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 bmr25658_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.77 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 4.53 _LACS_plot.Line_2_terminator_val_y_2 3.17 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 ILE -0.78 -3.56 0 16 ALA 0.14 -0.04 1 17 ALA 0.38 0.22 1 19 ALA -0.02 0.16 1 20 GLU 0.01 0.14 1 21 LEU 0.43 0.19 1 22 LYS 0.35 -0.11 1 23 THR 0.07 0.08 1 25 LYS -1.01 -0.38 1 26 ARG -0.36 0.06 1 27 ILE 0.77 0.85 1 28 LEU 0.44 1.44 1 29 TYR 0.59 -1.28 1 30 TRP -4.08 0.52 1 31 ARG -4.54 -1.08 1 32 ASP -2.25 -1.57 1 34 MET 1.63 2.88 1 35 VAL -0.30 -0.34 1 38 GLN -1.08 -1.00 1 39 ARG -2.62 -0.83 1 40 PHE -2.71 -0.52 1 41 ASP -0.56 -0.16 1 42 LYS -2.74 -1.13 1 45 LYS 0.56 -0.05 1 46 SER -1.60 -0.76 1 48 TYR -1.20 0.47 1 49 MET -2.79 -0.98 1 50 ASP 1.74 -0.68 1 51 MET -1.21 0.32 1 53 LEU -1.59 -0.23 1 54 ILE -1.97 -1.11 1 56 VAL 0.41 -0.47 1 57 TYR -1.60 -0.19 1 58 GLU -1.05 0.05 1 59 GLU -0.70 -0.24 1 60 GLU -0.42 0.05 1 61 ASN 0.10 0.03 1 62 ALA 0.21 0.27 1 63 ASP 0.41 0.37 1 65 ALA -0.06 0.04 1 66 ALA -0.02 0.05 1 67 VAL 0.18 0.00 1 68 ARG -0.53 -0.32 1 69 ILE -0.02 -0.13 1 70 ASP -0.16 -0.02 1 72 ARG 0.45 0.34 1 73 VAL 0.59 0.32 1 74 THR 0.38 0.25 1 75 GLN 0.03 0.33 1 76 ASN 0.22 0.15 1 77 LEU 0.46 0.31 1 79 VAL -0.48 -0.36 1 80 ARG -2.39 -0.77 1 81 THR -5.22 -2.54 1 82 ALA -6.36 -1.89 1 83 GLU -3.01 -1.11 1 84 VAL 2.70 1.15 1 85 LYS -4.73 -1.47 1 86 LEU -1.03 -0.28 1 88 ARG -1.58 -0.36 1 89 LEU -0.11 0.40 1 91 SER 0.89 0.94 1 92 THR -1.70 -0.61 1 93 GLU -0.63 0.12 1 94 ARG -6.77 -2.33 1 95 LEU 0.44 -0.08 1 96 LEU -5.13 -1.53 1 97 VAL -3.59 -2.73 1 99 SER 4.53 3.80 1 100 GLU 2.90 1.45 1 101 ALA -0.75 0.16 1 102 LEU -0.46 -1.25 1 103 ILE -1.41 -0.77 1 104 ARG -0.59 -0.94 1 105 THR -2.27 -2.57 1 107 ALA -0.35 -0.19 1 108 ARG -2.82 -0.60 1 109 THR 0.10 -0.07 1 110 ILE -6.45 -2.89 1 111 ALA -5.81 -2.58 1 112 MET -0.76 -2.57 1 113 VAL -1.76 -0.68 1 114 ALA -0.52 -0.27 1 115 LYS -0.47 -1.00 1 117 GLU 1.38 0.14 1 120 PHE -4.97 -1.19 1 121 ASP -4.41 -1.26 1 123 VAL -3.33 -1.26 1 124 GLU 0.25 0.04 1 125 VAL -6.23 -4.07 1 126 LYS -2.65 -1.53 1 127 ALA -3.51 -1.73 1 129 ALA -1.24 -0.34 1 130 THR -2.87 -0.85 1 131 ALA -2.14 0.23 1 134 GLN -5.43 -1.39 1 135 SER -3.06 -0.56 1 136 GLU -4.20 -1.64 1 138 LEU 1.45 1.05 1 139 GLU -4.58 -0.41 1 141 LEU -6.69 -2.44 1 142 LYS -4.98 -2.17 1 143 ALA 2.43 0.87 1 145 GLN 0.94 1.71 1 146 GLN -2.11 -1.44 1 147 VAL -6.02 -4.88 1 148 VAL 1.91 1.56 1 149 VAL -1.08 -0.92 1 150 SER -0.26 -0.09 1 156 ASP 1.40 1.07 1 157 SER 2.27 1.90 1 158 GLU 2.18 1.74 1 159 ALA 2.47 1.81 1 160 SER 2.01 1.64 1 161 LEU 1.34 1.01 1 162 ARG 1.48 1.19 1 164 THR 0.43 0.42 1 165 VAL 0.62 0.45 1 166 ALA 0.13 0.22 1 167 ARG 0.12 0.12 1 168 MET 0.39 0.47 1 169 GLN -0.05 0.23 1 170 GLU -0.23 0.18 1 171 THR -0.11 -0.04 1 172 THR 0.16 0.14 1 173 SER 0.12 0.24 1 175 LEU 0.14 0.20 1 176 GLU 0.05 0.15 1 177 VAL 0.27 0.00 1 178 LEU -0.55 -0.31 1 179 PHE -0.16 -0.23 1 180 GLN 0.32 1.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25658_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.77 _LACS_plot.Line_1_terminator_val_y_1 4.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 4.53 _LACS_plot.Line_2_terminator_val_y_2 -1.36 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 ILE -0.78 -2.78 0 16 ALA 0.14 -0.18 1 17 ALA 0.38 -0.16 1 19 ALA -0.02 0.18 1 20 GLU 0.01 0.13 1 21 LEU 0.43 -0.24 1 22 LYS 0.35 -0.46 1 23 THR 0.07 0.01 1 25 LYS -1.01 0.63 1 26 ARG -0.36 0.42 1 27 ILE 0.77 0.08 1 28 LEU 0.44 1.00 1 29 TYR 0.59 -1.87 1 30 TRP -4.08 4.60 1 31 ARG -4.54 3.46 1 32 ASP -2.25 0.68 1 34 MET 1.63 1.25 1 35 VAL -0.30 -0.04 1 38 GLN -1.08 0.08 1 39 ARG -2.62 1.79 1 40 PHE -2.71 2.19 1 41 ASP -0.56 0.40 1 42 LYS -2.74 1.61 1 45 LYS 0.56 -0.61 1 46 SER -1.60 0.84 1 48 TYR -1.20 1.67 1 49 MET -2.79 1.81 1 50 ASP 1.74 -2.42 1 51 MET -1.21 1.53 1 53 LEU -1.59 1.36 1 54 ILE -1.97 0.86 1 56 VAL 0.41 -0.88 1 57 TYR -1.60 1.41 1 58 GLU -1.05 1.10 1 59 GLU -0.70 0.46 1 60 GLU -0.42 0.47 1 61 ASN 0.10 -0.07 1 62 ALA 0.21 0.06 1 63 ASP 0.41 -0.04 1 65 ALA -0.06 0.10 1 66 ALA -0.02 0.07 1 67 VAL 0.18 -0.18 1 68 ARG -0.53 0.21 1 69 ILE -0.02 -0.11 1 70 ASP -0.16 0.14 1 72 ARG 0.45 -0.11 1 73 VAL 0.59 -0.27 1 74 THR 0.38 -0.13 1 75 GLN 0.03 0.30 1 76 ASN 0.22 -0.07 1 77 LEU 0.46 -0.15 1 79 VAL -0.48 0.12 1 80 ARG -2.39 1.62 1 81 THR -5.22 2.68 1 82 ALA -6.36 4.47 1 83 GLU -3.01 1.90 1 84 VAL 2.70 -1.55 1 85 LYS -4.73 3.26 1 86 LEU -1.03 0.75 1 88 ARG -1.58 1.22 1 89 LEU -0.11 0.51 1 91 SER 0.89 0.05 1 92 THR -1.70 1.09 1 93 GLU -0.63 0.75 1 94 ARG -6.77 4.44 1 95 LEU 0.44 -0.52 1 96 LEU -5.13 3.60 1 97 VAL -3.59 0.86 1 