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 bmr17070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.62 _LACS_plot.Line_1_terminator_val_y_1 -2.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.77 _LACS_plot.Line_2_terminator_val_x_2 7.44 _LACS_plot.Line_2_terminator_val_y_2 5.52 _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 95 SER -4.62 -2.05 0 10 VAL 6.05 4.23 1 11 ASP 4.45 3.28 1 12 ASN 3.98 2.46 1 13 ALA 2.80 2.44 1 14 LEU 3.75 3.17 1 15 ARG 4.31 2.88 1 16 ALA 4.34 2.63 1 17 VAL 4.68 3.28 1 19 ASP 4.00 2.97 1 20 ALA 3.81 2.55 1 21 SER 4.56 3.63 1 22 LYS 3.69 2.73 1 23 ARG 2.93 2.57 1 24 LEU 1.17 0.72 1 25 LEU 0.53 -1.21 1 26 SER -0.26 -0.18 1 27 ASP 0.72 0.52 1 28 LEU -0.21 -0.80 1 29 LEU -0.33 -0.66 1 32 SER -0.29 -0.20 1 33 THR -0.66 -0.44 1 35 THR -3.73 -1.89 1 36 PHE 4.75 4.04 1 37 GLN 5.46 3.70 1 38 GLU 2.73 2.17 1 39 ALA 3.22 1.89 1 40 GLN 3.99 3.41 1 41 SER 4.78 3.27 1 42 ARG 3.82 2.87 1 43 LEU 3.83 2.45 1 44 ASN 4.42 3.55 1 45 GLU 2.97 2.49 1 46 ALA 2.40 1.64 1 47 ALA 2.85 2.55 1 48 ALA 4.41 2.47 1 50 LEU 2.89 1.90 1 51 ASN 3.80 3.12 1 52 GLN 4.67 2.89 1 53 ALA 3.27 2.41 1 54 ALA 4.89 2.97 1 55 THR 6.06 4.66 1 56 GLU 3.66 2.52 1 57 LEU 3.80 3.13 1 58 VAL 6.44 4.34 1 59 GLN 4.92 3.23 1 60 ALA 2.43 1.47 1 61 SER 3.39 2.68 1 62 ARG 0.82 -0.30 1 64 THR 0.68 0.08 1 66 GLN 5.73 3.78 1 67 ASP 4.14 3.18 1 68 LEU 3.63 2.68 1 69 ALA 3.48 3.00 1 70 ARG 4.26 3.02 1 71 ALA 2.42 1.80 1 72 SER 6.63 5.04 1 74 ARG 4.43 2.69 1 75 PHE 5.32 4.83 1 77 GLN 3.75 2.84 1 78 ASP 4.88 2.88 1 79 PHE 6.03 4.81 1 80 SER 5.93 4.40 1 81 THR 5.30 3.94 1 82 PHE 4.11 3.39 1 83 LEU 3.99 2.29 1 84 GLU 3.87 3.00 1 85 ALA 3.59 1.67 1 87 VAL 5.95 4.16 1 88 GLU 4.11 2.41 1 89 MET 3.21 2.44 1 90 ALA 4.69 2.87 1 92 GLN -0.21 -1.08 1 93 ALA 0.85 0.10 1 97 GLU 4.74 3.26 1 98 ASP 3.17 3.08 1 99 ARG 5.17 4.23 1 100 ALA 3.64 2.14 1 101 GLN 3.74 2.75 1 102 VAL 6.77 5.16 1 103 VAL 7.45 5.72 1 104 SER 5.88 4.00 1 105 ASN 2.73 3.27 1 106 LEU 4.21 3.14 1 107 LYS 5.25 4.09 1 109 ILE 4.42 4.05 1 110 SER 5.47 4.02 1 111 MET 4.34 3.29 1 112 SER 5.66 3.79 1 113 SER 6.73 5.63 1 115 LYS 4.78 3.44 1 116 LEU 4.72 2.74 1 117 LEU 2.88 2.09 1 118 LEU 3.85 2.81 1 119 ALA 