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 bmr25138_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 -2.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.52 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 4.47 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 HIS 4.00 6.30 0 10 GLN 4.90 3.80 1 11 ALA 4.00 2.50 1 12 TYR 4.50 4.00 1 13 ALA 4.40 3.30 1 14 LEU 3.10 2.20 1 15 GLN 3.60 2.30 1 16 HIS 0.40 0.90 1 17 ASN 3.50 1.20 1 18 LEU -4.10 -2.30 1 19 GLU 0.70 0.10 1 20 LEU 3.20 0.90 1 22 VAL -2.50 -0.90 1 23 TYR -1.00 0.20 1 24 ALA -3.60 -1.30 1 25 ASN -6.60 -0.90 1 26 GLU -5.50 -1.90 1 27 ARG -4.20 -2.10 1 28 GLU -5.50 -2.30 1 32 HIS -0.30 0.70 1 33 ALA -0.20 0.00 1 35 ARG -4.10 -1.90 1 36 PHE -4.80 -0.50 1 37 ARG -4.00 -0.90 1 39 ASN -5.70 -2.20 1 40 VAL -6.10 -4.10 1 41 THR -0.10 -0.40 1 42 PHE -3.70 -1.20 1 45 GLN -4.80 -2.00 1 46 THR 0.20 0.10 1 47 PHE -0.30 -1.10 1 48 GLN -4.10 -1.50 1 49 SER -0.30 -0.80 1 50 SER 0.90 0.80 1 51 GLU -3.90 -1.20 1 52 PHE -3.10 -1.00 1 53 PHE -3.30 0.60 1 55 THR -5.70 -3.50 1 56 LEU 4.20 1.80 1 57 LYS 4.10 3.10 1 59 ALA 2.50 2.60 1 60 GLU 2.80 3.00 1 62 ALA 1.60 2.40 1 63 ALA 4.40 2.50 1 64 ALA 4.30 2.50 1 65 LYS 4.40 3.70 1 66 ILE 3.80 2.90 1 67 ALA 2.00 1.80 1 68 VAL 5.40 3.90 1 69 ALA 3.20 1.70 1 70 SER 1.60 1.70 1 71 LEU 0.60 0.00 1 72 THR 0.20 -0.10 1 74 GLN -0.40 -0.40 1 75 SER 0.00 -0.20 1 77 GLU 0.20 0.10 1 79 ILE 0.30 -0.10 1 80 ASP 0.50 0.10 1 81 VAL 0.40 -0.40 1 82 ALA 0.30 -1.60 1 83 TYR 6.20 5.60 1 84 LYS 5.50 4.20 1 85 ASN 4.40 2.80 1 86 LEU 3.90 2.60 1 87 LEU 3.40 2.40 1 88 GLN 5.60 4.00 1 89 GLU 3.20 2.50 1 90 ILE 4.70 4.00 1 91 ALA 3.20 2.50 1 92 GLN 3.70 2.60 1 93 LYS 3.30 2.50 1 94 GLU -0.50 -0.70 1 95 SER 1.30 0.10 1 96 SER -1.80 -1.20 1 97 LEU -0.00 -0.20 1 98 LEU 2.20 0.40 1 100 PHE -3.10 -1.30 1 101 TYR -2.10 -0.40 1 102 ALA -2.90 -1.10 1 103 THR 0.40 0.90 1 104 ALA -4.90 -2.30 1 105 THR -1.20 -1.00 1 106 SER -2.80 -1.80 1 109 SER 4.30 3.00 1 110 HIS -0.20 1.00 1 111 ALA 0.20 0.10 1 113 THR -3.00 -1.80 1 114 PHE -4.10 -1.00 1 115 THR -1.40 0.10 1 116 SER -1.80 -0.30 1 117 THR -4.80 -2.70 1 118 VAL -6.60 -4.30 1 119 GLU -3.80 -2.60 1 120 PHE -2.80 -0.70 1 121 ALA 2.50 -0.10 1 123 LYS -4.30 -1.90 1 124 VAL -1.30 -1.20 1 125 PHE -3.00 -1.40 1 126 SER -1.70 -0.80 1 128 GLU -3.90 -2.30 1 129 GLU -0.00 0.30 1 130 ALA -6.70 -2.20 1 131 LYS 0.90 1.30 1 132 THR -5.80 -3.40 1 133 LYS 4.80 3.40 1 134 LYS 4.40 3.10 1 135 LEU 2.60 2.00 1 136 ALA 3.70 3.10 1 137 GLU 3.50 3.10 1 138 MET 4.40 2.80 1 139 SER 4.00 2.30 1 140 ALA 4.80 2.90 1 141 ALA 3.30 2.30 1 142 LYS 4.80 3.70 1 143 VAL 5.90 4.30 1 144 ALA 1.60 1.80 1 145 PHE 4.40 4.30 1 146 MET 3.90 1.70 1 147 SER 3.10 2.60 1 148 ILE 3.00 1.80 1 149 LYS 2.00 0.50 1 150 ASN 0.70 0.40 1 152 ASN 0.00 -0.10 1 153 SER 0.70 0.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25138_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 3.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.48 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 HIS 4.00 2.30 0 10 GLN 4.90 -1.10 1 11 ALA 4.00 -1.50 1 12 TYR 4.50 -0.50 1 13 ALA 4.40 -1.10 1 14 LEU 3.10 -0.90 1 15 GLN 3.60 -1.30 1 16 HIS 0.40 0.50 1 17 ASN 3.50 -2.30 1 18 LEU -4.10 1.80 1 19 GLU 0.70 -0.60 1 20 LEU 3.20 -2.30 1 22 VAL -2.50 1.60 1 23 TYR -1.00 1.20 1 24 ALA -3.60 2.30 1 25 ASN -6.60 5.70 1 26 GLU -5.50 3.60 1 27 ARG -4.20 2.10 1 28 GLU -5.50 3.20 1 32 HIS -0.30 1.00 1 33 ALA -0.20 0.20 1 35 ARG -4.10 2.20 1 36 PHE -4.80 4.30 1 37 ARG -4.00 3.10 1 39 ASN -5.70 3.50 1 40 VAL -6.10 2.00 1 41 THR -0.10 -0.30 1 42 PHE -3.70 2.50 1 45 GLN -4.80 2.80 1 46 THR 0.20 -0.10 1 47 PHE -0.30 -0.80 1 48 GLN -4.10 2.60 1 49 SER -0.30 -0.50 1 50 SER 0.90 -0.10 1 51 GLU -3.90 2.70 1 52 PHE -3.10 2.10 1 53 PHE -3.30 3.90 1 55 THR -5.70 2.20 1 56 LEU 4.20 -2.40 1 57 LYS 4.10 -1.00 1 59 ALA 2.50 0.10 1 60 GLU 2.80 0.20 1 62 ALA 1.60 0.80 1 63 ALA 4.40 -1.90 1 64 ALA 4.30 -1.80 1 65 LYS 4.40 -0.70 1 66 ILE 3.80 -0.90 1 67 ALA 2.00 -0.20 1 68 VAL 5.40 -1.50 1 69 ALA 3.20 -1.50 1 70 SER 1.60 0.10 1 71 LEU 0.60 -0.60 1 72 THR 0.20 -0.30 1 74 GLN -0.40 0.00 1 75 SER 0.00 -0.20 1 77 GLU 0.20 -0.10 1 79 ILE 0.30 -0.40 1 80 ASP 0.50 -0.40 1 81 VAL 0.40 -0.80 1 82 ALA 0.30 -1.90 1 83 TYR 6.20 -0.60 1 84 LYS 5.50 -1.30 1 85 ASN 4.40 -1.60 1 86 LEU 3.90 -1.30 1 87 LEU 3.40 -1.00 1 88 GLN 5.60 -1.60 1 89 GLU 3.20 -0.70 1 90 ILE 4.70 -0.70 1 91 ALA 3.20 -0.70 1 92 GLN 3.70 -1.10 1 93 LYS 3.30 -0.80 1 94 GLU -0.50 -0.20 1 95 