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 bmr5165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.66 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 5.19 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 ALA -0.15 -2.28 0 77 PHE 4.70 0.46 0 10 THR 2.88 2.11 1 11 ALA 0.52 0.98 1 12 ASP -1.00 0.52 1 13 ALA -3.43 -1.00 1 15 PHE -3.67 -2.01 1 16 TRP -4.83 -1.88 1 17 ALA -5.23 -2.44 1 18 TYR -5.98 -1.72 1 20 HIS 2.64 2.91 1 21 ASP -3.75 -2.08 1 22 LEU 2.88 2.72 1 23 GLU 6.26 4.51 1 24 GLU 2.15 3.05 1 25 VAL 6.02 4.62 1 26 PHE 4.84 4.42 1 27 GLU 4.60 3.97 1 28 ASN 3.21 2.68 1 29 ALA 2.22 1.76 1 30 ALA 5.63 2.44 1 31 LEU 3.75 3.36 1 32 ALA 5.37 2.13 1 33 MET 4.22 4.59 1 34 PHE 6.59 6.32 1 35 GLU 0.82 1.72 1 36 VAL 5.46 3.73 1 37 MET -1.68 1.76 1 38 THR -2.36 -1.20 1 39 ASP -1.28 -1.64 1 40 THR 4.88 4.46 1 41 SER 4.11 3.20 1 42 LEU -1.33 -1.28 1 43 VAL -0.14 -0.83 1 44 GLU -0.86 -0.42 1 46 ALA -0.92 1.54 1 47 GLU -4.50 -1.81 1 48 GLU -5.74 -1.80 1 49 ARG -4.31 -2.38 1 50 ARG -2.84 -1.15 1 51 VAL -4.41 -1.25 1 52 GLU -3.51 -1.09 1 53 ILE -6.39 -0.75 1 54 THR -2.05 -0.82 1 55 SER -2.14 -0.35 1 56 GLU 1.48 2.42 1 57 ASP -4.33 -1.26 1 58 ARG 4.25 3.96 1 59 VAL 6.17 4.73 1 60 SER 5.41 4.49 1 61 LEU 2.06 2.92 1 62 LEU 6.16 3.26 1 63 TYR 5.45 5.18 1 64 ASP 4.15 3.75 1 65 TRP 0.69 2.25 1 66 LEU 3.98 2.60 1 67 ASP 1.89 3.49 1 68 GLU 4.19 2.93 1 69 LEU 2.88 3.13 1 70 LEU 3.58 3.03 1 71 PHE 4.80 4.18 1 72 ILE 5.17 5.19 1 73 HIS 6.12 5.11 1 74 ASP 2.24 2.22 1 75 THR 0.51 1.39 1 76 GLU -1.29 -0.58 1 78 ILE -5.29 -1.94 1 79 LEU -6.21 -2.47 1 80 PHE -5.92 -1.35 1 81 SER -5.61 -1.96 1 82 LYS -4.11 -0.80 1 83 PHE -5.52 -0.81 1 84 LYS -3.07 -1.21 1 85 VAL -3.39 -1.32 1 86 LYS -3.81 -1.85 1 87 ILE -3.04 -0.82 1 88 ASP -4.95 -1.55 1 89 GLU -0.29 0.22 1 90 LYS -4.02 -1.69 1 91 ASP 3.58 2.75 1 92 ASP 0.19 -0.93 1 94 LEU -3.16 -0.47 1 95 HIS -2.79 -0.71 1 96 LEU -4.24 -0.93 1 97 THR -0.48 0.05 1 99 THR -1.84 -0.45 1 100 ALA -4.92 -2.60 1 101 MET -5.97 -2.02 1 103 GLU -4.56 -1.82 1 104 GLU -0.21 0.46 1 105 ILE 1.73 2.05 1 106 LYS -5.35 -2.17 1 107 GLU 3.23 2.63 1 109 HIS -1.30 1.78 1 110 GLU -1.88 -0.14 1 111 ARG 0.36 -0.36 1 112 ARG 