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 bmr19751_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 -2.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 6.81 _LACS_plot.Line_2_terminator_val_y_2 5.17 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 TYR -5.42 -0.95 0 24 TYR -4.94 -0.41 0 10 ASP 0.79 0.95 1 13 GLN -1.43 -0.42 1 15 SER -1.08 -0.93 1 16 THR -3.09 -1.08 1 19 VAL -2.36 -0.36 1 20 ASN 2.13 0.45 1 23 THR 1.93 1.53 1 25 LEU 2.31 3.82 1 28 ASP 0.12 0.11 1 29 ASN -0.67 -0.44 1 31 SER 1.91 1.93 1 32 LYS -0.10 0.15 1 33 LYS -0.06 0.01 1 34 ARG -0.65 0.30 1 35 VAL 0.16 0.12 1 36 ALA -0.09 0.12 1 37 ARG 1.56 0.82 1 38 SER -0.15 0.14 1 39 LEU 0.61 0.49 1 40 ASP 0.03 0.11 1 41 SER 0.18 0.20 1 42 LYS 1.35 0.48 1 43 VAL 0.34 0.36 1 45 GLN 0.01 0.33 1 46 GLN 0.09 0.22 1 47 THR 0.11 0.12 1 48 LEU -0.40 0.01 1 49 ARG 1.39 0.46 1 52 ASP 0.07 0.13 1 53 VAL 0.31 0.20 1 54 LEU 0.29 0.27 1 55 MET 0.66 0.02 1 56 GLN 0.21 0.51 1 58 ALA -0.09 0.12 1 59 ALA -0.28 -0.07 1 60 SER -0.34 -0.07 1 62 GLU -0.22 -0.02 1 63 LEU 0.13 0.02 1 64 THR 0.02 -0.01 1 65 VAL -0.94 -0.49 1 66 SER -0.32 0.08 1 68 THR -2.98 -0.97 1 69 LEU -3.74 -1.69 1 70 LEU -1.14 -1.33 1 71 VAL -4.46 -2.34 1 72 GLU -0.32 -1.25 1 73 ALA -3.13 -0.80 1 74 ASP -0.98 -1.16 1 75 ASP 5.37 4.26 1 76 ALA 4.14 2.86 1 77 SER 4.90 3.33 1 78 ALA 3.39 2.80 1 79 LYS 4.68 3.94 1 80 ALA 3.92 2.65 1 81 LEU 2.71 2.79 1 82 ALA 5.10 3.26 1 83 THR 4.90 4.34 1 84 ARG 3.22 3.04 1 85 HIS -1.35 1.16 1 87 LEU -4.91 -2.23 1 88 ASN -3.22 -1.24 1 89 PHE 1.45 0.91 1 90 LYS 0.03 0.50 1 92 SER -5.14 -1.52 1 93 SER -0.09 0.06 1 96 ILE -1.88 -2.57 1 97 ALA -4.77 -2.06 1 98 LEU -1.38 -0.58 1 99 LEU -4.33 -2.46 1 100 GLU -5.02 -1.51 1 101 ALA -3.19 0.09 1 105 THR 1.26 1.20 1 106 ASP -0.34 -1.45 1 107 LEU 2.55 2.33 1 108 ASN 4.11 3.44 1 109 ALA 3.50 2.38 1 110 ILE 3.93 2.74 1 111 ALA 4.74 3.58 1 112 THR 6.81 5.56 1 113 LYS 4.20 3.17 1 114 LEU 4.30 3.02 1 115 LYS 4.22 3.41 1 116 SER 3.90 2.96 1 117 GLU 0.21 -0.29 1 119 VAL -1.26 -1.12 1 120 ASN 1.00 0.10 1 121 VAL -5.88 -3.69 1 122 GLN -4.59 -1.46 1 123 ILE -1.27 -0.14 1 124 GLU -2.24 -0.95 1 125 LEU -0.61 -0.59 1 126 SER 0.05 0.20 1 128 ALA -0.09 0.12 1 129 GLU -0.43 0.28 1 130 GLN -0.42 -0.12 1 131 GLN -0.02 0.04 1 133 LYS 1.12 1.59 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19751_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 3.