SER 1.30 -1.20 1 96 SER -1.80 0.60 1 97 LEU -0.00 -0.20 1 98 LEU 2.20 -1.80 1 100 PHE -3.10 1.80 1 101 TYR -2.10 1.70 1 102 ALA -2.90 1.80 1 103 THR 0.40 0.50 1 104 ALA -4.90 2.60 1 105 THR -1.20 0.20 1 106 SER -2.80 1.00 1 109 SER 4.30 -1.30 1 110 HIS -0.20 1.20 1 111 ALA 0.20 -0.10 1 113 THR -3.00 1.20 1 114 PHE -4.10 3.10 1 115 THR -1.40 1.50 1 116 SER -1.80 1.50 1 117 THR -4.80 2.10 1 118 VAL -6.60 2.30 1 119 GLU -3.80 1.20 1 120 PHE -2.80 2.10 1 121 ALA 2.50 -2.60 1 123 LYS -4.30 2.40 1 124 VAL -1.30 0.10 1 125 PHE -3.00 1.60 1 126 SER -1.70 0.90 1 128 GLU -3.90 1.60 1 129 GLU -0.00 0.30 1 130 ALA -6.70 4.50 1 131 LYS 0.90 0.40 1 132 THR -5.80 2.40 1 133 LYS 4.80 -1.40 1 134 LYS 4.40 -1.30 1 135 LEU 2.60 -0.60 1 136 ALA 3.70 -0.60 1 137 GLU 3.50 -0.40 1 138 MET 4.40 -1.60 1 139 SER 4.00 -1.70 1 140 ALA 4.80 -1.90 1 141 ALA 3.30 -1.00 1 142 LYS 4.80 -1.10 1 143 VAL 5.90 -1.60 1 144 ALA 1.60 0.20 1 145 PHE 4.40 -0.10 1 146 MET 3.90 -2.20 1 147 SER 3.10 -0.50 1 148 ILE 3.00 -1.20 1 149 LYS 2.00 -1.50 1 150 ASN 0.70 -0.30 1 152 ASN 0.00 -0.10 1 153 SER 0.70 -0.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25138_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 0.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.30 _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 6.19 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 ALA 2.00 -2.02 0 144 ALA 1.60 -2.04 0 10 GLN 4.90 -0.71 1 11 ALA 4.00 -0.48 1 12 TYR 4.50 -0.42 1 13 ALA 4.40 -0.22 1 14 LEU 3.10 -0.25 1 15 GLN 3.60 -0.55 1 16 HIS 0.40 -0.27 1 17 ASN 3.50 -0.41 1 18 LEU -4.10 0.21 1 19 GLU 0.70 -0.34 1 20 LEU 3.20 -0.31 1 22 VAL -2.50 0.18 1 23 TYR -1.00 0.27 1 24 ALA -3.60 0.41 1 25 ASN -6.60 0.94 1 26 GLU -5.50 0.24 1 27 ARG -4.20 0.94 1 28 GLU -5.50 0.18 1 32 HIS -0.30 -0.21 1 33 ALA -0.20 -0.09 1 35 ARG -4.10 0.40 1 36 PHE -4.80 1.08 1 37 ARG -4.00 0.63 1 39 ASN -5.70 0.58 1 40 VAL -6.10 0.79 1 41 THR -0.10 1.01 1 42 PHE -3.70 0.28 1 45 GLN -4.80 0.02 1 46 THR 0.20 0.42 1 47 PHE -0.30 -0.08 1 48 GLN -4.10 0.10 1 50 SER 0.90 -0.06 1 51 GLU -3.90 -0.05 1 52 PHE -3.10 0.41 1 53 PHE -3.30 -0.03 1 55 THR -5.70 0.26 1 56 LEU 4.20 -1.03 1 57 LYS 4.10 -0.56 1 59 ALA 2.50 -0.50 1 60 GLU 2.80 -0.43 1 61 HIS 4.00 -0.73 1 62 