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 bmr30353_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.10 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.56 _LACS_plot.Line_2_terminator_val_x_2 8.27 _LACS_plot.Line_2_terminator_val_y_2 5.69 _LACS_plot.Y_axis_chem_shift_offset 0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 147 SER -7.10 -1.40 0 139 TRP -1.88 -4.18 0 121 LEU 1.46 -2.51 0 10 LEU -5.79 -1.39 1 12 SER 1.99 1.01 1 13 VAL 3.20 1.92 1 17 LYS 8.27 4.54 1 18 SER 5.37 2.72 1 19 ALA 2.44 1.62 1 20 LEU 3.07 3.57 1 21 THR -1.54 -3.47 1 23 GLN 3.05 2.72 1 24 PHE 3.16 3.02 1 25 VAL 4.44 3.98 1 26 GLN -1.41 -0.08 1 28 ILE -6.12 -2.88 1 29 PHE -2.64 -2.57 1 30 VAL -2.68 -2.92 1 31 GLU -0.36 0.45 1 32 LYS -0.72 -1.12 1 33 TYR -0.16 0.34 1 34 ASP -0.34 0.14 1 36 THR -0.07 0.01 1 38 GLU -4.27 -2.24 1 39 ASP -3.92 -1.67 1 40 SER -3.45 -2.20 1 41 TYR -4.41 -1.26 1 42 ARG -3.99 -1.74 1 43 LYS -5.25 -0.67 1 44 GLN -0.77 -0.85 1 45 VAL -5.86 -3.04 1 46 GLU -3.25 -2.16 1 47 VAL -1.78 -1.15 1 48 ASP 4.17 1.35 1 49 ALA 2.62 0.59 1 50 GLN -3.44 -1.94 1 51 GLN 1.21 0.07 1 53 MET -0.50 -2.17 1 54 LEU 3.04 3.58 1 55 GLU -3.73 -1.75 1 56 ILE -3.18 -1.22 1 57 LEU -1.01 -0.81 1 58 ASP -1.00 -1.28 1 59 THR -1.78 0.11 1 60 ALA -2.78 -0.89 1 62 THR -0.59 -0.67 1 63 GLU 2.06 1.23 1 64 GLN 1.83 1.05 1 65 PHE 1.15 0.32 1 66 THR 1.72 1.58 1 67 ALA 2.91 1.76 1 68 MET 1.67 0.68 1 69 ARG 4.10 2.59 1 71 LEU 3.90 2.83 1 74 LYS 3.94 3.25 1 75 ASN 0.68 0.65 1 77 GLN -2.22 0.03 1 79 PHE -4.21 -0.75 1 80 ALA -2.54 -2.99 1 81 LEU -0.28 -0.52 1 82 VAL -1.99 -1.82 1 83 TYR -2.80 -2.90 1 84 SER -5.44 -4.47 1 85 ILE 4.32 3.23 1 86 THR 0.29 -0.58 1 87 ALA -3.20 -1.20 1 88 GLN 4.04 3.15 1 89 SER 5.87 3.23 1 90 THR 3.41 2.22 1 91 PHE 1.61 1.96 1 92 ASN 4.47 2.39 1 93 ASP 2.24 1.62 1 94 LEU 1.84 2.09 1 95 GLN 5.97 4.13 1 96 ASP 2.54 2.31 1 97 LEU 2.75 2.41 1 98 ARG 6.21 3.61 1 99 GLU 3.80 2.37 1 100 GLN 5.04 3.26 1 101 ILE 4.97 4.17 1 102 LEU 5.06 2.63 1 103 ARG 3.68 2.77 1 104 VAL 4.22 3.03 1 105 LYS 1.08 -0.25 1 106 ASP 1.44 0.13 1 107 THR -0.90 -2.46 1 108 ASP 0.11 -0.55 1 109 ASP -0.49 -1.14 1 110 VAL -4.42 -1.49 1 112 MET -4.06 -0.45 1 113 ILE -5.15 -1.49 1 114 LEU -2.49 -1.27 1 115 VAL -4.15 -2.07 1 117 ASN -3.73 -1.56 1 118 LYS 4.99 0.81 1 120 ASP 0.77 -0.15 1 122 GLU 3.02 2.63 1 123 ASP 3.39 1.89 1 124 GLU -2.83 -1.99 1 125 ARG 1.84 2.36 1 126 VAL -1.05 -0.03 1 127 VAL 0.08 -0.97 1 129 LYS 4.63 3.80 1 130 GLU 4.05 2.35 1 131 GLN 4.92 3.32 1 133 GLN 3.31 2.21 1 134 ASN 3.70 2.46 1 135 LEU 3.48 1.90 1 136 ALA 3.62 2.40 1 137 ARG 4.86 3.79 1 138 GLN 3.76 2.34 1 140 ASN 2.95 0.51 1 141 ASN 2.92 0.85 1 143 ALA 0.31 0.72 1 144 PHE -5.00 -1.91 1 145 LEU -4.61 -1.25 1 146 GLU -3.28 -1.80 1 148 SER -2.64 -1.29 1 149 ALA 2.70 2.18 1 150 LYS 0.62 1.72 1 151 SER -0.38 -0.73 1 152 LYS 6.25 1.97 1 153 ILE -1.41 -0.88 1 154 ASN 2.87 1.06 1 155 VAL 4.99 3.57 1 156 ASN 4.29 2.49 1 157 GLU 5.37 4.01 1 158 ILE 3.10 3.58 1 159 PHE 3.87 2.48 1 160 TYR 2.69 0.24 1 161 ASP 2.99 3.81 1 162 LEU 2.47 2.78 1 163 VAL 6.37 4.58 1 164 ARG 6.07 4.13 1 165 GLN 2.23 3.58 1 166 ILE 4.18 3.48 1 167 ASN 0.67 0.35 1 168 ARG 3.12 2.98 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30353_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.10 _LACS_plot.Line_1_terminator_val_y_1 4.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.44 _LACS_plot.Line_2_terminator_val_x_2 8.27 _LACS_plot.Line_2_terminator_val_y_2 -2.58 _LACS_plot.Y_axis_chem_shift_offset 0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 147 SER -7.10 5.70 0 139 TRP -1.88 -2.30 0 121 LEU 1.46 -3.97 0 10 LEU -5.79 4.40 1 12 SER 1.99 -0.98 1 13 VAL 3.20 -1.28 1 17 LYS 8.27 -3.73 1 18 SER 5.37 -2.65 1 19 ALA 2.44 -0.82 1 20 LEU 3.07 0.50 1 21 THR -1.54 -1.93 1 23 GLN 3.05 -0.33 1 24 PHE 3.16 -0.14 1 25 VAL 4.44 -0.46 1 26 GLN -1.41 1.33 1 28 ILE -6.12 3.24 1 29 PHE -2.64 0.07 1 30 VAL -2.68 -0.24 1 31 GLU -0.36 0.81 1 32 LYS -0.72 -0.40 1 33 TYR -0.16 0.50 1 34 ASP -0.34 0.48 1 36 THR -0.07 0.08 1 38 GLU -4.27 2.03 1 39 ASP -3.92 2.25 1 40 SER -3.45 1.25 1 41 TYR -4.41 3.15 1 42 ARG -3.99 2.25 1 43 LYS -5.25 4.58 1 44 GLN -0.77 -0.08 1 45 VAL -5.86 2.82 1 46 GLU -3.25 1.09 1 47 VAL -1.78 0.63 1 48 ASP 4.17 -2.82 1 49 ALA 2.62 -2.03 1 50 GLN -3.44 1.50 1 51 GLN 1.21 -1.14 1 53 MET -0.50 -1.67 1 54 LEU 3.04 0.54 1 55 GLU -3.73 1.98 1 56 ILE -3.18 1.96 1 57 LEU -1.01 0.20 1 58 ASP -1.00 -0.28 1 59 THR -1.78 1.89 1 60 ALA -2.78 1.89 1 62 THR -0.59 -0.08 1 63 GLU 2.06 -0.83 1 64 GLN 1.83 -0.78 1 65 PHE 1.15 -0.83 1 66 THR 1.72 -0.14 1 67 ALA 2.91 -1.15 1 68 MET 1.67 -0.99 1 69 ARG 4.10 -1.51 1 71 LEU 3.90 -1.07 1 74 LYS 3.94 -0.69 1 75 ASN 0.68 -0.03 1 77 GLN -2.22 2.25 1 79 PHE -4.21 3.46 1 80 ALA -2.54 -0.45 1 81 LEU -0.28 -0.24 1 82 VAL -1.99 0.17 1 83 TYR -2.80 -0.10 1 84 SER -5.44 0.97 1 85 ILE 4.32 -1.09 1 86 THR 0.29 -0.87 1 87 ALA -3.20 2.00 1 88 GLN 4.04 -0.89 1 89 SER 5.87 -2.64 1 90 THR 3.41 -1.19 1 91 PHE 1.61 0.35 1 92 ASN 4.47 -2.08 1 93 ASP 2.24 -0.62 1 94 LEU 1.84 0.25 1 95 GLN 5.97 -1.84 1 96 ASP 2.54 -0.23 1 97 LEU 2.75 -0.34 1 98 ARG 6.21 -2.60 1 99 GLU 3.80 -1.43 1 100 GLN 5.04 -1.78 1 101 ILE 4.97 -0.80 1 102 LEU 5.06 -2.43 1 103 ARG 3.68 -0.91 1 104 VAL 4.22 -1.19 1 105 LYS 1.08 -1.33 1 106 ASP 1.44 -1.31 1 107 THR -0.90 -1.56 1 108 ASP 0.11 -0.66 1 109 ASP -0.49 -0.65 1 110 VAL -4.42 2.93 1 112 MET -4.06 3.61 1 113 ILE -5.15 3.66 1 114 LEU -2.49 1.22 1 115 VAL -4.15 2.08 1 117 ASN -3.73 2.17 1 118 LYS 4.99 -4.18 1 120 ASP 0.77 -0.92 1 122 GLU 3.02 -0.39 1 123 ASP 3.39 -1.50 1 124 GLU -2.83 0.84 1 125 ARG 1.84 0.52 1 126 VAL -1.05 1.02 1 127 VAL 0.08 -1.05 1 129 LYS 4.63 -0.83 1 130 GLU 4.05 -1.70 1 131 GLN 4.92 -1.60 1 133 GLN 3.31 -1.10 1 134 ASN 3.70 -1.24 1 135 LEU 3.48 -1.58 1 136 ALA 3.62 -1.22 1 137 ARG 4.86 -1.07 1 138 GLN 3.76 -1.42 1 140 ASN 2.95 -2.44 1 141 ASN 2.92 -2.07 1 143 ALA 0.31 0.41 1 144 PHE -5.00 3.09 1 145 LEU -4.61 3.36 1 146 GLU -3.28 1.48 1 148 SER -2.64 1.35 1 149 ALA 2.70 -0.52 1 150 LYS 0.62 1.10 1 151 SER -0.38 -0.35 1 152 LYS 6.25 -4.28 1 153 ILE -1.41 0.53 1 154 ASN 2.87 -1.81 1 155 VAL 4.99 -1.42 1 156 ASN 4.29 -1.80 1 157 GLU 5.37 -1.36 1 158 ILE 3.10 0.48 1 159 PHE 3.87 -1.39 1 160 TYR 2.69 -2.45 1 161 ASP 2.99 0.82 1 162 LEU 2.47 0.31 1 163 VAL 6.37 -1.79 1 164 ARG 6.07 -1.94 1 165 GLN 2.23 1.35 1 166 ILE 4.18 -0.70 1 167 ASN 0.67 -0.32 1 168 ARG 3.12 -0.14 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30353_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.10 _LACS_plot.Line_1_terminator_val_y_1 0.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.31 _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 8.27 _LACS_plot.Line_2_terminator_val_y_2 -1.04 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 150 LYS 0.62 -1.84 0 10 LEU -5.79 0.25 1 12 SER 1.99 -0.15 1 13 VAL 3.20 -0.22 1 17 LYS 8.27 -0.85 1 18 SER 5.37 -0.42 1 19 ALA 2.44 -0.53 1 20 LEU 3.07 -0.53 1 21 THR -1.54 -0.18 1 23 GLN 3.05 -0.16 1 24 PHE 3.16 -0.58 1 25 VAL 4.44 -1.04 1 26 GLN -1.41 0.03 1 28 ILE -6.12 0.29 1 29 PHE -2.64 0.41 1 30 VAL -2.68 -0.19 1 31 GLU -0.36 -0.64 1 32 LYS -0.72 0.01 1 33 TYR -0.16 -0.39 1 34 ASP -0.34 -0.43 1 36 THR -0.07 -0.12 1 38 GLU -4.27 