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 bmr26010_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 -2.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.22 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 4.38 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 ASP 6.09 1.35 0 87 MET 1.84 4.11 0 114 THR 5.59 5.11 0 50 VAL -5.59 -4.69 0 12 LEU -3.31 0.33 1 13 ARG -4.11 -0.80 1 14 VAL -3.83 -1.78 1 15 ARG -5.15 -1.91 1 16 ALA -5.60 -1.99 1 17 SER -3.10 -2.06 1 18 ILE -4.64 -1.59 1 19 THR -1.20 0.13 1 20 ILE -2.05 -0.42 1 21 SER -1.24 -0.03 1 23 ASP -0.10 -0.71 1 25 LEU -5.20 -2.35 1 26 VAL -1.62 -0.11 1 27 SER -4.85 -1.80 1 29 GLU -6.78 -2.13 1 30 ILE -5.64 -1.17 1 31 ILE -3.19 -0.41 1 32 ALA -3.58 -1.66 1 33 ALA -6.58 -1.34 1 34 ALA -6.16 -1.34 1 39 SER 3.46 3.15 1 40 LYS -0.22 -0.53 1 41 ASP -0.63 0.39 1 42 THR 0.40 -0.03 1 45 ALA -4.26 -1.59 1 46 LEU -2.01 -1.82 1 47 ASP -0.38 -0.31 1 49 ASP 0.28 0.90 1 54 GLN 4.49 2.43 1 55 LYS 0.21 1.28 1 56 VAL -3.80 -1.38 1 57 ALA -3.27 -1.18 1 58 VAL -1.05 -0.32 1 59 SER -3.98 -1.08 1 60 ASN 0.81 1.49 1 61 TYR -4.11 -0.42 1 62 ASP -1.56 -0.78 1 63 SER -0.74 0.68 1 64 ASP 2.68 1.77 1 66 TYR -1.57 0.36 1 67 VAL -5.58 -2.89 1 69 SER -4.09 -0.17 1 70 GLN -5.70 -2.35 1 71 ALA -6.48 -2.43 1 72 VAL -2.86 -1.18 1 73 PHE -6.53 -3.43 1 74 SER -3.18 -0.89 1 75 ASP 3.96 1.84 1 76 LEU 0.60 0.81 1 77 THR -2.14 -1.18 1 78 PHE 4.08 0.50 1 79 ALA 1.70 1.77 1 80 GLU 1.05 1.40 1 83 GLN 2.37 1.97 1 84 LEU 2.53 2.57 1 85 ALA 2.93 2.23 1 86 ASN 1.45 1.17 1 88 ASN -3.52 0.51 1 89 SER 3.69 3.24 1 90 ASP 2.13 2.36 1 91 ALA -0.32 -0.53 1 92 ALA 1.86 1.96 1 94 VAL -0.51 -0.46 1 95 ASN -4.06 -0.27 1 96 LEU -3.31 -0.11 1 97 SER -4.02 -1.41 1 98 LEU -5.28 -1.62 1 99 ARG -4.66 -1.47 1 100 ARG -3.31 -1.34 1 101 ASN -2.26 -1.19 1 103 ASN 0.20 -0.01 1 104 ILE -2.32 -0.94 1 105 VAL -1.46 -0.07 1 106 ILE -3.56 -0.02 1 107 LEU -4.21 -1.23 1 108 GLU -5.14 -1.22 1 110 ARG -3.48 -0.36 1 111 ALA -4.46 -1.44 1 112 ASP -0.40 -0.65 1 113 LEU 2.04 -0.18 1 115 SER 0.64 0.68 1 116 VAL 3.46 2.79 1 120 ASP -1.03 -0.26 1 121 ALA 0.98 1.77 1 122 ASP -2.42 -0.98 1 123 VAL -1.63 -1.18 1 124 GLU -7.70 -1.35 1 125 LEU -5.55 -1.62 1 126 THR -0.56 0.72 1 127 VAL -3.25 -1.05 1 128 ALA -4.64 -2.03 1 129 PHE -1.27 0.89 1 131 ALA -6.81 -2.10 1 132 ALA 1.15 0.72 1 133 VAL 0.62 0.32 1 134 THR 2.33 1.31 1 135 