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 bmr16267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.94 _LACS_plot.Line_1_terminator_val_y_1 -3.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.47 _LACS_plot.Line_2_terminator_val_x_2 6.67 _LACS_plot.Line_2_terminator_val_y_2 5.36 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 VAL 6.67 5.45 0 58 ASN -0.91 2.03 0 12 SER 0.31 0.35 1 14 ARG 0.30 0.18 1 15 GLU 0.49 0.57 1 16 ASN 0.46 0.24 1 17 LEU 0.42 0.37 1 18 TYR -0.08 -0.22 1 19 PHE -0.12 -0.03 1 20 GLN -0.05 0.25 1 22 HIS -0.99 1.15 1 23 MET -3.49 -0.76 1 24 LEU -4.41 -1.47 1 25 GLU -0.19 0.04 1 26 VAL -7.94 -3.54 1 27 GLU -3.18 -0.97 1 28 VAL 0.73 -0.06 1 29 ILE -4.38 -1.46 1 30 SER -4.25 -2.69 1 32 ARG 0.35 0.66 1 33 THR -0.87 -0.51 1 34 LEU 0.23 0.53 1 35 ASN 0.72 0.53 1 36 GLN 0.59 0.68 1 38 ALA -0.57 0.16 1 39 THR -1.48 -0.63 1 40 VAL 2.98 2.25 1 41 GLU 1.97 1.76 1 42 GLU 0.93 0.88 1 43 LYS 1.24 0.86 1 44 LEU 0.77 -0.44 1 45 THR -2.55 -0.52 1 46 GLU 2.72 2.54 1 47 GLU 3.58 2.98 1 48 TYR 3.60 3.45 1 49 PHE 2.17 1.95 1 50 ASN 1.38 1.05 1 51 ALA -0.33 0.63 1 52 VAL -2.56 -1.58 1 53 ASN -0.02 -0.69 1 54 TYR -6.70 -3.55 1 55 ALA -6.33 -3.37 1 56 GLU -3.12 -0.47 1 57 ILE -5.09 -1.25 1 59 GLU 4.02 4.16 1 60 GLU 3.76 3.55 1 61 ASP 4.36 3.49 1 62 TRP 5.02 3.51 1 63 ASN 3.26 2.51 1 64 ALA 3.48 2.80 1 65 LEU -1.52 0.06 1 67 LEU 1.18 -0.46 1 68 GLN -5.27 -2.07 1 69 GLU 3.66 3.03 1 71 ASP -0.76 0.95 1 72 ARG 0.22 0.14 1 73 VAL -7.05 -4.55 1 74 LYS -3.03 -2.04 1 75 VAL -1.96 -1.56 1 76 LYS -3.55 -0.82 1 77 THR -6.04 -2.67 1 78 GLU 2.30 1.67 1 79 PHE 1.22 1.42 1 81 GLU -7.45 -2.95 1 82 VAL -4.03 -1.33 1 83 VAL 0.14 -0.57 1 84 VAL -6.53 -3.57 1 85 PHE 2.67 2.94 1 86 ALA -3.93 -0.86 1 87 LYS -3.95 -0.80 1 88 LYS 1.62 0.42 1 90 ASP 0.83 -0.56 1 91 VAL -3.02 -1.98 1 93 LYS 2.30 1.95 1 95 MET -4.38 -1.24 1 96 ILE -5.01 -2.52 1 97 PHE -6.17 -2.53 1 98 ILE -5.35 -1.92 1 100 MET 2.34 1.74 1 103 TYR 6.33 3.66 1 104 ALA 3.64 2.65 1 105 ASN 2.17 1.53 1 106 MET 1.30 0.72 1 107 VAL -3.17 -1.98 1 108 ILE -0.77 -0.46 1 109 ASP -1.68 -1.07 1 111 SER 1.47 1.33 1 112 THR -0.28 0.06 1 