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 bmr30130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.77 _LACS_plot.Line_1_terminator_val_y_1 -3.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.88 _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 9.35 _LACS_plot.Line_2_terminator_val_y_2 5.93 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 HIS -7.56 0.02 0 129 LYS 9.35 7.33 0 11 SER -1.50 -0.75 1 12 ARG -0.26 -1.19 1 13 ILE 2.19 1.90 1 14 THR -0.56 -1.47 1 15 GLU -3.25 -1.04 1 16 THR -1.43 -1.09 1 17 PHE 0.89 2.20 1 19 LYS -0.83 -0.15 1 20 TYR 1.29 1.90 1 21 GLN -0.44 1.40 1 22 HIS -0.45 1.02 1 23 SER -1.68 -0.59 1 25 PHE -1.87 -1.82 1 26 ASP -1.28 -0.30 1 28 LYS -1.03 -0.22 1 30 TYR 4.17 2.64 1 32 ILE -6.19 -2.00 1 33 ASP -4.25 -2.19 1 34 PHE -4.48 -2.42 1 35 ALA 1.70 0.52 1 36 LEU -5.10 -2.16 1 38 LYS 3.07 2.04 1 40 THR 3.98 3.35 1 42 ILE -3.20 -3.70 1 43 LYS -4.59 -2.78 1 44 ALA -1.05 -1.15 1 46 THR -5.96 -2.49 1 47 ASN 0.44 -0.22 1 49 LYS -5.12 -1.74 1 50 VAL 3.05 1.38 1 51 THR 0.31 0.22 1 52 ARG -2.16 2.25 1 53 ILE -1.45 1.03 1 54 PHE -1.31 -1.61 1 55 ASN -4.32 -1.70 1 56 ASN -4.14 -0.80 1 57 GLU 4.33 3.92 1 58 LEU 1.59 1.38 1 61 LYS 2.76 1.98 1 62 VAL -1.04 -1.33 1 63 LEU -6.84 -1.45 1 64 GLN -6.65 -1.28 1 65 ILE -6.66 -1.56 1 66 ALA -3.49 -1.45 1 67 GLU 1.07 0.81 1 68 ASP 3.90 2.66 1 69 ASN 0.80 1.14 1 71 GLU -3.29 -0.13 1 72 TYR -3.50 -0.39 1 74 GLN -5.32 -2.35 1 75 TRP -9.77 -4.37 1 76 TYR -3.17 -1.41 1 77 LEU -4.03 -0.46 1 78 HIS 5.58 2.16 1 79 LEU 0.72 0.20 1 80 ASP -2.24 1.74 1 81 LYS -4.52 -1.12 1 82 TYR -2.82 -0.13 1 83 ASN -4.37 -1.15 1 84 VAL -7.90 -3.44 1 85 LYS -4.39 -2.03 1 86 VAL 5.56 3.66 1 88 ASP 1.80 1.37 1 89 ARG -0.16 -0.46 1 90 VAL -4.15 -2.85 1 91 LYS -3.90 -2.83 1 92 ALA 2.05 0.75 1 94 ASP 0.70 0.69 1 95 ILE 2.57 -0.19 1 96 ILE 0.50 0.75 1 97 ALA -4.88 -1.17 1 98 TYR -3.40 -1.48 1 99 SER 1.90 1.85 1 101 ASN -2.60 -1.67 1 102 THR 0.22 0.64 1 104 ILE 1.06 1.10 1 105 GLN 0.21 -0.03 1 106 THR -0.22 -0.57 1 107 THR 0.45 0.04 1 109 ALA 1.42 1.05 1 110 HIS -0.18 1.22 1 111 LEU -4.48 -0.81 1 112 HIS -4.21 0.59 1 113 PHE -5.00 -1.53 1 114 GLN -6.02 -2.29 1 115 ARG -3.19 -0.45 1 116 MET -4.25 -1.25 1 117 LYS -4.09 -1.37 1 120 VAL -0.83 -0.94 1 122 ASN 6.13 3.04 1 123 ALA 2.76 1.63 1 124 TYR -1.40 -0.80 1 125 ALA -0.89 0.60 1 126 GLU -7.08 -3.37 1 127 ASP -0.56 -0.61 1 131 PHE 3.05 2.47 1 132 ILE 4.09 2.39 1 133 ASP 3.09 2.35 1 134 GLN -0.38 -0.62 1 135 LEU 3.74 0.88 1 137 ASP -2.25 -1.84 1 139 GLU 2.15 2.35 1 140 ARG 3.75 1.31 1 141 SER 2.94 3.12 1 142 LEU -2.11 0.12 1 143 TYR -4.30 -2.53 1 144 ASP -3.35 -1.23 1 145 LEU -1.71 1.81 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.77 _LACS_plot.Line_1_terminator_val_y_1 6.