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 bmr5871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.91 _LACS_plot.Line_1_terminator_val_y_1 -1.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.22 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 7.35 _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 31 HIS 2.14 4.51 0 10 GLN 0.63 0.54 1 12 ASP -0.26 -0.01 1 13 SER 0.60 0.66 1 14 SER 0.09 0.37 1 15 SER 0.95 1.01 1 17 GLU 4.48 3.78 1 18 ARG 3.23 2.22 1 19 GLN 3.85 3.31 1 20 VAL 4.92 3.60 1 21 ASP 1.78 2.23 1 22 ARG 0.24 0.56 1 23 VAL -1.72 -1.15 1 24 ASN -0.75 -1.75 1 26 LYS 9.91 6.63 1 29 GLU 3.37 3.85 1 30 GLN 3.87 3.04 1 32 ILE 5.81 3.50 1 33 MET 3.89 1.78 1 34 GLN 4.73 3.06 1 35 ARG 3.56 2.17 1 36 ILE 2.79 2.18 1 37 MET 1.13 0.78 1 39 GLU -0.28 0.19 1 40 GLN 0.31 0.21 1 41 GLU -0.34 0.20 1 42 GLN -0.60 -0.14 1 43 TYR 0.49 1.22 1 48 ILE 0.77 0.76 1 49 ARG 0.48 0.35 1 50 SER 0.32 0.33 1 51 THR 0.36 0.37 1 52 ARG 0.77 0.62 1 53 SER 0.34 0.42 1 54 SER -0.10 0.27 1 55 ASP 1.63 1.51 1 56 GLN 4.12 3.32 1 57 GLN 4.54 3.36 1 58 GLN 3.85 3.37 1 59 ARG 3.90 2.85 1 62 ASP 4.55 3.63 1 63 GLU 3.05 2.55 1 65 ASN 1.48 2.16 1 66 GLU 0.94 0.52 1 67 MET 0.69 1.75 1 68 GLU 2.57 2.18 1 69 ASN -0.63 -1.54 1 70 THR 5.07 4.60 1 71 GLN 3.52 2.93 1 74 MET 3.74 1.84 1 76 GLU 5.80 4.04 1 77 ALA 5.02 3.20 1 79 GLN 4.80 3.52 1 80 GLN 3.80 2.90 1 81 ILE 6.47 5.27 1 82 MET 2.63 3.28 1 83 GLU 3.38 2.83 1 84 ASN 2.53 1.73 1 85 GLN -1.27 -0.78 1 87 ASP 3.12 2.10 1 88 ARG 0.45 0.23 1 90 GLN 2.15 2.43 1 94 MET 0.20 1.15 1 95 VAL 6.57 5.38 1 96 GLN 2.66 3.20 1 97 GLN 4.31 3.64 1 98 PHE 3.74 4.29 1 99 LYS 4.93 4.79 1 100 ARG 4.81 3.74 1 101 GLU 2.35 1.98 1 103 MET 2.91 1.12 1 104 SER 1.19 2.40 1 107 GLN 4.21 3.23 1 108 GLN 4.32 3.51 1 110 ASN 3.73 1.69 1 111 PHE -2.91 -2.02 1 112 ARG -0.16 -0.26 1 113 ALA 0.41 0.00 1 115 GLN 0.94 1.07 1 116 ARG 0.77 -0.05 1 118 ASP 0.11 -0.12 1 120 ASP 0.35 0.03 1 121 VAL 0.28 -0.04 1 122 SER 1.07 0.75 1 125 ARG 1.61 1.44 1 127 SER 1.14 2.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.91 _LACS_plot.Line_1_terminator_val_y_1 0.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.45 _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 9.91 _LACS_plot.Line_2_terminator_val_y_2 -2.56 _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 31 HIS 2.14 2.37 0 10 GLN 0.63 -0.09 1 12 ASP -0.26 0.25 1 13 SER 0.60 0.06 1 14 SER 0.09 0.28 1 15 SER 0.95 0.06 1 17 GLU 4.48 -0.70 1 18 ARG 3.23 -1.01 1 19 GLN 3.85 -0.54 1 20 VAL 4.92 -1.32 1 21 ASP 1.78 0.45 1 22 ARG 0.24 0.32 1 23 VAL -1.72 0.57 1 24 ASN -0.75 -1.00 1 26 LYS 9.91 -3.28 1 29 GLU 