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 bmr16558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.97 _LACS_plot.Line_1_terminator_val_y_1 -4.12 _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 -1.35 _LACS_plot.Line_2_terminator_val_x_2 6.77 _LACS_plot.Line_2_terminator_val_y_2 4.77 _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 47 ILE 1.36 -2.14 0 46 GLN -9.97 -2.75 0 10 ARG -0.30 -0.28 1 11 ASN -3.04 -2.06 1 13 SER 3.30 2.13 1 14 GLU -1.33 -0.80 1 15 LEU 0.06 0.12 1 16 LYS -1.86 -1.95 1 18 LYS -3.63 -1.78 1 19 PHE -0.25 0.04 1 20 ILE -4.65 -1.47 1 21 HIS -3.23 -0.75 1 22 THR -1.07 -1.84 1 23 LYS -3.72 -1.59 1 24 LEU -7.03 -2.59 1 25 ARG -1.38 -1.08 1 26 LYS 2.15 1.85 1 27 SER -4.18 -1.11 1 28 SER 4.75 3.37 1 29 ARG -0.00 -0.95 1 31 PHE 0.33 1.87 1 33 PHE -3.97 -1.73 1 34 THR -3.36 -1.84 1 35 VAL -3.85 -1.52 1 36 VAL -5.06 -2.52 1 39 ASP 2.17 2.35 1 40 GLU -2.87 -1.08 1 42 ASP 1.87 -1.36 1 43 GLU -6.19 -2.46 1 44 PHE -2.30 -1.59 1 45 LEU -1.91 -1.43 1 48 LYS -0.25 0.21 1 49 SER -2.69 -1.22 1 50 LEU -3.12 -1.32 1 51 VAL 0.16 -0.08 1 52 LEU 3.80 2.89 1 53 ASP 1.92 0.22 1 56 ALA 2.48 2.89 1 57 ALA 2.45 2.31 1 58 LEU 3.40 2.28 1 59 ASP -0.23 2.32 1 61 LYS 0.79 1.32 1 62 MET -2.59 0.37 1 63 GLU -6.26 -2.18 1 64 THR 3.48 2.15 1 66 ASP 2.45 2.07 1 67 VAL -2.65 -1.22 1 68 ILE 3.21 1.66 1 69 VAL 1.92 1.89 1 70 SER -3.53 -1.36 1 71 VAL -2.15 -1.35 1 72 ASN 4.13 1.57 1 73 ASP 2.62 1.55 1 74 THR -0.03 0.38 1 76 VAL -0.02 -2.35 1 77 LEU 3.34 1.53 1 79 HIS -0.73 1.47 1 80 THR -2.70 -1.59 1 81 HIS 5.18 5.43 1 82 ALA 3.52 2.61 1 83 GLN 3.12 3.18 1 84 VAL 4.93 3.30 1 85 VAL 6.78 4.80 1 86 LYS 4.37 3.23 1 87 ILE 5.57 4.43 1 88 PHE 4.03 1.82 1 89 GLN 3.68 2.90 1 90 SER 1.59 1.60 1 91 ILE 0.11 0.12 1 93 ILE 5.09 3.54 1 95 ALA -2.31 -1.27 1 96 SER -3.03 -0.86 1 97 VAL -6.02 -3.27 1 98 ASP -2.39 -0.47 1 99 LEU -4.87 -1.54 1 100 GLU -4.01 -1.60 1 101 LEU -4.87 -2.65 1 103 ARG -1.45 0.66 1 105 TYR 2.36 0.89 1 107 LEU 0.15 0.43 1 109 PHE 0.52 0.46 1 110 ASP -3.08 -1.86 1 112 ASP 0.11 0.08 1 113 ASP -1.30 -0.64 1 115 ASN 1.25 0.85 1 116 THR 0.71 0.49 1 117 SER 0.11 0.19 1 118 LEU 0.44 0.23 1 119 VAL 0.59 0.28 1 120 THR 0.10 -0.12 1 121 SER -0.08 -0.14 1 122 VAL 0.16 -0.08 1 123 ALA -0.26 -0.19 1 124 ILE 0.32 -0.12 1 125 LEU -0.17 -0.18 1 126 ASP 0.28 0.11 1 127 LYS -0.68 -0.43 1 128 GLU 0.03 0.