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 bmr17066_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 -3.00 _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 -1.47 _LACS_plot.Line_2_terminator_val_x_2 6.29 _LACS_plot.Line_2_terminator_val_y_2 4.44 _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 124 ILE -6.76 -0.65 0 10 ALA -0.19 -0.20 1 12 GLN 0.62 0.59 1 13 ASN 0.75 0.52 1 14 THR 2.17 1.93 1 15 PHE 3.55 2.89 1 16 LEU 3.74 2.91 1 17 ASP 3.86 3.69 1 18 THR 5.58 4.34 1 19 ILE 4.40 2.53 1 20 ILE 5.93 5.48 1 21 ARG 3.83 3.05 1 22 LYS 3.16 2.44 1 23 PHE 2.66 1.90 1 24 GLU 1.52 1.67 1 26 GLN 0.80 0.56 1 27 SER 2.18 0.30 1 28 ARG -1.27 -0.39 1 29 LYS 0.48 0.08 1 30 PHE -4.48 -1.42 1 31 ILE -5.15 -2.61 1 32 ILE -2.58 -1.04 1 33 ALA -8.75 -2.81 1 34 ASN -0.26 -0.48 1 35 ALA -1.53 -0.21 1 36 ARG 1.47 0.28 1 37 VAL -2.41 -1.61 1 38 GLU 2.58 2.06 1 39 ASN 1.08 -0.14 1 41 ALA -1.98 -0.54 1 42 VAL 3.43 2.90 1 43 ILE -0.80 0.11 1 44 TYR -1.98 1.37 1 46 ASN -2.97 -2.44 1 47 ASP 5.72 3.75 1 49 PHE 5.67 5.25 1 51 GLU 1.86 1.67 1 52 LEU 3.22 2.47 1 55 TYR -0.85 -0.29 1 56 SER -3.01 -1.18 1 57 ARG 6.11 4.59 1 58 ALA 2.80 2.06 1 59 GLU -0.20 0.94 1 60 VAL 1.19 1.99 1 61 MET 2.05 0.86 1 62 GLN 4.25 1.91 1 63 ARG 1.44 0.29 1 66 THR 3.35 1.12 1 68 ASP 3.17 1.41 1 69 PHE 1.46 -1.09 1 70 LEU 0.30 -1.15 1 71 HIS -3.09 0.28 1 74 ARG 1.35 0.70 1 75 THR 4.17 2.60 1 76 GLN 1.71 0.70 1 77 ARG 4.78 2.93 1 78 ARG 4.40 3.09 1 79 ALA 2.76 2.09 1 80 ALA 4.12 2.45 1 81 ALA 3.58 2.20 1 82 GLN 3.51 3.49 1 83 ILE 6.30 5.18 1 84 ALA 4.49 2.82 1 85 GLN 3.24 2.24 1 86 ALA 3.15 1.88 1 87 LEU 2.37 0.31 1 88 LEU 0.18 -0.15 1 90 ALA -1.85 -1.53 1 91 GLU -5.78 -2.31 1 92 GLU -0.46 -0.65 1 93 ARG -5.84 -1.71 1 94 LYS -3.22 -1.29 1 95 VAL -4.58 -0.79 1 96 GLU -2.86 -1.40 1 97 ILE -4.75 -0.89 1 98 ALA -1.46 -1.87 1 99 PHE -2.83 -1.29 1 100 TYR -0.53 -0.39 1 101 ARG 4.85 3.46 1 102 LYS 0.99 -0.58 1 103 ASP 0.19 -0.03 1 105 SER -4.46 -2.72 1 107 PHE -1.73 -1.15 1 108 LEU -2.36 -1.48 1 110 LEU -2.08 -1.61 1 111 VAL -3.48 -1.58 1 112 ASP 1.15 0.38 1 113 VAL -2.30 -0.20 1 114 VAL -0.34 -0.21 1 116 VAL -4.54 -1.91 1 117 LYS -2.64 -2.80 1 118 ASN 4.04 3.00 1 119 GLU -0.17 0.09 1 120 ASP -1.66 -1.56 1 122 ALA 3.24 1.38 1 123 VAL -0.92 0.16 1 125 MET -4.51 -0.04 1 126 PHE -2.40 -1.19 1 127 ILE 0.20 0.80 1 128 LEU -5.04 -1.27 1 129 ASN -2.16 -0.09 1 130 PHE -5.04 -2.03 1 131 GLU 2.57 1.71 1 132 VAL 0.18 0.39 1 133 VAL -1.39 -0.45 1 134 MET -0.50 0.00 1 135 GLU 0.14 0.74 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17066_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 5.