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 bmr17656_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -3.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.48 _LACS_plot.Line_2_terminator_val_x_2 9.39 _LACS_plot.Line_2_terminator_val_y_2 7.19 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 SER -0.40 3.60 0 95 THR -6.70 -1.70 0 64 ILE 5.20 0.10 0 10 ILE 1.90 2.90 1 12 ASN -4.40 -2.80 1 13 ALA 3.60 1.90 1 14 GLU 4.00 2.30 1 17 ARG 4.00 3.00 1 18 ARG 1.60 2.00 1 19 ASP -2.70 -1.40 1 21 TYR 4.10 1.50 1 22 MET 0.10 -1.40 1 25 ALA 1.70 1.00 1 27 VAL 1.70 0.80 1 28 TRP -1.70 -1.20 1 29 THR 0.10 0.00 1 30 ASP 0.30 0.00 1 32 ILE 0.70 0.40 1 34 ASN 0.20 0.00 1 35 THR 0.40 0.20 1 36 HIS 0.70 0.40 1 38 VAL 0.30 0.10 1 39 THR 0.10 -0.10 1 42 VAL -0.10 0.00 1 43 ARG -0.50 -0.40 1 44 LYS -1.30 -0.10 1 45 THR -1.90 -0.90 1 46 ASP 4.60 3.20 1 47 GLN 4.60 3.40 1 48 GLN 3.30 2.80 1 49 ILE 4.40 3.80 1 50 ALA 3.80 2.60 1 51 ALA 3.70 2.80 1 52 ASP 1.70 1.20 1 53 TRP 3.80 4.80 1 54 GLU 4.30 2.50 1 55 LYS 5.00 3.60 1 56 ASN 3.40 3.50 1 57 ILE 8.30 6.90 1 58 LEU 4.70 3.20 1 59 ILE 4.90 4.50 1 60 ALA 3.30 2.70 1 61 GLU 5.20 3.90 1 62 ARG 5.10 3.70 1 65 ASN 3.90 3.30 1 66 GLN 3.00 2.90 1 67 HIS -1.90 0.80 1 68 PHE -0.50 -0.60 1 69 ARG 5.70 2.20 1 71 LYS 3.70 2.50 1 72 ASP -0.80 0.40 1 73 MET -0.60 0.60 1 75 ASP 4.40 4.10 1 76 ASN 6.70 4.00 1 77 ALA 4.30 2.90 1 78 PHE 4.90 4.90 1 80 ALA 1.50 2.90 1 81 MET 4.50 0.10 1 82 THR 5.70 6.40 1 83 SER -0.40 3.40 1 84 ALA 4.50 3.20 1 85 ALA 3.40 2.30 1 86 PHE 3.40 3.20 1 87 ASN 0.10 2.60 1 88 MET -0.10 -1.00 1 91 ASN 5.00 3.60 1 92 SER 3.10 2.30 1 93 LEU -0.60 0.30 1 94 ARG 0.70 3.40 1 96 TYR -4.90 -2.50 1 97 TYR 1.60 1.20 1 98 SER -3.20 -3.60 1 99 LYS 3.80 2.80 1 100 ALA 2.60 2.20 1 101 ARG -1.20 -0.90 1 103 MET -3.80 -1.40 1 104 ARG 0.70 0.00 1 105 VAL -5.30 -2.90 1 106 GLU -1.00 -0.20 1 107 THR -2.30 -1.10 1 109 ILE 6.40 6.30 1 110 HIS 5.80 6.10 1 111 LYS 4.80 3.60 1 112 TRP 1.70 1.80 1 113 ALA 2.10 2.90 1 114 GLN 4.20 2.20 1 115 LYS -0.70 0.00 1 117 GLU -1.00 -2.90 1 118 TRP -1.10 0.60 1 119 VAL 6.60 5.00 1 120 ASN 6.10 2.80 1 121 MET 3.40 5.00 1 123 ASN 2.50 1.50 1 124 HIS 1.90 2.10 1 125 LEU 9.40 7.90 1 127 ASP 3.50 1.30 1 128 PHE 2.00 0.60 1 129 