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 bmr16959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.68 _LACS_plot.Line_1_terminator_val_y_1 -3.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.57 _LACS_plot.Line_2_terminator_val_x_2 7.96 _LACS_plot.Line_2_terminator_val_y_2 6.19 _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 114 ILE -2.53 -4.50 0 174 HIS -2.82 2.19 0 10 LYS 0.17 0.07 1 11 ILE -5.81 -3.99 1 12 ARG -0.93 -0.92 1 13 MET -2.23 -1.59 1 14 LEU 3.96 2.78 1 15 ASP 0.14 -0.99 1 17 THR 0.47 0.87 1 18 VAL -1.14 -0.81 1 19 LYS -5.05 -2.18 1 20 THR 1.01 0.30 1 21 ILE -4.31 -2.39 1 22 MET 0.94 -1.88 1 23 VAL -6.11 -3.06 1 24 ASP -2.07 -1.92 1 25 ASP 0.57 0.72 1 26 SER 1.00 1.13 1 27 LYS -2.52 -2.28 1 28 THR -1.16 -0.13 1 29 VAL 6.65 5.12 1 30 THR 6.16 5.77 1 31 ASP 3.34 3.26 1 32 MET 3.04 3.66 1 33 LEU 3.20 2.93 1 34 MET 5.46 4.52 1 35 THR 5.73 4.79 1 36 ILE 4.09 4.32 1 38 ALA 3.77 2.55 1 39 ARG 2.61 1.51 1 40 ILE 0.68 0.00 1 42 ILE -1.58 -0.57 1 43 THR 2.15 1.42 1 44 ASN 2.31 -0.85 1 45 HIS 2.06 3.60 1 46 ASP 2.40 1.22 1 47 GLU -0.01 0.00 1 48 TYR -3.12 0.52 1 49 SER -2.39 -1.66 1 50 LEU -6.65 -2.23 1 51 VAL -4.96 -2.59 1 52 ARG -1.57 -0.37 1 53 GLU 0.45 0.95 1 54 LEU -0.17 0.05 1 55 MET -0.10 -0.09 1 56 GLU 0.35 0.57 1 57 GLU 0.51 0.59 1 58 LYS 0.36 -0.16 1 59 LYS 0.85 0.56 1 60 ASP 0.86 0.63 1 61 GLU -1.44 -0.46 1 62 LEU -0.14 -0.45 1 63 ASN -0.43 -0.74 1 64 TRP -0.75 -0.48 1 65 LEU -0.62 -0.24 1 66 ASP -0.98 -0.72 1 67 HIS 4.94 3.99 1 69 ARG -6.82 -1.96 1 70 THR -1.90 -0.72 1 71 LEU 4.45 3.21 1 72 ARG 4.13 3.05 1 73 GLU 1.26 1.51 1 74 GLN -1.55 -0.53 1 76 VAL 1.94 0.23 1 77 GLU -1.88 -0.46 1 78 GLU 3.39 3.09 1 79 HIS -0.23 0.90 1 80 GLU 0.10 1.14 1 81 THR 0.78 0.49 1 82 LEU -4.35 -2.45 1 83 LEU -1.72 -0.97 1 84 LEU -1.50 -0.54 1 85 ARG -5.53 -1.90 1 86 ARG 1.23 0.66 1 87 LYS -0.67 0.55 1 88 PHE 1.30 -1.15 1 90 TYR -0.53 -0.38 1 91 SER 0.74 0.70 1 92 ASP 0.07 -0.05 1 93 GLN 0.61 0.42 1 94 ASN 0.27 0.40 1 95 VAL 0.66 0.34 1 96 ASP -0.66 -0.01 1 97 SER 0.73 0.48 1 98 ARG 1.69 0.90 1 99 ASP -1.90 -1.26 1 101 VAL 5.42 3.90 1 102 GLN 3.46 2.45 1 103 LEU 3.57 2.81 1 104 ASN 4.78 4.74 1 105 LEU 4.06 3.13 1 106 LEU 2.58 2.47 1 107 TYR 3.69 2.81 1 108 VAL 