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.53 _LACS_plot.Line_2_terminator_val_x_2 6.29 _LACS_plot.Line_2_terminator_val_y_2 -1.85 _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 124 ILE -6.76 6.11 0 10 ALA -0.19 -0.01 1 12 GLN 0.62 -0.03 1 13 ASN 0.75 -0.23 1 14 THR 2.17 -0.24 1 15 PHE 3.55 -0.66 1 16 LEU 3.74 -0.83 1 17 ASP 3.86 -0.17 1 18 THR 5.58 -1.24 1 19 ILE 4.40 -1.87 1 20 ILE 5.93 -0.45 1 21 ARG 3.83 -0.78 1 22 LYS 3.16 -0.72 1 23 PHE 2.66 -0.76 1 24 GLU 1.52 0.15 1 26 GLN 0.80 -0.24 1 27 SER 2.18 -1.88 1 28 ARG -1.27 0.88 1 29 LYS 0.48 -0.40 1 30 PHE -4.48 3.06 1 31 ILE -5.15 2.54 1 32 ILE -2.58 1.54 1 33 ALA -8.75 5.94 1 34 ASN -0.26 -0.22 1 35 ALA -1.53 1.32 1 36 ARG 1.47 -1.19 1 37 VAL -2.41 0.80 1 38 GLU 2.58 -0.52 1 39 ASN 1.08 -1.22 1 41 ALA -1.98 1.44 1 42 VAL 3.43 -0.53 1 43 ILE -0.80 0.91 1 44 TYR -1.98 3.35 1 46 ASN -2.97 0.53 1 47 ASP 5.72 -1.97 1 49 PHE 5.67 -0.42 1 51 GLU 1.86 -0.19 1 52 LEU 3.22 -0.75 1 55 TYR -0.85 0.56 1 56 SER -3.01 1.83 1 57 ARG 6.11 -1.52 1 58 ALA 2.80 -0.74 1 59 GLU -0.20 1.14 1 60 VAL 1.19 0.80 1 61 MET 2.05 -1.19 1 62 GLN 4.25 -2.34 1 63 ARG 1.44 -1.15 1 66 THR 3.35 -2.23 1 68 ASP 3.17 -1.76 1 69 PHE 1.46 -2.55 1 70 LEU 0.30 -1.45 1 71 HIS -3.09 3.37 1 74 ARG 1.35 -0.65 1 75 THR 4.17 -1.57 1 76 GLN 1.71 -1.01 1 77 ARG 4.78 -1.85 1 78 ARG 4.40 -1.31 1 79 ALA 2.76 -0.67 1 80 ALA 4.12 -1.67 1 81 ALA 3.58 -1.38 1 82 GLN 3.51 -0.02 1 83 ILE 6.30 -1.12 1 84 ALA 4.49 -1.67 1 85 GLN 3.24 -1.00 1 86 ALA 3.15 -1.27 1 87 LEU 2.37 -2.06 1 88 LEU 0.18 -0.33 1 90 ALA -1.85 0.32 1 91 GLU -5.78 3.47 1 92 GLU -0.46 -0.19 1 93 ARG -5.84 4.13 1 94 LYS -3.22 1.93 1 95 VAL -4.58 3.79 1 96 GLU -2.86 1.46 1 97 ILE -4.75 3.86 1 98 ALA -1.46 -0.41 1 99 PHE -2.83 1.54 1 100 TYR -0.53 0.14 1 101 ARG 4.85 -1.39 1 102 LYS 0.99 -1.57 1 103 ASP 0.19 -0.22 1 105 SER -4.46 1.74 1 107 PHE -1.73 0.58 1 108 LEU -2.36 0.88 1 110 LEU -2.08 0.47 1 111 VAL -3.48 1.90 1 112 ASP 1.15 -0.77 1 113 VAL -2.30 2.10 1 114 VAL -0.34 0.13 1 116 VAL -4.54 2.63 1 117 LYS -2.64 -0.16 1 118 ASN 4.04 -1.04 1 119 GLU -0.17 0.26 1 120 ASP -1.66 0.10 1 122 ALA 3.24 -1.86 1 123 VAL -0.92 1.08 1 125 MET -4.51 4.47 1 126 PHE -2.40 1.21 1 127 ILE 0.20 0.60 1 128 LEU -5.04 3.77 1 129 ASN -2.16 2.07 1 130 PHE -5.04 3.01 1 131 GLU 2.57 -0.86 1 132 VAL 0.18 0.21 1 133 VAL -1.39 0.94 1 134 MET -0.50 0.50 1 135 GLU 0.14 0.60 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17066_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 0.