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 bmr15469_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.16 _LACS_plot.Line_1_terminator_val_y_1 -5.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.84 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 5.19 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 LEU -7.37 -1.87 0 36 ARG 6.02 -0.01 0 10 ALA -0.22 -0.40 1 12 ASN -0.20 -0.54 1 13 ALA -0.27 -0.19 1 14 LYS -0.05 -0.47 1 15 GLU -0.87 -0.57 1 16 GLU -0.79 -0.57 1 17 ILE -0.13 -0.69 1 18 LEU -2.41 -0.94 1 20 THR 1.12 -1.08 1 21 VAL -6.82 -3.98 1 22 SER -1.41 -2.62 1 23 TRP -9.16 -5.83 1 24 ASN -0.77 -1.44 1 25 LEU 4.18 3.13 1 26 ARG 5.79 3.78 1 27 GLU 2.65 1.93 1 28 MET 3.41 5.00 1 29 LEU 3.51 2.50 1 30 ALA 3.47 1.98 1 31 HIS 3.97 4.16 1 32 ALA 3.78 2.93 1 33 GLU 3.01 2.88 1 34 GLU 1.42 1.63 1 35 THR -0.60 0.15 1 37 LYS -2.74 0.14 1 38 LEU -1.76 -0.93 1 39 MET -4.02 -1.63 1 41 ILE -6.54 -3.85 1 43 MET -0.02 1.26 1 44 ASP -0.62 -0.05 1 45 VAL 2.39 -0.54 1 46 ARG 4.85 3.48 1 47 ALA 3.11 2.29 1 48 ILE 3.33 2.75 1 49 MET 3.74 0.33 1 50 ALA 3.77 2.29 1 51 THR 5.82 4.56 1 52 ILE 5.38 4.60 1 53 GLN 3.06 2.83 1 54 ARG 2.07 1.60 1 55 LYS 1.28 1.40 1 56 TYR 0.35 -2.48 1 57 LYS 2.83 1.73 1 59 ILE 1.12 0.56 1 60 LYS -0.93 -2.36 1 61 ILE 2.70 0.27 1 62 GLN -4.44 -2.79 1 63 GLU 0.15 1.00 1 65 ILE 0.82 -0.06 1 66 VAL -2.85 -0.02 1 67 ASP -1.56 -2.24 1 68 TYR -0.19 -0.45 1 70 VAL -4.01 -2.10 1 71 ARG 1.06 -0.94 1 72 PHE -2.50 -0.12 1 73 PHE -2.46 -1.04 1 74 PHE -0.27 -0.40 1 75 TYR -6.28 -3.73 1 76 THR -3.25 -2.02 1 77 SER 2.56 1.36 1 78 LYS 0.00 -0.48 1 79 GLU -2.20 -0.97 1 81 VAL 6.07 4.15 1 82 ALA 3.25 2.12 1 83 SER 3.47 1.48 1 84 ILE 4.56 4.00 1 85 ILE 5.82 3.68 1 86 THR 7.11 6.11 1 87 LYS 4.14 3.36 1 88 LEU 3.23 1.87 1 89 ASN 3.28 1.37 1 90 SER 3.91 2.40 1 91 LEU 2.60 1.87 1 92 ASN 1.43 0.13 1 93 GLU -2.03 -0.79 1 96 VAL -3.77 -2.73 1 97 THR -3.83 -2.34 1 98 MET 2.85 1.85 1 100 ILE 5.17 2.12 1 102 TYR -0.32 -0.58 1 103 VAL 4.58 2.70 1 104 THR 0.38 0.42 1 105 HIS -3.08 -4.16 1 107 PHE -0.75 -2.06 1 108 ASN 3.55 3.13 1 109 LEU 4.21 2.56 