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 bmr16233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.15 _LACS_plot.Line_2_terminator_val_x_2 9.93 _LACS_plot.Line_2_terminator_val_y_2 6.94 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 LEU 1.82 -1.14 0 35 ARG -7.05 -2.12 0 53 GLU 3.18 4.67 0 42 SER 9.93 5.30 0 47 GLU -7.44 -2.19 0 36 TYR -0.44 -2.67 0 10 ARG 4.14 3.38 1 11 LYS 4.97 1.27 1 13 ALA 4.54 2.75 1 14 GLN 5.31 3.45 1 15 PHE 2.62 0.29 1 17 LYS 4.39 3.40 1 18 GLU 3.62 2.87 1 19 SER 6.74 5.24 1 21 ASN 3.53 2.38 1 22 SER 0.89 0.72 1 25 ALA 2.97 2.71 1 26 SER 3.93 2.67 1 27 TYR 1.19 2.10 1 30 ALA -2.30 -1.03 1 31 ALA 0.20 0.04 1 32 ILE -5.02 -1.68 1 33 TYR -4.92 -0.88 1 34 ALA -3.85 -1.15 1 37 ASP -4.52 -1.06 1 38 LYS -0.73 0.50 1 40 ASN -0.84 1.45 1 43 GLN 0.34 -1.07 1 44 GLN 1.02 0.23 1 45 THR -1.06 -1.05 1 46 LYS 0.95 0.89 1 48 TRP 0.95 2.33 1 49 ARG -6.14 -3.23 1 51 TYR -3.80 -0.58 1 52 ILE 1.27 1.05 1 54 LYS 2.80 1.94 1 55 GLU -0.49 -0.13 1 56 LEU -5.32 -2.19 1 57 ASP -1.77 -2.19 1 58 PHE 4.66 2.90 1 59 SER 0.64 1.08 1 60 LYS -4.26 -1.40 1 61 SER -2.41 -1.21 1 63 ASP 1.88 -0.48 1 66 VAL -6.51 -3.72 1 67 ASP -1.84 -2.11 1 68 ASP 2.39 2.42 1 71 SER -0.66 -0.65 1 72 MET 2.99 -0.33 1 73 THR -2.97 -1.72 1 74 SER -1.08 -0.85 1 76 ARG -0.02 0.38 1 78 SER -4.83 -2.87 1 79 VAL 3.12 1.88 1 80 SER -0.71 -0.54 1 83 SER -0.68 -1.04 1 84 THR 0.40 1.30 1 85 SER -0.51 -0.95 1 86 HIS -4.04 -0.47 1 87 LEU -3.71 -2.62 1 88 THR 3.28 2.34 1 89 ARG -2.83 -1.38 1 91 SER 4.76 3.29 1 92 GLU 3.89 3.68 1 93 LEU 4.87 2.69 1 94 GLN 3.44 2.47 1 95 ALA 3.71 2.57 1 96 VAL 5.52 3.92 1 97 ILE 6.52 5.56 1 98 ASP 3.84 3.29 1 99 SER 2.08 2.25 1 100 ASP 1.00 1.10 1 101 LYS 6.43 4.72 1 102 SER 3.41 2.44 1 103 ASN 2.13 1.61 1 104 TYR -1.54 0.90 1 106 THR -0.63 0.01 1 107 ASP 0.53 0.58 1 108 LYS 0.59 0.31 1 109 SER 0.64 0.72 1 110 GLU -0.19 -0.04 1 111 GLN -0.26 0.12 1 112 GLN 0.02 0.18 1 114 SER 0.47 0.44 1 115 GLN -0.17 0.25 1 116 ALA -0.49 -0.11 1 117 THR -0.08 -0.25 1 121 GLU -0.64 -0.22 1 122 ILE -2.89 -2.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 4.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.85 _LACS_plot.Line_2_terminator_val_x_2 9.93 _LACS_plot.Line_2_terminator_val_y_2 -2.99 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 LEU 1.82 -2.96 0 35 ARG -7.05 4.93 0 53 GLU 3.18 1.49 0 42 SER 9.93 -4.63 0 47 GLU -7.44 5.25 0 36 TYR -0.44 -2.23 0 10 ARG 4.14 -0.76 1 11 LYS 4.97 -3.70 1 13 ALA 4.54 -1.79 1 14 GLN 5.31 -1.86 1 15 PHE 2.62 -2.33 1 17 LYS 4.39 -0.99 1 18 GLU 3.62 -0.75 1 19 SER 6.74 -1.50 1 21 ASN 3.53 -1.15 1 22 SER 0.89 -0.17 1 25 ALA 2.97 -0.26 1 26 SER 3.93 -1.26 1 27 TYR 1.19 0.91 