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 bmr5368_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.59 _LACS_plot.Line_1_terminator_val_y_1 -3.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.62 _LACS_plot.Line_2_terminator_val_x_2 8.00 _LACS_plot.Line_2_terminator_val_y_2 6.15 _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 73 ILE -0.70 -7.30 0 11 LEU -0.90 -1.01 1 12 PHE 0.27 -1.26 1 15 LYS 0.36 0.18 1 16 GLU 0.73 0.94 1 17 MET -3.43 -1.54 1 18 ARG -1.35 -0.27 1 19 ILE -2.09 -1.88 1 20 LEU -4.15 -2.39 1 21 MET -4.43 -1.13 1 22 VAL -7.80 -4.34 1 24 LEU 1.73 0.68 1 25 ASP 2.25 1.57 1 26 ALA 3.25 1.15 1 27 ALA 2.38 3.08 1 32 ILE 7.06 5.86 1 33 LEU 3.30 3.19 1 34 TYR 4.49 3.76 1 35 LYS 1.99 0.40 1 36 LEU 2.48 1.43 1 37 LYS 3.65 0.66 1 38 LEU -0.35 0.01 1 40 GLU -0.53 -0.32 1 41 ILE 1.45 0.72 1 42 VAL -0.81 -0.33 1 43 THR 0.65 0.32 1 44 THR -3.32 -1.31 1 45 ILE -0.90 -0.59 1 47 THR -1.69 -1.56 1 48 ILE 3.80 2.60 1 50 PHE -3.90 -3.08 1 51 ASN -2.16 -0.64 1 52 VAL -1.56 -0.60 1 53 GLU -5.29 -2.27 1 54 THR -4.12 -1.64 1 55 VAL -3.68 -0.85 1 56 GLU -4.33 -1.78 1 57 TYR -2.56 -0.94 1 58 LYS 6.28 1.91 1 59 ASN 3.06 1.26 1 60 ILE -0.68 -0.97 1 61 SER -3.51 -1.75 1 62 PHE -3.19 -0.97 1 63 THR 0.18 1.25 1 64 VAL -4.19 -1.83 1 65 TRP -1.04 -0.06 1 66 ASP -1.08 -0.83 1 67 VAL -1.68 -2.60 1 70 GLN 0.77 0.54 1 71 ASP 2.93 2.32 1 74 ARG 3.73 3.03 1 80 TYR 1.56 1.30 1 81 PHE -0.26 -1.79 1 82 GLN 2.89 2.19 1 83 ASN 2.71 0.95 1 84 THR 3.92 3.12 1 85 GLN -0.54 1.11 1 87 LEU -3.84 -0.67 1 88 ILE -2.40 -2.19 1 89 PHE -5.32 -1.70 1 90 VAL -0.59 -0.58 1 91 VAL -6.00 -2.70 1 92 ASP -0.42 -0.64 1 93 SER 3.89 3.00 1 94 ASN -2.95 -0.03 1 95 ASP -0.82 -2.44 1 96 ARG 3.86 3.07 1 97 GLU 2.65 2.39 1 98 ARG 0.38 0.53 1 99 VAL 4.81 3.58 1 100 ASN 4.75 3.45 1 101 GLU 3.46 2.73 1 102 ALA 4.73 3.53 1 103 ARG 5.51 4.25 1 104 GLU 3.11 3.01 1 105 GLU 2.11 2.01 1 106 LEU 6.41 3.49 1 107 MET 4.25 1.93 1 108 ARG 3.85 3.69 1 109 MET 4.29 3.37 1 110 LEU 2.87 0.89 1 111 ALA 0.14 -0.26 1 112 GLU 1.34 -0.33 1 115 LEU -0.68 -1.73 1 116 ARG 4.57 4.14 1 117 ASP -0.88 -0.16 1 118 ALA 1.02 0.32 1 119 VAL 1.02 0.57 1 120 LEU -4.57 -1.40 1 121 LEU -6.38 -2.75 1 122 VAL -2.62 -2.13 1 123 PHE -4.63 -4.75 1 124 ALA -1.62 -2.32 1 125 ASN -2.64 -0.19 1 126 LYS 5.43 1.03 1 127 GLN 1.98 1.44 1 128 ASP 0.71 0.17 1 129 LEU 2.34 0.16 1 131 ASN -0.40 -0.76 1 132 ALA -1.65 