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 bmr17694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 -2.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.09 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 3.08 _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 90 ASN 4.75 5.33 0 155 ASP -4.42 2.48 0 22 ALA 0.12 -0.11 1 23 SER -0.32 -0.09 1 24 ASP -1.64 -0.47 1 26 ASN 0.60 0.50 1 27 ARG 0.49 0.46 1 28 ILE 0.78 0.32 1 29 ILE -1.55 -0.91 1 30 ALA -4.53 -2.08 1 31 THR -2.37 -0.44 1 32 TYR 0.53 0.73 1 33 ILE -5.44 -2.02 1 34 SER -2.84 -0.75 1 35 ASN 1.38 -1.37 1 36 ARG 0.61 -1.17 1 37 GLN 0.27 0.64 1 38 ASP -1.91 -2.47 1 39 ALA -0.29 -1.23 1 41 THR 2.07 1.90 1 43 ASN -2.50 -0.66 1 45 ASP 5.14 3.70 1 46 ASN 2.56 0.69 1 47 ILE 1.57 -0.86 1 48 PHE -0.38 1.17 1 49 ASP 0.01 -1.08 1 50 ASN 2.34 0.47 1 51 ASN -1.54 -1.22 1 52 ALA 3.11 2.00 1 53 SER 1.58 1.70 1 54 THR -2.97 -3.59 1 55 GLU -8.66 -3.03 1 56 LEU -4.12 -0.93 1 57 VAL -3.41 -0.96 1 58 TYR 0.58 0.53 1 59 LYS -2.99 0.25 1 60 ASN -4.01 -1.48 1 62 ASN 3.82 0.03 1 63 ARG -3.82 -1.23 1 64 ILE -4.78 -1.51 1 65 ASP -0.71 0.05 1 66 VAL 5.34 3.76 1 68 THR 2.70 1.90 1 69 TYR -7.55 -3.18 1 70 VAL -5.05 -2.90 1 72 VAL -5.24 -1.35 1 73 LYS -5.04 -1.77 1 74 TYR -4.94 -0.57 1 75 SER 3.07 2.53 1 76 ASN -3.79 -0.67 1 78 ILE -5.65 -2.23 1 79 THR 2.51 1.46 1 80 LEU -2.28 -0.41 1 81 ASN -2.73 0.69 1 82 ASN -2.46 0.06 1 83 VAL -3.07 -1.79 1 84 GLU -8.27 -2.78 1 85 PHE -3.72 -1.47 1 86 LEU 0.00 -0.76 1 87 MET -1.86 -2.13 1 89 ALA -4.19 -2.52 1 91 SER 1.41 1.23 1 92 ASN 0.59 0.13 1 94 ASN 2.15 0.93 1 95 ASP 1.50 0.06 1 96 THR -5.43 -4.03 1 97 MET -1.31 0.84 1 98 GLN 3.44 3.60 1 99 LYS -5.45 -0.87 1 100 ALA -8.67 -0.77 1 101 LYS -5.98 -1.62 1 102 ILE -0.87 -0.14 1 103 GLN -8.63 -1.22 1 104 TYR -4.93 -1.66 1 105 THR -3.42 -3.67 1 106 VAL 2.42 2.59 1 107 ASP -1.57 -1.04 1 109 ARG -0.65 1.53 1 110 GLU -2.22 -1.68 1 111 TRP -1.43 -0.59 1 112 ILE -3.32 -0.92 1 113 ASP 3.77 1.67 1 114 LEU 0.24 2.51 1 115 GLU -3.90 -1.38 1 116 GLU 1.73 0.95 1 118 VAL 1.75 1.05 1 119 GLU -6.67 -2.40 1 120 TYR -1.91 -0.39 1 121 THR 1.31 1.12 1 122 MET -1.43 1.22 1 125 ALA -0.94 -0.77 1 126 ILE -3.94 -1.19 1 127 LYS -4.27 -1.00 1 128 VAL -1.53 0.00 1 129 GLU -6.36 -2.04 1 130 ASN 3.68 1.81 1 131 LEU -2.80 -1.06 1 132 ASP 0.39 -0.40 1 133 LEU -6.16 -1.50 1 134 LYS 0.45 -0.60 1 135 VAL -6.15 -2.89 1 136 ARG -1.20 -0.20 1 138 VAL -4.59 -0.90 1 139 ARG -3.11 -1.08 1 140 LEU -2.88 -1.28 1 141 ILE -8.71 -3.11 1 142 ALA 0.08 -0.33 1 143 THR 1.85 0.40 1 144 GLU -5.42 -0.72 1 145 ALA -1.90 -0.55 1 146 ARG -5.01 0.24 1 147 GLU -3.75 -1.85 1 148 ASN 3.07 1.20 1 149 THR -1.21 -0.51 1 150 TRP -6.19 -5.11 1 151 LEU -2.12 -0.91 1 153 VAL -1.97 -0.26 1 154 ARG 2.01 1.77 1 156 ILE 1.98 1.68 1 157 ASN -2.84 -1.37 1 158 VAL -0.82 -0.43 1 159 ASN 4.13 0.72 1 160 LYS 0.44 0.61 1 161 LYS -0.58 -0.12 1 162 GLU -0.39 0.15 1 163 ASP 0.39 0.46 1 164 SER -0.15 1.29 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 5.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.91 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 -2.25 _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 90 ASN 4.75 0.58 0 155 ASP -4.42 6.90 0 22 ALA 0.12 -0.23 1 23 SER -0.32 0.23 1 24 ASP -1.64 1.17 1 26 ASN 0.60 -0.10 1 27 ARG 0.49 -0.03 1 28 ILE 0.78 -0.46 1 29 ILE -1.55 0.64 1 30 ALA -4.53 2.45 1 31 THR -2.37 1.93 1 32 TYR 0.53 0.20 1 33 ILE -5.44 3.42 1 34 SER -2.84 2.09 1 35 ASN 1.38 -2.75 1 36 ARG 0.61 -1.78 1 37 GLN 0.27 0.37 1 38 ASP -1.91 -0.56 1 39 ALA -0.29 -0.94 1 41 THR 2.07 -0.17 1 43 ASN -2.50 1.84 1 45 ASP 5.14 -1.44 1 46 ASN 2.56 -1.87 1 47 ILE 1.57 -2.43 1 48 PHE -0.38 1.55 1 49 ASP 0.01 -1.09 1 50 ASN 2.34 -1.87 1 51 ASN -1.54 0.32 1 52 ALA 3.11 -1.11 1 53 SER 1.58 0.12 1 54 THR -2.97 -0.62 1 55 GLU -8.66 5.63 1 56 LEU -4.12 3.19 1 57 VAL -3.41 2.45 1 58 TYR 0.58 -0.05 1 59 LYS -2.99 3.24 1 60 ASN -4.01 2.53 1 62 ASN 3.82 -3.79 1 63 ARG -3.82 2.59 1 64 ILE -4.78 3.27 1 65 ASP -0.71 0.76 1 66 VAL 5.34 -1.58 1 68 THR 2.70 -0.80 1 69 TYR -7.55 4.37 1 70 VAL -5.05 2.15 1 72 VAL -5.24 3.89 1 73 LYS -5.04 3.27 1 74 TYR -4.94 4.37 1 75 SER 3.07 -0.54 1 76 ASN -3.79 3.12 1 78 ILE -5.65 3.42 1 79 THR 2.51 -1.05 1 80 LEU -2.28 1.87 1 81 ASN -2.73 3.42 1 82 ASN -2.46 2.52 1 83 VAL -3.07 1.28 1 84 GLU -8.27 5.49 1 85 PHE -3.72 2.25 1 86 LEU 0.00 -0.76 1 87 MET -1.86 -0.27 1 89 ALA -4.19 1.67 1 91 SER 1.41 -0.18 1 92 ASN 0.59 -0.46 1 94 ASN 2.15 -1.22 1 95 ASP 1.50 -1.44 1 96 THR -5.43 1.40 1 97 MET -1.31 2.15 1 98 GLN 3.44 0.16 1 99 LYS -5.45 4.58 1 100 ALA -8.67 7.90 1 