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 bmr19927_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.42 _LACS_plot.Line_1_terminator_val_y_1 -3.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.91 _LACS_plot.Line_2_terminator_val_x_2 9.68 _LACS_plot.Line_2_terminator_val_y_2 7.23 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 ILE -0.40 -3.86 0 106 ILE -7.57 -1.88 0 10 ASP -1.29 -0.62 1 11 ILE 4.15 3.09 1 12 ALA 1.92 1.05 1 13 THR -0.77 -0.84 1 14 ALA 0.56 1.38 1 15 ILE -0.91 -1.17 1 16 GLU 2.19 2.00 1 17 ASP 2.29 2.68 1 18 ALA -8.42 -3.71 1 19 VAL -3.53 -1.56 1 20 VAL -0.61 -1.98 1 21 ASN -4.55 -2.40 1 22 ALA 0.43 -1.85 1 23 ALA -4.49 -1.09 1 25 HIS 1.84 2.97 1 26 ARG 0.13 -0.98 1 28 GLN -3.59 -2.51 1 29 VAL 4.16 1.82 1 33 VAL 0.31 0.02 1 35 ARG 5.61 4.46 1 36 ALA 2.62 2.21 1 37 VAL 5.33 4.07 1 38 ALA 1.97 1.87 1 39 ARG 2.93 1.98 1 40 LYS 0.55 0.33 1 41 TRP 5.38 4.87 1 43 GLN 3.99 1.41 1 44 ALA 1.16 0.42 1 45 PHE 3.57 0.24 1 46 ARG 1.13 0.41 1 47 ASN 1.66 0.20 1 48 ALA 0.00 -0.36 1 49 ALA 2.37 1.58 1 50 THR -1.10 -0.35 1 52 VAL 3.73 1.78 1 54 THR -4.53 -2.21 1 55 ALA -6.26 -2.92 1 56 LYS -4.14 -1.23 1 57 THR 3.31 1.13 1 58 VAL -3.67 -1.73 1 59 LYS -0.22 -0.05 1 61 ASP 4.73 2.62 1 62 GLU 0.51 -0.21 1 63 THR -0.76 0.59 1 64 TYR 0.27 0.31 1 66 ILE -1.60 -1.68 1 67 HIS 0.08 1.19 1 68 ALA -5.51 -2.51 1 69 VAL 1.59 -1.35 1 72 ASN -0.65 -2.41 1 73 PHE 5.15 4.04 1 74 ASN 2.89 3.02 1 75 ASN -2.00 -0.96 1 76 THR -2.20 -1.97 1 77 SER -2.36 -1.19 1 78 GLU 4.55 2.99 1 79 ALA 3.50 2.73 1 80 GLU 2.77 2.43 1 82 ASP 3.87 5.22 1 83 ARG 4.16 2.73 1 84 ASP 3.77 2.80 1 85 LEU 2.89 1.95 1 86 ALA 4.53 2.99 1 87 ALA 3.46 2.58 1 88 ALA 4.49 2.43 1 89 TYR 4.92 4.82 1 90 ARG 6.14 4.67 1 91 ALA 3.27 1.81 1 92 VAL 6.43 4.70 1 93 ALA 3.78 2.80 1 94 ALA 3.78 2.31 1 95 GLU 2.61 1.20 1 96 ILE 4.79 2.65 1 97 ASN 3.42 1.86 1 98 ARG 3.51 3.19 1 99 LEU -0.38 -0.88 1 100 SER 2.67 -0.13 1 101 ILE 0.35 0.15 1 102 SER 1.88 2.10 1 103 SER -4.39 -2.25 1 104 VAL -6.23 -3.86 1 105 ALA -6.26 -2.87 1 108 LEU 0.10 -1.28 1 109 LEU 0.06 -0.35 1 110 SER 8.23 3.53 1 111 THR -1.54 -1.13 1 114 PHE -0.54 -2.48 1 115 SER 1.57 2.98 1 116 ALA 1.74 -0.41 1 118 LYS -3.44 -2.24 