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 bmr18290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.04 _LACS_plot.Line_1_terminator_val_y_1 -3.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.30 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 5.45 _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 78 TRP -8.04 -1.57 0 35 ASP 1.59 -2.96 0 10 GLN -3.85 -2.27 1 11 ASP 2.37 1.73 1 12 LEU -0.10 0.83 1 13 GLU -2.33 -1.61 1 14 VAL 1.53 0.81 1 18 ALA -0.84 0.06 1 20 MET -2.18 -3.53 1 21 THR -4.22 -3.40 1 23 TRP -2.44 -1.54 1 25 ARG 3.38 -0.64 1 26 ASN -1.90 -1.66 1 28 PHE -3.72 -0.83 1 30 GLN -1.50 -0.08 1 31 THR -2.00 -1.81 1 32 ASP -4.07 -0.77 1 33 VAL 3.47 2.32 1 34 GLN 2.14 1.33 1 36 ARG 3.88 2.36 1 38 SER 3.40 0.53 1 40 THR -1.22 0.06 1 41 VAL -0.67 -0.51 1 43 ALA -7.44 -3.13 1 44 GLU -4.61 -1.92 1 45 MET -2.81 0.84 1 46 THR -5.76 -4.00 1 47 GLU 3.98 3.56 1 48 GLU 4.55 3.39 1 49 PHE 3.54 3.54 1 50 LEU 4.88 3.33 1 51 LEU 4.08 2.92 1 52 PHE 4.02 3.79 1 54 ARG 5.46 4.10 1 55 ASP 3.46 2.04 1 56 ARG 3.65 -0.07 1 58 ASN -1.43 -2.48 1 59 ASP 1.27 -0.15 1 60 LEU -1.46 -1.05 1 61 MET -0.32 2.40 1 62 THR 0.50 -0.23 1 64 ARG -3.48 -2.07 1 66 GLU 4.26 2.14 1 67 PHE -2.47 -2.40 1 68 ASN 2.74 1.00 1 69 PHE -4.11 -2.03 1 72 LEU -4.06 -1.67 1 73 LYS -5.87 -3.11 1 74 ALA 2.45 1.04 1 76 ASP 0.33 1.10 1 77 ARG -3.14 -1.07 1 80 LEU -4.68 -1.63 1 82 ALA 5.22 3.74 1 83 SER 4.35 2.32 1 84 ARG 2.09 0.87 1 85 TRP 8.17 6.80 1 86 GLN 5.27 2.91 1 87 GLU 1.25 2.14 1 88 ALA 3.34 1.73 1 89 PHE 4.78 2.92 1 90 GLU 3.11 2.20 1 91 ALA -2.36 -1.12 1 93 MET -2.88 -2.60 1 94 ALA 2.17 -0.20 1 97 VAL -4.21 -1.89 1 98 VAL 0.06 -1.89 1 99 LEU 4.49 3.96 1 100 GLN 4.41 1.92 1 101 SER -1.38 -0.81 1 102 THR 0.50 1.01 1 103 GLU 1.50 2.46 1 104 LYS 4.40 3.79 1 105 SER 4.25 3.26 1 106 ALA 4.10 3.12 1 107 LEU 3.02 0.20 1 108 ARG 2.72 1.74 1 109 TYR -2.23 0.84 1 110 VAL -6.17 -3.77 1 111 SER -2.63 -2.06 1 112 LEU 4.20 2.70 1 113 ALA 3.16 2.18 1 114 ASP 4.40 2.98 1 115 LEU 3.12 2.70 1 116 GLN 4.50 3.46 1 117 ALA 2.18 1.24 1 118 HIS -0.91 -0.01 1 119 ALA -1.25 -0.01 1 120 LEU -0.76 -0.28 1 122 VAL 0.57 0.16 1 123 LEU -0.24 -0.42 1 124 GLU -0.77 -0.36 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.04 _LACS_plot.Line_1_terminator_val_y_1 4.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.70 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 -2.71 _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 78 TRP -8.04 6.47 0 35 ASP 1.59 -4.55 0 10 GLN -3.85 1.58 1 11 ASP 2.37 -0.64 1 12 LEU -0.10 0.93 1 13 GLU -2.33 0.72 1 14 VAL 1.53 -0.72 1 18 ALA -0.84 0.90 1 20 MET -2.18 -1.35 1 21 THR -4.22 0.82 1 23 TRP -2.44 0.90 1 25 ARG 3.38 -4.02 1 26 ASN -1.90 0.24 1 28 PHE -3.72 2.89 1 30 GLN -1.50 1.42 1 31 THR -2.00 0.19 1 32 ASP -4.07 3.30 1 33 VAL 3.47 -1.15 1 34 GLN 2.14 -0.81 1 36 ARG 3.88 -1.52 1 38 SER 3.40 -2.87 1 40 THR -1.22 1.28 1 41 VAL -0.67 0.16 1 43 ALA -7.44 4.31 1 44 GLU -4.61 2.69 1 45 MET -2.81 3.65 1 46 THR -5.76 1.76 1 47 GLU 3.98 -0.42 1 48 GLU 4.55 -1.16 1 49 PHE 3.54 0.00 1 50 LEU 4.88 -1.55 1 51 LEU 4.08 -1.16 1 52 PHE 4.02 -0.23 1 54 ARG 5.46 -1.36 1 55 ASP 3.46 -1.42 1 56 ARG 3.65 -3.72 1 58 ASN -1.43 -1.05 1 59 ASP 1.27 -1.42 1 60 LEU -1.46 0.41 1 61 MET -0.32 2.72 1 62 THR 0.50 -0.73 1 64 ARG -3.48 1.41 1 66 GLU 4.26 -2.12 1 67 PHE -2.47 0.07 1 68 ASN 2.74 -1.74 1 69 PHE -4.11 2.08 1 72 LEU -4.06 2.39 1 73 LYS -5.87 2.76 1 74 ALA 2.45 -1.41 1 76 ASP 0.33 0.77 1 77 ARG -3.14 2.07 1 80 LEU -4.68 3.05 1 82 ALA 5.22 -1.48 1 83 SER 4.35 -2.03 1 84 ARG 2.09 -1.22 1 85 TRP 8.17 -1.37 1 86 GLN 5.27 -2.36 1 87 GLU 1.25 0.89 1 88 ALA 3.34 -1.61 1 89 PHE 4.78 -1.86 1 90 GLU 3.11 -0.91 1 91 ALA -2.36 1.24 1 93 MET -2.88 0.28 1 94 ALA 2.17 -2.37 1 97 VAL -4.21 2.32 1 98 VAL 0.06 -1.95 1 99 LEU 4.49 -0.53 1 100 GLN 4.41 -2.49 1 101 SER -1.38 0.57 1 102 THR 0.50 0.51 1 103 GLU 1.50 0.96 1 104 LYS 4.40 -0.61 1 105 SER 4.25 -0.99 1 106 ALA 4.10 -0.98 1 107 LEU 3.02 -2.82 1 108 ARG 2.72 -0.98 1 109 TYR -2.23 3.07 1 110 VAL -6.17 2.40 1 111 SER -2.63 0.57 1 112 LEU 4.20 -1.50 1 113 ALA 3.16 -0.98 1 114 ASP 4.40 -1.42 1 115 LEU 3.12 -0.42 1 116 GLN 4.50 -1.04 1 117 ALA 2.18 -0.94 1 118 HIS -0.91 0.90 1 119 ALA -1.25 1.24 1 120 LEU -0.76 0.48 1 122 VAL 0.57 -0.41 1 123 LEU -0.24 -0.18 1 124 GLU -0.77 0.41 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18290_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.04 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.12 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 VAL 1.53 -1.98 0 10 GLN -3.85 0.35 1 11 ASP 2.37 -0.13 1 12 LEU -0.10 -0.42 1 13 GLU -2.33 0.30 1 18 ALA -0.84 -0.02 1 20 MET -2.18 -0.33 1 21 THR -4.22 -0.26 1 25 ARG 3.38 -0.82 1 26 ASN -1.90 0.27 1 28 PHE -3.72 -0.01 1 30 GLN -1.50 -0.04 1 31 THR -2.00 0.31 1 32 ASP -4.07 0.08 1 33 VAL 3.47 -0.24 1 34 GLN 2.14 -0.19 1 36 ARG 3.88 -0.48 1 38 SER 3.40 -0.93 1 40 THR -1.22 0.17 1 41 VAL -0.67 0.06 1 43 ALA -7.44 1.16 1 44 GLU -4.61 0.44 1 45 MET -2.81 -0.04 1 46 THR -5.76 0.44 1 47 GLU 3.98 -0.27 1 48 GLU 4.55 -0.28 1 49 PHE 3.54 -0.25 1 50 LEU 4.88 -0.65 1 51 LEU 4.08 -0.36 1 52 PHE 4.02 -0.38 1 54 ARG 5.46 -0.88 1 55 ASP 3.46 -0.27 1 56 ARG 3.65 0.07 1 58 ASN -1.43 0.19 1 59 ASP 1.27 -0.41 1 60 LEU -1.46 0.14 1 62 THR 0.50 -0.08 1 64 ARG -3.48 0.38 1 66 GLU 4.26 -0.25 1 67 PHE -2.47 0.40 1 68 ASN 2.74 -0.37 1 69 PHE -4.11 0.55 1 72 LEU -4.06 0.28 1 73 LYS -5.87 0.11 1 74 ALA 2.45 -0.77 1 76 ASP 0.33 0.22 1 77 ARG -3.14 1.48 1 78 TRP -8.04 0.15 1 80 LEU -4.68 0.39 1 82 