1.18 1 133 MET -1.69 -1.58 1 134 ASN 3.83 3.43 1 135 ALA 2.56 3.38 1 136 ALA 2.98 2.72 1 137 GLU 5.42 2.82 1 138 ILE 8.00 6.15 1 139 THR 3.14 3.39 1 140 ASP 2.81 2.63 1 141 LYS 0.56 -0.02 1 142 LEU 6.17 1.84 1 144 LEU 2.63 3.74 1 145 HIS 0.75 0.79 1 146 SER 1.28 -0.23 1 147 LEU -0.90 -0.30 1 148 ARG -4.02 -2.63 1 150 ARG 0.16 -0.34 1 151 ASN -8.59 -3.39 1 152 TRP -2.09 -0.95 1 153 TYR -5.99 -3.44 1 154 ILE -7.11 -3.11 1 155 GLN -0.21 -0.01 1 156 ALA -4.34 -0.93 1 157 THR 2.47 3.17 1 159 ALA 4.85 2.17 1 160 THR -0.49 0.02 1 161 SER 2.10 2.60 1 163 ASP 3.61 3.03 1 165 LEU 5.72 4.99 1 166 TYR 5.99 4.79 1 167 GLU 3.66 2.61 1 169 LEU 2.98 3.23 1 170 ASP 7.85 5.55 1 171 TRP 3.18 3.54 1 172 LEU 5.50 3.74 1 173 SER 3.80 3.60 1 174 ASN 2.55 1.38 1 175 GLN 2.73 1.68 1 176 LEU 2.67 2.34 1 177 ARG 0.69 0.33 1 178 ASN 0.12 0.36 1 179 GLN 1.14 1.71 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5368_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.59 _LACS_plot.Line_1_terminator_val_y_1 4.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.38 _LACS_plot.Line_2_terminator_val_x_2 8.00 _LACS_plot.Line_2_terminator_val_y_2 -1.85 _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 73 ILE -0.70 -6.60 0 11 LEU -0.90 -0.11 1 12 PHE 0.27 -1.53 1 15 LYS 0.36 -0.18 1 16 GLU 0.73 0.21 1 17 MET -3.43 1.89 1 18 ARG -1.35 1.08 1 19 ILE -2.09 0.21 1 20 LEU -4.15 1.76 1 21 MET -4.43 3.30 1 22 VAL -7.80 3.46 1 24 LEU 1.73 -1.05 1 25 ASP 2.25 -0.68 1 26 ALA 3.25 -2.10 1 27 ALA 2.38 0.70 1 32 ILE 7.06 -1.20 1 33 LEU 3.30 -0.11 1 34 TYR 4.49 -0.73 1 35 LYS 1.99 -1.59 1 36 LEU 2.48 -1.05 1 37 LYS 3.65 -2.99 1 38 LEU -0.35 0.36 1 40 GLU -0.53 0.21 1 41 ILE 1.45 -0.73 1 42 VAL -0.81 0.48 1 43 THR 0.65 -0.33 1 44 THR -3.32 2.01 1 45 ILE -0.90 0.31 1 47 THR -1.69 0.13 1 48 ILE 3.80 -1.20 1 50 PHE -3.90 0.82 1 51 ASN -2.16 1.52 1 52 VAL -1.56 0.96 1 53 GLU -5.29 3.02 1 54 THR -4.12 2.48 1 55 VAL -3.68 2.83 1 56 GLU -4.33 2.55 1 57 TYR -2.56 1.62 1 58 LYS 6.28 -4.37 1 59 ASN 3.06 -1.80 1 60 ILE -0.68 -0.29 1 61 SER -3.51 1.76 1 62 PHE -3.19 2.22 1 63 THR 0.18 1.07 1 64 VAL -4.19 2.36 1 65 TRP -1.04 0.98 1 66 ASP -1.08 0.25 1 67 VAL -1.68 -0.92 1 70 GLN 0.77 -0.23 1 71 ASP 2.93 -0.61 1 74 ARG 3.73 -0.70 1 80 TYR 1.56 -0.26 1 81 PHE -0.26 -1.53 1 82 GLN 2.89 -0.70 1 83 ASN 2.71 -1.76 1 84 THR 3.92 -0.80 1 85 GLN -0.54 1.65 1 87 LEU -3.84 3.17 1 88 ILE -2.40 