SER -1.89 -0.63 1 136 THR 0.10 -0.92 1 137 ASN -0.59 -0.73 1 139 ASP -1.42 -0.72 1 140 ARG 1.58 -0.03 1 141 ILE 3.07 2.21 1 142 GLU -2.33 0.26 1 144 GLU 0.01 0.48 1 145 VAL -2.67 -0.33 1 146 VAL -5.29 -3.15 1 147 GLN -9.02 -1.83 1 148 TRP -2.13 1.48 1 149 LYS 0.08 -0.82 1 150 LEU 0.94 0.61 1 151 LYS -0.53 -0.06 1 154 VAL -7.45 -3.15 1 155 VAL 1.20 0.45 1 156 SER -1.60 0.82 1 157 THR -2.44 -0.98 1 158 MET -2.81 -0.02 1 159 SER -3.57 -1.41 1 160 ALA -4.07 0.20 1 161 GLN -5.10 -1.30 1 162 ALA -6.05 -0.79 1 163 ARG -3.05 -1.34 1 164 TYR 1.31 0.36 1 165 THR 1.16 1.97 1 166 ASP -1.37 -0.29 1 168 ASN 1.36 1.49 1 169 THR 0.50 0.72 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26010_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 6.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.78 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 ASP 6.09 -4.74 0 87 MET 1.84 2.27 0 114 THR 5.59 -0.48 0 50 VAL -5.59 0.90 0 12 LEU -3.31 3.64 1 13 ARG -4.11 3.31 1 14 VAL -3.83 2.05 1 15 ARG -5.15 3.24 1 16 ALA -5.60 3.61 1 17 SER -3.10 1.04 1 18 ILE -4.64 3.05 1 19 THR -1.20 1.33 1 20 ILE -2.05 1.63 1 21 SER -1.24 1.21 1 23 ASP -0.10 -0.61 1 25 LEU -5.20 2.85 1 26 VAL -1.62 1.51 1 27 SER -4.85 3.05 1 29 GLU -6.78 4.65 1 30 ILE -5.64 4.47 1 31 ILE -3.19 2.78 1 32 ALA -3.58 1.92 1 33 ALA -6.58 5.24 1 34 ALA -6.16 4.82 1 39 SER 3.46 -0.31 1 40 LYS -0.22 -0.31 1 41 ASP -0.63 1.02 1 42 THR 0.40 -0.43 1 45 ALA -4.26 2.67 1 46 LEU -2.01 0.19 1 47 ASP -0.38 0.07 1 49 ASP 0.28 0.62 1 54 GLN 4.49 -2.06 1 55 LYS 0.21 1.07 1 56 VAL -3.80 2.42 1 57 ALA -3.27 2.09 1 58 VAL -1.05 0.73 1 59 SER -3.98 2.90 1 60 ASN 0.81 0.68 1 61 TYR -4.11 3.69 1 62 ASP -1.56 0.78 1 63 SER -0.74 1.42 1 64 ASP 2.68 -0.91 1 66 TYR -1.57 1.93 1 67 VAL -5.58 2.69 1 69 SER -4.09 3.92 1 70 GLN -5.70 3.35 1 71 ALA -6.48 4.05 1 72 VAL -2.86 1.68 1 73 PHE -6.53 3.10 1 74 SER -3.18 2.29 1 75 ASP 3.96 -2.12 1 76 LEU 0.60 0.21 1 77 THR -2.14 0.96 1 78 PHE 4.08 -3.58 1 79 ALA 1.70 0.07 1 80 GLU 1.05 0.35 1 83 GLN 2.37 -0.40 1 84 LEU 2.53 0.04 1 85 ALA 2.93 -0.70 1 86 ASN 1.45 -0.28 1 88 ASN -3.52 4.03 1 89 SER 3.69 -0.45 1 90 ASP 2.13 0.23 1 91 ALA -0.32 -0.21 1 92 ALA 1.86 0.10 1 94 VAL -0.51 0.05 1 95 ASN -4.06 3.79 1 96 LEU -3.31 3.20 1 97 SER -4.02 2.61 1 98 LEU -5.28 3.66 1 99 ARG -4.66 3.19 1 100 ARG -3.31 1.97 1 101 ASN -2.26 1.07 1 103 ASN 0.20 -0.21 1 104 