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 bmr16748_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 -2.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.06 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 4.24 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 TYR -5.15 -5.00 0 13 ASN -0.17 -0.07 1 14 PHE 0.87 0.48 1 16 ASP -4.78 -1.80 1 17 ILE -5.64 -2.61 1 18 THR -2.10 -0.66 1 19 ILE -2.82 -0.98 1 20 THR -0.61 -0.66 1 22 ALA -0.65 -0.34 1 23 THR 1.83 1.48 1 24 ASN 1.69 0.90 1 25 ARG -3.57 -1.29 1 26 ASP -1.40 -1.58 1 27 VAL 4.27 3.67 1 28 ASN -2.50 -0.57 1 29 VAL -5.45 -2.75 1 30 ASP -0.21 -0.82 1 31 ARG -2.33 -0.81 1 32 SER -1.29 -0.49 1 33 ALA -5.32 -1.86 1 34 ASN 0.28 0.16 1 35 ILE -2.82 -1.80 1 36 ASP -0.79 -0.05 1 37 LEU -2.40 -1.25 1 38 SER -2.02 -1.24 1 39 PHE -5.45 -1.57 1 40 THR -1.17 0.04 1 41 ILE -2.25 0.21 1 42 ARG -5.98 -1.38 1 43 GLN -3.10 -1.10 1 45 GLN 6.91 4.87 1 46 ARG 4.37 2.55 1 48 ALA 3.24 2.32 1 49 ASP 4.06 3.01 1 50 ALA 0.44 0.05 1 52 MET 2.45 0.49 1 53 ARG -5.89 -2.07 1 54 ILE -0.13 0.55 1 55 LYS -5.90 -2.26 1 56 ALA -6.24 -1.04 1 57 TRP -2.13 1.00 1 59 GLU -1.56 0.83 1 60 ALA -3.85 -1.48 1 61 ASN 3.12 2.10 1 62 HIS 2.13 0.64 1 64 GLN 0.26 0.24 1 65 LEU -0.36 0.84 1 66 LEU -7.23 -1.44 1 67 ILE -5.71 -2.79 1 68 LYS -3.62 -1.32 1 70 GLN 2.13 2.18 1 73 ASN -1.67 -0.37 1 74 LYS 4.43 3.32 1 75 SER 3.10 1.64 1 76 ALA -1.39 -0.96 1 78 PHE -4.07 -1.31 1 79 THR 3.14 2.26 1 80 LEU 2.97 0.62 1 81 ALA -4.52 -1.48 1 82 SER 1.75 0.96 1 84 ARG -4.73 -1.25 1 85 PHE -5.16 -1.72 1 86 SER -3.92 -1.96 1 88 ILE -0.29 0.64 1 90 ASN 2.07 -0.07 1 91 ASN -1.63 -1.55 1 93 ALA -3.48 -1.41 1 94 ASN -0.90 -0.20 1 95 ILE 1.25 0.37 1 96 MET -0.55 -0.42 1 97 ASN 1.02 0.30 1 99 PHE -1.91 -1.91 1 100 VAL -1.63 -0.55 1 101 LEU -5.51 -1.92 1 102 THR 0.79 0.70 1 103 ASN 1.35 0.16 1 106 VAL 2.11 1.65 1 107 TYR -2.54 -2.26 1 108 GLN -2.78 0.03 1 109 LEU -7.10 -2.44 1 111 MET -4.72 -0.06 1 112 GLN -7.05 -2.52 1 114 SER -1.09 0.25 1 115 ILE -0.21 0.14 1 116 THR 2.02 0.10 1 118 ALA -0.57 -0.37 1 119 ILE 1.93 0.73 1 121 LEU 1.21 1.61 1 125 LEU -1.90 -0.12 1 126 TYR -4.58 -1.11 1 127 GLU -7.16 -2.47 1 128 VAL -2.62 -0.51 1 129 VAL -1.99 -0.51 1 130 LEU -5.26 -1.84 1 131 ASN -4.26 -1.84 1 132 ALA -5.79 -0.96 1 133 GLU -7.26 -2.32 1 134 LEU -3.35 -1.55 1 135 VAL -4.30 -2.38 1 136 THR -2.08 -1.31 1 137 ASN 0.95 0.98 1 138 ASP -0.64 -0.50 1 139 ASN 1.43 0.79 1 140 LYS 1.10 0.59 1 141 GLN 0.72 0.56 1 142 ASN 0.57 0.45 1 143 ALA 0.02 0.60 1 144 THR 0.09 -0.04 1 145 ALA -0.79 0.23 1 146 VAL -1.91 -0.96 1 147 ALA -0.94 0.16 1 148 LYS -5.20 -1.03 1 149 THR -3.57 -1.31 1 150 ALA -5.87 -1.34 1 151 THR -2.29 -0.26 1 152 SER -0.94 0.20 1 153 THR 0.24 0.41 1 154 ILE -4.31 -3.29 1 155 THR 1.51 0.93 1 156 VAL 0.16 -1.48 1 157 VAL -0.66 0.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16748_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 4.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.94 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -2.66 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 TYR -5.15 0.15 0 13 ASN -0.17 0.10 1 14 PHE 0.87 -0.39 1 16 ASP -4.78 2.98 1 17 ILE -5.64 3.03 1 18 THR -2.10 1.44 1 19 ILE -2.82 1.84 1 20 THR -0.61 -0.05 1 22 ALA -0.65 0.31 1 23 THR 1.83 -0.35 1 24 ASN 1.69 -0.79 1 25 ARG -3.57 2.28 1 26 ASP -1.40 -0.18 1 27 VAL 4.27 -0.60 1 28 ASN -2.50 1.93 1 29 VAL -5.45 2.70 1 30 ASP -0.21 -0.61 1 31 ARG -2.33 1.52 1 32 SER -1.29 0.80 1 33 ALA -5.32 3.46 1 34 ASN 0.28 -0.12 1 35 ILE -2.82 1.02 1 36 ASP -0.79 0.74 1 37 LEU -2.40 1.15 1 38 SER -2.02 0.78 1 39 PHE -5.45 3.88 1 40 THR -1.17 1.21 1 41 ILE -2.25 2.46 1 42 ARG -5.98 4.60 1 43 GLN -3.10 2.00 1 45 GLN 6.91 -2.04 1 46 ARG 4.37 -1.82 1 48 ALA 3.24 -0.92 1 49 ASP 4.06 -1.05 1 50 ALA 0.44 -0.39 1 52 MET 2.45 -1.96 1 53 ARG -5.89 3.82 1 54 ILE -0.13 0.68 1 55 LYS -5.90 3.64 1 56 ALA -6.24 5.20 1 57 TRP -2.13 3.13 1 59 GLU -1.56 2.39 1 60 ALA -3.85 2.37 1 61 ASN 3.12 -1.02 1 62 HIS 2.13 -1.49 1 64 GLN 0.26 -0.02 1 65 LEU -0.36 1.20 1 66 LEU -7.23 5.79 1 67 ILE -5.71 2.92 1 68 LYS -3.62 2.30 1 70 GLN 2.13 0.05 1 73 ASN -1.67 1.30 1 74 LYS 4.43 -1.11 1 75 SER 3.10 -1.46 1 76 ALA -1.39 0.43 1 78 PHE -4.07 2.76 1 79 THR 3.14 -0.88 1 80 LEU 2.97 -2.35 1 81 ALA -4.52 3.04 1 82 SER 1.75 -0.79 1 84 ARG -4.73 3.48 1 85 PHE -5.16 3.44 1 86 SER -3.92 1.96 