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 bmr11116_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.34 _LACS_plot.Line_1_terminator_val_y_1 -3.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.19 _LACS_plot.Line_2_terminator_val_x_2 9.81 _LACS_plot.Line_2_terminator_val_y_2 7.33 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 ALA -9.34 -2.48 0 81 ILE 2.98 -1.54 0 10 ILE -0.60 0.22 1 11 GLU -0.47 -0.66 1 12 LEU -5.69 -1.79 1 13 THR -6.76 -2.97 1 14 ASP 3.33 3.88 1 15 ASP 0.70 1.78 1 16 SER -2.06 -0.32 1 17 PHE 3.81 5.62 1 18 ASP 6.45 4.53 1 19 LYS 2.78 1.57 1 20 ASN 0.52 2.92 1 21 VAL 2.29 1.96 1 22 LEU 4.19 1.98 1 23 ASP 0.68 -0.16 1 24 SER -2.24 -0.62 1 25 GLU -0.05 0.06 1 26 ASP -1.35 -0.29 1 27 VAL -0.19 0.10 1 28 TRP -3.31 -1.73 1 29 MET -2.14 -0.10 1 30 VAL -2.60 -0.67 1 31 GLU 1.59 -1.97 1 32 PHE -0.70 -0.53 1 33 TYR -7.11 -2.82 1 34 ALA -3.97 -2.68 1 36 TRP -3.24 -3.58 1 39 HIS 2.34 4.40 1 41 LYS 4.77 3.22 1 42 ASN 3.08 2.39 1 43 LEU 0.84 0.87 1 44 GLU 9.81 8.07 1 46 GLU 1.68 1.59 1 47 TRP 1.97 2.35 1 48 ALA 3.36 2.46 1 49 ALA 2.98 2.15 1 50 ALA 2.74 1.90 1 51 ALA 3.04 2.87 1 52 SER 4.37 3.51 1 53 GLU 2.84 2.91 1 54 VAL 5.99 4.91 1 55 LYS 4.87 4.24 1 56 GLU 2.56 2.39 1 57 GLN 2.55 2.89 1 58 THR -1.70 -0.85 1 59 LYS 4.44 0.55 1 61 LYS 1.85 0.59 1 62 VAL -1.19 -1.72 1 63 LYS -4.03 -1.30 1 64 LEU 0.15 0.48 1 66 ALA -4.80 -0.91 1 67 VAL -6.34 -2.22 1 68 ASP 0.32 -2.01 1 69 ALA -0.36 0.51 1 70 THR 2.78 1.71 1 71 VAL -0.72 0.15 1 72 ASN 1.83 0.88 1 73 GLN 2.88 2.61 1 74 VAL 7.72 5.21 1 75 LEU 1.83 2.34 1 76 ALA 3.30 2.71 1 77 SER 3.21 2.41 1 78 ARG 2.68 3.31 1 79 TYR 1.64 -0.14 1 82 ARG -1.66 -0.77 1 84 PHE -4.87 -1.58 1 86 THR -0.86 1.57 1 87 ILE -2.51 -1.12 1 88 LYS -7.84 -2.48 1 89 ILE -1.52 -0.34 1 90 PHE -1.78 -0.22 1 91 GLN -4.56 -1.05 1 92 LYS 3.43 2.42 1 94 GLU -4.92 -2.66 1 95 SER 2.41 1.36 1 97 VAL -5.40 -2.54 1 98 ASP 1.10 0.92 1 99 TYR 0.01 -0.28 1 100 ASP -1.27 -1.25 1 103 ARG 1.33 -0.34 1 104 THR -4.12 -1.96 1 105 ARG 5.54 4.10 1 106 SER 4.82 3.46 1 107 ASP 2.88 3.39 1 108 ILE 4.23 4.27 1 109 VAL 6.03 4.74 1 110 SER 5.09 4.02 1 111 ARG 2.97 1.24 1 112 ALA 1.85 2.93 1 113 LEU 4.56 2.26 1 114 ASP 3.54 3.03 1 115 LEU 2.16 1.95 1 116 PHE -0.05 0.45 1 117 SER 1.70 1.42 1 118 ASP 0.93 0.87 1 119 ASN -0.63 0.23 1 120 ALA 0.30 0.22 1 124 GLU -0.09 0.12 1 125 LEU 0.02 -0.12 1 126 LEU 0.09 0.00 1 127 GLU -0.50 -0.05 1 128 SER -0.04 0.