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.97 _LACS_plot.Line_1_terminator_val_y_1 5.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.65 _LACS_plot.Line_2_terminator_val_x_2 6.77 _LACS_plot.Line_2_terminator_val_y_2 -2.00 _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 47 ILE 1.36 -3.50 0 46 GLN -9.97 7.22 0 10 ARG -0.30 0.02 1 11 ASN -3.04 0.98 1 13 SER 3.30 -1.17 1 14 GLU -1.33 0.53 1 15 LEU 0.06 0.06 1 16 LYS -1.86 -0.09 1 18 LYS -3.63 1.85 1 19 PHE -0.25 0.29 1 20 ILE -4.65 3.18 1 21 HIS -3.23 2.48 1 22 THR -1.07 -0.77 1 23 LYS -3.72 2.13 1 24 LEU -7.03 4.44 1 25 ARG -1.38 0.30 1 26 LYS 2.15 -0.30 1 27 SER -4.18 3.07 1 28 SER 4.75 -1.38 1 29 ARG -0.00 -0.95 1 31 PHE 0.33 1.54 1 33 PHE -3.97 2.24 1 34 THR -3.36 1.52 1 35 VAL -3.85 2.33 1 36 VAL -5.06 2.54 1 39 ASP 2.17 0.18 1 40 GLU -2.87 1.79 1 42 ASP 1.87 -3.23 1 43 GLU -6.19 3.73 1 44 PHE -2.30 0.71 1 45 LEU -1.91 0.48 1 48 LYS -0.25 0.46 1 49 SER -2.69 1.47 1 50 LEU -3.12 1.80 1 51 VAL 0.16 -0.24 1 52 LEU 3.80 -0.91 1 53 ASP 1.92 -1.70 1 56 ALA 2.48 0.41 1 57 ALA 2.45 -0.14 1 58 LEU 3.40 -1.12 1 59 ASP -0.23 2.55 1 61 LYS 0.79 0.53 1 62 MET -2.59 2.96 1 63 GLU -6.26 4.08 1 64 THR 3.48 -1.33 1 66 ASP 2.45 -0.38 1 67 VAL -2.65 1.43 1 68 ILE 3.21 -1.55 1 69 VAL 1.92 -0.03 1 70 SER -3.53 2.17 1 71 VAL -2.15 0.80 1 72 ASN 4.13 -2.56 1 73 ASP 2.62 -1.07 1 74 THR -0.03 0.41 1 76 VAL -0.02 -2.33 1 77 LEU 3.34 -1.81 1 79 HIS -0.73 2.20 1 80 THR -2.70 1.11 1 81 HIS 5.18 0.25 1 82 ALA 3.52 -0.91 1 83 GLN 3.12 0.06 1 84 VAL 4.93 -1.63 1 85 VAL 6.78 -1.98 1 86 LYS 4.37 -1.14 1 87 ILE 5.57 -1.14 1 88 PHE 4.03 -2.21 1 89 GLN 3.68 -0.78 1 90 SER 1.59 0.01 1 91 ILE 0.11 0.01 1 93 ILE 5.09 -1.55 1 95 ALA -2.31 1.04 1 96 SER -3.03 2.17 1 97 VAL -6.02 2.75 1 98 ASP -2.39 1.92 1 99 LEU -4.87 3.33 1 100 GLU -4.01 2.41 1 101 LEU -4.87 2.22 1 103 ARG -1.45 2.11 1 105 TYR 2.36 -1.47 1 107 LEU 0.15 0.28 1 109 PHE 0.52 -0.06 1 110 ASP -3.08 1.22 1 112 ASP 0.11 -0.03 1 113 ASP -1.30 0.66 1 115 ASN 1.25 -0.40 1 116 THR 0.71 -0.22 1 117 SER 0.11 0.08 1 118 LEU 0.44 -0.21 1 119 VAL 0.59 -0.31 1 120 THR 0.10 -0.22 1 121 SER -0.08 -0.06 1 122 VAL 0.16 -0.24 1 123 ALA -0.26 0.07 1 124 ILE 0.32 -0.44 1 125 LEU -0.17 -0.01 1 126 ASP 0.28 -0.17 1 127 LYS -0.68 0.25 1 128 GLU 0.03 0.