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 bmr16411_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 -3.46 _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 -1.41 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 6.32 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 16 GLU -5.70 -2.49 0 66 HIS 3.34 5.95 0 32 GLN 0.92 -2.65 0 119 PHE -6.94 -4.13 0 10 THR 6.52 5.10 1 11 LYS 4.23 2.25 1 12 LEU 5.19 2.79 1 13 ASN 1.78 1.35 1 14 THR -1.28 -0.96 1 15 LEU 0.14 1.01 1 17 ASP 0.23 -1.78 1 18 SER -4.02 -1.96 1 19 GLN 4.09 2.72 1 20 GLU 4.13 3.28 1 21 SER 3.10 2.91 1 22 ILE 4.59 2.91 1 23 SER 4.80 3.40 1 24 SER 4.58 3.25 1 25 ALA 3.24 2.91 1 26 SER 3.69 3.13 1 27 LYS 4.15 3.67 1 28 TRP 5.77 4.12 1 29 LEU 2.69 2.60 1 30 LEU 3.57 2.73 1 31 LEU 2.15 1.44 1 33 TYR 3.37 2.41 1 34 ARG 3.70 2.16 1 35 ASP -3.00 -1.48 1 36 ALA 8.37 6.25 1 38 LYS 3.05 2.24 1 39 VAL 5.57 4.07 1 40 ALA 4.31 2.98 1 41 GLU 2.97 2.83 1 42 MET 4.18 3.69 1 43 TRP 6.19 5.48 1 44 LYS 5.16 3.71 1 45 GLU 3.68 3.01 1 46 TYR 3.71 4.25 1 47 MET 1.09 -0.35 1 48 LEU -0.14 -1.42 1 49 ARG 1.07 1.51 1 51 SER 0.51 -0.43 1 52 VAL 1.10 0.02 1 53 ASN -0.02 0.18 1 54 THR 5.72 4.66 1 55 ARG 5.23 3.50 1 56 ARG 5.07 3.37 1 57 LYS 3.89 3.97 1 58 LEU 4.80 3.26 1 59 LEU 5.20 3.12 1 61 LEU 4.45 3.37 1 62 TYR 3.03 0.22 1 63 LEU 4.26 3.29 1 64 MET 6.49 4.65 1 65 ASN 2.30 3.15 1 67 VAL 5.80 4.13 1 68 VAL 5.73 3.64 1 69 GLN 4.93 4.00 1 70 GLN 3.06 2.31 1 71 ALA 3.36 2.77 1 72 LYS 4.00 3.14 1 74 GLN -0.22 0.06 1 75 LYS 5.60 1.48 1 76 ILE 0.09 -1.30 1 77 ILE 1.85 1.75 1 78 GLN 5.45 4.37 1 79 PHE 5.04 5.09 1 80 GLN 4.63 4.31 1 81 ASP 2.82 2.96 1 82 SER 5.72 4.51 1 83 PHE 6.58 4.74 1 85 LYS 2.20 2.49 1 86 VAL -2.28 -1.91 1 87 ALA 4.67 4.28 1 88 ALA 6.25 4.36 1 89 GLU 2.72 2.36 1 90 VAL 5.11 4.33 1 91 LEU 6.14 3.50 1 93 ARG 3.78 2.19 1 94 ILE 6.56 3.40 1 95 ASN 2.94 3.81 1 96 GLN 2.38 1.88 1 97 GLU -0.95 0.21 1 98 PHE -1.86 -3.07 1 100 ARG 5.20 4.75 1 101 ASP 4.45 2.82 1 102 LEU 4.11 2.04 1 103 LYS 4.86 4.99 1 104 LYS 4.18 3.20 1 105 LYS 3.88 3.24 1 106 LEU 5.01 4.13 1 107 SER 5.64 4.19 1 108 ARG 4.67 3.43 1 109 VAL 5.76 4.34 1 110 VAL 7.16 5.49 1 111 