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 bmr15804_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.62 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 5.18 _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 145 GLU -8.75 -2.04 0 12 SER 0.38 0.38 1 14 LEU -0.02 0.00 1 15 VAL -0.07 -0.03 1 17 ARG 0.96 0.81 1 19 SER 2.14 1.68 1 22 TRP 0.15 1.00 1 23 ASN 4.76 2.73 1 24 ASP 4.88 3.81 1 25 LEU 3.61 2.83 1 26 ALA 2.40 2.95 1 27 VAL 6.12 4.91 1 28 TYR 5.91 4.82 1 29 ILE 5.95 4.74 1 30 ILE 5.58 5.03 1 31 ARG 3.98 2.91 1 33 SER -0.38 -0.63 1 37 THR -1.09 -0.14 1 38 ARG -1.43 -1.29 1 39 VAL -5.28 -2.24 1 40 VAL -5.28 -2.66 1 41 GLU -2.60 -2.94 1 42 VAL -2.83 -2.05 1 44 ALA 1.33 1.76 1 46 ARG -1.24 -1.29 1 47 PHE -1.17 -1.96 1 48 LEU 0.91 -1.04 1 49 TYR 3.17 4.49 1 50 VAL 6.07 4.72 1 51 SER 3.78 2.90 1 52 ASP 4.04 3.18 1 53 TYR 5.24 4.45 1 54 ILE 6.37 5.53 1 55 ARG 3.65 2.87 1 56 LYS 1.31 1.39 1 57 HIS 0.60 1.18 1 58 SER -4.01 -0.02 1 59 LYS -0.43 -1.91 1 60 VAL 0.87 0.90 1 61 ASP -0.58 -0.90 1 62 LEU -3.67 -1.23 1 63 VAL -3.17 -0.78 1 64 LEU -5.08 -1.64 1 65 THR -5.08 -2.48 1 66 ASP -3.33 1.07 1 67 ILE 2.96 2.47 1 68 LYS -1.96 -1.18 1 70 SER 0.94 0.82 1 71 HIS -2.88 0.55 1 74 ILE -0.46 -0.28 1 75 VAL 0.49 0.60 1 76 ARG 0.17 -0.85 1 77 ASP -2.29 2.26 1 78 ASP -3.41 -2.93 1 79 ILE -1.50 -1.56 1 80 THR 1.53 1.14 1 81 SER -0.35 -0.78 1 83 ARG 1.67 -0.17 1 84 MET 4.94 1.63 1 85 GLU 3.82 2.63 1 86 ILE 3.98 3.02 1 87 TYR -1.15 0.37 1 88 ARG 3.70 2.60 1 90 ALA 0.67 -0.13 1 91 ALA -0.17 0.25 1 92 LEU -4.16 -0.41 1 93 ILE -5.00 -1.98 1 94 TYR -7.49 -3.47 1 95 SER -3.42 -0.08 1 96 ILE 0.60 0.39 1 100 ALA 2.23 1.42 1 101 GLU 3.44 2.50 1 102 ILE 0.68 -0.07 1 103 HIS 2.11 4.33 1 104 SER 4.93 3.20 1 105 SER 5.46 4.44 1 106 LEU 4.11 3.30 1 107 MET 4.73 4.03 1 108 ARG 4.17 3.59 1 109 VAL 6.54 4.80 1 110 ALA 5.35 4.03 1 111 ASP 3.22 3.11 1 112 ALA 2.59 2.30 1 113 VAL -1.98 -1.84 1 115 ALA -3.63 -1.16 1 116 ARG -1.37 -0.03 1 117 LEU -5.86 -2.43 1 118 ILE -5.22 -2.02 1 119 ILE -4.91 -1.05 1 120 LYS -4.79 -3.09 1 122 LEU 1.34 1.44 1 123 THR 3.17 2.62 1 125 GLU -1.78 -0.63 1 126 ASP -1.46 -0.53 1 127 ILE 0.16 -1.57 1 128 VAL 1.72 -0.32 1 129 THR -0.22 0.46 1 132 LYS 0.85 0.71 1 133 MET -1.95 0.15 1 134 LYS -2.47 -0.65 1 135 LEU 1.03 0.28 1 136 VAL -1.76 -0.78 1 137 ASN -2.98 -1.06 1 138 TYR -2.00 0.39 1 140 ARG 0.16 -0.62 1 141 THR -3.18 -1.61 1 142 TYR -3.58 -1.95 1 143 PHE -0.05 -1.45 1 144 TYR -3.49 -0.57 1 146 TYR -6.21 -1.30 1 147 ILE -1.09 -0.90 1 148 ALA -0.99 0.01 1 149 GLU -0.95 -0.20 1 150 VAL 0.86 0.33 1 151 ARG -0.45 -0.31 1 152 SER 0.08 0.12 1 153 ARG 0.87 1.