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 bmr30139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.55 _LACS_plot.Line_1_terminator_val_y_1 -3.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 6.93 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 143 THR 9.56 7.74 0 10 HIS -0.11 1.03 1 12 SER -0.32 0.02 1 13 ALA -1.07 -0.47 1 14 THR 2.04 1.75 1 15 TYR -3.68 -2.18 1 16 THR -2.03 -1.66 1 17 ARG 0.42 1.86 1 19 LEU -7.32 -2.90 1 20 ASP 3.17 2.13 1 21 THR -3.04 -1.99 1 23 ASN -4.48 -1.46 1 24 ILE 2.89 1.86 1 25 THR 1.28 0.68 1 26 THR 0.49 1.49 1 28 PHE 1.76 1.82 1 29 ASN 1.06 1.47 1 31 TYR -0.22 -0.66 1 34 HIS 2.68 1.56 1 35 VAL 0.86 0.58 1 37 VAL -4.88 -3.34 1 38 ASP -5.58 -2.63 1 39 TYR -4.67 -2.30 1 40 ALA 2.32 0.93 1 41 VAL -2.77 -1.58 1 43 VAL 3.24 2.18 1 45 THR 3.57 2.96 1 47 VAL -2.37 -1.69 1 48 ARG -5.63 -2.56 1 49 ALA 0.51 -0.28 1 50 VAL 1.59 0.51 1 51 ALA -3.30 -1.18 1 52 ASN 0.67 0.03 1 54 THR -1.94 -0.78 1 55 VAL 3.23 1.26 1 56 LYS 0.16 -0.58 1 57 PHE -2.39 1.24 1 58 ALA -4.30 -1.71 1 60 ASN 0.14 0.90 1 62 ALA 2.13 1.93 1 63 ASN -0.69 -0.26 1 64 HIS -2.38 1.73 1 66 TRP -1.06 -1.63 1 67 MET -1.87 -0.39 1 68 LEU -1.48 -0.38 1 69 TRP 0.51 1.35 1 71 ALA 0.60 0.80 1 73 ASN 1.45 0.37 1 74 ALA -6.76 -1.86 1 75 VAL -5.18 -1.82 1 76 LEU -6.77 -1.80 1 77 ILE -3.04 -1.13 1 78 GLN -2.73 -1.01 1 79 HIS -0.31 0.81 1 80 ALA 3.60 3.19 1 81 ASP 0.16 -1.18 1 83 MET 0.64 -0.14 1 84 HIS -2.04 0.38 1 85 THR -4.44 -2.50 1 87 TYR -2.73 -1.58 1 88 ALA -4.78 -1.35 1 90 LEU -1.76 0.87 1 91 SER 0.90 0.93 1 92 LYS -4.02 -0.75 1 93 ILE -1.34 0.17 1 94 SER -0.22 0.48 1 95 VAL -5.71 -3.34 1 96 SER -4.32 -2.06 1 97 THR 5.44 4.67 1 98 ASP 5.44 3.14 1 99 SER -0.00 0.85 1 100 THR -0.11 0.21 1 101 VAL -6.86 -4.31 1 102 LYS -4.85 -2.80 1 103 GLN 2.62 2.89 1 105 GLN -0.07 0.31 1 106 ILE 2.42 0.69 1 107 ILE -0.24 -0.56 1 109 TYR -5.22 -1.97 1 110 THR 0.81 1.48 1 112 ALA -3.15 -2.48 1 113 THR -1.52 0.21 1 115 GLN -0.44 -0.24 1 116 VAL -1.54 0.20 1 117 THR 0.84 0.88 1 120 HIS 0.54 1.16 1 121 LEU -1.90 -0.11 1 122 HIS -3.27 1.49 1 123 PHE -5.59 -2.33 1 124 GLU -7.55 -4.00 1 125 MET -6.58 -0.53 1 126 LEU -2.50 0.45 1 128 ALA 3.40 3.05 1 129 ASN -1.82 -1.52 1 131 ASN -1.16 -2.83 1 132 TRP 0.46 0.08 1 133 GLN 1.13 -0.74 1 134 ASN 1.31 0.42 1 136 PHE -0.87 -0.65 1 137 SER 1.88 0.23 1 139 ARG 0.06 1.55 1 140 ILE -5.92 -3.32 1 141 ASP -1.14 -1.18 1 145 TYR 1.32 1.32 1 146 ILE 3.94 3.54 1 147 ALA -1.44 -1.63 1 148 ASN 0.82 0.25 1 149 ALA 0.95 0.40 1 151 VAL 2.86 2.48 1 152 PHE -1.25 -1.01 1 153 ASN 0.07 0.20 1 155 THR 0.98 0.68 1 156 THR 0.84 0.88 1 158 THR 