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11116_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.34 _LACS_plot.Line_1_terminator_val_y_1 5.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.81 _LACS_plot.Line_2_terminator_val_x_2 9.81 _LACS_plot.Line_2_terminator_val_y_2 -2.48 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 ALA -9.34 6.86 0 81 ILE 2.98 -4.52 0 10 ILE -0.60 0.82 1 11 GLU -0.47 -0.19 1 12 LEU -5.69 3.90 1 13 THR -6.76 3.79 1 14 ASP 3.33 0.55 1 15 ASP 0.70 1.08 1 16 SER -2.06 1.74 1 17 PHE 3.81 1.81 1 18 ASP 6.45 -1.92 1 19 LYS 2.78 -1.21 1 20 ASN 0.52 2.40 1 21 VAL 2.29 -0.33 1 22 LEU 4.19 -2.21 1 23 ASP 0.68 -0.84 1 24 SER -2.24 1.62 1 25 GLU -0.05 0.11 1 26 ASP -1.35 1.06 1 27 VAL -0.19 0.29 1 28 TRP -3.31 1.58 1 29 MET -2.14 2.04 1 30 VAL -2.60 1.93 1 31 GLU 1.59 -3.56 1 32 PHE -0.70 0.17 1 33 TYR -7.11 4.29 1 34 ALA -3.97 1.29 1 36 TRP -3.24 -0.34 1 39 HIS 2.34 2.06 1 41 LYS 4.77 -1.55 1 42 ASN 3.08 -0.69 1 43 LEU 0.84 0.03 1 44 GLU 9.81 -1.74 1 46 GLU 1.68 -0.09 1 47 TRP 1.97 0.38 1 48 ALA 3.36 -0.90 1 49 ALA 2.98 -0.83 1 50 ALA 2.74 -0.84 1 51 ALA 3.04 -0.17 1 52 SER 4.37 -0.86 1 53 GLU 2.84 0.07 1 54 VAL 5.99 -1.08 1 55 LYS 4.87 -0.63 1 56 GLU 2.56 -0.17 1 57 GLN 2.55 0.34 1 58 THR -1.70 0.85 1 59 LYS 4.44 -3.89 1 61 LYS 1.85 -1.26 1 62 VAL -1.19 -0.53 1 63 LYS -4.03 2.73 1 64 LEU 0.15 0.33 1 66 ALA -4.80 3.89 1 67 VAL -6.34 4.12 1 68 ASP 0.32 -2.33 1 69 ALA -0.36 0.87 1 70 THR 2.78 -1.07 1 71 VAL -0.72 0.87 1 72 ASN 1.83 -0.95 1 73 GLN 2.88 -0.27 1 74 VAL 7.72 -2.51 1 75 LEU 1.83 0.51 1 76 ALA 3.30 -0.59 1 77 SER 3.21 -0.80 1 78 ARG 2.68 0.63 1 79 TYR 1.64 -1.78 1 82 ARG -1.66 0.89 1 84 PHE -4.87 3.29 1 86 THR -0.86 2.43 1 87 ILE -2.51 1.39 1 88 LYS -7.84 5.36 1 89 ILE -1.52 1.18 1 90 PHE -1.78 1.56 1 91 GLN -4.56 3.51 1 92 LYS 3.43 -1.01 1 94 GLU -4.92 2.26 1 95 SER 2.41 -1.05 1 97 VAL -5.40 2.86 1 98 ASP 1.10 -0.18 1 99 TYR 0.01 -0.29 1 100 ASP -1.27 0.02 1 103 ARG 1.33 -1.67 1 104 THR -4.12 2.16 1 105 ARG 5.54 -1.44 1 106 SER 4.82 -1.36 1 107 ASP 2.88 0.51 1 108 ILE 4.23 0.04 1 109 VAL 6.03 -1.29 1 110 SER 5.09 -1.07 1 111 ARG 2.97 -1.73 1 112 ALA 1.85 1.08 1 113 LEU 4.56 -2.30 1 114 ASP 3.54 -0.51 1 115 LEU 2.16 -0.21 1 116 PHE -0.05 0.50 1 117 SER 1.70 -0.28 1 118 ASP 0.93 -0.06 1 119 ASN -0.63 0.86 1 120 ALA 0.30 -0.08 1 124 GLU -0.09 0.21 1 125 LEU 0.02 -0.14 1 126 LEU 0.09 -0.09 1 127 GLU -0.50 0.45 1 128 SER -0.04 0.