VAL -1.60 -2.20 1 130 ASN -2.70 -1.00 1 131 SER -2.00 -1.40 1 132 ASN 2.20 1.20 1 134 VAL -2.50 -0.80 1 136 LEU -3.20 -2.00 1 137 ARG 4.90 3.70 1 139 LEU 3.00 1.70 1 140 LYS 5.30 4.20 1 141 ILE 3.60 3.10 1 142 ARG 4.30 3.70 1 143 ARG -1.30 1.60 1 146 GLU 2.40 2.30 1 147 ARG 4.90 4.50 1 148 GLN 4.30 2.80 1 149 LEU 6.00 3.90 1 151 LEU -1.20 0.10 1 152 THR 6.40 4.70 1 154 LEU -0.70 0.00 1 155 VAL -1.40 -0.90 1 156 ASN -0.10 -0.30 1 157 GLU -0.50 -0.40 1 158 HIS 0.60 0.20 1 159 HIS 0.30 0.20 1 160 HIS 0.20 0.20 1 161 HIS 0.10 0.20 1 162 HIS 0.20 0.30 1 163 HIS 1.70 2.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17656_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 3.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.52 _LACS_plot.Line_2_terminator_val_x_2 9.39 _LACS_plot.Line_2_terminator_val_y_2 -2.20 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 SER -0.40 4.00 0 95 THR -6.70 5.00 0 64 ILE 5.20 -5.10 0 10 ILE 1.90 1.00 1 12 ASN -4.40 1.60 1 13 ALA 3.60 -1.70 1 14 GLU 4.00 -1.70 1 17 ARG 4.00 -1.00 1 18 ARG 1.60 0.40 1 19 ASP -2.70 1.30 1 21 TYR 4.10 -2.60 1 22 MET 0.10 -1.50 1 25 ALA 1.70 -0.70 1 27 VAL 1.70 -0.90 1 28 TRP -1.70 0.50 1 29 THR 0.10 -0.10 1 30 ASP 0.30 -0.30 1 32 ILE 0.70 -0.30 1 34 ASN 0.20 -0.20 1 35 THR 0.40 -0.20 1 36 HIS 0.70 -0.30 1 38 VAL 0.30 -0.20 1 39 THR 0.10 -0.20 1 42 VAL -0.10 0.10 1 43 ARG -0.50 0.10 1 44 LYS -1.30 1.20 1 45 THR -1.90 1.00 1 46 ASP 4.60 -1.40 1 47 GLN 4.60 -1.20 1 48 GLN 3.30 -0.50 1 49 ILE 4.40 -0.60 1 50 ALA 3.80 -1.20 1 51 ALA 3.70 -0.90 1 52 ASP 1.70 -0.50 1 53 TRP 3.80 1.00 1 54 GLU 4.30 -1.80 1 55 LYS 5.00 -1.40 1 56 ASN 3.40 0.10 1 57 ILE 8.30 -1.40 1 58 LEU 4.70 -1.50 1 59 ILE 4.90 -0.40 1 60 ALA 3.30 -0.60 1 61 GLU 5.20 -1.30 1 62 ARG 5.10 -1.40 1 65 ASN 3.90 -0.60 1 66 GLN 3.00 -0.10 1 67 HIS -1.90 2.70 1 68 PHE -0.50 -0.10 1 69 ARG 5.70 -3.50 1 71 LYS 3.70 -1.20 1 72 ASP -0.80 1.20 1 73 MET -0.60 1.20 1 75 ASP 4.40 -0.30 1 76 ASN 6.70 -2.70 1 77 ALA 4.30 -1.40 1 78 PHE 4.90 0.00 1 80 ALA 1.50 1.40 1 81 MET 4.50 -4.40 1 82 THR 5.70 0.70 1 83 SER -0.40 3.80 1 84 ALA 4.50 -1.30 1 85 ALA 3.40 -1.10 1 86 PHE 3.40 -0.20 1 87 ASN 0.10 2.50 1 88 MET -0.10 -0.90 1 91 ASN 5.00 -1.40 1 92 SER 3.10 -0.80 1 93 LEU -0.60 0.90 