0.51 1 39 ASP -3.92 0.06 1 40 SER -3.45 0.97 1 41 TYR -4.41 -0.08 1 42 ARG -3.99 1.21 1 43 LYS -5.25 -0.06 1 44 GLN -0.77 0.92 1 45 VAL -5.86 0.49 1 46 GLU -3.25 0.52 1 47 VAL -1.78 -0.41 1 48 ASP 4.17 -0.59 1 49 ALA 2.62 -0.51 1 50 GLN -3.44 0.22 1 51 GLN 1.21 0.10 1 53 MET -0.50 0.58 1 55 GLU -3.73 0.56 1 56 ILE -3.18 0.22 1 57 LEU -1.01 0.21 1 58 ASP -1.00 0.01 1 59 THR -1.78 -0.10 1 60 ALA -2.78 0.27 1 62 THR -0.59 -0.02 1 63 GLU 2.06 -0.22 1 64 GLN 1.83 -0.34 1 65 PHE 1.15 -0.01 1 66 THR 1.72 -0.34 1 67 ALA 2.91 -0.26 1 68 MET 1.67 -0.22 1 69 ARG 4.10 -1.05 1 71 LEU 3.90 -0.37 1 74 LYS 3.94 -0.59 1 75 ASN 0.68 -0.26 1 77 GLN -2.22 0.10 1 79 PHE -4.21 0.65 1 80 ALA -2.54 0.76 1 81 LEU -0.28 0.55 1 82 VAL -1.99 0.95 1 83 TYR -2.80 0.34 1 84 SER -5.44 0.42 1 85 ILE 4.32 -0.09 1 86 THR 0.29 0.18 1 87 ALA -3.20 0.49 1 88 GLN 4.04 -0.76 1 89 SER 5.87 -0.47 1 90 THR 3.41 -0.11 1 91 PHE 1.61 -0.78 1 92 ASN 4.47 -0.55 1 93 ASP 2.24 -0.20 1 94 LEU 1.84 -0.31 1 95 GLN 5.97 -0.31 1 96 ASP 2.54 -0.34 1 97 LEU 2.75 -0.42 1 98 ARG 6.21 -1.09 1 99 GLU 3.80 -0.77 1 100 GLN 5.04 -0.54 1 101 ILE 4.97 -1.00 1 102 LEU 5.06 -0.61 1 103 ARG 3.68 -0.38 1 104 VAL 4.22 -0.49 1 105 LYS 1.08 -0.28 1 106 ASP 1.44 -0.45 1 107 THR -0.90 0.07 1 108 ASP 0.11 -0.10 1 109 ASP -0.49 -0.02 1 110 VAL -4.42 0.00 1 112 MET -4.06 1.21 1 113 ILE -5.15 0.50 1 114 LEU -2.49 0.80 1 115 VAL -4.15 0.60 1 117 ASN -3.73 0.54 1 118 LYS 4.99 -0.31 1 120 ASP 0.77 -0.20 1 121 LEU 1.46 0.27 1 122 GLU 3.02 -0.61 1 123 ASP 3.39 -0.32 1 124 GLU -2.83 -0.06 1 125 ARG 1.84 -1.06 1 126 VAL -1.05 0.14 1 127 VAL 0.08 -0.30 1 129 LYS 4.63 -0.23 1 130 GLU 4.05 -0.46 1 131 GLN 4.92 -0.53 1 133 GLN 3.31 -1.24 1 134 ASN 3.70 -0.54 1 135 LEU 3.48 -0.71 1 136 ALA 3.62 -0.59 1 137 ARG 4.86 -0.51 1 138 GLN 3.76 -0.33 1 139 TRP -1.88 0.12 1 140 ASN 2.95 -0.48 1 141 ASN 2.92 -0.50 1 143 ALA 0.31 -0.06 1 144 PHE -5.00 1.32 1 145 LEU -4.61 -0.59 1 146 GLU -3.28 0.59 1 147 SER -7.10 0.30 1 148 SER -2.64 0.48 1 149 ALA 2.70 -0.42 1 151 SER -0.38 -0.27 1 152 LYS 6.25 -0.95 1 153 ILE -1.41 -0.17 1 154 ASN 2.87 0.00 1 155 VAL 4.99 -0.68 1 156 ASN 4.29 -0.65 1 157 GLU 5.37 -0.95 1 158 ILE 3.10 -1.21 1 159 PHE 3.87 -1.08 1 160 TYR 2.69 -0.53 1 161 ASP 2.99 -0.49 1 162 LEU 2.47 -0.61 1 163 VAL 6.37 -1.18 1 164 ARG 6.07 -0.57 1 165 GLN 2.23 -0.45 1 166 ILE 4.18 -0.58 1 167 ASN 0.67 -0.16 1 168 ARG 3.12 -0.46 1 stop_ save_