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 bmr17491_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 5.71 _LACS_plot.Line_2_terminator_val_y_2 4.50 _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 46 ILE 0.77 -2.98 0 10 ARG 4.11 3.47 1 11 LEU 3.30 2.96 1 12 LEU 3.22 2.43 1 13 ALA -1.87 -1.14 1 14 SER 1.14 1.17 1 18 LYS 3.83 2.43 1 19 GLU 1.14 1.42 1 20 LEU 2.21 1.53 1 21 GLU 1.89 1.69 1 22 THR 0.05 -0.25 1 23 LEU -6.69 -2.30 1 24 ILE -5.20 -1.73 1 26 LEU -5.45 -1.96 1 27 PHE 1.26 -0.04 1 29 LEU -4.79 -2.14 1 30 SER -0.98 -0.47 1 31 ASP 2.18 1.22 1 32 LYS 0.76 -0.37 1 33 VAL 1.59 1.09 1 34 SER -4.03 -3.16 1 37 LEU 2.57 2.86 1 38 ILE 5.46 4.10 1 40 GLN 4.72 3.79 1 41 PHE 2.57 2.57 1 42 LEU 3.88 2.33 1 43 GLN 1.70 3.24 1 44 GLU 1.65 2.25 1 45 GLU 0.70 0.51 1 47 HIS 4.80 1.36 1 48 ILE -0.45 -0.34 1 49 ASN -1.39 0.40 1 50 GLU 3.96 3.27 1 51 LYS 3.05 1.63 1 52 ASP 0.95 1.78 1 53 ILE -0.92 0.17 1 54 ARG 1.81 1.76 1 55 LYS -3.72 -0.20 1 56 ILE -2.28 -0.27 1 57 LEU -5.42 -2.33 1 58 LEU 1.06 0.21 1 59 VAL -0.99 -2.83 1 61 ASP 2.95 2.04 1 62 PHE -1.74 -1.51 1 63 ASN 2.08 1.13 1 65 ALA -4.92 -1.05 1 66 ILE -3.85 -0.58 1 67 ILE -1.36 -1.27 1 68 ILE 0.22 -0.07 1 69 PHE -1.35 0.70 1 70 ARG 3.09 2.74 1 71 ASP -4.03 -0.89 1 72 SER 3.39 2.47 1 73 LYS 4.69 3.16 1 74 PHE 3.35 3.73 1 75 ALA 3.80 3.11 1 76 ALA 3.59 2.53 1 77 LYS 3.55 2.58 1 78 MET 0.91 0.39 1 79 LEU 4.42 4.35 1 80 MET 2.62 2.15 1 81 ILE 2.36 2.47 1 82 LEU 1.00 0.96 1 83 ASN 3.05 2.62 1 85 SER 0.46 1.02 1 86 GLN -2.08 -0.71 1 87 PHE -3.47 -1.42 1 88 GLN 4.19 0.85 1 90 LYS -4.82 -2.05 1 91 VAL 1.82 1.02 1 92 ILE -5.00 -1.79 1 93 ARG -3.79 -2.79 1 94 SER -7.26 -3.83 1 96 THR -2.85 -0.89 1 97 ILE 5.72 4.59 1 98 ASN 4.25 3.15 1 99 ASP 4.20 3.45 1 100 MET 3.63 3.08 1 101 LYS 4.48 3.95 1 102 ARG 4.13 3.58 1 103 TYR 3.24 4.07 1 104 TYR 3.46 3.84 1 105 ASN 2.75 2.50 1 106 ASN 1.92 1.66 1 107 GLN 1.87 1.10 1 108 GLN 1.35 0.74 1 113 LYS 3.47 0.62 1 114 HIS -0.71 1.34 1 115 VAL -0.04 -0.06 1 116 LYS -0.21 -0.01 1 118 SER 0.67 1.85 1 120 ILE 0.48 0.55 1 123 MET 0.58 0.32 1 124 GLU -0.34 0.11 1 125 LYS -0.16 0.04 1 128 ASN 0.46 0.16 1 129 LEU 0.23 0.24 1 130 GLN 0.21 0.17 1 131 VAL 0.32 0.22 1 132 LYS -0.07 -0.03 1 133 LYS -0.27 0.01 1 134 LYS 0.09 0.21 1 135 ILE -0.12 -0.09 1 137 ASP -0.03 0.42 1 138 LYS 0.52 0.43 1 139 GLN 0.70 0.71 1 140 GLU 0.04 0.46 1 141 GLN 0.37 0.40 1 144 ASN 1.54 1.36 1 145 ASP 1.37 1.47 1 146 ASP 1.88 1.61 1 147 PHE 2.47 2.04 1 148 ARG 2.67 1.98 1 149 LYS 1.86 1.57 1 150 MET 1.12 1.20 1 151 PHE -3.33 -4.37 1 152 LEU 0.44 0.28 1 154 GLU -0.28 0.20 1 155 LEU 0.43 0.45 1 156 GLU -1.32 -0.44 1 157 HIS 0.65 2.62 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17491_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 4.