3.37 0.48 1 30 GLN 3.87 -0.83 1 32 ILE 5.81 -2.31 1 33 MET 3.89 -2.11 1 34 GLN 4.73 -1.67 1 35 ARG 3.56 -1.39 1 36 ILE 2.79 -0.61 1 37 MET 1.13 -0.35 1 39 GLU -0.28 0.47 1 40 GLN 0.31 -0.10 1 41 GLU -0.34 0.54 1 42 GLN -0.60 0.46 1 43 TYR 0.49 0.73 1 48 ILE 0.77 -0.01 1 49 ARG 0.48 -0.13 1 50 SER 0.32 0.01 1 51 THR 0.36 0.01 1 52 ARG 0.77 -0.15 1 53 SER 0.34 0.08 1 54 SER -0.10 0.37 1 55 ASP 1.63 -0.12 1 56 GLN 4.12 -0.80 1 57 GLN 4.54 -1.18 1 58 GLN 3.85 -0.48 1 59 ARG 3.90 -1.05 1 62 ASP 4.55 -0.92 1 63 GLU 3.05 -0.50 1 65 ASN 1.48 0.68 1 66 GLU 0.94 -0.42 1 67 MET 0.69 1.06 1 68 GLU 2.57 -0.39 1 69 ASN -0.63 -0.91 1 70 THR 5.07 -0.47 1 71 GLN 3.52 -0.59 1 74 MET 3.74 -1.90 1 76 GLU 5.80 -1.76 1 77 ALA 5.02 -1.82 1 79 GLN 4.80 -1.28 1 80 GLN 3.80 -0.90 1 81 ILE 6.47 -1.20 1 82 MET 2.63 0.65 1 83 GLU 3.38 -0.55 1 84 ASN 2.53 -0.80 1 85 GLN -1.27 0.49 1 87 ASP 3.12 -1.02 1 88 ARG 0.45 -0.22 1 90 GLN 2.15 0.28 1 94 MET 0.20 0.95 1 95 VAL 6.57 -1.19 1 96 GLN 2.66 0.54 1 97 GLN 4.31 -0.67 1 98 PHE 3.74 0.55 1 99 LYS 4.93 -0.14 1 100 ARG 4.81 -1.07 1 101 GLU 2.35 -0.37 1 103 MET 2.91 -1.79 1 104 SER 1.19 1.21 1 107 GLN 4.21 -0.98 1 108 GLN 4.32 -0.81 1 110 ASN 3.73 -2.04 1 111 PHE -2.91 0.89 1 112 ARG -0.16 -0.10 1 113 ALA 0.41 -0.41 1 115 GLN 0.94 0.13 1 116 ARG 0.77 -0.82 1 118 ASP 0.11 -0.23 1 120 ASP 0.35 -0.32 1 121 VAL 0.28 -0.32 1 122 SER 1.07 -0.32 1 125 ARG 1.61 -0.17 1 127 SER 1.14 0.89 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.91 _LACS_plot.Line_1_terminator_val_y_1 0.22 _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 0.13 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _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 31 HIS 2.14 -1.59 0 10 GLN 0.63 -0.01 1 12 ASP -0.26 0.02 1 13 SER 0.60 -0.02 1 14 SER 0.09 0.07 1 15 SER 0.95 -0.11 1 17 GLU 4.48 -0.46 1 18 ARG 3.23 -0.16 1 19 GLN 3.85 -0.29 1 20 VAL 4.92 -0.45 1 21 ASP 1.78 -0.13 1 22 ARG 0.24 -0.04 1 23 VAL -1.72 0.22 1 24 ASN -0.75 0.15 1 26 LYS 9.91 -0.46 1 29 GLU 3.37 -0.59 1 30 GLN 3.87 -0.38 1 32 ILE 5.81 -1.07 1 33 MET 3.89 -0.08 1 34 GLN 4.73 -0.35 1 35 ARG 3.56 -0.41 1 36 ILE 2.79 0.02 1 37 MET 1.13 0.04 1 39 GLU -0.28 -0.08 1 40 GLN 0.31 -0.04 1 48 ILE 0.77 0.03 1 49 ARG 0.48 0.02 1 50 SER 0.32 0.04 1 51 THR 0.36 -0.01 1 52 ARG 0.77 0.00 1 53 SER 0.34 0.07 1 54 SER -0.10 0.05 1 55 ASP 1.63 -0.09 1 56 GLN 4.12 -0.31 1 57 GLN 4.54 -0.30 1 58 GLN 3.85 -1.51 1 59 ARG 3.90 -0.21 1 62 ASP 4.55 -0.21 1 63 GLU 3.05 -0.21 1 65 ASN 1.48 -0.18 1 66 GLU 0.94 -0.15 1 67 MET 0.69 -0.30 1 68 GLU 2.57 -0.35 1 69 ASN -0.63 0.09 1 70 THR 5.07 -0.73 1 71 GLN 3.52 -0.41 1 74 MET 3.74 -0.18 