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 bmr17496_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 -2.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 5.95 _LACS_plot.Line_2_terminator_val_y_2 4.67 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 VAL -7.23 -4.71 0 91 MET -5.85 -0.49 0 70 ASN 1.35 -1.06 0 117 HIS 1.55 4.01 0 11 SER 0.00 0.12 1 12 SER 0.32 0.45 1 14 LEU 0.02 0.10 1 15 VAL 0.08 0.11 1 17 ARG 0.38 0.41 1 19 SER 0.13 0.21 1 20 HIS 0.07 1.45 1 21 MET 0.50 0.24 1 22 SER 0.11 0.21 1 23 ASP 0.32 0.20 1 24 GLN 0.22 0.00 1 25 HIS -0.29 0.77 1 26 ASP -0.42 -0.34 1 27 GLU -0.51 -0.37 1 28 ARG 0.49 1.24 1 29 ARG 0.72 0.62 1 30 ARG 0.58 0.25 1 34 ILE -3.29 -2.38 1 35 ALA 0.50 0.18 1 36 PHE -2.43 0.83 1 37 ASP -2.17 -1.26 1 38 ALA -3.35 -0.60 1 39 ASP 1.21 1.30 1 40 SER -3.98 -0.09 1 41 GLU -6.66 -1.87 1 42 ILE -4.00 -2.44 1 43 LEU -3.18 -0.25 1 44 GLN -1.90 1.32 1 46 GLU 0.20 -0.06 1 47 ARG -1.53 -0.78 1 48 ARG -4.36 -1.42 1 49 TRP -2.37 0.63 1 50 GLU 0.15 0.26 1 51 VAL -7.55 -3.84 1 52 LEU -1.55 -1.55 1 53 LEU -1.18 0.37 1 54 HIS -1.37 1.82 1 55 ASP -1.58 0.25 1 56 VAL -6.36 -2.93 1 57 SER -6.90 -2.54 1 58 LEU 1.23 1.49 1 61 ILE -6.14 -1.00 1 62 LEU -4.23 -0.92 1 65 GLN -0.41 0.19 1 67 GLN 2.66 2.17 1 68 ASP 1.14 -0.53 1 69 TRP -1.06 -0.06 1 72 ASP -2.27 -1.67 1 74 GLN 0.43 0.19 1 75 ARG -3.41 -0.96 1 77 PHE -4.98 -1.65 1 78 GLU -5.31 -1.62 1 79 ALA -5.43 -2.56 1 80 ARG -2.94 -0.87 1 81 LEU -2.19 -1.77 1 82 TYR 0.79 -0.67 1 83 LEU 0.65 -0.13 1 85 LEU 2.58 1.41 1 86 ASP 1.01 0.64 1 87 VAL 0.80 0.38 1 89 ILE -1.88 -1.42 1 90 ARG -4.19 -1.87 1 92 GLU -1.14 -0.21 1 93 ILE -5.93 -2.06 1 94 SER -4.07 -2.08 1 95 LEU 1.82 1.41 1 96 ALA 0.05 0.84 1 97 TRP -1.92 -1.49 1 98 ALA -4.29 -0.97 1 99 ARG -1.09 0.98 1 100 ASP 2.76 1.52 1 102 LEU -3.76 -1.53 1 103 LEU -4.08 -2.27 1 105 PHE -4.96 -1.41 1 106 GLU -4.79 -2.06 1 108 GLN -0.71 0.00 1 109 HIS -1.07 2.38 1 110 ILE -2.93 -0.69 1 111 ASP -1.79 -0.58 1 112 LEU 3.56 3.23 1 113 ASP 4.04 3.33 1 114 SER 5.73 4.90 1 115 ILE 5.70 4.27 1 116 SER 5.35 3.88 1 118 LEU 2.44 2.68 1 119 ARG 5.66 4.28 1 120 ARG 3.98 3.06 1 121 LEU 3.10 2.95 1 122 VAL 5.95 4.98 1 123 GLU 3.32 3.29 1 124 LEU 1.98 2.15 1 125 ASN -0.38 2.19 1 126 LEU 0.77 1.14 1 135 GLU 3.55 3.19 1 136 LEU 3.49 2.66 1 137 ALA 2.74 1.90 1 138 LEU 1.38 1.39 1 139 LEU 1.55 1.17 1 140 VAL 1.46 1.08 1 141 SER 0.31 0.43 1 142 ALA 0.06 0.23 1 143 HIS -0.45 0.72 1 144 ASP -0.17 0.17 1 145 ASP 0.56 1.77 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17496_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 4.