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.61 _LACS_plot.Line_2_terminator_val_x_2 6.81 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 TYR -5.42 4.47 0 24 TYR -4.94 4.53 0 10 ASP 0.79 0.16 1 13 GLN -1.43 1.01 1 15 SER -1.08 0.15 1 16 THR -3.09 2.01 1 19 VAL -2.36 2.00 1 20 ASN 2.13 -1.68 1 23 THR 1.93 -0.40 1 25 LEU 2.31 1.51 1 28 ASP 0.12 -0.01 1 29 ASN -0.67 0.23 1 31 SER 1.91 0.02 1 32 LYS -0.10 0.25 1 33 LYS -0.06 0.07 1 34 ARG -0.65 0.95 1 35 VAL 0.16 -0.04 1 36 ALA -0.09 0.21 1 37 ARG 1.56 -0.74 1 38 SER -0.15 0.29 1 39 LEU 0.61 -0.12 1 40 ASP 0.03 0.08 1 41 SER 0.18 0.02 1 42 LYS 1.35 -0.87 1 43 VAL 0.34 0.02 1 45 GLN 0.01 0.32 1 46 GLN 0.09 0.13 1 47 THR 0.11 0.01 1 48 LEU -0.40 0.41 1 49 ARG 1.39 -0.93 1 52 ASP 0.07 0.06 1 53 VAL 0.31 -0.11 1 54 LEU 0.29 -0.02 1 55 MET 0.66 -0.64 1 56 GLN 0.21 0.30 1 58 ALA -0.09 0.21 1 59 ALA -0.28 0.21 1 60 SER -0.34 0.27 1 62 GLU -0.22 0.20 1 63 LEU 0.13 -0.11 1 64 THR 0.02 -0.03 1 65 VAL -0.94 0.45 1 66 SER -0.32 0.40 1 68 THR -2.98 2.01 1 69 LEU -3.74 2.05 1 70 LEU -1.14 -0.19 1 71 VAL -4.46 2.12 1 72 GLU -0.32 -0.93 1 73 ALA -3.13 2.33 1 74 ASP -0.98 -0.18 1 75 ASP 5.37 -1.11 1 76 ALA 4.14 -1.28 1 77 SER 4.90 -1.57 1 78 ALA 3.39 -0.59 1 79 LYS 4.68 -0.74 1 80 ALA 3.92 -1.27 1 81 LEU 2.71 0.08 1 82 ALA 5.10 -1.84 1 83 THR 4.90 -0.56 1 84 ARG 3.22 -0.18 1 85 HIS -1.35 2.51 1 87 LEU -4.91 2.68 1 88 ASN -3.22 1.98 1 89 PHE 1.45 -0.54 1 90 LYS 0.03 0.47 1 92 SER -5.14 3.62 1 93 SER -0.09 0.15 1 96 ILE -1.88 -0.69 1 97 ALA -4.77 2.71 1 98 LEU -1.38 0.80 1 99 LEU -4.33 1.87 1 100 GLU -5.02 3.51 1 101 ALA -3.19 3.28 1 105 THR 1.26 -0.06 1 106 ASP -0.34 -1.11 1 107 LEU 2.55 -0.22 1 108 ASN 4.11 -0.67 1 109 ALA 3.50 -1.12 1 110 ILE 3.93 -1.19 1 111 ALA 4.74 -1.16 1 112 THR 6.81 -1.25 1 113 LYS 4.20 -1.03 1 114 LEU 4.30 -1.28 1 115 LYS 4.22 -0.81 1 116 SER 3.90 -0.94 1 117 GLU 0.21 -0.50 1 119 VAL -1.26 0.14 1 120 ASN 1.00 -0.90 1 121 VAL -5.88 2.19 1 122 GLN -4.59 3.13 1 123 ILE -1.27 1.13 1 124 GLU -2.24 1.29 1 125 LEU -0.61 0.02 1 126 SER 0.05 0.15 1 128 ALA -0.09 0.21 1 129 GLU -0.43 0.71 1 130 GLN -0.42 0.30 1 131 GLN -0.02 0.06 1 133 LYS 1.12 0.47 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19751_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 0.64 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.81 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 TYR -5.42 -0.25 0 24 TYR -4.94 -0.39 0 10 ASP 0.79 -0.14 1 13 GLN -1.43 0.13 1 15 SER -1.08 0.24 1 16 THR -3.09 0.58 1 19 VAL -2.36 0.16 1 20 ASN 2.13 0.42 1 23 THR 1.93 0.03 1 25 LEU 2.31 -0.49 1 28 ASP 0.12 -0.05 1 29 ASN -0.67 0.00 1 31 SER 1.91 -0.09 1 32 LYS -0.10 0.01 1 33 LYS -0.06 -0.03 1 34 ARG -0.65 0.02 1 35 VAL 0.16 0.12 1 36 ALA -0.09 -0.02 1 37 ARG 1.56 -0.02 1 38 SER -0.15 0.07 1 39 LEU 0.61 0.03 1 40 ASP 0.03 -0.05 1 41 SER 0.18 -0.02 1 42 LYS 1.35 0.02 1 43 VAL 0.34 -0.05 1 45 GLN 0.01 -0.06 1 46 GLN 0.09 0.05 1 47 THR 0.11 -0.05 1 48 LEU -0.40 0.16 1 49 ARG 1.39 -0.11 1 52 ASP 0.07 -0.02 1 53 VAL 0.31 -0.05 1 54 LEU 0.29 0.01 1 55 MET 0.66 -0.02 1 56 GLN 0.21 -0.03 1 58 ALA -0.09 -0.01 1 59 ALA -0.28 -0.02 1 60 