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 bmr36034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.65 _LACS_plot.Line_1_terminator_val_y_1 -1.35 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.46 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 4.82 _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 99 GLU -3.65 0.18 0 13 PHE 0.58 0.32 1 14 PHE -0.06 0.01 1 15 ASN -0.43 -0.06 1 16 GLU 0.10 0.38 1 22 GLU -0.50 -0.15 1 23 ALA -0.45 -0.03 1 24 ASP 0.02 0.08 1 25 VAL -0.18 -0.12 1 26 ASP -0.05 0.21 1 27 SER -0.15 0.07 1 28 ASP 0.02 0.23 1 31 ASP 0.29 0.27 1 32 ALA -0.22 -0.12 1 33 LYS 0.05 -0.14 1 35 TYR -0.11 -0.40 1 38 ASP 1.30 0.74 1 39 TRP 1.60 1.40 1 40 PHE 1.63 0.96 1 41 LYS 1.01 0.64 1 42 LYS 1.23 0.95 1 46 ARG 0.60 0.45 1 47 LYS 0.56 0.45 1 53 ASN 0.51 0.29 1 54 LYS 1.13 0.72 1 55 PHE 0.19 -0.16 1 56 LEU -0.02 0.01 1 57 LYS 0.24 0.21 1 60 ASN 0.18 0.13 1 61 TYR 0.30 0.22 1 62 ASP -0.40 -0.02 1 64 SER 0.79 0.80 1 65 ASP 0.35 0.41 1 66 GLU -0.36 0.16 1 67 GLU -0.56 -0.03 1 68 SER -0.12 0.05 1 69 ASP -0.05 0.25 1 70 GLU -0.36 0.12 1 71 GLU -0.03 0.32 1 72 ASP 0.73 0.74 1 74 LYS 0.65 0.37 1 75 LYS 0.45 0.25 1 76 VAL 0.26 0.13 1 77 VAL 0.16 0.04 1 78 LYS -1.27 0.15 1 79 SER -0.96 0.16 1 80 ALA 4.60 3.05 1 81 LYS 5.06 4.52 1 82 GLU 3.22 3.32 1 83 LYS 3.80 3.26 1 84 LEU 3.54 3.20 1 85 LEU 5.46 3.50 1 86 ASP 1.15 0.30 1 87 GLU 3.36 2.35 1 88 MET 3.41 2.29 1 89 GLN 3.93 3.23 1 90 ASP 3.24 3.63 1 91 VAL 5.66 4.22 1 92 TYR 4.78 4.75 1 93 ASN 4.08 3.15 1 94 LYS 4.40 4.04 1 95 ILE 5.49 4.31 1 96 SER 5.16 4.14 1 97 GLN -1.26 -0.57 1 98 ALA 3.01 1.53 1 100 ASN -3.30 -1.16 1 103 ASP 0.08 0.23 1 104 TRP 2.66 2.73 1 105 LEU 4.16 3.25 1 106 THR 6.07 4.95 1 107 ILE 5.56 4.85 1 108 SER 5.37 4.51 1 109 ASN 3.81 2.98 1 110 GLU 3.78 2.48 1 111 PHE 5.67 4.71 1 112 ASP 4.00 3.73 1 113 LEU 4.54 3.27 1 114 ILE 6.16 4.88 1 115 SER 5.60 4.28 1 116 ARG 4.13 3.29 1 117 LEU 2.61 2.35 1 118 LEU 4.00 3.09 1 119 VAL 5.50 4.11 1 120 ARG 3.65 2.60 1 121 ALA 3.52 1.87 1 122 GLN 2.28 1.79 1 123 GLN 1.76 0.97 1 124 GLN 1.23 0.73 1 125 ASN 0.19 0.27 1 126 TRP -0.12 -0.08 1 128 THR 0.42 1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.65 _LACS_plot.Line_1_terminator_val_y_1 2.30 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.54 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _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 99 GLU -3.65 3.83 0 13 PHE 0.58 -0.26 1 14 PHE -0.06 0.07 1 15 ASN -0.43 0.37 1 16 GLU 0.10 0.28 1 22 GLU -0.50 0.35 1 23 ALA -0.45 0.42 1 24 ASP 0.02 0.06 1 25 VAL -0.18 0.06 1 26 ASP -0.05 0.26 1 27 SER -0.15 0.22 1 28 ASP 0.02 0.21 1 31 ASP 0.29 -0.02 1 32 ALA -0.22 0.10 1 33 LYS 0.05 -0.19 1 35 TYR -0.11 -0.29 1 38 ASP 1.30 -0.56 1 39 TRP 1.60 -0.20 1 40 PHE 1.63 -0.67 1 41 LYS 1.01 -0.37 1 42 LYS 1.23 -0.28 1 46 ARG 0.60 -0.15 1 47 LYS 0.56 -0.11 1 53 ASN 0.51 -0.22 1 54 LYS 1.13 -0.41 1 55 PHE 0.19 -0.35 1 56 LEU -0.02 0.03 1 57 LYS 0.24 -0.03 1 60 ASN 0.18 -0.05 1 61 TYR 0.30 -0.08 1 62 ASP -0.40 0.38 1 64 SER 0.79 0.01 1 65 ASP 0.35 0.06 1 66 GLU -0.36 0.52 1 67 GLU -0.56 0.53 1 68 SER -0.12 0.17 1 69 ASP -0.05 0.30 1 70 GLU -0.36 0.48 1 71 GLU -0.03 0.35 1 72 ASP 0.73 0.01 1 74 LYS 0.65 -0.28 1 75 LYS 0.45 -0.20 1 76 VAL 0.26 -0.13 1 77 VAL 0.16 -0.12 1 78 LYS -1.27 1.42 1 79 SER -0.96 1.12 1 80 ALA 4.60 -1.55 1 81 LYS 5.06 -0.54 1 82 GLU 3.22 0.10 1 83 LYS 3.80 -0.54 1 84 LEU 3.54 -0.34 1 85 LEU 5.46 -1.96 1 86 ASP 1.15 -0.85 1 87 GLU 3.36 -1.01 1 88 MET 3.41 -1.12 1 89 GLN 3.93 -0.70 1 90 ASP 3.24 0.39 1 91 VAL 5.66 -1.44 1 92 TYR 4.78 -0.03 1 93 ASN 4.08 -0.93 1 94 LYS 4.40 -0.36 1 95 ILE 5.49 -1.18 1 96 SER 5.16 -1.02 1 97 GLN -1.26 0.69 1 98 ALA 3.01 -1.48 1 100 ASN -3.30 2.14 1 103 ASP 0.08 0.15 1 104 TRP 2.66 0.07 1 105 LEU 4.16 -0.91 1 106 THR 6.07 -1.12 1 107 ILE 5.56 -0.71 1 108 SER 5.37 -0.86 1 109 ASN 3.81 -0.83 1 110 GLU 3.78 -1.30 1 111 PHE 5.67 -0.96 1 112 ASP 4.00 -0.27 1 113 LEU 4.54 -1.27 1 114 ILE 6.16 -1.28 1 115 SER 5.60 -1.32 1 116 ARG 4.13 -0.84 1 117 LEU 2.61 -0.26 1 118 LEU 4.00 -0.91 1 119 VAL 5.50 -1.39 1 120 ARG 3.65 -1.05 1 121 ALA 3.52 -1.65 1 122 GLN 2.28 -0.49 1 123 GLN 1.76 -0.79 1 124 GLN 1.23 -0.50 1 125 ASN 0.19 0.08 1 126 TRP -0.12 0.04 1 128 THR 0.42 1.04 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.65 _LACS_plot.Line_1_terminator_val_y_1 0.19 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _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 122 GLN 2.28 -1.17 0 14 PHE -0.06 -0.11 1 15 ASN -0.43 -0.14 1 22 GLU -0.50 -0.08 1 23 ALA -0.45 -0.06 1 24 ASP 0.02 -0.05 1 25 VAL -0.18 0.00 1 26 ASP -0.05 -0.01 1 31 ASP 0.29 -0.05 1 32 ALA -0.22 -0.07 1 33 LYS 0.05 -0.15 1 35 TYR -0.11 -0.22 1 38 ASP 1.30 -0.14 1 39 TRP 1.60 -0.40 1 40 PHE 1.63 -0.42 1 41 LYS 1.01 -0.21 1 46 ARG 0.60 -0.14 1 47 LYS 0.56 -0.04 1 53 ASN 0.51 -0.12 1 55 PHE 0.19 -0.05 1 56 LEU -0.02 -0.08 1 60 ASN 0.18 -0.08 1 61 TYR 0.30 -0.05 1 65 ASP 0.35 -0.05 1 66 GLU -0.36 -0.10 1 69 ASP -0.05 -0.02 1 70 GLU -0.36 -0.10 1 71 GLU -0.03 -0.13 1 72 ASP 0.73 -0.13 1 75 LYS 0.45 -0.03 1 76 VAL 0.26 -0.08 1 77 VAL 0.16 -0.06 1 78 LYS -1.27 0.07 1 79 SER -0.96 -0.06 1 80 ALA 4.60 -0.40 1 81 LYS 5.06 -0.52 1 82 GLU 3.22 -0.52 1 83 LYS 3.80 -0.28 1 84 LEU 3.54 -0.33 1 85 LEU 5.46 -0.44 1 86 ASP 1.15 -0.14 1 87 GLU 3.36 -0.16 1 88 MET 3.41 -0.20 1 89 GLN 3.93 -0.42 1 90 ASP 3.24 -0.14 1 91 