ILE -2.32 1.38 1 105 VAL -1.46 1.39 1 106 ILE -3.56 3.54 1 107 LEU -4.21 2.98 1 108 GLU -5.14 3.92 1 110 ARG -3.48 3.12 1 111 ALA -4.46 3.02 1 112 ASP -0.40 -0.25 1 113 LEU 2.04 -2.22 1 115 SER 0.64 0.04 1 116 VAL 3.46 -0.67 1 120 ASP -1.03 0.77 1 121 ALA 0.98 0.79 1 122 ASP -2.42 1.44 1 123 VAL -1.63 0.45 1 124 GLU -7.70 6.35 1 125 LEU -5.55 3.93 1 126 THR -0.56 1.28 1 127 VAL -3.25 2.20 1 128 ALA -4.64 2.61 1 129 PHE -1.27 2.16 1 131 ALA -6.81 4.71 1 132 ALA 1.15 -0.43 1 133 VAL 0.62 -0.30 1 134 THR 2.33 -1.02 1 135 SER -1.89 1.26 1 136 THR 0.10 -1.02 1 137 ASN -0.59 -0.14 1 139 ASP -1.42 0.70 1 140 ARG 1.58 -1.61 1 141 ILE 3.07 -0.86 1 142 GLU -2.33 2.59 1 144 GLU 0.01 0.47 1 145 VAL -2.67 2.34 1 146 VAL -5.29 2.14 1 147 GLN -9.02 7.19 1 148 TRP -2.13 3.61 1 149 LYS 0.08 -0.90 1 150 LEU 0.94 -0.33 1 151 LYS -0.53 0.47 1 154 VAL -7.45 4.30 1 155 VAL 1.20 -0.75 1 156 SER -1.60 2.42 1 157 THR -2.44 1.46 1 158 MET -2.81 2.79 1 159 SER -3.57 2.16 1 160 ALA -4.07 4.27 1 161 GLN -5.10 3.80 1 162 ALA -6.05 5.26 1 163 ARG -3.05 1.71 1 164 TYR 1.31 -0.95 1 165 THR 1.16 0.81 1 166 ASP -1.37 1.08 1 168 ASN 1.36 0.13 1 169 THR 0.50 0.22 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26010_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 1.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.40 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 -0.74 _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 131 ALA -6.81 0.09 0 12 LEU -3.31 0.54 1 13 ARG -4.11 0.76 1 14 VAL -3.83 1.06 1 15 ARG -5.15 0.92 1 16 ALA -5.60 1.15 1 17 SER -3.10 1.15 1 18 ILE -4.64 1.08 1 19 THR -1.20 0.53 1 20 ILE -2.05 0.45 1 21 SER -1.24 0.12 1 23 ASP -0.10 0.00 1 24 ASP 6.09 -0.67 1 25 LEU -5.20 0.89 1 26 VAL -1.62 0.92 1 27 SER -4.85 0.61 1 29 GLU -6.78 1.07 1 30 ILE -5.64 0.85 1 31 ILE -3.19 0.04 1 32 ALA -3.58 0.63 1 33 ALA -6.58 0.89 1 34 ALA -6.16 1.29 1 40 LYS -0.22 0.11 1 41 ASP -0.63 -0.07 1 42 THR 0.40 0.00 1 45 ALA -4.26 0.23 1 46 LEU -2.01 0.44 1 47 ASP -0.38 -0.08 1 49 ASP 0.28 -0.14 1 50 VAL -5.59 0.32 1 54 GLN 4.49 0.08 1 55 LYS 0.21 0.28 1 56 VAL -3.80 0.86 1 57 ALA -3.27 0.62 1 58 VAL -1.05 1.04 1 59 SER -3.98 0.48 1 60 ASN 0.81 0.26 1 61 TYR -4.11 0.03 1 62 ASP -1.56 0.45 1 63 SER -0.74 -0.10 1 64 ASP 2.68 -0.29 1 66 TYR -1.57 -0.14 1 67 VAL -5.58 1.23 1 69 SER -4.09 1.00 1 70 GLN -5.70 1.10 1 71 ALA -6.48 1.33 1 72 