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _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 5.71 _LACS_plot.Line_2_terminator_val_y_2 -1.21 _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 46 ILE 0.77 -3.75 0 10 ARG 4.11 -0.64 1 11 LEU 3.30 -0.34 1 12 LEU 3.22 -0.79 1 13 ALA -1.87 0.73 1 14 SER 1.14 0.03 1 18 LYS 3.83 -1.40 1 19 GLU 1.14 0.28 1 20 LEU 2.21 -0.68 1 21 GLU 1.89 -0.20 1 22 THR 0.05 -0.30 1 23 LEU -6.69 4.39 1 24 ILE -5.20 3.47 1 26 LEU -5.45 3.49 1 27 PHE 1.26 -1.30 1 29 LEU -4.79 2.65 1 30 SER -0.98 0.51 1 31 ASP 2.18 -0.96 1 32 LYS 0.76 -1.13 1 33 VAL 1.59 -0.50 1 34 SER -4.03 0.87 1 37 LEU 2.57 0.29 1 38 ILE 5.46 -1.36 1 40 GLN 4.72 -0.93 1 41 PHE 2.57 0.00 1 42 LEU 3.88 -1.55 1 43 GLN 1.70 1.54 1 44 GLU 1.65 0.60 1 45 GLU 0.70 -0.19 1 47 HIS 4.80 -3.44 1 48 ILE -0.45 0.11 1 49 ASN -1.39 1.79 1 50 GLU 3.96 -0.69 1 51 LYS 3.05 -1.42 1 52 ASP 0.95 0.83 1 53 ILE -0.92 1.09 1 54 ARG 1.81 -0.05 1 55 LYS -3.72 3.52 1 56 ILE -2.28 2.01 1 57 LEU -5.42 3.09 1 58 LEU 1.06 -0.85 1 59 VAL -0.99 -1.84 1 61 ASP 2.95 -0.91 1 62 PHE -1.74 0.23 1 63 ASN 2.08 -0.95 1 65 ALA -4.92 3.87 1 66 ILE -3.85 3.27 1 67 ILE -1.36 0.09 1 68 ILE 0.22 -0.29 1 69 PHE -1.35 2.05 1 70 ARG 3.09 -0.35 1 71 ASP -4.03 3.14 1 72 SER 3.39 -0.92 1 73 LYS 4.69 -1.53 1 74 PHE 3.35 0.38 1 75 ALA 3.80 -0.69 1 76 ALA 3.59 -1.06 1 77 LYS 3.55 -0.97 1 78 MET 0.91 -0.52 1 79 LEU 4.42 -0.07 1 80 MET 2.62 -0.47 1 81 ILE 2.36 0.11 1 82 LEU 1.00 -0.04 1 83 ASN 3.05 -0.43 1 85 SER 0.46 0.56 1 86 GLN -2.08 1.37 1 87 PHE -3.47 2.05 1 88 GLN 4.19 -3.34 1 90 LYS -4.82 2.77 1 91 VAL 1.82 -0.80 1 92 ILE -5.00 3.21 1 93 ARG -3.79 1.00 1 94 SER -7.26 3.43 1 96 THR -2.85 1.96 1 97 ILE 5.72 -1.13 1 98 ASN 4.25 -1.10 1 99 ASP 4.20 -0.75 1 100 MET 3.63 -0.55 1 101 LYS 4.48 -0.53 1 102 ARG 4.13 -0.55 1 103 TYR 3.24 0.83 1 104 TYR 3.46 0.38 1 105 ASN 2.75 -0.25 1 106 ASN 1.92 -0.26 1 107 GLN 1.87 -0.77 1 108 GLN 1.35 -0.61 1 113 LYS 3.47 -2.85 1 114 HIS -0.71 2.05 1 115 VAL -0.04 -0.02 1 116 LYS -0.21 0.20 1 118 SER 0.67 1.18 1 120 ILE 0.48 0.07 1 123 MET 0.58 -0.26 1 124 GLU -0.34 0.45 1 125 LYS -0.16 0.20 1 128 ASN 0.46 -0.30 1 129 LEU 0.23 0.01 1 130 GLN 0.21 -0.04 1 131 VAL 0.32 -0.10 1 132 LYS -0.07 0.04 1 133 LYS -0.27 0.28 1 134 LYS 0.09 0.12 1 135 ILE -0.12 0.03 1 137 ASP -0.03 0.45 1 138 LYS 0.52 -0.09 1 139 GLN 0.70 0.01 1 140 GLU 0.04 0.42 1 141 GLN 0.37 0.03 1 144 ASN 1.54 -0.18 1 145 ASP 1.37 0.10 1 146 ASP 1.88 -0.27 1 147 PHE 2.47 -0.43 1 148 ARG 2.67 -0.69 1 149 LYS 1.86 -0.29 1 150 MET 1.12 0.08 1 151 PHE -3.33 -1.04 1 152 LEU 0.44 -0.16 1 154 GLU -0.28 0.48 1 155 LEU 0.43 0.02 1 156 GLU -1.32 0.88 1 157 HIS 0.65 1.97 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17491_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 0.