ALA 5.22 -0.37 1 83 SER 4.35 -0.28 1 84 ARG 2.09 0.03 1 85 TRP 8.17 -0.88 1 86 GLN 5.27 -0.27 1 87 GLU 1.25 -0.31 1 88 ALA 3.34 -0.94 1 89 PHE 4.78 -1.08 1 90 GLU 3.11 -0.70 1 91 ALA -2.36 0.03 1 93 MET -2.88 0.07 1 94 ALA 2.17 -1.22 1 97 VAL -4.21 0.72 1 98 VAL 0.06 0.29 1 99 LEU 4.49 -0.80 1 100 GLN 4.41 -0.18 1 101 SER -1.38 0.46 1 102 THR 0.50 0.37 1 103 GLU 1.50 -0.19 1 104 LYS 4.40 -0.62 1 105 SER 4.25 0.02 1 106 ALA 4.10 -0.22 1 107 LEU 3.02 0.63 1 108 ARG 2.72 -0.38 1 109 TYR -2.23 -0.07 1 110 VAL -6.17 0.43 1 111 SER -2.63 0.15 1 112 LEU 4.20 -0.57 1 113 ALA 3.16 -0.12 1 114 ASP 4.40 -0.09 1 115 LEU 3.12 -0.71 1 116 GLN 4.50 -0.54 1 117 ALA 2.18 -0.10 1 118 HIS -0.91 -0.11 1 119 ALA -1.25 0.51 1 120 LEU -0.76 -0.09 1 122 VAL 0.57 -0.09 1 123 LEU -0.24 0.02 1 124 GLU -0.77 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18290_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 -2.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.60 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 2.33 _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 89 PHE 4.78 3.92 0 69 PHE -4.11 1.26 0 84 ARG 2.09 3.74 0 85 TRP 8.17 1.15 0 43 ALA -7.44 -2.83 0 56 ARG 3.65 -2.09 0 10 GLN -3.85 -1.68 1 11 ASP 2.37 -0.57 1 12 LEU -0.10 -1.87 1 13 GLU -2.33 -0.99 1 14 VAL 1.53 -1.53 1 18 ALA -0.84 -2.99 1 20 MET -2.18 -1.69 1 26 ASN -1.90 1.23 1 28 PHE -3.72 0.22 1 30 GLN -1.50 0.07 1 31 THR -2.00 -3.06 1 32 ASP -4.07 0.24 1 33 VAL 3.47 0.72 1 34 GLN 2.14 0.25 1 35 ASP 1.59 0.29 1 38 SER 3.40 -0.23 1 41 VAL -0.67 -2.11 1 44 GLU -4.61 -1.72 1 45 MET -2.81 1.42 1 46 THR -5.76 -0.49 1 47 GLU 3.98 1.71 1 48 GLU 4.55 2.76 1 49 PHE 3.54 1.81 1 50 LEU 4.88 2.50 1 51 LEU 4.08 0.94 1 52 PHE 4.02 3.22 1 54 ARG 5.46 2.71 1 55 ASP 3.46 -0.10 1 58 ASN -1.43 -2.33 1 59 ASP 1.27 -0.12 1 60 LEU -1.46 -1.40 1 61 MET -0.32 0.84 1 62 THR 0.50 -2.13 1 68 ASN 2.74 -1.46 1 72 LEU -4.06 -1.99 1 73 LYS -5.87 -0.99 1 74 ALA 2.45 0.39 1 76 ASP 0.33 -0.39 1 77 ARG -3.14 -2.66 1 80 LEU -4.68 0.33 1 82 ALA 5.22 1.80 1 83 SER 4.35 3.12 1 86 GLN 5.27 1.49 1 87 GLU 1.25 2.06 1 88 ALA 3.34 1.21 1 90 GLU 3.11 0.18 1 91 ALA -2.36 -0.66 1 93 MET -2.88 -1.04 1 94 ALA 2.17 -0.55 1 97 VAL -4.21 -1.35 1 98 VAL 0.06 2.53 1 99 LEU 4.49 1.30 1 100 GLN 4.41 0.43 1 101 SER -1.38 -1.80 1 102 THR 0.50 -1.83 1 103 GLU 1.50 0.89 1 104 LYS 4.40 1.01 1 105 SER 4.25 1.47 1 106 ALA 4.10 2.19 1 107 LEU 3.02 0.12 1 108 ARG 2.72 0.48 1 109 TYR -2.23 -1.11 1 110 VAL -6.17 -2.68 1 111 SER -2.63 1.48 1 112 LEU 4.20 0.12 1 113 ALA 3.16 2.80 1 114 ASP 4.40 1.89 1 115 LEU 3.12 2.35 1 116 GLN 4.50 3.01 1 117 ALA 2.18 -0.08 1 118 HIS -0.91 -0.36 1 119 ALA -1.25 0.86 1 120 LEU -0.76 -0.26 1 122 VAL 0.57 -0.22 1 123 LEU -0.24 -0.70 1 124 GLU -0.77 -0.64 1 stop_ save_