4.40 1.89 1 120 ALA 4.43 2.52 1 121 LYS 4.24 3.21 1 122 ALA 3.54 2.23 1 123 LEU 2.59 1.78 1 124 SER 4.20 3.24 1 125 THR 1.59 1.03 1 126 ASP 1.17 0.17 1 128 ALA -1.16 -1.37 1 129 SER -1.39 -1.06 1 131 ASN 3.42 2.71 1 132 LEU 2.85 2.03 1 133 LYS 5.62 4.70 1 135 GLN 3.98 2.96 1 136 LEU 4.46 3.58 1 137 ALA 4.54 2.62 1 138 ALA 3.61 2.20 1 139 ALA 3.83 1.79 1 140 ALA 3.98 2.78 1 141 ARG 3.96 2.22 1 142 ALA 3.92 2.19 1 143 VAL 6.44 4.81 1 144 THR 6.07 4.71 1 145 ASP 4.33 3.15 1 146 SER 5.81 4.35 1 147 ILE 6.11 5.02 1 148 ASN 4.30 2.85 1 149 GLN 4.31 3.13 1 150 LEU 3.72 2.74 1 151 ILE 4.98 2.57 1 152 THR 5.11 4.01 1 153 MET 2.82 2.63 1 155 THR 0.42 0.49 1 156 GLN 0.40 0.01 1 157 GLN -0.09 -0.14 1 158 ALA 0.14 0.97 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.62 _LACS_plot.Line_1_terminator_val_y_1 2.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _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 7.44 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _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 95 SER -4.62 2.57 0 10 VAL 6.05 -1.82 1 11 ASP 4.45 -1.17 1 12 ASN 3.98 -1.52 1 13 ALA 2.80 -0.36 1 14 LEU 3.75 -0.58 1 15 ARG 4.31 -1.43 1 16 ALA 4.34 -1.71 1 17 VAL 4.68 -1.40 1 19 ASP 4.00 -1.03 1 20 ALA 3.81 -1.26 1 21 SER 4.56 -0.93 1 22 LYS 3.69 -0.96 1 23 ARG 2.93 -0.36 1 24 LEU 1.17 -0.45 1 25 LEU 0.53 -1.74 1 26 SER -0.26 0.08 1 27 ASP 0.72 -0.20 1 28 LEU -0.21 -0.59 1 29 LEU -0.33 -0.33 1 32 SER -0.29 0.09 1 33 THR -0.66 0.22 1 35 THR -3.73 1.84 1 36 PHE 4.75 -0.71 1 37 GLN 5.46 -1.76 1 38 GLU 2.73 -0.56 1 39 ALA 3.22 -1.33 1 40 GLN 3.99 -0.58 1 41 SER 4.78 -1.51 1 42 ARG 3.82 -0.95 1 43 LEU 3.83 -1.38 1 44 ASN 4.42 -0.87 1 45 GLU 2.97 -0.48 1 46 ALA 2.40 -0.76 1 47 ALA 2.85 -0.30 1 48 ALA 4.41 -1.94 1 50 LEU 2.89 -0.99 1 51 ASN 3.80 -0.68 1 52 GLN 4.67 -1.78 1 53 ALA 3.27 -0.86 1 54 ALA 4.89 -1.92 1 55 THR 6.06 -1.40 1 56 GLU 3.66 -1.14 1 57 LEU 3.80 -0.67 1 58 VAL 6.44 -2.10 1 59 GLN 4.92 -1.69 1 60 ALA 2.43 -0.96 1 61 SER 3.39 -0.71 1 62 ARG 0.82 -1.12 1 64 THR 0.68 -0.60 1 66 GLN 5.73 -1.95 1 67 ASP 4.14 -0.96 1 68 LEU 3.63 -0.95 1 69 ALA 3.48 -0.48 1 70 ARG 4.26 -1.24 1 71 ALA 2.42 -0.62 1 72 SER 6.63 -1.59 1 74 ARG 