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 5.95 _LACS_plot.Line_2_terminator_val_y_2 -1.28 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 VAL -7.23 2.52 0 91 MET -5.85 5.36 0 70 ASN 1.35 -2.41 0 117 HIS 1.55 2.46 0 11 SER 0.00 0.12 1 12 SER 0.32 0.13 1 14 LEU 0.02 0.08 1 15 VAL 0.08 0.03 1 17 ARG 0.38 0.03 1 19 SER 0.13 0.08 1 20 HIS 0.07 1.38 1 21 MET 0.50 -0.26 1 22 SER 0.11 0.10 1 23 ASP 0.32 -0.12 1 24 GLN 0.22 -0.22 1 25 HIS -0.29 1.06 1 26 ASP -0.42 0.08 1 27 GLU -0.51 0.14 1 28 ARG 0.49 0.75 1 29 ARG 0.72 -0.10 1 30 ARG 0.58 -0.33 1 34 ILE -3.29 0.91 1 35 ALA 0.50 -0.32 1 36 PHE -2.43 3.26 1 37 ASP -2.17 0.91 1 38 ALA -3.35 2.75 1 39 ASP 1.21 0.09 1 40 SER -3.98 3.89 1 41 GLU -6.66 4.79 1 42 ILE -4.00 1.56 1 43 LEU -3.18 2.93 1 44 GLN -1.90 3.22 1 46 GLU 0.20 -0.26 1 47 ARG -1.53 0.75 1 48 ARG -4.36 2.94 1 49 TRP -2.37 3.00 1 50 GLU 0.15 0.11 1 51 VAL -7.55 3.71 1 52 LEU -1.55 0.00 1 53 LEU -1.18 1.55 1 54 HIS -1.37 3.19 1 55 ASP -1.58 1.83 1 56 VAL -6.36 3.43 1 57 SER -6.90 4.36 1 58 LEU 1.23 0.26 1 61 ILE -6.14 5.14 1 62 LEU -4.23 3.31 1 65 GLN -0.41 0.60 1 67 GLN 2.66 -0.49 1 68 ASP 1.14 -1.67 1 69 TRP -1.06 1.00 1 72 ASP -2.27 0.60 1 74 GLN 0.43 -0.24 1 75 ARG -3.41 2.45 1 77 PHE -4.98 3.33 1 78 GLU -5.31 3.69 1 79 ALA -5.43 2.87 1 80 ARG -2.94 2.07 1 81 LEU -2.19 0.42 1 82 TYR 0.79 -1.46 1 83 LEU 0.65 -0.78 1 85 LEU 2.58 -1.17 1 86 ASP 1.01 -0.37 1 87 VAL 0.80 -0.42 1 89 ILE -1.88 0.46 1 90 ARG -4.19 2.32 1 92 GLU -1.14 0.93 1 93 ILE -5.93 3.87 1 94 SER -4.07 1.99 1 95 LEU 1.82 -0.41 1 96 ALA 0.05 0.79 1 97 TRP -1.92 0.43 1 98 ALA -4.29 3.32 1 99 ARG -1.09 2.07 1 100 ASP 2.76 -1.24 1 102 LEU -3.76 2.23 1 103 LEU -4.08 1.81 1 105 PHE -4.96 3.55 1 106 GLU -4.79 2.73 1 108 GLN -0.71 0.71 1 109 HIS -1.07 3.45 1 110 ILE -2.93 2.24 1 111 ASP -1.79 1.21 1 112 LEU 3.56 -0.33 1 113 ASP 4.04 -0.71 1 114 SER 5.73 -0.83 1 115 ILE 5.70 -1.43 1 116 SER 5.35 -1.47 1 118 LEU 2.44 0.24 1 119 ARG 5.66 -1.38 1 120 ARG 3.98 -0.92 1 121 LEU 3.10 -0.15 1 122 VAL 5.95 -0.97 1 123 GLU 3.32 -0.03 1 124 LEU 1.98 0.17 1 125 ASN -0.38 2.57 1 126 LEU 0.77 0.37 1 135 GLU 3.55 -0.36 1 136 LEU 3.49 -0.83 1 137 ALA 2.74 -0.84 1 138 LEU 1.38 0.01 1 139 LEU 1.55 -0.38 1 140 VAL 1.46 -0.38 1 141 SER 0.31 0.12 1 142 ALA 0.06 0.17 1 143 HIS -0.45 1.17 1 144 ASP -0.17 0.34 1 145 ASP 0.56 