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 bmr17139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.57 _LACS_plot.Line_1_terminator_val_y_1 -2.18 _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 -1.85 _LACS_plot.Line_2_terminator_val_x_2 6.80 _LACS_plot.Line_2_terminator_val_y_2 5.08 _LACS_plot.Y_axis_chem_shift_offset 0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 133 LYS 5.30 0.73 0 87 HIS -4.47 0.41 0 142 ASP 0.12 -2.55 0 10 ASN 0.63 0.19 1 11 LYS -3.05 -0.85 1 12 LEU -1.92 -1.33 1 13 LEU 2.57 0.58 1 14 ALA -2.38 -0.38 1 15 TRP -2.20 0.13 1 16 SER -3.23 -1.87 1 18 VAL -4.37 -1.24 1 19 LEU -5.48 -1.57 1 20 GLU -6.57 -2.23 1 21 TRP -4.45 -0.71 1 22 GLN -3.55 -1.56 1 23 GLU -2.90 -1.15 1 24 LYS 0.29 -0.13 1 26 LYS 6.81 3.10 1 28 ALA 0.88 0.28 1 29 SER -0.15 0.07 1 30 VAL 1.51 0.61 1 31 ASP -0.26 -0.13 1 32 ALA 0.63 0.56 1 33 ASN 0.30 0.30 1 34 THR 0.86 0.63 1 35 LYS 0.15 -0.15 1 36 LEU -0.40 -0.43 1 37 THR 0.74 0.51 1 38 ARG -3.15 -2.67 1 39 SER -2.87 -1.31 1 40 LEU -6.15 -1.01 1 43 GLN -5.50 -1.56 1 44 VAL -2.55 -1.37 1 45 TYR -4.54 -1.14 1 46 VAL -5.29 -3.60 1 47 ASN -0.12 0.13 1 48 HIS 3.47 4.05 1 50 GLU -1.43 -0.68 1 51 ASN -1.31 -0.41 1 52 LEU -1.78 -0.73 1 53 LYS 2.47 -0.15 1 54 THR 1.19 -0.13 1 55 GLU 4.65 3.18 1 56 GLN 0.51 -0.46 1 57 TRP 1.79 0.62 1 59 GLN 2.35 1.93 1 60 LYS -3.09 -1.93 1 61 LEU -2.74 -2.41 1 62 ILE -0.42 -1.32 1 63 MET -5.59 -1.37 1 64 GLN -2.90 -1.46 1 65 LEU 0.28 -0.46 1 66 ILE -4.19 -1.41 1 68 GLN 5.25 3.65 1 69 GLN 4.24 2.64 1 70 LEU 2.89 1.25 1 71 LEU 2.74 0.92 1 72 THR 5.17 4.02 1 73 THR 3.24 2.09 1 74 LEU 0.79 -0.32 1 77 LEU 2.26 1.89 1 78 PHE 1.28 0.74 1 79 ARG 3.30 2.34 1 80 ASN 0.75 -0.95 1 81 SER -3.13 0.04 1 82 ARG -1.67 -1.02 1 83 MET -2.06 -0.46 1 84 VAL -3.81 -3.19 1 85 GLN -1.86 -0.42 1 86 PHE -2.41 -0.17 1 88 PHE -1.60 -0.17 1 89 THR 0.40 0.17 1 90 ASN 0.59 -0.21 1 91 LYS 1.46 1.43 1 92 ASP -0.48 -1.07 1 93 LEU 3.04 2.03 1 94 GLU 4.12 2.92 1 95 SER 4.65 3.61 1 96 LEU 3.13 2.20 1 97 LYS 5.20 3.85 1 99 LEU 4.60 2.33 1 100 TYR 4.16 2.92 1 101 ARG 4.54 3.31 1 102 ILE 3.28 2.94 1 103 MET 3.98 2.83 1 105 ASN -0.46 -0.30 1 107 PHE -1.79 0.53 1 108 ALA -6.14 -2.44 1 111 VAL -0.65 -0.83 1 112 HIS -1.79 0.41 1 113 PHE -0.54 -2.15 1 116 THR 0.39 -0.14 1 117 ALA -1.79 -2.13 1 120 GLU 1.95 1.37 1 121 VAL 2.23 1.24 1 123 VAL -4.53 -2.58 1 124 LEU -5.06 -1.33 1 125 MET -4.42 -3.24 1 126 LEU -3.45 -1.23 1 127 LEU -4.23 -1.40 1 128 TYR -3.25 -1.38 1 129 SER -2.93 -3.36 1 130 SER 3.20 2.25 1 131 LYS 3.16 2.41 1 132 LYS -0.47 -0.15 1 134 ILE -6.12 -2.02 1 135 PHE -0.39 0.33 1 136 MET -3.89 -1.46 1 138 LEU -2.16 -1.54 1 139 ILE -0.25 -0.33 1 141 TYR 4.01 3.20 1 143 GLN 3.66 4.02 1 144 SER 4.65 3.24 1 146 PHE 5.24 4.53 1 147 VAL 6.39 4.97 1 148 ASN 3.63 2.92 1 150 ILE 3.11 1.23 1 151 ARG 4.79 3.38 1 152 GLN 3.52 2.74 1 153 VAL 3.96 2.72 1 154 ILE 3.63 2.63 1 155 THR 3.54 2.95 1 156 ASN 1.69 1.34 1 157 HIS 1.43 2.29 1 158 LYS 1.40 1.10 1 159 GLN 1.33 0.82 1 160 VAL 1.51 0.78 1 164 LYS 0.59 -0.04 1 165 LEU 0.57 0.01 1 166 GLU -0.07 1.13 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.57 _LACS_plot.Line_1_terminator_val_y_1 4.39 _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 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.80 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset 0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 133 LYS 5.30 -4.57 0 87 HIS -4.47 4.88 0 142 ASP 0.12 -2.67 0 10 ASN 0.63 -0.44 1 11 LYS -3.05 2.20 1 12 LEU -1.92 0.59 1 13 LEU 2.57 -1.99 1 14 ALA -2.38 2.00 1 15 TRP -2.20 2.33 1 16 SER -3.23 1.36 1 18 VAL -4.37 3.13 1 19 LEU -5.48 3.91 1 20 GLU -6.57 4.34 1 21 TRP -4.45 3.74 1 22 GLN -3.55 1.99 1 23 GLU -2.90 1.75 1 24 LYS 0.29 -0.42 1 26 LYS 6.81 -3.71 1 28 ALA 0.88 -0.60 1 29 SER -0.15 0.22 1 30 VAL 1.51 -0.90 1 31 ASP -0.26 0.13 1 32 ALA 0.63 -0.07 1 33 ASN 0.30 0.00 1 34 THR 0.86 -0.23 1 35 LYS 0.15 -0.30 1 36 LEU -0.40 -0.03 1 37 THR 0.74 -0.23 1 38 ARG -3.15 0.48 1 39 SER -2.87 1.56 1 40 LEU -6.15 5.14 1 43 GLN -5.50 3.94 1 44 VAL -2.55 1.18 1 45 TYR -4.54 3.40 1 46 VAL -5.29 1.69 1 47 ASN -0.12 0.25 1 48 HIS 3.47 0.58 1 50 GLU -1.43 0.75 1 51 ASN -1.31 0.90 1 52 LEU -1.78 1.05 1 53 LYS 2.47 -2.62 1 54 THR 1.19 -1.32 1 55 GLU 4.65 -1.47 1 56 GLN 0.51 -0.97 1 57 TRP 1.79 -1.17 1 59 GLN 2.35 -0.42 1 60 LYS -3.09 1.16 1 61 LEU -2.74 0.33 1 62 ILE -0.42 -0.90 1 63 MET -5.59 4.22 1 64 GLN -2.90 1.44 1 65 LEU 0.28 -0.74 1 66 ILE -4.19 2.78 1 68 GLN 5.25 -1.60 1 69 GLN 4.24 -1.60 1 70 LEU 2.89 -1.64 1 71 LEU 2.74 -1.82 1 72 THR 5.17 -1.15 1 73 THR 3.24 -1.15 1 74 LEU 0.79 -1.11 1 77 LEU 2.26 -0.37 1 78 PHE 1.28 -0.54 1 79 ARG 3.30 -0.96 1 80 ASN 0.75 -1.70 1 81 