101 LYS -5.98 4.36 1 102 ILE -0.87 0.73 1 103 GLN -8.63 7.41 1 104 TYR -4.93 3.27 1 105 THR -3.42 -0.25 1 106 VAL 2.42 0.17 1 107 ASP -1.57 0.53 1 109 ARG -0.65 2.18 1 110 GLU -2.22 0.54 1 111 TRP -1.43 0.84 1 112 ILE -3.32 2.40 1 113 ASP 3.77 -2.10 1 114 LEU 0.24 2.27 1 115 GLU -3.90 2.52 1 116 GLU 1.73 -0.78 1 118 VAL 1.75 -0.70 1 119 GLU -6.67 4.27 1 120 TYR -1.91 1.52 1 121 THR 1.31 -0.19 1 122 MET -1.43 2.65 1 125 ALA -0.94 0.17 1 126 ILE -3.94 2.75 1 127 LYS -4.27 3.27 1 128 VAL -1.53 1.53 1 129 GLU -6.36 4.32 1 130 ASN 3.68 -1.87 1 131 LEU -2.80 1.74 1 132 ASP 0.39 -0.79 1 133 LEU -6.16 4.66 1 134 LYS 0.45 -1.05 1 135 VAL -6.15 3.26 1 136 ARG -1.20 1.00 1 138 VAL -4.59 3.69 1 139 ARG -3.11 2.03 1 140 LEU -2.88 1.60 1 141 ILE -8.71 5.60 1 142 ALA 0.08 -0.41 1 143 THR 1.85 -1.45 1 144 GLU -5.42 4.70 1 145 ALA -1.90 1.35 1 146 ARG -5.01 5.25 1 147 GLU -3.75 1.90 1 148 ASN 3.07 -1.87 1 149 THR -1.21 0.70 1 150 TRP -6.19 1.08 1 151 LEU -2.12 1.21 1 153 VAL -1.97 1.71 1 154 ARG 2.01 -0.24 1 156 ILE 1.98 -0.30 1 157 ASN -2.84 1.47 1 158 VAL -0.82 0.39 1 159 ASN 4.13 -3.41 1 160 LYS 0.44 0.17 1 161 LYS -0.58 0.46 1 162 GLU -0.39 0.54 1 163 ASP 0.39 0.07 1 164 SER -0.15 1.44 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 0.99 _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 0.25 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 -0.41 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 138 VAL -4.59 1.69 0 22 ALA 0.12 -0.03 1 23 SER -0.32 -0.06 1 24 ASP -1.64 -0.48 1 26 ASN 0.60 -0.04 1 27 ARG 0.49 -0.10 1 28 ILE 0.78 -0.19 1 29 ILE -1.55 0.14 1 30 ALA -4.53 0.65 1 31 THR -2.37 0.33 1 32 TYR 0.53 0.55 1 33 ILE -5.44 0.42 1 34 SER -2.84 -0.44 1 35 ASN 1.38 -0.12 1 36 ARG 0.61 -0.25 1 37 GLN 0.27 -0.01 1 38 ASP -1.91 -0.10 1 39 ALA -0.29 0.08 1 41 THR 2.07 -0.16 1 43 ASN -2.50 0.00 1 45 ASP 5.14 -0.05 1 46 ASN 2.56 -0.40 1 47 ILE 1.57 -0.18 1 48 PHE -0.38 0.33 1 49 ASP 0.01 -0.16 1 50 ASN 2.34 -0.62 1 51 ASN -1.54 0.04 1 52 ALA 3.11 -0.24 1 53 SER 1.58 -0.14 1 54 THR -2.97 0.32 1 55 GLU -8.66 1.03 1 56 LEU -4.12 0.75 1 57 VAL -3.41 0.95 1 58 TYR 0.58 -0.13 1 59 LYS -2.99 -0.02 1 60 ASN -4.01 0.11 1 62 ASN 3.82 0.49 1 63 ARG -3.82 0.36 1 64 ILE -4.78 0.28 1 65 ASP -0.71 0.09 1 66 VAL 5.34 -1.06 1 68 THR 2.70 0.21 1 69 TYR -7.55 1.55 1 70 VAL -5.05 0.99 1 72 VAL -5.24 1.00 1 73 LYS -5.04 0.91 1 74 TYR -4.94 0.85 1 75 SER 3.07 -0.31 1 76 ASN -3.79 -0.04 1 78 ILE -5.65 0.33 1 79 THR 2.51 0.08 1 80 LEU -2.28 -0.14 1 81 ASN -2.73 0.62 1 82 ASN -2.46 0.41 1 83 VAL -3.07 0.82 1 84 GLU -8.27 1.40 1 85 PHE -3.72 0.12 1 86 LEU 0.00 0.66 1 87 MET -1.86 0.93 1 89 ALA -4.19 0.27 1 90 ASN 4.75 -0.70 1 91 SER 1.41 -0.13 1 92 ASN 0.59 -0.18 1 94 ASN 2.15 -0.35 1 95 ASP 1.50 0.58 1 96 THR -5.43 0.29 1 97 MET -1.31 -0.41 1 98 GLN 3.44 -0.27 1 99 LYS -5.45 0.94 1 100 ALA -8.67 1.27 1 101 LYS -5.98 0.87 1 102 ILE -0.87 0.89 1 103 GLN -8.63 1.38 1 104 TYR -4.93 1.31 1 105 THR -3.42 0.24 1 106 VAL 2.42 0.07 1 107 ASP -1.57 -0.15 1 109 ARG -0.65 0.02 1 110 GLU -2.22 0.24 1 111 TRP -1.43 0.03 1 112 ILE -3.32 -0.02 1 113 ASP 3.77 0.07 1 114 LEU 0.24 0.12 1 115 GLU -3.90 0.30 1 116 GLU 1.73 -0.10 1 118 VAL 1.75 -0.14 1 119 GLU -6.67 0.43 1 120 TYR -1.91 0.11 1 121 THR 1.31 0.41 1 122 MET -1.43 0.47 1 125 ALA -0.94 0.84 1 126 ILE -3.94 0.24 1 127 LYS -4.27 1.18 1 128 VAL -1.53 0.33 1 129 GLU -6.36 0.64 1 130 ASN 3.68 -0.33 1 131 LEU -2.80 0.17 1 132 ASP 0.39 -0.16 1 133 LEU -6.16 0.34 1 134 LYS 0.45 0.86 1 135 VAL -6.15 1.10 1 136 ARG -1.20 0.29 1 139 ARG -3.11 1.21 1 140 LEU -2.88 0.32 1 141 ILE -8.71 1.05 1 142 ALA 0.08 0.73 1 143 THR 1.85 0.09 1 144 GLU -5.42 0.10 1 145 ALA -1.90 0.31 1 146 ARG -5.01 0.27 1 147 GLU -3.75 0.25 1 148 ASN 3.07 -0.32 1 149 THR -1.21 0.23 1 150 TRP -6.19 0.74 1 151 LEU -2.12 0.21 1 153 VAL -1.97 0.50 1 154 ARG 2.01 0.17 1 155 ASP -4.42 0.27 1 156 ILE 1.98 0.09 1 157 ASN -2.84 0.29 1 158 VAL -0.82 0.25 1 159 ASN 4.13 -0.42 1 160 LYS 0.44 -0.17 1 161 LYS -0.58 0.05 1 162 GLU -0.39 -0.06 1 163 ASP 0.39 0.00 1 164 SER -0.15 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.71 _LACS_plot.Line_1_terminator_val_y_1 -2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.20 _LACS_plot.Line_2_terminator_val_x_2 5.33 _LACS_plot.Line_2_terminator_val_y_2 0.57 _LACS_plot.Y_axis_chem_shift_offset 0.71 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 VAL -3.07 -6.03 0 87 MET -1.86 3.60 0 139 ARG -3.11 -6.15 0 22 ALA 0.12 -0.28 1 23 SER -0.32 -0.83 1 26 ASN 0.60 -0.18 1 27 ARG 0.49 -0.65 1 28 ILE 0.78 -1.00 1 29 ILE -1.55 -1.00 1 30 ALA -4.53 -1.40 1 