VAL -2.86 0.77 1 73 PHE -6.53 1.50 1 74 SER -3.18 0.47 1 75 ASP 3.96 -0.61 1 76 LEU 0.60 -0.01 1 77 THR -2.14 0.30 1 78 PHE 4.08 -0.30 1 79 ALA 1.70 -0.09 1 80 GLU 1.05 -0.38 1 83 GLN 2.37 -0.15 1 84 LEU 2.53 -0.42 1 85 ALA 2.93 -0.51 1 86 ASN 1.45 -0.37 1 87 MET 1.84 -0.74 1 88 ASN -3.52 0.09 1 90 ASP 2.13 0.11 1 91 ALA -0.32 0.03 1 92 ALA 1.86 -0.20 1 94 VAL -0.51 0.41 1 95 ASN -4.06 0.25 1 96 LEU -3.31 0.43 1 97 SER -4.02 0.24 1 98 LEU -5.28 0.74 1 99 ARG -4.66 0.49 1 100 ARG -3.31 0.93 1 101 ASN -2.26 0.17 1 103 ASN 0.20 -0.32 1 104 ILE -2.32 0.44 1 105 VAL -1.46 0.66 1 106 ILE -3.56 0.47 1 107 LEU -4.21 0.91 1 108 GLU -5.14 0.72 1 110 ARG -3.48 0.63 1 111 ALA -4.46 0.48 1 112 ASP -0.40 0.04 1 113 LEU 2.04 0.37 1 114 THR 5.59 -0.92 1 115 SER 0.64 -0.03 1 116 VAL 3.46 -0.42 1 120 ASP -1.03 0.21 1 121 ALA 0.98 -0.04 1 122 ASP -2.42 0.03 1 123 VAL -1.63 1.09 1 124 GLU -7.70 1.07 1 125 LEU -5.55 1.26 1 126 THR -0.56 1.10 1 127 VAL -3.25 0.68 1 128 ALA -4.64 0.98 1 129 PHE -1.27 -0.22 1 132 ALA 1.15 -0.64 1 133 VAL 0.62 -0.15 1 134 THR 2.33 -0.10 1 135 SER -1.89 0.13 1 136 THR 0.10 0.83 1 137 ASN -0.59 0.47 1 139 ASP -1.42 0.00 1 140 ARG 1.58 0.33 1 141 ILE 3.07 -0.14 1 142 GLU -2.33 0.03 1 144 GLU 0.01 0.19 1 145 VAL -2.67 1.12 1 146 VAL -5.29 0.78 1 147 GLN -9.02 1.33 1 148 TRP -2.13 0.27 1 149 LYS 0.08 0.63 1 150 LEU 0.94 0.07 1 151 LYS -0.53 -0.04 1 154 VAL -7.45 0.67 1 155 VAL 1.20 0.63 1 156 SER -1.60 0.52 1 157 THR -2.44 0.50 1 158 MET -2.81 0.16 1 159 SER -3.57 0.90 1 160 ALA -4.07 1.07 1 161 GLN -5.10 1.27 1 162 ALA -6.05 0.34 1 163 ARG -3.05 1.19 1 164 TYR 1.31 0.14 1 165 THR 1.16 -0.63 1 166 ASP -1.37 -0.63 1 168 ASN 1.36 -0.09 1 169 THR 0.50 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26010_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 -3.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 6.08 _LACS_plot.Line_2_terminator_val_y_2 1.51 _LACS_plot.Y_axis_chem_shift_offset 0.56 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 ASP 6.09 -3.66 0 12 LEU -3.31 -2.01 1 13 ARG -4.11 -2.76 1 14 VAL -3.83 -1.23 1 15 ARG -5.15 -1.85 1 16 ALA -5.60 -2.48 1 17 SER -3.10 -0.86 1 18 ILE -4.64 -1.43 1 19 THR -1.20 -2.11 1 20 ILE -2.05 -1.23 1 21 SER -1.24 0.60 1 23 ASP -0.10 -2.53 1 25 LEU -5.20 0.31 1 26 VAL -1.62 -1.14 1 27 SER -4.85 -2.89 1 29 GLU -6.78 -1.52 1 30 ILE -5.64 -2.30 1 31 ILE -3.19 -2.48 1 32 ALA -3.58 -4.53 1 33 ALA -6.58 -4.08 1 34 ALA -6.16 -3.95 1 39 SER 3.46 0.36 1 40 LYS -0.22 -0.58 1 41 ASP -0.63 -0.09 1 42 THR 0.40 1.15 1 45 ALA -4.26 -0.51 1 46 LEU -2.01 -2.18 1 47 ASP -0.38 0.89 1 49 ASP 0.28 -0.28 1 50 VAL -5.59 -0.89 1 54 GLN 4.49 1.11 1 55 LYS 0.21 -1.42 1 56 VAL -3.80 -2.80 1 57 ALA -3.27 -0.78 1 58 VAL -1.05 -0.44 1 59 SER -3.98 -1.14 1 60 ASN 0.81 -1.16 1 61 TYR -4.11 -2.33 1 62 ASP -1.56 -1.55 1 63 SER -0.74 0.08 1 64 ASP 2.68 -1.58 1 66 TYR -1.57 -0.70 1 67 VAL -5.58 -0.72 1 69 SER -4.09 -4.68 1 70 GLN -5.70 -2.71 1 71 ALA -6.48 -1.85 1 72 VAL -2.86 -0.97 1 73 PHE -6.53 -1.12 1 74 SER -3.18 -2.50 1 75 ASP 3.96 -0.65 1 76 LEU 0.60 0.39 1 77 THR -2.14 1.94 1 78 PHE 4.08 3.03 1 79 ALA 1.70 2.10 1 80 GLU 1.05 0.77 1 83 GLN 2.37 1.90 1 84 LEU 2.53 0.43 1 85 ALA 2.93 -0.71 1 86 ASN 1.45 1.04 1 87 MET 1.84 -0.23 1 88 ASN -3.52 -0.33 1 89 SER 3.69 1.09 1 90 ASP 2.13 -0.01 1 91 ALA -0.32 -1.85 1 92 ALA 1.86 0.64 1 94 VAL -0.51 -1.94 1 95 ASN -4.06 -2.32 1 96 LEU -3.31 -4.13 1 97 SER -4.02 -2.25 1 98 LEU -5.28 -2.65 1 99 ARG -4.66 -3.13 1 100 ARG -3.31 -0.49 1 101 ASN -2.26 0.03 1 103 ASN 0.20 -3.15 1 104 ILE -2.32 -1.84 1 105 VAL -1.46 -1.90 1 106 ILE -3.56 -1.64 1 107 LEU -4.21 -1.98 1 108 GLU -5.14 -1.45 1 110 ARG -3.48 -2.85 1 111 ALA -4.46 -3.62 1 112 ASP -0.40 -0.75 1 113 LEU 2.04 1.41 1 114 THR 5.59 1.36 1 115 SER 0.64 -0.77 1 116 VAL 3.46 0.10 1 120 ASP -1.03 -0.54 1 121 ALA 0.98 -1.60 1 122 ASP -2.42 -2.82 1 123 VAL -1.63 -1.75 1 124 GLU -7.70 -3.13 1 125 LEU -5.55 -2.98 1 126 THR -0.56 -1.35 1 127 VAL -3.25 -3.85 1 128 ALA -4.64 -1.93 1 129 PHE -1.27 0.36 1 131 ALA -6.81 -3.76 1 132 ALA 1.15 -0.44 1 133 VAL 0.62 1.54 1 134 THR 2.33 0.87 1 135 SER -1.89 -1.86 1 136 THR 0.10 -3.42 1 137 ASN -0.59 1.64 1 139 ASP -1.42 -0.48 1 140 ARG 1.58 -0.03 1 141 ILE 3.07 0.33 1 142 GLU -2.33 0.01 1 144 GLU 0.01 -1.71 1 145 VAL -2.67 -2.04 1 146 VAL -5.29 -3.40 1 147 GLN -9.02 -1.91 1 148 TRP -2.13 -1.13 1 149 LYS 0.08 0.00 1 150 LEU 0.94 -1.36 1 151 LYS -0.53 -0.10 1 154 VAL -7.45 0.18 1 155 VAL 1.20 0.46 1 156 SER -1.60 -2.02 1 157 THR -2.44 -0.46 1 158 MET -2.81 -2.07 1 159 SER -3.57 0.15 1 160 ALA -4.07 -3.54 1 161 GLN -5.10 -2.41 1 162 ALA -6.05 -3.60 1 163 ARG -3.05 0.07 1 164 TYR 1.31 -2.16 1 165 THR 1.16 -1.53 1 166 ASP -1.37 0.69 1 168 ASN 1.36 0.75 1 169 THR 0.50 0.10 1 stop_ save_