113 ASP -0.53 -0.15 1 115 THR 0.48 0.83 1 117 MET 0.38 0.31 1 119 GLN 0.15 0.43 1 120 PHE 0.59 0.11 1 121 LYS -1.47 -0.56 1 123 VAL -3.79 -1.78 1 124 LYS 1.39 0.94 1 126 THR -5.47 -2.15 1 127 VAL -5.04 -2.56 1 128 GLU -7.13 -2.96 1 129 LYS 1.57 1.63 1 130 THR -2.49 -2.15 1 131 ASP -0.18 -0.12 1 132 GLU -0.20 0.88 1 133 LYS -1.38 -0.84 1 134 VAL 0.71 0.35 1 135 LEU -0.06 0.05 1 136 SER -1.24 -0.41 1 138 LYS 3.94 3.68 1 139 GLU 1.56 2.41 1 140 LEU 2.90 2.84 1 141 LEU 3.19 2.04 1 142 GLU 1.80 1.53 1 143 ALA 1.72 1.15 1 144 ILE 1.33 1.19 1 146 SER 0.22 1.55 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.94 _LACS_plot.Line_1_terminator_val_y_1 4.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.53 _LACS_plot.Line_2_terminator_val_x_2 6.67 _LACS_plot.Line_2_terminator_val_y_2 -1.31 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 VAL 6.67 -1.22 0 58 ASN -0.91 2.94 0 12 SER 0.31 0.04 1 14 ARG 0.30 -0.12 1 15 GLU 0.49 0.08 1 16 ASN 0.46 -0.22 1 17 LEU 0.42 -0.05 1 18 TYR -0.08 -0.14 1 19 PHE -0.12 0.09 1 20 GLN -0.05 0.30 1 22 HIS -0.99 2.14 1 23 MET -3.49 2.73 1 24 LEU -4.41 2.94 1 25 GLU -0.19 0.23 1 26 VAL -7.94 4.40 1 27 GLU -3.18 2.21 1 28 VAL 0.73 -0.79 1 29 ILE -4.38 2.92 1 30 SER -4.25 1.56 1 32 ARG 0.35 0.31 1 33 THR -0.87 0.36 1 34 LEU 0.23 0.30 1 35 ASN 0.72 -0.19 1 36 GLN 0.59 0.09 1 38 ALA -0.57 0.73 1 39 THR -1.48 0.85 1 40 VAL 2.98 -0.73 1 41 GLU 1.97 -0.21 1 42 GLU 0.93 -0.05 1 43 LYS 1.24 -0.38 1 44 LEU 0.77 -1.21 1 45 THR -2.55 2.03 1 46 GLU 2.72 -0.18 1 47 GLU 3.58 -0.60 1 48 TYR 3.60 -0.15 1 49 PHE 2.17 -0.22 1 50 ASN 1.38 -0.33 1 51 ALA -0.33 0.96 1 52 VAL -2.56 0.98 1 53 ASN -0.02 -0.67 1 54 TYR -6.70 3.15 1 55 ALA -6.33 2.96 1 56 GLU -3.12 2.65 1 57 ILE -5.09 3.84 1 59 GLU 4.02 0.14 1 60 GLU 3.76 -0.21 1 61 ASP 4.36 -0.87 1 62 TRP 5.02 -1.51 1 63 ASN 3.26 -0.75 1 64 ALA 3.48 -0.68 1 65 LEU -1.52 1.58 1 67 LEU 1.18 -1.64 1 68 GLN -5.27 3.20 1 69 GLU 3.66 -0.63 1 71 ASP -0.76 1.71 1 72 ARG 0.22 -0.08 1 73 VAL -7.05 2.50 1 74 LYS -3.03 0.99 1 75 VAL -1.96 0.40 1 76 LYS -3.55 2.73 1 77 THR -6.04 3.37 1 78 GLU 2.30 -0.63 1 79 PHE 1.22 0.20 1 81 GLU -7.45 4.50 