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 bmr16476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 -3.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 5.02 _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 50 GLU -7.29 -1.54 0 26 ALA -8.29 -2.24 0 10 MET 2.10 1.96 1 11 PHE 5.15 4.14 1 12 VAL 6.81 5.15 1 13 SER 4.79 3.47 1 14 ALA 3.77 2.31 1 15 LEU 3.74 2.69 1 16 ILE 5.87 4.77 1 17 ARG 4.82 3.92 1 18 ARG 4.18 3.61 1 19 VAL 6.95 4.47 1 20 PHE 5.34 4.29 1 21 ALA 3.57 2.22 1 22 ALA -0.32 -0.87 1 25 PHE -4.49 -1.27 1 27 ALA -4.82 -0.95 1 28 VAL 2.90 1.95 1 29 GLU 0.47 1.09 1 30 LYS -3.87 -0.83 1 31 LYS 0.60 -0.11 1 33 ALA 0.25 0.17 1 34 GLU 4.56 4.61 1 35 ALA 3.53 2.62 1 36 ALA -1.66 -1.31 1 38 ALA -0.79 0.18 1 39 ILE -1.14 0.33 1 40 PHE -3.51 -1.32 1 41 VAL -4.13 -1.91 1 42 ARG -4.46 -1.93 1 43 GLN -5.22 -2.92 1 44 ARG -0.01 0.32 1 45 LEU -0.94 -1.13 1 46 ARG 3.98 2.77 1 47 ASP 0.17 -0.94 1 49 ARG -0.42 -0.09 1 51 ASN -5.66 -2.74 1 52 LEU -6.11 -2.21 1 53 TYR -3.25 -1.97 1 56 ALA -0.99 -0.99 1 58 GLN -0.60 -0.07 1 59 SER -0.58 -0.63 1 60 PHE -0.00 -0.08 1 61 ALA -0.37 -0.03 1 62 ASP 0.05 0.16 1 63 ASP 0.81 0.51 1 64 GLU 0.49 0.70 1 65 ASP 0.65 0.45 1 66 ILE 2.22 1.65 1 67 MET 1.61 0.54 1 68 ARG 0.17 0.03 1 69 ALA -1.51 -0.59 1 70 GLU -1.54 -0.67 1 71 ARG 0.97 0.96 1 72 ARG -4.35 -1.70 1 73 PHE -4.17 -0.34 1 74 GLU -7.12 -3.62 1 75 THR 4.66 2.50 1 76 ARG -0.17 -0.14 1 77 LEU -5.79 -0.88 1 78 ALA -4.15 -2.18 1 80 VAL -4.24 -2.91 1 81 GLU -1.61 -0.97 1 83 GLU 3.70 2.80 1 84 GLU 3.04 2.61 1 85 ILE 4.92 2.96 1 86 ALA 3.77 2.60 1 87 ALA 3.42 2.27 1 88 LEU 3.98 3.19 1 89 LEU 3.30 2.38 1 90 GLU 3.95 2.91 1 91 ARG 4.72 3.54 1 92 GLU 3.89 2.06 1 93 ARG 2.32 1.74 1 94 ARG 3.79 2.46 1 95 PHE 0.39 0.51 1 96 ASP -1.63 -1.10 1 97 SER 2.14 1.75 1 98 ASP -0.99 0.18 1 99 LEU 0.72 0.59 1 100 TRP -4.06 -1.87 1 101 VAL -1.48 -0.20 1 102 VAL -2.96 -1.21 1 103 GLU -4.38 -2.44 1 104 ILE -5.26 -1.87 1 105 GLU -2.50 -1.24 1 106 THR 1.17 -1.03 1 107 ASP 1.21 1.57 1 108 GLU -3.09 -2.04 1 109 ILE -1.10 -0.95 1 111 THR 0.63 -0.51 1 112 LEU 0.65 1.56 1 113 LEU -5.21 -2.72 1 114 THR 2.59 1.04 1 115 LEU -3.07 -2.15 1 116 VAL 0.13 -0.64 1 117 ASP -0.64 -0.61 1 118 GLN -0.58 -0.24 1 120 GLN -0.30 -0.17 1 121 ALA 0.19 1.