6.12 4.58 1 109 GLN 3.42 2.85 1 110 ALA 3.62 2.33 1 111 ARG 2.67 0.99 1 112 ASP 5.94 3.46 1 113 ASP 3.43 2.42 1 115 LEU 4.35 2.99 1 116 ASN 0.84 -0.20 1 118 SER 3.65 2.58 1 119 HIS -3.23 -2.59 1 121 VAL -7.68 -3.24 1 122 SER -2.09 -0.87 1 123 PHE 3.29 2.43 1 124 ASP 4.46 3.47 1 125 LYS 3.39 2.01 1 126 ALA 4.68 3.49 1 128 GLU 3.85 3.17 1 129 PHE 7.96 6.04 1 130 ALA 1.88 2.03 1 132 PHE 2.84 3.11 1 133 GLN 4.63 3.99 1 135 GLN 5.19 3.02 1 136 ILE 4.05 4.34 1 137 GLN 4.16 3.08 1 138 PHE -1.97 -1.29 1 141 HIS 3.94 3.33 1 142 ASN -2.38 -1.95 1 143 GLU 2.57 2.05 1 144 GLN 2.48 1.51 1 145 LYS -2.09 -0.14 1 146 HIS -1.43 -1.08 1 147 LYS -3.84 -2.25 1 148 ALA 2.47 1.53 1 150 PHE 0.65 2.28 1 151 LEU -2.19 -1.37 1 152 ASP -0.32 -1.42 1 153 LEU 4.17 3.61 1 154 LYS 3.93 1.99 1 155 ASP 0.22 0.51 1 156 PHE -3.11 1.09 1 157 LEU -6.60 -2.13 1 159 LYS 4.30 3.68 1 160 GLU 3.21 1.96 1 161 TYR -3.98 -2.69 1 162 VAL 5.29 4.05 1 163 LYS 0.81 -0.23 1 164 GLN 1.00 0.58 1 165 LYS 4.11 0.61 1 167 GLU 5.03 4.96 1 168 ARG 5.19 3.71 1 169 LYS 3.60 3.02 1 170 ILE 5.52 4.52 1 171 PHE 3.18 0.91 1 172 GLN 4.09 3.08 1 173 ALA 3.39 2.54 1 175 LYS 4.87 3.86 1 176 ASN 2.75 1.63 1 179 GLN 0.04 -1.56 1 180 MET -0.42 1.86 1 181 SER -1.92 -0.36 1 182 GLU 3.65 3.46 1 183 ILE 4.08 2.81 1 184 GLU 3.56 2.54 1 185 ALA 3.60 2.95 1 186 LYS 4.19 4.52 1 187 VAL 6.37 4.88 1 188 ARG 4.94 2.90 1 189 TYR 3.41 4.32 1 190 VAL 6.47 5.19 1 191 LYS 4.43 3.78 1 192 LEU 2.12 1.36 1 193 ALA 0.63 0.60 1 194 ARG 2.30 2.62 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.68 _LACS_plot.Line_1_terminator_val_y_1 4.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.43 _LACS_plot.Line_2_terminator_val_x_2 7.96 _LACS_plot.Line_2_terminator_val_y_2 -1.77 _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 114 ILE -2.53 -1.97 0 174 HIS -2.82 5.01 0 10 LYS 0.17 -0.10 1 11 ILE -5.81 1.82 1 12 ARG -0.93 0.01 1 13 MET -2.23 0.64 1 14 LEU 3.96 -1.18 1 15 ASP 0.14 -1.13 1 17 THR 0.47 0.40 1 18 VAL -1.14 0.33 1 19 LYS -5.05 2.87 1 20 THR 1.01 -0.71 1 21 ILE -4.31 1.92 1 22 MET 0.94 -2.82 1 23 VAL -6.11 3.05 1 24 ASP -2.07 0.15 1 25 ASP 0.57 0.15 1 26 SER 1.00 0.13 1 27 LYS -2.52 0.24 1 28 THR -1.16 1.03 1 29 VAL 6.65 -1.53 1 30 THR 6.16 -0.39 1 31 