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 bmr26844_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.98 _LACS_plot.Line_1_terminator_val_y_1 -3.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.64 _LACS_plot.Line_2_terminator_val_x_2 4.20 _LACS_plot.Line_2_terminator_val_y_2 2.27 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 SER 3.25 -0.66 0 10 LYS -1.21 1.46 0 40 PHE 4.03 3.82 0 11 THR -4.54 -3.11 1 12 GLN 1.04 0.38 1 14 THR -0.90 -0.88 1 15 VAL -0.57 -0.39 1 16 THR -2.92 -1.39 1 17 TYR -3.01 -1.92 1 18 ASN -1.16 -2.11 1 19 ALA 2.09 1.27 1 20 VAL 4.21 2.63 1 21 LYS -0.66 -1.50 1 22 ASP 2.33 -0.25 1 23 SER -4.37 -2.27 1 24 TYR -2.65 0.26 1 25 GLN -4.11 -1.37 1 26 PHE -5.50 -2.79 1 27 THR -1.90 -0.92 1 28 VAL -6.98 -3.54 1 29 THR 1.32 0.20 1 30 LEU -4.84 -3.42 1 31 THR -2.91 -2.35 1 33 ALA -1.34 -1.85 1 34 THR 2.19 1.24 1 35 ALA 0.65 0.43 1 37 VAL -1.63 -1.18 1 38 THR 1.89 0.18 1 41 LEU -5.24 -2.07 1 42 LYS -4.91 -3.51 1 43 ALA 2.01 0.29 1 45 ASP 2.00 1.33 1 46 GLN -3.63 -1.71 1 47 VAL -4.70 -3.92 1 48 LYS -5.01 -2.34 1 49 PHE -2.41 -1.39 1 50 THR -1.39 -0.34 1 51 ASN 0.56 0.01 1 52 THR 0.93 -1.31 1 53 TYR -6.09 -2.98 1 54 TRP -1.72 -1.45 1 55 LEU 0.44 -0.13 1 56 GLN 2.75 1.37 1 57 GLN 1.65 0.41 1 58 GLN 1.49 0.38 1 59 THR 1.49 0.76 1 60 LYS 2.01 0.87 1 61 GLN 0.90 0.21 1 62 ALA 1.04 0.21 1 63 LEU 0.49 -0.12 1 64 TYR 0.58 -0.25 1 65 ASN 0.27 -0.36 1 67 ALA -0.53 -0.58 1 68 THR -2.12 -2.56 1 70 ILE -0.20 -0.80 1 71 SER -5.03 -1.27 1 72 PHE -2.29 -0.62 1 73 THR -1.97 -1.39 1 74 ALA -6.71 -2.07 1 75 THR -0.26 -0.30 1 76 VAL 1.88 0.89 1 77 THR 2.49 1.30 1 78 ALA -3.68 -1.44 1 79 ASP 1.19 0.24 1 80 ALA -6.05 -1.97 1 81 ASN -2.30 -2.15 1 82 SER -4.91 -3.40 1 83 ASP -3.12 -2.60 1 84 SER 3.92 2.15 1 87 ASP -1.24 -2.08 1 88 VAL -4.55 -2.85 1 89 THR 1.78 0.70 1 90 VAL -6.96 -4.08 1 91 THR -0.14 -0.36 1 92 LEU -3.42 -2.85 1 93 SER -0.03 -0.09 1 95 VAL -3.08 -3.26 1 97 ILE -4.23 -2.89 1 98 TYR 0.49 0.28 1 99 ASP -0.86 -0.76 1 100 THR 0.13 -1.31 1 101 THR 1.27 0.33 1 102 ASN -0.28 -0.22 1 104 GLN 1.22 0.53 1 105 TYR 0.16 -0.68 1 106 ASN 0.99 0.04 1 107 SER 0.56 -0.07 1 108 VAL -0.28 -0.69 1 109 SER 0.18 -0.32 1 110 ARG -0.67 -0.60 1 111 GLN -4.31 -2.29 1 112 VAL 2.15 1.23 1 113 GLU -6.80 -3.41 1 114 ALA 2.68 0.70 1 116 ASP 1.95 1.60 1 117 ALA -3.29 -1.14 1 118 VAL -4.18 -2.73 1 119 SER -4.21 -2.57 1 120 VAL 2.34 0.71 1 121 VAL -0.28 -0.71 1 123 THR -1.94 -1.61 1 124 ALA 0.58 0.25 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26844_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.98 _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 -1.