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 bmr18404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.42 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _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 -1.54 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 4.90 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 123 ASN 2.73 4.71 0 109 THR 6.88 6.02 0 12 SER -0.09 0.12 1 13 GLU -1.43 0.04 1 15 THR 0.08 0.48 1 16 THR 0.23 0.41 1 18 THR 0.34 0.21 1 19 THR 1.14 1.22 1 20 ASN 0.71 0.41 1 21 LEU 0.74 0.50 1 22 LYS 0.89 0.40 1 23 ILE -0.20 0.24 1 24 TYR -3.75 -1.02 1 25 LYS -1.92 -0.61 1 26 VAL 1.95 -0.64 1 27 ASP 3.46 4.12 1 28 ASP -2.75 -0.30 1 29 LEU -4.47 -0.58 1 30 GLN -5.19 -1.63 1 31 LYS 1.32 -1.38 1 32 ILE -1.88 -2.42 1 33 ASN 2.45 0.84 1 35 ILE -4.89 -2.27 1 36 TRP 0.90 0.82 1 37 GLN -5.88 -0.55 1 38 VAL -3.86 -1.37 1 39 ARG -4.07 -2.19 1 40 ASN -3.96 0.03 1 41 ASN 2.46 1.22 1 42 ILE 3.88 1.55 1 43 LEU 0.26 1.37 1 44 VAL 1.19 -0.35 1 46 THR -1.78 -1.58 1 47 ASP 2.45 1.03 1 48 PHE 1.80 2.09 1 49 THR -4.18 -2.21 1 50 TRP 3.65 2.94 1 51 VAL 4.18 2.88 1 52 ASP 0.64 1.60 1 53 ASN -4.01 0.50 1 55 ILE -3.58 -0.98 1 56 ALA 3.19 0.95 1 57 ALA 1.94 1.65 1 58 ASP 1.69 1.67 1 59 ASP -0.14 0.94 1 60 VAL -3.76 -3.75 1 61 ILE -3.69 -1.01 1 62 GLU 2.58 0.91 1 63 VAL -8.42 -3.55 1 64 THR -2.71 -0.98 1 65 SER 4.05 2.44 1 66 ASN -1.19 -1.26 1 68 THR 1.38 0.96 1 69 ARG 1.62 1.35 1 70 THR 0.03 -0.79 1 71 SER 2.80 2.20 1 72 ASP 1.75 0.99 1 73 GLN 1.55 -0.19 1 74 VAL -0.38 -0.99 1 75 LEU 0.38 0.31 1 76 GLN -5.82 -2.10 1 77 LYS 3.61 2.64 1 80 TYR -4.41 -0.93 1 81 PHE -3.89 -1.36 1 82 VAL -4.16 -3.66 1 83 ILE 0.75 0.17 1 84 ASN -1.06 -0.73 1 86 ASN 2.79 1.41 1 87 ASN 1.19 -0.36 1 88 VAL 0.49 -0.48 1 89 LYS 2.51 1.64 1 90 SER -0.81 -0.20 1 91 VAL -1.51 0.17 1 93 THR 1.17 1.39 1 95 MET -4.85 -1.90 1 96 LYS 1.48 0.74 1 98 SER 2.92 1.96 1 101 LEU -1.50 -1.20 1 102 SER 0.05 0.08 1 103 TRP -5.00 -1.90 1 104 ALA -6.59 -2.28 1 105 GLN 1.25 0.29 1 106 VAL -0.55 -0.80 1 107 ASN -1.60 -0.43 1 108 PHE -4.68 -1.31 1 110 THR 6.32 3.97 1 113 ASN -0.09 0.30 1 114 VAL -5.26 -0.59 1 115 TRP -1.00 -0.23 1 116 LEU -7.06 -1.67 1 117 ASN 0.16 -1.07 1 118 THR -0.69 -1.50 1 119 THR -0.41 -0.18 1 120 SER -1.32 -0.36 1 121 LYS 5.56 4.79 1 122 ASP 3.76 3.10 1 124 LEU 