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 bmr25132_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 -3.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.67 _LACS_plot.Line_2_terminator_val_x_2 7.14 _LACS_plot.Line_2_terminator_val_y_2 5.68 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 106 ILE -8.54 -1.81 0 10 ASP -2.05 -1.31 1 11 ILE 3.84 3.04 1 12 ALA 2.54 1.61 1 13 THR -0.67 -1.02 1 14 ALA 1.67 1.45 1 15 THR 0.73 -0.13 1 16 GLU 2.35 2.54 1 18 VAL -3.63 -2.61 1 19 ILE -5.24 -1.67 1 20 ILE -1.56 -2.11 1 21 ASN -4.76 -2.55 1 22 ALA 0.18 -1.81 1 23 ALA -3.48 -1.07 1 24 ASN -4.68 -1.83 1 25 SER 2.89 2.40 1 26 LYS 0.70 -0.03 1 28 GLN -0.65 -0.82 1 33 VAL 4.23 3.02 1 36 ALA 2.71 2.04 1 37 LEU 3.20 2.64 1 38 TYR 5.00 3.90 1 39 LYS 2.82 1.89 1 40 LYS 0.06 1.00 1 41 PHE -2.52 -1.83 1 43 GLU 3.89 1.65 1 44 SER 0.63 0.25 1 45 PHE -1.00 -0.21 1 46 ASP -0.72 -1.00 1 47 LEU 4.57 0.41 1 48 GLN -1.10 -1.25 1 50 ILE -3.51 -0.19 1 51 GLU -0.27 -0.16 1 52 VAL 4.64 2.26 1 54 LYS -3.34 -2.84 1 55 ALA -6.63 -2.42 1 56 ARG -3.74 -0.27 1 57 LEU -2.13 -0.71 1 58 VAL -0.37 0.04 1 59 LYS 0.89 -0.62 1 61 ALA 2.44 2.17 1 62 ALA -0.93 0.14 1 63 LYS -2.97 -2.68 1 64 HIS -2.39 -0.30 1 65 ILE -4.79 -2.46 1 66 ILE -1.07 -0.92 1 67 HIS -2.29 0.87 1 68 ALA -6.71 -2.13 1 69 VAL 0.66 -0.96 1 72 ASN -1.46 -2.92 1 73 PHE 5.89 4.14 1 74 ASN 2.40 2.93 1 75 LYS -2.35 -0.54 1 76 VAL -4.88 -2.60 1 77 SER -1.65 -0.64 1 78 GLU 4.34 3.28 1 79 VAL 4.83 3.81 1 80 GLU 2.80 2.39 1 82 ASP 3.96 5.24 1 83 LYS 3.79 2.92 1 84 GLN 3.75 2.85 1 85 LEU 2.71 2.26 1 86 ALA 4.84 3.38 1 87 GLU 3.29 2.81 1 88 ALA 4.54 2.86 1 89 TYR 4.61 4.52 1 90 GLU 4.51 3.62 1 91 SER 1.65 3.81 1 92 ILE 5.41 4.86 1 93 ALA 4.02 3.31 1 94 LYS 4.10 3.38 1 95 ILE 4.56 4.43 1 96 VAL 6.88 5.57 1 97 ASN 3.36 2.75 1 98 ASP 3.82 2.87 1 99 ASN -1.43 0.25 1 100 ASN 2.50 1.15 1 101 TYR 1.47 1.36 1 102 LYS -0.46 -0.90 1 103 SER -2.66 -1.54 1 104 VAL -6.80 -2.45 1 105 ALA -4.29 -2.12 1 108 LEU -0.26 -0.84 1 109 LEU -0.37 -0.27 1 110 SER 7.14 3.94 1 111 THR -3.42 -1.62 1 113 ILE 0.13 -0.40 1 114 PHE -0.84 -0.87 1 115 SER 1.68 3.24 1 120 ARG -5.14 -2.39 1 121 LEU 6.22 5.68 1 122 THR 5.75 4.49 1 123 GLN 3.51 2.40 1 124 SER 2.91 3.44 1 125 LEU 3.30 2.42 1 126 ASN 5.26 3.37 1 127 HIS 0.78 3.55 1 128 LEU 5.02 4.49 1 129 LEU 3.13 1.83 1 130 THR 5.95 4.91 1 131 ALA 1.46 1.71 