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15804_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 5.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.38 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -1.36 _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 145 GLU -8.75 6.71 0 12 SER 0.38 0.00 1 14 LEU -0.02 0.02 1 15 VAL -0.07 0.04 1 17 ARG 0.96 -0.15 1 19 SER 2.14 -0.46 1 22 TRP 0.15 0.85 1 23 ASN 4.76 -2.03 1 24 ASP 4.88 -1.07 1 25 LEU 3.61 -0.78 1 26 ALA 2.40 0.55 1 27 VAL 6.12 -1.21 1 28 TYR 5.91 -1.09 1 29 ILE 5.95 -1.21 1 30 ILE 5.58 -0.55 1 31 ARG 3.98 -1.07 1 33 SER -0.38 -0.25 1 37 THR -1.09 0.95 1 38 ARG -1.43 0.14 1 39 VAL -5.28 3.04 1 40 VAL -5.28 2.62 1 41 GLU -2.60 -0.34 1 42 VAL -2.83 0.78 1 44 ALA 1.33 0.43 1 46 ARG -1.24 -0.05 1 47 PHE -1.17 -0.79 1 48 LEU 0.91 -1.95 1 49 TYR 3.17 1.32 1 50 VAL 6.07 -1.35 1 51 SER 3.78 -0.88 1 52 ASP 4.04 -0.86 1 53 TYR 5.24 -0.79 1 54 ILE 6.37 -0.84 1 55 ARG 3.65 -0.78 1 56 LYS 1.31 0.08 1 57 HIS 0.60 0.58 1 58 SER -4.01 3.99 1 59 LYS -0.43 -1.48 1 60 VAL 0.87 0.03 1 61 ASP -0.58 -0.32 1 62 LEU -3.67 2.44 1 63 VAL -3.17 2.39 1 64 LEU -5.08 3.44 1 65 THR -5.08 2.60 1 66 ASP -3.33 4.40 1 67 ILE 2.96 -0.49 1 68 LYS -1.96 0.78 1 70 SER 0.94 -0.12 1 71 HIS -2.88 3.43 1 74 ILE -0.46 0.18 1 75 VAL 0.49 0.11 1 76 ARG 0.17 -1.02 1 77 ASP -2.29 4.55 1 78 ASP -3.41 0.48 1 79 ILE -1.50 -0.06 1 80 THR 1.53 -0.39 1 81 SER -0.35 -0.43 1 83 ARG 1.67 -1.84 1 84 MET 4.94 -3.31 1 85 GLU 3.82 -1.19 1 86 ILE 3.98 -0.96 1 87 TYR -1.15 1.52 1 88 ARG 3.70 -1.10 1 90 ALA 0.67 -0.80 1 91 ALA -0.17 0.42 1 92 LEU -4.16 3.75 1 93 ILE -5.00 3.02 1 94 TYR -7.49 4.02 1 95 SER -3.42 3.34 1 96 ILE 0.60 -0.21 1 100 ALA 2.23 -0.81 1 101 GLU 3.44 -0.94 1 102 ILE 0.68 -0.75 1 103 HIS 2.11 2.22 1 104 SER 4.93 -1.73 1 105 SER 5.46 -1.02 1 106 LEU 4.11 -0.81 1 107 MET 4.73 -0.70 1 108 ARG 4.17 -0.58 1 109 VAL 6.54 -1.74 1 110 ALA 5.35 -1.32 1 111 ASP 3.22 -0.11 1 112 ALA 2.59 -0.29 1 113 VAL -1.98 0.14 1 115 ALA -3.63 2.47 1 116 ARG -1.37 1.34 1 117 LEU -5.86 3.43 1 118 ILE -5.22 3.20 1 119 ILE -4.91 3.86 1 120 LYS -4.79 1.70 1 122 LEU 1.34 0.10 1 123 THR 3.17 -0.55 1 125 GLU -1.78 1.15 1 126 ASP -1.46 0.93 1 127 ILE 0.16 -1.73 1 128 VAL 1.72 -2.04 1 129 THR -0.22 0.68 1 132 LYS 0.85 -0.14 1 133 MET -1.95 2.10 1 134 LYS -2.47 1.82 1 135 LEU 1.03 -0.75 1 136 VAL -1.76 0.98 1 137 ASN -2.98 1.92 1 138 TYR -2.00 2.39 1 140 ARG 0.16 -0.78 1 141 THR -3.18 1.57 1 142 TYR -3.58 1.63 1 143 PHE -0.05 -1.40 1 144 TYR -3.49 2.92 1 146 TYR -6.21 4.91 1 147 ILE -1.09 0.19 1 148 ALA -0.99 1.00 1 149 GLU -0.95 0.75 1 150 VAL 0.86 -0.53 1 151 ARG -0.45 0.14 1 152 SER 0.08 0.04 1 153 ARG 0.87 0.60 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15804_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 1.