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.21 _LACS_plot.Line_2_terminator_val_x_2 6.29 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 127 ILE 0.20 1.14 0 30 PHE -4.48 1.61 0 10 ALA -0.19 -0.09 1 12 GLN 0.62 -0.11 1 13 ASN 0.75 -0.03 1 14 THR 2.17 -0.16 1 15 PHE 3.55 -0.32 1 16 LEU 3.74 -0.60 1 17 ASP 3.86 -0.47 1 18 THR 5.58 -0.58 1 19 ILE 4.40 -0.59 1 20 ILE 5.93 -0.81 1 21 ARG 3.83 -0.36 1 22 LYS 3.16 -0.41 1 23 PHE 2.66 -0.52 1 24 GLU 1.52 0.19 1 26 GLN 0.80 0.00 1 27 SER 2.18 -0.10 1 28 ARG -1.27 0.23 1 29 LYS 0.48 0.80 1 31 ILE -5.15 0.70 1 32 ILE -2.58 1.01 1 33 ALA -8.75 0.99 1 34 ASN -0.26 -0.04 1 35 ALA -1.53 0.39 1 36 ARG 1.47 0.02 1 37 VAL -2.41 0.31 1 38 GLU 2.58 -0.35 1 39 ASN 1.08 -0.20 1 41 ALA -1.98 -0.28 1 42 VAL 3.43 -0.24 1 43 ILE -0.80 0.45 1 44 TYR -1.98 0.03 1 46 ASN -2.97 -0.31 1 47 ASP 5.72 -0.40 1 49 PHE 5.67 -0.78 1 51 GLU 1.86 -0.54 1 52 LEU 3.22 -0.48 1 55 TYR -0.85 -0.23 1 56 SER -3.01 -0.14 1 57 ARG 6.11 -0.73 1 58 ALA 2.80 -0.37 1 59 GLU -0.20 -0.40 1 60 VAL 1.19 -0.82 1 61 MET 2.05 -0.67 1 62 GLN 4.25 -0.53 1 63 ARG 1.44 -0.09 1 66 THR 3.35 -0.65 1 69 PHE 1.46 -0.26 1 70 LEU 0.30 0.16 1 71 HIS -3.09 0.50 1 74 ARG 1.35 -0.14 1 75 THR 4.17 -0.38 1 76 GLN 1.71 -0.11 1 77 ARG 4.78 -0.44 1 78 ARG 4.40 -0.29 1 79 ALA 2.76 -0.12 1 80 ALA 4.12 -0.52 1 81 ALA 3.58 -0.15 1 82 GLN 3.51 -0.36 1 83 ILE 6.30 -0.82 1 84 ALA 4.49 -0.57 1 85 GLN 3.24 -0.46 1 86 ALA 3.15 -0.29 1 87 LEU 2.37 -0.92 1 88 LEU 0.18 0.02 1 90 ALA -1.85 0.13 1 91 GLU -5.78 0.31 1 92 GLU -0.46 0.67 1 93 ARG -5.84 0.31 1 94 LYS -3.22 1.26 1 95 VAL -4.58 0.05 1 96 GLU -2.86 0.87 1 97 ILE -4.75 -0.01 1 98 ALA -1.46 0.32 1 99 PHE -2.83 0.74 1 100 TYR -0.53 0.45 1 101 ARG 4.85 -0.55 1 102 LYS 0.99 -0.37 1 103 ASP 0.19 -0.23 1 105 SER -4.46 0.34 1 107 PHE -1.73 0.07 1 108 LEU -2.36 0.55 1 110 LEU -2.08 0.46 1 111 VAL -3.48 0.60 1 112 ASP 1.15 0.16 1 113 VAL -2.30 0.13 1 114 VAL -0.34 -0.07 1 116 VAL -4.54 0.93 1 117 LYS -2.64 -0.08 1 118 ASN 4.04 -0.37 1 119 GLU -0.17 0.03 1 120 ASP -1.66 -0.02 1 122 ALA 3.24 -0.39 1 123 VAL -0.92 0.24 1 124 ILE -6.76 0.65 1 125 MET -4.51 0.51 1 126 PHE -2.40 0.59 1 128 LEU -5.04 0.79 1 129 ASN -2.16 0.42 1 130 PHE -5.04 0.51 1 131 GLU 2.57 0.14 1 132 VAL 0.18 -0.07 1 133 VAL -1.39 0.05 1 134 MET -0.50 -0.06 1 135 GLU 0.14 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17066_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 -3.