9.57 _LACS_plot.Line_2_terminator_val_y_2 7.00 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ARG 5.63 1.61 0 86 LYS 9.57 7.10 0 13 HIS -6.59 -0.52 0 10 ARG -4.64 -0.99 1 12 SER -4.05 -1.93 1 14 LEU -2.42 0.73 1 15 LEU -5.46 -2.40 1 16 VAL -0.63 -0.33 1 17 LYS -2.41 1.03 1 18 HIS -5.01 -0.23 1 19 SER 3.27 2.72 1 20 GLN -0.39 -0.39 1 21 SER 3.49 3.34 1 22 ARG 4.47 3.17 1 23 ARG -2.17 -0.66 1 25 SER -2.07 -0.14 1 26 SER -6.52 -1.39 1 27 TRP 3.19 0.73 1 28 ARG 1.72 0.89 1 30 GLU 2.78 2.74 1 31 LYS -1.83 -0.86 1 32 ILE 1.15 -0.27 1 33 THR -1.13 -1.01 1 34 ARG -0.40 -0.26 1 35 THR -2.48 -0.77 1 36 LYS 5.42 4.29 1 37 GLU 5.36 4.19 1 38 GLU 2.18 2.47 1 39 ALA 2.82 2.55 1 40 LEU 3.27 2.41 1 41 GLU 3.41 2.98 1 42 LEU 3.40 2.67 1 43 ILE 4.83 1.58 1 44 ASN 4.05 2.87 1 46 TYR 3.70 0.88 1 47 ILE 6.45 5.95 1 48 GLN 4.88 3.60 1 49 LYS 2.90 3.44 1 50 ILE 2.71 2.87 1 51 LYS 4.04 3.59 1 52 SER 0.84 1.15 1 54 GLU 1.21 2.35 1 55 GLU -6.78 -2.39 1 56 ASP -3.70 -1.66 1 57 PHE 4.26 5.09 1 58 GLU 4.07 3.95 1 59 SER 4.09 3.02 1 60 LEU 3.23 2.43 1 61 ALA 5.15 2.98 1 62 SER 2.59 2.55 1 63 GLN -0.07 1.90 1 64 PHE -1.76 -0.24 1 65 SER -3.23 -1.23 1 66 ASP -0.53 2.27 1 67 ALA -3.26 -0.84 1 68 SER 5.34 4.06 1 69 SER 1.35 0.49 1 70 ALA 3.39 4.16 1 71 LYS 3.07 1.60 1 72 ALA -1.05 -1.74 1 75 ASP 0.68 1.63 1 76 LEU -2.17 -0.44 1 78 ALA -2.99 -1.98 1 79 PHE -2.91 -1.41 1 80 SER -4.34 -1.58 1 81 ARG 3.46 2.72 1 83 GLN -0.17 2.24 1 84 MET -3.35 -3.03 1 85 GLN 1.05 1.42 1 88 PHE 2.05 3.02 1 89 GLU 3.08 3.88 1 90 ASP 4.69 3.24 1 91 ALA 1.10 2.07 1 92 SER 5.57 5.29 1 93 PHE 4.31 3.70 1 94 ALA -0.93 -0.36 1 95 LEU -1.08 -0.44 1 96 ARG -0.89 -0.90 1 97 THR 7.01 4.70 1 99 GLU -3.33 -0.90 1 100 MET -7.07 -2.40 1 101 SER -0.60 0.94 1 104 VAL -2.49 -0.46 1 105 PHE 0.92 0.77 1 106 THR -0.97 -1.77 1 107 ASP 2.92 2.16 1 108 SER 1.93 2.16 1 110 ILE -1.41 -0.80 1 111 HIS -5.96 -0.73 1 112 ILE -1.52 1.47 1 113 ILE -3.21 -0.07 1 114 LEU -5.21 -2.16 1 115 ARG 1.39 0.56 1 116 THR 0.59 0.30 1 117 GLU -1.95 1.68 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.07 _LACS_plot.Line_1_terminator_val_y_1 4.