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 bmr15558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.88 _LACS_plot.Line_1_terminator_val_y_1 -5.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.32 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 2.56 _LACS_plot.Y_axis_chem_shift_offset 3.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 TYR 7.46 4.39 0 16 ASN 0.39 -4.00 1 17 THR 4.16 0.69 1 18 ILE -0.06 -3.79 1 20 ASP 4.48 1.14 1 21 SER 3.13 -1.07 1 22 GLN 1.33 -1.96 1 23 MET -1.13 -2.53 1 24 SER -3.51 -3.69 1 25 ALA -6.57 -3.51 1 26 SER -0.40 -1.12 1 27 SER 0.31 -2.44 1 28 SER -2.14 -2.36 1 29 TYR -1.50 -2.87 1 30 LYS -2.30 -4.50 1 31 THR -1.07 -7.18 1 32 TRP 2.87 -2.25 1 33 ASN 2.28 -1.28 1 34 LEU -0.82 -2.96 1 35 ARG -6.04 -3.82 1 36 ALA 1.89 -1.64 1 37 PHE -2.10 -5.28 1 39 TRP -3.08 -5.20 1 42 HIS 2.33 -0.31 1 43 LEU 0.79 -3.60 1 46 LEU -1.28 -1.89 1 47 ASP 3.95 -0.69 1 48 ASN 2.85 -1.25 1 49 GLN -3.53 -4.16 1 51 LYS 3.56 0.13 1 52 ILE 2.40 -2.74 1 53 ASN 0.20 -3.52 1 54 ALA -6.35 -4.72 1 55 TRP -0.71 -3.88 1 56 THR -5.18 -5.15 1 57 ALA -1.37 -3.90 1 58 GLN 4.28 1.02 1 59 SER -4.70 -5.37 1 60 ASN -0.53 -5.54 1 61 SER -2.78 -4.27 1 62 ALA 0.66 -2.46 1 64 GLU -1.52 -4.19 1 65 TRP -3.25 -4.10 1 66 LEU -3.86 -4.22 1 67 GLN -6.29 -4.24 1 68 VAL -4.07 -3.85 1 69 ASP -2.54 -4.68 1 70 LEU 1.72 -1.74 1 72 THR -2.31 -5.55 1 73 GLN 1.17 -1.38 1 75 GLN 0.25 -2.67 1 76 VAL 1.62 -2.35 1 77 THR -1.59 -3.71 1 79 ILE -4.62 -4.13 1 80 ILE -3.74 -4.12 1 81 THR -5.26 -4.62 1 82 GLN -7.89 -3.86 1 84 ALA -1.03 -2.07 1 85 ARG -4.58 -3.92 1 86 ASP -2.50 -4.03 1 87 PHE 4.74 -0.67 1 89 HIS -0.15 -1.31 1 90 ILE 2.38 -0.89 1 91 GLN -4.06 -4.45 1 92 TYR -1.44 -3.90 1 93 VAL 2.74 -0.84 1 94 ALA -0.66 -2.56 1 95 SER -0.44 -2.36 1 96 TYR -1.94 -3.17 1 97 LYS -4.96 -3.96 1 98 VAL -3.50 -3.41 1 99 ALA -8.30 -5.99 1 100 HIS -5.63 -3.54 1 101 SER -1.48 -3.72 1 102 ASP 0.28 -1.26 1 103 ASP -1.82 -3.68 1 105 VAL -0.00 -1.34 1 106 GLN -1.21 -3.90 1 107 TRP -2.16 -3.06 1 108 THR -1.03 -3.06 1 109 VAL 1.48 -2.45 1 110 TYR 2.60 -0.16 1 111 GLU -5.94 -4.93 1 112 GLU -4.74 -3.27 1 113 GLN 3.71 -1.94 1 115 SER -3.44 -4.30 1 116 SER 1.70 -1.78 1 117 LYS -1.42 -3.42 1 118 VAL 1.67 -3.19 1 119 PHE 1.24 -1.98 1 120 GLN 1.06 -2.39 1 122 ASN -1.28 0.22 1 123 LEU -2.72 -3.60 1 124 ASP -0.54 -4.16 1 126 ASN -3.56 -2.67 1 127 SER 5.35 0.07 1 128 HIS -3.41 -2.72 1 130 LYS -2.43 -4.38 1 131 ASN -8.00 -6.46 1 132 ILE -2.94 -5.52 1 133 PHE -0.22 -5.27 1 134 GLU 2.63 -0.16 1 137 PHE -6.12 -7.12 1 138 MET -2.21 -5.95 1 139 ALA -5.50 -2.81 1 141 TYR -6.79 -5.33 1 142 VAL -4.66 -3.78 1 143 ARG -6.68 -4.52 1 144 VAL 0.19 -2.47 1 147 VAL 1.31 -1.13 1 148 SER -2.98 -3.75 1 150 HIS -0.85 -2.62 1 151 ASN 7.73 2.69 1 152 ARG -5.92 -3.91 1 153 ILE 2.27 -1.90 1 154 THR -3.59 -3.78 1 155 LEU -8.88 -3.46 1 157 LEU -5.83 -3.05 1 158 GLU -8.25 -4.16 1 160 LEU -5.39 -6.12 1 163 LEU -0.62 -2.75 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.88 _LACS_plot.Line_1_terminator_val_y_1 3.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -4.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.32 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 -5.16 _LACS_plot.Y_axis_chem_shift_offset 3.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 TYR 7.46 -3.07 0 16 ASN 0.39 -4.39 1 17 THR 4.16 -3.47 1 18 ILE -0.06 -3.73 1 20 ASP 4.48 -3.34 1 21 SER 3.13 -4.20 1 22 GLN 1.33 -3.29 1 23 MET -1.13 -1.40 1 24 SER -3.51 -0.18 1 25 ALA -6.57 3.06 1 26 SER -0.40 -0.72 1 27 SER 0.31 -2.75 1 28 SER -2.14 -0.22 1 29 TYR -1.50 -1.37 1 30 LYS -2.30 -2.20 1 31 THR -1.07 -6.11 1 32 TRP 2.87 -5.12 1 33 ASN 2.28 -3.56 1 34 LEU -0.82 -2.14 1 35 ARG -6.04 2.22 1 36 ALA 1.89 -3.53 1 37 PHE -2.10 -3.18 1 39 TRP -3.08 -2.12 1 42 HIS 2.33 -2.64 1 43 LEU 0.79 -4.39 1 46 LEU -1.28 -0.61 1 47 ASP 3.95 -4.64 1 48 ASN 2.85 -4.10 1 49 GLN -3.53 -0.63 1 51 LYS 3.56 -3.43 1 52 ILE 2.40 -5.14 1 53 ASN 0.20 -3.72 1 54 ALA -6.35 1.63 1 55 TRP -0.71 -3.17 1 56 THR -5.18 0.03 1 57 ALA -1.37 -2.53 1 58 GLN 4.28 -3.26 1 59 SER -4.70 -0.67 1 60 ASN -0.53 -5.01 1 61 SER -2.78 -1.49 1 62 ALA 0.66 -3.12 1 64 GLU -1.52 -2.67 1 65 TRP -3.25 -0.85 1 66 LEU -3.86 -0.36 1 67 GLN -6.29 2.05 1 68 VAL -4.07 0.22 1 69 ASP -2.54 -2.14 1 70 LEU 1.72 -3.46 1 72 THR -2.31 -3.24 1 73 GLN 1.17 -2.55 1 75 GLN 0.25 -2.92 1 76 VAL 1.62 -3.97 1 77 THR -1.59 -2.12 1 79 ILE -4.62 0.49 1 80 ILE -3.74 -0.38 1 81 THR -5.26 0.64 1 82 GLN -7.89 4.03 1 84 ALA -1.03 -1.04 1 85 ARG -4.58 0.66 1 86 ASP -2.50 -1.53 1 87 PHE 