SER -3.13 3.17 1 82 ARG -1.67 0.65 1 83 MET -2.06 1.60 1 84 VAL -3.81 0.62 1 85 GLN -1.86 1.44 1 86 PHE -2.41 2.24 1 88 PHE -1.60 1.43 1 89 THR 0.40 -0.23 1 90 ASN 0.59 -0.80 1 91 LYS 1.46 -0.03 1 92 ASP -0.48 -0.59 1 93 LEU 3.04 -1.01 1 94 GLU 4.12 -1.20 1 95 SER 4.65 -1.04 1 96 LEU 3.13 -0.93 1 97 LYS 5.20 -1.35 1 99 LEU 4.60 -2.27 1 100 TYR 4.16 -1.24 1 101 ARG 4.54 -1.23 1 102 ILE 3.28 -0.34 1 103 MET 3.98 -1.15 1 105 ASN -0.46 0.16 1 107 PHE -1.79 2.32 1 108 ALA -6.14 3.70 1 111 VAL -0.65 -0.18 1 112 HIS -1.79 2.20 1 113 PHE -0.54 -1.61 1 116 THR 0.39 -0.53 1 117 ALA -1.79 -0.34 1 120 GLU 1.95 -0.58 1 121 VAL 2.23 -0.99 1 123 VAL -4.53 1.95 1 124 LEU -5.06 3.73 1 125 MET -4.42 1.18 1 126 LEU -3.45 2.22 1 127 LEU -4.23 2.83 1 128 TYR -3.25 1.87 1 129 SER -2.93 -0.43 1 130 SER 3.20 -0.95 1 131 LYS 3.16 -0.75 1 132 LYS -0.47 0.32 1 134 ILE -6.12 4.10 1 135 PHE -0.39 0.72 1 136 MET -3.89 2.43 1 138 LEU -2.16 0.62 1 139 ILE -0.25 -0.08 1 141 TYR 4.01 -0.81 1 143 GLN 3.66 0.36 1 144 SER 4.65 -1.41 1 146 PHE 5.24 -0.71 1 147 VAL 6.39 -1.42 1 148 ASN 3.63 -0.71 1 150 ILE 3.11 -1.88 1 151 ARG 4.79 -1.41 1 152 GLN 3.52 -0.78 1 153 VAL 3.96 -1.24 1 154 ILE 3.63 -1.00 1 155 THR 3.54 -0.59 1 156 ASN 1.69 -0.35 1 157 HIS 1.43 0.86 1 158 LYS 1.40 -0.30 1 159 GLN 1.33 -0.51 1 160 VAL 1.51 -0.73 1 164 LYS 0.59 -0.63 1 165 LEU 0.57 -0.56 1 166 GLU -0.07 1.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.57 _LACS_plot.Line_1_terminator_val_y_1 0.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _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 6.80 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 THR 1.19 -1.24 0 10 ASN 0.63 0.06 1 11 LYS -3.05 0.23 1 12 LEU -1.92 0.18 1 13 LEU 2.57 -0.99 1 14 ALA -2.38 0.09 1 15 TRP -2.20 -0.27 1 16 SER -3.23 0.08 1 18 VAL -4.37 0.79 1 19 LEU -5.48 0.99 1 20 GLU -6.57 1.19 1 21 TRP -4.45 0.55 1 22 GLN -3.55 0.63 1 23 GLU -2.90 0.06 1 24 LYS 0.29 -0.02 1 26 LYS 6.81 -0.06 1 28 ALA 0.88 -0.08 1 29 SER -0.15 -0.04 1 30 VAL 1.51 -0.04 1 31 ASP -0.26 -0.06 1 32 ALA 0.63 -0.13 1 33 ASN 0.30 -0.06 1 34 THR 0.86 -0.15 1 35 LYS 0.15 0.06 1 36 LEU -0.40 0.02 1 37 THR 0.74 0.12 1 38 ARG -3.15 -0.19 1 39 SER -2.87 0.84 1 40 LEU -6.15 0.46 1 43 GLN -5.50 0.73 1 44 VAL -2.55 0.58 1 45 TYR -4.54 0.74 1 46 VAL -5.29 0.74 1 47 ASN -0.12 0.11 1 48 HIS 3.47 -0.56 1 