ASP 3.34 -0.08 1 32 MET 3.04 0.62 1 33 LEU 3.20 -0.27 1 34 MET 5.46 -0.94 1 35 THR 5.73 -0.94 1 36 ILE 4.09 0.23 1 38 ALA 3.77 -1.22 1 39 ARG 2.61 -1.10 1 40 ILE 0.68 -0.68 1 42 ILE -1.58 1.01 1 43 THR 2.15 -0.73 1 44 ASN 2.31 -3.16 1 45 HIS 2.06 1.54 1 46 ASP 2.40 -1.18 1 47 GLU -0.01 0.01 1 48 TYR -3.12 3.64 1 49 SER -2.39 0.73 1 50 LEU -6.65 4.42 1 51 VAL -4.96 2.37 1 52 ARG -1.57 1.20 1 53 GLU 0.45 0.50 1 54 LEU -0.17 0.22 1 55 MET -0.10 0.01 1 56 GLU 0.35 0.22 1 57 GLU 0.51 0.08 1 58 LYS 0.36 -0.52 1 59 LYS 0.85 -0.29 1 60 ASP 0.86 -0.23 1 61 GLU -1.44 0.98 1 62 LEU -0.14 -0.31 1 63 ASN -0.43 -0.31 1 64 TRP -0.75 0.27 1 65 LEU -0.62 0.38 1 66 ASP -0.98 0.26 1 67 HIS 4.94 -0.95 1 69 ARG -6.82 4.86 1 70 THR -1.90 1.18 1 71 LEU 4.45 -1.24 1 72 ARG 4.13 -1.08 1 73 GLU 1.26 0.25 1 74 GLN -1.55 1.02 1 76 VAL 1.94 -1.71 1 77 GLU -1.88 1.42 1 78 GLU 3.39 -0.30 1 79 HIS -0.23 1.13 1 80 GLU 0.10 1.04 1 81 THR 0.78 -0.29 1 82 LEU -4.35 1.90 1 83 LEU -1.72 0.75 1 84 LEU -1.50 0.96 1 85 ARG -5.53 3.63 1 86 ARG 1.23 -0.57 1 87 LYS -0.67 1.22 1 88 PHE 1.30 -2.45 1 90 TYR -0.53 0.15 1 91 SER 0.74 -0.04 1 92 ASP 0.07 -0.12 1 93 GLN 0.61 -0.19 1 94 ASN 0.27 0.13 1 95 VAL 0.66 -0.32 1 96 ASP -0.66 0.65 1 97 SER 0.73 -0.25 1 98 ARG 1.69 -0.79 1 99 ASP -1.90 0.64 1 101 VAL 5.42 -1.52 1 102 GLN 3.46 -1.01 1 103 LEU 3.57 -0.76 1 104 ASN 4.78 -0.04 1 105 LEU 4.06 -0.93 1 106 LEU 2.58 -0.11 1 107 TYR 3.69 -0.88 1 108 VAL 6.12 -1.54 1 109 GLN 3.42 -0.57 1 110 ALA 3.62 -1.29 1 111 ARG 2.67 -1.68 1 112 ASP 5.94 -2.48 1 113 ASP 3.43 -1.01 1 115 LEU 4.35 -1.36 1 116 ASN 0.84 -1.04 1 118 SER 3.65 -1.07 1 119 HIS -3.23 0.64 1 121 VAL -7.68 4.44 1 122 SER -2.09 1.22 1 123 PHE 3.29 -0.86 1 124 ASP 4.46 -0.99 1 125 LYS 3.39 -1.38 1 126 ALA 4.68 -1.19 1 128 GLU 3.85 -0.68 1 129 PHE 7.96 -1.92 1 130 ALA 1.88 0.15 1 132 PHE 2.84 0.27 1 133 GLN 4.63 -0.64 1 135 GLN 5.19 -2.17 1 136 ILE 4.05 0.29 1 137 GLN 4.16 -1.08 1 138 PHE -1.97 0.68 1 141 HIS 3.94 -0.61 1 142 ASN -2.38 0.43 1 143 GLU 2.57 -0.52 1 144 GLN 2.48 -0.97 1 145 LYS -2.09 1.95 1 146 HIS -1.43 0.35 1 147 LYS -3.84 1.59 1 148 ALA 2.47 -0.94 1 150 PHE 0.65 1.63 1 151 LEU -2.19 0.82 1 152 ASP -0.32 -1.10 1 153 LEU 4.17 -0.56 1 154 LYS 3.93 -1.94 1 155 ASP 