0.21 1 89 PHE -5.32 3.62 1 90 VAL -0.59 0.01 1 91 VAL -6.00 3.30 1 92 ASP -0.42 -0.22 1 93 SER 3.89 -0.89 1 94 ASN -2.95 2.92 1 95 ASP -0.82 -1.62 1 96 ARG 3.86 -0.79 1 97 GLU 2.65 -0.26 1 98 ARG 0.38 0.15 1 99 VAL 4.81 -1.23 1 100 ASN 4.75 -1.30 1 101 GLU 3.46 -0.73 1 102 ALA 4.73 -1.20 1 103 ARG 5.51 -1.26 1 104 GLU 3.11 -0.10 1 105 GLU 2.11 -0.10 1 106 LEU 6.41 -2.92 1 107 MET 4.25 -2.32 1 108 ARG 3.85 -0.16 1 109 MET 4.29 -0.92 1 110 LEU 2.87 -1.98 1 111 ALA 0.14 -0.40 1 112 GLU 1.34 -1.67 1 115 LEU -0.68 -1.05 1 116 ARG 4.57 -0.43 1 117 ASP -0.88 0.72 1 118 ALA 1.02 -0.70 1 119 VAL 1.02 -0.45 1 120 LEU -4.57 3.17 1 121 LEU -6.38 3.63 1 122 VAL -2.62 0.49 1 123 PHE -4.63 -0.12 1 124 ALA -1.62 -0.70 1 125 ASN -2.64 2.45 1 126 LYS 5.43 -4.40 1 127 GLN 1.98 -0.54 1 128 ASP 0.71 -0.54 1 129 LEU 2.34 -2.18 1 131 ASN -0.40 -0.36 1 132 ALA -1.65 2.83 1 133 MET -1.69 0.11 1 134 ASN 3.83 -0.40 1 135 ALA 2.56 0.82 1 136 ALA 2.98 -0.26 1 137 GLU 5.42 -2.60 1 138 ILE 8.00 -1.85 1 139 THR 3.14 0.25 1 140 ASP 2.81 -0.18 1 141 LYS 0.56 -0.58 1 142 LEU 6.17 -4.33 1 144 LEU 2.63 1.11 1 145 HIS 0.75 0.04 1 146 SER 1.28 -1.51 1 147 LEU -0.90 0.60 1 148 ARG -4.02 1.39 1 150 ARG 0.16 -0.50 1 151 ASN -8.59 5.20 1 152 TRP -2.09 1.14 1 153 TYR -5.99 2.55 1 154 ILE -7.11 4.00 1 155 GLN -0.21 0.20 1 156 ALA -4.34 3.41 1 157 THR 2.47 0.70 1 159 ALA 4.85 -2.68 1 160 THR -0.49 0.51 1 161 SER 2.10 0.50 1 163 ASP 3.61 -0.58 1 165 LEU 5.72 -0.73 1 166 TYR 5.99 -1.20 1 167 GLU 3.66 -1.05 1 169 LEU 2.98 0.25 1 170 ASP 7.85 -2.30 1 171 TRP 3.18 0.36 1 172 LEU 5.50 -1.76 1 173 SER 3.80 -0.20 1 174 ASN 2.55 -1.17 1 175 GLN 2.73 -1.05 1 176 LEU 2.67 -0.33 1 177 ARG 0.69 -0.36 1 178 ASN 0.12 0.24 1 179 GLN 1.14 0.57 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5368_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.59 _LACS_plot.Line_1_terminator_val_y_1 -3.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 8.00 _LACS_plot.Line_2_terminator_val_y_2 2.09 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 154 ILE -7.11 -5.74 0 151 ASN -8.59 -2.51 0 48 ILE 3.80 -4.78 0 156 ALA -4.34 3.15 0 58 LYS 6.28 -3.57 0 11 LEU -0.90 -3.11 1 12 PHE 0.27 1.67 1 15 LYS 0.36 -0.04 1 16 GLU 0.73 -0.84 1 17 MET -3.43 -0.25 1 18 ARG -1.35 -2.65 1 19 ILE -2.09 -1.49 1 20 LEU -4.15 -2.68 1 21 MET -4.43 -1.33 1 22 VAL -7.80 -3.44 1 24 LEU 1.73 -4.42 1 25 ASP 2.25 1.87 1 