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.00 _LACS_plot.Line_2_terminator_val_x_2 6.29 _LACS_plot.Line_2_terminator_val_y_2 1.83 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 ALA -8.75 -1.31 0 135 GLU 0.14 4.36 0 97 ILE -4.75 -6.09 0 10 ALA -0.19 -0.40 1 12 GLN 0.62 0.00 1 13 ASN 0.75 0.36 1 14 THR 2.17 1.14 1 15 PHE 3.55 1.76 1 16 LEU 3.74 -0.10 1 17 ASP 3.86 2.07 1 18 THR 5.58 1.46 1 19 ILE 4.40 1.08 1 20 ILE 5.93 1.66 1 21 ARG 3.83 2.72 1 22 LYS 3.16 1.34 1 23 PHE 2.66 0.95 1 24 GLU 1.52 1.77 1 26 GLN 0.80 -0.22 1 27 SER 2.18 -0.04 1 28 ARG -1.27 0.81 1 29 LYS 0.48 -3.05 1 30 PHE -4.48 -4.11 1 31 ILE -5.15 -2.22 1 32 ILE -2.58 -2.18 1 34 ASN -0.26 -1.27 1 35 ALA -1.53 -0.26 1 36 ARG 1.47 -0.10 1 37 VAL -2.41 0.51 1 38 GLU 2.58 -0.11 1 39 ASN 1.08 -0.76 1 41 ALA -1.98 -0.10 1 42 VAL 3.43 0.86 1 43 ILE -0.80 -1.07 1 44 TYR -1.98 -3.16 1 46 ASN -2.97 -1.14 1 47 ASP 5.72 2.90 1 49 PHE 5.67 0.77 1 51 GLU 1.86 1.49 1 52 LEU 3.22 -1.50 1 55 TYR -0.85 -1.88 1 56 SER -3.01 0.65 1 57 ARG 6.11 1.67 1 58 ALA 2.80 1.82 1 59 GLU -0.20 -0.88 1 60 VAL 1.19 -0.60 1 61 MET 2.05 0.59 1 62 GLN 4.25 -0.89 1 63 ARG 1.44 -0.72 1 66 THR 3.35 0.05 1 68 ASP 3.17 0.89 1 69 PHE 1.46 -0.37 1 70 LEU 0.30 -0.91 1 71 HIS -3.09 2.20 1 74 ARG 1.35 0.23 1 75 THR 4.17 -0.24 1 76 GLN 1.71 0.91 1 78 ARG 4.40 1.70 1 79 ALA 2.76 1.12 1 80 ALA 4.12 3.28 1 81 ALA 3.58 2.17 1 82 GLN 3.51 3.63 1 83 ILE 6.30 -0.14 1 84 ALA 4.49 2.86 1 85 GLN 3.24 3.18 1 86 ALA 3.15 1.95 1 87 LEU 2.37 -0.32 1 88 LEU 0.18 0.61 1 90 ALA -1.85 -2.08 1 91 GLU -5.78 -1.53 1 92 GLU -0.46 0.05 1 93 ARG -5.84 -2.97 1 94 LYS -3.22 -0.22 1 95 VAL -4.58 -2.75 1 96 GLU -2.86 -1.31 1 98 ALA -1.46 -3.24 1 99 PHE -2.83 1.62 1 100 TYR -0.53 1.99 1 101 ARG 4.85 0.84 1 102 LYS 0.99 0.92 1 103 ASP 0.19 -2.47 1 105 SER -4.46 -4.23 1 107 PHE -1.73 -2.11 1 108 LEU -2.36 -1.60 1 110 LEU -2.08 -1.70 1 111 VAL -3.48 -1.60 1 112 ASP 1.15 -1.41 1 113 VAL -0.34 -1.49 1 116 VAL -4.54 0.31 1 117 LYS -2.64 2.36 1 118 ASN 4.04 0.27 1 119 GLU -0.17 0.21 1 120 ASP -1.66 -0.75 1 122 ALA 3.24 -0.02 1 123 VAL -0.92 0.03 1 124 ILE -6.76 -3.80 1 125 MET -4.51 -1.26 1 126 PHE -2.40 -1.29 1 127 ILE 0.20 -3.26 1 128 LEU -5.04 -1.06 1 129 ASN -2.16 -0.53 1 130 PHE -5.04 -1.61 1 131 GLU 2.57 -0.14 1 132 VAL 0.18 -0.74 1 133 VAL -1.39 -1.05 1 134 MET -0.50 -1.21 1 stop_ save_