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 bmr30285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.19 _LACS_plot.Line_1_terminator_val_y_1 -2.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.58 _LACS_plot.Line_2_terminator_val_x_2 9.02 _LACS_plot.Line_2_terminator_val_y_2 7.11 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 ILE -8.19 -2.36 0 12 VAL 0.39 -2.85 0 17 TYR 0.70 -3.00 0 10 LYS 3.49 2.70 1 11 MET 2.97 4.22 1 13 SER 4.23 3.82 1 14 LYS 1.22 -0.47 1 15 TYR 5.44 1.78 1 16 LYS 2.80 2.71 1 18 ARG 4.94 4.81 1 19 ASP 5.47 3.75 1 20 LEU 3.21 2.94 1 21 THR 9.02 7.43 1 22 VAL 6.79 5.63 1 23 ARG 4.42 3.45 1 24 GLU 4.05 4.36 1 25 THR 6.79 5.51 1 26 VAL 6.21 4.79 1 27 ASN 4.08 2.86 1 28 VAL 5.60 4.66 1 29 ILE 5.13 2.94 1 30 THR 4.50 3.81 1 31 LEU -0.26 1.20 1 32 TYR 2.77 0.13 1 33 LYS 2.35 1.52 1 34 ASP -0.76 -0.15 1 35 LEU -2.90 -1.18 1 36 LYS -3.93 -1.74 1 38 VAL -4.37 -1.43 1 39 LEU -3.00 -1.61 1 40 ASP -5.53 -1.58 1 41 SER 0.35 -0.09 1 42 TYR -1.58 -0.02 1 43 VAL -0.21 -1.01 1 44 PHE -0.15 0.35 1 45 ASN 3.82 2.83 1 46 ASP 0.20 -1.06 1 48 SER -0.16 0.34 1 49 SER -4.70 -1.72 1 50 ARG -4.74 -1.01 1 51 GLU -0.08 0.09 1 52 LEU -6.67 -1.85 1 53 MET -2.12 -0.28 1 54 ASN -5.29 -2.70 1 55 LEU -3.09 -1.90 1 56 THR -3.83 -2.37 1 58 THR -4.98 -2.87 1 59 ILE -2.99 -1.69 1 63 TYR -0.86 0.54 1 64 ARG 3.70 0.88 1 66 ASN -4.63 -1.49 1 67 THR 1.53 1.31 1 68 TYR -3.20 -2.02 1 69 ASN -0.16 -0.90 1 70 ILE -1.16 -1.85 1 74 LEU -3.28 -2.02 1 75 TRP -1.12 -0.48 1 76 LEU -0.25 -1.65 1 77 LEU 1.15 0.32 1 78 ASP 3.33 1.33 1 79 THR 0.31 -1.02 1 80 TYR 3.83 4.41 1 82 TYR 5.06 3.56 1 83 ASN -3.34 -0.68 1 86 ILE 0.62 0.65 1 88 PHE -5.38 -1.05 1 89 VAL -0.77 -0.48 1 90 LYS -3.91 -3.09 1 92 THR -2.11 -1.27 1 93 SER 3.23 2.25 1 94 SER 0.31 0.04 1 95 MET -3.94 -0.45 1 96 THR -2.55 -1.38 1 97 ILE 0.13 0.32 1 98 LYS -2.02 -2.18 1 99 THR 0.10 0.07 1 101 LYS 3.15 2.31 1 102 HIS -0.49 0.53 1 103 VAL -4.42 -1.27 1 104 ASP -3.71 -2.15 1 105 ALA 2.70 2.08 1 106 ASN -0.49 -0.30 1 109 ILE -2.24 -1.25 1 110 TYR -2.16 -0.88 1 111 LEU -7.23 -1.56 1 113 TYR 1.71 3.33 1 114 LEU 1.82 1.75 1 115 HIS 3.30 4.08 1 116 GLU -0.88 -2.03 1 117 TRP 0.85 1.17 1 118 LYS -2.16 -0.71 1 119 HIS 1.14 1.00 1 121 GLN 5.93 4.25 1 122 SER 1.47 -1.69 1 123 ASP -1.96 -1.11 1 124 LEU 2.86 3.14 1 125 LEU 4.08 3.08 1 127 LEU 2.75 2.05 1 128 ILE 5.45 3.42 1 129 GLN 5.56 4.07 1 130 VAL 5.82 3.90 1 131 MET 5.19 4.92 1 132 ILE 5.54 5.17 1 133 VAL 5.33 4.34 1 134 VAL 5.46 3.97 1 135 PHE 0.10 -2.43 1 137 ASP 0.38 1.42 1 138 GLU -2.66 -0.72 1 141 VAL -7.91 -4.46 1 142 PHE -2.57 -1.13 1 143 SER -0.59 -0.38 1 144 ARG -1.12 -1.87 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.19 _LACS_plot.Line_1_terminator_val_y_1 5.