ASN 4.33 3.65 1 112 ILE 4.74 3.66 1 113 LEU 3.70 2.98 1 114 LYS 3.63 3.46 1 115 GLU 2.38 2.43 1 116 ARG 0.69 -0.51 1 117 ASN 3.13 1.06 1 118 ILE 2.49 0.53 1 120 SER -1.73 -0.80 1 121 LYS 4.18 3.07 1 122 GLN 4.41 3.37 1 123 VAL 5.49 4.28 1 124 VAL 7.28 5.63 1 125 ASN 4.04 3.40 1 126 ASP 4.67 3.24 1 127 ILE 5.79 5.26 1 128 GLU 4.70 4.05 1 129 ARG 4.04 3.30 1 130 SER 3.78 3.07 1 131 LEU 2.98 1.84 1 132 ALA 1.31 0.81 1 133 ALA 1.12 0.83 1 134 ALA 0.30 0.20 1 135 LEU 0.28 0.15 1 136 GLU -0.52 -0.06 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16411_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 3.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.65 _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 8.37 _LACS_plot.Line_2_terminator_val_y_2 -2.05 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 16 GLU -5.70 3.21 0 66 HIS 3.34 2.61 0 32 GLN 0.92 -3.57 0 119 PHE -6.94 2.81 0 10 THR 6.52 -1.42 1 11 LYS 4.23 -1.98 1 12 LEU 5.19 -2.40 1 13 ASN 1.78 -0.43 1 14 THR -1.28 0.32 1 15 LEU 0.14 0.87 1 17 ASP 0.23 -2.01 1 18 SER -4.02 2.06 1 19 GLN 4.09 -1.37 1 20 GLU 4.13 -0.85 1 21 SER 3.10 -0.19 1 22 ILE 4.59 -1.68 1 23 SER 4.80 -1.40 1 24 SER 4.58 -1.33 1 25 ALA 3.24 -0.33 1 26 SER 3.69 -0.56 1 27 LYS 4.15 -0.48 1 28 TRP 5.77 -1.65 1 29 LEU 2.69 -0.09 1 30 LEU 3.57 -0.84 1 31 LEU 2.15 -0.71 1 33 TYR 3.37 -0.96 1 34 ARG 3.70 -1.54 1 35 ASP -3.00 1.52 1 36 ALA 8.37 -2.12 1 38 LYS 3.05 -0.81 1 39 VAL 5.57 -1.50 1 40 ALA 4.31 -1.33 1 41 GLU 2.97 -0.14 1 42 MET 4.18 -0.49 1 43 TRP 6.19 -0.71 1 44 LYS 5.16 -1.45 1 45 GLU 3.68 -0.67 1 46 TYR 3.71 0.54 1 47 MET 1.09 -1.44 1 48 LEU -0.14 -1.28 1 49 ARG 1.07 0.44 1 51 SER 0.51 -0.94 1 52 VAL 1.10 -1.08 1 53 ASN -0.02 0.20 1 54 THR 5.72 -1.06 1 55 ARG 5.23 -1.73 1 56 ARG 5.07 -1.70 1 57 LYS 3.89 0.08 1 58 LEU 4.80 -1.54 1 59 LEU 5.20 -2.08 1 61 LEU 4.45 -1.08 1 62 TYR 3.03 -2.81 1 63 LEU 4.26 -0.97 1 64 MET 6.49 -1.84 1 65 ASN 2.30 0.85 1 67 VAL 5.80 -1.67 1 68 VAL 5.73 -2.09 1 69 GLN 4.93 -0.93 1 70 GLN 3.06 -0.75 1 71 ALA 3.36 -0.59 1 72 LYS 4.00 -0.86 1 74 GLN -0.22 0.28 1 75 LYS 5.60 -4.12 1 76 ILE 0.09 -1.39 1 77 ILE 1.85 -0.10 1 78 GLN 5.45 -1.08 