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 bmr19908_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -3.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.34 _LACS_plot.Line_2_terminator_val_x_2 7.52 _LACS_plot.Line_2_terminator_val_y_2 5.70 _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 55 ASP 0.68 -1.62 0 98 VAL -7.36 -2.36 0 10 LYS 0.97 0.55 1 11 PHE -2.48 -2.66 1 12 LYS -1.59 -1.69 1 13 VAL -0.44 -0.57 1 15 GLU 5.10 4.63 1 16 GLU 4.91 3.42 1 17 ILE 3.72 1.88 1 18 GLN 7.53 5.08 1 19 LYS 4.92 3.62 1 20 GLU 3.00 3.07 1 21 LEU 4.00 3.13 1 22 LEU 4.40 3.14 1 23 ASP 3.40 2.95 1 24 ALA 4.57 2.33 1 25 VAL 6.26 4.88 1 26 ALA 2.88 2.23 1 27 LYS -0.45 -0.63 1 28 ALA 0.34 0.49 1 29 GLN 1.40 1.71 1 30 LYS -2.73 0.13 1 31 ILE -4.97 -1.67 1 33 LYS -2.13 -1.16 1 35 ALA 4.15 3.53 1 36 ASN 4.35 3.69 1 37 GLU 2.88 3.48 1 38 VAL 7.32 5.63 1 40 LYS 4.39 3.56 1 41 ALA 3.24 1.97 1 42 VAL 5.33 4.16 1 43 GLU 4.21 3.82 1 44 ARG 0.66 0.78 1 46 ILE 0.08 0.23 1 47 ALA -1.44 -0.68 1 48 LYS -0.49 0.88 1 49 LEU -2.23 0.01 1 50 VAL -0.97 -0.52 1 51 ILE -2.78 -1.05 1 52 ILE -3.71 -1.57 1 53 ALA -0.63 -0.83 1 54 GLU 0.74 2.21 1 57 LYS -4.47 -0.96 1 60 GLU 3.87 3.01 1 61 VAL 4.97 4.35 1 63 ALA 4.04 5.09 1 67 TYR 3.92 2.80 1 68 LEU 2.13 2.59 1 70 GLU 3.72 2.59 1 71 GLU 2.79 2.56 1 72 LYS -0.74 -1.40 1 74 ILE -3.57 -1.41 1 76 TYR -6.30 -3.37 1 77 ALA -6.20 -1.91 1 78 TYR -5.80 -1.72 1 80 ALA 2.98 3.42 1 81 SER -4.78 -3.72 1 82 LYS 3.64 1.89 1 83 GLN 4.90 3.57 1 84 ASP 3.96 2.68 1 85 LEU 4.20 2.49 1 87 LYS 4.12 2.72 1 88 ALA 3.44 2.73 1 89 ALA -0.72 -1.21 1 91 LEU -3.81 -2.49 1 92 GLU -1.04 -0.96 1 93 VAL -4.78 -3.76 1 94 ALA -2.25 -1.16 1 95 ALA -2.14 -1.03 1 96 SER 4.41 2.37 1 97 SER -2.11 -1.76 1 99 ALA -5.79 -3.30 1 102 ASN -1.77 0.21 1 103 GLU -1.57 -0.98 1 105 ASP -2.35 0.10 1 106 ALA 3.14 3.12 1 107 GLU 3.88 2.72 1 108 GLU 1.59 1.90 1 109 LEU 4.69 3.07 1 110 LYS 4.92 4.09 1 111 VAL 4.60 3.76 1 112 LEU 2.86 2.87 1 113 ILE 6.01 5.34 1 114 GLU 4.14 3.02 1 115 LYS 4.41 3.93 1 116 VAL 5.45 3.64 1 117 ASN 4.02 2.71 1 118 VAL 3.97 2.68 1 119 LEU 1.26 0.86 1 120 LYS 1.37 0.60 1 121 GLN 1.47 1.93 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19908_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 4.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.27 _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 7.52 _LACS_plot.Line_2_terminator_val_y_2 -1.82 _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 55 ASP 0.68 -2.30 0 98 VAL -7.36 5.00 0 10 LYS 0.97 -0.42 1 11 PHE -2.48 -0.18 1 12 LYS -1.59 -0.10 1 13 VAL -0.44 -0.13 1 15 GLU 5.10 -0.47 1 16 GLU 4.91 -1.49 1 17 ILE 3.72 -1.84 1 18 GLN 7.53 -2.45 1 19 LYS 4.92 -1.30 1 20 GLU 3.00 0.07 1 21 LEU 4.00 -0.87 1 22 LEU 4.40 -1.26 1 23 ASP 3.40 -0.45 