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.17 _LACS_plot.Line_2_terminator_val_x_2 9.57 _LACS_plot.Line_2_terminator_val_y_2 -2.57 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ARG 5.63 -4.02 0 86 LYS 9.57 -2.47 0 13 HIS -6.59 6.07 0 10 ARG -4.64 3.65 1 12 SER -4.05 2.12 1 14 LEU -2.42 3.15 1 15 LEU -5.46 3.06 1 16 VAL -0.63 0.30 1 17 LYS -2.41 3.44 1 18 HIS -5.01 4.78 1 19 SER 3.27 -0.55 1 20 GLN -0.39 0.00 1 21 SER 3.49 -0.15 1 22 ARG 4.47 -1.30 1 23 ARG -2.17 1.51 1 25 SER -2.07 1.93 1 26 SER -6.52 5.13 1 27 TRP 3.19 -2.46 1 28 ARG 1.72 -0.83 1 30 GLU 2.78 -0.04 1 31 LYS -1.83 0.97 1 32 ILE 1.15 -1.42 1 33 THR -1.13 0.12 1 34 ARG -0.40 0.14 1 35 THR -2.48 1.71 1 36 LYS 5.42 -1.13 1 37 GLU 5.36 -1.17 1 38 GLU 2.18 0.29 1 39 ALA 2.82 -0.27 1 40 LEU 3.27 -0.86 1 41 GLU 3.41 -0.43 1 42 LEU 3.40 -0.73 1 43 ILE 4.83 -3.25 1 44 ASN 4.05 -1.18 1 46 TYR 3.70 -2.82 1 47 ILE 6.45 -0.50 1 48 GLN 4.88 -1.28 1 49 LYS 2.90 0.54 1 50 ILE 2.71 0.16 1 51 LYS 4.04 -0.45 1 52 SER 0.84 0.31 1 54 GLU 1.21 1.14 1 55 GLU -6.78 4.39 1 56 ASP -3.70 2.04 1 57 PHE 4.26 0.83 1 58 GLU 4.07 -0.12 1 59 SER 4.09 -1.07 1 60 LEU 3.23 -0.80 1 61 ALA 5.15 -2.17 1 62 SER 2.59 -0.04 1 63 GLN -0.07 1.97 1 64 PHE -1.76 1.52 1 65 SER -3.23 2.00 1 66 ASP -0.53 2.80 1 67 ALA -3.26 2.42 1 68 SER 5.34 -1.28 1 69 SER 1.35 -0.86 1 70 ALA 3.39 0.77 1 71 LYS 3.07 -1.47 1 72 ALA -1.05 -0.69 1 75 ASP 0.68 0.95 1 76 LEU -2.17 1.73 1 78 ALA -2.99 1.01 1 79 PHE -2.91 1.50 1 80 SER -4.34 2.76 1 81 ARG 3.46 -0.74 1 83 GLN -0.17 2.41 1 84 MET -3.35 0.32 1 85 GLN 1.05 0.37 1 88 PHE 2.05 0.97 1 89 GLU 3.08 0.80 1 90 ASP 4.69 -1.45 1 91 ALA 1.10 0.97 1 92 SER 5.57 -0.28 1 93 PHE 4.31 -0.61 1 94 ALA -0.93 0.57 1 95 LEU -1.08 0.64 1 96 ARG -0.89 -0.01 1 97 THR 7.01 -2.31 1 99 GLU -3.33 2.43 1 100 MET -7.07 4.67 1 101 SER -0.60 1.54 1 104 VAL -2.49 2.03 1 105 PHE 0.92 -0.15 1 106 THR -0.97 -0.80 1 107 ASP 2.92 -0.76 1 108 SER 1.93 0.23 1 110 ILE -1.41 0.61 1 111 HIS -5.96 5.23 1 112 ILE -1.52 2.99 1 113 ILE -3.21 3.14 1 114 LEU -5.21 3.05 1 115 ARG 1.39 -0.83 1 116 THR 0.59 -0.29 1 117 GLU -1.95 3.63 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.07 _LACS_plot.Line_1_terminator_val_y_1 