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 bmr11348_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 -3.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 4.11 _LACS_plot.Line_2_terminator_val_y_2 2.73 _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 127 GLU -8.91 -2.83 0 10 HIS 2.23 4.10 0 12 ARG 4.12 1.97 1 13 THR -6.74 -2.38 1 15 ARG 3.76 3.12 1 16 LEU 0.41 -1.74 1 17 VAL 0.45 0.41 1 18 SER -2.15 -1.34 1 19 LEU -4.46 -1.76 1 20 SER -0.06 -0.11 1 21 ALA 3.24 2.23 1 24 ARG -0.17 0.91 1 25 THR -1.95 0.00 1 26 ALA -7.91 -2.90 1 27 ARG -5.89 -2.39 1 28 ARG -1.76 -0.19 1 29 GLN 0.95 0.35 1 30 GLN 0.69 2.32 1 33 GLN -1.89 1.19 1 34 GLU -4.30 -2.29 1 35 PHE -1.89 -2.78 1 36 ASN -1.26 -2.00 1 37 HIS 4.09 3.53 1 39 LEU 0.00 2.10 1 40 VAL -5.08 -2.07 1 41 LEU -5.20 -0.90 1 42 SER 0.38 0.63 1 43 ARG 3.27 3.39 1 44 GLU -3.52 -1.37 1 46 LEU 1.41 -0.22 1 47 ARG -2.26 -1.79 1 48 ASP 1.73 1.16 1 50 ARG -0.92 -1.93 1 51 VAL 2.25 0.92 1 52 PHE -0.32 0.31 1 53 THR 0.65 0.71 1 54 VAL -6.14 -4.57 1 55 ARG -6.27 -2.70 1 56 ILE 2.81 1.31 1 57 ASP -0.57 1.32 1 58 ARG -4.91 -1.44 1 59 LYS -6.28 -2.35 1 60 VAL -2.61 -1.48 1 61 ASN 0.99 1.14 1 62 SER 1.71 0.73 1 63 TRP -5.28 -2.41 1 64 SER 0.55 0.55 1 66 SER -4.79 -3.42 1 67 ILE -1.70 -0.10 1 68 GLU -4.46 -3.29 1 69 ILE -6.66 -2.47 1 71 VAL -7.82 -3.89 1 72 THR -2.01 -1.98 1 73 ALA -0.54 -0.04 1 74 LEU -0.61 -0.54 1 75 ASP -4.30 -2.99 1 77 SER 3.95 3.46 1 78 VAL -2.31 -1.52 1 79 LEU 0.21 0.98 1 80 ASP -0.94 -1.63 1 81 PHE 3.07 2.67 1 83 SER 2.77 1.81 1 84 SER -2.64 -1.26 1 85 ALA 3.06 2.50 1 86 THR 3.82 2.45 1 88 LEU 1.44 0.20 1 89 LYS -1.17 -1.38 1 92 SER -2.87 -0.39 1 93 TRP -3.77 0.25 1 94 VAL -5.99 -1.52 1 95 VAL 0.22 -1.13 1 96 SER -2.84 -2.46 1 99 SER -1.45 -0.38 1 100 VAL -0.45 -0.93 1 101 LEU -3.02 -1.23 1 102 ARG -4.09 -2.11 1 103 ASP 2.93 1.24 1 105 ARG -3.45 -1.94 1 106 SER 2.74 1.46 1 107 VAL -1.73 -1.08 1 108 LEU -1.28 1.36 1 109 GLU -2.84 -0.82 1 110 GLU 2.02 0.07 1 111 TYR -0.90 0.14 1 113 GLN -3.53 -1.46 1 114 ASP -0.23 -0.14 1 115 LEU 3.64 2.39 1 116 ASP 2.96 2.47 1 117 GLN -0.42 -0.68 1 118 LEU 0.88 0.24 1 120 GLU 2.83 1.81 1 122 ASP 0.45 1.46 1 123 ARG -4.00 -1.93 1 124 VAL -4.61 -3.02 1 126 VAL -6.56 -3.21 1 128 ARG -2.12 -2.08 1 129 THR -3.35 -1.32 1 130 VAL 3.73 2.41 1 131 ALA -0.54 -0.91 1 133 GLU -3.20 -2.89 1 134 LEU -3.65 -1.97 