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 bmr17110_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.32 _LACS_plot.Line_1_terminator_val_y_1 -3.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 6.37 _LACS_plot.Line_2_terminator_val_y_2 4.38 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 139 SER -2.46 3.41 0 103 LYS -8.32 0.25 0 10 ARG -5.80 -1.47 1 11 VAL -2.06 -1.01 1 12 THR -2.67 -1.62 1 13 ASN -1.69 -1.52 1 15 ALA 1.16 1.58 1 16 THR -2.43 -1.14 1 18 HIS 1.51 1.88 1 19 LEU -1.41 -0.93 1 20 PHE -1.40 -0.67 1 21 ASP -3.34 -1.40 1 22 LEU 0.70 -1.03 1 23 THR 6.38 5.44 1 24 SER 3.88 2.61 1 25 LEU 0.45 -0.11 1 26 LYS 2.96 2.05 1 27 ARG -5.07 -1.95 1 28 GLU 3.97 3.28 1 29 SER 0.40 0.11 1 31 TYR -2.92 -0.59 1 32 THR -0.90 0.06 1 33 ILE -4.85 -1.53 1 34 THR -4.18 -2.37 1 35 ASP -3.66 -1.90 1 36 SER 2.93 1.93 1 37 HIS 0.53 0.01 1 38 ASN 3.62 1.69 1 39 ARG 0.92 0.70 1 40 LYS -0.95 -0.35 1 41 ILE 0.08 -0.05 1 42 GLU -4.32 -2.55 1 43 LEU -5.38 -1.49 1 44 ASN -6.86 -2.97 1 45 VAL -0.15 0.30 1 47 ALA -3.91 -1.03 1 48 GLU -0.20 0.13 1 49 ALA -0.37 -1.28 1 50 LYS 1.48 -0.72 1 51 SER -3.29 -0.36 1 52 SER 1.13 0.62 1 54 ALA -0.96 -0.27 1 55 ASN 2.36 1.14 1 57 ALA 0.71 0.71 1 58 ALA 0.57 0.42 1 59 VAL -3.03 -0.59 1 61 ILE -1.18 -0.08 1 62 THR 0.65 0.58 1 63 ASP -3.52 -2.62 1 66 LYS -1.59 -0.35 1 67 THR -2.08 -0.99 1 68 LEU -4.41 -0.99 1 69 ASN 0.76 -0.56 1 70 ALA -0.79 -1.96 1 72 LYS -1.53 0.28 1 73 LEU 1.82 2.35 1 74 SER -3.75 -1.56 1 75 LYS -1.01 -1.25 1 76 THR 0.47 0.57 1 77 LEU -4.79 -1.94 1 78 THR -2.93 -1.18 1 79 TYR -2.13 -0.51 1 80 GLU -3.87 -1.46 1 81 ASP 2.91 1.32 1 82 GLN 4.44 2.45 1 83 VAL -3.05 -1.33 1 84 LEU -2.77 -2.51 1 85 LYS -4.49 -1.57 1 86 LEU -6.79 -1.09 1 87 VAL -3.13 -1.70 1 88 TYR -4.30 -3.98 1 89 GLU -5.46 -1.61 1 90 ASP 3.81 2.12 1 92 ASP 3.73 2.27 1 96 THR 2.54 1.68 1 97 ASP 0.00 0.20 1 98 LEU 2.65 1.81 1 99 LYS 2.22 1.24 1 100 MET -2.84 -0.96 1 101 LYS 0.63 -1.87 1 104 SER -3.61 0.79 1 105 TYR -5.60 -2.00 1 106 PHE -3.59 -0.64 1 107 SER -2.23 -1.48 1 108 PHE -0.95 -1.19 1 109 VAL -4.61 -2.16 1 111 LYS -2.36 0.12 1 112 SER 3.62 2.93 1 113 ASP -0.48 -1.42 1 114 ALA -0.04 0.34 1 116 ASP 1.33 1.13 1 117 ASP -0.17 -0.56 1 118 SER 0.00 0.66 1 119 GLN -3.37 -1.45 1 121 VAL -4.05 -1.44 1 122 PHE 1.13 0.73 1 123 LEU -0.53 0.53 1 124 SER -0.31 -0.20 1 125 PHE -5.68 -2.47 1 126 ASP -3.19 -2.14 1 127 GLU 1.86 1.84 1 128 GLN 3.46 2.66 1 129 THR -2.83 -1.86 1 131 THR -1.92 -1.87 1 132 SER -0.75 1.16 1 133 TYR -1.27 0.44 1 134 PHE -6.15 -1.69 1 135 SER -4.13 -2.00 1 136 TRP -3.90 -1.16 1 137 HIS 0.29 0.73 1 138 THR -1.62 -2.65 1 140 LEU 1.20 1.30 1 141 ALA -0.91 -1.23 1 143 GLU -1.43 -0.54 1 144 GLU -1.01 -0.43 1 145 GLU -0.45 0.01 1 146 VAL 0.08 0.10 1 148 ARG -1.25 -0.07 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17110_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.32 _LACS_plot.Line_1_terminator_val_y_1 5.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 6.37 _LACS_plot.Line_2_terminator_val_y_2 -1.99 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 139 SER -2.46 5.87 0 103 LYS -8.32 8.57 0 10 ARG -5.80 4.33 1 11 VAL -2.06 1.05 1 12 THR -2.67 1.05 1 13 ASN -1.69 0.17 1 15 ALA 1.16 0.42 1 16 THR -2.43 1.29 1 18 HIS 1.51 0.37 1 19 LEU -1.41 0.48 1 20 PHE -1.40 0.73 1 21 ASP -3.34 1.94 1 22 LEU 0.70 -1.73 1 23 THR 6.38 -0.94 1 24 SER 3.88 -1.27 1 25 LEU 0.45 -0.56 1 26 LYS 2.96 -0.91 1 27 ARG -5.07 3.12 1 28 GLU 3.97 -0.69 1 29 SER 0.40 -0.29 1 31 TYR -2.92 2.33 1 32 THR -0.90 0.96 1 33 ILE -4.85 3.32 1 34 THR -4.18 1.81 1 35 ASP -3.66 1.76 1 36 SER 2.93 -1.00 1 37 HIS 0.53 -0.52 1 38 ASN 3.62 -1.93 1 39 ARG 0.92 -0.22 1 40 LYS -0.95 0.60 1 41 ILE 0.08 -0.13 1 42 GLU -4.32 1.77 1 43 LEU -5.38 3.89 1 44 ASN -6.86 3.89 1 45 VAL -0.15 0.45 1 47 ALA -3.91 2.88 1 48 GLU -0.20 0.33 1 49 ALA -0.37 -0.91 1 50 LYS 1.48 -2.20 1 51 SER -3.29 2.93 1 52 SER 1.13 -0.51 1 54 ALA -0.96 0.69 1 55 ASN 2.36 -1.22 1 57 ALA 0.71 0.00 1 58 ALA 0.57 -0.15 1 59 VAL -3.03 2.44 1 61 ILE -1.18 1.10 1 62 THR 0.65 -0.07 1 63 ASP -3.52 0.90 1 66 LYS -1.59 1.24 1 67 THR -2.08 1.09 1 68 LEU -4.41 3.42 1 69 ASN 0.76 -1.32 1 70 ALA -0.79 -1.17 1 72 LYS -1.53 1.81 1 73 LEU 1.82 0.53 1 74 SER -3.75 2.19 1 75 LYS -1.01 -0.24 1 76 THR 0.47 0.10 1 77 LEU -4.79 2.85 1 78 THR -2.93 1.75 1 79 TYR -2.13 1.62 1 80 GLU -3.87 2.41 1 81 ASP 2.91 -1.59 1 82 GLN 4.44 -1.99 1 83 