1 94 ARG 0.70 2.70 1 96 TYR -4.90 2.40 1 97 TYR 1.60 -0.40 1 98 SER -3.20 -0.40 1 99 LYS 3.80 -1.00 1 100 ALA 2.60 -0.40 1 101 ARG -1.20 0.30 1 103 MET -3.80 2.40 1 104 ARG 0.70 -0.70 1 105 VAL -5.30 2.40 1 106 GLU -1.00 0.80 1 107 THR -2.30 1.20 1 109 ILE 6.40 -0.10 1 110 HIS 5.80 0.30 1 111 LYS 4.80 -1.20 1 112 TRP 1.70 0.10 1 113 ALA 2.10 0.80 1 114 GLN 4.20 -2.00 1 115 LYS -0.70 0.70 1 117 GLU -1.00 -1.90 1 118 TRP -1.10 1.70 1 119 VAL 6.60 -1.60 1 120 ASN 6.10 -3.30 1 121 MET 3.40 1.60 1 123 ASN 2.50 -1.00 1 124 HIS 1.90 0.20 1 125 LEU 9.40 -1.50 1 127 ASP 3.50 -2.20 1 128 PHE 2.00 -1.40 1 129 VAL -1.60 -0.60 1 130 ASN -2.70 1.70 1 131 SER -2.00 0.60 1 132 ASN 2.20 -1.00 1 134 VAL -2.50 1.70 1 136 LEU -3.20 1.20 1 137 ARG 4.90 -1.20 1 139 LEU 3.00 -1.30 1 140 LYS 5.30 -1.10 1 141 ILE 3.60 -0.50 1 142 ARG 4.30 -0.60 1 143 ARG -1.30 2.90 1 146 GLU 2.40 -0.10 1 147 ARG 4.90 -0.40 1 148 GLN 4.30 -1.50 1 149 LEU 6.00 -2.10 1 151 LEU -1.20 1.30 1 152 THR 6.40 -1.70 1 154 LEU -0.70 0.70 1 155 VAL -1.40 0.50 1 156 ASN -0.10 -0.20 1 157 GLU -0.50 0.10 1 158 HIS 0.60 -0.40 1 159 HIS 0.30 -0.10 1 160 HIS 0.20 0.00 1 161 HIS 0.10 0.10 1 162 HIS 0.20 0.10 1 163 HIS 1.70 0.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17656_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 0.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _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 9.39 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 ALA 3.60 -1.78 0 10 ILE 1.90 -0.81 1 12 ASN -4.40 -0.32 1 14 GLU 4.00 -0.45 1 17 ARG 4.00 -0.36 1 18 ARG 1.60 -0.23 1 19 ASP -2.70 0.20 1 21 TYR 4.10 -0.26 1 22 MET 0.10 0.07 1 25 ALA 1.70 -0.38 1 27 VAL 1.70 -0.09 1 28 TRP -1.70 0.21 1 29 THR 0.10 -0.05 1 30 ASP 0.30 -0.02 1 32 ILE 0.70 -0.12 1 34 ASN 0.20 0.02 1 35 THR 0.40 -0.05 1 36 HIS 0.70 -0.05 1 38 VAL 0.30 0.06 1 39 THR 0.10 -0.01 1 42 VAL -0.10 0.03 1 43 ARG -0.50 0.02 1 44 LYS -1.30 0.14 1 45 THR -1.90 0.33 1 46 ASP 4.60 -0.28 1 47 GLN 4.60 -0.25 1 48 GLN 3.30 -0.30 1 49 ILE 4.40 -0.36 1 50 ALA 3.80 -0.18 1 51 ALA 3.70 -0.18 1 52 ASP 1.70 0.14 1 53 TRP 3.80 -0.39 1 54 GLU 4.30 -0.23 1 55 LYS 5.00 -0.28 1 56 ASN 3.40 -0.12 1 57 ILE 8.30 -0.46 1 58 LEU 4.70 -0.28 1 59 ILE 4.90 -0.52 1 60 ALA 