SER -0.34 -0.04 1 62 GLU -0.22 -0.11 1 63 LEU 0.13 0.10 1 64 THR 0.02 0.03 1 65 VAL -0.94 0.20 1 66 SER -0.32 0.07 1 68 THR -2.98 0.58 1 69 LEU -3.74 0.58 1 70 LEU -1.14 0.87 1 71 VAL -4.46 0.74 1 72 GLU -0.32 0.55 1 73 ALA -3.13 0.24 1 74 ASP -0.98 -0.06 1 75 ASP 5.37 -0.52 1 76 ALA 4.14 -0.37 1 77 SER 4.90 -0.26 1 78 ALA 3.39 -0.50 1 79 LYS 4.68 -0.51 1 80 ALA 3.92 -0.13 1 81 LEU 2.71 -0.30 1 82 ALA 5.10 -0.42 1 83 THR 4.90 -0.30 1 84 ARG 3.22 -0.40 1 85 HIS -1.35 -0.02 1 87 LEU -4.91 0.49 1 88 ASN -3.22 0.43 1 89 PHE 1.45 -0.18 1 90 LYS 0.03 0.03 1 92 SER -5.14 0.83 1 93 SER -0.09 0.13 1 96 ILE -1.88 0.57 1 97 ALA -4.77 0.41 1 98 LEU -1.38 0.62 1 99 LEU -4.33 0.83 1 100 GLU -5.02 0.51 1 101 ALA -3.19 0.15 1 105 THR 1.26 -0.22 1 106 ASP -0.34 0.06 1 107 LEU 2.55 -0.47 1 108 ASN 4.11 -0.40 1 109 ALA 3.50 -0.23 1 110 ILE 3.93 -0.52 1 111 ALA 4.74 -0.52 1 112 THR 6.81 -0.54 1 113 LYS 4.20 -0.24 1 114 LEU 4.30 -0.48 1 115 LYS 4.22 0.12 1 116 SER 3.90 -0.08 1 117 GLU 0.21 0.08 1 119 VAL -1.26 0.01 1 120 ASN 1.00 0.05 1 121 VAL -5.88 1.15 1 122 GLN -4.59 0.31 1 123 ILE -1.27 0.28 1 124 GLU -2.24 0.15 1 125 LEU -0.61 0.24 1 126 SER 0.05 -0.04 1 128 ALA -0.09 -0.01 1 129 GLU -0.43 0.00 1 130 GLN -0.42 -0.03 1 131 GLN -0.02 -0.07 1 133 LYS 1.12 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19751_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.88 _LACS_plot.Line_1_terminator_val_y_1 -2.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 6.81 _LACS_plot.Line_2_terminator_val_y_2 2.92 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 LYS 4.22 4.97 0 58 ALA -0.09 -0.40 1 59 ALA -0.28 -0.35 1 62 GLU -0.22 -0.22 1 63 LEU 0.13 -0.40 1 64 THR 0.02 -0.50 1 65 VAL -0.94 -0.38 1 66 SER -0.32 -0.35 1 69 LEU -3.74 -3.24 1 70 LEU -1.14 -0.49 1 71 VAL -4.46 -2.22 1 72 GLU -0.32 -3.11 1 73 ALA -3.13 -2.95 1 74 ASP -0.98 -1.14 1 75 ASP 5.37 1.30 1 76 ALA 4.14 3.91 1 77 SER 4.90 2.32 1 78 ALA 3.39 1.36 1 79 LYS 4.68 2.58 1 80 ALA 3.92 3.07 1 81 LEU 2.71 1.27 1 82 ALA 5.10 1.59 1 83 THR 4.90 2.33 1 84 ARG 3.22 1.25 1 85 HIS -1.35 0.82 1 87 LEU -4.91 -2.72 1 88 ASN -3.22 0.01 1 89 PHE 1.45 -2.06 1 90 LYS 0.03 -1.40 1 92 SER -5.14 -0.84 1 96 ILE -1.88 -1.35 1 97 ALA -4.77 -3.29 1 98 LEU -1.38 -2.68 1 99 LEU -4.33 -2.54 1 100 GLU -5.02 -1.26 1 101 ALA -3.19 0.98 1 106 ASP -0.34 -0.39 1 107 LEU 2.55 0.93 1 108 ASN 4.11 2.80 1 109 ALA 3.50 3.22 1 110 ILE 3.93 0.92 1 112 THR 6.81 1.93 1 113 LYS 4.20 3.04 1 114 LEU 4.30 1.69 1 116 SER 3.90 0.60 1 117 GLU 0.21 -0.09 1 119 VAL -1.26 -1.21 1 120 ASN 1.00 -1.35 1 121 VAL -5.88 -2.75 1 122 GLN -4.59 -1.74 1 123 ILE -1.27 -0.78 1 124 GLU -2.24 -1.11 1 125 LEU -0.61 -0.31 1 126 SER 0.05 0.47 1 128 ALA -0.09 0.11 1 129 GLU -0.43 -0.06 1 130 GLN -0.42 -0.31 1 stop_ save_