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 bmr15315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 -5.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.84 _LACS_plot.Line_2_terminator_val_x_2 8.87 _LACS_plot.Line_2_terminator_val_y_2 2.95 _LACS_plot.Y_axis_chem_shift_offset 2.66 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 MET -7.09 -1.84 0 67 HIS 8.88 4.44 0 11 MET 1.09 -1.89 1 12 SER 2.37 -0.22 1 15 GLN 6.62 1.49 1 16 ILE -0.44 -2.44 1 18 ASP 3.90 1.01 1 19 GLU 3.35 -0.59 1 20 ASP 0.46 -1.98 1 21 ILE -1.35 -3.32 1 22 THR -6.04 -5.10 1 23 ALA -7.03 -4.13 1 24 SER 3.87 -1.74 1 25 SER -0.32 -2.59 1 26 GLN -3.50 -5.01 1 27 TRP 4.47 0.05 1 28 SER -4.43 -4.96 1 29 GLU 3.90 0.42 1 30 SER 2.77 -1.28 1 31 THR -0.21 -4.09 1 32 ALA -2.82 -3.06 1 33 ALA 3.54 0.27 1 34 LYS 4.95 -0.80 1 35 TYR 2.34 -2.43 1 37 ARG -2.53 -3.52 1 38 LEU -0.12 -1.18 1 39 ASP 3.19 -0.44 1 40 SER -0.26 -2.44 1 41 GLU -2.33 -4.68 1 42 GLU -1.08 -3.17 1 44 ASP 0.69 -2.95 1 46 ALA -3.99 -3.35 1 47 TRP 0.07 -4.14 1 50 GLU -0.14 -0.73 1 51 ILE -2.43 -4.02 1 53 VAL 1.30 -2.26 1 54 GLU -3.05 -4.53 1 56 ASP 0.44 -2.81 1 57 ASP -0.38 -3.13 1 58 LEU 1.69 -3.59 1 59 LYS -0.27 -2.46 1 60 GLU -2.40 -5.84 1 61 PHE -2.92 -3.67 1 62 LEU -3.64 -3.94 1 63 GLN -5.04 -4.00 1 64 ILE -4.41 -2.80 1 65 ASP -2.76 -4.48 1 66 LEU 0.18 -2.55 1 68 THR -3.55 -5.08 1 69 LEU 2.26 -1.11 1 70 HIS -2.91 -1.92 1 71 PHE -1.61 -3.23 1 72 ILE -0.52 -2.88 1 73 THR -0.90 -3.35 1 74 LEU -2.98 -2.22 1 75 VAL -5.89 -5.27 1 77 THR -5.37 -4.33 1 78 GLN -8.77 -4.58 1 80 ARG -3.42 -3.80 1 81 HIS -0.61 -0.48 1 82 ALA 0.31 -3.41 1 85 HIS -0.07 -1.43 1 87 ILE -2.66 -3.05 1 88 GLU -0.10 -0.82 1 89 PHE -1.60 -4.21 1 90 ALA -2.75 -4.97 1 92 MET -8.07 -4.15 1 93 TYR -0.44 -2.71 1 94 LYS -5.25 -4.55 1 95 ILE -3.73 -3.72 1 96 ASN -5.64 -5.63 1 97 TYR -4.18 -4.48 1 98 SER -2.76 -4.69 1 100 ASP -2.29 -3.29 1 102 THR 1.05 -1.25 1 103 ARG -0.09 -3.38 1 104 TRP -1.79 -3.45 1 105 ILE -2.75 -4.34 1 106 SER -0.59 -3.55 1 107 TRP 4.29 0.73 1 108 ARG -5.02 -5.15 1 109 ASN -2.14 -4.98 1 110 ARG 3.79 -0.37 1 111 HIS -1.48 -2.51 1 113 LYS -0.03 -2.82 1 114 GLN -2.11 -2.30 1 115 VAL 2.14 -1.49 1 116 LEU 0.14 -3.38 1 117 ASP 0.66 -1.82 1 119 ASN 0.34 0.17 1 120 SER -1.51 -3.53 1 121 ASN 1.55 -2.35 1 123 TYR -3.60 -5.43 1 124 ASP 