1 135 ARG -3.68 -0.22 1 136 LEU -3.28 -1.06 1 137 TRP -4.36 -2.54 1 138 VAL -2.17 -0.91 1 139 ASN 3.18 1.43 1 141 ARG -2.61 -1.34 1 142 ASP 0.78 -0.43 1 145 VAL 3.65 2.70 1 146 ALA 0.26 -0.02 1 147 ALA -4.91 -1.53 1 148 THR -3.32 -1.94 1 150 LEU 2.68 1.12 1 153 ARG -1.53 -1.51 1 154 VAL -7.73 -3.91 1 155 TRP -1.50 1.36 1 156 ALA -1.73 -0.60 1 157 VAL -4.22 -2.17 1 158 VAL -2.39 -1.13 1 159 ASP -6.41 -1.90 1 160 LEU 3.61 0.04 1 161 TYR -2.24 -1.39 1 163 LYS 1.27 3.11 1 165 THR 0.64 0.20 1 166 GLN -1.77 0.89 1 167 ILE -8.48 -2.92 1 168 THR -2.35 0.50 1 169 VAL 1.03 0.79 1 170 LEU 0.03 0.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11348_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 5.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 4.11 _LACS_plot.Line_2_terminator_val_y_2 -1.38 _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 127 GLU -8.91 6.08 0 10 HIS 2.23 1.87 0 12 ARG 4.12 -2.15 1 13 THR -6.74 4.36 1 15 ARG 3.76 -0.64 1 16 LEU 0.41 -2.15 1 17 VAL 0.45 -0.04 1 18 SER -2.15 0.81 1 19 LEU -4.46 2.70 1 20 SER -0.06 -0.05 1 21 ALA 3.24 -1.01 1 24 ARG -0.17 1.08 1 25 THR -1.95 1.95 1 26 ALA -7.91 5.01 1 27 ARG -5.89 3.50 1 28 ARG -1.76 1.57 1 29 GLN 0.95 -0.60 1 30 GLN 0.69 1.63 1 33 GLN -1.89 3.08 1 34 GLU -4.30 2.01 1 35 PHE -1.89 -0.89 1 36 ASN -1.26 -0.74 1 37 HIS 4.09 -0.56 1 39 LEU 0.00 2.10 1 40 VAL -5.08 3.01 1 41 LEU -5.20 4.30 1 42 SER 0.38 0.25 1 43 ARG 3.27 0.12 1 44 GLU -3.52 2.15 1 46 LEU 1.41 -1.63 1 47 ARG -2.26 0.47 1 48 ASP 1.73 -0.57 1 50 ARG -0.92 -1.01 1 51 VAL 2.25 -1.33 1 52 PHE -0.32 0.63 1 53 THR 0.65 0.06 1 54 VAL -6.14 1.57 1 55 ARG -6.27 3.57 1 56 ILE 2.81 -1.50 1 57 ASP -0.57 1.89 1 58 ARG -4.91 3.47 1 59 LYS -6.28 3.93 1 60 VAL -2.61 1.13 1 61 ASN 0.99 0.15 1 62 SER 1.71 -0.98 1 63 TRP -5.28 2.87 1 64 SER 0.55 0.00 1 66 SER -4.79 1.37 1 67 ILE -1.70 1.60 1 68 GLU -4.46 1.17 1 69 ILE -6.66 4.19 1 71 VAL -7.82 3.93 1 72 THR -2.01 0.03 1 73 ALA -0.54 0.50 1 74 LEU -0.61 0.07 1 75 ASP -4.30 1.31 1 77 SER 3.95 -0.49 1 78 VAL -2.31 0.79 1 79 LEU 0.21 0.77 1 80 ASP -0.94 -0.69 1 81 PHE 3.07 -0.40 1 83 SER 2.77 -0.96 1 84 SER -2.64 1.38 1 85 ALA 3.06 -0.56 1 86 THR 3.82 -1.37 1 88 LEU 1.44 -1.24 1 89 LYS -1.17 -0.21 1 92 SER -2.87 2.48 1 93 TRP -3.77 4.02 1 94 VAL -5.99 4.47 1 95 VAL 0.22 -1.35 1 96 SER -2.84 0.38 1 99 SER -1.45 1.07 1 100 VAL -0.45 -0.48 