1.21 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17496_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 0.92 _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 5.95 _LACS_plot.Line_2_terminator_val_y_2 -0.56 _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 103 LEU -4.08 -0.52 0 65 GLN -0.41 -1.07 0 11 SER 0.00 0.05 1 12 SER 0.32 0.03 1 14 LEU 0.02 0.03 1 15 VAL 0.08 -0.04 1 17 ARG 0.38 -0.01 1 19 SER 0.13 0.09 1 20 HIS 0.07 -0.11 1 21 MET 0.50 -0.08 1 22 SER 0.11 -0.08 1 23 ASP 0.32 -0.10 1 24 GLN 0.22 -0.18 1 25 HIS -0.29 -0.27 1 26 ASP -0.42 -0.16 1 27 GLU -0.51 -0.12 1 28 ARG 0.49 -0.12 1 29 ARG 0.72 0.48 1 30 ARG 0.58 -0.51 1 34 ILE -3.29 0.33 1 35 ALA 0.50 0.35 1 36 PHE -2.43 -0.20 1 37 ASP -2.17 0.43 1 38 ALA -3.35 0.11 1 39 ASP 1.21 0.28 1 40 SER -3.98 1.10 1 41 GLU -6.66 1.14 1 42 ILE -4.00 1.12 1 43 LEU -3.18 1.23 1 44 GLN -1.90 0.12 1 46 GLU 0.20 -0.07 1 47 ARG -1.53 -0.24 1 48 ARG -4.36 0.72 1 49 TRP -2.37 0.37 1 50 GLU 0.15 0.42 1 51 VAL -7.55 0.88 1 52 LEU -1.55 0.31 1 53 LEU -1.18 0.07 1 54 HIS -1.37 0.35 1 55 ASP -1.58 0.63 1 56 VAL -6.36 1.02 1 57 SER -6.90 0.17 1 58 LEU 1.23 -0.26 1 61 ILE -6.14 0.87 1 62 LEU -4.23 0.66 1 63 VAL -7.23 1.23 1 67 GLN 2.66 -0.17 1 68 ASP 1.14 0.00 1 69 TRP -1.06 -0.34 1 70 ASN 1.35 -0.29 1 72 ASP -2.27 0.04 1 74 GLN 0.43 0.08 1 75 ARG -3.41 0.18 1 77 PHE -4.98 0.67 1 78 GLU -5.31 0.95 1 79 ALA -5.43 1.11 1 80 ARG -2.94 0.62 1 81 LEU -2.19 0.52 1 82 TYR 0.79 0.31 1 83 LEU 0.65 0.09 1 85 LEU 2.58 -0.19 1 86 ASP 1.01 -0.10 1 87 VAL 0.80 -0.31 1 89 ILE -1.88 0.16 1 90 ARG -4.19 1.08 1 91 MET -5.85 0.48 1 92 GLU -1.14 0.78 1 93 ILE -5.93 1.33 1 94 SER -4.07 0.74 1 95 LEU 1.82 -0.76 1 96 ALA 0.05 0.28 1 97 TRP -1.92 -0.17 1 98 ALA -4.29 0.45 1 99 ARG -1.09 0.21 1 100 ASP 2.76 -0.27 1 102 LEU -3.76 0.39 1 105 PHE -4.96 0.20 1 106 GLU -4.79 0.11 1 108 GLN -0.71 0.14 1 109 HIS -1.07 0.02 1 110 ILE -2.93 0.33 1 111 ASP -1.79 0.04 1 112 LEU 3.56 -0.26 1 113 ASP 4.04 -0.23 1 114 SER 5.73 -0.06 1 115 ILE 5.70 -0.42 1 116 SER 5.35 -0.33 1 117 HIS 1.55 -0.18 1 118 LEU 2.44 -0.35 1 119 ARG 5.66 -0.56 1 120 ARG 3.98 -0.18 1 121 LEU 3.10 -0.30 1 122 VAL 5.95 -0.54 1 123 GLU 3.32 -0.43 1 124 LEU 1.98 -0.16 1 125 ASN -0.38 -0.06 1 126 LEU 0.77 -0.15 1 135 GLU 3.55 -0.38 1 136 LEU 3.49 -0.29 1 137 ALA 2.74 -0.12 1 138 LEU 1.38 -0.08 1 139 LEU 1.55 -0.07 1 140 VAL 1.46 0.00 1 141 SER 0.31 0.01 1 142 ALA 0.06 0.04 1 143 HIS -0.45 -0.03 1 144 ASP -0.17 0.09 1 145 ASP 0.56 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17496_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 -3.