1 79 PHE 5.04 0.05 1 80 GLN 4.63 -0.32 1 81 ASP 2.82 0.14 1 82 SER 5.72 -1.21 1 83 PHE 6.58 -1.84 1 85 LYS 2.20 0.29 1 86 VAL -2.28 0.37 1 87 ALA 4.67 -0.39 1 88 ALA 6.25 -1.89 1 89 GLU 2.72 -0.36 1 90 VAL 5.11 -0.78 1 91 LEU 6.14 -2.64 1 93 ARG 3.78 -1.59 1 94 ILE 6.56 -3.16 1 95 ASN 2.94 0.87 1 96 GLN 2.38 -0.50 1 97 GLU -0.95 1.16 1 98 PHE -1.86 -1.21 1 100 ARG 5.20 -0.45 1 101 ASP 4.45 -1.63 1 102 LEU 4.11 -2.07 1 103 LYS 4.86 0.13 1 104 LYS 4.18 -0.98 1 105 LYS 3.88 -0.64 1 106 LEU 5.01 -0.88 1 107 SER 5.64 -1.45 1 108 ARG 4.67 -1.24 1 109 VAL 5.76 -1.42 1 110 VAL 7.16 -1.67 1 111 ASN 4.33 -0.68 1 112 ILE 4.74 -1.08 1 113 LEU 3.70 -0.72 1 114 LYS 3.63 -0.17 1 115 GLU 2.38 0.05 1 116 ARG 0.69 -1.20 1 117 ASN 3.13 -2.07 1 118 ILE 2.49 -1.96 1 120 SER -1.73 0.93 1 121 LYS 4.18 -1.11 1 122 GLN 4.41 -1.04 1 123 VAL 5.49 -1.21 1 124 VAL 7.28 -1.65 1 125 ASN 4.04 -0.64 1 126 ASP 4.67 -1.43 1 127 ILE 5.79 -0.53 1 128 GLU 4.70 -0.65 1 129 ARG 4.04 -0.74 1 130 SER 3.78 -0.71 1 131 LEU 2.98 -1.14 1 132 ALA 1.31 -0.50 1 133 ALA 1.12 -0.29 1 134 ALA 0.30 -0.10 1 135 LEU 0.28 -0.13 1 136 GLU -0.52 0.46 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16411_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 0.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 8.37 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 MET 6.49 -1.62 0 10 THR 6.52 -0.45 1 11 LYS 4.23 -0.61 1 12 LEU 5.19 -0.67 1 13 ASN 1.78 -0.15 1 14 THR -1.28 0.14 1 15 LEU 0.14 -0.30 1 16 GLU -5.70 0.21 1 17 ASP 0.23 0.07 1 18 SER -4.02 0.17 1 19 GLN 4.09 -0.36 1 20 GLU 4.13 -0.37 1 21 SER 3.10 -0.33 1 22 ILE 4.59 -0.49 1 23 SER 4.80 -0.77 1 24 SER 4.58 -0.22 1 25 ALA 3.24 -0.04 1 26 SER 3.69 -0.46 1 27 LYS 4.15 -0.36 1 28 TRP 5.77 -0.38 1 29 LEU 2.69 -0.75 1 30 LEU 3.57 -0.37 1 31 LEU 2.15 0.01 1 32 GLN 0.92 0.16 1 33 TYR 3.37 -0.89 1 34 ARG 3.70 -0.53 1 35 ASP -3.00 0.36 1 36 ALA 8.37 -1.06 1 38 LYS 3.05 -0.24 1 39 VAL 5.57 -0.82 1 40 ALA 4.31 -0.72 1 41 GLU 2.97 -0.30 1 42 MET 4.18 -0.22 1 43 TRP 6.19 -0.43 1 44 LYS 5.16 -0.84 1 45 GLU 3.68 -0.57 1 46 TYR 3.71 -0.79 1 47 MET 1.09 -0.62 1 48 LEU -0.14 -0.09 1 49 ARG 1.07 -0.28 1 51 SER 