0.22 0.29 1 156 PHE -3.11 4.20 1 157 LEU -6.60 4.47 1 159 LYS 4.30 -0.62 1 160 GLU 3.21 -1.25 1 161 TYR -3.98 1.29 1 162 VAL 5.29 -1.24 1 163 LYS 0.81 -1.04 1 164 GLN 1.00 -0.42 1 165 LYS 4.11 -3.50 1 167 GLU 5.03 -0.07 1 168 ARG 5.19 -1.48 1 169 LYS 3.60 -0.58 1 170 ILE 5.52 -1.00 1 171 PHE 3.18 -2.27 1 172 GLN 4.09 -1.01 1 173 ALA 3.39 -0.85 1 175 LYS 4.87 -1.01 1 176 ASN 2.75 -1.12 1 179 GLN 0.04 -1.60 1 180 MET -0.42 2.28 1 181 SER -1.92 1.56 1 182 GLU 3.65 -0.19 1 183 ILE 4.08 -1.27 1 184 GLU 3.56 -1.02 1 185 ALA 3.60 -0.65 1 186 LYS 4.19 0.33 1 187 VAL 6.37 -1.49 1 188 ARG 4.94 -2.04 1 189 TYR 3.41 0.91 1 190 VAL 6.47 -1.28 1 191 LYS 4.43 -0.65 1 192 LEU 2.12 -0.76 1 193 ALA 0.63 -0.03 1 194 ARG 2.30 0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16959_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.68 _LACS_plot.Line_1_terminator_val_y_1 2.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.51 _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 7.96 _LACS_plot.Line_2_terminator_val_y_2 -3.67 _LACS_plot.Y_axis_chem_shift_offset 0.68 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ARG -6.82 -0.30 0 50 LEU -6.65 -0.86 0 121 VAL -7.68 0.21 0 146 HIS -1.43 6.29 0 10 LYS 0.17 0.75 1 11 ILE -5.81 0.97 1 12 ARG -0.93 0.13 1 13 MET -2.23 -2.70 1 14 LEU 3.96 -3.45 1 15 ASP 0.14 -1.35 1 17 THR 0.47 4.34 1 18 VAL -1.14 -0.46 1 19 LYS -5.05 0.79 1 20 THR 1.01 3.02 1 21 ILE -4.31 1.21 1 22 MET 0.94 -0.83 1 23 VAL -6.11 2.07 1 24 ASP -2.07 -1.22 1 25 ASP 0.57 -0.83 1 26 SER 1.00 2.75 1 27 LYS -2.52 -0.85 1 28 THR -1.16 1.97 1 29 VAL 6.65 -1.74 1 30 THR 6.16 2.01 1 31 ASP 3.34 -3.45 1 32 MET 3.04 -2.80 1 33 LEU 3.20 -4.45 1 34 MET 5.46 -3.06 1 35 THR 5.73 1.05 1 36 ILE 4.09 -1.55 1 38 ALA 3.77 -6.41 1 39 ARG 2.61 -2.46 1 40 ILE 0.68 -0.25 1 42 ILE -1.58 -0.51 1 43 THR 2.15 2.27 1 44 ASN 2.31 1.28 1 45 HIS 2.06 2.09 1 46 ASP 2.40 -4.91 1 47 GLU -0.01 0.20 1 48 TYR -3.12 2.15 1 49 SER -2.39 4.62 1 51 VAL -4.96 0.47 1 52 ARG -1.57 -0.02 1 53 GLU 0.45 -0.82 1 54 LEU -0.17 -2.57 1 55 MET -0.10 -0.61 1 56 GLU 0.35 -1.02 1 57 GLU 0.51 -1.09 1 58 LYS 0.36 -0.86 1 59 LYS 0.85 -0.72 1 60 ASP 0.86 -0.03 1 61 GLU -1.44 -0.28 1 62 LEU -0.14 -2.22 1 63 ASN -0.43 2.57 1 64 TRP -0.75 -1.36 1 65 LEU -0.62 -1.58 1 66 ASP -0.98 -2.87 1 67 HIS 4.94 1.83 1 70 THR -1.90 0.29 1 71 LEU 4.45 -5.30 1 72 ARG 4.13 -4.70 1 73 GLU 1.26 -1.44 1 74 GLN -1.55 1.00 1 76 VAL 1.94 -0.76 1 77 GLU -1.88 -3.31 1 78 GLU 3.39 -1.29 1 79 HIS -0.23 2.25 1 80 GLU 0.10 -0.36 1 81 THR 0.78 3.23 1 82 LEU -4.35 -0.16 1 83 LEU -1.72 -1.25 1 84 LEU -1.50 -1.21 1 85 ARG -5.53 1.38 1 86 ARG 1.23 0.66 1 87 LYS -0.67 0.00 1 90 TYR -0.53 -0.01 1 91 SER 0.74 3.31 1 92 ASP 0.07 -0.35 1 93 GLN 0.61 0.28 1 94 ASN 0.27 1.77 1 95 VAL 0.66 0.88 1 96 ASP -0.66 -0.43 1 97 SER 0.73 2.97 1 98 ARG 1.69 -0.04 1 101 VAL 5.42 -3.06 1 102 GLN 3.46 -2.51 1 103 LEU 3.57 -3.75 1 104 ASN 4.78 0.52 1 105 LEU 4.06 -5.44 1 106 LEU 2.58 -5.07 1 107 TYR 3.69 1.43 1 108 VAL 6.12 -1.49 1 109 GLN 3.42 -1.50 1 110 ALA 3.62 -5.00 1 111 ARG 2.67 -3.13 1 112 ASP 5.94 -2.81 1 113 ASP 3.43 -3.05 1 114 ILE -2.53 -4.55 1 115 LEU 4.35 -5.31 1 116 ASN 0.84 -0.14 1 118 SER 3.65 3.57 1 122 SER -2.09 3.67 1 123 PHE 3.29 -1.19 1 124 ASP 4.46 -3.75 1 125 LYS 3.39 -2.60 1 126 ALA 4.68 -6.77 1 128 GLU 3.85 -4.47 1 129 PHE 7.96 -1.81 1 130 ALA 1.88 -5.79 1 132 PHE 2.84 -1.84 1 133 GLN 4.63 -3.23 1 135 GLN 5.19 -3.92 1 136 ILE 4.05 -1.59 1 137 GLN 4.16 -1.97 1 138 PHE -1.97 -1.15 1 141 HIS 3.94 3.19 1 142 ASN -2.38 1.95 1 143 GLU 2.57 -0.93 1 144 GLN 2.48 -0.02 1 145 LYS -2.09 -0.20 1 147 LYS -3.84 0.41 1 148 ALA 2.47 -4.56 1 150 PHE 0.65 0.67 1 151 LEU -2.19 -1.90 1 152 ASP -0.32 -1.63 1 153 LEU 4.17 -3.83 1 154 LYS 3.93 -1.61 1 155 ASP 0.22 0.54 1 156 PHE -3.11 2.87 1 159 LYS 4.30 -2.95 1 160 GLU 3.21 -1.79 1 161 TYR -3.98 -0.27 1 162 VAL 5.29 -0.41 1 163 LYS 0.81 -1.29 1 164 GLN 1.00 0.23 1 165 LYS 4.11 -2.32 1 167 GLU 5.03 -1.45 1 168 ARG 5.19 -3.50 1 169 LYS 3.60 -4.65 1 170 ILE 5.52 -2.27 1 171 PHE 3.18 -2.26 1 172 GLN 4.09 -1.54 1 173 ALA 3.39 -5.43 1 174 HIS -2.82 -1.89 1 175 LYS 4.87 -3.98 1 176 ASN 2.75 -0.06 1 179 GLN 0.04 1.07 1 180 MET -0.42 -0.14 1 181 SER -1.92 4.01 1 182 GLU 3.65 -2.46 1 183 ILE 4.08 -1.11 1 184 GLU 3.56 -2.91 1 185 ALA 3.60 -4.63 1 186 LYS 4.19 -2.71 1 187 VAL 6.37 -2.51 1 188 ARG 4.94 -2.71 1 189 TYR 3.41 -1.64 1 190 VAL 6.47 -3.08 1 191 LYS 4.43 -4.08 1 192 LEU 2.12 -3.34 1 193 ALA 0.63 -1.95 1 stop_ save_