4.74 -5.41 1 89 HIS -0.15 -1.16 1 90 ILE 2.38 -3.27 1 91 GLN -4.06 -0.39 1 92 TYR -1.44 -2.46 1 93 VAL 2.74 -3.58 1 94 ALA -0.66 -1.90 1 95 SER -0.44 -1.92 1 96 TYR -1.94 -1.23 1 97 LYS -4.96 1.00 1 98 VAL -3.50 0.09 1 99 ALA -8.30 2.31 1 100 HIS -5.63 2.09 1 101 SER -1.48 -2.24 1 102 ASP 0.28 -1.54 1 103 ASP -1.82 -1.86 1 105 VAL -0.00 -1.34 1 106 GLN -1.21 -2.69 1 107 TRP -2.16 -0.90 1 108 THR -1.03 -2.03 1 109 VAL 1.48 -3.93 1 110 TYR 2.60 -2.76 1 111 GLU -5.94 1.01 1 112 GLU -4.74 1.47 1 113 GLN 3.71 -5.65 1 115 SER -3.44 -0.86 1 116 SER 1.70 -3.48 1 117 LYS -1.42 -2.00 1 118 VAL 1.67 -4.86 1 119 PHE 1.24 -3.22 1 120 GLN 1.06 -3.45 1 122 ASN -1.28 1.50 1 123 LEU -2.72 -0.88 1 124 ASP -0.54 -3.62 1 126 ASN -3.56 0.89 1 127 SER 5.35 -5.28 1 128 HIS -3.41 0.69 1 130 LYS -2.43 -1.95 1 131 ASN -8.00 1.54 1 132 ILE -2.94 -2.58 1 133 PHE -0.22 -5.05 1 134 GLU 2.63 -2.79 1 137 PHE -6.12 -1.00 1 138 MET -2.21 -3.74 1 139 ALA -5.50 2.69 1 141 TYR -6.79 1.46 1 142 VAL -4.66 0.88 1 143 ARG -6.68 2.16 1 144 VAL 0.19 -2.66 1 147 VAL 1.31 -2.44 1 148 SER -2.98 -0.77 1 150 HIS -0.85 -1.77 1 151 ASN 7.73 -5.04 1 152 ARG -5.92 2.01 1 153 ILE 2.27 -4.17 1 154 THR -3.59 -0.19 1 155 LEU -8.88 5.42 1 157 LEU -5.83 2.78 1 158 GLU -8.25 4.09 1 160 LEU -5.39 -0.73 1 163 LEU -0.62 -2.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.88 _LACS_plot.Line_1_terminator_val_y_1 0.84 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 -0.87 _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 155 LEU -8.88 -0.66 0 16 ASN 0.39 -0.25 1 17 THR 4.16 -0.19 1 18 ILE -0.06 -0.28 1 20 ASP 4.48 -0.64 1 21 SER 3.13 -0.40 1 22 GLN 1.33 0.02 1 23 MET -1.13 0.82 1 24 SER -3.51 0.15 1 25 ALA -6.57 0.14 1 26 SER -0.40 1.18 1 27 SER 0.31 0.02 1 28 SER -2.14 0.76 1 30 LYS -2.30 -0.19 1 32 TRP 2.87 -0.46 1 33 ASN 2.28 -0.62 1 35 ARG -6.04 -0.18 1 36 ALA 1.89 -0.15 1 37 PHE -2.10 0.06 1 39 TRP -3.08 0.02 1 40 TYR 7.46 -0.72 1 42 HIS 2.33 0.62 1 43 LEU 0.79 -0.22 1 46 LEU -1.28 -0.79 1 47 ASP 3.95 -0.39 1 48 ASN 2.85 -0.14 1 49 GLN -3.53 0.30 1 51 LYS 3.56 -0.53 1 52 ILE 2.40 0.02 1 53 ASN 0.20 -0.32 1 54 ALA -6.35 0.22 1 55 TRP -0.71 0.12 1 56 THR -5.18 0.39 1 57 ALA -1.37 -0.65 1 58 GLN 4.28 -0.88 1 59 SER -4.70 -0.19 1 60 ASN -0.53 -0.77 1 61 SER -2.78 0.11 1 62 ALA 0.66 0.35 1 64 GLU -1.52 0.00 1 65 TRP -3.25 0.35 1 66 LEU -3.86 -0.16 1 67 GLN -6.29 1.12 1 68 VAL -4.07 0.43 1 69 ASP -2.54 0.09 1 70 LEU 1.72 -0.34 1 72 THR -2.31 -0.20 1 73 GLN 1.17 -0.50 1 75 GLN 0.25 0.30 1 76 VAL 1.62 0.12 1 77 THR -1.59 0.03 1 79 ILE -4.62 0.64 1 80 ILE -3.74 0.89 1 81 THR -5.26 1.21 1 82 GLN -7.89 0.40 1 84 ALA -1.03 0.29 1 85 ARG -4.58 0.81 1 86 ASP -2.50 0.29 1 87 PHE 4.74 -0.71 1 90 ILE 2.38 -0.29 1 91 GLN -4.06 0.89 1 92 TYR -1.44 0.66 1 93 VAL 2.74 0.16 1 94 ALA -0.66 0.73 1 95 SER -0.44 0.78 1 96 TYR -1.94 0.88 1 97 LYS -4.96 0.99 1 98 VAL -3.50 0.94 1 99 ALA -8.30 1.32 1 100 HIS -5.63 1.16 1 101 SER -1.48 0.25 1 102 ASP 0.28 0.48 1 103 ASP -1.82 0.04 1 105 VAL -0.00 -0.33 1 106 GLN -1.21 0.04 1 107 TRP -2.16 -0.27 1 108 THR -1.03 -0.16 1 109 VAL 1.48 0.04 1 110 TYR 2.60 -0.41 1 111 GLU -5.94 0.23 1 112 GLU -4.74 -0.15 1 113 GLN 3.71 -0.53 1 115 SER -3.44 0.22 1 116 SER 1.70 -0.34 1 117 LYS -1.42 -0.20 1 118 VAL 1.67 -0.09 1 119 PHE 1.24 -0.67 1 120 GLN 1.06 -0.36 1 122 ASN -1.28 -0.46 1 123 LEU -2.72 -0.49 1 124 ASP -0.54 -0.66 1 126 ASN -3.56 0.34 1 127 SER 5.35 -0.50 1 128 HIS -3.41 -0.22 1 130 LYS -2.43 0.76 1 131 ASN -8.00 0.31 1 132 ILE -2.94 0.01 1 133 PHE -0.22 0.12 1 134 GLU 2.63 -0.28 1 137 PHE -6.12 0.43 1 138 MET -2.21 0.95 1 139 ALA -5.50 0.57 1 141 TYR -6.79 1.22 1 142 VAL -4.66 1.02 1 143 ARG -6.68 1.33 1 144 VAL 0.19 0.20 1 147 VAL 1.31 0.14 1 148 SER -2.98 -0.73 1 150 HIS -0.85 0.49 1 151 ASN 7.73 -0.93 1 152 ARG -5.92 -0.06 1 153 ILE 2.27 -1.08 1 154 THR -3.59 0.89 1 157 LEU -5.83 0.99 1 158 GLU -8.25 0.37 1 160 LEU -5.39 0.75 1 163 LEU -0.62 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15558_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.88 _LACS_plot.Line_1_terminator_val_y_1 -5.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.03 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset 3.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 ILE 2.27 -7.30 0 40 TYR 7.46 1.00 0 16 ASN 0.39 -2.50 1 17 THR 4.16 0.20 1 18 ILE -0.06 -0.10 1 20 ASP 4.48 -1.20 1 21 SER 3.13 -1.50 1 22 GLN 1.33 -3.90 1 23 MET -1.13 -5.40 1 24 SER -3.51 -6.10 1 25 ALA -6.57 -4.00 1 26 SER -0.40 -2.20 1 27 SER 0.31 -4.80 1 28 SER -2.14 -4.80 1 29 