4.43 -1.74 1 75 PHE 5.32 -0.49 1 77 GLN 3.75 -0.91 1 78 ASP 4.88 -2.00 1 79 PHE 6.03 -1.22 1 80 SER 5.93 -1.53 1 81 THR 5.30 -1.36 1 82 PHE 4.11 -0.72 1 83 LEU 3.99 -1.70 1 84 GLU 3.87 -0.87 1 85 ALA 3.59 -1.92 1 87 VAL 5.95 -1.79 1 88 GLU 4.11 -1.70 1 89 MET 3.21 -0.77 1 90 ALA 4.69 -1.82 1 92 GLN -0.21 -0.87 1 93 ALA 0.85 -0.75 1 97 GLU 4.74 -1.48 1 98 ASP 3.17 -0.09 1 99 ARG 5.17 -0.94 1 100 ALA 3.64 -1.50 1 101 GLN 3.74 -0.99 1 102 VAL 6.77 -1.61 1 103 VAL 7.45 -1.73 1 104 SER 5.88 -1.88 1 105 ASN 2.73 0.54 1 106 LEU 4.21 -1.07 1 107 LYS 5.25 -1.16 1 109 ILE 4.42 -0.37 1 110 SER 5.47 -1.45 1 111 MET 4.34 -1.05 1 112 SER 5.66 -1.87 1 113 SER 6.73 -1.10 1 115 LYS 4.78 -1.34 1 116 LEU 4.72 -1.98 1 117 LEU 2.88 -0.79 1 118 LEU 3.85 -1.04 1 119 ALA 4.40 -2.51 1 120 ALA 4.43 -1.91 1 121 LYS 4.24 -1.03 1 122 ALA 3.54 -1.31 1 123 LEU 2.59 -0.81 1 124 SER 4.20 -0.96 1 125 THR 1.59 -0.56 1 126 ASP 1.17 -1.00 1 128 ALA -1.16 -0.21 1 129 SER -1.39 0.33 1 131 ASN 3.42 -0.71 1 132 LEU 2.85 -0.82 1 133 LYS 5.62 -0.92 1 135 GLN 3.98 -1.02 1 136 LEU 4.46 -0.88 1 137 ALA 4.54 -1.92 1 138 ALA 3.61 -1.41 1 139 ALA 3.83 -2.04 1 140 ALA 3.98 -1.20 1 141 ARG 3.96 -1.74 1 142 ALA 3.92 -1.73 1 143 VAL 6.44 -1.63 1 144 THR 6.07 -1.36 1 145 ASP 4.33 -1.18 1 146 SER 5.81 -1.46 1 147 ILE 6.11 -1.09 1 148 ASN 4.30 -1.45 1 149 GLN 4.31 -1.18 1 150 LEU 3.72 -0.98 1 151 ILE 4.98 -2.41 1 152 THR 5.11 -1.10 1 153 MET 2.82 -0.19 1 155 THR 0.42 0.07 1 156 GLN 0.40 -0.39 1 157 GLN -0.09 -0.05 1 158 ALA 0.14 0.83 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.62 _LACS_plot.Line_1_terminator_val_y_1 0.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 7.44 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 SER -4.62 0.39 0 83 LEU 3.99 -0.92 0 10 VAL 6.05 -0.38 1 11 ASP 4.45 -0.16 1 12 ASN 3.98 -0.21 1 13 ALA 2.80 0.08 1 14 LEU 3.75 -0.44 1 15 ARG 4.31 -0.26 1 16 ALA 4.34 -0.06 1 17 VAL 4.68 -0.34 1 19 ASP 4.00 -0.16 1 20 ALA 3.81 -0.06 1 21 SER 4.56 -0.31 1 22 LYS 3.69 -0.26 1 23 ARG 2.93 -0.18 1 24 LEU 1.17 0.03 1 25 LEU 0.53 0.21 1 26 SER -0.26 0.04 1 27 ASP 0.72 -0.09 1 28 LEU -0.21 0.06 1 29 LEU -0.33 -0.05 1 32 SER -0.29 0.12 1 33 THR -0.66 0.15 1 35 THR -3.73 0.41 