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 4.20 _LACS_plot.Line_2_terminator_val_y_2 -1.93 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 SER 3.25 -3.91 0 10 LYS -1.21 2.67 0 40 PHE 4.03 -0.21 0 11 THR -4.54 1.43 1 12 GLN 1.04 -0.66 1 14 THR -0.90 0.02 1 15 VAL -0.57 0.18 1 16 THR -2.92 1.53 1 17 TYR -3.01 1.09 1 18 ASN -1.16 -0.95 1 19 ALA 2.09 -0.82 1 20 VAL 4.21 -1.58 1 21 LYS -0.66 -0.84 1 22 ASP 2.33 -2.58 1 23 SER -4.37 2.10 1 24 TYR -2.65 2.91 1 25 GLN -4.11 2.74 1 26 PHE -5.50 2.71 1 27 THR -1.90 0.98 1 28 VAL -6.98 3.44 1 29 THR 1.32 -1.12 1 30 LEU -4.84 1.42 1 31 THR -2.91 0.56 1 33 ALA -1.34 -0.51 1 34 THR 2.19 -0.95 1 35 ALA 0.65 -0.22 1 37 VAL -1.63 0.45 1 38 THR 1.89 -1.71 1 41 LEU -5.24 3.17 1 42 LYS -4.91 1.40 1 43 ALA 2.01 -1.72 1 45 ASP 2.00 -0.67 1 46 GLN -3.63 1.92 1 47 VAL -4.70 0.78 1 48 LYS -5.01 2.67 1 49 PHE -2.41 1.02 1 50 THR -1.39 1.05 1 51 ASN 0.56 -0.55 1 52 THR 0.93 -2.24 1 53 TYR -6.09 3.11 1 54 TRP -1.72 0.27 1 55 LEU 0.44 -0.57 1 56 GLN 2.75 -1.38 1 57 GLN 1.65 -1.24 1 58 GLN 1.49 -1.11 1 59 THR 1.49 -0.73 1 60 LYS 2.01 -1.14 1 61 GLN 0.90 -0.69 1 62 ALA 1.04 -0.83 1 63 LEU 0.49 -0.61 1 64 TYR 0.58 -0.83 1 65 ASN 0.27 -0.63 1 67 ALA -0.53 -0.05 1 68 THR -2.12 -0.44 1 70 ILE -0.20 -0.60 1 71 SER -5.03 3.76 1 72 PHE -2.29 1.67 1 73 THR -1.97 0.58 1 74 ALA -6.71 4.64 1 75 THR -0.26 -0.04 1 76 VAL 1.88 -0.99 1 77 THR 2.49 -1.19 1 78 ALA -3.68 2.24 1 79 ASP 1.19 -0.95 1 80 ALA -6.05 4.08 1 81 ASN -2.30 0.15 1 82 SER -4.91 1.51 1 83 ASP -3.12 0.52 1 84 SER 3.92 -1.77 1 87 ASP -1.24 -0.84 1 88 VAL -4.55 1.70 1 89 THR 1.78 -1.08 1 90 VAL -6.96 2.88 1 91 THR -0.14 -0.22 1 92 LEU -3.42 0.57 1 93 SER -0.03 -0.06 1 95 VAL -3.08 -0.18 1 97 ILE -4.23 1.34 1 98 TYR 0.49 -0.21 1 99 ASP -0.86 0.10 1 100 THR 0.13 -1.44 1 101 THR 1.27 -0.94 1 102 ASN -0.28 0.06 1 104 GLN 1.22 -0.69 1 105 TYR 0.16 -0.84 1 106 ASN 0.99 -0.95 1 107 SER 0.56 -0.63 1 108 VAL -0.28 -0.41 1 109 SER 0.18 -0.50 1 110 ARG -0.67 0.07 1 111 GLN -4.31 2.02 1 112 VAL 2.15 -0.92 1 113 GLU -6.80 3.39 1 114 ALA 2.68 -1.98 1 116 ASP 1.95 -0.35 1 117 ALA -3.29 2.15 1 118 VAL -4.18 1.45 1 119 SER -4.21 1.64 1 120 VAL 2.34 -1.63 1 121 VAL -0.28 -0.43 1 123 THR -1.94 0.33 1 124 ALA 0.58 -0.