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11116_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.34 _LACS_plot.Line_1_terminator_val_y_1 0.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 9.81 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _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 21 VAL 2.29 -1.91 0 10 ILE -0.60 -0.08 1 11 GLU -0.47 0.54 1 12 LEU -5.69 0.40 1 13 THR -6.76 0.32 1 14 ASP 3.33 -0.31 1 15 ASP 0.70 0.07 1 16 SER -2.06 0.19 1 17 PHE 3.81 -0.86 1 18 ASP 6.45 -0.50 1 19 LYS 2.78 -0.27 1 20 ASN 0.52 -0.29 1 22 LEU 4.19 -0.29 1 23 ASP 0.68 0.02 1 24 SER -2.24 0.02 1 25 GLU -0.05 0.12 1 26 ASP -1.35 0.32 1 27 VAL -0.19 0.42 1 28 TRP -3.31 0.62 1 29 MET -2.14 0.81 1 30 VAL -2.60 0.45 1 31 GLU 1.59 0.03 1 32 PHE -0.70 0.90 1 33 TYR -7.11 0.80 1 34 ALA -3.97 -0.31 1 36 TRP -3.24 -0.07 1 39 HIS 2.34 -0.06 1 41 LYS 4.77 -0.27 1 42 ASN 3.08 -0.19 1 43 LEU 0.84 0.10 1 44 GLU 9.81 -0.56 1 46 GLU 1.68 -0.18 1 47 TRP 1.97 -0.62 1 48 ALA 3.36 -0.47 1 49 ALA 2.98 -0.16 1 50 ALA 2.74 -0.63 1 51 ALA 3.04 -0.80 1 52 SER 4.37 -0.23 1 53 GLU 2.84 -0.23 1 54 VAL 5.99 -0.96 1 55 LYS 4.87 -0.27 1 56 GLU 2.56 -0.34 1 57 GLN 2.55 -0.25 1 58 THR -1.70 -0.75 1 59 LYS 4.44 -0.34 1 61 LYS 1.85 -0.09 1 62 VAL -1.19 0.52 1 63 LYS -4.03 -0.36 1 64 LEU 0.15 1.06 1 65 ALA -9.34 1.49 1 66 ALA -4.80 1.19 1 67 VAL -6.34 0.21 1 68 ASP 0.32 -1.54 1 69 ALA -0.36 -0.19 1 70 THR 2.78 -0.06 1 71 VAL -0.72 0.21 1 72 ASN 1.83 0.33 1 73 GLN 2.88 -0.35 1 74 VAL 7.72 -0.52 1 75 LEU 1.83 -0.59 1 76 ALA 3.30 -0.54 1 77 SER 3.21 -0.23 1 78 ARG 2.68 -0.67 1 79 TYR 1.64 0.12 1 81 ILE 2.98 -0.46 1 82 ARG -1.66 0.00 1 84 PHE -4.87 0.16 1 86 THR -0.86 0.20 1 87 ILE -2.51 1.26 1 88 LYS -7.84 1.05 1 89 ILE -1.52 0.82 1 90 PHE -1.78 0.22 1 91 GLN -4.56 0.51 1 92 LYS 3.43 -0.15 1 94 GLU -4.92 0.46 1 97 VAL -5.40 0.40 1 98 ASP 1.10 0.36 1 99 TYR 0.01 0.09 1 100 ASP -1.27 0.06 1 103 ARG 1.33 0.26 1 104 THR -4.12 0.36 1 105 ARG 5.54 -0.42 1 106 SER 4.82 -0.40 1 107 ASP 2.88 -0.22 1 108 ILE 4.23 -0.72 1 109 VAL 6.03 -0.96 1 110 SER 5.09 -0.40 1 111 ARG 2.97 0.02 1 112 ALA 1.85 -0.34 1 113 LEU 4.56 -0.24 1 114 ASP 3.54 -0.09 1 115 LEU 2.16 -0.18 1 116 PHE -0.05 -0.24 1 118 ASP 0.93 -0.15 1 119 ASN -0.63 -0.05 1 120 ALA 0.30 -0.14 1 124 GLU -0.09 -0.14 1 125 LEU 0.02 0.02 1 126 LEU 0.09 0.02 1 127 GLU -0.50 -0.04 1 128 SER -0.04 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11116_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.34 _LACS_plot.Line_1_terminator_val_y_1 -3.