31 THR -2.37 -1.19 1 32 TYR 0.53 -1.12 1 33 ILE -5.44 -3.63 1 34 SER -2.84 -1.09 1 35 ASN 1.38 2.27 1 36 ARG 0.61 1.47 1 37 GLN 0.27 -0.36 1 38 ASP -1.91 -0.40 1 41 THR 2.07 -0.26 1 45 ASP 5.14 2.21 1 46 ASN 2.56 1.47 1 47 ILE 1.57 -0.63 1 48 PHE -0.38 -0.50 1 49 ASP 0.01 -1.03 1 50 ASN 2.34 -1.80 1 51 ASN -1.54 1.69 1 52 ALA 3.11 -1.04 1 53 SER 1.58 -0.32 1 54 THR -2.97 0.57 1 55 GLU -8.66 -1.82 1 56 LEU -4.12 -1.46 1 57 VAL -3.41 -1.41 1 58 TYR 0.58 0.50 1 59 LYS -2.99 -1.45 1 62 ASN 3.82 0.82 1 63 ARG -3.82 -2.41 1 64 ILE -4.78 -0.88 1 65 ASP -0.71 2.35 1 66 VAL 5.34 0.47 1 68 THR 2.70 -1.81 1 69 TYR -7.55 -2.25 1 70 VAL -5.05 -0.91 1 72 VAL -5.24 -2.90 1 73 LYS -5.04 -1.83 1 74 TYR -4.94 1.48 1 75 SER 3.07 -1.21 1 78 ILE -5.65 -1.01 1 79 THR 2.51 -1.43 1 80 LEU -2.28 -4.12 1 81 ASN -2.73 -0.17 1 82 ASN -2.46 -2.56 1 84 GLU -8.27 -1.71 1 85 PHE -3.72 -1.90 1 86 LEU 0.00 -2.46 1 90 ASN 4.75 2.46 1 91 SER 1.41 -0.07 1 94 ASN 2.15 -0.68 1 95 ASP 1.50 -0.65 1 96 THR -5.43 -3.18 1 97 MET -1.31 -1.28 1 98 GLN 3.44 1.64 1 99 LYS -5.45 -0.32 1 100 ALA -8.67 -3.16 1 101 LYS -5.98 -2.70 1 102 ILE -0.87 0.25 1 103 GLN -8.63 -1.97 1 104 TYR -4.93 -4.27 1 105 THR -3.42 -2.18 1 106 VAL 2.42 0.22 1 107 ASP -1.57 1.72 1 109 ARG -0.65 -1.16 1 110 GLU -2.22 0.42 1 111 TRP -1.43 -1.20 1 112 ILE -3.32 -1.34 1 113 ASP 3.77 -0.29 1 114 LEU 0.24 -1.33 1 115 GLU -3.90 -1.70 1 116 GLU 1.73 0.81 1 118 VAL 1.75 -1.15 1 119 GLU -6.67 -1.58 1 120 TYR -1.91 -0.26 1 121 THR 1.31 -0.80 1 125 ALA -0.94 -0.90 1 126 ILE -3.94 -2.38 1 127 LYS -4.27 -1.70 1 128 VAL -1.53 -1.83 1 129 GLU -6.36 -2.45 1 130 ASN 3.68 -0.31 1 131 LEU -2.80 -0.46 1 132 ASP 0.39 -2.17 1 133 LEU -6.16 -1.95 1 134 LYS 0.45 0.42 1 135 VAL -6.15 -1.90 1 136 ARG -1.20 -0.40 1 138 VAL -4.59 -3.28 1 140 LEU -2.88 -3.37 1 141 ILE -8.71 -3.75 1 142 ALA 0.08 2.22 1 143 THR 1.85 -0.50 1 144 GLU -5.42 -2.20 1 145 ALA -1.90 -1.91 1 146 ARG -5.01 -2.28 1 147 GLU -3.75 -1.82 1 148 ASN 3.07 -1.55 1 149 THR -1.21 -4.44 1 150 TRP -6.19 -0.70 1 151 LEU -2.12 -3.46 1 153 VAL -1.97 -1.52 1 154 ARG 2.01 -0.15 1 155 ASP -4.42 -1.15 1 156 ILE 1.98 -2.25 1 157 ASN -2.84 -1.05 1 158 VAL -0.82 -1.21 1 159 ASN 4.13 -0.43 1 160 LYS 0.44 0.52 1 161 LYS -0.58 -0.35 1 162 GLU -0.39 -0.55 1 163 ASP 0.39 -1.00 1 stop_ save_