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 4.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.61 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _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 50 GLU -7.29 5.75 0 26 ALA -8.29 6.05 0 10 MET 2.10 -0.14 1 11 PHE 5.15 -1.01 1 12 VAL 6.81 -1.66 1 13 SER 4.79 -1.32 1 14 ALA 3.77 -1.46 1 15 LEU 3.74 -1.05 1 16 ILE 5.87 -1.10 1 17 ARG 4.82 -0.90 1 18 ARG 4.18 -0.57 1 19 VAL 6.95 -2.48 1 20 PHE 5.34 -1.05 1 21 ALA 3.57 -1.35 1 22 ALA -0.32 -0.55 1 25 PHE -4.49 3.22 1 27 ALA -4.82 3.87 1 28 VAL 2.90 -0.95 1 29 GLU 0.47 0.62 1 30 LYS -3.87 3.04 1 31 LYS 0.60 -0.71 1 33 ALA 0.25 -0.08 1 34 GLU 4.56 0.05 1 35 ALA 3.53 -0.91 1 36 ALA -1.66 0.35 1 38 ALA -0.79 0.97 1 39 ILE -1.14 1.47 1 40 PHE -3.51 2.19 1 41 VAL -4.13 2.22 1 42 ARG -4.46 2.53 1 43 GLN -5.22 2.30 1 44 ARG -0.01 0.33 1 45 LEU -0.94 -0.19 1 46 ARG 3.98 -1.21 1 47 ASP 0.17 -1.11 1 49 ARG -0.42 0.33 1 51 ASN -5.66 2.92 1 52 LEU -6.11 3.90 1 53 TYR -3.25 1.28 1 56 ALA -0.99 0.00 1 58 GLN -0.60 0.53 1 59 SER -0.58 -0.05 1 60 PHE -0.00 -0.08 1 61 ALA -0.37 0.34 1 62 ASP 0.05 0.11 1 63 ASP 0.81 -0.30 1 64 GLU 0.49 0.21 1 65 ASP 0.65 -0.20 1 66 ILE 2.22 -0.57 1 67 MET 1.61 -1.07 1 68 ARG 0.17 -0.14 1 69 ALA -1.51 0.92 1 70 GLU -1.54 0.87 1 71 ARG 0.97 -0.01 1 72 ARG -4.35 2.65 1 73 PHE -4.17 3.83 1 74 GLU -7.12 3.50 1 75 THR 4.66 -2.16 1 76 ARG -0.17 0.03 1 77 LEU -5.79 4.91 1 78 ALA -4.15 1.97 1 80 VAL -4.24 1.33 1 81 GLU -1.61 0.64 1 83 GLU 3.70 -0.90 1 84 GLU 3.04 -0.43 1 85 ILE 4.92 -1.96 1 86 ALA 3.77 -1.17 1 87 ALA 3.42 -1.15 1 88 LEU 3.98 -0.79 1 89 LEU 3.30 -0.92 1 90 GLU 3.95 -1.04 1 91 ARG 4.72 -1.18 1 92 GLU 3.89 -1.83 1 93 ARG 2.32 -0.58 1 94 ARG 3.79 -1.33 1 95 PHE 0.39 0.12 1 96 ASP -1.63 0.53 1 97 SER 2.14 -0.39 1 98 ASP -0.99 1.17 1 99 LEU 0.72 -0.13 1 100 TRP -4.06 2.19 1 101 VAL -1.48 1.28 1 102 VAL -2.96 1.75 1 103 GLU -4.38 1.94 1 104 ILE -5.26 3.39 1 105 GLU -2.50 1.26 1 106 THR 1.17 -2.20 1 107 ASP 1.21 0.36 1 108 GLU -3.09 1.05 1 109 ILE -1.10 0.15 1 111 THR 0.63 -1.14 1 112 LEU 0.65 0.91 1 113 LEU -5.21 2.49 1 114 THR 2.59 -1.55 1 115 LEU -3.07 0.92 1 116 VAL 0.13 -0.77 1 117 ASP -0.64 0.03 1 118 GLN -0.58 0.34 1 