1 132 LEU 5.35 1.02 1 133 ASP 2.63 2.13 1 134 THR 0.83 0.76 1 135 THR -3.68 -1.50 1 136 ASP -3.07 -2.66 1 137 ALA -0.53 -0.32 1 138 ASP -0.08 -0.09 1 139 VAL -0.18 -0.25 1 140 ALA -4.38 -3.03 1 141 ILE -0.91 -0.47 1 142 TYR -3.73 -0.21 1 144 ARG 1.77 1.35 1 145 ASP 3.08 -0.54 1 146 LYS -4.21 -1.51 1 147 LYS 3.77 3.32 1 148 TRP 0.19 2.02 1 149 GLU 4.37 3.27 1 150 MET 4.01 3.00 1 151 THR 5.89 4.90 1 152 LEU 2.40 3.16 1 153 LYS 5.43 4.73 1 154 GLU 3.02 2.54 1 155 ALA 3.21 2.48 1 156 VAL 4.85 3.66 1 157 ALA 3.13 2.16 1 158 ARG 2.10 1.37 1 159 ARG 1.71 0.99 1 160 GLU 0.13 0.44 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25132_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 5.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.33 _LACS_plot.Line_2_terminator_val_x_2 7.14 _LACS_plot.Line_2_terminator_val_y_2 -1.46 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 106 ILE -8.54 6.73 0 10 ASP -2.05 0.74 1 11 ILE 3.84 -0.80 1 12 ALA 2.54 -0.93 1 13 THR -0.67 -0.35 1 14 ALA 1.67 -0.22 1 15 THR 0.73 -0.86 1 16 GLU 2.35 0.19 1 18 VAL -3.63 1.02 1 19 ILE -5.24 3.57 1 20 ILE -1.56 -0.55 1 21 ASN -4.76 2.21 1 22 ALA 0.18 -1.99 1 23 ALA -3.48 2.41 1 24 ASN -4.68 2.85 1 25 SER 2.89 -0.49 1 26 LYS 0.70 -0.73 1 28 GLN -0.65 -0.17 1 33 VAL 4.23 -1.21 1 36 ALA 2.71 -0.67 1 37 LEU 3.20 -0.56 1 38 TYR 5.00 -1.10 1 39 LYS 2.82 -0.93 1 40 LYS 0.06 0.94 1 41 PHE -2.52 0.69 1 43 GLU 3.89 -2.24 1 44 SER 0.63 -0.38 1 45 PHE -1.00 0.79 1 46 ASP -0.72 -0.28 1 47 LEU 4.57 -4.16 1 48 GLN -1.10 -0.15 1 50 ILE -3.51 3.32 1 51 GLU -0.27 0.11 1 52 VAL 4.64 -2.38 1 54 LYS -3.34 0.50 1 55 ALA -6.63 4.21 1 56 ARG -3.74 3.47 1 57 LEU -2.13 1.42 1 58 VAL -0.37 0.41 1 59 LYS 0.89 -1.51 1 61 ALA 2.44 -0.27 1 62 ALA -0.93 1.07 1 63 LYS -2.97 0.29 1 64 HIS -2.39 2.09 1 65 ILE -4.79 2.33 1 66 ILE -1.07 0.15 1 67 HIS -2.29 3.16 1 68 ALA -6.71 4.58 1 69 VAL 0.66 -1.62 1 72 ASN -1.46 -1.46 1 73 PHE 5.89 -1.75 1 74 ASN 2.40 0.53 1 75 LYS -2.35 1.81 1 76 VAL -4.88 2.28 1 77 SER -1.65 1.01 1 78 GLU 4.34 -1.06 1 79 VAL 4.83 -1.02 1 80 GLU 2.80 -0.41 1 82 ASP 3.96 1.28 1 83 LYS 3.79 -0.87 1 84 GLN 3.75 -0.90 1 85 LEU 2.71 -0.45 1 86 ALA 4.84 -1.46 1 87 GLU 3.29 -0.48 1 88 ALA 4.54 -1.68 1 89 TYR 4.61 -0.09 1 90 GLU 4.51 -0.89 1 91 SER 1.65 2.16 1 92 ILE 5.41 -0.55 1 93 ALA 4.02 -0.71 1 94 LYS 4.10 -0.72 1 95 ILE 4.56 -0.13 1 96 VAL 