1 88 ILE -0.29 0.93 1 90 ASN 2.07 -2.14 1 91 ASN -1.63 0.08 1 93 ALA -3.48 2.07 1 94 ASN -0.90 0.70 1 95 ILE 1.25 -0.88 1 96 MET -0.55 0.13 1 97 ASN 1.02 -0.72 1 99 PHE -1.91 0.00 1 100 VAL -1.63 1.08 1 101 LEU -5.51 3.59 1 102 THR 0.79 -0.09 1 103 ASN 1.35 -1.19 1 106 VAL 2.11 -0.46 1 107 TYR -2.54 0.28 1 108 GLN -2.78 2.81 1 109 LEU -7.10 4.66 1 111 MET -4.72 4.66 1 112 GLN -7.05 4.53 1 114 SER -1.09 1.34 1 115 ILE -0.21 0.35 1 116 THR 2.02 -1.92 1 118 ALA -0.57 0.20 1 119 ILE 1.93 -1.20 1 121 LEU 1.21 0.40 1 125 LEU -1.90 1.78 1 126 TYR -4.58 3.47 1 127 GLU -7.16 4.69 1 128 VAL -2.62 2.11 1 129 VAL -1.99 1.48 1 130 LEU -5.26 3.42 1 131 ASN -4.26 2.42 1 132 ALA -5.79 4.83 1 133 GLU -7.26 4.94 1 134 LEU -3.35 1.80 1 135 VAL -4.30 1.92 1 136 THR -2.08 0.77 1 137 ASN 0.95 0.03 1 138 ASP -0.64 0.14 1 139 ASN 1.43 -0.64 1 140 LYS 1.10 -0.51 1 141 GLN 0.72 -0.16 1 142 ASN 0.57 -0.12 1 143 ALA 0.02 0.58 1 144 THR 0.09 -0.13 1 145 ALA -0.79 1.02 1 146 VAL -1.91 0.95 1 147 ALA -0.94 1.10 1 148 LYS -5.20 4.17 1 149 THR -3.57 2.26 1 150 ALA -5.87 4.53 1 151 THR -2.29 2.03 1 152 SER -0.94 1.14 1 153 THR 0.24 0.17 1 154 ILE -4.31 1.02 1 155 THR 1.51 -0.58 1 156 VAL 0.16 -1.64 1 157 VAL -0.66 1.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16748_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 0.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 SER -1.09 1.22 0 45 GLN 6.91 -0.85 0 13 ASN -0.17 -0.01 1 14 PHE 0.87 -0.10 1 16 ASP -4.78 0.15 1 17 ILE -5.64 0.96 1 18 THR -2.10 0.23 1 19 ILE -2.82 0.70 1 20 THR -0.61 0.23 1 22 ALA -0.65 -0.20 1 23 THR 1.83 -0.46 1 24 ASN 1.69 0.02 1 25 ARG -3.57 0.47 1 26 ASP -1.40 0.82 1 27 VAL 4.27 -0.75 1 28 ASN -2.50 1.03 1 29 VAL -5.45 0.33 1 30 ASP -0.21 0.16 1 31 ARG -2.33 0.27 1 32 SER -1.29 0.11 1 33 ALA -5.32 0.34 1 34 ASN 0.28 -0.03 1 35 ILE -2.82 0.10 1 36 ASP -0.79 0.35 1 37 LEU -2.40 0.25 1 38 SER -2.02 0.70 1 39 PHE -5.45 0.27 1 40 THR -1.17 0.84 1 41 ILE -2.25 0.74 1 42 ARG -5.98 1.31 1 43 GLN -3.10 0.88 1 46 ARG 4.37 -0.13 1 48 ALA 3.24 0.25 1 49 ASP 4.06 -0.17 1 50 ALA 0.44 0.14 1 52 MET 2.45 0.26 1 53 ARG -5.89 0.79 1 54 ILE -0.13 0.15 1 55 LYS -5.90 1.51 1 56 ALA -6.24 1.36 