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 bmr27607_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.72 _LACS_plot.Line_1_terminator_val_y_1 -2.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.28 _LACS_plot.Line_2_terminator_val_x_2 8.54 _LACS_plot.Line_2_terminator_val_y_2 6.29 _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 99 HIS 2.31 4.54 0 10 PHE -3.80 0.11 1 11 ASP 0.03 -0.39 1 12 GLN -5.64 -1.67 1 13 THR 1.46 1.01 1 14 LEU -4.96 -1.72 1 15 ILE 0.66 -0.60 1 16 ALA -6.98 -2.31 1 17 SER 0.22 0.12 1 18 LEU -2.21 -1.18 1 19 LEU -2.19 -0.85 1 20 GLN -3.44 -1.08 1 22 LEU 1.20 1.23 1 23 SER -1.51 -0.67 1 24 LEU 1.56 1.42 1 25 ASN 0.60 0.56 1 26 GLN -1.17 -0.08 1 28 ASP -0.75 -0.19 1 29 PHE -1.64 -0.01 1 30 LYS -1.95 -0.78 1 31 ALA -3.18 -1.12 1 32 TYR -2.72 -1.32 1 33 LYS -0.65 -0.38 1 34 THR -2.07 -1.24 1 35 LYS -0.80 -0.14 1 36 VAL -5.22 -2.86 1 37 LYS 0.03 -0.96 1 38 LEU -5.00 -1.68 1 39 LYS -5.26 -1.92 1 40 ILE -3.05 -1.40 1 41 SER -3.63 -1.41 1 42 GLU -4.36 -1.69 1 43 GLN -3.88 -1.83 1 44 ARG -3.17 -2.26 1 45 ASN 0.78 2.16 1 46 GLU 2.64 2.72 1 47 THR 3.61 2.86 1 48 SER -1.81 0.02 1 50 GLU -1.32 0.05 1 51 LYS 2.15 1.97 1 52 GLU -7.72 -2.43 1 53 LEU -6.58 -2.18 1 54 LYS -3.38 -0.84 1 55 PHE -4.08 -0.94 1 56 GLU -6.25 -1.14 1 57 ILE -5.24 -2.54 1 58 SER -4.07 -1.09 1 60 SER 2.84 2.01 1 61 ASP 0.08 -0.74 1 62 ASP -0.55 -0.20 1 63 PHE 2.19 1.15 1 66 LEU -1.81 0.17 1 67 PHE -6.63 -2.05 1 68 SER -5.02 -1.18 1 69 GLU -5.29 -0.25 1 70 THR -0.82 -0.17 1 71 LEU -4.32 -0.48 1 72 ASN -3.45 -2.32 1 73 ASN 4.31 4.50 1 74 GLU 4.35 3.76 1 75 LYS 1.95 3.40 1 76 TYR 3.97 4.12 1 77 GLN 4.61 3.16 1 78 ILE 4.00 3.44 1 79 LEU 2.90 3.27 1 80 ALA 4.66 2.72 1 81 ARG 3.65 2.70 1 82 ASP 3.29 2.53 1 83 HIS 0.27 1.51 1 84 ASP 2.94 1.35 1 85 LEU 2.55 -0.55 1 88 ASP 0.62 -1.15 1 89 PHE 1.03 1.07 1 90 ASP 2.80 2.45 1 91 ALA -0.11 0.41 1 92 PHE 8.54 6.04 1 94 LYS 4.48 3.41 1 95 VAL 4.76 3.80 1 96 ILE 4.24 2.41 1 97 ILE 6.51 5.08 1 98 GLN 4.92 3.52 1 100 LEU 1.57 1.66 1 101 LEU 0.21 0.23 1 103 LYS 0.37 0.31 1 104 ASN 0.35 0.59 1 105 ILE 0.19 0.32 1 106 VAL 0.55 0.28 1 107 LYS -0.14 0.08 1 108 ASN 0.10 0.18 1 109 LEU 0.62 