6.88 -1.31 1 97 ASN 3.36 -0.61 1 98 ASP 3.82 -0.95 1 99 ASN -1.43 1.68 1 100 ASN 2.50 -1.35 1 101 TYR 1.47 -0.11 1 102 LYS -0.46 -0.44 1 103 SER -2.66 1.12 1 104 VAL -6.80 4.35 1 105 ALA -4.29 2.17 1 108 LEU -0.26 -0.58 1 109 LEU -0.37 0.10 1 110 SER 7.14 -3.20 1 111 THR -3.42 1.80 1 113 ILE 0.13 -0.53 1 114 PHE -0.84 -0.03 1 115 SER 1.68 1.56 1 120 ARG -5.14 2.75 1 121 LEU 6.22 -0.54 1 122 THR 5.75 -1.26 1 123 GLN 3.51 -1.11 1 124 SER 2.91 0.53 1 125 LEU 3.30 -0.88 1 126 ASN 5.26 -1.89 1 127 HIS 0.78 2.77 1 128 LEU 5.02 -0.53 1 129 LEU 3.13 -1.30 1 130 THR 5.95 -1.04 1 131 ALA 1.46 0.25 1 132 LEU 5.35 -4.33 1 133 ASP 2.63 -0.50 1 134 THR 0.83 -0.07 1 135 THR -3.68 2.18 1 136 ASP -3.07 0.41 1 137 ALA -0.53 0.21 1 138 ASP -0.08 -0.01 1 139 VAL -0.18 -0.07 1 140 ALA -4.38 1.35 1 141 ILE -0.91 0.44 1 142 TYR -3.73 3.52 1 144 ARG 1.77 -0.42 1 145 ASP 3.08 -3.62 1 146 LYS -4.21 2.70 1 147 LYS 3.77 -0.45 1 148 TRP 0.19 1.83 1 149 GLU 4.37 -1.10 1 150 MET 4.01 -1.01 1 151 THR 5.89 -0.99 1 152 LEU 2.40 0.76 1 153 LYS 5.43 -0.70 1 154 GLU 3.02 -0.48 1 155 ALA 3.21 -0.73 1 156 VAL 4.85 -1.19 1 157 ALA 3.13 -0.97 1 158 ARG 2.10 -0.73 1 159 ARG 1.71 -0.72 1 160 GLU 0.13 0.31 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25132_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 0.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 7.14 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _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 105 ALA -4.29 1.46 0 10 ASP -2.05 0.01 1 11 ILE 3.84 0.45 1 12 ALA 2.54 -0.17 1 13 THR -0.67 0.05 1 14 ALA 1.67 0.04 1 15 THR 0.73 -0.10 1 16 GLU 2.35 -0.39 1 18 VAL -3.63 0.43 1 19 ILE -5.24 0.40 1 20 ILE -1.56 0.79 1 21 ASN -4.76 -0.02 1 22 ALA 0.18 0.21 1 23 ALA -3.48 0.17 1 24 ASN -4.68 0.56 1 25 SER 2.89 -0.31 1 26 LYS 0.70 -0.05 1 28 GLN -0.65 -0.27 1 33 VAL 4.23 -0.28 1 36 ALA 2.71 -0.11 1 37 LEU 3.20 -0.16 1 38 TYR 5.00 -0.31 1 39 LYS 2.82 -0.59 1 40 LYS 0.06 -0.42 1 41 PHE -2.52 0.48 1 43 GLU 3.89 0.16 1 44 SER 0.63 -0.12 1 45 PHE -1.00 -0.14 1 46 ASP -0.72 -0.15 1 47 LEU 4.57 -0.22 1 48 GLN -1.10 -0.24 1 50 ILE -3.51 -0.20 1 51 GLU -0.27 -0.29 1 52 VAL 4.64 -0.75 1 54 LYS -3.34 0.35 1 55 ALA -6.63 1.32 1 56 ARG -3.74 0.26 1 57 LEU -2.13 0.50 1 58 VAL -0.37 0.04 1 59 LYS 0.89 -0.40 1 61 ALA 2.44 -0.25 1 62 ALA -0.93 0.21 1 63 LYS -2.97 -0.12 1 64 HIS -2.39 