0.72 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 9.57 _LACS_plot.Line_2_terminator_val_y_2 -0.91 _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 111 HIS -5.96 1.41 0 13 HIS -6.59 1.56 0 86 LYS 9.57 -0.40 0 12 SER -4.05 1.44 0 10 ARG -4.64 0.50 1 14 LEU -2.42 -0.36 1 15 LEU -5.46 0.49 1 16 VAL -0.63 0.54 1 17 LYS -2.41 -0.17 1 18 HIS -5.01 -0.03 1 19 SER 3.27 -0.35 1 20 GLN -0.39 0.35 1 21 SER 3.49 -0.62 1 22 ARG 4.47 -0.27 1 23 ARG -2.17 0.18 1 25 SER -2.07 -0.06 1 26 SER -6.52 0.56 1 27 TRP 3.19 -0.29 1 28 ARG 1.72 -0.77 1 30 GLU 2.78 -0.31 1 31 LYS -1.83 0.33 1 32 ILE 1.15 -0.30 1 33 THR -1.13 0.01 1 34 ARG -0.40 0.27 1 35 THR -2.48 0.25 1 36 LYS 5.42 -0.88 1 37 GLU 5.36 -0.44 1 38 GLU 2.18 -0.39 1 39 ALA 2.82 -0.32 1 40 LEU 3.27 -0.44 1 41 GLU 3.41 -0.30 1 42 LEU 3.40 -0.69 1 43 ILE 4.83 -0.51 1 44 ASN 4.05 -0.21 1 46 TYR 3.70 -0.13 1 47 ILE 6.45 -0.65 1 48 GLN 4.88 -0.30 1 49 LYS 2.90 -0.22 1 50 ILE 2.71 0.14 1 51 LYS 4.04 -0.22 1 52 SER 0.84 -0.04 1 54 GLU 1.21 -0.31 1 55 GLU -6.78 0.30 1 56 ASP -3.70 0.25 1 57 PHE 4.26 -1.00 1 58 GLU 4.07 -0.46 1 59 SER 4.09 -0.31 1 60 LEU 3.23 -0.35 1 61 ALA 5.15 -0.68 1 62 SER 2.59 0.05 1 63 GLN -0.07 -0.16 1 64 PHE -1.76 0.13 1 65 SER -3.23 0.29 1 66 ASP -0.53 -0.05 1 67 ALA -3.26 0.47 1 68 SER 5.34 -0.07 1 69 SER 1.35 -0.10 1 70 ALA 3.39 -0.50 1 71 LYS 3.07 -0.34 1 72 ALA -1.05 0.39 1 73 ARG 5.63 -0.65 1 75 ASP 0.68 0.17 1 76 LEU -2.17 0.14 1 78 ALA -2.99 0.93 1 79 PHE -2.91 0.47 1 80 SER -4.34 0.90 1 81 ARG 3.46 -0.38 1 83 GLN -0.17 0.09 1 84 MET -3.35 0.14 1 85 GLN 1.05 -0.13 1 88 PHE 2.05 -0.95 1 89 GLU 3.08 -0.26 1 90 ASP 4.69 -0.19 1 91 ALA 1.10 -0.16 1 92 SER 5.57 -0.41 1 93 PHE 4.31 -0.77 1 94 ALA -0.93 0.11 1 95 LEU -1.08 -0.09 1 96 ARG -0.89 0.03 1 97 THR 7.01 -1.14 1 99 GLU -3.33 -0.02 1 100 MET -7.07 1.18 1 101 SER -0.60 -0.05 1 104 VAL -2.49 0.22 1 105 PHE 0.92 0.28 1 106 THR -0.97 0.73 1 107 ASP 2.92 0.00 1 108 SER 1.93 0.25 1 110 ILE -1.41 0.80 1 112 ILE -1.52 0.05 1 113 ILE -3.21 0.57 1 114 LEU -5.21 0.49 1 115 ARG 1.39 0.78 1 116 THR 0.59 0.04 1 117 GLU -1.95 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11587_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.07 _LACS_plot.Line_1_terminator_val_y_1 -1.