1 101 LEU -3.02 1.79 1 102 ARG -4.09 1.98 1 103 ASP 2.93 -1.69 1 105 ARG -3.45 1.51 1 106 SER 2.74 -1.28 1 107 VAL -1.73 0.65 1 108 LEU -1.28 2.64 1 109 GLU -2.84 2.02 1 110 GLU 2.02 -1.95 1 111 TYR -0.90 1.04 1 113 GLN -3.53 2.07 1 114 ASP -0.23 0.09 1 115 LEU 3.64 -1.25 1 116 ASP 2.96 -0.49 1 117 GLN -0.42 -0.26 1 118 LEU 0.88 -0.64 1 120 GLU 2.83 -1.02 1 122 ASP 0.45 1.01 1 123 ARG -4.00 2.07 1 124 VAL -4.61 1.59 1 126 VAL -6.56 3.35 1 128 ARG -2.12 0.04 1 129 THR -3.35 2.03 1 130 VAL 3.73 -1.32 1 131 ALA -0.54 -0.37 1 133 GLU -3.20 0.31 1 134 LEU -3.65 1.68 1 135 ARG -3.68 3.46 1 136 LEU -3.28 2.22 1 137 TRP -4.36 1.82 1 138 VAL -2.17 1.26 1 139 ASN 3.18 -1.75 1 141 ARG -2.61 1.27 1 142 ASP 0.78 -1.21 1 145 VAL 3.65 -0.95 1 146 ALA 0.26 -0.28 1 147 ALA -4.91 3.38 1 148 THR -3.32 1.38 1 150 LEU 2.68 -1.56 1 153 ARG -1.53 0.02 1 154 VAL -7.73 3.82 1 155 TRP -1.50 2.86 1 156 ALA -1.73 1.13 1 157 VAL -4.22 2.05 1 158 VAL -2.39 1.26 1 159 ASP -6.41 4.51 1 160 LEU 3.61 -3.57 1 161 TYR -2.24 0.85 1 163 LYS 1.27 1.84 1 165 THR 0.64 -0.44 1 166 GLN -1.77 2.66 1 167 ILE -8.48 5.56 1 168 THR -2.35 2.85 1 169 VAL 1.03 -0.24 1 170 LEU 0.03 0.44 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11348_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 1.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.37 _LACS_plot.Line_2_terminator_val_x_2 4.11 _LACS_plot.Line_2_terminator_val_y_2 -0.43 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 ASP -4.30 -2.56 0 10 HIS 2.23 -1.00 1 12 ARG 4.12 0.01 1 13 THR -6.74 0.32 1 15 ARG 3.76 -0.24 1 16 LEU 0.41 0.33 1 17 VAL 0.45 0.50 1 18 SER -2.15 0.33 1 19 LEU -4.46 0.80 1 20 SER -0.06 -0.04 1 21 ALA 3.24 -0.19 1 24 ARG -0.17 0.24 1 25 THR -1.95 1.14 1 26 ALA -7.91 0.98 1 27 ARG -5.89 1.13 1 28 ARG -1.76 0.40 1 29 GLN 0.95 -0.23 1 30 GLN 0.69 -0.53 1 33 GLN -1.89 0.43 1 34 GLU -4.30 0.31 1 35 PHE -1.89 -0.91 1 36 ASN -1.26 0.47 1 37 HIS 4.09 -0.53 1 39 LEU 0.00 0.23 1 40 VAL -5.08 0.85 1 41 LEU -5.20 1.41 1 42 SER 0.38 0.00 1 43 ARG 3.27 -0.15 1 44 GLU -3.52 0.39 1 46 LEU 1.41 -0.14 1 47 ARG -2.26 0.15 1 48 ASP 1.73 0.06 1 50 ARG -0.92 0.25 1 51 VAL 2.25 -0.32 1 52 PHE -0.32 -0.06 1 53 THR 0.65 0.53 1 54 VAL -6.14 1.05 1 55 ARG -6.27 0.74 1 56 ILE 2.81 -0.10 1 57 ASP -0.57 0.17 1 58 ARG -4.91 0.55 1 59 LYS -6.28 1.45 1 60 VAL -2.61 0.43 1 61 ASN 0.99 0.07 1 62 