1 121 VAL 8.28 5.40 1 122 HIS 5.31 5.63 1 123 GLN 3.96 2.63 1 124 SER 2.70 3.29 1 125 LEU 2.44 1.86 1 127 HIS -0.27 2.84 1 128 LEU 5.29 4.37 1 129 LEU 2.99 1.49 1 130 ALA 2.90 2.06 1 131 ALA 0.38 1.12 1 132 MET 2.84 0.57 1 133 ASP 2.91 1.98 1 134 THR 0.83 0.26 1 135 THR -4.29 -1.95 1 136 GLU -2.94 -3.64 1 137 ALA -0.60 -0.69 1 138 ARG 2.50 0.11 1 139 VAL -1.13 -1.10 1 140 THR -1.47 -1.92 1 141 ILE -1.28 -0.94 1 142 TYR -1.95 -1.80 1 145 ASP 3.05 2.70 1 146 LYS 1.18 -0.76 1 147 THR 5.29 3.55 1 148 TRP 2.99 1.85 1 149 GLU 3.26 3.31 1 150 GLN 4.11 2.76 1 151 LYS 3.79 3.40 1 152 ILE 3.94 3.71 1 153 LYS 5.39 4.36 1 154 THR 9.68 6.82 1 155 VAL 5.74 4.05 1 156 LEU 4.12 2.49 1 157 GLN 2.84 1.85 1 158 ASN 0.38 0.36 1 159 ARG 2.07 1.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19927_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.42 _LACS_plot.Line_1_terminator_val_y_1 4.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 9.68 _LACS_plot.Line_2_terminator_val_y_2 -2.45 _LACS_plot.Y_axis_chem_shift_offset 0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 ILE -0.40 -3.46 0 106 ILE -7.57 5.69 0 10 ASP -1.29 0.67 1 11 ILE 4.15 -1.06 1 12 ALA 1.92 -0.87 1 13 THR -0.77 -0.07 1 14 ALA 0.56 0.82 1 15 ILE -0.91 -0.26 1 16 GLU 2.19 -0.19 1 17 ASP 2.29 0.39 1 18 ALA -8.42 4.71 1 19 VAL -3.53 1.97 1 20 VAL -0.61 -1.37 1 21 ASN -4.55 2.15 1 22 ALA 0.43 -2.28 1 23 ALA -4.49 3.40 1 25 HIS 1.84 1.13 1 26 ARG 0.13 -1.11 1 28 GLN -3.59 1.08 1 29 VAL 4.16 -2.34 1 33 VAL 0.31 -0.29 1 35 ARG 5.61 -1.15 1 36 ALA 2.62 -0.41 1 37 VAL 5.33 -1.26 1 38 ALA 1.97 -0.10 1 39 ARG 2.93 -0.95 1 40 LYS 0.55 -0.22 1 41 TRP 5.38 -0.51 1 43 GLN 3.99 -2.58 1 44 ALA 1.16 -0.74 1 45 PHE 3.57 -3.33 1 46 ARG 1.13 -0.72 1 47 ASN 1.66 -1.46 1 48 ALA 0.00 -0.36 1 49 ALA 2.37 -0.79 1 50 THR -1.10 0.75 1 52 VAL 3.73 -1.95 1 54 THR -4.53 2.32 1 55 ALA -6.26 3.34 1 56 LYS -4.14 2.91 1 57 THR 3.31 -2.18 1 58 VAL -3.67 1.94 1 59 LYS -0.22 0.17 1 61 ASP 4.73 -2.11 1 62 GLU 0.51 -0.72 1 63 THR -0.76 1.35 1 64 TYR 0.27 0.04 1 66 ILE -1.60 -0.08 1 67 HIS 0.08 1.11 1 68 ALA -5.51 3.00 1 69 VAL 1.59 -2.94 1 72 ASN -0.65 -1.76 1 73 PHE 5.15 -1.11 1 74 ASN 2.89 0.13 1 75 ASN -2.00 1.04 1 76 