0.55 1 110 GLU 0.13 0.32 1 111 GLU -0.22 0.22 1 112 ASP 0.27 0.56 1 114 GLU -0.04 0.23 1 115 VAL 1.80 1.38 1 116 ASP 0.87 0.98 1 117 ALA 1.85 1.58 1 118 ARG 2.19 1.49 1 119 LYS 1.36 1.02 1 120 LYS 0.87 0.73 1 121 ALA 0.45 0.46 1 123 TYR 0.51 0.50 1 124 HIS -0.84 0.94 1 125 GLU -0.69 -0.10 1 126 ILE -0.03 -0.02 1 127 ALA -0.43 -0.15 1 128 ASP -0.77 -0.05 1 131 LYS -0.68 -0.28 1 133 THR -2.12 -0.56 1 134 GLU -4.08 -0.98 1 135 ILE -2.94 -1.24 1 136 ASN -4.90 -1.82 1 137 ILE -2.79 -1.84 1 138 ILE -1.02 -0.46 1 139 LEU -1.73 -0.26 1 140 ASP -2.95 -0.81 1 141 ALA 3.70 3.16 1 142 GLU -0.23 -0.40 1 144 ASN 1.55 2.03 1 145 PHE -3.13 -1.31 1 147 SER -1.00 -1.00 1 148 PHE -2.05 -0.71 1 149 GLU -5.18 -1.90 1 150 LEU -5.21 -1.87 1 151 PHE -3.98 -1.23 1 152 SER -2.09 -1.38 1 153 LYS -0.39 -0.24 1 154 THR 0.75 0.14 1 156 GLU 0.94 0.86 1 157 SER -1.38 -0.65 1 158 LYS -0.22 0.08 1 160 LYS 1.92 0.99 1 161 ILE 0.97 0.91 1 163 SER -3.83 -2.14 1 164 ILE -3.99 -1.26 1 165 LYS -0.14 -0.38 1 166 LEU -3.65 -1.43 1 167 HIS -2.07 1.43 1 168 ALA 1.24 0.71 1 169 VAL 1.58 0.68 1 170 ARG -0.31 0.87 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27607_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.72 _LACS_plot.Line_1_terminator_val_y_1 4.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.72 _LACS_plot.Line_2_terminator_val_x_2 8.54 _LACS_plot.Line_2_terminator_val_y_2 -2.25 _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 99 HIS 2.31 2.23 0 10 PHE -3.80 3.91 1 11 ASP 0.03 -0.42 1 12 GLN -5.64 3.97 1 13 THR 1.46 -0.45 1 14 LEU -4.96 3.24 1 15 ILE 0.66 -1.26 1 16 ALA -6.98 4.67 1 17 SER 0.22 -0.10 1 18 LEU -2.21 1.03 1 19 LEU -2.19 1.34 1 20 GLN -3.44 2.36 1 22 LEU 1.20 0.03 1 23 SER -1.51 0.84 1 24 LEU 1.56 -0.14 1 25 ASN 0.60 -0.04 1 26 GLN -1.17 1.09 1 28 ASP -0.75 0.56 1 29 PHE -1.64 1.63 1 30 LYS -1.95 1.17 1 31 ALA -3.18 2.06 1 32 TYR -2.72 1.40 1 33 LYS -0.65 0.27 1 34 THR -2.07 0.83 1 35 LYS -0.80 0.66 1 36 VAL -5.22 2.36 1 37 LYS 0.03 -0.99 1 38 LEU -5.00 3.32 1 39 LYS -5.26 3.34 1 40 ILE -3.05 1.65 1 41 SER -3.63 2.22 1 42 GLU -4.36 2.67 1 43 GLN -3.88 2.05 1 44 ARG -3.17 0.91 1 45 ASN 0.78 1.38 1 46 GLU 2.64 0.08 1 47 