0.51 -0.22 1 52 VAL 1.10 -0.20 1 53 ASN -0.02 -0.12 1 54 THR 5.72 -0.54 1 55 ARG 5.23 -0.49 1 56 ARG 5.07 -0.32 1 57 LYS 3.89 -0.08 1 58 LEU 4.80 -0.38 1 59 LEU 5.20 -0.34 1 61 LEU 4.45 0.31 1 62 TYR 3.03 0.08 1 63 LEU 4.26 -0.13 1 65 ASN 2.30 -0.59 1 66 HIS 3.34 -0.80 1 67 VAL 5.80 -0.63 1 68 VAL 5.73 -0.32 1 69 GLN 4.93 -0.44 1 70 GLN 3.06 -0.40 1 71 ALA 3.36 -0.46 1 72 LYS 4.00 -0.27 1 74 GLN -0.22 -0.01 1 75 LYS 5.60 -0.36 1 76 ILE 0.09 0.23 1 77 ILE 1.85 0.00 1 78 GLN 5.45 -0.17 1 79 PHE 5.04 -0.19 1 80 GLN 4.63 -0.22 1 81 ASP 2.82 -0.17 1 82 SER 5.72 -0.25 1 83 PHE 6.58 -0.24 1 85 LYS 2.20 -0.20 1 86 VAL -2.28 0.93 1 87 ALA 4.67 -0.34 1 88 ALA 6.25 -0.48 1 89 GLU 2.72 -0.38 1 90 VAL 5.11 -0.63 1 91 LEU 6.14 -0.47 1 93 ARG 3.78 -0.19 1 94 ILE 6.56 -0.36 1 95 ASN 2.94 -0.65 1 96 GLN 2.38 -0.24 1 97 GLU -0.95 -0.10 1 98 PHE -1.86 0.09 1 100 ARG 5.20 -0.49 1 101 ASP 4.45 -0.25 1 102 LEU 4.11 -0.19 1 103 LYS 4.86 -0.16 1 104 LYS 4.18 -0.14 1 105 LYS 3.88 -0.16 1 106 LEU 5.01 -0.31 1 107 SER 5.64 -0.46 1 108 ARG 4.67 -0.17 1 109 VAL 5.76 -0.46 1 110 VAL 7.16 -0.66 1 111 ASN 4.33 -0.29 1 112 ILE 4.74 -0.30 1 113 LEU 3.70 -0.59 1 114 LYS 3.63 -0.27 1 115 GLU 2.38 -0.32 1 116 ARG 0.69 -0.04 1 117 ASN 3.13 -0.27 1 118 ILE 2.49 -0.71 1 119 PHE -6.94 0.65 1 120 SER -1.73 -0.09 1 121 LYS 4.18 -0.35 1 122 GLN 4.41 -0.35 1 123 VAL 5.49 -0.42 1 124 VAL 7.28 -0.66 1 125 ASN 4.04 -0.26 1 126 ASP 4.67 -0.23 1 127 ILE 5.79 -0.71 1 128 GLU 4.70 -0.49 1 129 ARG 4.04 -0.26 1 130 SER 3.78 -0.21 1 131 LEU 2.98 -0.16 1 132 ALA 1.31 -0.12 1 133 ALA 1.12 -0.12 1 134 ALA 0.30 -0.04 1 135 LEU 0.28 -0.06 1 136 GLU -0.52 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16411_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.94 _LACS_plot.Line_1_terminator_val_y_1 -1.90 _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 -0.15 _LACS_plot.Line_2_terminator_val_x_2 7.27 _LACS_plot.Line_2_terminator_val_y_2 2.73 _LACS_plot.Y_axis_chem_shift_offset -0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 119 PHE -6.94 -0.62 0 10 THR 6.52 2.09 1 11 LYS 4.23 2.49 1 12 LEU 5.19 1.36 1 13 ASN 1.78 1.23 1 14 THR -1.28 0.13 1 15 