SER 1.71 -0.42 1 63 TRP -5.28 0.21 1 64 SER 0.55 0.12 1 66 SER -4.79 0.75 1 67 ILE -1.70 0.46 1 68 GLU -4.46 0.86 1 69 ILE -6.66 1.40 1 71 VAL -7.82 1.68 1 72 THR -2.01 1.30 1 73 ALA -0.54 0.77 1 74 LEU -0.61 -0.46 1 77 SER 3.95 -0.44 1 78 VAL -2.31 0.22 1 79 LEU 0.21 -0.56 1 80 ASP -0.94 0.22 1 81 PHE 3.07 -1.07 1 83 SER 2.77 -1.15 1 84 SER -2.64 0.43 1 85 ALA 3.06 -0.57 1 86 THR 3.82 -0.55 1 88 LEU 1.44 -0.27 1 89 LYS -1.17 0.40 1 92 SER -2.87 0.86 1 93 TRP -3.77 0.96 1 94 VAL -5.99 0.27 1 95 VAL 0.22 0.94 1 96 SER -2.84 0.36 1 99 SER -1.45 0.66 1 100 VAL -0.45 0.38 1 101 LEU -3.02 0.65 1 102 ARG -4.09 0.45 1 103 ASP 2.93 -0.20 1 105 ARG -3.45 0.32 1 106 SER 2.74 0.06 1 107 VAL -1.73 0.52 1 108 LEU -1.28 0.21 1 109 GLU -2.84 0.50 1 110 GLU 2.02 -0.28 1 111 TYR -0.90 -0.11 1 113 GLN -3.53 -0.07 1 114 ASP -0.23 -0.15 1 115 LEU 3.64 -0.33 1 116 ASP 2.96 0.07 1 117 GLN -0.42 0.02 1 118 LEU 0.88 0.01 1 120 GLU 2.83 -0.56 1 122 ASP 0.45 0.47 1 123 ARG -4.00 1.26 1 124 VAL -4.61 1.31 1 126 VAL -6.56 1.25 1 127 GLU -8.91 0.31 1 128 ARG -2.12 0.85 1 129 THR -3.35 0.17 1 130 VAL 3.73 -0.33 1 131 ALA -0.54 0.08 1 133 GLU -3.20 0.33 1 134 LEU -3.65 0.74 1 135 ARG -3.68 0.49 1 136 LEU -3.28 1.27 1 137 TRP -4.36 0.67 1 138 VAL -2.17 0.84 1 139 ASN 3.18 -0.34 1 141 ARG -2.61 0.35 1 142 ASP 0.78 -1.65 1 145 VAL 3.65 -0.32 1 146 ALA 0.26 -0.49 1 147 ALA -4.91 0.19 1 148 THR -3.32 0.22 1 150 LEU 2.68 -1.11 1 153 ARG -1.53 0.19 1 154 VAL -7.73 1.05 1 155 TRP -1.50 -0.35 1 156 ALA -1.73 0.37 1 157 VAL -4.22 0.65 1 158 VAL -2.39 0.50 1 159 ASP -6.41 0.49 1 160 LEU 3.61 -0.17 1 161 TYR -2.24 -0.10 1 163 LYS 1.27 0.24 1 165 THR 0.64 0.23 1 166 GLN -1.77 1.22 1 167 ILE -8.48 1.40 1 168 THR -2.35 0.99 1 169 VAL 1.03 -0.10 1 170 LEU 0.03 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11348_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 -2.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 4.11 _LACS_plot.Line_2_terminator_val_y_2 0.36 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 170 LEU 0.03 -8.20 0 10 HIS 2.23 0.99 1 12 ARG 4.12 -2.49 1 13 THR -6.74 0.18 1 15 ARG 3.76 0.94 1 16 LEU 0.41 -2.03 1 17 VAL 0.45 0.26 1 18 SER -2.15 -0.79 1 19 LEU -4.46 -0.26 1 20 SER -0.06 1.32 1 24 ARG -0.17 -1.35 1 25 THR -1.95 -2.58 1 26 ALA -7.91 -3.57 1 27 ARG -5.89 -2.21 1 28 ARG -1.76 -0.48 1 29 GLN 0.95 -2.97 1 