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 bmr18092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.35 _LACS_plot.Line_1_terminator_val_y_1 -2.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 5.25 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 LEU -5.97 -0.84 0 124 LEU -4.56 0.24 0 93 LEU -6.35 -0.93 0 10 ARG 2.46 2.02 1 11 ASN 2.86 2.42 1 12 VAL 4.46 3.66 1 13 GLU 3.17 2.24 1 14 ILE 4.92 4.31 1 15 TRP 4.14 3.34 1 16 LYS 4.15 4.09 1 17 ILE 4.43 2.67 1 18 LYS 5.35 5.00 1 19 LYS 3.96 3.22 1 20 LEU 3.37 3.06 1 21 ILE 5.88 5.58 1 22 LYS 3.86 2.96 1 23 SER 3.79 3.24 1 24 LEU 2.29 2.17 1 25 GLU 2.46 2.48 1 26 ALA -0.56 -0.05 1 27 ALA -0.26 0.40 1 28 ARG -4.33 -1.56 1 30 ASN -0.53 -0.88 1 32 THR -0.82 -1.86 1 33 SER -1.36 -0.29 1 34 MET -2.39 -0.20 1 35 ILE -2.13 -0.20 1 36 SER -2.12 -0.80 1 37 LEU -4.61 -1.44 1 38 ILE -1.54 -0.14 1 39 ILE -3.10 -0.92 1 42 LYS 3.24 1.03 1 43 ASP -2.67 -1.08 1 44 GLN -3.90 -1.38 1 45 ILE 4.69 2.54 1 46 SER 4.55 2.83 1 47 ARG 3.88 3.45 1 48 VAL 5.08 4.21 1 49 ALA 3.97 3.16 1 50 LYS 3.87 3.09 1 51 MET 5.54 3.95 1 52 LEU 2.98 2.63 1 53 ALA 3.74 2.72 1 54 ASP 4.70 3.42 1 55 GLU 2.93 2.41 1 56 PHE 4.27 4.29 1 58 THR 4.92 4.03 1 59 ALA 2.06 1.80 1 60 SER 3.76 3.37 1 61 ASN -0.50 0.32 1 62 ILE 2.34 2.58 1 63 LYS 3.23 2.87 1 64 SER -0.81 -1.17 1 65 ARG 4.61 4.16 1 66 VAL 4.38 3.56 1 67 ASN 2.94 2.67 1 68 ARG 3.93 4.19 1 69 LEU 4.24 3.24 1 70 SER 4.26 3.73 1 71 VAL 5.45 4.96 1 72 LEU 4.92 3.55 1 74 ALA 4.07 3.37 1 75 ILE 5.69 5.77 1 76 THR 5.93 5.23 1 77 SER 4.78 4.62 1 78 VAL 6.32 4.95 1 79 GLN 3.99 4.22 1 80 GLN 4.09 3.20 1 81 ARG 3.07 1.03 1 82 LEU 3.52 2.67 1 83 LYS 2.40 1.92 1 84 LEU 1.76 0.62 1 85 TYR -1.13 0.19 1 86 ASN 0.55 1.02 1 87 LYS -3.71 -1.61 1 88 VAL 2.30 2.59 1 91 ASN 0.23 -0.75 1 94 VAL -1.19 -1.33 1 95 VAL -4.27 -1.51 1 96 TYR -3.43 -1.23 1 99 THR 0.20 0.71 1 100 ILE -3.90 -1.85 1 101 VAL -1.70 -1.21 1 102 THR -2.69 -0.78 1 103 GLU 3.35 2.74 1 104 GLU -0.17 0.04 1 106 LYS -2.02 -1.27 1 107 GLU -2.72 -0.69 1 108 LYS -4.11 -0.78 1 109 LYS -0.22 0.04 1 110 VAL -2.30 -0.44 1 111 ASN -1.75 0.52 1 112 ILE -3.71 -0.58 1 113 ASP -4.90 -1.61 1 114 PHE -1.40 -0.75 1 115 GLU -4.88 -2.20 1 117 PHE 1.74 1.23 1 118 LYS -2.98 -1.19 1 120 ILE -2.45 -0.90 1 121 ASN -0.32 0.25 1 122 THR -1.70 -0.67 1 123 SER -2.56 -1.58 1 125 TYR -1.00 0.78 1 128 ASP -5.56 -1.28 1 129 ASN 0.30 0.07 1 130 LYS -3.06 -1.67 1 131 PHE -0.79 -0.58 1 132 HIS 0.48 2.00 1 133 THR 0.63 0.25 1 134 GLU 5.79 4.48 1 135 ALA 2.39 2.31 1 136 LEU 2.09 1.66 1 137 THR 6.41 5.22 1 138 ALA 3.46 2.70 1 139 LEU 2.59 2.55 1 140 LEU 2.20 1.73 1 141 SER 2.81 2.45 1 142 ASP 1.67 1.83 1 143 LEU 1.18 1.43 1 144 GLU 0.62 1.15 1 145 HIS -0.11 1.47 1 146 HIS 0.81 2.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.35 _LACS_plot.Line_1_terminator_val_y_1 4.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 -1.15 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 126 LEU -5.97 5.13 0 124 LEU -4.56 4.80 0 93 LEU -6.35 5.42 0 10 ARG 2.46 -0.44 1 11 ASN 2.86 -0.44 1 12 VAL 4.46 -0.80 1 13 GLU 3.17 -0.93 1 14 ILE 4.92 -0.61 1 15 TRP 4.14 -0.80 1 16 LYS 4.15 -0.06 1 17 ILE 4.43 -1.76 1 18 LYS 5.35 -0.35 1 19 LYS 3.96 -0.74 1 20 LEU 3.37 -0.31 1 21 ILE 5.88 -0.30 1 22 LYS 3.86 -0.90 1 23 SER 3.79 -0.55 1 24 LEU 2.29 -0.12 1 25 GLU 2.46 0.02 1 26 ALA -0.56 0.51 1 27 ALA -0.26 0.66 1 28 ARG -4.33 2.77 1 30 ASN -0.53 -0.35 1 32 THR -0.82 -1.04 1 33 SER -1.36 1.07 1 34 MET -2.39 2.19 1 35 ILE -2.13 1.93 1 36 SER -2.12 1.32 1 37 LEU -4.61 3.17 1 38 ILE -1.54 1.40 1 39 ILE -3.10 2.18 1 42 LYS 3.24 -2.21 1 43 ASP -2.67 1.59 1 44 GLN -3.90 2.52 1 45 ILE 4.69 -2.15 1 46 SER 4.55 -1.72 1 47 ARG 3.88 -0.43 1 48 VAL 5.08 -0.87 1 49 ALA 3.97 -0.81 1 50 LYS 3.87 -0.78 1 51 MET 5.54 -1.59 1 52 LEU 2.98 -0.35 1 53 ALA 3.74 -1.02 1 54 ASP 4.70 -1.28 1 55 GLU 2.93 -0.52 1 56 PHE 4.27 0.02 1 58 THR 4.92 -0.89 1 59 ALA 2.06 -0.26 1 60 SER 3.76 -0.39 1 61 ASN -0.50 0.82 1 62 ILE 2.34 0.24 1 63 LYS 3.23 -0.36 1 64 SER -0.81 -0.36 1 65 ARG 4.61 -0.45 1 66 VAL 4.38 -0.82 1 67 ASN 2.94 -0.27 1 68 ARG 3.93 0.26 1 69 LEU 4.24 -1.00 1 70 SER 4.26 -0.53 1 71 VAL 5.45 -0.49 1 72 LEU 4.92 -1.37 1 74 ALA 4.07 -0.70 1 75 ILE 5.69 0.08 1 76 THR 5.93 -0.70 1 77 SER 4.78 -0.16 1 78 VAL 6.32 -1.37 1 79 GLN 3.99 0.23 1 80 GLN 4.09 -0.89 1 81 ARG 3.07 -2.04 1 82 LEU 3.52 -0.85 1 83 LYS 2.40 -0.48 1 84 LEU 