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.97 _LACS_plot.Line_1_terminator_val_y_1 1.10 _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 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.77 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 ASP 1.87 -1.71 0 10 ARG -0.30 -0.21 1 11 ASN -3.04 0.08 1 13 SER 3.30 -0.17 1 14 GLU -1.33 0.02 1 15 LEU 0.06 0.09 1 16 LYS -1.86 0.22 1 18 LYS -3.63 0.24 1 19 PHE -0.25 0.76 1 20 ILE -4.65 0.19 1 21 HIS -3.23 0.85 1 22 THR -1.07 0.31 1 23 LYS -3.72 1.25 1 24 LEU -7.03 0.64 1 25 ARG -1.38 0.46 1 26 LYS 2.15 -1.19 1 27 SER -4.18 0.44 1 28 SER 4.75 -0.37 1 29 ARG -0.00 0.18 1 31 PHE 0.33 -0.09 1 33 PHE -3.97 1.08 1 34 THR -3.36 0.52 1 35 VAL -3.85 1.12 1 36 VAL -5.06 0.66 1 39 ASP 2.17 0.03 1 40 GLU -2.87 -0.06 1 43 GLU -6.19 -0.19 1 44 PHE -2.30 0.36 1 45 LEU -1.91 0.62 1 46 GLN -9.97 1.32 1 47 ILE 1.36 0.02 1 48 LYS -0.25 0.17 1 49 SER -2.69 0.15 1 50 LEU -3.12 0.69 1 51 VAL 0.16 -0.14 1 52 LEU 3.80 -0.40 1 53 ASP 1.92 -0.18 1 56 ALA 2.48 -0.09 1 57 ALA 2.45 -0.18 1 58 LEU 3.40 -0.28 1 59 ASP -0.23 -0.19 1 61 LYS 0.79 0.03 1 62 MET -2.59 -0.55 1 63 GLU -6.26 0.19 1 64 THR 3.48 -0.73 1 66 ASP 2.45 -0.13 1 67 VAL -2.65 0.35 1 68 ILE 3.21 -0.32 1 69 VAL 1.92 -0.23 1 70 SER -3.53 0.83 1 71 VAL -2.15 0.36 1 72 ASN 4.13 -0.18 1 73 ASP 2.62 -0.32 1 74 THR -0.03 0.00 1 76 VAL -0.02 -0.15 1 77 LEU 3.34 0.29 1 79 HIS -0.73 0.00 1 80 THR -2.70 0.20 1 81 HIS 5.18 -0.70 1 82 ALA 3.52 -0.28 1 83 GLN 3.12 -0.38 1 84 VAL 4.93 -0.26 1 85 VAL 6.78 -0.37 1 86 LYS 4.37 -0.21 1 87 ILE 5.57 -0.46 1 88 PHE 4.03 0.04 1 89 GLN 3.68 -0.27 1 90 SER 1.59 -0.14 1 91 ILE 0.11 -0.09 1 93 ILE 5.09 -1.04 1 95 ALA -2.31 0.39 1 96 SER -3.03 1.35 1 97 VAL -6.02 0.75 1 98 ASP -2.39 0.57 1 99 LEU -4.87 0.77 1 100 GLU -4.01 0.61 1 101 LEU -4.87 1.27 1 103 ARG -1.45 0.18 1 105 TYR 2.36 -0.06 1 107 LEU 0.15 -0.21 1 109 PHE 0.52 -0.22 1 110 ASP -3.08 -0.10 1 112 ASP 0.11 -0.01 1 113 ASP -1.30 -0.06 1 115 ASN 1.25 -0.03 1 116 THR 0.71 0.04 1 117 SER 0.11 0.04 1 118 LEU 0.44 0.01 1 119 VAL 0.59 0.05 1 120 THR 0.10 0.04 1 121 SER -0.08 0.04 1 122 VAL 0.16 0.01 1 123 ALA -0.26 0.01 1 124 ILE 0.32 -0.05 1 125 LEU -0.17 0.05 1 126 ASP 0.28 -0.08 1 127 LYS -0.68 0.01 1 128 GLU 0.03 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.97 _LACS_plot.Line_1_terminator_val_y_1 -3.