1 57 TRP -2.13 0.43 1 59 GLU -1.56 0.06 1 60 ALA -3.85 0.16 1 61 ASN 3.12 -0.31 1 62 HIS 2.13 -0.17 1 64 GLN 0.26 -0.04 1 65 LEU -0.36 -0.04 1 66 LEU -7.23 0.61 1 67 ILE -5.71 1.23 1 68 LYS -3.62 0.68 1 70 GLN 2.13 -0.50 1 73 ASN -1.67 0.06 1 74 LYS 4.43 -0.55 1 75 SER 3.10 -0.30 1 76 ALA -1.39 0.16 1 78 PHE -4.07 0.35 1 79 THR 3.14 -0.06 1 80 LEU 2.97 -0.11 1 81 ALA -4.52 0.18 1 82 SER 1.75 -0.73 1 84 ARG -4.73 0.25 1 85 PHE -5.16 0.82 1 86 SER -3.92 0.11 1 87 TYR -5.15 0.18 1 88 ILE -0.29 -0.18 1 90 ASN 2.07 -0.02 1 91 ASN -1.63 -0.05 1 93 ALA -3.48 -0.04 1 94 ASN -0.90 -0.01 1 95 ILE 1.25 0.00 1 96 MET -0.55 0.12 1 97 ASN 1.02 -0.17 1 99 PHE -1.91 0.46 1 100 VAL -1.63 0.20 1 101 LEU -5.51 1.41 1 102 THR 0.79 -0.14 1 103 ASN 1.35 -0.14 1 106 VAL 2.11 0.35 1 107 TYR -2.54 0.54 1 108 GLN -2.78 1.02 1 109 LEU -7.10 0.87 1 111 MET -4.72 0.33 1 112 GLN -7.05 1.50 1 115 ILE -0.21 -0.08 1 116 THR 2.02 0.54 1 118 ALA -0.57 -0.20 1 119 ILE 1.93 -0.63 1 121 LEU 1.21 -0.58 1 125 LEU -1.90 0.84 1 126 TYR -4.58 0.54 1 127 GLU -7.16 1.35 1 128 VAL -2.62 0.66 1 129 VAL -1.99 0.56 1 130 LEU -5.26 0.00 1 131 ASN -4.26 0.24 1 132 ALA -5.79 1.04 1 133 GLU -7.26 0.64 1 134 LEU -3.35 0.86 1 135 VAL -4.30 0.71 1 136 THR -2.08 0.34 1 137 ASN 0.95 -0.04 1 138 ASP -0.64 -0.02 1 139 ASN 1.43 -0.23 1 140 LYS 1.10 -0.06 1 141 GLN 0.72 -0.04 1 142 ASN 0.57 -0.03 1 143 ALA 0.02 0.09 1 144 THR 0.09 -0.03 1 145 ALA -0.79 0.15 1 146 VAL -1.91 0.18 1 147 ALA -0.94 0.48 1 148 LYS -5.20 0.41 1 149 THR -3.57 0.79 1 150 ALA -5.87 0.52 1 151 THR -2.29 1.02 1 152 SER -0.94 0.42 1 153 THR 0.24 0.76 1 154 ILE -4.31 0.77 1 155 THR 1.51 0.43 1 156 VAL 0.16 0.85 1 157 VAL -0.66 0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16748_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 -2.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 1.29 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 ALA 3.24 5.29 0 13 ASN -0.17 -0.54 1 14 PHE 0.87 -0.12 1 16 ASP -4.78 -1.77 1 17 ILE -5.64 -1.12 1 18 THR -2.10 -0.57 1 19 ILE -2.82 -1.06 1 20 THR -0.61 -0.16 1 22 ALA -0.65 0.32 1 23 THR 1.83 -0.84 1 24 ASN 1.69 0.27 1 25 ARG -3.57 -2.62 1 26 ASP -1.40 0.08 1 27 VAL 