THR 3.61 -0.75 1 48 SER -1.81 1.83 1 50 GLU -1.32 1.37 1 51 LYS 2.15 -0.18 1 52 GLU -7.72 5.29 1 53 LEU -6.58 4.40 1 54 LYS -3.38 2.54 1 55 PHE -4.08 3.14 1 56 GLU -6.25 5.11 1 57 ILE -5.24 2.70 1 58 SER -4.07 2.98 1 60 SER 2.84 -0.83 1 61 ASP 0.08 -0.82 1 62 ASP -0.55 0.35 1 63 PHE 2.19 -1.04 1 66 LEU -1.81 1.98 1 67 PHE -6.63 4.58 1 68 SER -5.02 3.84 1 69 GLU -5.29 5.04 1 70 THR -0.82 0.65 1 71 LEU -4.32 3.84 1 72 ASN -3.45 1.13 1 73 ASN 4.31 0.19 1 74 GLU 4.35 -0.59 1 75 LYS 1.95 1.45 1 76 TYR 3.97 0.15 1 77 GLN 4.61 -1.45 1 78 ILE 4.00 -0.56 1 79 LEU 2.90 0.37 1 80 ALA 4.66 -1.94 1 81 ARG 3.65 -0.95 1 82 ASP 3.29 -0.76 1 83 HIS 0.27 1.24 1 84 ASP 2.94 -1.59 1 85 LEU 2.55 -3.10 1 88 ASP 0.62 -1.77 1 89 PHE 1.03 0.04 1 90 ASP 2.80 -0.35 1 91 ALA -0.11 0.52 1 92 PHE 8.54 -2.50 1 94 LYS 4.48 -1.07 1 95 VAL 4.76 -0.96 1 96 ILE 4.24 -1.83 1 97 ILE 6.51 -1.43 1 98 GLN 4.92 -1.40 1 100 LEU 1.57 0.09 1 101 LEU 0.21 0.02 1 103 LYS 0.37 -0.06 1 104 ASN 0.35 0.24 1 105 ILE 0.19 0.13 1 106 VAL 0.55 -0.27 1 107 LYS -0.14 0.22 1 108 ASN 0.10 0.08 1 109 LEU 0.62 -0.07 1 110 GLU 0.13 0.19 1 111 GLU -0.22 0.44 1 112 ASP 0.27 0.29 1 114 GLU -0.04 0.27 1 115 VAL 1.80 -0.42 1 116 ASP 0.87 0.11 1 117 ALA 1.85 -0.27 1 118 ARG 2.19 -0.70 1 119 LYS 1.36 -0.34 1 120 LYS 0.87 -0.14 1 121 ALA 0.45 0.01 1 123 TYR 0.51 -0.01 1 124 HIS -0.84 1.78 1 125 GLU -0.69 0.59 1 126 ILE -0.03 0.01 1 127 ALA -0.43 0.28 1 128 ASP -0.77 0.72 1 131 LYS -0.68 0.40 1 133 THR -2.12 1.56 1 134 GLU -4.08 3.10 1 135 ILE -2.94 1.70 1 136 ASN -4.90 3.08 1 137 ILE -2.79 0.95 1 138 ILE -1.02 0.56 1 139 LEU -1.73 1.47 1 140 ASP -2.95 2.14 1 141 ALA 3.70 -0.54 1 142 GLU -0.23 -0.17 1 144 ASN 1.55 0.48 1 145 PHE -3.13 1.82 1 147 SER -1.00 0.00 1 148 PHE -2.05 1.34 1 149 GLU -5.18 3.28 1 150 LEU -5.21 3.34 1 151 PHE -3.98 2.75 1 152 SER -2.09 0.71 1 153 LYS -0.39 0.15 1 154 THR 0.75 -0.61 1 156 GLU 0.94 -0.08 1 157 SER -1.38 0.73 1 158 LYS -0.22 0.30 1 160 LYS 1.92 -0.93 1 161 ILE 0.97 -0.06 1 163 SER -3.83 1.69 1 164 ILE -3.99 2.73 1 165 LYS -0.14 -0.24 1 166 LEU -3.65 2.22 1 167 HIS -2.07 3.50 1 168 ALA 1.24 -0.53 1 169 VAL 1.58 -0.90 1 170 ARG -0.31 1.18 1 stop_ save_