99 SER 4.53 -0.73 1 100 GLU 2.90 -1.45 1 101 ALA -0.75 0.91 1 102 LEU -0.46 -0.79 1 103 ILE -1.41 0.64 1 104 ARG -0.59 -0.35 1 105 THR -2.27 -0.30 1 107 ALA -0.35 0.16 1 108 ARG -2.82 2.22 1 109 THR 0.10 -0.17 1 110 ILE -6.45 3.56 1 111 ALA -5.81 3.23 1 112 MET -0.76 -1.81 1 113 VAL -1.76 1.08 1 114 ALA -0.52 0.25 1 115 LYS -0.47 -0.53 1 117 GLU 1.38 -1.24 1 120 PHE -4.97 3.78 1 121 ASP -4.41 3.15 1 123 VAL -3.33 2.07 1 124 GLU 0.25 -0.21 1 125 VAL -6.23 2.16 1 126 LYS -2.65 1.12 1 127 ALA -3.51 1.78 1 129 ALA -1.24 0.90 1 130 THR -2.87 2.02 1 131 ALA -2.14 2.37 1 134 GLN -5.43 4.04 1 135 SER -3.06 2.50 1 136 GLU -4.20 2.56 1 138 LEU 1.45 -0.40 1 139 GLU -4.58 4.17 1 141 LEU -6.69 4.25 1 142 LYS -4.98 2.81 1 143 ALA 2.43 -1.56 1 145 GLN 0.94 0.77 1 146 GLN -2.11 0.67 1 147 VAL -6.02 1.14 1 148 VAL 1.91 -0.35 1 149 VAL -1.08 0.16 1 150 SER -0.26 0.17 1 156 ASP 1.40 -0.33 1 157 SER 2.27 -0.37 1 158 GLU 2.18 -0.44 1 159 ALA 2.47 -0.66 1 160 SER 2.01 -0.37 1 161 LEU 1.34 -0.33 1 162 ARG 1.48 -0.29 1 164 THR 0.43 -0.01 1 165 VAL 0.62 -0.17 1 166 ALA 0.13 0.09 1 167 ARG 0.12 0.00 1 168 MET 0.39 0.08 1 169 GLN -0.05 0.28 1 170 GLU -0.23 0.41 1 171 THR -0.11 0.07 1 172 THR 0.16 -0.02 1 173 SER 0.12 0.12 1 175 LEU 0.14 0.06 1 176 GLU 0.05 0.10 1 177 VAL 0.27 -0.27 1 178 LEU -0.55 0.24 1 179 PHE -0.16 -0.07 1 180 GLN 0.32 1.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25658_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.77 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 4.53 _LACS_plot.Line_2_terminator_val_y_2 -0.49 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 LYS -2.74 -0.64 0 17 ALA 0.38 -0.05 1 19 ALA -0.02 -0.04 1 20 GLU 0.01 -0.12 1 21 LEU 0.43 -0.02 1 22 LYS 0.35 0.04 1 23 THR 0.07 -0.08 1 25 LYS -1.01 0.02 1 26 ARG -0.36 -0.03 1 27 ILE 0.77 -0.72 1 28 LEU 0.44 -0.22 1 29 TYR 0.59 -0.02 1 30 TRP -4.08 0.61 1 31 ARG -4.54 1.05 1 32 ASP -2.25 0.42 1 34 MET 1.63 -0.11 1 35 VAL -0.30 -0.11 1 38 GLN -1.08 0.10 1 39 ARG -2.62 0.41 1 40 PHE -2.71 0.30 1 41 ASP -0.56 0.53 1 45 LYS 0.56 -0.20 1 46 SER -1.60 -0.65 1 48 TYR -1.20 -0.04 1 49 MET -2.79 0.14 1 50 ASP 1.74 0.01 1 51 MET -1.21 0.18 1 53 LEU -1.59 -0.02 1 54 ILE -1.97 0.62 1 56 VAL 0.41 -0.39 1 57 TYR -1.60 0.16 1 58 GLU -1.05 -0.18 1 59 GLU -0.70 -0.08 1 60 GLU -0.42 -0.11 1 61 ASN 0.10 -0.08 1 62 ALA 0.21 -0.04 1 63 ASP 0.41 -0.09 1 65 ALA -0.06 -0.05 1 66 ALA -0.02 -0.04 1 67 VAL 0.18 -0.07 1 68 ARG -0.53 0.07 1 69 ILE -0.02 -0.01 1 70 ASP -0.16 -0.08 1 72 ARG 0.45 -0.01 1 73 VAL 0.59 0.04 1 74 THR 0.38 -0.04 1 75 GLN 0.03 -0.02 1 76 ASN 0.22 -0.05 1 77 LEU 0.46 -0.02 1 79 VAL -0.48 0.07 1 80 ARG -2.39 0.36 1 81 THR -5.22 1.16 1 82 ALA -6.36 0.40 1 83 GLU -3.01 0.29 1 84 VAL 2.70 -0.23 1 85 LYS -4.73 0.46 1 86 LEU -1.03 0.31 1 88 ARG -1.58 0.32 1 89 LEU -0.11 0.31 1 91 SER 0.89 -0.07 1 92 THR -1.70 0.14 1 93 GLU -0.63 0.24 1 94 ARG -6.77 0.30 1 95 LEU 0.44 0.12 1 96 LEU -5.13 1.01 1 97 VAL -3.59 0.42 1 99 SER 4.53 -0.59 1 100 GLU 2.90 -0.14 1 101 ALA -0.75 0.20 1 102 LEU -0.46 0.32 1 103 ILE -1.41 -0.03 1 104 ARG -0.59 0.63 1 105 THR -2.27 0.20 1 107 ALA -0.35 0.09 1 108 ARG -2.82 0.31 1 109 THR 0.10 0.67 1 110 ILE -6.45 1.02 1 111 ALA -5.81 0.56 1 112 MET -0.76 0.64 1 113 VAL -1.76 0.59 1 114 ALA -0.52 0.01 1 115 LYS -0.47 0.06 1 117 GLU 1.38 -0.13 1 120 PHE -4.97 0.72 1 121 ASP -4.41 0.53 1 123 VAL -3.33 0.21 1 124 GLU 0.25 0.34 1 125 VAL -6.23 0.83 1 126 LYS -2.65 0.43 1 127 ALA -3.51 0.73 1 129 ALA -1.24 0.01 1 130 THR -2.87 0.95 1 131 ALA -2.14 0.22 1 134 GLN -5.43 0.74 1 135 SER -3.06 0.83 1 137 ILE -0.78 0.28 1 138 LEU 1.45 -0.09 1 139 GLU -4.58 0.20 1 141 LEU -6.69 0.60 1 142 LYS -4.98 0.18 1 143 ALA 2.43 -0.59 1 145 GLN 0.94 -0.02 1 146 GLN -2.11 0.76 1 147 VAL -6.02 1.43 1 148 VAL 1.91 -0.21 1 149 VAL -1.08 0.10 1 150 SER -0.26 -0.01 1 156 ASP 1.40 -0.10 1 157 SER 2.27 -0.21 1 158 GLU 2.18 -0.29 1 159 ALA 2.47 -0.22 1 160 SER 2.01 -0.18 1 161 LEU 1.34 -0.07 1 162 ARG 1.48 -0.13 1 164 THR 0.43 -0.04 1 166 ALA 0.13 -0.03 1 167 ARG 0.12 -0.02 1 168 MET 0.39 -0.03 1 171 THR -0.11 0.10 1 172 THR 0.16 0.03 1 173 SER 0.12 -0.01 1 175 LEU 0.14 -0.01 1 179 PHE -0.16 0.04 1 180 GLN 0.32 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25658_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.77 _LACS_plot.Line_1_terminator_val_y_1 -2.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.77 _LACS_plot.Line_2_terminator_val_x_2 4.53 _LACS_plot.Line_2_terminator_val_y_2 0.91 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 TYR 0.59 -5.50 0 16 ALA 0.14 -0.01 1 17 ALA 0.38 0.58 1 19 ALA -0.02 0.07 1 20 GLU 0.01 -0.09 1 21 LEU 0.43 -0.17 1 22 LYS 0.35 0.05 1 23 THR 0.07 0.30 1 25 