50 GLU -1.43 0.02 1 51 ASN -1.31 -0.03 1 52 LEU -1.78 0.01 1 53 LYS 2.47 0.08 1 55 GLU 4.65 -0.15 1 56 GLN 0.51 0.22 1 57 TRP 1.79 -0.20 1 59 GLN 2.35 0.23 1 60 LYS -3.09 1.02 1 61 LEU -2.74 0.11 1 62 ILE -0.42 0.62 1 63 MET -5.59 0.57 1 64 GLN -2.90 0.37 1 65 LEU 0.28 0.75 1 66 ILE -4.19 0.50 1 68 GLN 5.25 -0.64 1 69 GLN 4.24 -0.27 1 70 LEU 2.89 -0.19 1 71 LEU 2.74 -0.27 1 72 THR 5.17 -0.45 1 73 THR 3.24 -0.15 1 74 LEU 0.79 0.03 1 77 LEU 2.26 -0.05 1 78 PHE 1.28 -0.24 1 79 ARG 3.30 -0.36 1 80 ASN 0.75 0.24 1 81 SER -3.13 0.11 1 82 ARG -1.67 0.19 1 83 MET -2.06 1.04 1 84 VAL -3.81 0.74 1 85 GLN -1.86 0.94 1 86 PHE -2.41 0.49 1 87 HIS -4.47 0.24 1 88 PHE -1.60 0.29 1 89 THR 0.40 -0.05 1 90 ASN 0.59 0.03 1 91 LYS 1.46 -0.13 1 92 ASP -0.48 0.18 1 93 LEU 3.04 -0.26 1 94 GLU 4.12 -0.31 1 95 SER 4.65 -0.22 1 96 LEU 3.13 -0.48 1 97 LYS 5.20 -0.46 1 99 LEU 4.60 -0.58 1 100 TYR 4.16 -0.84 1 101 ARG 4.54 -0.39 1 102 ILE 3.28 -0.16 1 103 MET 3.98 0.20 1 105 ASN -0.46 0.37 1 107 PHE -1.79 0.38 1 108 ALA -6.14 0.56 1 111 VAL -0.65 0.38 1 112 HIS -1.79 0.40 1 113 PHE -0.54 -0.11 1 116 THR 0.39 -0.18 1 117 ALA -1.79 0.43 1 120 GLU 1.95 -0.20 1 121 VAL 2.23 -0.73 1 123 VAL -4.53 1.22 1 124 LEU -5.06 0.35 1 125 MET -4.42 1.05 1 126 LEU -3.45 0.79 1 127 LEU -4.23 0.62 1 128 TYR -3.25 0.23 1 129 SER -2.93 0.11 1 130 SER 3.20 -0.58 1 131 LYS 3.16 -0.25 1 132 LYS -0.47 -0.12 1 133 LYS 5.30 -0.56 1 134 ILE -6.12 0.68 1 135 PHE -0.39 0.54 1 136 MET -3.89 0.76 1 138 LEU -2.16 0.85 1 139 ILE -0.25 0.03 1 141 TYR 4.01 -0.15 1 142 ASP 0.12 0.27 1 143 GLN 3.66 -0.67 1 144 SER 4.65 -0.35 1 146 PHE 5.24 -0.53 1 147 VAL 6.39 -0.65 1 148 ASN 3.63 -0.31 1 150 ILE 3.11 -0.30 1 151 ARG 4.79 -0.35 1 152 GLN 3.52 -0.26 1 153 VAL 3.96 -0.11 1 154 ILE 3.63 -0.21 1 155 THR 3.54 -0.29 1 156 ASN 1.69 -0.12 1 157 HIS 1.43 -0.19 1 158 LYS 1.40 -0.14 1 159 GLN 1.33 -0.08 1 160 VAL 1.51 -0.09 1 164 LYS 0.59 -0.04 1 165 LEU 0.57 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.57 _LACS_plot.Line_1_terminator_val_y_1 -3.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.38 _LACS_plot.Line_2_terminator_val_y_2 2.68 _LACS_plot.Y_axis_chem_shift_offset 0.