1 76 GLU 5.80 -0.28 1 77 ALA 5.02 -0.30 1 79 GLN 4.80 -0.28 1 80 GLN 3.80 -0.37 1 81 ILE 6.47 -0.55 1 82 MET 2.63 -0.34 1 83 GLU 3.38 -0.43 1 84 ASN 2.53 -0.30 1 85 GLN -1.27 0.02 1 87 ASP 3.12 -0.27 1 88 ARG 0.45 -0.07 1 90 GLN 2.15 -0.28 1 94 MET 0.20 -0.24 1 95 VAL 6.57 -0.58 1 96 GLN 2.66 -0.58 1 97 GLN 4.31 -0.31 1 98 PHE 3.74 -0.86 1 99 LYS 4.93 -0.48 1 100 ARG 4.81 -0.38 1 101 GLU 2.35 -0.44 1 103 MET 2.91 -0.14 1 104 SER 1.19 -0.06 1 107 GLN 4.21 -0.03 1 108 GLN 4.32 -0.32 1 110 ASN 3.73 -0.45 1 111 PHE -2.91 0.27 1 112 ARG -0.16 -0.04 1 113 ALA 0.41 -0.26 1 115 GLN 0.94 -0.17 1 116 ARG 0.77 -0.13 1 118 ASP 0.11 0.02 1 120 ASP 0.35 0.03 1 121 VAL 0.28 0.01 1 122 SER 1.07 -0.11 1 125 ARG 1.61 -0.10 1 127 SER 1.14 -0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.91 _LACS_plot.Line_1_terminator_val_y_1 -1.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.43 _LACS_plot.Line_2_terminator_val_x_2 6.56 _LACS_plot.Line_2_terminator_val_y_2 2.78 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 GLN 4.21 4.39 0 70 THR 5.07 -0.23 0 110 ASN 3.73 -1.15 0 95 VAL 6.57 0.57 0 10 GLN 0.63 -0.50 1 12 ASP -0.26 0.58 1 13 SER 0.60 0.41 1 14 SER 0.09 0.49 1 15 SER 0.95 1.88 1 17 GLU 4.48 1.69 1 18 ARG 3.23 2.50 1 19 GLN 3.85 3.27 1 20 VAL 4.92 1.16 1 21 ASP 1.78 0.74 1 22 ARG 0.24 0.37 1 23 VAL -1.72 -1.85 1 24 ASN -0.75 -0.73 1 29 GLU 3.37 1.61 1 30 GLN 3.87 2.38 1 31 HIS 2.14 2.33 1 32 ILE 5.81 1.62 1 33 MET 3.89 2.64 1 34 GLN 4.73 3.25 1 35 ARG 3.56 2.82 1 36 ILE 2.79 0.94 1 37 MET 1.13 1.17 1 39 GLU -0.28 0.00 1 41 GLU -0.34 -0.69 1 42 GLN -0.60 -1.46 1 48 ILE 0.77 -0.19 1 49 ARG 0.48 0.23 1 50 SER 0.32 0.46 1 51 THR 0.36 1.81 1 52 ARG 0.77 0.46 1 53 SER 0.34 0.24 1 54 SER -0.10 0.26 1 55 ASP 1.63 1.03 1 56 GLN 4.12 2.63 1 57 GLN 4.54 1.06 1 58 GLN 3.85 1.79 1 59 ARG 3.90 2.15 1 62 ASP 4.55 2.98 1 63 GLU 3.05 3.51 1 65 ASN 1.48 0.71 1 66 GLU 0.94 1.46 1 67 MET 0.69 -0.56 1 68 GLU 2.57 0.70 1 69 ASN -0.63 -0.45 1 71 GLN 3.52 1.21 1 74 MET 3.74 1.69 1 76 GLU 5.80 2.59 1 77 ALA 5.02 0.97 1 79 GLN 4.80 2.53 1 80 GLN 3.80 1.99 1 81 ILE 6.47 1.09 1 82 MET 2.63 1.80 1 83 GLU 3.38 2.48 1 84 ASN 2.53 2.33 1 85 GLN -1.27 1.17 1 87 ASP 3.12 0.74 1 88 ARG 0.45 0.43 1 90 GLN 2.15 -0.35 1 94 MET 0.20 2.19 1 96 GLN 2.66 2.04 1 97 GLN 4.31 2.06 1 98 PHE 3.74 1.40 1 99 LYS 4.93 1.46 1 100 ARG 4.81 3.27 1 101 GLU 2.35 3.47 1 103 MET 2.91 1.51 1 104 SER 1.19 1.61 1 108 GLN 4.32 1.66 1 111 PHE -2.91 -0.42 1 112 ARG -0.16 0.12 1 115 GLN 0.94 -0.09 1 116 ARG 0.77 -1.34 1 118 ASP 0.11 -0.27 1 120 ASP 0.35 0.34 1 121 VAL 0.28 0.12 1 122 SER 1.07 1.87 1 125 ARG 1.61 0.42 1 stop_ save_