VAL 5.66 -0.40 1 92 TYR 4.78 -0.80 1 93 ASN 4.08 -0.36 1 94 LYS 4.40 -0.49 1 95 ILE 5.49 -1.08 1 96 SER 5.16 -0.63 1 97 GLN -1.26 -0.04 1 98 ALA 3.01 -0.58 1 99 GLU -3.65 0.36 1 100 ASN -3.30 0.39 1 103 ASP 0.08 -0.02 1 104 TRP 2.66 -0.29 1 105 LEU 4.16 -0.08 1 106 THR 6.07 -0.33 1 107 ILE 5.56 -0.65 1 108 SER 5.37 -0.36 1 109 ASN 3.81 -0.16 1 110 GLU 3.78 -0.16 1 111 PHE 5.67 -0.34 1 112 ASP 4.00 -0.14 1 113 LEU 4.54 -0.26 1 114 ILE 6.16 -0.75 1 115 SER 5.60 -0.42 1 116 ARG 4.13 -0.28 1 117 LEU 2.61 -0.36 1 118 LEU 4.00 -0.52 1 119 VAL 5.50 -0.58 1 120 ARG 3.65 -0.43 1 121 ALA 3.52 -0.86 1 123 GLN 1.76 -0.39 1 124 GLN 1.23 -0.26 1 125 ASN 0.19 -0.06 1 126 TRP -0.12 -0.03 1 128 THR 0.42 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.65 _LACS_plot.Line_1_terminator_val_y_1 -1.61 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -0.93 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 2.21 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 THR 0.42 4.63 0 13 PHE 0.58 -0.51 1 14 PHE -0.06 -0.91 1 15 ASN -0.43 -0.37 1 16 GLU 0.10 -0.10 1 22 GLU -0.50 -0.51 1 23 ALA -0.45 -0.47 1 24 ASP 0.02 -0.06 1 25 VAL -0.18 -0.45 1 26 ASP -0.05 -0.13 1 27 SER -0.15 -0.36 1 28 ASP 0.02 -0.27 1 31 ASP 0.29 -0.49 1 32 ALA -0.22 -0.48 1 33 LYS 0.05 -0.30 1 35 TYR -0.11 -0.09 1 38 ASP 1.30 0.43 1 39 TRP 1.60 0.60 1 40 PHE 1.63 0.10 1 41 LYS 1.01 0.20 1 42 LYS 1.23 0.35 1 46 ARG 0.60 -0.12 1 47 LYS 0.56 0.04 1 53 ASN 0.51 0.10 1 54 LYS 1.13 -0.44 1 55 PHE 0.19 -0.29 1 56 LEU -0.02 -0.72 1 57 LYS 0.24 -0.10 1 60 ASN 0.18 -0.46 1 61 TYR 0.30 -0.66 1 62 ASP -0.40 -0.39 1 64 SER 0.79 0.16 1 65 ASP 0.35 0.02 1 66 GLU -0.36 -0.07 1 67 GLU -0.56 -0.17 1 68 SER -0.12 -0.28 1 69 ASP -0.05 0.05 1 70 GLU -0.36 0.18 1 71 GLU -0.03 0.05 1 72 ASP 0.73 0.79 1 74 LYS 0.65 -0.01 1 75 LYS 0.45 -0.13 1 76 VAL 0.26 -0.37 1 77 VAL 0.16 -0.39 1 78 LYS -1.27 -0.26 1 79 SER -0.96 -0.23 1 80 ALA 4.60 2.20 1 81 LYS 5.06 0.55 1 83 LYS 3.80 1.46 1 85 LEU 5.46 1.29 1 87 GLU 3.36 2.53 1 88 MET 3.41 2.31 1 89 GLN 3.93 1.89 1 90 ASP 3.24 2.71 1 91 VAL 5.66 0.77 1 92 TYR 4.78 1.50 1 93 ASN 4.08 3.08 1 94 LYS 4.40 3.49 1 95 ILE 5.49 1.28 1 96 SER 5.16 1.40 1 97 GLN -1.26 -0.34 1 98 ALA 3.01 0.47 1 99 GLU -3.65 -1.04 1 100 ASN -3.30 0.49 1 103 ASP 0.08 3.31 1 104 TRP 2.66 2.07 1 105 LEU 4.16 1.69 1 106 THR 6.07 2.26 1 107 ILE 5.56 0.74 1 108 SER 5.37 2.59 1 109 ASN 3.81 1.05 1 110 GLU 3.78 2.38 1 111 PHE 5.67 2.34 1 112 ASP 4.00 2.38 1 113 LEU 4.54 2.02 1 114 ILE 6.16 0.68 1 115 SER 5.60 2.09 1 116 ARG 4.13 3.16 1 120 ARG 3.65 2.04 1 121 ALA 3.52 0.60 1 122 GLN 2.28 0.92 1 123 GLN 1.76 0.71 1 124 GLN 1.23 -0.47 1 125 ASN 0.19 -0.36 1 126 TRP -0.12 0.63 1 stop_ save_