0.88 -1.30 1 125 ILE 0.72 -1.57 1 126 PHE -2.30 -3.73 1 127 LEU -2.25 -3.80 1 128 LYS -3.75 -5.08 1 129 ASP -0.40 -2.22 1 130 LEU 0.88 -3.61 1 131 GLU -4.50 -4.63 1 134 ILE -2.33 -3.07 1 135 VAL -0.21 -3.84 1 136 ALA -6.18 -3.26 1 137 ARG -0.05 -1.30 1 138 PHE -7.85 -5.00 1 139 VAL -3.88 -3.32 1 140 ARG -5.20 -4.27 1 141 PHE -2.09 -2.55 1 142 ILE -2.88 -3.77 1 144 VAL -3.04 -3.25 1 145 THR -5.19 -6.47 1 146 ASP -1.41 -3.60 1 147 HIS -1.71 -3.67 1 148 SER 2.56 -1.66 1 149 MET -3.11 -2.90 1 150 ASN 0.99 -2.68 1 151 VAL -5.55 -5.93 1 154 ARG -4.86 -2.96 1 155 VAL -7.01 -5.86 1 156 GLU -7.93 -4.49 1 157 LEU -6.05 -4.29 1 158 TYR -3.60 -5.53 1 161 VAL 2.19 -1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 3.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -4.08 _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 8.87 _LACS_plot.Line_2_terminator_val_y_2 -5.92 _LACS_plot.Y_axis_chem_shift_offset 2.66 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 MET -7.09 5.25 0 67 HIS 8.88 -4.44 0 11 MET 1.09 -2.98 1 12 SER 2.37 -2.59 1 15 GLN 6.62 -5.13 1 16 ILE -0.44 -2.00 1 18 ASP 3.90 -2.89 1 19 GLU 3.35 -3.94 1 20 ASP 0.46 -2.44 1 21 ILE -1.35 -1.97 1 22 THR -6.04 0.94 1 23 ALA -7.03 2.90 1 24 SER 3.87 -5.61 1 25 SER -0.32 -2.27 1 26 GLN -3.50 -1.51 1 27 TRP 4.47 -4.42 1 28 SER -4.43 -0.53 1 29 GLU 3.90 -3.48 1 30 SER 2.77 -4.05 1 31 THR -0.21 -3.88 1 32 ALA -2.82 -0.24 1 33 ALA 3.54 -3.27 1 34 LYS 4.95 -5.75 1 35 TYR 2.34 -4.77 1 37 ARG -2.53 -0.99 1 38 LEU -0.12 -1.06 1 39 ASP 3.19 -3.63 1 40 SER -0.26 -2.18 1 41 GLU -2.33 -2.35 1 42 GLU -1.08 -2.09 1 44 ASP 0.69 -3.64 1 46 ALA -3.99 0.64 1 47 TRP 0.07 -4.21 1 50 GLU -0.14 -0.59 1 51 ILE -2.43 -1.59 1 53 VAL 1.30 -3.56 1 54 GLU -3.05 -1.48 1 56 ASP 0.44 -3.25 1 57 ASP -0.38 -2.75 1 58 LEU 1.69 -5.28 1 59 LYS -0.27 -2.19 1 60 GLU -2.40 -3.44 1 61 PHE -2.92 -0.75 1 62 LEU -3.64 -0.30 1 63 GLN -5.04 1.04 1 64 ILE -4.41 1.61 1 65 ASP -2.76 -1.72 1 66 LEU 0.18 -2.73 1 68 THR -3.55 -1.53 1 69 LEU 2.26 -3.37 1 70 HIS -2.91 0.99 1 71 PHE -1.61 -1.62 1 72 ILE -0.52 -2.36 1 73 THR -0.90 -2.45 1 74 LEU -2.98 0.76 1 75 VAL -5.89 0.62 1 77 THR -5.37 1.04 1 78 GLN -8.77 4.19 1 80 ARG -3.42 -0.38 1 81 HIS -0.61 0.13 1 82 ALA 0.31 -3.72 1 85 HIS -0.07 -1.36 1 87 ILE -2.66 -0.39 1 88 GLU -0.10 -0.72 1 89 PHE -1.60 -2.61 1 90 ALA -2.75 -2.22 1 92 MET -8.07 3.92 1 93 TYR -0.44 -2.27 1 94 LYS -5.25 0.70 1 95 ILE -3.73 0.01 1 96 ASN -5.64 0.01 1 97 TYR -4.18 -0.30 1 98 SER -2.76 -1.93 1 100 ASP -2.29 -1.00 1 102 THR 1.05 -2.30 1 103 ARG -0.09 -3.29 1 104 TRP -1.79 -1.66 1 105 ILE -2.75 -1.59 1 106 SER -0.59 -2.96 1 107 TRP 4.29 -3.56 1 108 ARG -5.02 -0.13 1 109 ASN -2.14 -2.84 1 110 ARG 3.79 -4.16 1 111 HIS -1.48 -1.03 1 113 LYS -0.03 -2.79 1 114 GLN -2.11 -0.19 1 115 VAL 2.14 -3.63 1 116 LEU 0.14 -3.52 1 117 ASP 0.66 -2.48 1 119 ASN 0.34 -0.17 1 120 SER -1.51 -2.02 1 121 ASN 1.55 -3.90 1 123 TYR -3.60 -1.83 1 124 ASP 0.88 -2.18 1 125 ILE 0.72 -2.29 1 126 PHE -2.30 -1.43 1 127 LEU -2.25 -1.55 1 128 LYS -3.75 -1.33 1 129 ASP -0.40 -1.82 1 130 LEU 0.88 -4.49 1 131 GLU -4.50 -0.13 1 134 ILE -2.33 -0.74 1 135 VAL -0.21 -3.63 1 136 ALA -6.18 2.92 1 137 ARG -0.05 -1.25 1 138 PHE -7.85 2.85 1 139 VAL -3.88 0.56 1 140 ARG -5.20 0.93 1 141 PHE -2.09 -0.46 1 142 ILE -2.88 -0.89 1 144 VAL -3.04 -0.21 1 145 THR -5.19 -1.28 1 146 ASP -1.41 -2.19 1 147 HIS -1.71 -1.96 1 148 SER 2.56 -4.22 1 149 MET -3.11 0.21 1 150 ASN 0.99 -3.67 1 151 VAL -5.55 -0.38 1 154 ARG -4.86 1.90 1 155 VAL -7.01 1.15 1 156 GLU -7.93 3.44 1 157 LEU -6.05 1.76 1 158 TYR -3.60 -1.93 1 161 VAL 2.19 -3.49 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 0.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 8.87 _LACS_plot.Line_2_terminator_val_y_2 -0.98 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 HIS 8.88 -1.28 0 11 MET 1.09 0.05 1 12 SER 2.37 -0.24 1 15 GLN 6.62 -0.42 1 16 ILE -0.44 -0.09 1 18 ASP 3.90 -0.71 1 19 GLU 3.35 -0.34 1 20 ASP 0.46 0.28 1 21 ILE -1.35 0.80 1 22 THR -6.04 0.21 1 23 ALA -7.03 0.37 1 24 SER 3.87 -1.14 1 25 SER -0.32 0.06 1 26 GLN -3.50 1.26 1 27 TRP 4.47 -0.60 1 28 SER -4.43 -0.04 1 29 GLU 3.90 -0.27 1 30 SER 2.77 -0.12 1 31 THR -0.21 1.07 1 32 ALA -2.82 0.04 1 33 ALA 3.54 -0.63 1 34 LYS 4.95 -0.51 1 35 TYR 2.34 0.10 1 37 ARG -2.53 -0.04 1 38 LEU -0.12 -0.77 1 39 ASP 3.19 -0.23 1 40 SER -0.26 -0.10 1 41 GLU -2.33 0.28 1 42 GLU -1.08 -0.17 1 44 ASP 0.69 0.26 1 46 ALA -3.99 -0.08 1 47 TRP 0.07 0.39 1 50 GLU -0.14 -0.83 1 51 ILE -2.43 0.27 1 53 VAL 1.30 -0.17 1 54 GLU -3.05 -0.19 1 56 ASP 0.44 -0.18 1 57 ASP -0.38 0.00 1 58 LEU 1.69 0.11 1 59 LYS -0.27 0.11 1 60 GLU -2.40 0.58 1 61 PHE -2.92 0.91 1 62 LEU -3.64 -0.25 1 63 GLN -5.04 1.17 1 64 ILE -4.41 0.49 1 65 ASP -2.76 -0.21 1 66 LEU 0.18 -0.31 1 68 THR -3.55 0.14 1 69 LEU 2.26 -0.46 1 70 HIS -2.91 0.02 1 71 PHE -1.61 0.53 1 72 ILE -0.52 0.57 1 73 THR -0.90 0.14 1 74 LEU -2.98 0.76 1 75 VAL -5.89 1.18 1 77 THR -5.37 1.09 1 78 GLN -8.77 0.55 1 80 ARG -3.42 -0.27 1 81 HIS -0.61 -0.08 1 82 ALA 0.31 -0.21 1 85 HIS -0.07 -0.19 1 87 ILE -2.66 0.51 1 88 GLU -0.10 -0.28 1 89 PHE -1.60 0.43 1 90 ALA -2.75 0.28 1 92 MET -8.07 0.52 1 93 TYR -0.44 0.81 1 94 LYS -5.25 0.66 1 95 ILE -3.73 0.93 1 96 ASN -5.64 1.43 1 97 TYR -4.18 1.17 1 98 SER -2.76 0.10 1 100 ASP -2.29 0.04 1 102 THR 1.05 -0.14 1 103 ARG -0.09 0.07 1 104 TRP -1.79 -0.18 1 105 ILE -2.75 -0.15 1 106 SER -0.59 0.71 1 107 TRP 4.29 -0.21 1 108 ARG -5.02 -0.21 1 109 ASN -2.14 -0.46 1 110 ARG 3.79 -0.44 1 111 HIS -1.48 -0.07 1 113 LYS -0.03 -0.06 1 114 GLN -2.11 0.43 1 115 VAL 2.14 -0.19 1 116 LEU 0.14 -0.01 1 117 ASP 0.66 -0.22 1 119 ASN 0.34 -0.95 1 120 SER -1.51 -0.26 1 121 ASN 1.55 -1.29 1 123 TYR -3.60 0.04 1 124 ASP 0.88 -0.06 1 125 ILE 0.72 -0.18 1 126 PHE -2.30 0.31 1 127 LEU -2.25 0.74 1 128 LYS -3.75 0.13 1 129 ASP -0.40 -0.05 1 130 LEU 0.88 -0.10 1 131 GLU -4.50 0.07 1 134 ILE -2.33 -0.31 1 135 VAL -0.21 0.74 1 136 ALA -6.18 -0.01 1 137 ARG -0.05 0.19 1 138 PHE -7.85 1.14 1 139 VAL -3.88 0.56 1 140 ARG -5.20 1.26 1 141 PHE -2.09 0.17 1 142 ILE -2.88 0.63 1 144 VAL -3.04 0.04 1 145 THR -5.19 0.20 1 146 ASP -1.41 0.03 1 147 HIS -1.71 -0.25 1 148 SER 2.56 -0.13 1 149 MET -3.11 -0.02 1 150 ASN 0.99 0.19 1 151 VAL -5.55 -0.07 1 153 MET -7.09 0.95 1 154 ARG -4.86 -0.30 1 155 VAL -7.01 1.29 1 156 GLU -7.93 0.10 1 157 LEU -6.05 0.61 1 158 TYR -3.60 0.86 1 161 VAL 2.19 -0.74 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15315_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 -4.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.72 _LACS_plot.Line_2_terminator_val_x_2 8.87 _LACS_plot.Line_2_terminator_val_y_2 -1.44 _LACS_plot.Y_axis_chem_shift_offset 3.