0.24 1.41 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.55 _LACS_plot.Line_1_terminator_val_y_1 4.15 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 -2.63 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 143 THR 9.56 -1.82 0 10 HIS -0.11 1.14 1 12 SER -0.32 0.34 1 13 ALA -1.07 0.60 1 14 THR 2.04 -0.29 1 15 TYR -3.68 1.50 1 16 THR -2.03 0.37 1 17 ARG 0.42 1.44 1 19 LEU -7.32 4.42 1 20 ASP 3.17 -1.04 1 21 THR -3.04 1.05 1 23 ASN -4.48 3.02 1 24 ILE 2.89 -1.03 1 25 THR 1.28 -0.60 1 26 THR 0.49 1.00 1 28 PHE 1.76 0.06 1 29 ASN 1.06 0.41 1 31 TYR -0.22 -0.44 1 34 HIS 2.68 -1.12 1 35 VAL 0.86 -0.28 1 37 VAL -4.88 1.54 1 38 ASP -5.58 2.95 1 39 TYR -4.67 2.37 1 40 ALA 2.32 -1.39 1 41 VAL -2.77 1.19 1 43 VAL 3.24 -1.06 1 45 THR 3.57 -0.61 1 47 VAL -2.37 0.68 1 48 ARG -5.63 3.07 1 49 ALA 0.51 -0.79 1 50 VAL 1.59 -1.08 1 51 ALA -3.30 2.12 1 52 ASN 0.67 -0.64 1 54 THR -1.94 1.16 1 55 VAL 3.23 -1.97 1 56 LYS 0.16 -0.74 1 57 PHE -2.39 3.63 1 58 ALA -4.30 2.59 1 60 ASN 0.14 0.76 1 62 ALA 2.13 -0.20 1 63 ASN -0.69 0.43 1 64 HIS -2.38 4.11 1 66 TRP -1.06 -0.57 1 67 MET -1.87 1.48 1 68 LEU -1.48 1.10 1 69 TRP 0.51 0.84 1 71 ALA 0.60 0.20 1 73 ASN 1.45 -1.08 1 74 ALA -6.76 4.90 1 75 VAL -5.18 3.36 1 76 LEU -6.77 4.97 1 77 ILE -3.04 1.91 1 78 GLN -2.73 1.72 1 79 HIS -0.31 1.12 1 80 ALA 3.60 -0.41 1 81 ASP 0.16 -1.34 1 83 MET 0.64 -0.78 1 84 HIS -2.04 2.42 1 85 THR -4.44 1.94 1 87 TYR -2.73 1.15 1 88 ALA -4.78 3.43 1 90 LEU -1.76 2.63 1 91 SER 0.90 0.03 1 92 LYS -4.02 3.27 1 93 ILE -1.34 1.51 1 94 SER -0.22 0.70 1 95 VAL -5.71 2.37 1 96 SER -4.32 2.26 1 97 THR 5.44 -0.77 1 98 ASP 5.44 -2.30 1 99 SER -0.00 0.85 1 100 THR -0.11 0.32 1 101 VAL -6.86 2.55 1 102 LYS -4.85 2.05 1 103 GLN 2.62 0.27 1 105 GLN -0.07 0.38 1 106 ILE 2.42 -1.73 1 107 ILE -0.24 -0.32 1 109 TYR -5.22 3.25 1 110 THR 0.81 0.67 1 112 ALA -3.15 0.67 1 113 THR -1.52 1.73 1 115 GLN -0.44 0.20 1 116 VAL -1.54 1.74 1 117 THR 0.84 0.04 1 120 HIS 0.54 0.62 1 121 LEU -1.90 1.79 1 122 HIS -3.27 4.76 1 123 PHE -5.59 3.26 1 124 GLU -7.55 3.55 1 125 MET -6.58 6.05 1 126 LEU -2.50 2.95 1 128 ALA 3.40 -0.35 1 129 ASN -1.82 0.30 1 131 ASN -1.16 -1.67 1 132 TRP 0.46 -0.38 1 133 GLN 1.13 -1.87 1 134 ASN 1.31 -0.89 1 136 PHE -0.87 0.22 1 137 SER 1.88 -1.65 1 139 ARG 0.06 1.49 1 140 ILE -5.92 2.60 1 141 ASP -1.14 -0.04 1 145 TYR 1.32 0.00 1 146 ILE 3.94 -0.40 1 147 ALA -1.44 -0.19 1 148 ASN 0.82 -0.57 1 149 ALA 0.95 -0.55 1 151 VAL 2.86 -0.38 1 152 PHE -1.25 0.24 1 153 ASN 0.07 0.13 1 155 THR 0.98 -0.30 1 156 THR 0.84 0.04 1 158 THR 0.24 1.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.55 _LACS_plot.Line_1_terminator_val_y_1 0.