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.92 _LACS_plot.Line_2_terminator_val_x_2 9.35 _LACS_plot.Line_2_terminator_val_y_2 -3.42 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 HIS -7.56 7.58 0 129 LYS 9.35 -2.02 0 11 SER -1.50 0.75 1 12 ARG -0.26 -0.93 1 13 ILE 2.19 -0.29 1 14 THR -0.56 -0.91 1 15 GLU -3.25 2.21 1 16 THR -1.43 0.34 1 17 PHE 0.89 1.31 1 19 LYS -0.83 0.68 1 20 TYR 1.29 0.61 1 21 GLN -0.44 1.84 1 22 HIS -0.45 1.47 1 23 SER -1.68 1.09 1 25 PHE -1.87 0.05 1 26 ASP -1.28 0.98 1 28 LYS -1.03 0.81 1 30 TYR 4.17 -1.53 1 32 ILE -6.19 4.19 1 33 ASP -4.25 2.06 1 34 PHE -4.48 2.06 1 35 ALA 1.70 -1.18 1 36 LEU -5.10 2.94 1 38 LYS 3.07 -1.03 1 40 THR 3.98 -0.63 1 42 ILE -3.20 -0.50 1 43 LYS -4.59 1.81 1 44 ALA -1.05 -0.10 1 46 THR -5.96 3.47 1 47 ASN 0.44 -0.66 1 49 LYS -5.12 3.38 1 50 VAL 3.05 -1.67 1 51 THR 0.31 -0.09 1 52 ARG -2.16 4.41 1 53 ILE -1.45 2.48 1 54 PHE -1.31 -0.30 1 55 ASN -4.32 2.62 1 56 ASN -4.14 3.34 1 57 GLU 4.33 -0.41 1 58 LEU 1.59 -0.21 1 61 LYS 2.76 -0.78 1 62 VAL -1.04 -0.29 1 63 LEU -6.84 5.39 1 64 GLN -6.65 5.37 1 65 ILE -6.66 5.10 1 66 ALA -3.49 2.04 1 67 GLU 1.07 -0.26 1 68 ASP 3.90 -1.24 1 69 ASN 0.80 0.34 1 71 GLU -3.29 3.16 1 72 TYR -3.50 3.11 1 74 GLN -5.32 2.97 1 75 TRP -9.77 5.40 1 76 TYR -3.17 1.76 1 77 LEU -4.03 3.57 1 78 HIS 5.58 -3.42 1 79 LEU 0.72 -0.52 1 80 ASP -2.24 3.98 1 81 LYS -4.52 3.40 1 82 TYR -2.82 2.69 1 83 ASN -4.37 3.22 1 84 VAL -7.90 4.46 1 85 LYS -4.39 2.36 1 86 VAL 5.56 -1.90 1 88 ASP 1.80 -0.43 1 89 ARG -0.16 -0.30 1 90 VAL -4.15 1.30 1 91 LYS -3.90 1.07 1 92 ALA 2.05 -1.30 1 94 ASP 0.70 -0.01 1 95 ILE 2.57 -2.76 1 96 ILE 0.50 0.25 1 97 ALA -4.88 3.71 1 98 TYR -3.40 1.92 1 99 SER 1.90 -0.05 1 101 ASN -2.60 0.93 1 102 THR 0.22 0.42 1 104 ILE 1.06 0.04 1 105 GLN 0.21 -0.24 1 106 THR -0.22 -0.35 1 107 THR 0.45 -0.41 1 109 ALA 1.42 -0.37 1 110 HIS -0.18 1.40 1 111 LEU -4.48 3.67 1 112 HIS -4.21 4.80 1 113 PHE -5.00 3.47 1 114 GLN -6.02 3.73 1 115 ARG -3.19 2.74 1 116 MET -4.25 3.00 1 117 LYS -4.09 2.72 1 120 VAL -0.83 -0.11 1 122 ASN 6.13 -3.09 1 123 ALA 2.76 -1.13 1 124 TYR -1.40 0.60 1 125 ALA -0.89 1.49 1 126 GLU -7.08 3.71 1 127 ASP -0.56 -0.05 1 131 PHE 3.05 -0.58 1 132 ILE 4.09 -1.70 1 133 ASP 3.09 -0.74 1 134 GLN -0.38 -0.24 1 135 LEU 3.74 -2.86 1 137 ASP -2.25 0.41 1 139 GLU 2.15 0.20 1 140 ARG 3.75 -2.44 1 141 SER 2.94 0.18 1 142 LEU -2.11 2.23 1 143 TYR -4.30 1.77 1 144 ASP -3.35 2.12 1 145 LEU -1.71 3.52 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.77 _LACS_plot.Line_1_terminator_val_y_1 1.