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 HIS 8.88 -2.44 0 81 HIS -0.61 1.89 0 78 GLN -8.77 -0.48 0 11 MET 1.09 0.39 1 12 SER 2.37 0.77 1 15 GLN 6.62 -0.34 1 18 ASP 3.90 -0.96 1 19 GLU 3.35 -2.70 1 20 ASP 0.46 -4.55 1 21 ILE -1.35 -4.19 1 22 THR -6.04 -5.03 1 23 ALA -7.03 -3.11 1 24 SER 3.87 -2.31 1 25 SER -0.32 -5.83 1 26 GLN -3.50 -4.43 1 27 TRP 4.47 -3.45 1 28 SER -4.43 -2.31 1 29 GLU 3.90 -0.45 1 30 SER 2.77 -3.95 1 31 THR -0.21 -3.83 1 32 ALA -2.82 -4.12 1 33 ALA 3.54 -2.04 1 34 LYS 4.95 -3.59 1 35 TYR 2.34 -0.65 1 37 ARG -2.53 -3.79 1 38 LEU -0.12 -4.50 1 39 ASP 3.19 -3.62 1 40 SER -0.26 -1.79 1 41 GLU -2.33 -2.87 1 42 GLU -1.08 -2.23 1 44 ASP 0.69 -1.13 1 46 ALA -3.99 -6.02 1 47 TRP 0.07 -2.23 1 50 GLU -0.14 -5.08 1 53 VAL 1.30 -3.62 1 54 GLU -3.05 -2.63 1 56 ASP 0.44 -3.76 1 57 ASP -0.38 -3.89 1 58 LEU 1.69 -3.05 1 59 LYS -0.27 -2.69 1 60 GLU -2.40 -2.34 1 61 PHE -2.92 -7.77 1 62 LEU -3.64 -5.63 1 63 GLN -5.04 -5.52 1 64 ILE -4.41 -4.72 1 65 ASP -2.76 -3.33 1 66 LEU 0.18 -0.84 1 68 THR -3.55 -2.73 1 69 LEU 2.26 -3.34 1 70 HIS -2.91 -3.21 1 71 PHE -1.61 -3.06 1 72 ILE -0.52 -3.45 1 73 THR -0.90 -1.64 1 74 LEU -2.98 -6.35 1 75 VAL -5.89 -5.16 1 77 THR -5.37 -3.47 1 80 ARG -3.42 -7.56 1 82 ALA 0.31 -1.28 1 85 HIS -0.07 -1.04 1 87 ILE -2.66 -3.15 1 88 GLU -0.10 -3.61 1 89 PHE -1.60 -6.42 1 92 MET -8.07 -4.99 1 93 TYR -0.44 -6.59 1 94 LYS -5.25 -4.47 1 95 ILE -3.73 -3.01 1 96 ASN -5.64 -3.57 1 97 TYR -4.18 -5.52 1 98 SER -2.76 -1.66 1 100 ASP -2.29 -2.03 1 102 THR 1.05 -3.95 1 103 ARG -0.09 -2.82 1 104 TRP -1.79 -4.05 1 105 ILE -2.75 -3.79 1 106 SER -0.59 -2.46 1 107 TRP 4.29 -4.07 1 108 ARG -5.02 -5.42 1 109 ASN -2.14 0.18 1 110 ARG 3.79 -2.64 1 111 HIS -1.48 -1.11 1 113 LYS -0.03 -3.09 1 114 GLN -2.11 -3.16 1 115 VAL 2.14 -3.72 1 116 LEU 0.14 -4.57 1 117 ASP 0.66 -3.96 1 119 ASN 0.34 -5.16 1 120 SER -1.51 -4.86 1 123 TYR -3.60 -1.85 1 124 ASP 0.88 -2.44 1 125 ILE 0.72 -3.33 1 126 PHE -2.30 -3.00 1 127 LEU -2.25 -4.39 1 128 LYS -3.75 -4.81 1 129 ASP -0.40 -3.42 1 130 LEU 0.88 -6.65 1 134 ILE -2.33 -4.81 1 135 VAL -0.21 -3.44 1 136 ALA -6.18 -5.77 1 137 ARG -0.05 -6.25 1 138 PHE -7.85 -1.93 1 139 VAL -3.88 -4.99 1 140 ARG -5.20 -3.86 1 141 PHE -2.09 -2.88 1 144 VAL -3.04 -6.00 1 145 THR -5.19 -3.66 1 146 ASP -1.41 -3.31 1 147 HIS -1.71 -4.72 1 148 SER 2.56 -1.95 1 149 MET -3.11 -5.40 1 150 ASN 0.99 -3.22 1 151 VAL -5.55 -5.92 1 153 MET -7.09 -4.58 1 154 ARG -4.86 -3.22 1 155 VAL -7.01 -3.78 1 156 GLU -7.93 -5.77 1 157 LEU -6.05 -6.65 1 158 TYR -3.60 -3.11 1 161 VAL 2.19 -3.38 1 stop_ save_