1 36 PHE 4.75 -0.63 1 37 GLN 5.46 -0.35 1 38 GLU 2.73 -0.34 1 39 ALA 3.22 -0.29 1 40 GLN 3.99 -0.57 1 41 SER 4.78 -0.22 1 42 ARG 3.82 -0.23 1 43 LEU 3.83 -0.40 1 44 ASN 4.42 -0.38 1 45 GLU 2.97 -0.18 1 46 ALA 2.40 -0.01 1 47 ALA 2.85 -0.30 1 48 ALA 4.41 -0.07 1 50 LEU 2.89 -0.22 1 51 ASN 3.80 -0.34 1 52 GLN 4.67 -0.21 1 53 ALA 3.27 -0.16 1 54 ALA 4.89 -0.28 1 55 THR 6.06 -0.45 1 56 GLU 3.66 -0.29 1 57 LEU 3.80 -0.34 1 58 VAL 6.44 -0.70 1 59 GLN 4.92 -0.36 1 60 ALA 2.43 -0.15 1 61 SER 3.39 -0.39 1 62 ARG 0.82 0.19 1 64 THR 0.68 0.26 1 66 GLN 5.73 -0.22 1 67 ASP 4.14 -0.19 1 68 LEU 3.63 -0.50 1 69 ALA 3.48 -0.40 1 70 ARG 4.26 -0.27 1 71 ALA 2.42 -0.07 1 72 SER 6.63 -0.36 1 74 ARG 4.43 -0.19 1 75 PHE 5.32 -0.69 1 77 GLN 3.75 -0.12 1 78 ASP 4.88 -0.16 1 79 PHE 6.03 -0.74 1 80 SER 5.93 -0.59 1 81 THR 5.30 -0.44 1 82 PHE 4.11 -0.68 1 84 GLU 3.87 -0.54 1 85 ALA 3.59 -0.29 1 87 VAL 5.95 -0.53 1 88 GLU 4.11 -0.20 1 89 MET 3.21 -0.35 1 90 ALA 4.69 -0.40 1 92 GLN -0.21 0.10 1 93 ALA 0.85 -0.20 1 97 GLU 4.74 -0.23 1 98 ASP 3.17 -0.16 1 99 ARG 5.17 -0.54 1 100 ALA 3.64 -0.20 1 101 GLN 3.74 -0.13 1 102 VAL 6.77 -0.52 1 103 VAL 7.45 -0.66 1 104 SER 5.88 -0.40 1 105 ASN 2.73 -0.04 1 106 LEU 4.21 -0.16 1 107 LYS 5.25 -0.28 1 109 ILE 4.42 -0.17 1 110 SER 5.47 -0.15 1 111 MET 4.34 -0.15 1 112 SER 5.66 -0.28 1 113 SER 6.73 -0.25 1 115 LYS 4.78 -0.36 1 116 LEU 4.72 -0.35 1 117 LEU 2.88 -0.35 1 118 LEU 3.85 -0.31 1 119 ALA 4.40 -0.11 1 120 ALA 4.43 -0.34 1 121 LYS 4.24 -0.51 1 122 ALA 3.54 -0.17 1 123 LEU 2.59 -0.28 1 124 SER 4.20 -0.39 1 125 THR 1.59 -0.01 1 126 ASP 1.17 -0.04 1 128 ALA -1.16 0.12 1 129 SER -1.39 -0.12 1 131 ASN 3.42 -0.19 1 132 LEU 2.85 -0.21 1 133 LYS 5.62 -0.40 1 135 GLN 3.98 -0.20 1 136 LEU 4.46 -0.42 1 137 ALA 4.54 -0.32 1 138 ALA 3.61 -0.18 1 139 ALA 3.83 -0.10 1 140 ALA 3.98 -0.36 1 141 ARG 3.96 -0.21 1 142 ALA 3.92 0.00 1 143 VAL 6.44 -0.44 1 144 THR 6.07 -0.24 1 145 ASP 4.33 -0.14 1 146 SER 5.81 -0.44 1 147 ILE 6.11 -0.53 1 148 ASN 4.30 -0.24 1 149 GLN 4.31 -0.23 1 150 LEU 3.72 -0.10 1 151 ILE 4.98 -0.35 1 152 THR 5.11 -0.32 1 153 MET 2.82 -0.14 1 155 THR 0.42 0.09 1 156 GLN 0.40 0.04 1 157 GLN -0.09 -0.01 1 158 ALA 0.14 -0.21 1 stop_ save_