VAL -3.05 1.72 1 84 LEU -2.77 0.26 1 85 LYS -4.49 2.92 1 86 LEU -6.79 5.70 1 87 VAL -3.13 1.43 1 88 TYR -4.30 0.32 1 89 GLU -5.46 3.85 1 90 ASP 3.81 -1.69 1 92 ASP 3.73 -1.46 1 96 THR 2.54 -0.86 1 97 ASP 0.00 0.20 1 98 LEU 2.65 -0.84 1 99 LYS 2.22 -0.98 1 100 MET -2.84 1.88 1 101 LYS 0.63 -2.50 1 104 SER -3.61 4.40 1 105 TYR -5.60 3.60 1 106 PHE -3.59 2.95 1 107 SER -2.23 0.75 1 108 PHE -0.95 -0.24 1 109 VAL -4.61 2.45 1 111 LYS -2.36 2.48 1 112 SER 3.62 -0.69 1 113 ASP -0.48 -0.94 1 114 ALA -0.04 0.38 1 116 ASP 1.33 -0.20 1 117 ASP -0.17 -0.39 1 118 SER 0.00 0.66 1 119 GLN -3.37 1.92 1 121 VAL -4.05 2.61 1 122 PHE 1.13 -0.40 1 123 LEU -0.53 1.06 1 124 SER -0.31 0.11 1 125 PHE -5.68 3.21 1 126 ASP -3.19 1.05 1 127 GLU 1.86 -0.02 1 128 GLN 3.46 -0.80 1 129 THR -2.83 0.97 1 131 THR -1.92 0.05 1 132 SER -0.75 1.91 1 133 TYR -1.27 1.71 1 134 PHE -6.15 4.46 1 135 SER -4.13 2.13 1 136 TRP -3.90 2.74 1 137 HIS 0.29 0.44 1 138 THR -1.62 -1.03 1 140 LEU 1.20 0.10 1 141 ALA -0.91 -0.32 1 143 GLU -1.43 0.89 1 144 GLU -1.01 0.58 1 145 GLU -0.45 0.46 1 146 VAL 0.08 0.02 1 148 ARG -1.25 1.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17110_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.32 _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 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.30 _LACS_plot.Line_2_terminator_val_x_2 6.37 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 103 LYS -8.32 0.02 0 10 ARG -5.80 1.00 1 11 VAL -2.06 0.43 1 12 THR -2.67 1.15 1 13 ASN -1.69 -0.66 1 15 ALA 1.16 -0.02 1 16 THR -2.43 0.15 1 18 HIS 1.51 -0.77 1 19 LEU -1.41 -0.08 1 20 PHE -1.40 0.11 1 21 ASP -3.34 0.40 1 22 LEU 0.70 0.03 1 23 THR 6.38 -0.71 1 24 SER 3.88 -0.24 1 25 LEU 0.45 0.02 1 26 LYS 2.96 -0.02 1 27 ARG -5.07 0.56 1 28 GLU 3.97 -0.34 1 29 SER 0.40 -0.04 1 31 TYR -2.92 0.23 1 32 THR -0.90 1.15 1 33 ILE -4.85 0.73 1 34 THR -4.18 1.13 1 35 ASP -3.66 0.27 1 36 SER 2.93 -0.19 1 37 HIS 0.53 0.06 1 38 ASN 3.62 -0.41 1 39 ARG 0.92 0.02 1 40 LYS -0.95 0.28 1 41 ILE 0.08 0.54 1 42 GLU -4.32 1.10 1 43 LEU -5.38 1.52 1 44 ASN -6.86 0.47 1 45 VAL -0.15 -0.38 1 47 ALA -3.91 -0.10 1 48 GLU -0.20 -0.57 1 49 ALA -0.37 -0.07 1 50 LYS 1.48 0.16 1 