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.35 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -0.82 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 ALA 2.23 -2.33 0 12 SER 0.38 0.02 1 14 LEU -0.02 0.05 1 15 VAL -0.07 -0.01 1 17 ARG 0.96 -0.01 1 19 SER 2.14 -0.18 1 22 TRP 0.15 0.07 1 23 ASN 4.76 -0.97 1 24 ASP 4.88 -0.09 1 25 LEU 3.61 -0.44 1 26 ALA 2.40 -0.67 1 27 VAL 6.12 -0.61 1 28 TYR 5.91 -1.22 1 29 ILE 5.95 -1.08 1 30 ILE 5.58 -0.84 1 31 ARG 3.98 -0.40 1 33 SER -0.38 -0.12 1 37 THR -1.09 0.09 1 38 ARG -1.43 1.08 1 39 VAL -5.28 1.02 1 40 VAL -5.28 1.20 1 41 GLU -2.60 -0.02 1 42 VAL -2.83 0.92 1 44 ALA 1.33 -0.03 1 46 ARG -1.24 0.10 1 47 PHE -1.17 0.61 1 48 LEU 0.91 -0.02 1 49 TYR 3.17 -0.71 1 50 VAL 6.07 -0.72 1 51 SER 3.78 -0.47 1 52 ASP 4.04 -0.34 1 53 TYR 5.24 -0.72 1 54 ILE 6.37 -0.62 1 55 ARG 3.65 -0.04 1 56 LYS 1.31 -0.26 1 57 HIS 0.60 -0.01 1 58 SER -4.01 0.51 1 59 LYS -0.43 0.43 1 60 VAL 0.87 -0.14 1 61 ASP -0.58 0.14 1 62 LEU -3.67 0.94 1 63 VAL -3.17 0.06 1 64 LEU -5.08 1.03 1 65 THR -5.08 1.70 1 66 ASP -3.33 0.06 1 67 ILE 2.96 -0.37 1 68 LYS -1.96 -0.06 1 70 SER 0.94 -0.17 1 74 ILE -0.46 -0.20 1 75 VAL 0.49 -0.37 1 76 ARG 0.17 0.66 1 77 ASP -2.29 -0.02 1 78 ASP -3.41 0.31 1 79 ILE -1.50 -0.09 1 80 THR 1.53 0.03 1 81 SER -0.35 -0.16 1 83 ARG 1.67 0.25 1 84 MET 4.94 0.12 1 85 GLU 3.82 -0.30 1 86 ILE 3.98 -0.75 1 87 TYR -1.15 -0.58 1 88 ARG 3.70 -0.47 1 90 ALA 0.67 -0.08 1 91 ALA -0.17 0.23 1 92 LEU -4.16 1.14 1 93 ILE -5.00 1.23 1 94 TYR -7.49 1.92 1 95 SER -3.42 0.32 1 96 ILE 0.60 0.36 1 101 GLU 3.44 -0.25 1 102 ILE 0.68 0.56 1 103 HIS 2.11 -0.56 1 104 SER 4.93 -0.30 1 105 SER 5.46 -0.27 1 106 LEU 4.11 -0.67 1 107 MET 4.73 -0.71 1 108 ARG 4.17 -0.19 1 109 VAL 6.54 -0.56 1 110 ALA 5.35 -0.36 1 111 ASP 3.22 0.00 1 112 ALA 2.59 -0.09 1 113 VAL -1.98 0.57 1 115 ALA -3.63 0.14 1 116 ARG -1.37 0.35 1 117 LEU -5.86 1.59 1 118 ILE -5.22 1.27 1 119 ILE -4.91 0.84 1 120 LYS -4.79 0.85 1 122 LEU 1.34 -0.07 1 123 THR 3.17 -0.21 1 125 GLU -1.78 0.13 1 126 ASP -1.46 0.02 1 127 ILE 0.16 1.21 1 128 VAL 1.72 0.13 1 129 THR -0.22 -0.19 1 132 LYS 0.85 -0.11 1 133 MET -1.95 0.22 1 134 LYS -2.47 0.32 1 135 LEU 1.03 -0.50 1 136 VAL -1.76 -0.26 1 137 ASN -2.98 0.07 1 138 TYR -2.00 -0.12 1 140 ARG 0.16 0.03 1 141 THR -3.18 0.56 1 142 TYR -3.58 0.78 1 143 PHE -0.05 -0.06 1 144 TYR -3.49 1.08 1 145 GLU -8.75 1.53 1 146 TYR -6.21 0.53 1 147 ILE -1.09 -0.19 1 148 ALA -0.99 -0.33 1 149 GLU -0.95 -0.13 1 150 VAL 0.86 -0.03 1 151 ARG -0.45 0.14 1 152 SER 0.08 -0.01 1 153 ARG 0.87 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15804_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.75 _LACS_plot.Line_1_terminator_val_y_1 -3.