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 -0.96 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 ASP -5.58 2.03 0 10 HIS -0.11 -0.12 1 12 SER -0.32 -0.03 1 13 ALA -1.07 0.09 1 14 THR 2.04 -0.35 1 15 TYR -3.68 0.65 1 16 THR -2.03 -0.10 1 17 ARG 0.42 -0.17 1 19 LEU -7.32 0.38 1 20 ASP 3.17 -0.15 1 21 THR -3.04 0.16 1 23 ASN -4.48 0.32 1 24 ILE 2.89 -0.57 1 25 THR 1.28 0.06 1 26 THR 0.49 0.09 1 28 PHE 1.76 -0.10 1 29 ASN 1.06 -0.24 1 31 TYR -0.22 0.05 1 34 HIS 2.68 -0.24 1 35 VAL 0.86 -0.06 1 37 VAL -4.88 0.78 1 39 TYR -4.67 0.69 1 40 ALA 2.32 0.37 1 41 VAL -2.77 0.42 1 43 VAL 3.24 -0.35 1 45 THR 3.57 -0.04 1 47 VAL -2.37 0.29 1 48 ARG -5.63 0.47 1 49 ALA 0.51 -0.39 1 50 VAL 1.59 0.05 1 51 ALA -3.30 -0.06 1 52 ASN 0.67 -0.04 1 54 THR -1.94 0.51 1 55 VAL 3.23 -0.16 1 56 LYS 0.16 0.13 1 57 PHE -2.39 -0.10 1 58 ALA -4.30 0.47 1 60 ASN 0.14 0.05 1 62 ALA 2.13 -0.34 1 63 ASN -0.69 0.02 1 64 HIS -2.38 -0.57 1 66 TRP -1.06 0.16 1 67 MET -1.87 0.28 1 68 LEU -1.48 0.40 1 69 TRP 0.51 0.04 1 71 ALA 0.60 -0.52 1 73 ASN 1.45 0.34 1 74 ALA -6.76 1.43 1 75 VAL -5.18 0.69 1 76 LEU -6.77 1.35 1 77 ILE -3.04 0.53 1 78 GLN -2.73 0.40 1 79 HIS -0.31 0.26 1 80 ALA 3.60 -0.19 1 81 ASP 0.16 -0.13 1 83 MET 0.64 -0.24 1 84 HIS -2.04 1.42 1 85 THR -4.44 0.70 1 87 TYR -2.73 0.73 1 88 ALA -4.78 1.16 1 90 LEU -1.76 0.06 1 91 SER 0.90 0.09 1 92 LYS -4.02 0.26 1 93 ILE -1.34 0.26 1 94 SER -0.22 0.28 1 95 VAL -5.71 0.65 1 96 SER -4.32 0.35 1 97 THR 5.44 -1.01 1 98 ASP 5.44 -0.31 1 99 SER -0.00 0.13 1 100 THR -0.11 0.52 1 101 VAL -6.86 0.83 1 102 LYS -4.85 0.45 1 103 GLN 2.62 -1.43 1 105 GLN -0.07 -0.52 1 106 ILE 2.42 0.15 1 107 ILE -0.24 0.17 1 109 TYR -5.22 0.74 1 110 THR 0.81 0.22 1 112 ALA -3.15 0.50 1 113 THR -1.52 0.05 1 115 GLN -0.44 -0.16 1 116 VAL -1.54 0.57 1 117 THR 0.84 -0.08 1 120 HIS 0.54 -0.16 1 121 LEU -1.90 0.86 1 122 HIS -3.27 1.34 1 123 PHE -5.59 0.92 1 124 GLU -7.55 0.55 1 125 MET -6.58 0.66 1 126 LEU -2.50 0.37 1 128 ALA 3.40 -0.09 1 129 ASN -1.82 0.09 1 131 ASN -1.16 -0.21 1 132 TRP 0.46 -0.54 1 133 GLN 1.13 0.35 1 134 ASN 1.31 -0.31 1 136 PHE -0.87 0.11 1 137 SER 1.88 -0.21 1 139 ARG 0.06 0.55 1 140 ILE -5.92 0.26 1 141 ASP -1.14 -0.54 1 143 THR 9.56 -1.01 1 145 TYR 1.32 -0.18 1 146 ILE 3.94 -0.23 1 147 ALA -1.44 0.26 1 148 ASN 0.82 -0.12 1 149 ALA 0.95 -0.14 1 151 VAL 2.86 -0.50 1 152 PHE -1.25 -0.23 1 153 ASN 0.07 0.00 1 155 THR 0.98 -0.09 1 156 THR 0.84 -0.03 1 158 THR 0.24 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30139_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.55 _LACS_plot.Line_1_terminator_val_y_1 -1.