1 24 ALA 4.57 -2.24 1 25 VAL 6.26 -1.38 1 26 ALA 2.88 -0.65 1 27 LYS -0.45 -0.18 1 28 ALA 0.34 0.15 1 29 GLN 1.40 0.31 1 30 LYS -2.73 2.86 1 31 ILE -4.97 3.30 1 33 LYS -2.13 0.97 1 35 ALA 4.15 -0.62 1 36 ASN 4.35 -0.66 1 37 GLU 2.88 0.60 1 38 VAL 7.32 -1.69 1 40 LYS 4.39 -0.83 1 41 ALA 3.24 -1.27 1 42 VAL 5.33 -1.17 1 43 GLU 4.21 -0.39 1 44 ARG 0.66 0.12 1 46 ILE 0.08 0.15 1 47 ALA -1.44 0.76 1 48 LYS -0.49 1.37 1 49 LEU -2.23 2.24 1 50 VAL -0.97 0.45 1 51 ILE -2.78 1.73 1 52 ILE -3.71 2.14 1 53 ALA -0.63 -0.20 1 54 GLU 0.74 1.47 1 57 LYS -4.47 3.51 1 60 GLU 3.87 -0.86 1 61 VAL 4.97 -0.62 1 63 ALA 4.04 1.05 1 67 TYR 3.92 -1.12 1 68 LEU 2.13 0.46 1 70 GLU 3.72 -1.13 1 71 GLU 2.79 -0.23 1 72 LYS -0.74 -0.66 1 74 ILE -3.57 2.16 1 76 TYR -6.30 2.93 1 77 ALA -6.20 4.29 1 78 TYR -5.80 4.08 1 80 ALA 2.98 0.44 1 81 SER -4.78 1.06 1 82 LYS 3.64 -1.75 1 83 GLN 4.90 -1.33 1 84 ASP 3.96 -1.28 1 85 LEU 4.20 -1.71 1 87 LYS 4.12 -1.40 1 88 ALA 3.44 -0.71 1 89 ALA -0.72 -0.49 1 91 LEU -3.81 1.32 1 92 GLU -1.04 0.08 1 93 VAL -4.78 1.02 1 94 ALA -2.25 1.09 1 95 ALA -2.14 1.11 1 96 SER 4.41 -2.04 1 97 SER -2.11 0.35 1 99 ALA -5.79 2.49 1 102 ASN -1.77 1.98 1 103 GLU -1.57 0.59 1 105 ASP -2.35 2.45 1 106 ALA 3.14 -0.02 1 107 GLU 3.88 -1.16 1 108 GLU 1.59 0.31 1 109 LEU 4.69 -1.62 1 110 LYS 4.92 -0.83 1 111 VAL 4.60 -0.84 1 112 LEU 2.86 0.01 1 113 ILE 6.01 -0.67 1 114 GLU 4.14 -1.12 1 115 LYS 4.41 -0.48 1 116 VAL 5.45 -1.81 1 117 ASN 4.02 -1.31 1 118 VAL 3.97 -1.29 1 119 LEU 1.26 -0.40 1 120 LYS 1.37 -0.77 1 121 GLN 1.47 0.46 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19908_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 0.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 7.31 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _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 78 TYR -5.80 1.63 0 11 PHE -2.48 0.04 1 12 LYS -1.59 0.09 1 13 VAL -0.44 -0.02 1 15 GLU 5.10 0.41 1 16 GLU 4.91 0.42 1 17 ILE 3.72 0.59 1 20 GLU 3.00 -0.31 1 21 LEU 4.00 -0.47 1 22 LEU 4.40 -0.34 1 23 ASP 3.40 -0.28 1 24 ALA 4.57 -0.35 1 25 VAL 6.26 -0.97 1 26 ALA 2.88 -0.08 1 27 LYS -0.45 0.01 1 28 ALA 0.34 -0.31 1 29 GLN 1.40 -0.12 1 30 LYS -2.73 0.46 1 31 ILE -4.97 1.05 1 33 LYS -2.13 0.30 1 36 ASN 4.35 -0.16 1 37 GLU 2.88 -0.30 1 38 VAL 7.32 -0.91 1 40 LYS 4.39 -0.17 1 41 ALA 3.24 -0.32 1 42 VAL 5.33 -0.62 1 44 ARG 0.66 -0.20 1 46 ILE 0.08 0.31 1 47 ALA -1.44 -0.25 1 48 LYS -0.49 0.02 1 49 LEU -2.23 0.21 1 50 VAL -0.97 0.54 1 52 ILE -3.71 -0.35 1 53 ALA -0.63 0.74 1 54 GLU 0.74 0.55 1 55 ASP 0.68 0.17 1 57 LYS -4.47 -0.05 1 61 VAL 4.97 0.65 1 67 TYR 3.92 -0.47 1 68 LEU 2.13 -0.30 1 70 GLU 3.72 -0.14 1 71 GLU 2.79 -0.36 1 72 LYS -0.74 -0.01 1 74 ILE -3.57 0.02 1 76 TYR -6.30 1.43 1 77 ALA -6.20 -0.18 1 80 ALA 2.98 0.27 1 