1 30 ALA -2.30 1.27 1 31 ALA 0.20 -0.16 1 32 ILE -5.02 3.34 1 33 TYR -4.92 4.04 1 34 ALA -3.85 2.70 1 37 ASP -4.52 3.46 1 38 LYS -0.73 1.23 1 40 ASN -0.84 2.29 1 43 GLN 0.34 -1.41 1 44 GLN 1.02 -0.79 1 45 THR -1.06 0.01 1 46 LYS 0.95 -0.06 1 48 TRP 0.95 1.38 1 49 ARG -6.14 2.91 1 51 TYR -3.80 3.22 1 52 ILE 1.27 -0.22 1 54 LYS 2.80 -0.86 1 55 GLU -0.49 0.36 1 56 LEU -5.32 3.13 1 57 ASP -1.77 -0.42 1 58 PHE 4.66 -1.76 1 59 SER 0.64 0.44 1 60 LYS -4.26 2.86 1 61 SER -2.41 1.20 1 63 ASP 1.88 -2.36 1 66 VAL -6.51 2.79 1 67 ASP -1.84 -0.27 1 68 ASP 2.39 0.03 1 71 SER -0.66 0.01 1 72 MET 2.99 -3.32 1 73 THR -2.97 1.25 1 74 SER -1.08 0.23 1 76 ARG -0.02 0.40 1 78 SER -4.83 1.96 1 79 VAL 3.12 -1.24 1 80 SER -0.71 0.17 1 83 SER -0.68 -0.36 1 84 THR 0.40 0.90 1 85 SER -0.51 -0.44 1 86 HIS -4.04 3.57 1 87 LEU -3.71 1.09 1 88 THR 3.28 -0.94 1 89 ARG -2.83 1.45 1 91 SER 4.76 -1.47 1 92 GLU 3.89 -0.21 1 93 LEU 4.87 -2.18 1 94 GLN 3.44 -0.97 1 95 ALA 3.71 -1.14 1 96 VAL 5.52 -1.60 1 97 ILE 6.52 -0.96 1 98 ASP 3.84 -0.55 1 99 SER 2.08 0.17 1 100 ASP 1.00 0.10 1 101 LYS 6.43 -1.71 1 102 SER 3.41 -0.97 1 103 ASN 2.13 -0.52 1 104 TYR -1.54 2.44 1 106 THR -0.63 0.64 1 107 ASP 0.53 0.05 1 108 LYS 0.59 -0.28 1 109 SER 0.64 0.08 1 110 GLU -0.19 0.15 1 111 GLN -0.26 0.38 1 112 GLN 0.02 0.16 1 114 SER 0.47 -0.03 1 115 GLN -0.17 0.42 1 116 ALA -0.49 0.38 1 117 THR -0.08 -0.17 1 121 GLU -0.64 0.42 1 122 ILE -2.89 0.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 0.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _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 9.93 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 SER 9.93 0.15 0 34 ALA -3.85 1.57 0 10 ARG 4.14 -0.26 1 11 LYS 4.97 -0.35 1 13 ALA 4.54 -0.20 1 14 GLN 5.31 -0.26 1 15 PHE 2.62 0.13 1 17 LYS 4.39 -0.20 1 18 GLU 3.62 -0.29 1 19 SER 6.74 -0.36 1 21 ASN 3.53 -0.22 1 22 SER 0.89 0.14 1 24 LEU 1.82 0.47 1 25 ALA 2.97 0.08 1 26 SER 3.93 -0.38 1 27 TYR 1.19 -0.44 1 30 ALA -2.30 0.20 1 31 ALA 0.20 0.03 1 32 ILE -5.02 0.99 1 33 TYR -4.92 0.20 1 35 ARG -7.05 1.03 1 36 TYR -0.44 -0.38 1 37 ASP -4.52 -0.25 1 38 LYS -0.73 -0.17 1 43 GLN 0.34 0.34 1 44 GLN 1.02 -0.15 1 45 THR -1.06 -0.12 1 46 LYS 0.95 -0.78 1 47 GLU -7.44 0.05 1 48 TRP 0.95 0.27 1 49 ARG -6.14 0.71 1 51 TYR -3.80 0.43 1 52 ILE 1.27 0.71 1 53 GLU 3.18 -0.36 1 54 LYS 2.80 0.04 1 55 GLU -0.49 0.32 1 56 LEU -5.32 -0.13 1 57 ASP -1.77 0.26 1 58 PHE 4.66 -0.57 1 59 SER 0.64 0.11 1 60 LYS -4.26 0.27 1 61 SER -2.41 0.53 1 63 ASP 1.88 0.49 1 66 VAL -6.51 1.20 1 67 ASP -1.84 0.02 1 68 ASP 2.39 0.03 1 71 SER -0.66 0.20 1 72 MET 2.99 0.65 1 73 THR -2.97 0.28 1 74 SER -1.08 0.51 1 76 ARG -0.02 0.13 1 78 SER -4.83 -0.09 1 79 VAL 3.12 -0.31 1 80 SER -0.71 0.06 1 83 SER -0.68 0.36 1 84 THR 0.40 0.33 1 85 SER -0.51 0.12 1 86 HIS -4.04 0.58 1 87 LEU -3.71 0.34 1 88 THR 3.28 -0.15 1 89 ARG -2.83 0.36 1 91 SER 4.76 -0.57 1 92 GLU 3.89 -0.28 1 93 LEU 4.87 -0.22 1 94 GLN 3.44 -0.72 1 95 ALA 3.71 -0.08 1 96 VAL 5.52 -0.38 1 97 ILE 6.52 -0.76 1 98 ASP 3.84 -0.35 1 99 SER 2.08 -0.07 1 100 ASP 1.00 0.24 1 101 LYS 6.43 -0.02 1 102 SER 3.41 -0.17 1 103 ASN 2.13 -0.28 1 104 TYR -1.54 0.03 1 106 THR -0.63 0.12 1 107 ASP 0.53 0.00 1 108 LYS 0.59 0.09 1 109 SER 0.64 -0.07 1 110 GLU -0.19 -0.01 1 111 GLN -0.26 -0.03 1 115 GLN -0.17 0.05 1 116 ALA -0.49 0.05 1 121 GLU -0.64 -0.09 1 122 ILE -2.89 0.33 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.78 _LACS_plot.Line_2_terminator_val_x_2 6.74 _LACS_plot.Line_2_terminator_val_y_2 2.53 _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 15 PHE 2.62 4.36 0 32 ILE -5.02 -4.45 0 66 VAL -6.51 0.47 0 10 ARG 4.14 3.20 1 11 LYS 4.97 1.98 1 13 ALA 4.54 2.92 1 14 GLN 5.31 2.89 1 17 LYS 4.39 2.51 1 18 GLU 3.62 3.52 1 19 SER 6.74 1.90 1 21 ASN 3.53 1.27 1 22 SER 0.89 -0.72 1 24 LEU 1.82 -1.72 1 25 ALA 2.97 2.54 1 26 SER 3.93 2.84 1 27 TYR 1.19 1.54 1 30 ALA -2.30 -0.52 1 31 ALA 0.20 -2.18 1 33 TYR -4.92 -1.18 1 34 ALA -3.85 1.65 1 35 ARG -7.05 -2.23 1 36 TYR -0.44 -3.16 1 37 ASP -4.52 0.51 1 38 LYS -0.73 -0.37 1 40 ASN -0.84 0.58 1 43 GLN 0.34 -0.60 1 44 GLN 1.02 -0.16 1 45 THR -1.06 -1.26 1 46 LYS 0.95 -2.28 1 47 GLU -7.44 -1.74 1 48 TRP 0.95 -0.15 1 49 ARG -6.14 -2.65 1 51 TYR -3.80 0.93 1 52 ILE 1.27 1.13 1 53 GLU 3.18 0.99 1 54 LYS 2.80 0.76 1 55 GLU -0.49 -0.90 1 56 LEU -5.32 -3.08 1 57 ASP -1.77 2.44 1 58 PHE 4.66 -0.46 1 59 SER 0.64 -1.26 1 60 LYS -4.26 -1.60 1 61 SER -2.41 -1.20 1 63 ASP 1.88 -0.37 1 67 ASP -1.84 0.35 1 68 ASP 2.39 -1.34 1 71 SER -0.66 -1.13 1 72 MET 2.99 1.10 1 73 THR -2.97 -3.56 1 74 SER -1.08 0.94 1 76 ARG -0.02 0.36 1 78 SER -4.83 -1.48 1 79 VAL 3.12 0.47 1 80 SER -0.71 -0.54 1 83 SER -0.68 0.34 1 84 THR 0.40 1.39 1 85 SER -0.51 -1.61 1 86 HIS -4.04 0.02 1 87 LEU -3.71 -0.75 1 88 THR 3.28 0.39 1 89 ARG -2.83 -2.55 1 91 SER 4.76 3.16 1 92 GLU 3.89 2.87 1 93 LEU 4.87 0.87 1 94 GLN 3.44 1.44 1 95 ALA 3.71 2.86 1 96 VAL 5.52 1.17 1 97 ILE 6.52 1.16 1 98 ASP 3.84 2.84 1 99 SER 2.08 2.99 1 100 ASP 1.00 2.79 1 101 LYS 6.43 0.99 1 102 SER 3.41 2.12 1 103 ASN 2.13 -0.06 1 104 TYR -1.54 -0.39 1 106 THR -0.63 -0.57 1 107 ASP 0.53 -0.01 1 108 LYS 0.59 0.26 1 109 SER 0.64 0.00 1 110 GLU -0.19 -0.25 1 111 GLN -0.26 -0.28 1 112 GLN 0.02 -0.41 1 114 SER 0.47 0.11 1 115 GLN -0.17 -0.56 1 116 ALA -0.49 -0.29 1 117 THR -0.08 -0.82 1 121 GLU -0.64 -0.57 1 122 ILE -2.89 -2.64 1 stop_ save_