1 82 VAL -4.03 2.70 1 83 VAL 0.14 -0.71 1 84 VAL -6.53 2.96 1 85 PHE 2.67 0.27 1 86 ALA -3.93 3.07 1 87 LYS -3.95 3.15 1 88 LYS 1.62 -1.20 1 90 ASP 0.83 -1.39 1 91 VAL -3.02 1.04 1 93 LYS 2.30 -0.35 1 95 MET -4.38 3.14 1 96 ILE -5.01 2.49 1 97 PHE -6.17 3.64 1 98 ILE -5.35 3.43 1 100 MET 2.34 -0.60 1 103 TYR 6.33 -2.67 1 104 ALA 3.64 -0.99 1 105 ASN 2.17 -0.64 1 106 MET 1.30 -0.58 1 107 VAL -3.17 1.19 1 108 ILE -0.77 0.31 1 109 ASP -1.68 0.61 1 111 SER 1.47 -0.14 1 112 THR -0.28 0.34 1 113 ASP -0.53 0.38 1 115 THR 0.48 0.35 1 117 MET 0.38 -0.07 1 119 GLN 0.15 0.28 1 120 PHE 0.59 -0.48 1 121 LYS -1.47 0.91 1 123 VAL -3.79 2.01 1 124 LYS 1.39 -0.45 1 126 THR -5.47 3.32 1 127 VAL -5.04 2.48 1 128 GLU -7.13 4.17 1 129 LYS 1.57 0.06 1 130 THR -2.49 0.34 1 131 ASP -0.18 0.06 1 132 GLU -0.20 1.08 1 133 LYS -1.38 0.54 1 134 VAL 0.71 -0.36 1 135 LEU -0.06 0.11 1 136 SER -1.24 0.83 1 138 LYS 3.94 -0.26 1 139 GLU 1.56 0.85 1 140 LEU 2.90 -0.06 1 141 LEU 3.19 -1.15 1 142 GLU 1.80 -0.27 1 143 ALA 1.72 -0.57 1 144 ILE 1.33 -0.14 1 146 SER 0.22 1.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.94 _LACS_plot.Line_1_terminator_val_y_1 0.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _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 6.67 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _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 109 ASP -1.68 -1.55 0 12 SER 0.31 0.00 1 14 ARG 0.30 -0.02 1 15 GLU 0.49 -0.14 1 16 ASN 0.46 -0.10 1 17 LEU 0.42 -0.12 1 18 TYR -0.08 -0.03 1 19 PHE -0.12 -0.08 1 20 GLN -0.05 -0.07 1 22 HIS -0.99 -0.04 1 23 MET -3.49 0.46 1 24 LEU -4.41 0.36 1 25 GLU -0.19 0.42 1 26 VAL -7.94 0.89 1 27 GLU -3.18 0.45 1 28 VAL 0.73 0.17 1 29 ILE -4.38 0.57 1 30 SER -4.25 0.08 1 32 ARG 0.35 0.19 1 33 THR -0.87 0.17 1 34 LEU 0.23 0.08 1 35 ASN 0.72 -0.06 1 36 GLN 0.59 -0.01 1 38 ALA -0.57 0.10 1 39 THR -1.48 0.08 1 40 VAL 2.98 -0.30 1 41 GLU 1.97 -0.27 1 42 GLU 0.93 -0.23 1 43 LYS 1.24 -0.60 1 44 LEU 0.77 0.21 1 45 THR -2.55 0.22 1 46 GLU 2.72 -0.05 1 47 GLU 3.58 -0.22 1 48 TYR 3.60 -0.27 1 49 PHE 2.17 -0.25 1 50 ASN 1.38 -0.23 1 51 ALA -0.33 0.34 1 52 VAL -2.56 