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 133 LYS 5.30 -1.15 0 121 VAL 2.23 -3.17 0 11 LYS -3.05 -2.10 1 12 LEU -1.92 -2.05 1 13 LEU 2.57 -1.88 1 14 ALA -2.38 -1.07 1 15 TRP -2.20 -3.24 1 16 SER -3.23 -3.32 1 18 VAL -4.37 -3.65 1 19 LEU -5.48 -3.28 1 20 GLU -6.57 -2.48 1 21 TRP -4.45 -3.56 1 22 GLN -3.55 -0.33 1 24 LYS 0.29 -0.36 1 28 ALA 0.88 -0.37 1 29 SER -0.15 0.23 1 30 VAL 1.51 -0.49 1 31 ASP -0.26 -0.32 1 32 ALA 0.63 -0.23 1 33 ASN 0.30 0.18 1 34 THR 0.86 -0.68 1 35 LYS 0.15 -0.79 1 36 LEU -0.40 -1.32 1 37 THR 0.74 -0.85 1 38 ARG -3.15 -2.84 1 39 SER -2.87 -0.86 1 40 LEU -6.15 -1.73 1 43 GLN -5.50 -1.62 1 44 VAL -2.55 -2.04 1 45 TYR -4.54 -0.17 1 46 VAL -5.29 -1.47 1 47 ASN -0.12 0.80 1 48 HIS 3.47 2.52 1 50 GLU -1.43 -1.18 1 51 ASN -1.31 -1.15 1 52 LEU -1.78 -2.77 1 53 LYS 2.47 0.97 1 54 THR 1.19 1.98 1 55 GLU 4.65 0.94 1 56 GLN 0.51 0.40 1 57 TRP 1.79 0.00 1 59 GLN 2.35 -0.97 1 60 LYS -3.09 -2.33 1 61 LEU -2.74 -2.80 1 62 ILE -0.42 -1.37 1 64 GLN -2.90 -0.75 1 65 LEU 0.28 -0.81 1 66 ILE -4.19 -2.26 1 68 GLN 5.25 2.46 1 69 GLN 4.24 1.65 1 70 LEU 2.89 0.64 1 71 LEU 2.74 1.31 1 72 THR 5.17 2.48 1 73 THR 3.24 0.44 1 74 LEU 0.79 -0.23 1 77 LEU 2.26 0.81 1 78 PHE 1.28 0.82 1 79 ARG 3.30 0.46 1 80 ASN 0.75 -1.35 1 81 SER -3.13 -1.84 1 82 ARG -1.67 -1.30 1 83 MET -2.06 -0.32 1 84 VAL -3.81 -2.25 1 85 GLN -1.86 -0.58 1 86 PHE -2.41 -1.33 1 87 HIS -4.47 -1.08 1 88 PHE -1.60 -0.07 1 89 THR 0.40 -0.51 1 90 ASN 0.59 0.22 1 91 LYS 1.46 -0.20 1 92 ASP -0.48 -0.07 1 93 LEU 3.04 1.34 1 94 GLU 4.12 3.31 1 95 SER 4.65 1.07 1 97 LYS 5.20 3.31 1 99 LEU 4.60 1.20 1 100 TYR 4.16 3.54 1 101 ARG 4.54 2.25 1 103 MET 3.98 3.25 1 105 ASN -0.46 0.02 1 107 PHE -1.79 -2.08 1 108 ALA -6.14 -2.13 1 111 VAL -0.65 -2.61 1 112 HIS -1.79 1.29 1 113 PHE -0.54 -1.89 1 116 THR 0.39 -0.59 1 117 ALA -1.79 -2.21 1 120 GLU 1.95 -0.01 1 123 VAL -4.53 -5.02 1 124 LEU -5.06 -3.75 1 125 MET -4.42 -2.61 1 126 LEU -3.45 -3.27 1 127 LEU -4.23 -2.35 1 128 TYR -3.25 -0.90 1 129 SER -2.93 -0.09 1 130 SER 3.20 1.38 1 131 LYS 3.16 1.44 1 132 LYS -0.47 -1.29 1 134 ILE -6.12 -2.55 1 135 PHE -0.39 -0.94 1 136 MET -3.89 -1.84 1 138 LEU -2.16 -1.60 1 139 ILE -0.25 -0.73 1 141 TYR 4.01 1.61 1 142 ASP 0.12 -0.07 1 143 GLN 3.66 1.79 1 144 SER 4.65 2.55 1 146 PHE 5.24 0.82 1 147 VAL 6.39 2.05 1 148 ASN 3.63 2.42 1 150 ILE 3.11 0.47 1 151 ARG 4.79 2.44 1 152 GLN 3.52 1.68 1 153 VAL 3.96 1.77 1 154 ILE 3.63 1.25 1 155 THR 3.54 0.64 1 156 ASN 1.69 0.39 1 157 HIS 1.43 1.40 1 159 GLN 1.33 0.53 1 stop_ save_