1.76 -1.14 1 85 TYR -1.13 1.32 1 86 ASN 0.55 0.47 1 87 LYS -3.71 2.10 1 88 VAL 2.30 0.29 1 91 ASN 0.23 -0.98 1 94 VAL -1.19 -0.14 1 95 VAL -4.27 2.76 1 96 TYR -3.43 2.20 1 99 THR 0.20 0.51 1 100 ILE -3.90 2.05 1 101 VAL -1.70 0.49 1 102 THR -2.69 1.91 1 103 GLU 3.35 -0.61 1 104 GLU -0.17 0.21 1 106 LYS -2.02 0.75 1 107 GLU -2.72 2.03 1 108 LYS -4.11 3.33 1 109 LYS -0.22 0.26 1 110 VAL -2.30 1.86 1 111 ASN -1.75 2.27 1 112 ILE -3.71 3.13 1 113 ASP -4.90 3.29 1 114 PHE -1.40 0.65 1 115 GLU -4.88 2.68 1 117 PHE 1.74 -0.51 1 118 LYS -2.98 1.79 1 120 ILE -2.45 1.55 1 121 ASN -0.32 0.57 1 122 THR -1.70 1.03 1 123 SER -2.56 0.98 1 125 TYR -1.00 1.78 1 128 ASP -5.56 4.28 1 129 ASN 0.30 -0.23 1 130 LYS -3.06 1.39 1 131 PHE -0.79 0.21 1 132 HIS 0.48 1.52 1 133 THR 0.63 -0.38 1 134 GLU 5.79 -1.31 1 135 ALA 2.39 -0.08 1 136 LEU 2.09 -0.43 1 137 THR 6.41 -1.19 1 138 ALA 3.46 -0.76 1 139 LEU 2.59 -0.04 1 140 LEU 2.20 -0.47 1 141 SER 2.81 -0.36 1 142 ASP 1.67 0.16 1 143 LEU 1.18 0.25 1 144 GLU 0.62 0.53 1 145 HIS -0.11 1.58 1 146 HIS 0.81 1.82 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.35 _LACS_plot.Line_1_terminator_val_y_1 0.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.12 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _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 113 ASP -4.90 1.25 0 126 LEU -5.97 -0.14 0 10 ARG 2.46 -0.34 1 11 ASN 2.86 -0.29 1 12 VAL 4.46 -0.34 1 13 GLU 3.17 -0.36 1 14 ILE 4.92 -0.79 1 15 TRP 4.14 -0.46 1 16 LYS 4.15 -0.66 1 17 ILE 4.43 -0.45 1 18 LYS 5.35 -0.58 1 19 LYS 3.96 -0.53 1 20 LEU 3.37 -0.36 1 21 ILE 5.88 -0.92 1 22 LYS 3.86 -0.32 1 23 SER 3.79 -0.28 1 24 LEU 2.29 -0.26 1 25 GLU 2.46 -0.31 1 26 ALA -0.56 -0.04 1 27 ALA -0.26 -0.11 1 28 ARG -4.33 0.38 1 30 ASN -0.53 0.07 1 32 THR -0.82 -0.38 1 33 SER -1.36 -0.05 1 34 MET -2.39 0.37 1 35 ILE -2.13 0.95 1 36 SER -2.12 0.57 1 37 LEU -4.61 0.95 1 38 ILE -1.54 0.44 1 39 ILE -3.10 0.09 1 42 LYS 3.24 -0.24 1 43 ASP -2.67 0.00 1 44 GLN -3.90 0.34 1 45 ILE 4.69 -0.67 1 46 SER 4.55 -0.38 1 47 ARG 3.88 -0.32 1 48 VAL 5.08 -0.72 1 49 ALA 3.97 -0.38 1 50 LYS 3.87 -0.27 1 51 MET 5.54 -0.37 1 52 LEU 2.98 -0.57 1 53 ALA 3.74 -0.24 1 54 ASP 4.70 -0.18 1 