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 9.35 _LACS_plot.Line_2_terminator_val_y_2 -0.97 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 127 ASP -0.56 -1.54 0 11 SER -1.50 0.19 1 12 ARG -0.26 0.27 1 13 ILE 2.19 0.19 1 14 THR -0.56 0.09 1 16 THR -1.43 0.36 1 17 PHE 0.89 -0.35 1 19 LYS -0.83 0.07 1 20 TYR 1.29 -0.29 1 21 GLN -0.44 -0.04 1 22 HIS -0.45 -0.01 1 23 SER -1.68 -0.11 1 25 PHE -1.87 0.04 1 26 ASP -1.28 0.08 1 28 LYS -1.03 -0.34 1 30 TYR 4.17 -0.55 1 32 ILE -6.19 0.51 1 33 ASP -4.25 1.74 1 34 PHE -4.48 0.45 1 35 ALA 1.70 0.15 1 36 LEU -5.10 0.05 1 38 LYS 3.07 -0.47 1 40 THR 3.98 -0.17 1 42 ILE -3.20 0.52 1 43 LYS -4.59 0.53 1 44 ALA -1.05 -0.12 1 46 THR -5.96 0.28 1 47 ASN 0.44 0.25 1 49 LYS -5.12 1.00 1 50 VAL 3.05 0.20 1 51 THR 0.31 0.21 1 52 ARG -2.16 0.07 1 53 ILE -1.45 0.26 1 54 PHE -1.31 0.31 1 55 ASN -4.32 0.83 1 56 ASN -4.14 0.12 1 57 GLU 4.33 -0.36 1 58 LEU 1.59 0.05 1 61 LYS 2.76 -0.25 1 62 VAL -1.04 0.72 1 63 LEU -6.84 0.66 1 64 GLN -6.65 2.00 1 65 ILE -6.66 0.90 1 66 ALA -3.49 0.61 1 67 GLU 1.07 -0.06 1 68 ASP 3.90 -0.23 1 69 ASN 0.80 -0.24 1 71 GLU -3.29 0.05 1 72 TYR -3.50 1.03 1 73 HIS -7.56 0.51 1 74 GLN -5.32 0.79 1 75 TRP -9.77 1.47 1 76 TYR -3.17 0.67 1 77 LEU -4.03 0.45 1 78 HIS 5.58 -0.07 1 79 LEU 0.72 -0.38 1 80 ASP -2.24 0.37 1 81 LYS -4.52 0.01 1 82 TYR -2.82 0.13 1 83 ASN -4.37 0.63 1 84 VAL -7.90 0.57 1 85 LYS -4.39 0.19 1 86 VAL 5.56 -0.88 1 88 ASP 1.80 -0.09 1 89 ARG -0.16 0.49 1 90 VAL -4.15 0.42 1 91 LYS -3.90 0.53 1 92 ALA 2.05 -0.70 1 94 ASP 0.70 -0.26 1 95 ILE 2.57 0.16 1 96 ILE 0.50 0.31 1 97 ALA -4.88 -0.11 1 98 TYR -3.40 0.57 1 99 SER 1.90 -0.27 1 101 ASN -2.60 0.32 1 102 THR 0.22 -0.16 1 104 ILE 1.06 0.00 1 105 GLN 0.21 0.03 1 106 THR -0.22 0.12 1 107 THR 0.45 0.03 1 109 ALA 1.42 -0.05 1 110 HIS -0.18 0.46 1 111 LEU -4.48 0.84 1 112 HIS -4.21 1.40 1 113 PHE -5.00 0.76 1 114 GLN -6.02 0.37 1 115 ARG -3.19 0.67 1 116 MET -4.25 0.28 1 117 LYS -4.09 0.00 1 120 VAL -0.83 -0.58 1 122 ASN 6.13 -1.09 1 123 ALA 2.76 -0.46 1 124 TYR -1.40 -0.18 1 125 ALA -0.89 0.26 1 126 GLU -7.08 0.06 1 129 LYS 9.35 -0.52 1 131 PHE 3.05 -0.42 1 132 ILE 4.09 -0.90 1 133 ASP 3.09 -0.31 1 134 GLN -0.38 -0.01 1 135 LEU 3.74 -0.44 1 137 ASP -2.25 0.32 1 139 GLU 2.15 -0.56 1 140 ARG 3.75 -1.08 1 141 SER 2.94 -0.29 1 142 LEU -2.11 0.21 1 143 TYR -4.30 0.86 1 144 ASP -3.35 0.39 1 145 LEU -1.71 -0.02 1 stop_ save_