51 SER -3.29 0.32 1 52 SER 1.13 -0.01 1 54 ALA -0.96 -0.03 1 55 ASN 2.36 -0.37 1 57 ALA 0.71 -0.27 1 58 ALA 0.57 -0.06 1 59 VAL -3.03 0.48 1 61 ILE -1.18 0.74 1 62 THR 0.65 0.58 1 63 ASP -3.52 0.19 1 66 LYS -1.59 0.21 1 67 THR -2.08 0.47 1 68 LEU -4.41 0.16 1 69 ASN 0.76 0.08 1 70 ALA -0.79 0.21 1 72 LYS -1.53 0.18 1 73 LEU 1.82 -1.05 1 74 SER -3.75 0.11 1 75 LYS -1.01 0.52 1 76 THR 0.47 0.16 1 77 LEU -4.79 0.70 1 78 THR -2.93 0.40 1 79 TYR -2.13 0.36 1 80 GLU -3.87 -0.01 1 81 ASP 2.91 -0.41 1 82 GLN 4.44 -0.78 1 83 VAL -3.05 0.31 1 84 LEU -2.77 0.90 1 85 LYS -4.49 1.31 1 86 LEU -6.79 0.32 1 87 VAL -3.13 0.72 1 88 TYR -4.30 0.83 1 89 GLU -5.46 0.80 1 90 ASP 3.81 -0.41 1 92 ASP 3.73 -0.01 1 96 THR 2.54 -0.38 1 97 ASP 0.00 -0.17 1 98 LEU 2.65 0.03 1 99 LYS 2.22 -0.05 1 100 MET -2.84 0.20 1 101 LYS 0.63 0.36 1 104 SER -3.61 1.43 1 105 TYR -5.60 0.50 1 106 PHE -3.59 0.13 1 107 SER -2.23 0.68 1 108 PHE -0.95 0.88 1 109 VAL -4.61 0.21 1 111 LYS -2.36 0.25 1 112 SER 3.62 -0.28 1 113 ASP -0.48 0.09 1 114 ALA -0.04 0.08 1 116 ASP 1.33 0.04 1 117 ASP -0.17 0.27 1 118 SER 0.00 0.14 1 119 GLN -3.37 -0.28 1 121 VAL -4.05 0.18 1 122 PHE 1.13 -0.60 1 123 LEU -0.53 -0.09 1 124 SER -0.31 -0.26 1 125 PHE -5.68 1.03 1 126 ASP -3.19 0.09 1 127 GLU 1.86 -0.73 1 128 GLN 3.46 -0.33 1 129 THR -2.83 0.10 1 131 THR -1.92 0.60 1 132 SER -0.75 0.75 1 133 TYR -1.27 0.48 1 134 PHE -6.15 0.65 1 135 SER -4.13 0.90 1 136 TRP -3.90 0.24 1 137 HIS 0.29 0.79 1 138 THR -1.62 0.86 1 139 SER -2.46 0.07 1 140 LEU 1.20 -0.08 1 141 ALA -0.91 0.24 1 143 GLU -1.43 -0.68 1 144 GLU -1.01 -0.09 1 145 GLU -0.45 -0.09 1 146 VAL 0.08 -0.03 1 148 ARG -1.25 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17110_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.32 _LACS_plot.Line_1_terminator_val_y_1 -2.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.43 _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 6.37 _LACS_plot.Line_2_terminator_val_y_2 0.42 _LACS_plot.Y_axis_chem_shift_offset 0.73 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 ASP -3.66 2.47 0 23 THR 6.38 2.73 0 10 ARG -5.80 -1.48 1 11 VAL -2.06 -4.51 1 12 THR -2.67 0.27 1 15 ALA 1.16 1.07 1 16 THR -2.43 1.69 