0.47 1 65 ILE -4.79 0.99 1 66 ILE -1.07 0.13 1 67 HIS -2.29 -0.20 1 68 ALA -6.71 0.85 1 69 VAL 0.66 0.14 1 72 ASN -1.46 0.07 1 73 PHE 5.89 -0.36 1 74 ASN 2.40 -0.07 1 75 LYS -2.35 0.26 1 76 VAL -4.88 0.47 1 77 SER -1.65 0.11 1 78 GLU 4.34 -0.12 1 79 VAL 4.83 -0.17 1 80 GLU 2.80 -0.27 1 82 ASP 3.96 -0.09 1 83 LYS 3.79 -0.26 1 84 GLN 3.75 -0.25 1 85 LEU 2.71 -0.39 1 86 ALA 4.84 -0.50 1 87 GLU 3.29 -0.43 1 88 ALA 4.54 -0.59 1 89 TYR 4.61 -0.23 1 90 GLU 4.51 -0.38 1 91 SER 1.65 -0.21 1 92 ILE 5.41 -0.81 1 93 ALA 4.02 -0.65 1 94 LYS 4.10 -0.21 1 95 ILE 4.56 -0.34 1 96 VAL 6.88 -0.33 1 97 ASN 3.36 -0.12 1 98 ASP 3.82 -0.28 1 99 ASN -1.43 -0.23 1 100 ASN 2.50 -0.30 1 101 TYR 1.47 0.02 1 102 LYS -0.46 0.08 1 103 SER -2.66 0.98 1 104 VAL -6.80 0.45 1 106 ILE -8.54 0.75 1 108 LEU -0.26 0.34 1 109 LEU -0.37 -0.09 1 110 SER 7.14 -0.42 1 111 THR -3.42 0.87 1 113 ILE 0.13 -0.01 1 114 PHE -0.84 0.06 1 115 SER 1.68 0.02 1 120 ARG -5.14 -0.15 1 121 LEU 6.22 -0.39 1 122 THR 5.75 -0.39 1 123 GLN 3.51 -0.47 1 124 SER 2.91 -0.09 1 125 LEU 3.30 -0.51 1 126 ASN 5.26 -0.66 1 127 HIS 0.78 -0.50 1 128 LEU 5.02 -0.12 1 129 LEU 3.13 -0.50 1 130 THR 5.95 -0.56 1 131 ALA 1.46 0.07 1 132 LEU 5.35 -0.11 1 133 ASP 2.63 0.19 1 134 THR 0.83 0.17 1 135 THR -3.68 0.89 1 136 ASP -3.07 0.67 1 137 ALA -0.53 -0.22 1 138 ASP -0.08 0.31 1 139 VAL -0.18 0.34 1 140 ALA -4.38 -0.07 1 141 ILE -0.91 0.73 1 142 TYR -3.73 0.90 1 144 ARG 1.77 -0.17 1 145 ASP 3.08 -0.17 1 146 LYS -4.21 0.22 1 147 LYS 3.77 -0.24 1 148 TRP 0.19 -0.41 1 149 GLU 4.37 0.09 1 150 MET 4.01 -0.26 1 151 THR 5.89 -0.41 1 152 LEU 2.40 -0.47 1 153 LYS 5.43 -0.54 1 154 GLU 3.02 -0.24 1 155 ALA 3.21 -0.31 1 156 VAL 4.85 -0.18 1 157 ALA 3.13 -0.10 1 158 ARG 2.10 -0.13 1 159 ARG 1.71 -0.16 1 160 GLU 0.13 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25132_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.54 _LACS_plot.Line_1_terminator_val_y_1 -3.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 7.14 _LACS_plot.Line_2_terminator_val_y_2 2.40 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 110 SER 7.14 -3.32 0 10 ASP -2.05 0.68 1 11 ILE 3.84 -1.91 1 12 ALA 2.54 0.47 1 13 THR -0.67 -0.08 1 14 ALA 1.67 0.75 1 15 THR 0.73 0.21 1 16 GLU 2.35 -0.70 1 18 VAL -3.63 -4.33 1 19 ILE -5.24 -2.34 1 20 ILE -1.56 -3.48 1 21 ASN -4.76 -0.09 1 22 ALA 0.18 -3.80 1 23 ALA -3.48 -2.10 