55 GLU 2.93 -0.30 1 56 PHE 4.27 -0.79 1 58 THR 4.92 -0.33 1 59 ALA 2.06 -0.23 1 60 SER 3.76 -0.56 1 61 ASN -0.50 -0.06 1 62 ILE 2.34 -0.38 1 63 LYS 3.23 -0.35 1 64 SER -0.81 -0.01 1 65 ARG 4.61 -0.50 1 66 VAL 4.38 -0.40 1 67 ASN 2.94 -0.19 1 68 ARG 3.93 -0.56 1 69 LEU 4.24 -0.39 1 70 SER 4.26 -0.22 1 71 VAL 5.45 -0.43 1 72 LEU 4.92 -0.48 1 74 ALA 4.07 -0.05 1 75 ILE 5.69 -0.70 1 76 THR 5.93 -0.16 1 77 SER 4.78 -0.22 1 78 VAL 6.32 -0.42 1 79 GLN 3.99 -0.41 1 80 GLN 4.09 -0.42 1 81 ARG 3.07 -0.20 1 82 LEU 3.52 -0.33 1 83 LYS 2.40 -0.22 1 84 LEU 1.76 -0.34 1 85 TYR -1.13 -0.15 1 86 ASN 0.55 -0.12 1 87 LYS -3.71 0.27 1 88 VAL 2.30 -0.69 1 91 ASN 0.23 0.03 1 93 LEU -6.35 0.14 1 94 VAL -1.19 0.13 1 95 VAL -4.27 0.66 1 96 TYR -3.43 0.91 1 99 THR 0.20 0.61 1 100 ILE -3.90 0.49 1 101 VAL -1.70 0.68 1 102 THR -2.69 0.15 1 103 GLU 3.35 -0.26 1 104 GLU -0.17 -0.03 1 106 LYS -2.02 0.15 1 107 GLU -2.72 0.78 1 108 LYS -4.11 0.27 1 109 LYS -0.22 0.51 1 110 VAL -2.30 0.14 1 111 ASN -1.75 0.72 1 112 ILE -3.71 0.35 1 114 PHE -1.40 0.22 1 115 GLU -4.88 0.35 1 117 PHE 1.74 -0.27 1 118 LYS -2.98 -0.24 1 120 ILE -2.45 0.01 1 121 ASN -0.32 0.08 1 122 THR -1.70 -0.04 1 123 SER -2.56 0.17 1 124 LEU -4.56 0.24 1 125 TYR -1.00 0.61 1 128 ASP -5.56 0.42 1 129 ASN 0.30 0.07 1 130 LYS -3.06 -0.05 1 131 PHE -0.79 0.07 1 132 HIS 0.48 0.04 1 133 THR 0.63 0.03 1 134 GLU 5.79 -0.30 1 135 ALA 2.39 -0.14 1 136 LEU 2.09 -0.14 1 137 THR 6.41 -0.61 1 138 ALA 3.46 -0.17 1 139 LEU 2.59 -0.20 1 140 LEU 2.20 -0.19 1 141 SER 2.81 -0.18 1 142 ASP 1.67 -0.09 1 143 LEU 1.18 -0.17 1 144 GLU 0.62 -0.26 1 145 HIS -0.11 -0.19 1 146 HIS 0.81 -0.37 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18092_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.35 _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 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.20 _LACS_plot.Line_2_terminator_val_x_2 6.40 _LACS_plot.Line_2_terminator_val_y_2 2.92 _LACS_plot.Y_axis_chem_shift_offset 0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 GLN -3.90 0.89 0 102 THR -2.69 1.99 0 10 ARG 2.46 0.73 1 11 ASN 2.86 1.92 1 12 VAL 4.46 1.35 1 13 GLU 3.17 2.58 1 14 ILE 4.92 1.01 1 15 TRP 4.14 2.40 