81 SER -4.78 0.81 1 82 LYS 3.64 -0.09 1 84 ASP 3.96 -0.40 1 85 LEU 4.20 -0.34 1 87 LYS 4.12 -0.10 1 88 ALA 3.44 -0.30 1 89 ALA -0.72 -0.52 1 91 LEU -3.81 -0.06 1 92 GLU -1.04 -0.07 1 93 VAL -4.78 0.31 1 94 ALA -2.25 -0.29 1 95 ALA -2.14 0.21 1 97 SER -2.11 0.70 1 98 VAL -7.36 0.54 1 99 ALA -5.79 1.08 1 102 ASN -1.77 0.30 1 103 GLU -1.57 0.01 1 105 ASP -2.35 0.13 1 106 ALA 3.14 0.46 1 107 GLU 3.88 -0.25 1 108 GLU 1.59 -0.01 1 109 LEU 4.69 -0.36 1 110 LYS 4.92 -0.44 1 111 VAL 4.60 -0.41 1 112 LEU 2.86 0.83 1 113 ILE 6.01 -0.86 1 114 GLU 4.14 -0.29 1 115 LYS 4.41 -0.31 1 116 VAL 5.45 -0.44 1 117 ASN 4.02 -0.49 1 118 VAL 3.97 -0.22 1 119 LEU 1.26 -0.21 1 120 LYS 1.37 -0.67 1 121 GLN 1.47 -0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19908_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -3.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.02 _LACS_plot.Line_2_terminator_val_x_2 7.52 _LACS_plot.Line_2_terminator_val_y_2 3.03 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 SER 4.41 -2.01 0 81 SER -4.78 1.18 0 10 LYS 0.97 -1.21 1 11 PHE -2.48 -3.61 1 12 LYS -1.59 -0.52 1 15 GLU 5.10 1.36 1 16 GLU 4.91 2.44 1 17 ILE 3.72 1.43 1 18 GLN 7.53 2.05 1 19 LYS 4.92 2.19 1 20 GLU 3.00 3.45 1 21 LEU 4.00 1.75 1 22 LEU 4.40 2.12 1 23 ASP 3.40 1.62 1 24 ALA 4.57 2.71 1 25 VAL 6.26 0.74 1 26 ALA 2.88 1.60 1 27 LYS -0.45 -0.89 1 28 ALA 0.34 -0.61 1 29 GLN 1.40 0.85 1 30 LYS -2.73 -1.21 1 31 ILE -4.97 -1.88 1 33 LYS -2.13 -3.58 1 35 ALA 4.15 3.33 1 36 ASN 4.35 2.71 1 37 GLU 2.88 3.56 1 38 VAL 7.32 0.58 1 40 LYS 4.39 1.48 1 41 ALA 3.24 1.65 1 42 VAL 5.33 2.34 1 43 GLU 4.21 2.61 1 44 ARG 0.66 0.80 1 46 ILE 0.08 -0.75 1 47 ALA -1.44 -2.12 1 48 LYS -0.49 -0.47 1 49 LEU -2.23 -3.27 1 50 VAL -0.97 -3.37 1 51 ILE -2.78 -2.82 1 52 ILE -3.71 -1.10 1 53 ALA -0.63 2.60 1 54 GLU 0.74 -0.47 1 55 ASP 0.68 -1.02 1 60 GLU 3.87 -0.36 1 61 VAL 4.97 0.00 1 63 ALA 4.04 0.98 1 67 TYR 3.92 2.06 1 68 LEU 2.13 1.47 1 70 GLU 3.72 3.51 1 71 GLU 2.79 2.06 1 72 LYS -0.74 0.12 1 76 TYR -6.30 -2.99 1 77 ALA -6.20 -4.68 1 78 TYR -5.80 -0.36 1 80 ALA 2.98 0.68 1 82 LYS 3.64 2.39 1 83 GLN 4.90 2.05 1 84 ASP 3.96 2.96 1 85 LEU 4.20 0.17 1 87 LYS 4.12 4.94 1 88 ALA 3.44 0.08 1 89 ALA -0.72 -3.13 1 91 LEU -3.81 -0.44 1 92 GLU -1.04 -0.71 1 93 VAL -4.78 -2.60 1 94 ALA -2.25 -1.29 1 95 ALA -2.14 -1.85 1 97 SER -2.11 -1.98 1 98 VAL -7.36 -2.86 1 99 ALA -5.79 -1.28 1 102 ASN -1.77 -1.77 1 103 GLU -1.57 -1.66 1 105 ASP -2.35 -0.01 1 106 ALA 3.14 2.35 1 107 GLU 3.88 2.48 1 108 GLU 1.59 1.42 1 109 LEU 4.69 -0.23 1 110 LYS 4.92 3.51 1 111 VAL 4.60 1.88 1 112 LEU 2.86 0.70 1 113 ILE 6.01 1.40 1 114 GLU 4.14 2.79 1 115 LYS 4.41 2.99 1 116 VAL 5.45 1.23 1 117 ASN 4.02 3.45 1 118 VAL 3.97 1.39 1 119 LEU 1.26 -0.21 1 120 LYS 1.37 -1.24 1 stop_ save_