LEU 0.14 -1.52 1 16 GLU -5.70 -1.88 1 17 ASP 0.23 -0.79 1 18 SER -4.02 -0.38 1 19 GLN 4.09 3.09 1 20 GLU 4.13 1.79 1 21 SER 3.10 4.19 1 22 ILE 4.59 1.95 1 23 SER 4.80 2.67 1 24 SER 4.58 3.07 1 25 ALA 3.24 1.20 1 26 SER 3.69 1.31 1 27 LYS 4.15 2.25 1 28 TRP 5.77 2.71 1 29 LEU 2.69 2.08 1 30 LEU 3.57 2.14 1 31 LEU 2.15 1.57 1 32 GLN 0.92 1.22 1 33 TYR 3.37 0.38 1 34 ARG 3.70 0.35 1 35 ASP -3.00 -0.99 1 38 LYS 3.05 2.33 1 39 VAL 5.57 1.20 1 40 ALA 4.31 1.44 1 41 GLU 2.97 2.90 1 42 MET 4.18 3.03 1 43 TRP 6.19 -0.02 1 44 LYS 5.16 -0.35 1 45 GLU 3.68 2.21 1 46 TYR 3.71 0.25 1 47 MET 1.09 1.23 1 48 LEU -0.14 0.21 1 51 SER 0.51 -0.46 1 52 VAL 1.10 -1.06 1 53 ASN -0.02 0.69 1 54 THR 5.72 1.49 1 55 ARG 5.23 2.46 1 56 ARG 5.07 3.83 1 57 LYS 3.89 2.26 1 58 LEU 4.80 0.59 1 59 LEU 5.20 1.89 1 61 LEU 4.45 0.39 1 62 TYR 3.03 4.25 1 63 LEU 4.26 -1.01 1 64 MET 6.49 0.05 1 65 ASN 2.30 0.50 1 66 HIS 3.34 4.28 1 67 VAL 5.80 1.83 1 68 VAL 5.73 2.04 1 69 GLN 4.93 3.44 1 70 GLN 3.06 2.58 1 71 ALA 3.36 1.44 1 72 LYS 4.00 4.11 1 74 GLN -0.22 -1.54 1 75 LYS 5.60 -0.54 1 76 ILE 0.09 1.14 1 78 GLN 5.45 3.74 1 79 PHE 5.04 2.35 1 80 GLN 4.63 2.26 1 81 ASP 2.82 3.05 1 82 SER 5.72 2.76 1 83 PHE 6.58 2.55 1 85 LYS 2.20 1.38 1 86 VAL -2.28 0.33 1 87 ALA 4.67 0.67 1 88 ALA 6.25 2.15 1 89 GLU 2.72 2.65 1 90 VAL 5.11 1.05 1 91 LEU 6.14 0.95 1 93 ARG 3.78 3.68 1 94 ILE 6.56 0.86 1 95 ASN 2.94 1.51 1 96 GLN 2.38 1.43 1 97 GLU -0.95 0.70 1 100 ARG 5.20 1.71 1 101 ASP 4.45 2.43 1 102 LEU 4.11 1.71 1 103 LYS 4.86 3.26 1 104 LYS 4.18 3.09 1 105 LYS 3.88 2.67 1 106 LEU 5.01 0.68 1 107 SER 5.64 1.79 1 108 ARG 4.67 2.42 1 109 VAL 5.76 2.18 1 110 VAL 7.16 0.83 1 111 ASN 4.33 2.77 1 112 ILE 4.74 1.34 1 113 LEU 3.70 2.82 1 114 LYS 3.63 3.33 1 115 GLU 2.38 1.85 1 116 ARG 0.69 -1.08 1 117 ASN 3.13 -0.61 1 118 ILE 2.49 -0.22 1 120 SER -1.73 -0.41 1 121 LYS 4.18 2.30 1 122 GLN 4.41 1.85 1 124 VAL 7.28 2.79 1 125 ASN 4.04 2.67 1 126 ASP 4.67 3.53 1 127 ILE 5.79 1.18 1 128 GLU 4.70 1.18 1 129 ARG 4.04 2.88 1 130 SER 3.78 2.94 1 131 LEU 2.98 0.64 1 132 ALA 1.31 0.71 1 133 ALA 1.12 0.23 1 134 ALA 0.30 0.12 1 135 LEU 0.28 -0.05 1 136 GLU -0.52 -0.36 1 stop_ save_