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 bmr27835_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 -1.63 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.62 _LACS_plot.Line_2_terminator_val_x_2 6.97 _LACS_plot.Line_2_terminator_val_y_2 5.48 _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 98 HIS 2.01 4.37 0 45 MET -5.02 -1.38 0 10 THR 0.06 -0.16 1 14 GLN 0.56 0.30 1 20 PHE -0.39 -0.26 1 21 GLN 0.43 0.17 1 23 ALA -0.61 -0.30 1 24 VAL 0.18 -0.03 1 25 VAL 0.44 0.16 1 28 LEU -0.16 -0.15 1 31 TYR -0.23 -0.21 1 32 VAL -0.47 -0.39 1 33 LEU 0.30 0.03 1 36 LEU 0.40 0.16 1 39 TYR -0.99 0.22 1 43 SER -0.40 0.02 1 44 ALA 0.99 0.38 1 46 SER 0.96 0.19 1 47 ARG 0.12 -1.35 1 51 HIS -1.60 -0.98 1 52 PHE 0.66 1.78 1 54 ASN -3.14 -0.76 1 55 ASP 3.51 3.52 1 56 TRP 5.55 4.13 1 57 GLU 3.48 3.14 1 61 TYR 4.95 4.33 1 74 TYR -2.84 -1.93 1 75 ARG -1.58 -2.80 1 83 GLN 3.69 3.40 1 84 ASN 4.55 3.39 1 85 ASN 3.86 2.84 1 86 PHE 3.81 3.26 1 87 VAL 6.43 5.34 1 88 HIS 5.00 4.45 1 89 ASP 3.09 2.96 1 91 VAL 4.80 3.78 1 92 ASN 3.45 3.50 1 95 ILE 6.97 4.85 1 96 LYS 4.77 3.65 1 97 GLN 3.67 2.13 1 99 THR 4.86 4.01 1 100 VAL 4.63 3.41 1 101 THR 3.55 2.77 1 102 THR 3.71 2.70 1 103 THR 3.77 2.90 1 104 THR 3.13 2.26 1 105 LYS 0.47 -0.11 1 107 GLU -1.93 -0.96 1 108 ASN -2.12 -0.43 1 109 PHE -1.62 -1.03 1 110 THR -3.58 -1.35 1 111 GLU 4.26 3.42 1 112 THR 6.33 4.96 1 114 VAL 6.77 5.42 1 115 LYS 4.29 3.00 1 116 MET 4.40 4.27 1 117 MET 3.76 4.40 1 118 GLU 5.20 3.96 1 119 ARG 3.21 2.29 1 120 VAL 4.27 3.64 1 121 VAL 6.08 4.27 1 122 GLU 5.52 4.55 1 123 GLN 4.85 3.25 1 124 MET 2.91 4.47 1 126 VAL 6.86 5.33 1 135 ALA 2.21 1.38 1 137 TYR 2.34 1.80 1 138 ASP 1.26 0.93 1 140 ARG 0.45 -0.05 1 142 SER -0.19 0.10 1 143 SER 0.73 1.56 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27835_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 3.39 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.38 _LACS_plot.Line_2_terminator_val_x_2 6.97 _LACS_plot.Line_2_terminator_val_y_2 -1.49 _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 98 HIS 2.01 2.36 0 45 MET -5.02 3.64 0 10 THR 0.06 -0.22 1 14 GLN 0.56 -0.26 1 20 PHE -0.39 0.13 1 21 GLN 0.43 -0.26 1 23 ALA -0.61 0.31 1 24 VAL 0.18 -0.21 1 25 VAL 0.44 -0.28 1 28 LEU -0.16 0.01 1 31 TYR -0.23 0.02 1 32 VAL -0.47 0.08 1 33 LEU 0.30 -0.27 1 36 LEU 0.40 -0.24 1 39 TYR -0.99 1.21 1 43 SER -0.40 0.42 1 44 ALA 0.99 -0.61 1 46 SER 0.96 -0.77 1 47 ARG 0.12 -1.47 1 51 HIS -1.60 0.62 1 52 PHE 0.66 1.12 1 54 ASN -3.14 2.38 1 