3.30 0.30 1 61 GLU 5.20 -0.42 1 62 ARG 5.10 -0.17 1 64 ILE 5.20 -0.14 1 65 ASN 3.90 -0.13 1 66 GLN 3.00 -0.24 1 67 HIS -1.90 -0.28 1 68 PHE -0.50 -0.17 1 69 ARG 5.70 -0.36 1 71 LYS 3.70 -0.43 1 72 ASP -0.80 0.13 1 73 MET -0.60 -1.23 1 75 ASP 4.40 -0.50 1 76 ASN 6.70 -0.35 1 77 ALA 4.30 0.10 1 78 PHE 4.90 -0.55 1 80 ALA 1.50 -0.54 1 81 MET 4.50 -0.30 1 83 SER -0.40 -0.48 1 84 ALA 4.50 -0.20 1 85 ALA 3.40 -0.72 1 86 PHE 3.40 0.26 1 87 ASN 0.10 -0.37 1 88 MET -0.10 0.35 1 91 ASN 5.00 -0.53 1 92 SER 3.10 0.08 1 93 LEU -0.60 -0.25 1 94 ARG 0.70 -0.31 1 95 THR -6.70 1.08 1 96 TYR -4.90 0.47 1 97 TYR 1.60 -0.45 1 98 SER -3.20 0.14 1 99 LYS 3.80 -0.37 1 100 ALA 2.60 -0.23 1 101 ARG -1.20 -0.05 1 103 MET -3.80 0.20 1 104 ARG 0.70 0.43 1 105 VAL -5.30 0.23 1 106 GLU -1.00 -0.09 1 107 THR -2.30 0.24 1 108 SER -0.40 0.17 1 109 ILE 6.40 -0.01 1 110 HIS 5.80 -0.64 1 111 LYS 4.80 -0.53 1 112 TRP 1.70 0.03 1 113 ALA 2.10 0.08 1 114 GLN 4.20 -0.77 1 115 LYS -0.70 -0.11 1 117 GLU -1.00 -0.16 1 118 TRP -1.10 0.07 1 119 VAL 6.60 -0.80 1 120 ASN 6.10 -0.65 1 121 MET 3.40 -0.37 1 123 ASN 2.50 -0.19 1 124 HIS 1.90 -0.25 1 125 LEU 9.40 -0.19 1 127 ASP 3.50 -0.37 1 128 PHE 2.00 -0.18 1 129 VAL -1.60 0.43 1 130 ASN -2.70 0.57 1 131 SER -2.00 0.19 1 132 ASN 2.20 -0.29 1 134 VAL -2.50 0.21 1 136 LEU -3.20 0.43 1 137 ARG 4.90 -0.45 1 139 LEU 3.00 -0.02 1 140 LYS 5.30 -0.38 1 141 ILE 3.60 -0.46 1 142 ARG 4.30 -0.31 1 146 GLU 2.40 -0.55 1 147 ARG 4.90 -0.59 1 148 GLN 4.30 -0.49 1 151 LEU -1.20 -0.38 1 152 THR 6.40 -0.39 1 154 LEU -0.70 0.21 1 155 VAL -1.40 0.13 1 156 ASN -0.10 -0.02 1 157 GLU -0.50 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17656_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.70 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.31 _LACS_plot.Line_2_terminator_val_x_2 9.39 _LACS_plot.Line_2_terminator_val_y_2 3.32 _LACS_plot.Y_axis_chem_shift_offset -0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 125 LEU 9.40 -0.20 0 68 PHE -0.50 -4.60 0 10 ILE 1.90 1.70 1 12 ASN -4.40 0.40 1 13 ALA 3.60 2.20 1 14 GLU 4.00 1.70 1 17 ARG 4.00 1.80 1 18 ARG 1.60 -0.20 1 19 ASP -2.70 -2.40 1 21 TYR 4.10 0.40 1 22 MET 0.10 0.20 1 25 ALA 1.70 0.80 1 27 VAL 1.70 -0.90 1 28 TRP -1.70 0.10 1 29 THR 