120 GLN -0.30 0.13 1 121 ALA 0.19 0.99 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 -0.84 _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 25 PHE -4.49 -0.84 0 10 MET 2.10 -0.28 1 11 PHE 5.15 -0.90 1 12 VAL 6.81 -1.10 1 13 SER 4.79 -0.57 1 14 ALA 3.77 -0.46 1 15 LEU 3.74 -0.70 1 16 ILE 5.87 -1.11 1 17 ARG 4.82 -0.36 1 18 ARG 4.18 -0.47 1 19 VAL 6.95 -0.82 1 20 PHE 5.34 -0.40 1 21 ALA 3.57 -0.22 1 22 ALA -0.32 0.04 1 26 ALA -8.29 0.62 1 27 ALA -4.82 0.01 1 28 VAL 2.90 -0.15 1 29 GLU 0.47 -0.07 1 30 LYS -3.87 0.03 1 31 LYS 0.60 -1.05 1 33 ALA 0.25 -0.15 1 34 GLU 4.56 -0.22 1 35 ALA 3.53 0.06 1 36 ALA -1.66 0.29 1 38 ALA -0.79 -0.27 1 39 ILE -1.14 0.36 1 40 PHE -3.51 0.62 1 41 VAL -4.13 0.86 1 42 ARG -4.46 0.75 1 43 GLN -5.22 1.03 1 44 ARG -0.01 0.15 1 45 LEU -0.94 0.14 1 46 ARG 3.98 -0.41 1 47 ASP 0.17 -0.27 1 49 ARG -0.42 -0.03 1 50 GLU -7.29 1.03 1 51 ASN -5.66 0.41 1 52 LEU -6.11 0.93 1 53 TYR -3.25 0.97 1 56 ALA -0.99 -0.38 1 58 GLN -0.60 -0.26 1 59 SER -0.58 -0.22 1 60 PHE -0.00 -0.13 1 61 ALA -0.37 -0.15 1 62 ASP 0.05 -0.23 1 63 ASP 0.81 -0.29 1 64 GLU 0.49 -0.34 1 65 ASP 0.65 -0.27 1 66 ILE 2.22 -0.46 1 67 MET 1.61 -0.25 1 68 ARG 0.17 -0.14 1 69 ALA -1.51 -0.07 1 70 GLU -1.54 -0.12 1 71 ARG 0.97 -0.64 1 72 ARG -4.35 0.30 1 73 PHE -4.17 0.40 1 74 GLU -7.12 0.65 1 75 THR 4.66 -0.24 1 76 ARG -0.17 -0.06 1 77 LEU -5.79 0.14 1 78 ALA -4.15 0.68 1 80 VAL -4.24 0.52 1 81 GLU -1.61 0.10 1 83 GLU 3.70 -0.38 1 84 GLU 3.04 -0.35 1 85 ILE 4.92 -0.81 1 86 ALA 3.77 -0.53 1 87 ALA 3.42 -0.31 1 88 LEU 3.98 -0.30 1 89 LEU 3.30 -0.85 1 90 GLU 3.95 -0.62 1 91 ARG 4.72 -0.58 1 92 GLU 3.89 -0.33 1 93 ARG 2.32 -0.34 1 94 ARG 3.79 -0.55 1 95 PHE 0.39 -0.15 1 96 ASP -1.63 0.06 1 97 SER 2.14 -0.27 1 98 ASP -0.99 0.04 1 99 LEU 0.72 0.46 1 100 TRP -4.06 0.10 1 101 VAL -1.48 0.90 1 102 VAL -2.96 0.43 1 103 GLU -4.38 1.03 1 104 ILE -5.26 0.85 1 105 GLU -2.50 0.45 1 106 THR 1.17 0.07 1 107 ASP 1.21 -0.01 1 108 GLU -3.09 0.17 1 109 ILE -1.10 -0.32 1 111 THR 0.63 -0.10 1 112 LEU 0.65 -0.45 1 113 LEU -5.21 -0.01 1 114 THR 2.59 -0.27 1 115 LEU -3.07 0.65 1 116 VAL 0.13 0.02 1 117 ASP -0.64 -0.08 1 118 GLN -0.58 -0.11 1 120 GLN -0.30 -0.17 1 121 ALA 0.19 -0.34 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16476_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.29 _LACS_plot.Line_1_terminator_val_y_1 -3.