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26844_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.98 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 4.20 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _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 53 TYR -6.09 -0.43 0 10 LYS -1.21 -0.01 1 11 THR -4.54 0.28 1 12 GLN 1.04 -0.40 1 14 THR -0.90 0.31 1 15 VAL -0.57 0.70 1 16 THR -2.92 0.36 1 17 TYR -3.01 0.01 1 18 ASN -1.16 -0.29 1 19 ALA 2.09 -0.71 1 20 VAL 4.21 -0.50 1 21 LYS -0.66 -0.21 1 22 ASP 2.33 -0.60 1 23 SER -4.37 0.34 1 24 TYR -2.65 0.69 1 25 GLN -4.11 1.24 1 26 PHE -5.50 1.37 1 27 THR -1.90 1.10 1 28 VAL -6.98 0.73 1 29 THR 1.32 -0.17 1 30 LEU -4.84 0.91 1 31 THR -2.91 1.06 1 33 ALA -1.34 -0.82 1 34 THR 2.19 -0.45 1 35 ALA 0.65 -0.17 1 36 SER 3.25 -0.76 1 37 VAL -1.63 0.08 1 38 THR 1.89 -0.17 1 40 PHE 4.03 -0.88 1 41 LEU -5.24 0.05 1 42 LYS -4.91 0.30 1 43 ALA 2.01 -0.64 1 45 ASP 2.00 -0.10 1 46 GLN -3.63 0.82 1 47 VAL -4.70 0.83 1 48 LYS -5.01 0.86 1 49 PHE -2.41 0.41 1 50 THR -1.39 0.73 1 51 ASN 0.56 -0.10 1 54 TRP -1.72 -0.55 1 55 LEU 0.44 -0.14 1 56 GLN 2.75 -0.29 1 57 GLN 1.65 -0.35 1 58 GLN 1.49 -0.32 1 60 LYS 2.01 -0.15 1 61 GLN 0.90 -0.12 1 62 ALA 1.04 -0.14 1 63 LEU 0.49 -0.16 1 64 TYR 0.58 -0.09 1 65 ASN 0.27 -0.10 1 67 ALA -0.53 0.01 1 68 THR -2.12 0.18 1 71 SER -5.03 1.70 1 72 PHE -2.29 0.49 1 73 THR -1.97 1.15 1 74 ALA -6.71 0.75 1 75 THR -0.26 0.58 1 76 VAL 1.88 -0.07 1 77 THR 2.49 -0.11 1 78 ALA -3.68 0.23 1 79 ASP 1.19 -0.08 1 80 ALA -6.05 0.48 1 81 ASN -2.30 0.68 1 82 SER -4.91 0.73 1 83 ASP -3.12 0.20 1 84 SER 3.92 -0.19 1 87 ASP -1.24 0.99 1 88 VAL -4.55 0.41 1 89 THR 1.78 0.74 1 90 VAL -6.96 0.72 1 91 THR -0.14 0.76 1 92 LEU -3.42 0.78 1 93 SER -0.03 -0.06 1 95 VAL -3.08 0.05 1 97 ILE -4.23 -0.10 1 98 TYR 0.49 0.16 1 99 ASP -0.86 0.04 1 100 THR 0.13 0.04 1 101 THR 1.27 -0.09 1 102 ASN -0.28 -0.18 1 104 GLN 1.22 -0.19 1 105 TYR 0.16 -0.08 1 106 ASN 0.99 -0.17 1 107 SER 0.56 -0.14 1 108 VAL -0.28 0.00 1 109 SER 0.18 -0.04 1 110 ARG -0.67 0.08 1 111 GLN -4.31 0.59 1 112 VAL 2.15 0.21 1 113 GLU -6.80 0.31 1 114 ALA 2.68 -0.64 1 116 ASP 1.95 0.44 1 117 ALA -3.29 0.63 1 118 VAL -4.18 0.94 1 119 SER -4.21 0.47 1 120 VAL 2.34 0.16 1 121 VAL -0.28 0.15 1 123 THR -1.94 0.32 1 124 ALA 0.58 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26844_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.98 _LACS_plot.Line_1_terminator_val_y_1 0.