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 bmr18599_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.02 _LACS_plot.Line_1_terminator_val_y_1 -2.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.26 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 3.08 _LACS_plot.Y_axis_chem_shift_offset -0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 HIS 1.58 3.83 0 15 GLU -0.48 -0.08 1 16 LEU -4.65 -2.67 1 17 LEU 2.82 1.41 1 18 ASN 5.39 2.54 1 20 ASN -5.66 -1.06 1 21 VAL -1.27 -1.41 1 22 LYS 1.50 2.45 1 23 GLU -3.74 -1.76 1 24 LYS 1.13 0.64 1 25 THR -0.60 0.10 1 26 LYS -2.65 -1.30 1 27 GLU 0.93 1.48 1 28 GLU -4.53 -1.34 1 29 TYR -4.29 -0.92 1 32 SER 3.53 3.20 1 33 GLU 1.39 2.93 1 34 VAL -4.72 -2.04 1 35 VAL -2.93 -0.57 1 36 GLU -4.96 -1.87 1 37 TYR -5.66 -0.54 1 38 TYR -3.77 -1.37 1 40 ASN 3.68 1.01 1 42 ARG 5.62 3.04 1 43 PHE -3.36 -0.91 1 44 LEU -4.74 -1.88 1 45 MET -0.90 1.00 1 46 LYS -1.38 -0.60 1 49 ASN 1.76 1.02 1 50 LYS -4.78 -2.01 1 51 ILE -3.37 -1.63 1 52 GLN -5.92 -2.08 1 54 VAL -0.71 -1.07 1 55 ASP 1.58 0.60 1 57 GLU -6.02 -2.73 1 58 TRP -2.22 -0.70 1 59 THR 0.54 0.93 1 60 THR 2.01 2.44 1 61 LEU -0.14 1.15 1 63 VAL -4.52 -1.81 1 65 ILE -3.41 -1.76 1 66 VAL 2.24 1.42 1 67 GLU -0.96 -0.33 1 68 GLU -0.81 -0.21 1 69 SER 0.57 0.51 1 70 THR -4.95 -2.43 1 73 ASP 0.37 0.85 1 74 ILE 1.00 0.60 1 76 GLU -1.40 -0.34 1 77 LEU -4.23 -2.56 1 78 GLU 2.20 1.29 1 79 HIS 4.75 1.16 1 81 TRP -2.37 -0.98 1 82 ALA -3.40 -1.74 1 83 GLN 0.43 -0.11 1 84 LEU 1.36 1.26 1 85 SER -1.58 -0.55 1 86 SER -2.11 -0.77 1 89 TYR -2.99 -1.66 1 90 TYR -3.03 -1.08 1 91 TYR 2.15 1.18 1 93 ASP 1.50 1.65 1 94 SER -4.99 -1.48 1 95 VAL -3.37 -0.80 1 96 GLU -3.99 -1.46 1 97 PHE -4.44 -0.59 1 98 ASN -4.99 -1.58 1 100 SER 1.04 1.36 1 101 GLU 2.30 2.20 1 102 SER 3.36 2.72 1 103 PHE -2.63 -0.54 1 104 THR -2.28 -1.01 1 105 MET -1.11 0.90 1 106 ILE -0.65 -0.72 1 108 HIS -0.24 1.85 1 109 ARG 1.78 1.79 1 110 SER -5.16 -2.58 1 111 ILE -3.10 -1.41 1 112 THR -2.26 -0.48 1 114 ILE -1.49 -1.85 1 115 HIS 3.17 2.08 1 117 VAL -4.21 -1.96 1 118 TRP -2.15 -0.67 1 119 THR 0.95 1.05 1 120 GLN 0.78 1.28 1 121 LEU 0.14 1.30 1 123 GLN -4.99 -1.18 1 125 VAL -4.30 -2.12 1 126 ALA 0.91 0.22 1 127 ILE 2.05 2.42 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18599_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.02 _LACS_plot.Line_1_terminator_val_y_1 3.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.74 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 -2.53 _LACS_plot.Y_axis_chem_shift_offset -0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 HIS 1.58 2.25 0 15 GLU -0.48 0.40 1 16 LEU -4.65 1.98 1 17 LEU 2.82 -1.41 1 18 ASN 5.39 -2.85 1 20 ASN -5.66 4.60 1 21 VAL -1.27 -0.14 1 22 LYS 1.50 0.95 1 23 GLU -3.74 1.98 1 24 LYS 1.13 -0.49 1 25 THR -0.60 0.70 1 26 LYS -2.65 1.35 1 27 GLU 0.93 0.55 1 28 GLU -4.53 3.19 1 29 TYR -4.29 3.37 1 32 SER 3.53 -0.33 1 33 GLU 1.39 1.54 1 34 VAL -4.72 2.68 1 35 VAL -2.93 2.36 1 36 GLU -4.96 3.09 1 37 TYR -5.66 5.12 1 38 TYR -3.77 2.40 1 40 ASN 3.68 -2.67 1 42 ARG 5.62 -2.58 1 43 PHE -3.36 2.45 1 44 LEU -4.74 2.86 1 45 MET -0.90 1.90 1 46 LYS -1.38 0.78 1 49 ASN 1.76 -0.74 1 50 LYS -4.78 2.77 1 51 ILE -3.37 1.74 1 52 GLN -5.92 3.84 1 54 VAL -0.71 -0.36 1 55 ASP 1.58 -0.98 1 57 GLU -6.02 3.29 1 58 TRP -2.22 1.52 1 59 THR 0.54 0.39 1 60 THR 2.01 0.43 1 61 LEU -0.14 1.29 1 63 VAL -4.52 2.71 1 65 ILE -3.41 1.65 1 66 VAL 2.24 -0.82 1 67 GLU -0.96 0.63 1 68 GLU -0.81 0.60 1 69 SER 0.57 -0.06 1 70 THR -4.95 2.52 1 73 ASP 0.37 0.48 1 74 ILE 1.00 -0.40 1 76 GLU -1.40 1.06 1 77 LEU -4.23 1.67 1 78 GLU 2.20 -0.91 1 79 HIS 4.75 -3.59 1 81 TRP -2.37 1.39 1 82 ALA -3.40 1.66 1 83 GLN 0.43 -0.54 1 84 LEU 1.36 -0.10 1 85 SER -1.58 1.03 1 86 SER -2.11 1.34 1 89 TYR -2.99 1.33 1 90 TYR -3.03 1.95 1 91 TYR 2.15 -0.97 1 93 ASP 1.50 0.15 1 94 SER -4.99 3.51 1 95 VAL -3.37 2.57 1 96 GLU -3.99 2.53 1 97 PHE -4.44 3.85 1 98 ASN -4.99 3.41 1 100 SER 1.04 0.32 1 101 GLU 2.30 -0.10 1 102 SER 3.36 -0.64 1 103 PHE -2.63 2.09 1 104 THR -2.28 1.27 1 105 MET -1.11 2.01 1 106 ILE -0.65 -0.07 1 108 HIS -0.24 2.09 1 109 ARG 1.78 0.01 1 110 SER -5.16 2.58 1 111 ILE -3.10 1.69 1 112 THR -2.26 1.78 1 114 ILE -1.49 -0.36 1 115 HIS 3.17 -1.09 1 117 VAL -4.21 2.25 1 118 TRP -2.15 1.48 1 119 THR 0.95 0.10 1 120 GLN 0.78 0.50 1 121 LEU 0.14 1.16 1 123 GLN -4.99 3.81 1 125 VAL -4.30 2.18 1 126 ALA 0.91 -0.69 1 127 ILE 2.05 0.37 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18599_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.02 _LACS_plot.Line_1_terminator_val_y_1 0.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.34 _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 5.61 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 SER -4.99 1.60 0 15 GLU -0.48 -0.26 1 16 LEU -4.65 -0.10 1 17 LEU 2.82 -0.42 1 18 ASN 5.39 -1.07 1 20 ASN -5.66 0.18 1 21 VAL -1.27 -0.11 1 22 LYS 1.50 -0.18 1 23 GLU -3.74 0.12 1 24 LYS 1.13 -0.07 1 25 THR -0.60 -0.06 1 26 LYS -2.65 0.29 1 27 GLU 0.93 -0.12 1 28 GLU -4.53 0.50 1 29 TYR -4.29 -0.11 1 31 HIS 1.58 -0.69 1 32 SER 3.53 -0.66 1 33 GLU 1.39 0.00 1 34 VAL -4.72 1.34 1 35 VAL -2.93 0.05 1 36 GLU -4.96 0.83 1 37 TYR -5.66 0.61 1 38 TYR -3.77 0.27 1 40 ASN 3.68 -0.21 1 42 ARG 5.62 -0.56 1 43 PHE -3.36 0.36 1 44 LEU -4.74 0.25 1 45 MET -0.90 0.33 1 46 LYS -1.38 0.29 1 49 ASN 1.76 -0.20 1 50 LYS -4.78 1.17 1 51 ILE -3.37 0.34 1 52 GLN -5.92 1.20 1 54 VAL -0.71 0.19 1 55 ASP 1.58 -0.28 1 57 GLU -6.02 0.25 1 58 TRP -2.22 0.54 1 59 THR 0.54 0.08 1 60 THR 2.01 -0.52 1 61 LEU -0.14 -0.66 1 63 VAL -4.52 0.12 1 65 ILE -3.41 0.56 1 66 VAL 2.24 -0.71 1 67 GLU -0.96 -0.15 1 68 GLU -0.81 0.00 1 69 SER 0.57 -0.18 1 70 THR -4.95 0.78 1 73 ASP 0.37 -0.13 1 74 ILE 1.00 -1.03 1 76 GLU -1.40 -0.26 1 77 LEU -4.23 -0.10 1 78 GLU 2.20 -0.58 1 79 HIS 4.75 -0.80 1 81 TRP -2.37 0.38 1 82 ALA -3.40 -0.19 1 83 GLN 0.43 -0.13 1 84 LEU 1.36 -0.16 1 85 SER -1.58 0.21 1 86 SER -2.11 0.22 1 89 TYR -2.99 0.34 1 90 TYR -3.03 0.20 1 91 TYR 2.15 -0.60 1 93 ASP 1.50 0.19 1 95 VAL -3.37 0.02 1 96 GLU -3.99 0.40 1 97 PHE -4.44 0.30 1 98 ASN -4.99 -0.21 1 100 SER 1.04 0.15 1 101 GLU 2.30 -0.13 1 102 SER 3.36 -0.50 1 103 PHE -2.63 0.25 1 104 THR -2.28 0.25 1 105 MET -1.11 0.54 1 106 ILE -0.65 0.16 1 108 HIS -0.24 -0.23 1 109 ARG 1.78 -0.04 1 110 SER -5.16 1.28 1 111 ILE -3.10 0.39 1 112 THR -2.26 1.07 1 114 ILE -1.49 -0.35 1 115 HIS 3.17 -0.68 1 117 VAL -4.21 0.08 1 118 TRP -2.15 0.46 1 119 THR 0.95 -0.03 1 120 GLN 0.78 -0.34 1 121 LEU 0.14 -0.77 1 123 GLN -4.99 0.16 1 125 VAL -4.30 0.60 1 126 ALA 0.91 -0.48 1 127 ILE 2.05 -0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18599_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.02 _LACS_plot.Line_1_terminator_val_y_1 -1.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 5.61 _LACS_plot.Line_2_terminator_val_y_2 -0.26 _LACS_plot.Y_axis_chem_shift_offset 0.84 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 ASN 5.39 -2.96 0 31 HIS 1.58 3.53 0 15 GLU -0.48 -1.84 1 16 LEU -4.65 -2.03 1 17 LEU 2.82 0.27 1 20 ASN -5.66 -2.27 1 21 VAL -1.27 0.43 1 22 LYS 1.50 -0.17 1 23 GLU -3.74 -1.38 1 24 LYS 1.13 0.96 1 25 THR -0.60 -0.10 1 26 LYS -2.65 -0.59 1 27 GLU 0.93 -0.80 1 28 GLU -4.53 -2.68 1 29 TYR -4.29 -1.35 1 32 SER 3.53 -0.17 1 33 GLU 1.39 -1.44 1 34 VAL -4.72 -0.18 1 35 VAL -2.93 -2.89 1 36 GLU -4.96 -1.62 1 37 TYR -5.66 -0.56 1 38 TYR -3.77 -2.07 1 40 ASN 3.68 -1.81 1 42 ARG 5.62 -1.68 1 43 PHE -3.36 -1.72 1 44 LEU -4.74 -2.23 1 45 MET -0.90 -0.54 1 46 LYS -1.38 -1.02 1 49 ASN 1.76 -1.45 1 50 LYS -4.78 -0.26 1 51 ILE -3.37 -3.09 1 52 GLN -5.92 -1.80 1 54 VAL -0.71 -0.56 1 55 ASP 1.58 0.00 1 57 GLU -6.02 -1.51 1 58 TRP -2.22 2.58 1 59 THR 0.54 -1.75 1 60 THR 2.01 -0.86 1 61 LEU -0.14 0.39 1 63 VAL -4.52 -1.87 1 65 ILE -3.41 -0.93 1 66 VAL 2.24 -0.84 1 67 GLU -0.96 -0.63 1 68 GLU -0.81 -0.29 1 69 SER 0.57 -0.36 1 70 THR -4.95 0.61 1 73 ASP 0.37 0.21 1 74 ILE 1.00 -0.49 1 76 GLU -1.40 -1.54 1 77 LEU -4.23 -2.02 1 78 GLU 2.20 0.72 1 79 HIS 4.75 -1.32 1 81 TRP -2.37 -2.92 1 82 ALA -3.40 0.31 1 83 GLN 0.43 -0.69 1 84 LEU 1.36 -1.08 1 85 SER -1.58 -1.17 1 86 SER -2.11 -2.70 1 89 TYR -2.99 -1.79 1 90 TYR -3.03 -0.15 1 91 TYR 2.15 1.48 1 93 ASP 1.50 -0.65 1 94 SER -4.99 -1.04 1 95 VAL -3.37 -2.59 1 96 GLU -3.99 -1.72 1 97 PHE -4.44 -1.15 1 98 ASN -4.99 -1.26 1 100 SER 1.04 -1.78 1 101 GLU 2.30 0.79 1 102 SER 3.36 -1.97 1 103 PHE -2.63 -1.44 1 104 THR -2.28 -2.48 1 105 MET -1.11 -0.11 1 106 ILE -0.65 -0.42 1 108 HIS -0.24 2.16 1 109 ARG 1.78 -2.21 1 110 SER -5.16 -0.23 1 111 ILE -3.10 -1.69 1 112 THR -2.26 -1.86 1 114 ILE -1.49 -1.16 1 115 HIS 3.17 1.15 1 117 VAL -4.21 -1.43 1 118 TRP -2.15 2.54 1 119 THR 0.95 -1.90 1 120 GLN 0.78 0.50 1 121 LEU 0.14 0.05 1 123 GLN -4.99 -1.37 1 125 VAL -4.30 -1.24 1 126 ALA 0.91 -0.73 1 stop_ save_