1 18 HIS 1.51 -1.51 1 19 LEU -1.41 -2.78 1 20 PHE -1.40 -1.44 1 21 ASP -3.34 0.54 1 22 LEU 0.70 -0.50 1 24 SER 3.88 0.72 1 25 LEU 0.45 1.12 1 26 LYS 2.96 -0.11 1 27 ARG -5.07 1.23 1 28 GLU 3.97 1.08 1 29 SER 0.40 -0.04 1 31 TYR -2.92 -0.66 1 32 THR -0.90 -0.40 1 33 ILE -4.85 -2.31 1 34 THR -4.18 -0.65 1 36 SER 2.93 0.49 1 37 HIS 0.53 -0.44 1 38 ASN 3.62 -0.53 1 39 ARG 0.92 -0.03 1 40 LYS -0.95 -1.93 1 41 ILE 0.08 -2.06 1 42 GLU -4.32 -1.45 1 43 LEU -5.38 -2.97 1 44 ASN -6.86 0.62 1 45 VAL -0.15 1.05 1 47 ALA -3.91 -4.82 1 48 GLU -0.20 0.48 1 49 ALA -0.37 -1.07 1 50 LYS 1.48 -1.40 1 51 SER -3.29 -0.62 1 52 SER 1.13 0.16 1 54 ALA -0.96 -1.09 1 55 ASN 2.36 0.23 1 57 ALA 0.71 -0.40 1 58 ALA 0.57 -2.58 1 59 VAL -3.03 -2.45 1 61 ILE -1.18 -0.95 1 62 THR 0.65 -1.58 1 63 ASP -3.52 -0.22 1 66 LYS -1.59 -1.29 1 67 THR -2.08 -1.11 1 68 LEU -4.41 -3.50 1 69 ASN 0.76 -1.33 1 70 ALA -0.79 0.38 1 72 LYS -1.53 -0.93 1 73 LEU 1.82 -2.77 1 74 SER -3.75 -1.35 1 75 LYS -1.01 -1.16 1 76 THR 0.47 -2.20 1 77 LEU -4.79 -1.44 1 78 THR -2.93 -2.00 1 79 TYR -2.13 -1.28 1 80 GLU -3.87 -1.64 1 81 ASP 2.91 -2.03 1 82 GLN 4.44 -1.87 1 83 VAL -3.05 -2.48 1 84 LEU -2.77 -1.67 1 85 LYS -4.49 -1.72 1 86 LEU -6.79 -3.88 1 87 VAL -3.13 -1.71 1 88 TYR -4.30 -0.16 1 89 GLU -5.46 -0.66 1 90 ASP 3.81 -0.97 1 96 THR 2.54 -0.20 1 97 ASP 0.00 -0.83 1 98 LEU 2.65 0.65 1 99 LYS 2.22 0.97 1 100 MET -2.84 -1.52 1 103 LYS -8.32 -3.36 1 104 SER -3.61 -2.99 1 105 TYR -5.60 -1.41 1 106 PHE -3.59 -1.07 1 107 SER -2.23 -2.00 1 108 PHE -0.95 -1.61 1 109 VAL -4.61 -0.98 1 111 LYS -2.36 -0.74 1 112 SER 3.62 -0.25 1 113 ASP -0.48 -0.31 1 114 ALA -0.04 0.01 1 116 ASP 1.33 -0.16 1 117 ASP -0.17 0.32 1 118 SER 0.00 -0.77 1 121 VAL -4.05 -0.77 1 122 PHE 1.13 -1.59 1 123 LEU -0.53 -1.02 1 124 SER -0.31 -4.23 1 125 PHE -5.68 -1.80 1 126 ASP -3.19 -0.40 1 127 GLU 1.86 0.59 1 128 GLN 3.46 0.68 1 129 THR -2.83 -0.85 1 132 SER -0.75 -2.71 1 133 TYR -1.27 -1.62 1 134 PHE -6.15 0.39 1 135 SER -4.13 -1.48 1 136 TRP -3.90 -0.87 1 137 HIS 0.29 0.03 1 138 THR -1.62 -0.05 1 139 SER -2.46 -1.10 1 140 LEU 1.20 -0.57 1 141 ALA -0.91 -2.97 1 143 GLU -1.43 -1.72 1 144 GLU -1.01 -0.53 1 145 GLU -0.45 -0.36 1 stop_ save_