3.21 3.19 1 125 LEU 2.56 2.31 1 126 TYR -1.61 0.01 1 128 LYS 0.47 1.44 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.42 _LACS_plot.Line_1_terminator_val_y_1 5.66 _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 0.46 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 -1.97 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 123 ASN 2.73 1.98 0 109 THR 6.88 -0.86 0 12 SER -0.09 0.21 1 13 GLU -1.43 1.47 1 15 THR 0.08 0.40 1 16 THR 0.23 0.18 1 18 THR 0.34 -0.13 1 19 THR 1.14 0.08 1 20 ASN 0.71 -0.30 1 21 LEU 0.74 -0.24 1 22 LYS 0.89 -0.49 1 23 ILE -0.20 0.44 1 24 TYR -3.75 2.73 1 25 LYS -1.92 1.31 1 26 VAL 1.95 -2.59 1 27 ASP 3.46 0.66 1 28 ASP -2.75 2.45 1 29 LEU -4.47 3.89 1 30 GLN -5.19 3.56 1 31 LYS 1.32 -2.70 1 32 ILE -1.88 -0.54 1 33 ASN 2.45 -1.61 1 35 ILE -4.89 2.62 1 36 TRP 0.90 -0.08 1 37 GLN -5.88 5.33 1 38 VAL -3.86 2.49 1 39 ARG -4.07 1.88 1 40 ASN -3.96 3.99 1 41 ASN 2.46 -1.24 1 42 ILE 3.88 -2.33 1 43 LEU 0.26 1.11 1 44 VAL 1.19 -1.54 1 46 THR -1.78 0.20 1 47 ASP 2.45 -1.42 1 48 PHE 1.80 0.29 1 49 THR -4.18 1.97 1 50 TRP 3.65 -0.71 1 51 VAL 4.18 -1.30 1 52 ASP 0.64 0.96 1 53 ASN -4.01 4.51 1 55 ILE -3.58 2.60 1 56 ALA 3.19 -2.24 1 57 ALA 1.94 -0.29 1 58 ASP 1.69 -0.02 1 59 ASP -0.14 1.08 1 60 VAL -3.76 0.01 1 61 ILE -3.69 2.68 1 62 GLU 2.58 -1.67 1 63 VAL -8.42 4.87 1 64 THR -2.71 1.73 1 65 SER 4.05 -1.61 1 66 ASN -1.19 -0.07 1 68 THR 1.38 -0.42 1 69 ARG 1.62 -0.27 1 70 THR 0.03 -0.82 1 71 SER 2.80 -0.60 1 72 ASP 1.75 -0.76 1 73 GLN 1.55 -1.74 1 74 VAL -0.38 -0.61 1 75 LEU 0.38 -0.07 1 76 GLN -5.82 3.72 1 77 LYS 3.61 -0.97 1 80 TYR -4.41 3.48 1 81 PHE -3.89 2.53 1 82 VAL -4.16 0.50 1 83 ILE 0.75 -0.58 1 84 ASN -1.06 0.33 1 86 ASN 2.79 -1.38 1 87 ASN 1.19 -1.55 1 88 VAL 0.49 -0.97 1 89 LYS 2.51 -0.87 1 90 SER -0.81 0.61 1 91 VAL -1.51 1.68 1 93 THR 1.17 0.22 1 95 MET -4.85 2.95 1 96 LYS 1.48 -0.74 1 98 SER 2.92 -0.96 1 101 LEU -1.50 0.30 1 102 SER 0.05 0.03 1 103 TRP -5.00 3.10 1 104 ALA -6.59 4.31 1 105 GLN 1.25 -0.96 1 106 VAL -0.55 -0.25 1 107 ASN -1.60 1.17 1 108 PHE -4.68 3.37 1 110 THR 6.32 -2.35 1 113 ASN -0.09 0.39 1 114 VAL -5.26 4.67 1 115 TRP -1.00 0.77 1 116 LEU -7.06 5.39 1 117 ASN 0.16 -1.23 1 118 THR -0.69 -0.81 1 119 THR -0.41 0.23 1 120 SER -1.32 0.96 1 121 LYS 5.56 -0.77 1 122 ASP 3.76 -0.66 1 124 LEU 3.21 -0.02 1 125 LEU 2.56 -0.25 1 126 TYR -1.61 1.62 1 128 LYS 0.47 0.97 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.42 _LACS_plot.Line_1_terminator_val_y_1 0.91 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 -0.59 _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 65 SER 4.05 -1.73 0 12 SER -0.09 -0.02 1 13 GLU -1.43 -0.24 1 15 THR 0.08 0.00 1 16 THR 0.23 -0.02 1 18 THR 0.34 0.00 1 19 THR 1.14 -0.26 1 20 ASN 0.71 -0.02 1 21 LEU 0.74 0.02 1 22 LYS 0.89 -0.51 1 23 ILE -0.20 -0.21 1 24 TYR -3.75 -0.14 1 25 LYS -1.92 0.21 1 26 VAL 1.95 -0.05 1 27 ASP 3.46 -0.02 1 28 ASP -2.75 0.05 1 29 LEU -4.47 1.26 1 30 GLN -5.19 0.18 1 31 LYS 1.32 -0.51 1 32 ILE -1.88 -0.21 1 33 ASN 2.45 -0.49 1 35 ILE -4.89 0.19 1 36 TRP 0.90 -0.14 1 37 GLN -5.88 0.94 1 38 VAL -3.86 0.71 1 39 ARG -4.07 0.17 1 40 ASN -3.96 0.74 1 41 ASN 2.46 -0.17 1 42 ILE 3.88 -0.08 1 43 LEU 0.26 0.06 1 44 VAL 1.19 0.41 1 46 THR -1.78 0.16 1 47 ASP 2.45 -0.52 1 48 PHE 1.80 -0.63 1 49 THR -4.18 -0.24 1 50 TRP 3.65 -0.96 1 51 VAL 4.18 -0.18 1 52 ASP 0.64 0.37 1 53 ASN -4.01 0.57 1 55 ILE -3.58 -0.38 1 56 ALA 3.19 -0.02 1 57 ALA 1.94 -0.69 1 58 ASP 1.69 -0.15 1 59 ASP -0.14 0.46 1 60 VAL -3.76 1.06 1 61 ILE -3.69 0.21 1 62 GLU 2.58 0.29 1 63 VAL -8.42 1.28 1 64 THR -2.71 0.22 1 66 ASN -1.19 -0.02 1 68 THR 1.38 -0.20 1 69 ARG 1.62 0.22 1 70 THR 0.03 0.08 1 71 SER 2.80 -0.15 1 72 ASP 1.75 -0.17 1 73 GLN 1.55 -0.67 1 74 VAL -0.38 -0.10 1 75 LEU 0.38 -0.25 1 76 GLN -5.82 0.04 1 77 LYS 3.61 -0.55 1 80 TYR -4.41 1.05 1 81 PHE -3.89 1.26 1 82 VAL -4.16 0.94 1 83 ILE 0.75 -0.14 1 84 ASN -1.06 -0.47 1 86 ASN 2.79 -0.25 1 87 ASN 1.19 0.50 1 88 VAL 0.49 -0.19 1 89 LYS 2.51 -0.20 1 90 SER -0.81 -0.09 1 91 VAL -1.51 0.08 1 93 THR 1.17 -0.21 1 95 MET -4.85 0.37 1 96 LYS 1.48 0.21 1 98 SER 2.92 -0.22 1 101 LEU -1.50 -0.07 1 102 SER 0.05 0.39 1 103 TRP -5.00 0.58 1 104 ALA -6.59 0.61 1 105 GLN 1.25 -0.82 1 106 VAL -0.55 0.05 1 107 ASN -1.60 0.26 1 108 PHE -4.68 1.02 1 109 THR 6.88 -0.56 1 110 THR 6.32 -0.01 1 113 ASN -0.09 0.55 1 114 VAL -5.26 0.23 1 115 TRP -1.00 0.62 1 116 LEU -7.06 1.08 1 117 ASN 0.16 0.04 1 118 THR -0.69 0.27 1 119 THR -0.41 0.17 1 120 SER -1.32 0.03 1 121 LYS 5.56 -0.51 1 122 ASP 3.76 0.01 1 123 ASN 2.73 -0.24 1 124 LEU 3.21 -0.35 1 125 LEU 2.56 -0.34 1 126 TYR -1.61 0.33 1 128 LYS 0.47 