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.42 _LACS_plot.Line_2_terminator_val_x_2 9.02 _LACS_plot.Line_2_terminator_val_y_2 -1.91 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 ILE -8.19 5.83 0 12 VAL 0.39 -3.24 0 17 TYR 0.70 -3.70 0 10 LYS 3.49 -0.79 1 11 MET 2.97 1.25 1 13 SER 4.23 -0.41 1 14 LYS 1.22 -1.69 1 15 TYR 5.44 -3.66 1 16 LYS 2.80 -0.09 1 18 ARG 4.94 -0.13 1 19 ASP 5.47 -1.72 1 20 LEU 3.21 -0.27 1 21 THR 9.02 -1.59 1 22 VAL 6.79 -1.16 1 23 ARG 4.42 -0.97 1 24 GLU 4.05 0.31 1 25 THR 6.79 -1.28 1 26 VAL 6.21 -1.42 1 27 ASN 4.08 -1.22 1 28 VAL 5.60 -0.94 1 29 ILE 5.13 -2.19 1 30 THR 4.50 -0.69 1 31 LEU -0.26 1.46 1 32 TYR 2.77 -2.64 1 33 LYS 2.35 -0.83 1 34 ASP -0.76 0.61 1 35 LEU -2.90 1.72 1 36 LYS -3.93 2.19 1 38 VAL -4.37 2.94 1 39 LEU -3.00 1.39 1 40 ASP -5.53 3.95 1 41 SER 0.35 -0.44 1 42 TYR -1.58 1.56 1 43 VAL -0.21 -0.80 1 44 PHE -0.15 0.50 1 45 ASN 3.82 -0.99 1 46 ASP 0.20 -1.26 1 48 SER -0.16 0.50 1 49 SER -4.70 2.98 1 50 ARG -4.74 3.73 1 51 GLU -0.08 0.17 1 52 LEU -6.67 4.82 1 53 MET -2.12 1.84 1 54 ASN -5.29 2.59 1 55 LEU -3.09 1.19 1 56 THR -3.83 1.46 1 58 THR -4.98 2.11 1 59 ILE -2.99 1.30 1 63 TYR -0.86 1.40 1 64 ARG 3.70 -2.82 1 66 ASN -4.63 3.14 1 67 THR 1.53 -0.22 1 68 TYR -3.20 1.18 1 69 ASN -0.16 -0.74 1 70 ILE -1.16 -0.69 1 74 LEU -3.28 1.26 1 75 TRP -1.12 0.64 1 76 LEU -0.25 -1.40 1 77 LEU 1.15 -0.83 1 78 ASP 3.33 -2.00 1 79 THR 0.31 -1.33 1 80 TYR 3.83 0.58 1 82 TYR 5.06 -1.50 1 83 ASN -3.34 2.66 1 86 ILE 0.62 0.03 1 88 PHE -5.38 4.33 1 89 VAL -0.77 0.29 1 90 LYS -3.91 0.82 1 92 THR -2.11 0.84 1 93 SER 3.23 -0.98 1 94 SER 0.31 -0.27 1 95 MET -3.94 3.49 1 96 THR -2.55 1.17 1 97 ILE 0.13 0.19 1 98 LYS -2.02 -0.16 1 99 THR 0.10 -0.03 1 101 LYS 3.15 -0.84 1 102 HIS -0.49 1.02 1 103 VAL -4.42 3.15 1 104 ASP -3.71 1.56 1 105 ALA 2.70 -0.62 1 106 ASN -0.49 0.19 1 109 ILE -2.24 0.99 1 110 TYR -2.16 1.28 1 111 LEU -7.23 5.67 1 113 TYR 1.71 1.62 1 114 LEU 1.82 -0.07 1 115 HIS 3.30 0.78 1 116 GLU -0.88 -1.15 1 117 TRP 0.85 0.32 1 118 LYS -2.16 1.45 1 119 HIS 1.14 -0.14 1 121 GLN 5.93 -1.68 1 122 SER 1.47 -3.16 1 123 ASP -1.96 0.85 1 124 LEU 2.86 0.28 1 125 LEU 4.08 -1.00 1 127 LEU 2.75 -0.70 1 128 ILE 5.45 -2.03 1 129 GLN 5.56 -1.49 1 130 VAL 5.82 -1.92 1 131 MET 5.19 -0.27 1 132 ILE 5.54 -0.37 1 133 VAL 5.33 -0.99 1 134 VAL 5.46 -1.49 1 135 PHE 0.10 -2.53 1 137 ASP 0.38 1.04 1 138 GLU -2.66 1.94 1 141 VAL -7.91 3.45 1 142 PHE -2.57 1.44 1 143 SER -0.59 0.21 1 144 ARG -1.12 -0.75 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.19 _LACS_plot.Line_1_terminator_val_y_1 0.