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _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 5.71 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 LEU -6.69 1.52 0 10 ARG 4.11 -0.37 1 11 LEU 3.30 -0.44 1 12 LEU 3.22 -0.46 1 13 ALA -1.87 0.16 1 14 SER 1.14 -0.42 1 18 LYS 3.83 -0.18 1 19 GLU 1.14 -0.14 1 20 LEU 2.21 -0.18 1 21 GLU 1.89 -0.02 1 22 THR 0.05 -0.17 1 24 ILE -5.20 0.54 1 26 LEU -5.45 1.02 1 27 PHE 1.26 -0.05 1 29 LEU -4.79 0.32 1 30 SER -0.98 0.01 1 31 ASP 2.18 -0.17 1 32 LYS 0.76 0.00 1 33 VAL 1.59 -0.21 1 34 SER -4.03 0.62 1 37 LEU 2.57 -0.04 1 38 ILE 5.46 -0.54 1 40 GLN 4.72 -0.27 1 41 PHE 2.57 0.01 1 42 LEU 3.88 -0.84 1 43 GLN 1.70 0.24 1 44 GLU 1.65 -0.24 1 45 GLU 0.70 0.00 1 46 ILE 0.77 -0.27 1 47 HIS 4.80 -0.24 1 48 ILE -0.45 0.25 1 49 ASN -1.39 -0.05 1 50 GLU 3.96 -0.56 1 51 LYS 3.05 -0.22 1 52 ASP 0.95 -0.19 1 53 ILE -0.92 -0.29 1 54 ARG 1.81 -0.05 1 55 LYS -3.72 0.09 1 56 ILE -2.28 0.56 1 57 LEU -5.42 0.43 1 58 LEU 1.06 0.02 1 59 VAL -0.99 0.21 1 61 ASP 2.95 -0.67 1 62 PHE -1.74 -0.58 1 63 ASN 2.08 -0.07 1 65 ALA -4.92 0.73 1 66 ILE -3.85 0.55 1 67 ILE -1.36 0.25 1 68 ILE 0.22 0.21 1 69 PHE -1.35 0.50 1 70 ARG 3.09 -0.25 1 71 ASP -4.03 0.24 1 72 SER 3.39 -0.16 1 73 LYS 4.69 -0.18 1 74 PHE 3.35 -0.66 1 75 ALA 3.80 -0.93 1 76 ALA 3.59 -0.29 1 77 LYS 3.55 -0.33 1 79 LEU 4.42 -0.56 1 80 MET 2.62 -0.21 1 81 ILE 2.36 -0.29 1 82 LEU 1.00 -0.25 1 83 ASN 3.05 -0.41 1 85 SER 0.46 -0.07 1 86 GLN -2.08 0.54 1 87 PHE -3.47 -0.15 1 88 GLN 4.19 -0.84 1 90 LYS -4.82 0.38 1 91 VAL 1.82 0.16 1 92 ILE -5.00 0.35 1 93 ARG -3.79 0.26 1 94 SER -7.26 1.21 1 96 THR -2.85 -0.07 1 97 ILE 5.72 -0.30 1 98 ASN 4.25 -0.52 1 99 ASP 4.20 -0.39 1 100 MET 3.63 -0.38 1 101 LYS 4.48 -0.84 1 102 ARG 4.13 -0.39 1 104 TYR 3.46 -0.40 1 105 ASN 2.75 -0.33 1 106 ASN 1.92 -0.20 1 107 GLN 1.87 -0.32 1 113 LYS 3.47 -0.21 1 114 HIS -0.71 -0.12 1 115 VAL -0.04 -0.07 1 116 LYS -0.21 -0.03 1 123 MET 0.58 -0.05 1 124 GLU -0.34 -0.10 1 125 LYS -0.16 0.03 1 128 ASN 0.46 -0.01 1 130 GLN 0.21 -0.03 1 131 VAL 0.32 -0.08 1 132 LYS -0.07 -0.07 1 133 LYS -0.27 -0.07 1 134 LYS 0.09 -0.06 1 137 ASP -0.03 -0.13 1 139 GLN 0.70 -0.09 1 140 GLU 0.04 -0.13 1 141 GLN 0.37 -0.05 1 144 ASN 1.54 -0.07 1 145 ASP 1.37 -0.15 1 147 PHE 2.47 -0.21 1 148 ARG 2.67 -0.31 1 151 PHE -3.33 0.05 1 152 LEU 0.44 -0.04 1 154 GLU -0.28 -0.10 1 155 LEU 0.43 -0.09 1 156 GLU -1.32 0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17491_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -2.