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _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 9.81 _LACS_plot.Line_2_terminator_val_y_2 3.65 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 HIS 2.34 6.77 0 10 ILE -0.60 -1.91 1 11 GLU -0.47 -0.03 1 12 LEU -5.69 -2.79 1 13 THR -6.76 0.32 1 14 ASP 3.33 2.20 1 15 ASP 0.70 0.62 1 16 SER -2.06 1.68 1 17 PHE 3.81 1.08 1 18 ASP 6.45 2.40 1 19 LYS 2.78 0.20 1 20 ASN 0.52 -1.55 1 21 VAL 2.29 1.17 1 22 LEU 4.19 0.64 1 23 ASP 0.68 -1.35 1 24 SER -2.24 1.06 1 25 GLU -0.05 0.12 1 26 ASP -1.35 -1.32 1 27 VAL -0.19 -1.34 1 28 TRP -3.31 -0.25 1 29 MET -2.14 -1.67 1 30 VAL -2.60 -2.83 1 31 GLU 1.59 -2.66 1 32 PHE -0.70 -0.63 1 33 TYR -7.11 -4.70 1 34 ALA -3.97 0.93 1 36 TRP -3.24 -0.15 1 41 LYS 4.77 2.56 1 42 ASN 3.08 1.70 1 43 LEU 0.84 -0.23 1 44 GLU 9.81 0.16 1 46 GLU 1.68 1.15 1 47 TRP 1.97 0.87 1 48 ALA 3.36 2.58 1 49 ALA 2.98 3.46 1 50 ALA 2.74 0.57 1 51 ALA 3.04 3.00 1 52 SER 4.37 1.44 1 53 GLU 2.84 2.15 1 54 VAL 5.99 2.71 1 55 LYS 4.87 2.25 1 56 GLU 2.56 2.57 1 57 GLN 2.55 1.47 1 58 THR -1.70 0.35 1 59 LYS 4.44 -0.08 1 61 LYS 1.85 -0.21 1 62 VAL -1.19 -2.35 1 63 LYS -4.03 -2.49 1 64 LEU 0.15 -1.36 1 65 ALA -9.34 -0.98 1 66 ALA -4.80 -3.24 1 67 VAL -6.34 -2.34 1 68 ASP 0.32 1.00 1 69 ALA -0.36 -1.78 1 70 THR 2.78 1.27 1 71 VAL -0.72 -0.58 1 72 ASN 1.83 -1.06 1 73 GLN 2.88 3.46 1 74 VAL 7.72 3.63 1 75 LEU 1.83 1.33 1 76 ALA 3.30 1.73 1 77 SER 3.21 2.89 1 78 ARG 2.68 2.15 1 79 TYR 1.64 -1.06 1 81 ILE 2.98 -0.26 1 82 ARG -1.66 -1.58 1 84 PHE -4.87 -1.16 1 86 THR -0.86 -2.10 1 87 ILE -2.51 -1.68 1 88 LYS -7.84 -1.98 1 89 ILE -1.52 -0.77 1 90 PHE -1.78 -1.86 1 91 GLN -4.56 -1.10 1 92 LYS 3.43 1.27 1 94 GLU -4.92 0.44 1 95 SER 2.41 -0.29 1 97 VAL -5.40 -1.23 1 98 ASP 1.10 0.39 1 99 TYR 0.01 -1.45 1 103 ARG 1.33 -1.38 1 104 THR -4.12 0.51 1 105 ARG 5.54 0.49 1 106 SER 4.82 2.71 1 107 ASP 2.88 1.92 1 108 ILE 4.23 1.23 1 109 VAL 6.03 1.15 1 110 SER 5.09 2.46 1 111 ARG 2.97 1.83 1 112 ALA 1.85 1.78 1 113 LEU 4.56 2.78 1 114 ASP 3.54 2.36 1 115 LEU 2.16 1.07 1 116 PHE -0.05 0.27 1 117 SER 1.70 0.49 1 118 ASP 0.93 -0.10 1 119 ASN -0.63 -1.05 1 120 ALA 0.30 -1.07 1 124 GLU -0.09 -0.22 1 125 LEU 0.02 -0.57 1 126 LEU 0.09 -0.27 1 127 GLU -0.50 -0.19 1 128 SER -0.04 0.02 1 stop_ save_