30 GLN 0.69 1.05 1 33 GLN -1.89 -1.12 1 34 GLU -4.30 -0.27 1 35 PHE -1.89 -4.27 1 36 ASN -1.26 -3.12 1 37 HIS 4.09 2.22 1 39 LEU 0.00 -0.94 1 40 VAL -5.08 -2.85 1 41 LEU -5.20 -0.16 1 42 SER 0.38 -1.06 1 43 ARG 3.27 0.47 1 44 GLU -3.52 -1.22 1 46 LEU 1.41 0.27 1 47 ARG -2.26 0.42 1 48 ASP 1.73 2.47 1 50 ARG -0.92 -0.82 1 51 VAL 2.25 -0.59 1 52 PHE -0.32 -1.82 1 53 THR 0.65 -1.81 1 54 VAL -6.14 -3.62 1 55 ARG -6.27 -0.17 1 56 ILE 2.81 -1.28 1 57 ASP -0.57 0.29 1 58 ARG -4.91 -2.57 1 59 LYS -6.28 -0.06 1 60 VAL -2.61 -0.44 1 61 ASN 0.99 1.08 1 62 SER 1.71 -1.60 1 63 TRP -5.28 -1.10 1 64 SER 0.55 0.22 1 66 SER -4.79 -1.09 1 67 ILE -1.70 -4.36 1 68 GLU -4.46 -1.94 1 69 ILE -6.66 -3.78 1 71 VAL -7.82 -2.09 1 72 THR -2.01 -2.88 1 73 ALA -0.54 -0.13 1 74 LEU -0.61 -5.83 1 75 ASP -4.30 1.41 1 77 SER 3.95 0.45 1 78 VAL -2.31 -0.33 1 79 LEU 0.21 -2.38 1 80 ASP -0.94 -0.81 1 81 PHE 3.07 0.50 1 83 SER 2.77 -0.75 1 84 SER -2.64 0.28 1 85 ALA 3.06 1.33 1 86 THR 3.82 -0.07 1 88 LEU 1.44 -3.04 1 89 LYS -1.17 -0.41 1 92 SER -2.87 -2.76 1 93 TRP -3.77 -1.74 1 94 VAL -5.99 -3.47 1 95 VAL 0.22 -1.90 1 96 SER -2.84 1.44 1 99 SER -1.45 -2.74 1 100 VAL -0.45 -1.54 1 101 LEU -3.02 -1.83 1 102 ARG -4.09 -0.09 1 103 ASP 2.93 -0.14 1 105 ARG -3.45 -0.79 1 106 SER 2.74 1.66 1 107 VAL -1.73 -0.48 1 108 LEU -1.28 -3.10 1 109 GLU -2.84 -0.94 1 110 GLU 2.02 -1.29 1 111 TYR -0.90 0.07 1 113 GLN -3.53 -2.96 1 114 ASP -0.23 2.96 1 115 LEU 3.64 1.73 1 116 ASP 2.96 1.12 1 117 GLN -0.42 0.84 1 118 LEU 0.88 0.34 1 120 GLU 2.83 1.73 1 122 ASP 0.45 0.84 1 123 ARG -4.00 -1.14 1 124 VAL -4.61 -3.55 1 126 VAL -6.56 -4.05 1 127 GLU -8.91 -2.40 1 128 ARG -2.12 0.24 1 129 THR -3.35 1.59 1 130 VAL 3.73 0.38 1 131 ALA -0.54 -0.33 1 133 GLU -3.20 -1.10 1 134 LEU -3.65 -2.49 1 135 ARG -3.68 -2.43 1 136 LEU -3.28 -2.82 1 137 TRP -4.36 0.88 1 138 VAL -2.17 0.12 1 139 ASN 3.18 0.12 1 141 ARG -2.61 -1.84 1 142 ASP 0.78 1.29 1 145 VAL 3.65 -0.33 1 146 ALA 0.26 -2.21 1 147 ALA -4.91 -2.82 1 148 THR -3.32 -1.11 1 150 LEU 2.68 0.08 1 153 ARG -1.53 -2.35 1 154 VAL -7.73 -3.57 1 155 TRP -1.50 0.77 1 156 ALA -1.73 -2.22 1 157 VAL -4.22 -2.96 1 158 VAL -2.39 -4.11 1 159 ASP -6.41 1.02 1 160 LEU 3.61 -3.06 1 161 TYR -2.24 1.32 1 163 LYS 1.27 0.59 1 165 THR 0.64 0.63 1 166 GLN -1.77 -0.91 1 167 ILE -8.48 -2.07 1 168 THR -2.35 -1.26 1 169 VAL 1.03 -1.59 1 stop_ save_