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18404_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.42 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 1.37 _LACS_plot.Y_axis_chem_shift_offset 0.50 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 THR 1.17 7.38 0 12 SER -0.09 -1.20 1 13 GLU -1.43 1.41 1 15 THR 0.08 -0.15 1 16 THR 0.23 -0.55 1 18 THR 0.34 0.20 1 19 THR 1.14 -0.79 1 20 ASN 0.71 -0.17 1 21 LEU 0.74 -0.85 1 22 LYS 0.89 -2.86 1 23 ILE -0.20 -1.11 1 24 TYR -3.75 -2.04 1 25 LYS -1.92 0.55 1 26 VAL 1.95 -1.20 1 27 ASP 3.46 0.83 1 28 ASP -2.75 -3.26 1 29 LEU -4.47 -2.82 1 30 GLN -5.19 -3.55 1 31 LYS 1.32 -1.82 1 32 ILE -1.88 -0.40 1 33 ASN 2.45 -0.05 1 35 ILE -4.89 -1.09 1 36 TRP 0.90 0.20 1 37 GLN -5.88 -2.22 1 38 VAL -3.86 -0.48 1 39 ARG -4.07 -2.41 1 40 ASN -3.96 -1.60 1 41 ASN 2.46 1.42 1 42 ILE 3.88 2.10 1 43 LEU 0.26 -0.14 1 44 VAL 1.19 -2.36 1 46 THR -1.78 -3.50 1 47 ASP 2.45 -2.41 1 48 PHE 1.80 1.08 1 49 THR -4.18 -1.75 1 50 TRP 3.65 3.08 1 51 VAL 4.18 0.23 1 52 ASP 0.64 0.28 1 53 ASN -4.01 -1.62 1 55 ILE -3.58 -0.74 1 56 ALA 3.19 0.26 1 57 ALA 1.94 1.47 1 58 ASP 1.69 0.85 1 59 ASP -0.14 -2.16 1 60 VAL -3.76 -1.65 1 61 ILE -3.69 -0.69 1 62 GLU 2.58 0.18 1 63 VAL -8.42 -0.10 1 64 THR -2.71 1.81 1 65 SER 4.05 -0.30 1 66 ASN -1.19 1.41 1 68 THR 1.38 -0.65 1 69 ARG 1.62 0.97 1 70 THR 0.03 1.29 1 72 ASP 1.75 -0.55 1 73 GLN 1.55 -1.82 1 74 VAL -0.38 -1.56 1 75 LEU 0.38 -3.01 1 76 GLN -5.82 -0.95 1 77 LYS 3.61 0.94 1 80 TYR -4.41 -1.01 1 81 PHE -3.89 -2.79 1 82 VAL -4.16 -0.09 1 83 ILE 0.75 -2.38 1 84 ASN -1.06 5.04 1 86 ASN 2.79 0.75 1 87 ASN 1.19 -0.79 1 88 VAL 0.49 -1.35 1 89 LYS 2.51 1.14 1 90 SER -0.81 -2.76 1 91 VAL -1.51 -0.93 1 95 MET -4.85 -0.89 1 96 LYS 1.48 0.88 1 98 SER 2.92 1.61 1 101 LEU -1.50 -1.67 1 102 SER 0.05 -1.95 1 103 TRP -5.00 -1.62 1 104 ALA -6.59 -2.44 1 105 GLN 1.25 -0.94 1 106 VAL -0.55 -2.87 1 107 ASN -1.60 -1.46 1 108 PHE -4.68 2.97 1 109 THR 6.88 1.00 1 110 THR 6.32 3.14 1 113 ASN -0.09 0.17 1 114 VAL -5.26 -1.00 1 115 TRP -1.00 -0.08 1 116 LEU -7.06 -1.58 1 117 ASN 0.16 -3.09 1 118 THR -0.69 -3.49 1 119 THR -0.41 0.60 1 120 SER -1.32 -1.53 1 121 LYS 5.56 0.34 1 122 ASP 3.76 2.94 1 123 ASN 2.73 0.51 1 124 LEU 3.21 0.46 1 125 LEU 2.56 0.78 1 126 TYR -1.61 1.04 1 128 LYS 0.47 3.99 1 stop_ save_