26 ALA 3.25 -2.57 1 27 ALA 2.38 -2.24 1 32 ILE 7.06 0.38 1 33 LEU 3.30 -1.24 1 34 TYR 4.49 3.75 1 35 LYS 1.99 2.75 1 36 LEU 2.48 -0.32 1 37 LYS 3.65 -0.33 1 38 LEU -0.35 -1.63 1 40 GLU -0.53 -4.64 1 41 ILE 1.45 -1.14 1 42 VAL -0.81 0.31 1 43 THR 0.65 1.61 1 44 THR -3.32 0.09 1 45 ILE -0.90 -2.62 1 47 THR -1.69 2.83 1 50 PHE -3.90 -2.40 1 51 ASN -2.16 -4.47 1 52 VAL -1.56 -2.46 1 53 GLU -5.29 -1.10 1 54 THR -4.12 0.80 1 55 VAL -3.68 -2.32 1 57 TYR -2.56 -1.12 1 59 ASN 3.06 0.40 1 60 ILE -0.68 -3.72 1 61 SER -3.51 0.07 1 62 PHE -3.19 -2.90 1 63 THR 0.18 0.98 1 64 VAL -4.19 -3.31 1 65 TRP -1.04 0.21 1 67 VAL -1.68 0.52 1 70 GLN 0.77 -1.15 1 71 ASP 2.93 0.48 1 74 ARG 3.73 2.85 1 80 TYR 1.56 0.77 1 82 GLN 2.89 1.65 1 83 ASN 2.71 0.65 1 84 THR 3.92 0.18 1 85 GLN -0.54 -0.97 1 88 ILE -2.40 -3.35 1 89 PHE -5.32 -1.46 1 90 VAL -0.59 -1.91 1 91 VAL -6.00 -2.69 1 92 ASP -0.42 -2.62 1 93 SER 3.89 2.92 1 94 ASN -2.95 -2.40 1 95 ASP -0.82 -2.25 1 96 ARG 3.86 0.30 1 97 GLU 2.65 1.92 1 98 ARG 0.38 2.32 1 99 VAL 4.81 0.80 1 100 ASN 4.75 0.08 1 101 GLU 3.46 0.72 1 102 ALA 4.73 0.68 1 103 ARG 5.51 2.00 1 104 GLU 3.11 0.96 1 105 GLU 2.11 3.46 1 106 LEU 6.41 2.04 1 107 MET 4.25 1.84 1 108 ARG 3.85 3.56 1 109 MET 4.29 3.60 1 110 LEU 2.87 0.00 1 111 ALA 0.14 -0.71 1 112 GLU 1.34 1.71 1 116 ARG 4.57 1.82 1 117 ASP -0.88 -0.42 1 118 ALA 1.02 -1.63 1 119 VAL 1.02 1.76 1 121 LEU -6.38 -4.86 1 122 VAL -2.62 -2.32 1 123 PHE -4.63 0.10 1 124 ALA -1.62 -3.21 1 125 ASN -2.64 -0.54 1 126 LYS 5.43 0.15 1 127 GLN 1.98 0.28 1 128 ASP 0.71 -1.42 1 129 LEU 2.34 0.96 1 131 ASN -0.40 2.29 1 132 ALA -1.65 2.20 1 133 MET -1.69 -0.05 1 134 ASN 3.83 -2.40 1 135 ALA 2.56 2.20 1 136 ALA 2.98 3.52 1 137 GLU 5.42 2.93 1 138 ILE 8.00 2.33 1 139 THR 3.14 -0.13 1 140 ASP 2.81 2.53 1 141 LYS 0.56 1.10 1 142 LEU 6.17 -0.33 1 144 LEU 2.63 3.31 1 145 HIS 0.75 2.25 1 146 SER 1.28 -2.92 1 147 LEU -0.90 0.93 1 148 ARG -4.02 -2.20 1 150 ARG 0.16 -1.16 1 152 TRP -2.09 -2.11 1 153 TYR -5.99 -3.74 1 155 GLN -0.21 -2.87 1 157 THR 2.47 -3.19 1 159 ALA 4.85 2.54 1 160 THR 2.10 -2.63 1 163 ASP 3.61 -3.24 1 165 LEU 5.72 2.99 1 166 TYR 5.99 -0.31 1 167 GLU 3.66 -3.31 1 169 LEU 2.98 2.30 1 170 ASP 7.85 1.83 1 171 TRP 3.18 1.32 1 172 LEU 5.50 3.27 1 173 SER 3.80 1.03 1 174 ASN 2.55 1.53 1 175 GLN 2.73 1.53 1 176 LEU 2.67 2.22 1 177 ARG 0.69 1.40 1 178 ASN 0.12 -1.09 1 179 GLN 1.14 -1.57 1 stop_ save_