1 110 GLU 2.30 1.33 1 111 GLU 2.51 1.98 1 112 ALA 2.83 2.28 1 113 ALA 5.16 3.44 1 114 ARG 3.08 0.32 1 116 MET 3.00 2.49 1 117 ARG 0.80 0.54 1 118 SER 0.06 -0.33 1 119 LEU -1.55 -1.42 1 120 LYS 0.42 -0.70 1 121 ALA -4.93 -1.76 1 123 ALA -0.87 -0.85 1 124 VAL -2.75 -2.73 1 125 VAL -5.09 -4.43 1 126 SER -2.72 -3.02 1 127 VAL 3.35 3.10 1 128 SER -1.53 -0.98 1 129 SER 2.52 1.51 1 131 ASP 0.97 0.10 1 132 ALA 5.73 4.19 1 133 VAL 5.42 3.30 1 134 THR 5.18 3.30 1 135 THR 3.82 4.18 1 136 TYR 3.62 1.68 1 137 ASN 0.29 -0.92 1 139 TYR 1.66 1.56 1 140 LEU 0.48 -0.16 1 141 THR 0.20 -0.06 1 142 SER 1.78 2.14 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15469_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.16 _LACS_plot.Line_1_terminator_val_y_1 4.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 LEU -7.37 5.50 0 36 ARG 6.02 -6.03 0 10 ALA -0.22 -0.18 1 12 ASN -0.20 -0.34 1 13 ALA -0.27 0.08 1 14 LYS -0.05 -0.42 1 15 GLU -0.87 0.30 1 16 GLU -0.79 0.22 1 17 ILE -0.13 -0.56 1 18 LEU -2.41 1.47 1 20 THR 1.12 -2.20 1 21 VAL -6.82 2.84 1 22 SER -1.41 -1.21 1 23 TRP -9.16 3.33 1 24 ASN -0.77 -0.67 1 25 LEU 4.18 -1.05 1 26 ARG 5.79 -2.01 1 27 GLU 2.65 -0.72 1 28 MET 3.41 1.59 1 29 LEU 3.51 -1.01 1 30 ALA 3.47 -1.49 1 31 HIS 3.97 0.19 1 32 ALA 3.78 -0.85 1 33 GLU 3.01 -0.13 1 34 GLU 1.42 0.21 1 35 THR -0.60 0.75 1 37 LYS -2.74 2.88 1 38 LEU -1.76 0.83 1 39 MET -4.02 2.39 1 41 ILE -6.54 2.69 1 43 MET -0.02 1.28 1 44 ASP -0.62 0.57 1 45 VAL 2.39 -2.93 1 46 ARG 4.85 -1.37 1 47 ALA 3.11 -0.82 1 48 ILE 3.33 -0.58 1 49 MET 3.74 -3.41 1 50 ALA 3.77 -1.48 1 51 THR 5.82 -1.26 1 52 ILE 5.38 -0.78 1 53 GLN 3.06 -0.23 1 54 ARG 2.07 -0.47 1 55 LYS 1.28 0.12 1 56 TYR 0.35 -2.83 1 57 LYS 2.83 -1.10 1 59 ILE 1.12 -0.56 1 60 LYS -0.93 -1.43 1 61 ILE 2.70 -2.43 1 62 GLN -4.44 1.65 1 63 GLU 0.15 0.85 1 65 ILE 0.82 -0.88 1 66 VAL -2.85 2.83 1 67 ASP -1.56 -0.68 1 68 TYR -0.19 -0.26 1 70 VAL -4.01 1.91 1 71 ARG 1.06 -2.00 1 72 PHE -2.50 2.38 1 73 PHE -2.46 1.42 1 74 PHE -0.27 -0.13 1 75 TYR -6.28 2.55 1 76 THR -3.25 1.23 1 77 SER 2.56 -1.20 1 78 LYS 0.00 -0.48 1 79 GLU -2.20 