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 bmr17258_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -3.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 6.09 _LACS_plot.Line_2_terminator_val_y_2 4.35 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 LYS -7.81 -1.29 0 10 VAL -0.25 -0.39 1 12 ALA -0.18 -0.16 1 13 ALA -0.23 -0.10 1 14 GLU -0.68 -0.26 1 15 GLU -0.61 -0.40 1 16 ALA -0.19 -0.08 1 18 ALA -0.27 -0.12 1 19 ALA -0.18 0.05 1 20 GLU -0.59 -0.29 1 21 ALA -0.09 -0.09 1 22 GLU -1.17 -0.47 1 23 ALA -0.11 -0.11 1 24 GLU -0.66 -0.15 1 25 GLU -0.74 -0.29 1 26 GLU -0.31 -0.10 1 27 GLU 0.36 0.57 1 29 LEU -0.18 -0.13 1 30 HIS 0.28 -0.02 1 31 LEU 0.45 0.35 1 32 GLU -1.63 -0.28 1 33 ASP 0.07 0.08 1 34 ASP 0.03 0.08 1 35 GLN -0.08 -0.01 1 36 GLU 2.40 0.52 1 38 ARG 1.39 -0.50 1 39 GLU 3.03 0.06 1 40 HIS 0.50 0.49 1 42 ILE 0.35 0.19 1 43 MET 0.05 -0.07 1 46 ILE 0.51 0.21 1 47 TYR -3.45 -1.82 1 48 ASP 0.93 1.24 1 49 ALA -2.10 -1.08 1 51 LEU 0.34 -0.13 1 52 ASN -0.62 -0.46 1 53 ASN 1.32 0.92 1 54 GLU 1.58 1.22 1 55 ASN -0.59 -0.48 1 57 PHE 1.77 1.01 1 58 ASP 1.57 1.50 1 59 LYS 1.85 1.44 1 60 GLU 4.54 3.53 1 61 ASP 2.94 3.57 1 62 LEU 1.48 2.67 1 63 ALA 0.63 2.46 1 64 ARG 5.33 4.33 1 65 PHE 4.99 3.00 1 66 ALA 2.96 2.54 1 67 VAL 5.49 4.40 1 68 ARG 4.55 3.62 1 69 GLU 2.26 1.86 1 70 TYR 6.09 4.44 1 71 ASN 4.07 2.46 1 72 ASN 2.77 2.33 1 73 LYS 2.11 1.75 1 74 ASN -0.66 -0.27 1 75 ASN 3.17 1.14 1 76 ALA -1.20 -2.07 1 77 LEU -2.15 -1.92 1 78 LEU 0.82 1.06 1 79 GLU -4.86 -2.50 1 80 PHE 2.94 2.96 1 81 VAL 2.28 2.25 1 82 ARG -0.02 -0.10 1 83 VAL 1.12 0.48 1 84 VAL 1.41 1.57 1 85 LYS -2.96 -0.27 1 86 ALA -4.00 -0.95 1 87 LYS -4.37 -1.56 1 88 GLU -5.04 -1.76 1 89 GLN -4.88 -0.82 1 90 VAL 3.23 1.66 1 91 VAL -1.05 -1.49 1 92 SER 1.29 -0.53 1 94 MET -4.95 -1.97 1 95 MET -2.28 -2.62 1 96 HIS -3.49 0.20 1 97 TYR -0.88 -1.79 1 98 LEU -4.38 -1.80 1 99 THR 3.24 1.33 1 100 VAL -4.22 -2.16 1 101 GLU -4.08 -1.80 1 102 VAL -6.43 -4.39 1 103 ASN -2.77 -1.14 1 104 ASP -3.10 -2.24 1 105 ALA 2.70 0.57 1 107 LYS -2.66 -1.76 1 108 LYS 0.16 -0.43 1 110 LEU -4.69 -2.02 1 111 TYR -6.66 -2.05 1 112 GLU -4.08 -2.18 1 113 ALA -5.63 -2.87 1 114 LYS -3.74 -1.40 1 115 VAL -4.31 -1.27 1 116 TRP -5.95 -3.26 1 117 GLU -6.37 -2.21 1 118 GLN -0.86 -1.53 1 119 VAL 4.71 3.48 1 120 TRP 4.23 2.13 1 121 MET -2.31 -2.44 1 122 ASN 2.79 1.06 1 123 PHE -3.70 -1.23 1 124 ARG -4.81 -1.98 1 125 GLN -6.00 -1.02 1 126 LEU 0.17 0.52 1 127 GLN -0.05 0.90 1 128 GLU -5.80 -1.41 1 129 PHE -0.86 1.25 1 130 THR -1.37 0.46 1 131 TYR 1.70 0.42 1 132 LEU -1.60 -0.66 1 134 ASP 0.57 0.48 1 135 ALA 0.55 0.55 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17258_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 4.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 6.09 _LACS_plot.Line_2_terminator_val_y_2 -1.74 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 LYS -7.81 6.52 0 10 VAL -0.25 -0.14 1 12 ALA -0.18 0.02 1 13 ALA -0.23 0.13 1 14 GLU -0.68 0.42 1 15 GLU -0.61 0.21 1 16 ALA -0.19 0.11 1 18 ALA -0.27 0.15 1 19 ALA -0.18 0.23 1 20 GLU -0.59 0.30 1 21 ALA -0.09 0.00 1 22 GLU -1.17 0.70 1 23 ALA -0.11 0.00 1 24 GLU -0.66 0.51 1 25 GLU -0.74 0.45 1 26 GLU -0.31 0.21 1 27 GLU 0.36 0.21 1 29 LEU -0.18 0.05 1 30 HIS 0.28 -0.30 1 31 LEU 0.45 -0.10 1 32 GLU -1.63 1.35 1 33 ASP 0.07 0.01 1 34 ASP 0.03 0.05 1 35 GLN -0.08 0.07 1 36 GLU 2.40 -1.88 1 38 ARG 1.39 -1.89 1 39 GLU 3.03 -2.97 1 40 HIS 0.50 -0.01 1 42 ILE 0.35 -0.16 1 43 MET 0.05 -0.12 1 46 ILE 0.51 -0.30 1 47 TYR -3.45 1.63 1 48 ASP 0.93 0.31 1 49 ALA -2.10 1.02 1 51 LEU 0.34 -0.47 1 52 ASN -0.62 0.16 1 53 ASN 1.32 -0.40 1 54 GLU 1.58 -0.36 1 55 ASN -0.59 0.11 1 57 PHE 1.77 -0.76 1 58 ASP 1.57 -0.07 1 59 LYS 1.85 -0.41 1 60 GLU 4.54 -1.01 1 61 ASP 2.94 0.63 1 62 LEU 1.48 1.19 1 63 ALA 0.63 1.83 1 64 ARG 5.33 -1.00 1 65 PHE 4.99 -1.99 1 66 ALA 2.96 -0.42 1 67 VAL 5.49 -1.09 1 68 ARG 4.55 -0.93 1 69 GLU 2.26 -0.40 1 70 TYR 6.09 -1.65 1 71 ASN 4.07 -1.61 1 72 ASN 2.77 -0.44 1 73 LYS 2.11 -0.36 1 74 ASN -0.66 0.39 1 75 ASN 3.17 -2.03 1 76 ALA -1.20 -0.87 1 77 LEU -2.15 0.23 1 78 LEU 0.82 0.24 1 79 GLU -4.86 2.36 1 80 PHE 2.94 0.02 1 81 VAL 2.28 -0.03 1 82 ARG -0.02 -0.08 1 83 VAL 1.12 -0.64 1 84 VAL 1.41 