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.04 _LACS_plot.Line_2_terminator_val_x_2 6.77 _LACS_plot.Line_2_terminator_val_y_2 2.55 _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 68 ILE 3.21 -3.74 0 46 GLN -9.97 -0.62 0 10 ARG -0.30 -1.02 1 13 SER 3.30 0.68 1 14 GLU -1.33 -0.01 1 15 LEU 0.06 -0.54 1 16 LYS -1.86 -2.06 1 18 LYS -3.63 -1.15 1 19 PHE -0.25 0.12 1 20 ILE -4.65 -2.69 1 21 HIS -3.23 0.42 1 22 THR -1.07 -4.56 1 23 LYS -3.72 -0.99 1 24 LEU -7.03 -2.44 1 25 ARG -1.38 -0.33 1 26 LYS 2.15 0.16 1 29 ARG -0.00 -0.35 1 31 PHE 0.33 0.31 1 33 PHE -3.97 -2.42 1 34 THR -3.36 -0.68 1 35 VAL -3.85 -1.45 1 36 VAL -5.06 -3.05 1 39 ASP 2.17 -0.17 1 42 ASP 1.87 -3.36 1 43 GLU -6.19 -0.20 1 44 PHE -2.30 0.27 1 45 LEU -1.91 -0.77 1 47 ILE 1.36 -0.76 1 48 LYS -0.25 -2.27 1 49 SER -2.69 -2.80 1 50 LEU -3.12 -1.16 1 51 VAL 0.16 1.45 1 52 LEU 3.80 -0.59 1 53 ASP 1.92 -0.76 1 56 ALA 2.48 2.59 1 57 ALA 2.45 2.52 1 58 LEU 3.40 1.70 1 59 ASP -0.23 1.52 1 61 LYS 0.79 0.23 1 62 MET -2.59 -2.93 1 63 GLU -6.26 -0.61 1 64 THR 3.48 1.83 1 66 ASP 2.45 -0.93 1 67 VAL -2.65 0.66 1 69 VAL 1.92 0.24 1 70 SER -3.53 -2.32 1 71 VAL -2.15 -0.34 1 73 ASP 2.62 -0.95 1 74 THR -0.03 -1.80 1 76 VAL -0.02 0.31 1 77 LEU 3.34 0.43 1 79 HIS -0.73 2.51 1 80 THR -2.70 1.05 1 81 HIS 5.18 3.18 1 82 ALA 3.52 3.26 1 83 GLN 3.12 3.58 1 84 VAL 4.93 0.48 1 85 VAL 6.78 2.28 1 86 LYS 4.37 2.98 1 87 ILE 5.57 3.44 1 88 PHE 4.03 3.76 1 89 GLN 3.68 0.97 1 90 SER 1.59 -0.54 1 93 ILE 5.09 1.28 1 95 ALA -2.31 -1.86 1 96 SER -3.03 -0.96 1 97 VAL -6.02 -3.95 1 98 ASP -2.39 -0.45 1 99 LEU -4.87 -2.97 1 100 GLU -4.01 -1.92 1 101 LEU -4.87 -2.13 1 103 ARG -1.45 -1.47 1 109 PHE 0.52 -1.36 1 112 ASP 0.11 -0.67 1 115 ASN 1.25 0.75 1 116 THR 0.71 -0.07 1 117 SER 0.11 -0.30 1 118 LEU 0.44 -0.21 1 119 VAL 0.59 0.10 1 120 THR 0.10 -0.30 1 121 SER -0.08 -0.29 1 122 VAL 0.16 -0.62 1 123 ALA -0.26 -0.41 1 124 ILE 0.32 -0.17 1 125 LEU -0.17 -0.70 1 126 ASP 0.28 -0.55 1 127 LYS -0.68 -0.47 1 stop_ save_