1.23 1 81 VAL 6.07 -1.92 1 82 ALA 3.25 -1.13 1 83 SER 3.47 -1.99 1 84 ILE 4.56 -0.56 1 85 ILE 5.82 -2.14 1 86 THR 7.11 -1.00 1 87 LYS 4.14 -0.78 1 88 LEU 3.23 -1.36 1 89 ASN 3.28 -1.91 1 90 SER 3.91 -1.51 1 91 LEU 2.60 -0.73 1 92 ASN 1.43 -1.30 1 93 GLU -2.03 1.24 1 96 VAL -3.77 1.04 1 97 THR -3.83 1.49 1 98 MET 2.85 -1.00 1 100 ILE 5.17 -3.05 1 102 TYR -0.32 -0.26 1 103 VAL 4.58 -1.88 1 104 THR 0.38 0.04 1 105 HIS -3.08 -1.08 1 107 PHE -0.75 -1.31 1 108 ASN 3.55 -0.42 1 109 LEU 4.21 -1.65 1 110 GLU 2.30 -0.97 1 111 GLU 2.51 -0.53 1 112 ALA 2.83 -0.55 1 113 ALA 5.16 -1.72 1 114 ARG 3.08 -2.76 1 116 MET 3.00 -0.51 1 117 ARG 0.80 -0.26 1 118 SER 0.06 -0.39 1 119 LEU -1.55 0.13 1 120 LYS 0.42 -1.12 1 121 ALA -4.93 3.17 1 123 ALA -0.87 0.02 1 124 VAL -2.75 0.02 1 125 VAL -5.09 0.66 1 126 SER -2.72 -0.30 1 127 VAL 3.35 -0.25 1 128 SER -1.53 0.55 1 129 SER 2.52 -1.01 1 131 ASP 0.97 -0.87 1 132 ALA 5.73 -1.54 1 133 VAL 5.42 -2.12 1 134 THR 5.18 -1.88 1 135 THR 3.82 0.36 1 136 TYR 3.62 -1.94 1 137 ASN 0.29 -1.21 1 139 TYR 1.66 -0.10 1 140 LEU 0.48 -0.64 1 141 THR 0.20 -0.26 1 142 SER 1.78 0.36 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15469_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.16 _LACS_plot.Line_1_terminator_val_y_1 0.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 -0.85 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 ILE 1.12 -1.65 0 10 ALA -0.22 -0.15 1 12 ASN -0.20 -0.18 1 13 ALA -0.27 -0.12 1 14 LYS -0.05 -0.12 1 15 GLU -0.87 -0.18 1 16 GLU -0.79 -0.18 1 17 ILE -0.13 -0.12 1 18 LEU -2.41 -0.05 1 20 THR 1.12 0.72 1 21 VAL -6.82 0.13 1 22 SER -1.41 0.34 1 23 TRP -9.16 0.69 1 24 ASN -0.77 0.61 1 25 LEU 4.18 -0.24 1 26 ARG 5.79 -0.50 1 27 GLU 2.65 -0.64 1 28 MET 3.41 -0.52 1 29 LEU 3.51 -0.37 1 30 ALA 3.47 -0.29 1 31 HIS 3.97 -0.53 1 32 ALA 3.78 -0.67 1 33 GLU 3.01 -0.67 1 34 GLU 1.42 -0.37 1 35 THR -0.60 -0.24 1 36 ARG 6.02 -0.42 1 37 LYS -2.74 -0.18 1 38 LEU -1.76 0.13 1 39 MET -4.02 0.99 1 41 ILE -6.54 0.11 1 43 MET -0.02 0.16 1 44 ASP -0.62 -0.08 1 45 VAL 2.39 -0.07 1 46 ARG 4.85 -0.55 1 47 ALA 3.11 -0.24 1 