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.35 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.06 _LACS_plot.Line_2_terminator_val_x_2 5.95 _LACS_plot.Line_2_terminator_val_y_2 1.76 _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 117 HIS 1.55 4.52 0 11 SER 0.00 0.04 1 12 SER 0.32 0.37 1 14 LEU 0.02 -0.42 1 17 ARG 0.38 0.71 1 20 HIS 0.07 1.18 1 21 MET 0.50 -0.12 1 22 SER 0.11 -0.32 1 23 ASP 0.32 -0.30 1 24 GLN 0.22 -0.50 1 25 HIS -0.29 0.25 1 26 ASP -0.42 -0.89 1 27 GLU -0.51 -0.85 1 28 ARG 0.49 0.70 1 29 ARG 0.72 2.55 1 30 ARG 0.58 -2.29 1 34 ILE -3.29 -1.31 1 35 ALA 0.50 -0.86 1 36 PHE -2.43 -3.68 1 37 ASP -2.17 -1.36 1 38 ALA -3.35 -1.44 1 39 ASP 1.21 -0.36 1 40 SER -3.98 -1.81 1 41 GLU -6.66 -2.16 1 42 ILE -4.00 -1.99 1 43 LEU -3.18 -0.57 1 44 GLN -1.90 -0.36 1 46 GLU 0.20 -0.37 1 47 ARG -1.53 -1.57 1 48 ARG -4.36 -1.95 1 49 TRP -2.37 -0.83 1 50 GLU 0.15 0.06 1 51 VAL -7.55 -2.30 1 52 LEU -1.55 -1.88 1 53 LEU -1.18 -1.98 1 54 HIS -1.37 2.74 1 55 ASP -1.58 -3.19 1 56 VAL -6.36 -4.68 1 57 SER -6.90 -2.12 1 58 LEU 1.23 -2.98 1 61 ILE -6.14 -4.71 1 62 LEU -4.23 -0.93 1 63 VAL -7.23 -1.53 1 67 GLN 2.66 0.21 1 68 ASP 1.14 0.07 1 69 TRP -1.06 -0.36 1 74 GLN 0.43 -0.72 1 77 PHE -4.98 -0.64 1 78 GLU -5.31 -1.89 1 79 ALA -5.43 -1.32 1 80 ARG -2.94 -2.59 1 81 LEU -2.19 -2.31 1 82 TYR 0.79 -0.25 1 83 LEU 0.65 -0.94 1 85 LEU 2.58 -0.10 1 86 ASP 1.01 -0.94 1 87 VAL 0.80 -2.95 1 89 ILE -1.88 -2.69 1 90 ARG -4.19 -0.73 1 91 MET -5.85 -1.68 1 92 GLU -1.14 0.25 1 93 ILE -5.93 -2.52 1 94 SER -4.07 -0.69 1 95 LEU 1.82 -2.41 1 96 ALA 0.05 -0.42 1 97 TRP -1.92 -4.39 1 98 ALA -4.29 -1.21 1 99 ARG -1.09 -1.00 1 100 ASP 2.76 -1.27 1 102 LEU -3.76 -2.76 1 103 LEU -4.08 -4.96 1 105 PHE -4.96 -2.43 1 106 GLU -4.79 -0.75 1 108 GLN -0.71 0.47 1 109 HIS -1.07 -2.23 1 110 ILE -2.93 -3.99 1 111 ASP -1.79 -0.59 1 112 LEU 3.56 1.96 1 113 ASP 4.04 2.35 1 114 SER 5.73 1.67 1 115 ILE 5.70 0.57 1 116 SER 5.35 2.61 1 118 LEU 2.44 0.40 1 119 ARG 5.66 1.18 1 120 ARG 3.98 1.82 1 121 LEU 3.10 1.85 1 122 VAL 5.95 -0.02 1 123 GLU 3.32 2.95 1 124 LEU 1.98 0.80 1 126 LEU 0.77 1.00 1 135 GLU 3.55 1.68 1 136 LEU 3.49 2.13 1 137 ALA 2.74 2.01 1 138 LEU 1.38 1.06 1 139 LEU 1.55 0.49 1 140 VAL 1.46 0.45 1 141 SER 0.31 -0.16 1 142 ALA 0.06 -0.51 1 143 HIS -0.45 0.33 1 144 ASP -0.17 -1.21 1 stop_ save_