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.74 _LACS_plot.Line_2_terminator_val_x_2 9.56 _LACS_plot.Line_2_terminator_val_y_2 1.73 _LACS_plot.Y_axis_chem_shift_offset 0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 49 ALA 0.51 5.02 0 143 THR 9.56 1.62 0 10 HIS -0.11 1.24 1 12 SER -0.32 -0.67 1 13 ALA -1.07 -0.30 1 14 THR 2.04 -0.65 1 15 TYR -3.68 0.28 1 16 THR -2.03 -0.47 1 19 LEU -7.32 -0.35 1 20 ASP 3.17 -0.59 1 21 THR -3.04 -1.63 1 23 ASN -4.48 -1.09 1 24 ILE 2.89 0.98 1 25 THR 1.28 1.62 1 26 THR 0.49 -0.31 1 28 PHE 1.76 2.53 1 29 ASN 1.06 1.45 1 31 TYR -0.22 -1.88 1 34 HIS 2.68 3.54 1 35 VAL 0.86 -0.96 1 37 VAL -4.88 -2.82 1 38 ASP -5.58 -1.13 1 39 TYR -4.67 0.20 1 40 ALA 2.32 -2.42 1 41 VAL -2.77 -2.38 1 43 VAL 3.24 0.92 1 45 THR 3.57 -0.06 1 47 VAL -2.37 -1.92 1 48 ARG -5.63 -0.59 1 50 VAL 1.59 -1.85 1 51 ALA -3.30 -3.00 1 52 ASN 0.67 2.91 1 54 THR -1.94 -1.02 1 55 VAL 3.23 -1.07 1 56 LYS 0.16 0.22 1 57 PHE -2.39 -4.16 1 58 ALA -4.30 -3.12 1 60 ASN 0.14 2.17 1 62 ALA 2.13 0.80 1 63 ASN -0.69 -1.76 1 64 HIS -2.38 2.07 1 66 TRP -1.06 0.54 1 67 MET -1.87 -2.19 1 68 LEU -1.48 -3.36 1 69 TRP 0.51 0.30 1 71 ALA 0.60 -1.29 1 73 ASN 1.45 -1.02 1 74 ALA -6.76 -2.90 1 75 VAL -5.18 -2.45 1 76 LEU -6.77 -1.94 1 77 ILE -3.04 -2.44 1 78 GLN -2.73 -0.61 1 79 HIS -0.31 2.51 1 80 ALA 3.60 0.24 1 81 ASP 0.16 0.49 1 83 MET 0.64 -1.39 1 84 HIS -2.04 3.14 1 85 THR -4.44 -1.86 1 87 TYR -2.73 -0.84 1 88 ALA -4.78 -0.08 1 90 LEU -1.76 1.80 1 91 SER 0.90 0.17 1 92 LYS -4.02 -2.89 1 93 ILE -1.34 -0.24 1 94 SER -0.22 -1.30 1 95 VAL -5.71 -2.62 1 96 SER -4.32 -0.03 1 97 THR 5.44 -0.68 1 98 ASP 5.44 -0.76 1 99 SER -0.00 -1.28 1 100 THR -0.11 -0.22 1 101 VAL -6.86 -0.94 1 102 LYS -4.85 -0.82 1 103 GLN 2.62 -0.89 1 105 GLN -0.07 -0.44 1 106 ILE 2.42 0.73 1 107 ILE -0.24 -0.94 1 109 TYR -5.22 0.49 1 110 THR 0.81 2.81 1 112 ALA -3.15 -1.27 1 113 THR -1.52 0.40 1 115 GLN -0.44 -0.09 1 116 VAL -1.54 0.10 1 117 THR 0.84 -0.93 1 120 HIS 0.54 0.19 1 121 LEU -1.90 0.29 1 122 HIS -3.27 -2.11 1 123 PHE -5.59 -3.82 1 124 GLU -7.55 -3.54 1 125 MET -6.58 -1.58 1 126 LEU -2.50 -2.30 1 128 ALA 3.40 0.64 1 129 ASN -1.82 -2.14 1 131 ASN -1.16 0.21 1 132 TRP 0.46 0.87 1 133 GLN 1.13 -0.37 1 134 ASN 1.31 0.04 1 136 PHE -0.87 -0.30 1 137 SER 1.88 -0.43 1 139 ARG 0.06 0.71 1 140 ILE -5.92 -1.84 1 141 ASP -1.14 2.28 1 145 TYR 1.32 0.98 1 146 ILE 3.94 0.81 1 147 ALA -1.44 -0.40 1 148 ASN 0.82 -1.04 1 149 ALA 0.95 0.57 1 151 VAL 2.86 -0.92 1 152 PHE -1.25 -0.41 1 153 ASN 0.98 -0.54 1 156 THR 0.84 -0.93 1 158 THR 0.24 4.25 1 stop_ save_