0.39 1 53 ASN -0.02 -1.17 1 54 TYR -6.70 1.24 1 55 ALA -6.33 1.02 1 56 GLU -3.12 0.72 1 57 ILE -5.09 0.34 1 58 ASN -0.91 -0.13 1 59 GLU 4.02 -0.53 1 60 GLU 3.76 -0.04 1 61 ASP 4.36 -0.16 1 62 TRP 5.02 -0.80 1 63 ASN 3.26 0.01 1 64 ALA 3.48 -0.14 1 65 LEU -1.52 -0.11 1 67 LEU 1.18 -0.42 1 68 GLN -5.27 0.35 1 69 GLU 3.66 0.10 1 71 ASP -0.76 0.19 1 72 ARG 0.22 0.66 1 73 VAL -7.05 1.05 1 74 LYS -3.03 0.83 1 75 VAL -1.96 0.77 1 76 LYS -3.55 0.92 1 77 THR -6.04 0.66 1 78 GLU 2.30 -0.23 1 79 PHE 1.22 -0.17 1 81 GLU -7.45 1.34 1 82 VAL -4.03 0.41 1 83 VAL 0.14 0.87 1 84 VAL -6.53 0.36 1 85 PHE 2.67 -0.08 1 86 ALA -3.93 0.56 1 87 LYS -3.95 0.36 1 88 LYS 1.62 0.15 1 90 ASP 0.83 0.11 1 91 VAL -3.02 0.14 1 93 LYS 2.30 -0.42 1 95 MET -4.38 1.08 1 96 ILE -5.01 1.20 1 97 PHE -6.17 0.95 1 98 ILE -5.35 0.49 1 100 MET 2.34 -0.53 1 103 TYR 6.33 -0.58 1 104 ALA 3.64 -0.68 1 105 ASN 2.17 -0.29 1 106 MET 1.30 0.03 1 107 VAL -3.17 0.38 1 108 ILE -0.77 0.10 1 111 SER 1.47 -0.13 1 112 THR -0.28 0.00 1 113 ASP -0.53 -0.02 1 115 THR 0.48 -0.01 1 117 MET 0.38 0.07 1 119 GLN 0.15 -0.10 1 120 PHE 0.59 0.03 1 121 LYS -1.47 0.15 1 123 VAL -3.79 0.48 1 124 LYS 1.39 0.31 1 126 THR -5.47 1.27 1 127 VAL -5.04 1.09 1 128 GLU -7.13 0.64 1 129 LYS 1.57 0.16 1 130 THR -2.49 0.50 1 131 ASP -0.18 0.15 1 132 GLU -0.20 -0.33 1 133 LYS -1.38 -0.17 1 134 VAL 0.71 -0.43 1 135 LEU -0.06 0.00 1 136 SER -1.24 -0.22 1 137 VAL 6.67 -0.54 1 138 LYS 3.94 -0.44 1 139 GLU 1.56 -0.34 1 140 LEU 2.90 -0.31 1 141 LEU 3.19 -0.24 1 142 GLU 1.80 -0.22 1 143 ALA 1.72 -0.05 1 144 ILE 1.33 0.00 1 146 SER 0.22 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16267_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.94 _LACS_plot.Line_1_terminator_val_y_1 -2.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 6.67 _LACS_plot.Line_2_terminator_val_y_2 2.39 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 146 SER 0.22 4.09 0 82 VAL -4.03 -5.68 0 12 SER 0.31 0.61 1 14 ARG 0.30 0.06 1 15 GLU 0.49 -0.34 1 16 ASN 0.46 -0.25 1 17 LEU 0.42 -0.75 1 18 TYR -0.08 -0.55 1 19 PHE -0.12 -0.59 1 20 GLN -0.05 -0.26 1 22 HIS -0.99 -0.31 1 23 MET -3.49 -1.82 1 24 LEU -4.41 -1.45 1 25 GLU -0.19 -0.69 1 26 VAL -7.94 -1.62 1 27 GLU -3.18 -1.91 1 28 VAL 0.73 -1.05 1 29 ILE -4.38 -2.86 1 30 SER -4.25 -0.33 1 32 ARG 0.35 0.40 1 33 THR -0.87 -0.31 1 34 LEU 0.23 -0.39 1 35 ASN 0.72 0.14 1 36 GLN 0.59 0.37 1 38 ALA -0.57 0.21 1 39 THR -1.48 0.24 1 40 VAL 2.98 0.30 1 41 GLU 1.97 1.41 1 42 GLU 0.93 0.67 1 43 LYS 1.24 -0.47 1 44 LEU 0.77 0.12 1 45 THR -2.55 1.43 1 46 GLU 2.72 1.19 1 47 GLU 3.58 1.91 1 48 TYR 3.60 0.93 1 49 PHE 2.17 0.68 1 50 ASN 1.38 -0.30 1 51 ALA -0.33 1.22 1 52 VAL -2.56 -1.05 1 53 ASN -0.02 -1.88 1 54 TYR -6.70 -5.12 1 55 ALA -6.33 -1.25 1 56 GLU -3.12 -0.82 1 57 ILE -5.09 -1.32 1 58 ASN -0.91 1.87 1 59 GLU 4.02 0.23 1 60 GLU 3.76 3.64 1 61 ASP 4.36 0.42 1 62 TRP 5.02 1.90 1 63 ASN 3.26 3.75 1 64 ALA 3.48 1.96 1 65 LEU -1.52 -0.37 1 67 LEU 1.18 -2.62 1 68 GLN -5.27 -1.27 1 69 GLU 3.66 1.18 1 71 ASP -0.76 0.43 1 72 ARG 0.22 -0.95 1 73 VAL -7.05 -2.86 1 74 LYS -3.03 -1.18 1 75 VAL -1.96 -1.92 1 76 LYS -3.55 -0.95 1 77 THR -6.04 0.36 1 78 GLU 2.30 0.01 1 79 PHE 1.22 -0.39 1 81 GLU -7.45 -2.22 1 83 VAL 0.14 -1.22 1 84 VAL -6.53 -0.65 1 85 PHE 2.67 -0.71 1 86 ALA -3.93 -0.72 1 87 LYS -3.95 -2.91 1 88 LYS 1.62 0.92 1 90 ASP 0.83 -1.57 1 91 VAL -3.02 -2.05 1 93 LYS 2.30 1.70 1 95 MET -4.38 -2.51 1 96 ILE -5.01 -3.16 1 97 PHE -6.17 -1.55 1 98 ILE -5.35 -2.39 1 100 MET 2.34 -0.77 1 103 TYR 6.33 1.99 1 104 ALA 3.64 2.03 1 105 ASN 2.17 0.72 1 106 MET 1.30 0.92 1 107 VAL -3.17 -0.40 1 108 ILE -0.77 -2.85 1 109 ASP -1.68 0.67 1 111 SER 1.47 0.24 1 112 THR -0.28 -0.32 1 113 ASP -0.53 0.78 1 115 THR 0.48 0.83 1 117 MET 0.38 -0.32 1 119 GLN 0.15 -0.52 1 120 PHE 0.59 -0.77 1 121 LYS -1.47 -0.70 1 123 VAL -3.79 -1.34 1 124 LYS 1.39 0.08 1 126 THR -5.47 -1.49 1 127 VAL -5.04 -4.37 1 128 GLU -7.13 -2.35 1 129 LYS 1.57 -1.29 1 130 THR -2.49 -3.84 1 131 ASP -0.18 1.53 1 132 GLU -0.20 -1.79 1 133 LYS -1.38 -1.19 1 134 VAL 0.71 1.04 1 135 LEU -0.06 -0.18 1 136 SER -1.24 -0.70 1 137 VAL 6.67 1.42 1 138 LYS 3.94 2.29 1 139 GLU 1.56 2.80 1 140 LEU 2.90 1.69 1 141 LEU 3.19 2.41 1 142 GLU 1.80 1.16 1 143 ALA 1.72 1.07 1 144 ILE 1.33 0.70 1 stop_ save_