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.25 _LACS_plot.Line_2_terminator_val_x_2 9.57 _LACS_plot.Line_2_terminator_val_y_2 2.66 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 117 GLU -1.95 4.77 0 111 HIS -5.96 3.33 0 86 LYS 9.57 -0.73 0 10 ARG -4.64 -0.42 1 12 SER -4.05 -1.47 1 13 HIS -6.59 -2.54 1 14 LEU -2.42 -4.13 1 15 LEU -5.46 -3.49 1 16 VAL -0.63 0.04 1 17 LYS -2.41 -2.46 1 18 HIS -5.01 2.47 1 19 SER 3.27 0.96 1 20 GLN -0.39 0.33 1 21 SER 3.49 -1.49 1 22 ARG 4.47 0.32 1 23 ARG -2.17 -0.24 1 25 SER -2.07 -2.24 1 26 SER -6.52 -0.03 1 27 TRP 3.19 0.24 1 30 GLU 2.78 0.08 1 31 LYS -1.83 -2.05 1 32 ILE 1.15 -0.80 1 33 THR -1.13 0.63 1 34 ARG -0.40 -1.71 1 35 THR -2.48 1.78 1 36 LYS 5.42 1.20 1 37 GLU 5.36 3.21 1 38 GLU 2.18 3.33 1 39 ALA 2.82 0.26 1 40 LEU 3.27 0.23 1 41 GLU 3.41 3.73 1 42 LEU 3.40 1.06 1 43 ILE 4.83 1.06 1 44 ASN 4.05 3.92 1 46 TYR 3.70 2.25 1 47 ILE 6.45 1.51 1 48 GLN 4.88 3.28 1 49 LYS 2.90 1.73 1 50 ILE 2.71 4.85 1 51 LYS 4.04 2.36 1 52 SER 0.84 1.07 1 54 GLU 1.21 0.12 1 55 GLU -6.78 -2.30 1 56 ASP -3.70 -0.65 1 57 PHE 4.26 0.96 1 58 GLU 4.07 2.50 1 59 SER 4.09 3.44 1 60 LEU 3.23 1.29 1 61 ALA 5.15 1.07 1 62 SER 2.59 0.26 1 63 GLN -0.07 1.59 1 64 PHE -1.76 -0.79 1 65 SER -3.23 1.22 1 66 ASP -0.53 -0.67 1 67 ALA -3.26 0.96 1 69 SER 1.35 2.18 1 70 ALA 3.39 2.26 1 71 LYS 3.07 0.02 1 72 ALA -1.05 -0.41 1 73 ARG 5.63 -1.38 1 75 ASP 0.68 -0.68 1 76 LEU -2.17 1.27 1 78 ALA -2.99 1.19 1 79 PHE -2.91 -3.01 1 80 SER -4.34 0.51 1 81 ARG 3.46 1.56 1 83 GLN -0.17 0.19 1 84 MET -3.35 -0.73 1 85 GLN 1.05 2.65 1 88 PHE 2.05 2.43 1 89 GLU 3.08 0.94 1 90 ASP 4.69 3.01 1 91 ALA 1.10 1.78 1 92 SER 5.57 0.15 1 93 PHE 4.31 0.07 1 94 ALA -0.93 0.14 1 95 LEU -1.08 0.31 1 96 ARG -0.89 0.73 1 97 THR 7.01 1.08 1 99 GLU -3.33 -3.52 1 100 MET -7.07 0.08 1 101 SER -0.60 0.16 1 104 VAL -2.49 -1.08 1 105 PHE 0.92 0.14 1 108 SER 1.93 0.86 1 110 ILE -1.41 -2.46 1 112 ILE -1.52 -0.84 1 113 ILE -3.21 -3.71 1 114 LEU -5.21 -2.06 1 115 ARG 1.39 -0.10 1 116 THR 0.59 0.73 1 stop_ save_