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 2.09 _LACS_plot.Y_axis_chem_shift_offset 0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 THR -5.08 1.63 0 143 PHE -0.05 -5.09 0 12 SER 0.38 0.42 1 14 LEU -0.02 -0.40 1 17 ARG 0.96 1.04 1 22 TRP 0.15 1.83 1 23 ASN 4.76 1.55 1 24 ASP 4.88 1.43 1 25 LEU 3.61 -0.54 1 26 ALA 2.40 1.08 1 27 VAL 6.12 1.57 1 28 TYR 5.91 1.75 1 29 ILE 5.95 2.59 1 30 ILE 5.58 2.68 1 31 ARG 3.98 1.96 1 33 SER -0.38 -0.64 1 37 THR -1.09 -1.92 1 38 ARG -1.43 -1.76 1 39 VAL -5.28 -2.49 1 40 VAL -5.28 -1.90 1 41 GLU -2.60 -1.08 1 42 VAL -2.83 2.69 1 44 ALA 1.33 -0.74 1 46 ARG -1.24 -0.97 1 47 PHE -1.17 -1.62 1 48 LEU 0.91 -1.91 1 49 TYR 3.17 1.19 1 50 VAL 6.07 0.34 1 51 SER 3.78 2.10 1 52 ASP 4.04 2.11 1 53 TYR 5.24 3.74 1 54 ILE 6.37 2.23 1 55 ARG 3.65 1.66 1 56 LYS 1.31 1.39 1 57 HIS 0.60 -0.82 1 58 SER -4.01 -1.68 1 59 LYS -0.43 0.91 1 60 VAL 0.87 -1.03 1 61 ASP -0.58 -2.90 1 62 LEU -3.67 -1.55 1 63 VAL -3.17 -3.69 1 64 LEU -5.08 -1.29 1 66 ASP -3.33 -2.12 1 67 ILE 2.96 -1.77 1 70 SER 0.94 -1.04 1 71 HIS -2.88 1.23 1 74 ILE -0.46 -2.44 1 75 VAL 0.49 -0.83 1 76 ARG 0.17 -0.44 1 77 ASP -2.29 -2.99 1 78 ASP -3.41 0.85 1 79 ILE -1.50 -1.83 1 80 THR 1.53 1.38 1 83 ARG 1.67 0.29 1 84 MET 4.94 1.77 1 85 GLU 3.82 1.24 1 86 ILE 3.98 -0.63 1 87 TYR -1.15 -0.71 1 88 ARG 3.70 0.87 1 90 ALA 0.67 -0.91 1 91 ALA -0.17 1.39 1 92 LEU -4.16 -3.90 1 93 ILE -5.00 -2.36 1 94 TYR -7.49 -2.73 1 95 SER -3.42 -1.39 1 96 ILE 0.60 -1.37 1 100 ALA 2.23 1.61 1 101 GLU 3.44 1.41 1 102 ILE 0.68 0.13 1 103 HIS 2.11 3.52 1 104 SER 4.93 2.91 1 105 SER 5.46 0.92 1 106 LEU 4.11 -0.09 1 107 MET 4.73 0.20 1 108 ARG 4.17 3.87 1 109 VAL 6.54 0.71 1 110 ALA 5.35 2.34 1 111 ASP 3.22 2.19 1 112 ALA 2.59 2.48 1 113 VAL -1.98 0.59 1 115 ALA -3.63 -1.44 1 116 ARG -1.37 -2.34 1 117 LEU -5.86 -2.47 1 118 ILE -5.22 -0.82 1 119 ILE -4.91 -1.13 1 122 LEU 1.34 -0.40 1 123 THR 3.17 0.89 1 125 GLU -1.78 -1.05 1 126 ASP -1.46 -0.75 1 133 MET -1.95 -1.75 1 134 LYS -2.47 -1.11 1 135 LEU 1.03 -1.99 1 136 VAL -1.76 -3.05 1 137 ASN -2.98 -1.27 1 138 TYR -2.00 -1.86 1 140 ARG 0.16 -0.72 1 141 THR -3.18 -2.31 1 142 TYR -3.58 -1.89 1 144 TYR -3.49 -0.66 1 145 GLU -8.75 -2.09 1 146 TYR -6.21 -3.54 1 147 ILE -1.09 -2.70 1 148 ALA -0.99 -0.29 1 149 GLU -0.95 -0.24 1 150 VAL 0.86 -0.11 1 151 ARG -0.45 -0.16 1 152 SER 0.08 -1.12 1 stop_ save_