1 16 LYS 4.15 3.14 1 17 ILE 4.43 0.90 1 18 LYS 5.35 2.83 1 19 LYS 3.96 2.34 1 20 LEU 3.37 1.25 1 21 ILE 5.88 1.02 1 22 LYS 3.86 2.88 1 23 SER 3.79 2.21 1 24 LEU 2.29 2.09 1 25 GLU 2.46 0.58 1 26 ALA -0.56 -0.32 1 27 ALA -0.26 -0.57 1 28 ARG -4.33 -1.39 1 30 ASN -0.53 0.22 1 32 THR -0.82 -0.30 1 33 SER -1.36 -1.10 1 34 MET -2.39 -1.02 1 35 ILE -2.13 -1.19 1 36 SER -2.12 -3.29 1 37 LEU -4.61 -4.65 1 38 ILE -1.54 -1.31 1 42 LYS 3.24 -0.48 1 43 ASP -2.67 -2.11 1 45 ILE 4.69 0.97 1 46 SER 4.55 2.39 1 47 ARG 3.88 2.80 1 48 VAL 5.08 1.05 1 49 ALA 3.97 2.91 1 50 LYS 3.87 0.97 1 51 MET 5.54 2.72 1 52 LEU 2.98 0.88 1 53 ALA 3.74 3.54 1 54 ASP 4.70 3.41 1 55 GLU 2.93 2.40 1 56 PHE 4.27 2.35 1 58 THR 4.92 2.68 1 59 ALA 2.06 0.68 1 60 SER 3.76 -0.82 1 61 ASN -0.50 0.35 1 62 ILE 2.34 0.75 1 63 LYS 3.23 0.87 1 65 ARG 4.61 1.14 1 66 VAL 4.38 2.05 1 67 ASN 2.94 1.28 1 68 ARG 3.93 1.12 1 69 LEU 4.24 3.38 1 70 SER 4.26 2.13 1 71 VAL 5.45 1.48 1 72 LEU 4.92 3.18 1 74 ALA 4.07 1.56 1 75 ILE 5.69 2.03 1 76 THR 5.93 2.32 1 77 SER 4.78 2.40 1 78 VAL 6.32 1.70 1 79 GLN 3.99 3.54 1 80 GLN 4.09 2.61 1 81 ARG 3.07 2.43 1 82 LEU 3.52 1.13 1 83 LYS 2.40 0.75 1 84 LEU 1.76 -0.99 1 86 ASN 0.55 -0.23 1 87 LYS -3.71 -1.51 1 91 ASN 0.23 -0.26 1 93 LEU -6.35 -4.61 1 94 VAL -1.19 -2.56 1 95 VAL -4.27 -2.96 1 96 TYR -3.43 -0.21 1 99 THR 0.20 -1.43 1 100 ILE -3.90 -1.89 1 101 VAL -1.70 1.11 1 103 GLU 3.35 0.63 1 104 GLU -0.17 -0.06 1 106 LYS -2.02 -1.34 1 107 GLU -2.72 0.33 1 108 LYS -4.11 -2.32 1 109 LYS -0.22 -0.15 1 110 VAL -2.30 -1.30 1 111 ASN -1.75 -2.10 1 112 ILE -3.71 -3.11 1 113 ASP -4.90 -1.92 1 114 PHE -1.40 -3.91 1 117 PHE 1.74 -1.96 1 120 ILE -2.45 -1.86 1 121 ASN -0.32 -0.49 1 122 THR -1.70 -3.93 1 123 SER -2.56 -0.94 1 124 LEU -4.56 -2.98 1 125 TYR -1.00 -2.39 1 126 LEU -5.97 -3.91 1 128 ASP -5.56 -2.28 1 129 ASN 0.30 -1.97 1 130 LYS -3.06 -1.39 1 131 PHE -0.79 -0.88 1 132 HIS 0.48 2.26 1 133 THR 0.63 0.92 1 134 GLU 5.79 2.31 1 135 ALA 2.39 2.26 1 136 LEU 2.09 0.81 1 137 THR 6.41 2.47 1 138 ALA 3.46 1.88 1 139 LEU 2.59 0.67 1 140 LEU 2.20 0.65 1 141 SER 2.81 1.10 1 142 ASP 1.67 1.07 1 143 LEU 1.18 0.58 1 144 GLU 0.62 0.09 1 145 HIS -0.11 -0.12 1 stop_ save_