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.57 _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 4.20 _LACS_plot.Line_2_terminator_val_y_2 -1.18 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 ALA 2.68 -5.03 0 80 ALA -6.05 -2.61 0 74 ALA -6.71 -2.01 0 19 ALA 2.09 -5.88 0 83 ASP -3.12 -5.42 0 10 LYS -1.21 -1.08 1 11 THR -4.54 3.98 1 12 GLN 1.04 2.10 1 14 THR -0.90 2.00 1 15 VAL -0.57 -1.06 1 16 THR -2.92 4.09 1 17 TYR -3.01 1.23 1 18 ASN -1.16 1.43 1 20 VAL 4.21 -3.03 1 21 LYS -0.66 -1.29 1 22 ASP 2.33 0.91 1 23 SER -4.37 3.87 1 24 TYR -2.65 -1.03 1 25 GLN -4.11 0.75 1 26 PHE -5.50 2.99 1 27 THR -1.90 2.51 1 28 VAL -6.98 2.45 1 29 THR 1.32 3.33 1 30 LEU -4.84 -1.52 1 31 THR -2.91 2.83 1 33 ALA -1.34 -3.20 1 34 THR 2.19 2.64 1 35 ALA 0.65 -3.68 1 36 SER 3.25 2.57 1 37 VAL -1.63 -1.96 1 38 THR 1.89 0.40 1 40 PHE 4.03 -1.11 1 41 LEU -5.24 -1.06 1 42 LYS -4.91 -1.81 1 43 ALA 2.01 -5.17 1 45 ASP 2.00 -0.05 1 46 GLN -3.63 -0.29 1 47 VAL -4.70 2.07 1 48 LYS -5.01 -1.06 1 49 PHE -2.41 -0.46 1 50 THR -1.39 2.96 1 51 ASN 0.56 0.24 1 52 THR 0.93 -0.78 1 53 TYR -6.09 -0.68 1 54 TRP -1.72 -0.74 1 55 LEU 0.44 -4.03 1 56 GLN 2.75 -2.66 1 57 GLN 1.65 -2.23 1 58 GLN 1.49 -2.05 1 59 THR 1.49 1.06 1 60 LYS 2.01 -2.62 1 61 GLN 0.90 -0.73 1 62 ALA 1.04 -4.62 1 63 LEU 0.49 -3.98 1 64 TYR 0.58 -0.68 1 65 ASN 0.27 0.24 1 67 ALA -0.53 -3.88 1 68 THR -2.12 3.89 1 71 SER -5.03 2.40 1 72 PHE -2.29 2.48 1 73 THR -1.97 3.00 1 75 THR -0.26 2.27 1 76 VAL 1.88 -3.75 1 77 THR 2.49 1.78 1 78 ALA -3.68 -1.32 1 79 ASP 1.19 -1.01 1 81 ASN -2.30 0.07 1 82 SER -4.91 1.87 1 84 SER 3.92 1.47 1 87 ASP -1.24 -2.20 1 88 VAL -4.55 1.91 1 89 THR 1.78 3.31 1 90 VAL -6.96 2.54 1 91 THR -0.14 3.25 1 92 LEU -3.42 -2.00 1 93 SER -0.03 1.77 1 95 VAL -3.08 -0.04 1 97 ILE -4.23 0.52 1 98 TYR 0.49 -0.29 1 99 ASP -0.86 -1.17 1 100 THR 0.13 1.92 1 101 THR 1.27 1.81 1 102 ASN -0.28 3.34 1 104 GLN 1.22 -1.15 1 105 TYR 0.16 -0.37 1 106 ASN 0.99 0.77 1 107 SER 0.56 2.19 1 108 VAL -0.28 -1.14 1 109 SER 0.18 2.39 1 110 ARG -0.67 0.09 1 111 GLN -4.31 -0.22 1 112 VAL 2.15 0.23 1 113 GLU -6.80 -1.08 1 116 ASP 1.95 0.26 1 117 ALA -3.29 -3.88 1 118 VAL -4.18 0.07 1 119 SER -4.21 3.44 1 120 VAL 2.34 -1.89 1 121 VAL -0.28 -1.46 1 123 THR -1.94 1.84 1 124 ALA 0.58 -4.93 1 stop_ save_