55 ASP 3.51 0.01 1 56 TRP 5.55 -1.42 1 57 GLU 3.48 -0.34 1 61 TYR 4.95 -0.62 1 74 TYR -2.84 0.91 1 75 ARG -1.58 -1.22 1 83 GLN 3.69 -0.29 1 84 ASN 4.55 -1.16 1 85 ASN 3.86 -1.02 1 86 PHE 3.81 -0.55 1 87 VAL 6.43 -1.09 1 88 HIS 5.00 -0.55 1 89 ASP 3.09 -0.13 1 91 VAL 4.80 -1.02 1 92 ASN 3.45 0.05 1 95 ILE 6.97 -2.12 1 96 LYS 4.77 -1.12 1 97 GLN 3.67 -1.54 1 99 THR 4.86 -0.85 1 100 VAL 4.63 -1.22 1 101 THR 3.55 -0.78 1 102 THR 3.71 -1.01 1 103 THR 3.77 -0.87 1 104 THR 3.13 -0.87 1 105 LYS 0.47 -0.58 1 107 GLU -1.93 0.97 1 108 ASN -2.12 1.69 1 109 PHE -1.62 0.59 1 110 THR -3.58 2.23 1 111 GLU 4.26 -0.84 1 112 THR 6.33 -1.37 1 114 VAL 6.77 -1.35 1 115 LYS 4.29 -1.29 1 116 MET 4.40 -0.13 1 117 MET 3.76 0.64 1 118 GLU 5.20 -1.24 1 119 ARG 3.21 -0.92 1 120 VAL 4.27 -0.63 1 121 VAL 6.08 -1.81 1 122 GLU 5.52 -0.97 1 123 GLN 4.85 -1.60 1 124 MET 2.91 1.56 1 126 VAL 6.86 -1.53 1 135 ALA 2.21 -0.83 1 137 TYR 2.34 -0.54 1 138 ASP 1.26 -0.33 1 140 ARG 0.45 -0.50 1 142 SER -0.19 0.29 1 143 SER 0.73 0.83 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27835_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 0.26 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.10 _LACS_plot.Line_2_terminator_val_x_2 6.77 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _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 45 MET -5.02 -0.07 0 117 MET 3.76 -0.93 0 109 PHE -1.62 0.67 0 10 THR 0.06 0.04 1 21 GLN 0.43 -0.13 1 23 ALA -0.61 0.02 1 24 VAL 0.18 -0.02 1 25 VAL 0.44 -0.03 1 28 LEU -0.16 0.02 1 32 VAL -0.47 0.02 1 33 LEU 0.30 -0.05 1 36 LEU 0.40 0.01 1 39 TYR -0.99 -0.04 1 43 SER -0.40 -0.05 1 44 ALA 0.99 0.10 1 46 SER 0.96 -0.12 1 47 ARG 0.12 0.04 1 51 HIS -1.60 -0.38 1 52 PHE 0.66 -0.36 1 54 ASN -3.14 0.15 1 55 ASP 3.51 -0.21 1 56 TRP 5.55 -0.42 1 57 GLU 3.48 -0.24 1 85 ASN 3.86 -0.19 1 88 HIS 5.00 -0.44 1 89 ASP 3.09 -0.09 1 91 VAL 4.80 -0.46 1 92 ASN 3.45 -0.44 1 96 LYS 4.77 -0.26 1 97 GLN 3.67 -0.27 1 98 HIS 2.01 -0.16 1 99 THR 4.86 0.09 1 100 VAL 4.63 -0.20 1 101 THR 3.55 -0.21 1 102 THR 3.71 -0.24 1 103 THR 3.77 0.00 1 104 THR 3.13 -0.14 1 105 LYS 0.47 0.04 1 107 GLU -1.93 -0.09 1 108 ASN -2.12 -0.06 1 110 THR -3.58 0.31 1 111 GLU 4.26 -0.28 1 112 THR 6.33 -0.54 1 114 VAL 6.77 -0.79 1 115 LYS 4.29 -0.24 1 116 MET 4.40 -0.32 1 119 ARG 3.21 -0.16 1 120 VAL 4.27 -0.37 1 121 VAL 6.08 -0.47 1 122 GLU 5.52 -0.76 1 123 GLN 4.85 -0.36 1 135 ALA 2.21 -0.14 1 138 ASP 1.26 -0.14 1 140 ARG 0.45 -0.06 1 142 SER -0.19 0.03 1 143 SER 0.73 -0.19 1 stop_ save_