48 ILE 3.33 -0.44 1 49 MET 3.74 -0.24 1 50 ALA 3.77 -0.24 1 51 THR 5.82 -0.50 1 52 ILE 5.38 -0.47 1 53 GLN 3.06 -0.53 1 54 ARG 2.07 -0.25 1 55 LYS 1.28 -0.40 1 56 TYR 0.35 0.24 1 57 LYS 2.83 -0.24 1 60 LYS -0.93 -0.02 1 61 ILE 2.70 -1.01 1 62 GLN -4.44 -0.14 1 63 GLU 0.15 -0.62 1 65 ILE 0.82 0.74 1 66 VAL -2.85 -0.05 1 67 ASP -1.56 0.31 1 68 TYR -0.19 -0.15 1 70 VAL -4.01 -0.72 1 71 ARG 1.06 -0.11 1 72 PHE -2.50 0.01 1 73 PHE -2.46 0.07 1 74 PHE -0.27 0.94 1 75 TYR -6.28 0.75 1 76 THR -3.25 0.33 1 77 SER 2.56 0.21 1 78 LYS 0.00 -0.25 1 79 GLU -2.20 -0.05 1 81 VAL 6.07 -0.99 1 82 ALA 3.25 -0.37 1 83 SER 3.47 -0.28 1 84 ILE 4.56 -0.81 1 85 ILE 5.82 -0.92 1 86 THR 7.11 -0.04 1 87 LYS 4.14 -0.39 1 88 LEU 3.23 -0.67 1 89 ASN 3.28 -0.27 1 90 SER 3.91 -0.34 1 91 LEU 2.60 -0.37 1 92 ASN 1.43 -0.63 1 93 GLU -2.03 0.04 1 95 LEU -7.37 1.43 1 96 VAL -3.77 0.96 1 97 THR -3.83 0.75 1 98 MET 2.85 0.53 1 100 ILE 5.17 -0.75 1 102 TYR -0.32 -0.12 1 103 VAL 4.58 -0.55 1 104 THR 0.38 -0.05 1 105 HIS -3.08 0.62 1 107 PHE -0.75 0.21 1 108 ASN 3.55 -0.51 1 109 LEU 4.21 -1.47 1 110 GLU 2.30 -0.86 1 111 GLU 2.51 -0.11 1 112 ALA 2.83 -0.50 1 113 ALA 5.16 -0.71 1 114 ARG 3.08 -0.31 1 116 MET 3.00 -0.32 1 117 ARG 0.80 -0.20 1 118 SER 0.06 0.03 1 119 LEU -1.55 -0.08 1 120 LYS 0.42 -0.21 1 121 ALA -4.93 0.78 1 123 ALA -0.87 0.15 1 124 VAL -2.75 0.61 1 125 VAL -5.09 0.44 1 126 SER -2.72 0.39 1 127 VAL 3.35 -0.56 1 128 SER -1.53 0.16 1 129 SER 2.52 -0.29 1 131 ASP 0.97 -0.10 1 132 ALA 5.73 -0.90 1 133 VAL 5.42 -0.51 1 134 THR 5.18 -0.88 1 135 THR 3.82 -0.78 1 136 TYR 3.62 -0.42 1 137 ASN 0.29 0.06 1 139 TYR 1.66 -0.57 1 140 LEU 0.48 -0.11 1 141 THR 0.20 -0.03 1 142 SER 1.78 -0.29 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15469_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.16 _LACS_plot.Line_1_terminator_val_y_1 -3.