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 TYR -1.58 -1.05 0 78 ASP 3.33 -1.66 0 10 LYS 3.49 -0.28 1 11 MET 2.97 -0.44 1 12 VAL 0.39 0.37 1 13 SER 4.23 -0.42 1 14 LYS 1.22 0.26 1 15 TYR 5.44 -0.29 1 16 LYS 2.80 -0.51 1 17 TYR 0.70 0.43 1 18 ARG 4.94 -0.60 1 19 ASP 5.47 -0.28 1 20 LEU 3.21 -0.16 1 22 VAL 6.79 -0.83 1 23 ARG 4.42 -0.39 1 24 GLU 4.05 -0.16 1 25 THR 6.79 -0.23 1 26 VAL 6.21 -0.66 1 27 ASN 4.08 -0.28 1 28 VAL 5.60 -0.18 1 29 ILE 5.13 0.15 1 30 THR 4.50 -0.40 1 31 LEU -0.26 -0.20 1 32 TYR 2.77 -0.02 1 33 LYS 2.35 0.00 1 34 ASP -0.76 0.32 1 35 LEU -2.90 0.31 1 36 LYS -3.93 0.30 1 38 VAL -4.37 0.04 1 39 LEU -3.00 0.70 1 40 ASP -5.53 0.39 1 41 SER 0.35 0.32 1 43 VAL -0.21 0.18 1 44 PHE -0.15 -0.25 1 45 ASN 3.82 -0.35 1 46 ASP 0.20 -0.11 1 48 SER -0.16 -0.04 1 49 SER -4.70 1.41 1 50 ARG -4.74 0.33 1 51 GLU -0.08 0.45 1 52 LEU -6.67 0.77 1 53 MET -2.12 0.52 1 54 ASN -5.29 0.49 1 55 LEU -3.09 0.50 1 56 THR -3.83 0.68 1 58 THR -4.98 1.19 1 59 ILE -2.99 0.35 1 63 TYR -0.86 0.27 1 64 ARG 3.70 -0.69 1 66 ASN -4.63 0.29 1 67 THR 1.53 0.22 1 68 TYR -3.20 0.06 1 69 ASN -0.16 0.51 1 70 ILE -1.16 -0.12 1 72 ILE -8.19 1.24 1 74 LEU -3.28 0.78 1 75 TRP -1.12 -0.07 1 76 LEU -0.25 0.25 1 77 LEU 1.15 -0.04 1 79 THR 0.31 0.05 1 80 TYR 3.83 -0.76 1 82 TYR 5.06 -0.34 1 83 ASN -3.34 -0.01 1 86 ILE 0.62 -0.12 1 88 PHE -5.38 0.88 1 89 VAL -0.77 0.51 1 90 LYS -3.91 0.17 1 92 THR -2.11 0.25 1 93 SER 3.23 -0.23 1 94 SER 0.31 0.10 1 95 MET -3.94 0.54 1 96 THR -2.55 0.11 1 97 ILE 0.13 -0.01 1 98 LYS -2.02 0.15 1 99 THR 0.10 -0.27 1 101 LYS 3.15 -0.41 1 102 HIS -0.49 0.70 1 103 VAL -4.42 1.18 1 104 ASP -3.71 0.41 1 105 ALA 2.70 -0.39 1 106 ASN -0.49 0.14 1 109 ILE -2.24 0.81 1 110 TYR -2.16 0.13 1 111 LEU -7.23 0.31 1 113 TYR 1.71 -0.68 1 114 LEU 1.82 0.21 1 115 HIS 3.30 -0.29 1 116 GLU -0.88 -0.08 1 117 TRP 0.85 -0.93 1 118 LYS -2.16 0.12 1 119 HIS 1.14 -0.64 1 121 GLN 5.93 -0.56 1 122 SER 1.47 -0.18 1 123 ASP -1.96 -0.08 1 124 LEU 2.86 -0.08 1 125 LEU 4.08 -0.37 1 127 LEU 2.75 -1.19 1 128 ILE 5.45 -0.81 1 129 GLN 5.56 -0.49 1 130 VAL 5.82 -0.49 1 131 MET 5.19 -1.50 1 132 ILE 5.54 -0.66 1 133 VAL 5.33 -0.45 1 134 VAL 5.46 -0.36 1 135 PHE 0.10 0.28 1 137 ASP 0.38 0.23 1 138 GLU -2.66 -0.08 1 141 VAL -7.91 1.02 1 142 PHE -2.57 0.08 1 143 SER -0.59 0.18 1 144 ARG -1.12 0.16 1 stop_ save_