4.27 -3.02 1 29 VAL -5.45 -3.02 1 30 ASP -0.21 -2.02 1 31 ARG -2.33 -0.88 1 32 SER -1.29 -1.47 1 33 ALA -5.32 -1.02 1 34 ASN 0.28 -0.15 1 35 ILE -2.82 -1.90 1 36 ASP -0.79 -1.55 1 37 LEU -2.40 -3.06 1 38 SER -2.02 -1.73 1 39 PHE -5.45 0.13 1 40 THR -1.17 -1.99 1 41 ILE -2.25 -2.51 1 42 ARG -5.98 -1.76 1 43 GLN -3.10 -1.63 1 45 GLN 6.91 1.80 1 46 ARG 4.37 2.32 1 49 ASP 4.06 0.36 1 50 ALA 0.44 -0.44 1 52 MET 2.45 0.42 1 53 ARG -5.89 -2.01 1 54 ILE -0.13 -2.87 1 55 LYS -5.90 -1.37 1 56 ALA -6.24 -1.51 1 57 TRP -2.13 -1.76 1 59 GLU -1.56 -0.21 1 60 ALA -3.85 -0.09 1 61 ASN 3.12 1.78 1 62 HIS 2.13 0.03 1 64 GLN 0.26 -1.48 1 65 LEU -0.36 -1.50 1 66 LEU -7.23 -2.86 1 67 ILE -5.71 -3.42 1 68 LYS -3.62 -3.06 1 70 GLN 2.13 1.23 1 73 ASN -1.67 1.42 1 74 LYS 4.43 1.76 1 75 SER 3.10 -0.09 1 76 ALA -1.39 -1.52 1 78 PHE -4.07 -0.52 1 79 THR 3.14 -0.02 1 80 LEU 2.97 -0.79 1 81 ALA -4.52 -0.75 1 82 SER 1.75 -1.89 1 84 ARG -4.73 -2.02 1 85 PHE -5.16 -0.97 1 86 SER -3.92 -2.41 1 87 TYR -5.15 -0.80 1 90 ASN 2.07 -1.13 1 91 ASN -1.63 -1.61 1 93 ALA -3.48 -1.27 1 94 ASN -0.90 -0.57 1 95 ILE 1.25 -0.92 1 96 MET -0.55 -1.10 1 97 ASN 1.02 -0.70 1 99 PHE -1.91 -2.70 1 100 VAL -1.63 -2.59 1 101 LEU -5.51 0.11 1 102 THR 0.79 -0.17 1 103 ASN 1.35 0.05 1 106 VAL 2.11 0.15 1 107 TYR -2.54 -3.01 1 108 GLN -2.78 -3.98 1 109 LEU -7.10 -3.74 1 111 MET -4.72 -2.84 1 112 GLN -7.05 -0.47 1 114 SER -1.09 -0.56 1 115 ILE -0.21 0.82 1 116 THR 2.02 2.63 1 118 ALA -0.57 0.33 1 125 LEU -1.90 -0.56 1 126 TYR -4.58 -1.61 1 127 GLU -7.16 -1.46 1 128 VAL -2.62 -1.81 1 129 VAL -1.99 -2.07 1 130 LEU -5.26 -4.35 1 131 ASN -4.26 -2.01 1 132 ALA -5.79 -3.09 1 133 GLU -7.26 -2.91 1 134 LEU -3.35 -0.95 1 135 VAL -4.30 -0.58 1 136 THR -2.08 -0.04 1 137 ASN 0.95 -0.22 1 138 ASP -0.64 -0.49 1 140 LYS 1.10 0.45 1 141 GLN 0.72 -0.05 1 142 ASN 0.57 0.08 1 143 ALA 0.02 0.12 1 144 THR 0.09 -0.57 1 145 ALA -0.79 -0.87 1 146 VAL -1.91 -1.52 1 147 ALA -0.94 -0.57 1 148 LYS -5.20 -1.79 1 149 THR -3.57 -1.19 1 150 ALA -5.87 -2.85 1 151 THR -2.29 -0.50 1 152 SER -0.94 -1.09 1 153 THR 0.24 -0.86 1 154 ILE -4.31 -1.77 1 155 THR 1.51 -1.78 1 156 VAL 0.16 -0.55 1 157 VAL -0.66 3.15 1 stop_ save_