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 7.11 _LACS_plot.Line_2_terminator_val_y_2 2.63 _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 23 TRP -9.16 0.93 0 12 ASN -0.20 -0.24 1 13 ALA -0.27 -0.18 1 14 LYS -0.05 -0.10 1 15 GLU -0.87 -0.43 1 16 GLU -0.79 -0.70 1 17 ILE -0.13 -1.45 1 18 LEU -2.41 -0.93 1 20 THR 1.12 -0.16 1 21 VAL -6.82 -2.29 1 22 SER -1.41 -1.69 1 24 ASN -0.77 0.01 1 25 LEU 4.18 0.71 1 26 ARG 5.79 3.29 1 27 GLU 2.65 3.34 1 28 MET 3.41 1.06 1 29 LEU 3.51 0.94 1 30 ALA 3.47 2.57 1 31 HIS 3.97 5.06 1 32 ALA 3.78 3.00 1 33 GLU 3.01 1.88 1 34 GLU 1.42 1.61 1 35 THR -0.60 0.62 1 36 ARG 6.02 -1.10 1 37 LYS -2.74 -1.75 1 38 LEU -1.76 -1.87 1 41 ILE -6.54 -3.00 1 43 MET -0.02 -1.69 1 44 ASP -0.62 -0.92 1 45 VAL 2.39 -0.57 1 46 ARG 4.85 2.52 1 47 ALA 3.11 2.91 1 48 ILE 3.33 1.14 1 49 MET 3.74 2.43 1 50 ALA 3.77 2.83 1 51 THR 5.82 1.72 1 52 ILE 5.38 0.53 1 53 GLN 3.06 1.12 1 54 ARG 2.07 0.88 1 55 LYS 1.28 0.13 1 56 TYR 0.35 -1.56 1 57 LYS 2.83 2.48 1 59 ILE 1.12 -3.51 1 60 LYS -0.93 -1.83 1 61 ILE 2.70 -1.45 1 62 GLN -4.44 -4.05 1 63 GLU 0.15 0.78 1 65 ILE 0.82 1.55 1 66 VAL -2.85 -3.41 1 67 ASP -1.56 -1.09 1 68 TYR -0.19 -1.80 1 71 ARG 1.06 -3.58 1 72 PHE -2.50 -0.25 1 73 PHE -2.46 -1.20 1 74 PHE -0.27 1.05 1 75 TYR -6.28 -1.98 1 76 THR -3.25 0.16 1 77 SER 2.56 -1.02 1 78 LYS 0.00 0.24 1 81 VAL 6.07 1.06 1 82 ALA 3.25 2.74 1 83 SER 3.47 1.99 1 84 ILE 4.56 1.30 1 85 ILE 5.82 1.13 1 86 THR 7.11 2.34 1 87 LYS 4.14 3.08 1 88 LEU 3.23 2.86 1 89 ASN 3.28 3.19 1 90 SER 3.91 1.56 1 91 LEU 2.60 0.54 1 92 ASN 1.43 -1.78 1 95 LEU -7.37 0.45 1 96 VAL -3.77 -3.50 1 97 THR -3.83 -1.81 1 100 ILE 5.17 -2.74 1 102 TYR -0.32 1.63 1 103 VAL 4.58 0.51 1 104 THR 0.38 1.46 1 105 HIS -3.08 2.76 1 107 PHE -0.75 0.27 1 108 ASN 3.55 -0.33 1 109 LEU 4.21 1.70 1 110 GLU 2.30 2.99 1 111 GLU 2.51 1.11 1 112 ALA 2.83 1.10 1 113 ALA 5.16 3.89 1 114 ARG 3.08 2.79 1 116 MET 3.00 1.14 1 117 ARG 0.80 -0.83 1 118 SER 0.06 -1.70 1 119 LEU -1.55 0.33 1 120 LYS -4.93 -1.04 1 123 ALA -0.87 -2.23 1 124 VAL -2.75 -1.96 1 125 VAL -5.09 1.00 1 126 SER -2.72 2.18 1 127 VAL 3.35 -1.02 1 128 SER 2.52 0.70 1 131 ASP 0.97 0.16 1 132 ALA 5.73 0.75 1 133 VAL 5.42 2.92 1 134 THR 5.18 0.68 1 135 THR 3.82 0.69 1 136 TYR 3.62 3.80 1 137 ASN 0.29 2.64 1 139 TYR 1.66 1.05 1 140 LEU 0.48 0.17 1 141 THR 0.20 -0.85 1 stop_ save_