1 24 ASN -4.68 1.16 1 25 SER 2.89 1.40 1 26 LYS 0.70 0.34 1 28 GLN -0.65 0.01 1 33 VAL 4.23 0.08 1 36 ALA 2.71 3.08 1 37 LEU 3.20 0.28 1 38 TYR 5.00 -0.08 1 39 LYS 2.82 1.08 1 40 LYS 0.06 -0.78 1 41 PHE -2.52 -0.97 1 43 GLU 3.89 1.16 1 44 SER 0.63 -3.35 1 45 PHE -1.00 -1.78 1 46 ASP -0.72 0.14 1 47 LEU 4.57 -1.87 1 48 GLN -1.10 -0.94 1 50 ILE -3.51 -2.26 1 51 GLU -0.27 -1.05 1 52 VAL 4.64 0.70 1 54 LYS -3.34 -3.09 1 55 ALA -6.63 -1.49 1 56 ARG -3.74 -2.18 1 57 LEU -2.13 -2.36 1 58 VAL -0.37 -1.09 1 59 LYS 0.89 -0.58 1 61 ALA 2.44 0.58 1 62 ALA -0.93 -0.55 1 63 LYS -2.97 -1.44 1 64 HIS -2.39 -0.70 1 65 ILE -4.79 -1.40 1 66 ILE -1.07 -2.18 1 67 HIS -2.29 -0.70 1 68 ALA -6.71 -2.19 1 69 VAL 0.66 -0.45 1 72 ASN -1.46 1.98 1 73 PHE 5.89 -0.10 1 74 ASN 2.40 0.67 1 75 LYS -2.35 -1.36 1 76 VAL -4.88 -2.54 1 77 SER -1.65 0.26 1 78 GLU 4.34 3.65 1 79 VAL 4.83 1.97 1 80 GLU 2.80 2.58 1 82 ASP 3.96 0.88 1 83 LYS 3.79 2.53 1 84 GLN 3.75 1.38 1 85 LEU 2.71 -0.74 1 86 ALA 4.84 3.06 1 87 GLU 3.29 1.97 1 88 ALA 4.54 2.21 1 89 TYR 4.61 2.43 1 90 GLU 4.51 3.41 1 91 SER 1.65 2.41 1 92 ILE 5.41 0.19 1 93 ALA 4.02 0.15 1 94 LYS 4.10 1.43 1 95 ILE 4.56 3.33 1 96 VAL 6.88 1.11 1 97 ASN 3.36 3.71 1 98 ASP 3.82 1.04 1 99 ASN -1.43 -2.59 1 100 ASN 2.50 -0.54 1 101 TYR 1.47 0.86 1 102 LYS -0.46 0.12 1 103 SER -2.66 -1.84 1 104 VAL -6.80 -3.65 1 105 ALA -4.29 -2.64 1 106 ILE -8.54 -4.04 1 108 LEU -0.26 0.68 1 109 LEU -0.37 -0.22 1 111 THR -3.42 1.66 1 113 ILE 0.13 -0.07 1 114 PHE -0.84 0.40 1 115 SER 1.68 2.71 1 120 ARG -5.14 -0.23 1 121 LEU 6.22 0.19 1 122 THR 5.75 1.01 1 123 GLN 3.51 1.74 1 124 SER 2.91 2.00 1 125 LEU 3.30 0.01 1 126 ASN 5.26 3.45 1 127 HIS 0.78 2.52 1 128 LEU 5.02 0.73 1 129 LEU 3.13 0.43 1 130 THR 5.95 1.48 1 131 ALA 1.46 2.29 1 132 LEU 5.35 1.49 1 133 ASP 2.63 0.89 1 134 THR 0.83 -1.00 1 135 THR -3.68 -2.84 1 136 ASP -3.07 0.28 1 137 ALA -0.53 -2.45 1 138 ASP -0.08 -0.86 1 139 VAL -0.18 -2.66 1 140 ALA -4.38 -2.62 1 141 ILE -0.91 -0.76 1 142 TYR -3.73 0.54 1 144 ARG 1.77 2.77 1 145 ASP 3.08 -2.66 1 146 LYS -4.21 -1.96 1 147 LYS 3.77 1.35 1 148 TRP 0.19 3.71 1 149 GLU 4.37 0.97 1 150 MET 4.01 2.55 1 151 THR 5.89 2.30 1 152 LEU 2.40 0.39 1 153 LYS 5.43 3.11 1 154 GLU 3.02 1.31 1 155 ALA 3.21 3.24 1 156 VAL 4.85 1.36 1 157 ALA 3.13 2.05 1 158 ARG 2.10 0.80 1 159 ARG 1.71 0.54 1 160 GLU 0.13 0.11 1 stop_ save_