THR -2.20 0.23 1 77 SER -2.36 1.17 1 78 GLU 4.55 -1.56 1 79 ALA 3.50 -0.77 1 80 GLU 2.77 -0.34 1 82 ASP 3.87 1.35 1 83 ARG 4.16 -1.43 1 84 ASP 3.77 -0.97 1 85 LEU 2.89 -0.94 1 86 ALA 4.53 -1.54 1 87 ALA 3.46 -0.88 1 88 ALA 4.49 -2.06 1 89 TYR 4.92 -0.10 1 90 ARG 6.14 -1.47 1 91 ALA 3.27 -1.46 1 92 VAL 6.43 -1.73 1 93 ALA 3.78 -0.98 1 94 ALA 3.78 -1.47 1 95 GLU 2.61 -1.41 1 96 ILE 4.79 -2.14 1 97 ASN 3.42 -1.56 1 98 ARG 3.51 -0.32 1 99 LEU -0.38 -0.50 1 100 SER 2.67 -2.80 1 101 ILE 0.35 -0.20 1 102 SER 1.88 0.22 1 103 SER -4.39 2.14 1 104 VAL -6.23 2.37 1 105 ALA -6.26 3.39 1 108 LEU 0.10 -1.38 1 109 LEU 0.06 -0.41 1 110 SER 8.23 -4.70 1 111 THR -1.54 0.41 1 114 PHE -0.54 -1.94 1 115 SER 1.57 1.41 1 116 ALA 1.74 -2.15 1 118 LYS -3.44 1.20 1 121 VAL 8.28 -2.88 1 122 HIS 5.31 0.32 1 123 GLN 3.96 -1.33 1 124 SER 2.70 0.59 1 125 LEU 2.44 -0.58 1 127 HIS -0.27 3.11 1 128 LEU 5.29 -0.92 1 129 LEU 2.99 -1.50 1 130 ALA 2.90 -0.84 1 131 ALA 0.38 0.74 1 132 MET 2.84 -2.27 1 133 ASP 2.91 -0.93 1 134 THR 0.83 -0.57 1 135 THR -4.29 2.34 1 136 GLU -2.94 -0.70 1 137 ALA -0.60 -0.09 1 138 ARG 2.50 -2.39 1 139 VAL -1.13 0.03 1 140 THR -1.47 -0.45 1 141 ILE -1.28 0.34 1 142 TYR -1.95 0.15 1 145 ASP 3.05 -0.35 1 146 LYS 1.18 -1.94 1 147 THR 5.29 -1.74 1 148 TRP 2.99 -1.14 1 149 GLU 3.26 0.05 1 150 GLN 4.11 -1.35 1 151 LYS 3.79 -0.39 1 152 ILE 3.94 -0.23 1 153 LYS 5.39 -1.03 1 154 THR 9.68 -2.86 1 155 VAL 5.74 -1.69 1 156 LEU 4.12 -1.63 1 157 GLN 2.84 -0.99 1 158 ASN 0.38 -0.02 1 159 ARG 2.07 -0.99 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19927_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.42 _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 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 9.68 _LACS_plot.Line_2_terminator_val_y_2 -0.94 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 145 ASP 3.05 0.83 0 154 THR 9.68 -0.17 0 128 LEU 5.29 -1.73 0 10 ASP -1.29 0.07 1 12 ALA 1.92 -0.13 1 13 THR -0.77 -0.07 1 14 ALA 0.56 0.05 1 15 ILE -0.91 0.24 1 16 GLU 2.19 -0.41 1 17 ASP 2.29 -0.31 1 18 ALA -8.42 1.24 1 19 VAL -3.53 0.21 1 20 VAL -0.61 0.49 1 21 ASN -4.55 -0.14 1 22 ALA 0.43 0.19 1 23 ALA -4.49 0.18 1 25 HIS 1.84 0.31 1 26 ARG 0.13 -0.26 1 28 GLN -3.59 0.13 1 29 VAL 4.16 -0.60 1 33 VAL 0.31 -0.13 1 35 ARG 5.61 -0.49 1 36 ALA 2.62 -0.28 1 37 VAL 5.33 -0.27 1 38 ALA 1.97 -0.42 1 39 ARG 2.93 -0.48 1 40 LYS 0.55 -0.43 1 41 TRP 5.38 0.14 1 43 GLN 3.99 -0.06 1 44 ALA 1.16 -0.33 1 45 PHE 3.57 -0.67 1 46 ARG 1.13 -0.16 1 47 ASN 1.66 -0.27 1 48 ALA 0.00 -0.52 1 49 ALA 2.37 -0.94 1 50 THR -1.10 0.09 1 52 VAL 3.73 -0.66 1 54 THR -4.53 0.12 1 55 ALA -6.26 1.39 1 56 LYS -4.14 0.20 1 57 THR 3.31 0.59 1 58 VAL -3.67 0.11 1 59 LYS -0.22 -0.09 1 61 ASP 4.73 -0.65 1 62 GLU 0.51 -0.17 1 63 THR -0.76 -0.02 1 64 TYR 0.27 -0.18 1 65 ILE -0.40 0.44 1 66 ILE -1.60 0.01 1 67 HIS 0.08 -0.36 1 68 ALA -5.51 0.58 1 69 VAL 1.59 0.06 1 72 ASN -0.65 -0.32 1 73 PHE 5.15 -0.54 1 74 ASN 2.89 -0.32 1 75 ASN -2.00 0.16 1 76 THR -2.20 0.21 1 77 SER -2.36 0.14 1 78 GLU 4.55 -0.11 1 79 ALA 3.50 -0.14 1 80 GLU 2.77 -0.60 1 82 ASP 3.87 -0.22 1 83 ARG 4.16 -0.40 1 84 ASP 3.77 -0.18 1 85 LEU 2.89 -0.44 1 86 ALA 4.53 -0.54 1 87 ALA 3.46 -0.47 1 88 ALA 4.49 -0.80 1 89 TYR 4.92 -0.46 1 90 ARG 6.14 -0.49 1 91 ALA 3.27 -0.14 1 92 VAL 6.43 -0.99 1 93 ALA 3.78 -0.71 1 94 ALA 3.78 -0.23 1 95 GLU 2.61 -0.31 1 96 ILE 4.79 -0.89 1 97 ASN 3.42 -0.32 1 98 ARG 3.51 -0.35 1 99 LEU -0.38 -0.21 1 100 SER 2.67 -0.57 1 101 ILE 0.35 -0.27 1 102 SER 1.88 -0.15 1 103 SER -4.39 1.14 1 104 VAL -6.23 1.01 1 105 ALA -6.26 1.15 1 106 ILE -7.57 0.64 1 108 LEU 0.10 0.34 1 109 LEU 0.06 -0.15 1 114 PHE -0.54 0.32 1 115 SER 1.57 -0.24 1 116 ALA 1.74 -0.10 1 118 LYS -3.44 0.10 1 121 VAL 8.28 -1.27 1 122 HIS 5.31 -0.83 1 123 GLN 3.96 -0.54 1 124 SER 2.70 -0.24 1 125 LEU 2.44 -0.44 1 127 HIS -0.27 -0.02 1 129 LEU 2.99 -0.54 1 130 ALA 2.90 -0.38 1 131 ALA 0.38 -0.09 1 132 MET 2.84 0.03 1 133 ASP 2.91 -0.10 1 134 THR 0.83 0.18 1 135 THR -4.29 0.78 1 136 GLU -2.94 0.02 1 137 ALA -0.60 -0.28 1 138 ARG 2.50 0.08 1 139 VAL -1.13 0.25 1 140 THR -1.47 0.45 1 141 ILE -1.28 0.92 1 142 TYR -1.95 -0.13 1 146 LYS 1.18 0.81 1 147 THR 5.29 -0.17 1 149 GLU 3.26 -0.64 1 150 GLN 4.11 -0.39 1 151 LYS 3.79 -0.33 1 152 ILE 3.94 -0.81 1 153 LYS 5.39 -0.66 1 155 VAL 5.74 -0.56 1 156 LEU 4.12 -0.68 1 157 GLN 2.84 -0.30 1 158 ASN 0.38 -0.08 1 159 ARG 2.07 -0.25 1 stop_ save_