ALA 1.60 -0.45 1 63 ALA 4.40 -0.35 1 64 ALA 4.30 -0.63 1 65 LYS 4.40 -1.30 1 66 ILE 3.80 -0.69 1 68 VAL 5.40 -1.00 1 69 ALA 3.20 -0.38 1 70 SER 1.60 -0.20 1 71 LEU 0.60 -0.23 1 72 THR 0.20 -0.13 1 74 GLN -0.40 -0.06 1 75 SER 0.00 0.00 1 77 GLU 0.20 -0.21 1 79 ILE 0.30 -0.14 1 80 ASP 0.50 -0.15 1 81 VAL 0.40 -0.41 1 82 ALA 0.30 -0.05 1 83 TYR 6.20 -1.07 1 84 LYS 5.50 -0.50 1 85 ASN 4.40 -0.51 1 86 LEU 3.90 -0.49 1 87 LEU 3.40 -0.41 1 88 GLN 5.60 -0.65 1 89 GLU 3.20 -0.35 1 90 ILE 4.70 -0.45 1 91 ALA 3.20 -0.25 1 92 GLN 3.70 -0.22 1 93 LYS 3.30 -0.25 1 94 GLU -0.50 -0.01 1 95 SER 1.30 -0.22 1 96 SER -1.80 0.05 1 97 LEU -0.00 -0.13 1 98 LEU 2.20 -0.43 1 100 PHE -3.10 0.27 1 101 TYR -2.10 0.41 1 102 ALA -2.90 0.21 1 103 THR 0.40 0.65 1 104 ALA -4.90 0.45 1 105 THR -1.20 0.37 1 106 SER -2.80 0.06 1 109 SER 4.30 -0.40 1 110 HIS -0.20 -0.23 1 111 ALA 0.20 -0.16 1 113 THR -3.00 -0.01 1 114 PHE -4.10 0.61 1 115 THR -1.40 0.17 1 116 SER -1.80 1.27 1 117 THR -4.80 0.97 1 118 VAL -6.60 0.70 1 119 GLU -3.80 0.97 1 120 PHE -2.80 0.08 1 121 ALA 2.50 -0.68 1 123 LYS -4.30 0.00 1 124 VAL -1.30 0.54 1 125 PHE -3.00 0.08 1 126 SER -1.70 0.64 1 128 GLU -3.90 0.01 1 129 GLU -0.00 0.15 1 130 ALA -6.70 0.55 1 131 LYS 0.90 0.03 1 132 THR -5.80 -0.04 1 133 LYS 4.80 -1.15 1 134 LYS 4.40 -0.60 1 135 LEU 2.60 -0.35 1 136 ALA 3.70 -0.34 1 137 GLU 3.50 -0.54 1 138 MET 4.40 -0.51 1 139 SER 4.00 -0.33 1 140 ALA 4.80 -0.63 1 141 ALA 3.30 -0.47 1 142 LYS 4.80 -0.49 1 143 VAL 5.90 -0.78 1 145 PHE 4.40 -1.04 1 146 MET 3.90 -0.56 1 147 SER 3.10 -0.33 1 148 ILE 3.00 -0.37 1 149 LYS 2.00 -0.39 1 150 ASN 0.70 -0.20 1 152 ASN 0.00 -0.08 1 153 SER 0.70 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25138_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 -2.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.88 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 2.18 _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 17 ASN 3.50 -1.40 0 109 SER 4.30 4.20 0 130 ALA -6.70 -0.40 0 10 GLN 4.90 0.90 1 11 ALA 4.00 2.20 1 12 TYR 4.50 1.80 1 13 ALA 4.40 1.70 1 14 LEU 3.10 3.00 1 15 GLN 3.60 0.70 1 16 HIS 0.40 -1.00 1 18 LEU -4.10 -1.20 1 19 GLU 0.70 0.00 1 20 LEU 3.20 -0.20 1 22 VAL -2.50 -0.80 1 23 TYR -1.00 -1.20 1 24 