TYR -1.50 -5.10 1 30 LYS -2.30 -5.40 1 31 THR -1.07 -2.70 1 32 TRP 2.87 -2.20 1 33 ASN 2.28 -3.10 1 34 LEU -0.82 -5.20 1 36 ALA 1.89 -2.80 1 37 PHE -2.10 -4.00 1 39 TRP -3.08 -4.70 1 42 HIS 2.33 -1.30 1 43 LEU 0.79 -0.50 1 46 LEU -1.28 -5.30 1 47 ASP 3.95 -3.10 1 48 ASN 2.85 -1.40 1 49 GLN -3.53 -3.50 1 51 LYS 3.56 -2.50 1 52 ILE 2.40 -3.00 1 53 ASN 0.20 -7.40 1 54 ALA -6.35 -6.50 1 55 TRP -0.71 -2.00 1 56 THR -5.18 -5.00 1 57 ALA -1.37 -6.60 1 58 GLN 4.28 -3.90 1 59 SER -4.70 -3.40 1 60 ASN -0.53 -4.40 1 61 SER -2.78 -4.90 1 62 ALA 0.66 -2.70 1 64 GLU -1.52 -4.20 1 65 TRP -3.25 -6.10 1 66 LEU -3.86 -6.00 1 67 GLN -6.29 -5.00 1 68 VAL -4.07 -4.90 1 69 ASP -2.54 -2.70 1 70 LEU 1.72 -1.30 1 72 THR -2.31 -6.00 1 73 GLN 1.17 -3.10 1 75 GLN 0.25 -4.80 1 76 VAL 1.62 -3.60 1 77 THR -1.59 -1.90 1 79 ILE -4.62 -8.10 1 80 ILE -3.74 -3.80 1 81 THR -5.26 -3.10 1 82 GLN -7.89 -2.50 1 84 ALA -1.03 -6.20 1 85 ARG -4.58 -4.90 1 86 ASP -2.50 -3.00 1 87 PHE 4.74 -2.90 1 89 HIS -0.15 -2.70 1 90 ILE 2.38 -3.80 1 91 GLN -4.06 -5.20 1 92 TYR -1.44 -5.40 1 93 VAL 2.74 -4.30 1 94 ALA -0.66 -1.70 1 95 SER -0.44 -3.60 1 96 TYR -1.94 -6.50 1 97 LYS -4.96 -3.90 1 98 VAL -3.50 -5.60 1 99 ALA -8.30 -4.80 1 100 HIS -5.63 -3.60 1 101 SER -1.48 -3.20 1 102 ASP 0.28 -2.90 1 103 ASP -1.82 -2.30 1 105 VAL -0.00 -3.90 1 106 GLN -1.21 -2.60 1 107 TRP -2.16 -3.50 1 108 THR -1.03 -4.20 1 109 VAL 1.48 -3.30 1 110 TYR 2.60 -3.80 1 111 GLU -5.94 -4.80 1 112 GLU -4.74 -3.40 1 113 GLN 3.71 -2.20 1 115 SER -3.44 -3.90 1 116 SER 1.70 -3.40 1 117 LYS -1.42 -5.00 1 118 VAL 1.67 -3.00 1 119 PHE 1.24 -2.50 1 120 GLN 1.06 -3.70 1 122 ASN -1.28 -6.10 1 123 LEU -2.72 -5.50 1 124 ASP -0.54 -4.70 1 126 ASN -3.56 -0.30 1 127 SER 5.35 -3.00 1 128 HIS -3.41 -0.10 1 130 LYS -2.43 -4.50 1 131 ASN -8.00 -5.50 1 132 ILE -2.94 -2.90 1 133 PHE -0.22 -2.70 1 134 GLU 2.63 -2.50 1 137 PHE -6.12 -5.80 1 138 MET -2.21 -2.50 1 139 ALA -5.50 -5.30 1 141 TYR -6.79 -2.40 1 142 VAL -4.66 -4.60 1 143 ARG -6.68 -3.90 1 144 VAL 0.19 -4.50 1 147 VAL 1.31 -4.30 1 148 SER -2.98 -3.20 1 150 HIS -0.85 -2.70 1 151 ASN 7.73 -2.40 1 152 ARG -5.92 -5.80 1 154 THR -3.59 -4.50 1 155 LEU -8.88 -5.00 1 157 LEU -5.83 -4.80 1 158 GLU -8.25 -5.20 1 160 LEU -5.39 -3.70 1 163 LEU -0.62 -4.00 1 stop_ save_