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 2.34 _LACS_plot.Y_axis_chem_shift_offset 0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 96 ASP -1.63 3.17 0 20 PHE 5.34 5.17 0 88 LEU 3.98 -2.68 0 10 MET 2.10 1.87 1 11 PHE 5.15 1.80 1 12 VAL 6.81 0.37 1 13 SER 4.79 2.35 1 14 ALA 3.77 1.35 1 15 LEU 3.74 0.02 1 16 ILE 5.87 1.31 1 17 ARG 4.82 3.58 1 18 ARG 4.18 0.33 1 19 VAL 6.95 1.01 1 21 ALA 3.57 0.63 1 22 ALA -0.32 -0.14 1 25 PHE -4.49 -3.38 1 26 ALA -8.29 -3.96 1 27 ALA -4.82 -2.26 1 28 VAL 2.90 -0.75 1 29 GLU 0.47 -0.42 1 30 LYS -3.87 -2.37 1 31 LYS 0.60 -1.43 1 33 ALA 0.25 3.23 1 34 GLU 4.56 0.54 1 35 ALA 3.53 2.46 1 36 ALA -1.66 -0.33 1 39 ILE -1.14 -3.65 1 40 PHE -3.51 -0.24 1 41 VAL -4.13 -2.07 1 42 ARG -4.46 -3.10 1 43 GLN -5.22 -1.72 1 44 ARG -0.01 -0.88 1 45 LEU -0.94 2.29 1 46 ARG 3.98 0.81 1 47 ASP 0.17 0.82 1 49 ARG -0.42 -2.10 1 50 GLU -7.29 -1.01 1 51 ASN -5.66 -1.64 1 52 LEU -6.11 -3.39 1 53 TYR -3.25 -0.43 1 58 GLN -0.60 -0.63 1 59 SER -0.58 -0.53 1 60 PHE -0.00 -0.36 1 61 ALA -0.37 1.49 1 62 ASP 0.05 -0.23 1 63 ASP 0.81 0.32 1 64 GLU 0.49 0.05 1 65 ASP 0.65 1.16 1 66 ILE 2.22 0.40 1 67 MET 1.61 0.42 1 68 ARG 0.17 -0.77 1 69 ALA -1.51 -0.95 1 70 GLU -1.54 -0.27 1 71 ARG 0.97 -0.88 1 72 ARG -4.35 -1.25 1 73 PHE -4.17 -2.64 1 74 GLU -7.12 -1.04 1 75 THR 4.66 0.36 1 76 ARG -0.17 0.27 1 77 LEU -5.79 -3.09 1 78 ALA -4.15 -1.46 1 80 VAL -4.24 -1.09 1 81 GLU -1.61 2.36 1 83 GLU 3.70 2.45 1 84 GLU 3.04 3.08 1 85 ILE 4.92 0.91 1 86 ALA 3.77 2.54 1 87 ALA 3.42 2.47 1 89 LEU 3.30 1.25 1 90 GLU 3.95 2.14 1 91 ARG 4.72 2.62 1 92 GLU 3.89 3.65 1 93 ARG 2.32 1.29 1 94 ARG 3.79 1.69 1 95 PHE 0.39 -0.07 1 97 SER 2.14 0.95 1 98 ASP -0.99 -0.75 1 99 LEU 0.72 -1.38 1 100 TRP -4.06 0.64 1 101 VAL -1.48 -0.48 1 102 VAL -2.96 -2.91 1 103 GLU -4.38 -1.54 1 104 ILE -5.26 -2.67 1 105 GLU -2.50 -1.77 1 106 THR 1.17 -2.52 1 107 ASP 1.21 -0.09 1 108 GLU -3.09 -1.26 1 109 ILE -1.10 -0.08 1 111 THR 0.63 0.72 1 112 LEU 0.65 -1.88 1 113 LEU -5.21 -2.04 1 114 THR 2.59 -1.58 1 115 LEU -3.07 0.89 1 116 VAL 0.13 -0.66 1 117 ASP -0.64 -0.69 1 120 GLN -0.30 -1.25 1 stop_ save_