LYS -1.01 -0.52 1 26 ARG -0.36 -0.99 1 27 ILE 0.77 -0.08 1 30 TRP -4.08 -0.34 1 31 ARG -4.54 -2.54 1 34 MET 1.63 -0.64 1 38 GLN -1.08 -0.76 1 39 ARG -2.62 -1.56 1 40 PHE -2.71 0.11 1 41 ASP -0.56 -1.74 1 45 LYS 0.56 0.51 1 48 TYR -1.20 -0.45 1 49 MET -2.79 -2.73 1 50 ASP 1.74 -1.79 1 53 LEU -1.59 0.22 1 57 TYR -1.60 0.12 1 58 GLU -1.05 -1.10 1 59 GLU -0.70 -0.34 1 60 GLU -0.42 -0.42 1 61 ASN 0.10 -0.11 1 62 ALA 0.21 -0.14 1 63 ASP 0.41 0.73 1 65 ALA -0.06 -0.26 1 66 ALA -0.02 -0.14 1 67 VAL 0.18 -0.46 1 68 ARG -0.53 -0.16 1 69 ILE -0.02 -0.57 1 70 ASP -0.16 0.34 1 72 ARG 0.45 0.26 1 73 VAL 0.59 0.18 1 74 THR 0.38 -0.24 1 75 GLN 0.03 -0.54 1 76 ASN 0.22 -0.12 1 77 LEU 0.46 0.04 1 79 VAL -0.48 -0.78 1 80 ARG -2.39 -0.32 1 81 THR -5.22 -1.19 1 82 ALA -6.36 -2.67 1 83 GLU -3.01 -0.04 1 84 VAL 2.70 -0.29 1 85 LYS -4.73 -2.17 1 86 LEU -1.03 0.00 1 88 ARG -1.58 -1.15 1 89 LEU -0.11 -0.07 1 91 SER 0.89 -0.22 1 92 THR -1.70 -1.76 1 93 GLU -0.63 -0.87 1 94 ARG -6.77 -1.87 1 95 LEU 0.44 -1.88 1 96 LEU -5.13 0.32 1 99 SER 4.53 1.78 1 100 GLU 2.90 -0.64 1 101 ALA -0.75 -0.74 1 102 LEU -0.46 -1.28 1 103 ILE -1.41 -1.12 1 104 ARG -0.59 -0.21 1 105 THR -2.27 0.04 1 107 ALA -0.35 -0.74 1 108 ARG -2.82 -1.20 1 109 THR 0.10 -1.67 1 110 ILE -6.45 -2.50 1 111 ALA -5.81 -2.56 1 112 MET -0.76 -1.32 1 113 VAL -1.76 0.19 1 114 ALA -0.52 -0.63 1 115 LYS -0.47 1.40 1 117 GLU 1.38 -0.26 1 120 PHE -4.97 -1.63 1 123 VAL -3.33 -1.75 1 124 GLU 0.25 -0.11 1 125 VAL -6.23 -1.74 1 126 LYS -2.65 -1.56 1 127 ALA -3.51 -0.44 1 129 ALA -1.24 -1.71 1 130 THR -2.87 -0.74 1 131 ALA -2.14 0.51 1 134 GLN -5.43 -1.78 1 135 SER -3.06 -1.75 1 136 GLU -4.20 0.34 1 137 ILE -0.78 -1.09 1 138 LEU 1.45 -0.15 1 139 GLU -4.58 -0.78 1 141 LEU -6.69 -2.99 1 142 LYS -4.98 -1.43 1 143 ALA 2.43 1.00 1 145 GLN 0.94 -1.79 1 146 GLN -2.11 -0.37 1 147 VAL -6.02 -0.44 1 149 VAL -1.08 -1.51 1 156 ASP 1.40 1.11 1 157 SER 2.27 0.67 1 158 GLU 2.18 0.79 1 159 ALA 2.47 1.67 1 160 SER 2.01 1.20 1 161 LEU 1.34 0.38 1 162 ARG 1.48 0.99 1 164 THR 0.43 0.04 1 165 VAL 0.62 -0.33 1 166 ALA 0.13 -0.09 1 167 ARG 0.12 0.13 1 168 MET 0.39 -0.12 1 169 GLN -0.05 -0.25 1 170 GLU -0.23 0.10 1 171 THR -0.11 0.16 1 172 THR 0.16 -0.01 1 173 SER 0.12 0.29 1 175 LEU 0.14 -1.85 1 176 GLU 0.05 -0.45 1 177 VAL 0.27 -0.80 1 178 LEU -0.55 -1.06 1 179 PHE -0.16 -1.11 1 stop_ save_