0.16 1 85 LYS -2.96 2.69 1 86 ALA -4.00 3.05 1 87 LYS -4.37 2.81 1 88 GLU -5.04 3.28 1 89 GLN -4.88 4.06 1 90 VAL 3.23 -1.57 1 91 VAL -1.05 -0.44 1 92 SER 1.29 -1.82 1 94 MET -4.95 2.98 1 95 MET -2.28 -0.34 1 96 HIS -3.49 3.69 1 97 TYR -0.88 -0.91 1 98 LEU -4.38 2.58 1 99 THR 3.24 -1.91 1 100 VAL -4.22 2.06 1 101 GLU -4.08 2.28 1 102 VAL -6.43 2.04 1 103 ASN -2.77 1.63 1 104 ASP -3.10 0.86 1 105 ALA 2.70 -2.13 1 107 LYS -2.66 0.90 1 108 LYS 0.16 -0.59 1 110 LEU -4.69 2.67 1 111 TYR -6.66 4.61 1 112 GLU -4.08 1.90 1 113 ALA -5.63 2.76 1 114 LYS -3.74 2.34 1 115 VAL -4.31 3.04 1 116 TRP -5.95 2.69 1 117 GLU -6.37 4.16 1 118 GLN -0.86 -0.67 1 119 VAL 4.71 -1.23 1 120 TRP 4.23 -2.10 1 121 MET -2.31 -0.13 1 122 ASN 2.79 -1.73 1 123 PHE -3.70 2.47 1 124 ARG -4.81 2.83 1 125 GLN -6.00 4.98 1 126 LEU 0.17 0.35 1 127 GLN -0.05 0.95 1 128 GLU -5.80 4.39 1 129 PHE -0.86 2.11 1 130 THR -1.37 1.83 1 131 TYR 1.70 -1.28 1 132 LEU -1.60 0.94 1 134 ASP 0.57 -0.09 1 135 ALA 0.55 0.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17258_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 1.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _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 6.09 _LACS_plot.Line_2_terminator_val_y_2 -0.84 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 131 TYR 1.70 -1.28 0 99 THR 3.24 0.67 0 10 VAL -0.25 -0.03 1 12 ALA -0.18 -0.02 1 13 ALA -0.23 -0.02 1 14 GLU -0.68 -0.06 1 15 GLU -0.61 -0.06 1 16 ALA -0.19 -0.03 1 18 ALA -0.27 -0.02 1 19 ALA -0.18 -0.02 1 20 GLU -0.59 -0.06 1 21 ALA -0.09 -0.01 1 22 GLU -1.17 -0.06 1 23 ALA -0.11 -0.01 1 24 GLU -0.66 -0.06 1 25 GLU -0.74 -0.06 1 26 GLU -0.31 -0.06 1 27 GLU 0.36 -0.07 1 29 LEU -0.18 -0.05 1 30 HIS 0.28 -0.01 1 31 LEU 0.45 0.01 1 32 GLU -1.63 -0.07 1 33 ASP 0.07 -0.05 1 34 ASP 0.03 -0.06 1 35 GLN -0.08 -0.02 1 36 GLU 2.40 -0.24 1 38 ARG 1.39 -0.04 1 39 GLU 3.03 -0.05 1 40 HIS 0.50 -0.43 1 42 ILE 0.35 0.00 1 43 MET 0.05 0.09 1 46 ILE 0.51 0.12 1 47 TYR -3.45 0.36 1 48 ASP 0.93 -0.07 1 49 ALA -2.10 0.20 1 51 LEU 0.34 0.14 1 52 ASN -0.62 0.05 1 53 ASN 1.32 -0.06 1 54 GLU 1.58 -0.06 1 