0.10 -0.70 1 30 ASP 0.30 0.00 1 32 ILE 0.70 0.30 1 34 ASN 0.20 0.40 1 35 THR 0.40 0.40 1 36 HIS 0.70 0.40 1 38 VAL 0.30 -0.10 1 39 THR 0.10 -0.60 1 42 VAL -0.10 -0.60 1 43 ARG -0.50 0.00 1 44 LYS -1.30 -0.10 1 45 THR -1.90 0.40 1 46 ASP 4.60 2.50 1 47 GLN 4.60 2.60 1 48 GLN 3.30 2.30 1 49 ILE 4.40 2.40 1 50 ALA 3.80 2.70 1 51 ALA 3.70 2.50 1 52 ASP 1.70 0.70 1 53 TRP 3.80 1.40 1 54 GLU 4.30 2.60 1 55 LYS 5.00 2.40 1 56 ASN 3.40 3.50 1 57 ILE 8.30 0.90 1 58 LEU 4.70 3.30 1 59 ILE 4.90 2.00 1 60 ALA 3.30 1.20 1 61 GLU 5.20 2.00 1 62 ARG 5.10 1.80 1 64 ILE 5.20 4.60 1 65 ASN 3.90 2.60 1 66 GLN 3.00 2.70 1 67 HIS -1.90 -0.10 1 69 ARG 5.70 1.70 1 71 LYS 3.70 0.70 1 72 ASP -0.80 -1.20 1 73 MET -0.60 -0.90 1 75 ASP 4.40 3.00 1 76 ASN 6.70 1.80 1 77 ALA 4.30 -0.10 1 78 PHE 4.90 2.50 1 80 ALA 1.50 0.60 1 81 MET 4.50 2.10 1 82 THR 5.70 1.50 1 83 SER -0.40 1.70 1 84 ALA 4.50 1.90 1 85 ALA 3.40 3.40 1 86 PHE 3.40 0.40 1 87 ASN 0.10 0.50 1 88 MET -0.10 2.20 1 91 ASN 5.00 2.90 1 92 SER 3.10 -1.20 1 93 LEU -0.60 1.00 1 94 ARG 0.70 1.40 1 95 THR -6.70 -2.80 1 96 TYR -4.90 -3.20 1 97 TYR 1.60 -2.10 1 98 SER -3.20 -0.20 1 99 LYS 3.80 2.00 1 100 ALA 2.60 1.50 1 101 ARG -1.20 0.40 1 103 MET -3.80 -2.70 1 104 ARG 0.70 -0.50 1 105 VAL -5.30 -2.30 1 106 GLU -1.00 0.10 1 107 THR -2.30 1.40 1 108 SER -0.40 1.80 1 109 ILE 6.40 -1.00 1 110 HIS 5.80 1.80 1 111 LYS 4.80 3.60 1 112 TRP 1.70 2.50 1 113 ALA 2.10 2.50 1 114 GLN 4.20 2.70 1 115 LYS -0.70 -0.20 1 117 GLU -1.00 -0.60 1 118 TRP -1.10 1.00 1 119 VAL 6.60 0.70 1 120 ASN 6.10 2.00 1 121 MET 3.40 1.60 1 123 ASN 2.50 0.90 1 124 HIS 1.90 0.80 1 127 ASP 3.50 1.80 1 128 PHE 2.00 -1.00 1 129 VAL -1.60 -2.80 1 130 ASN -2.70 0.80 1 131 SER -2.00 1.10 1 132 ASN 2.20 0.10 1 134 VAL -2.50 -1.50 1 136 LEU -3.20 -0.20 1 137 ARG 4.90 1.80 1 139 LEU 3.00 0.30 1 140 LYS 5.30 3.00 1 141 ILE 3.60 1.90 1 142 ARG 4.30 1.70 1 143 ARG -1.30 3.00 1 146 GLU 2.40 1.50 1 147 ARG 4.90 0.90 1 148 GLN 4.30 3.60 1 149 LEU 6.00 0.40 1 151 LEU -1.20 1.40 1 152 THR 6.40 1.50 1 154 LEU -0.70 -0.40 1 155 VAL -1.40 -1.00 1 156 ASN -0.10 -0.20 1 157 GLU -0.50 -0.60 1 158 HIS 0.60 0.10 1 159 HIS 0.30 0.10 1 160 HIS 0.20 0.00 1 161 HIS 0.10 -0.10 1 162 HIS 0.20 -0.50 1 163 HIS 1.70 4.70 1 stop_ save_