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 5.71 _LACS_plot.Line_2_terminator_val_y_2 2.01 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 SER -7.26 0.19 0 10 ARG 4.11 3.42 1 11 LEU 3.30 1.37 1 12 LEU 3.22 -0.25 1 13 ALA -1.87 -0.22 1 18 LYS 3.83 2.44 1 20 LEU 2.21 1.52 1 21 GLU 1.89 0.38 1 22 THR 0.05 -2.71 1 23 LEU -6.69 -2.00 1 24 ILE -5.20 -2.83 1 26 LEU -5.45 -1.58 1 29 LEU -4.79 -0.80 1 30 SER -0.98 0.09 1 31 ASP 2.18 0.51 1 32 LYS 0.76 0.18 1 33 VAL 1.59 -3.01 1 37 LEU 2.57 2.68 1 38 ILE 5.46 0.42 1 40 GLN 4.72 1.38 1 41 PHE 2.57 1.63 1 42 LEU 3.88 0.90 1 43 GLN 1.70 2.53 1 44 GLU 1.65 0.78 1 45 GLU 0.70 0.19 1 46 ILE 0.77 -0.69 1 47 HIS 4.80 0.99 1 48 ILE -0.45 -1.35 1 49 ASN -1.39 1.22 1 50 GLU 3.96 1.37 1 51 LYS 3.05 0.74 1 52 ASP 0.95 -0.87 1 53 ILE -0.92 -1.42 1 54 ARG 1.81 0.37 1 55 LYS -3.72 -3.59 1 56 ILE -2.28 -2.21 1 57 LEU -5.42 -1.77 1 58 LEU 1.06 -1.13 1 61 ASP 2.95 -1.55 1 62 PHE -1.74 -2.48 1 63 ASN 2.08 -0.82 1 65 ALA -4.92 -3.04 1 66 ILE -3.85 -2.25 1 67 ILE -1.36 -2.44 1 68 ILE 0.22 -0.27 1 69 PHE -1.35 -0.37 1 70 ARG 3.09 -1.22 1 72 SER 3.39 2.15 1 73 LYS 4.69 -0.41 1 74 PHE 3.35 1.85 1 75 ALA 3.80 0.32 1 76 ALA 3.59 2.73 1 77 LYS 3.55 2.35 1 79 LEU 4.42 1.47 1 80 MET 2.62 1.92 1 81 ILE 2.36 1.16 1 82 LEU 1.00 0.77 1 83 ASN 3.05 -1.18 1 85 SER 0.46 -2.98 1 87 PHE -3.47 -0.96 1 88 GLN 4.19 0.17 1 90 LYS -4.82 -2.07 1 91 VAL 1.82 0.07 1 92 ILE -5.00 -2.85 1 93 ARG -3.79 -2.37 1 96 THR -2.85 0.90 1 97 ILE 5.72 1.73 1 98 ASN 4.25 2.85 1 99 ASP 4.20 1.55 1 100 MET 3.63 1.82 1 101 LYS 4.48 1.47 1 103 TYR 3.24 3.36 1 104 TYR 3.46 2.06 1 105 ASN 2.75 1.78 1 106 ASN 1.92 1.21 1 107 GLN 1.87 1.07 1 113 LYS 3.47 -0.38 1 114 HIS -0.71 1.14 1 115 VAL -0.04 -0.71 1 123 MET 0.58 -0.08 1 124 GLU -0.34 -0.33 1 125 LYS -0.16 0.06 1 128 ASN 0.46 -0.33 1 129 LEU 0.23 -0.30 1 130 GLN 0.21 -0.10 1 131 VAL 0.32 -0.26 1 132 LYS -0.07 -0.41 1 133 LYS -0.27 -0.45 1 134 LYS 0.09 -0.43 1 137 ASP -0.03 -0.03 1 138 LYS 0.52 -0.16 1 139 GLN 0.70 0.26 1 140 GLU 0.04 -0.09 1 141 GLN 0.37 0.04 1 144 ASN 1.54 0.71 1 145 ASP 1.37 0.48 1 146 ASP 1.88 -2.08 1 147 PHE 2.47 0.95 1 148 ARG 2.67 1.04 1 151 PHE -3.33 -0.56 1 152 LEU 0.44 0.20 1 154 GLU -0.28 0.06 1 155 LEU 0.43 -0.22 1 156 GLU -1.32 -2.42 1 stop_ save_