55 ASN -0.59 0.05 1 57 PHE 1.77 -0.08 1 58 ASP 1.57 -0.24 1 59 LYS 1.85 -0.24 1 60 GLU 4.54 -0.64 1 61 ASP 2.94 -0.49 1 62 LEU 1.48 -0.55 1 63 ALA 0.63 -0.47 1 64 ARG 5.33 -0.89 1 65 PHE 4.99 -0.53 1 66 ALA 2.96 -0.84 1 67 VAL 5.49 -1.12 1 68 ARG 4.55 -0.42 1 69 GLU 2.26 -0.47 1 70 TYR 6.09 -1.07 1 71 ASN 4.07 -0.64 1 72 ASN 2.77 -0.26 1 73 LYS 2.11 -0.24 1 74 ASN -0.66 -0.06 1 75 ASN 3.17 -0.35 1 76 ALA -1.20 -0.04 1 77 LEU -2.15 0.22 1 78 LEU 0.82 -0.06 1 79 GLU -4.86 0.40 1 80 PHE 2.94 -0.53 1 81 VAL 2.28 -0.28 1 82 ARG -0.02 -0.02 1 83 VAL 1.12 0.26 1 84 VAL 1.41 -0.15 1 85 LYS -2.96 0.21 1 86 ALA -4.00 1.16 1 87 LYS -4.37 0.72 1 88 GLU -5.04 0.93 1 89 GLN -4.88 0.39 1 90 VAL 3.23 0.36 1 91 VAL -1.05 0.34 1 92 SER 1.29 0.16 1 94 MET -4.95 0.91 1 95 MET -2.28 0.93 1 96 HIS -3.49 0.26 1 97 TYR -0.88 0.64 1 98 LEU -4.38 0.88 1 100 VAL -4.22 0.75 1 101 GLU -4.08 1.00 1 102 VAL -6.43 1.17 1 103 ASN -2.77 0.41 1 104 ASP -3.10 0.21 1 105 ALA 2.70 -0.33 1 107 LYS -2.66 0.32 1 108 LYS 0.16 0.97 1 109 LYS -7.81 0.71 1 110 LEU -4.69 1.15 1 111 TYR -6.66 0.46 1 112 GLU -4.08 0.89 1 113 ALA -5.63 1.03 1 114 LYS -3.74 1.09 1 115 VAL -4.31 0.78 1 116 TRP -5.95 1.17 1 117 GLU -6.37 0.70 1 118 GLN -0.86 -0.11 1 119 VAL 4.71 -0.29 1 120 TRP 4.23 -0.06 1 121 MET -2.31 0.14 1 122 ASN 2.79 -0.52 1 123 PHE -3.70 0.08 1 124 ARG -4.81 0.36 1 125 GLN -6.00 0.31 1 126 LEU 0.17 0.32 1 127 GLN -0.05 0.30 1 128 GLU -5.80 0.28 1 129 PHE -0.86 0.60 1 130 THR -1.37 0.28 1 132 LEU -1.60 -0.15 1 134 ASP 0.57 0.27 1 135 ALA 0.55 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17258_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -2.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 6.09 _LACS_plot.Line_2_terminator_val_y_2 1.56 _LACS_plot.Y_axis_chem_shift_offset 0.41 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 135 ALA 0.55 4.20 0 10 VAL -0.25 -0.36 1 12 ALA -0.18 -0.22 1 13 ALA -0.23 0.06 1 14 GLU -0.68 -0.51 1 15 GLU -0.61 -0.87 1 16 ALA -0.19 -0.65 1 18 ALA -0.27 -0.25 1 19 ALA -0.18 -0.06 1 20 GLU -0.59 -0.26 1 21 ALA -0.09 -0.13 1 22 GLU -1.17 -0.40 1 23 ALA -0.11 -0.30 1 24 GLU -0.66 -0.06 1 25 GLU -0.74 -0.10 1 26 GLU -0.31 -0.08 1 27 GLU 0.36 0.36 1 29 LEU -0.18 -0.56 1 30 HIS 0.28 0.27 1 31 LEU 0.45 -0.36 1 32 GLU -1.63 -0.37 1 33 ASP 0.07 -0.27 1 34 ASP 0.03 -0.27 1 35 GLN -0.08 -0.15 1 36 GLU 2.40 -0.53 1 38 ARG 1.39 0.24 1 39 GLU 3.03 -0.82 1 40 HIS 0.50 0.00 1 42 ILE 0.35 -0.06 1 43 MET 0.05 0.07 1 46 ILE 0.51 -0.45 1 47 TYR -3.45 -1.27 1 48 ASP 0.93 -1.24 1 49 ALA -2.10 -1.87 1 51 LEU 0.34 -0.61 1 52 ASN -0.62 0.06 1 53 ASN 1.32 0.87 1 54 GLU 1.58 0.42 1 55 ASN -0.59 1.73 1 57 PHE 1.77 0.98 1 58 ASP 1.57 1.99 1 59 LYS 1.85 1.18 1 60 GLU 4.54 0.98 1 61 ASP 2.94 3.08 1 62 LEU 1.48 0.44 1 63 ALA 0.63 0.83 1 64 ARG 5.33 3.38 1 65 PHE 4.99 -0.48 1 66 ALA 2.96 -0.27 1 67 VAL 5.49 0.13 1 68 ARG 4.55 2.55 1 69 GLU 2.26 2.24 1 70 TYR 6.09 2.33 1 71 ASN 4.07 3.61 1 72 ASN 2.77 2.39 1 73 LYS 2.11 0.90 1 74 ASN -0.66 -1.70 1 75 ASN 3.17 -1.68 1 76 ALA -1.20 -1.95 1 77 LEU -2.15 0.05 1 78 LEU 0.82 0.37 1 79 GLU -4.86 -0.42 1 80 PHE 2.94 -1.93 1 81 VAL 2.28 -1.99 1 82 ARG -0.02 -2.38 1 83 VAL 1.12 -1.60 1 84 VAL 1.41 -0.57 1 85 LYS -2.96 -3.64 1 86 ALA -4.00 -2.69 1 87 LYS -4.37 -0.65 1 88 GLU -5.04 -2.41 1 89 GLN -4.88 -1.97 1 90 VAL 3.23 -0.09 1 91 VAL -1.05 -1.55 1 92 SER 1.29 1.11 1 94 MET -4.95 -2.51 1 95 MET -2.28 -2.38 1 96 HIS -3.49 0.63 1 97 TYR -0.88 0.31 1 98 LEU -4.38 -2.22 1 99 THR 3.24 -0.94 1 100 VAL -4.22 -3.13 1 101 GLU -4.08 -0.83 1 102 VAL -6.43 -2.78 1 103 ASN -2.77 -0.46 1 104 ASP -3.10 -0.67 1 105 ALA 2.70 -0.89 1 107 LYS -2.66 -1.18 1 108 LYS 0.16 0.48 1 109 LYS -7.81 -2.98 1 110 LEU -4.69 -2.32 1 111 TYR -6.66 -1.81 1 112 GLU -4.08 -1.61 1 113 ALA -5.63 -2.72 1 114 LYS -3.74 -1.35 1 115 VAL -4.31 -3.30 1 116 TRP -5.95 -1.92 1 117 GLU -6.37 -1.57 1 118 GLN -0.86 1.01 1 119 VAL 4.71 1.98 1 120 TRP 4.23 -0.55 1 121 MET -2.31 -1.05 1 122 ASN 2.79 -2.09 1 123 PHE -3.70 -2.15 1 124 ARG -4.81 -2.39 1 125 GLN -6.00 -0.98 1 126 LEU 0.17 -2.50 1 127 GLN -0.05 -0.06 1 128 GLU -5.80 -2.79 1 129 PHE -0.86 -1.58 1 130 THR -1.37 -1.52 1 131 TYR 1.70 -1.66 1 132 LEU -1.60 -0.89 1 134 ASP 0.57 -0.96 1 stop_ save_