ALA -3.60 -2.20 1 25 ASN -6.60 -1.70 1 26 GLU -5.50 -2.80 1 27 ARG -4.20 -1.00 1 28 GLU -5.50 -1.80 1 32 HIS -0.30 1.00 1 33 ALA -0.20 -0.80 1 35 ARG -4.10 -1.70 1 36 PHE -4.80 -1.10 1 37 ARG -4.00 -0.30 1 39 ASN -5.70 -2.40 1 40 VAL -6.10 -3.70 1 41 THR -0.10 -0.50 1 42 PHE -3.70 -2.30 1 45 GLN -4.80 -3.00 1 46 THR 0.20 -1.50 1 47 PHE -0.30 -1.90 1 48 GLN -4.10 -1.10 1 49 SER -0.30 0.60 1 50 SER 0.90 -0.30 1 51 GLU -3.90 -3.20 1 52 PHE -3.10 0.60 1 53 PHE -3.30 0.80 1 55 THR -5.70 -1.70 1 56 LEU 4.20 0.20 1 57 LYS 4.10 2.20 1 59 ALA 2.50 2.20 1 60 GLU 2.80 2.80 1 61 HIS 4.00 3.00 1 62 ALA 1.60 2.70 1 63 ALA 4.40 0.60 1 64 ALA 4.30 0.40 1 65 LYS 4.40 1.40 1 66 ILE 3.80 1.90 1 67 ALA 2.00 1.70 1 68 VAL 5.40 1.90 1 69 ALA 3.20 1.10 1 70 SER 1.60 0.20 1 71 LEU 0.60 -0.50 1 72 THR 0.20 -0.80 1 74 GLN -0.40 -0.30 1 75 SER 0.00 -0.20 1 77 GLU 0.20 0.20 1 79 ILE 0.30 -0.90 1 80 ASP 0.50 -0.70 1 81 VAL 0.40 -0.80 1 82 ALA 0.30 0.00 1 83 TYR 6.20 1.00 1 84 LYS 5.50 3.00 1 85 ASN 4.40 2.10 1 86 LEU 3.90 2.00 1 87 LEU 3.40 0.50 1 88 GLN 5.60 1.30 1 89 GLU 3.20 2.60 1 90 ILE 4.70 1.30 1 91 ALA 3.20 1.90 1 92 GLN 3.70 2.80 1 93 LYS 3.30 1.50 1 94 GLU -0.50 -0.60 1 95 SER 1.30 -0.70 1 96 SER -1.80 -0.90 1 97 LEU -0.00 -0.60 1 98 LEU 2.20 -0.40 1 100 PHE -3.10 -1.70 1 101 TYR -2.10 -1.70 1 102 ALA -2.90 -1.40 1 103 THR 0.40 -2.20 1 104 ALA -4.90 -1.50 1 105 THR -1.20 -1.00 1 106 SER -2.80 -0.90 1 110 HIS -0.20 1.00 1 111 ALA 0.20 -0.80 1 113 THR -3.00 -2.20 1 114 PHE -4.10 -1.30 1 115 THR -1.40 -1.00 1 116 SER -1.80 -1.40 1 117 THR -4.80 -1.20 1 118 VAL -6.60 -4.30 1 119 GLU -3.80 -0.40 1 120 PHE -2.80 -2.70 1 121 ALA 2.50 -0.90 1 123 LYS -4.30 -3.10 1 124 VAL -1.30 -1.20 1 125 PHE -3.00 -1.20 1 126 SER -1.70 0.00 1 128 GLU -3.90 -0.10 1 129 GLU -0.00 0.20 1 131 LYS 0.90 -0.20 1 132 THR -5.80 -1.40 1 133 LYS 4.80 0.50 1 134 LYS 4.40 3.10 1 135 LEU 2.60 2.20 1 136 ALA 3.70 3.50 1 137 GLU 3.50 1.80 1 138 MET 4.40 1.20 1 139 SER 4.00 1.90 1 140 ALA 4.80 0.00 1 141 ALA 3.30 0.70 1 142 LYS 4.80 0.90 1 143 VAL 5.90 3.10 1 144 ALA 1.60 0.50 1 145 PHE 4.40 1.20 1 146 MET 3.90 1.80 1 147 SER 3.10 1.60 1 148 ILE 3.00 0.70 1 149 LYS 2.00 0.30 1 150 ASN 0.70 0.60 1 152 ASN 0.00 0.00 1 153 SER 0.70 -0.10 1 stop_ save_