1.34 -0.08 1 113 ASP -3.69 -0.01 1 114 GLU -2.04 -1.23 1 115 VAL 1.03 0.51 1 116 LYS 1.76 1.29 1 117 ALA -3.19 -0.54 1 118 VAL 0.16 -0.29 1 119 THR 1.45 0.12 1 120 PHE 3.18 2.92 1 121 HIS 3.13 3.63 1 122 MET -0.22 -0.51 1 123 MET -0.56 1.15 1 124 GLU -5.74 -1.08 1 125 ILE -1.06 0.73 1 126 LEU -4.44 -1.28 1 127 ASP -1.90 -0.66 1 128 GLU -3.53 -0.80 1 129 ASP 2.47 1.47 1 131 LEU -3.95 -1.34 1 132 ILE -1.02 -0.48 1 133 LYS -6.11 -2.34 1 134 ALA -6.66 -2.72 1 135 ARG -2.03 -0.88 1 136 VAL -2.03 -1.01 1 137 ILE -2.37 -2.12 1 138 LEU -4.83 -2.65 1 139 ASP -2.01 -0.55 1 140 LEU -0.59 0.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.66 _LACS_plot.Line_1_terminator_val_y_1 4.26 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.10 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 -1.39 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 ALA -0.15 -2.13 0 77 PHE 4.70 -4.24 0 10 THR 2.88 -0.77 1 11 ALA 0.52 0.46 1 12 ASP -1.00 1.52 1 13 ALA -3.43 2.43 1 15 PHE -3.67 1.66 1 16 TRP -4.83 2.95 1 17 ALA -5.23 2.79 1 18 TYR -5.98 4.26 1 20 HIS 2.64 0.27 1 21 ASP -3.75 1.67 1 22 LEU 2.88 -0.16 1 23 GLU 6.26 -1.75 1 24 GLU 2.15 0.90 1 25 VAL 6.02 -1.40 1 26 PHE 4.84 -0.42 1 27 GLU 4.60 -0.63 1 28 ASN 3.21 -0.53 1 29 ALA 2.22 -0.46 1 30 ALA 5.63 -3.19 1 31 LEU 3.75 -0.39 1 32 ALA 5.37 -3.24 1 33 MET 4.22 0.37 1 34 PHE 6.59 -0.27 1 35 GLU 0.82 0.90 1 36 VAL 5.46 -1.73 1 37 MET -1.68 3.44 1 38 THR -2.36 1.16 1 39 ASP -1.28 -0.36 1 40 THR 4.88 -0.42 1 41 SER 4.11 -0.91 1 42 LEU -1.33 0.05 1 43 VAL -0.14 -0.69 1 44 GLU -0.86 0.44 1 46 ALA -0.92 2.46 1 47 GLU -4.50 2.69 1 48 GLU -5.74 3.94 1 49 ARG -4.31 1.93 1 50 ARG -2.84 1.69 1 51 VAL -4.41 3.16 1 52 GLU -3.51 2.42 1 53 ILE -6.39 5.64 1 54 THR -2.05 1.23 1 55 SER -2.14 1.79 1 56 GLU 1.48 0.94 1 57 ASP -4.33 3.07 1 58 ARG 4.25 -0.29 1 59 VAL 6.17 -1.44 1 60 SER 5.41 -0.92 1 61 LEU 2.06 0.86 1 62 LEU 6.16 -2.90 1 63 TYR 5.45 -0.27 1 64 ASP 4.15 -0.40 1 65 TRP 0.69 1.56 1 66 LEU 3.98 -1.38 1 67 ASP 1.89 1.60 1 68 GLU 4.19 -1.26 1 69 LEU 2.88 0.25 1 70 LEU 3.58 -0.55 1 71 PHE 4.80 -0.62 1 72 ILE 5.17 0.02 1 73 HIS 6.12 -1.01 1 74 ASP 2.24 -0.02 1 75 THR 0.51 0.88 1 76 GLU -1.29 0.71 1 78 ILE -5.29 3.35 1 79 LEU -6.21 3.74 1 80 PHE -5.92 4.57 1 81 SER -5.61 3.65 1 82 LYS -4.11 3.31 1 83 PHE -5.52 4.71 1 84 LYS -3.07 1.86 1 85 VAL -3.39 2.07 1 86 LYS -3.81 1.96 1 87 ILE -3.04 2.22 1 88 ASP -4.95 3.40 1 89 GLU -0.29 0.51 1 90 LYS -4.02 2.33 1 91 ASP 3.58 -0.83 1 92 ASP 0.19 -1.12 1 94 LEU -3.16 2.69 1 95 HIS -2.79 2.08 1 96 LEU -4.24 3.31 1 97 THR -0.48 0.53 1 99 THR -1.84 1.39 1 100 ALA -4.92 2.32 1 101 MET -5.97 3.95 1 103 GLU -4.56 2.74 1 104 GLU -0.21 0.67 1 105 ILE 1.73 0.32 1 106 LYS -5.35 3.18 1 107 GLU 3.23 -0.60 1 109 HIS -1.30 3.08 1 110 GLU -1.88 1.74 1 111 ARG 0.36 -0.72 1 112 ARG 1.34 -1.42 1 113 ASP -3.69 3.68 1 114 GLU -2.04 0.81 1 115 VAL 1.03 -0.52 1 116 LYS 1.76 -0.47 1 117 ALA -3.19 2.65 1 118 VAL 0.16 -0.45 1 119 THR 1.45 -1.33 1 120 PHE 3.18 -0.26 1 121 HIS 3.13 0.50 1 122 MET -0.22 -0.29 1 123 MET -0.56 1.71 1 124 GLU -5.74 4.66 1 125 ILE -1.06 1.79 1 126 LEU -4.44 3.16 1 127 ASP -1.90 1.24 1 128 GLU -3.53 2.73 1 129 ASP 2.47 -1.00 1 131 LEU -3.95 2.61 1 132 ILE -1.02 0.54 1 133 LYS -6.11 3.77 1 134 ALA -6.66 3.94 1 135 ARG -2.03 1.15 1 136 VAL -2.03 1.02 1 137 ILE -2.37 0.25 1 138 LEU -4.83 2.18 1 139 ASP -2.01 1.46 1 140 LEU -0.59 1.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.66 _LACS_plot.Line_1_terminator_val_y_1 0.82 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _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 32 ALA 5.37 -1.88 0 10 THR 2.88 -0.24 1 11 ALA 0.52 0.02 1 12 ASP -1.00 0.19 1 13 ALA -3.43 0.46 1 15 PHE -3.67 0.41 1 16 TRP -4.83 1.20 1 17 ALA -5.23 0.92 1 18 TYR -5.98 1.29 1 20 HIS 2.64 0.05 1 21 ASP -3.75 -0.06 1 22 LEU 2.88 -0.39 1 23 GLU 6.26 -1.04 1 24 GLU 2.15 -0.13 1 25 VAL 6.02 -0.52 1 26 PHE 4.84 -0.63 1 27 GLU 4.60 -0.41 1 28 ASN 3.21 0.11 1 29 ALA 2.22 -0.33 1 30 ALA 5.63 -0.95 1 31 LEU 3.75 -0.22 1 33 MET 4.22 -0.85 1 34 PHE 6.59 -0.60 1 35 GLU 0.82 0.78 1 36 VAL 5.46 -0.61 1 37 MET -1.68 0.53 1 38 THR -2.36 0.43 1 39 ASP -1.28 0.31 1 40 THR 4.88 -0.49 1 41 SER 4.11 -0.01 1 42 LEU -1.33 0.26 1 43 VAL -0.14 0.13 1 44 GLU -0.86 -0.31 1 45 ALA -0.15 -0.15 1 46 ALA -0.92 0.09 1 47 GLU -4.50 0.36 1 48 GLU -5.74 1.04 1 49 ARG -4.31 0.52 1 50 ARG -2.84 1.00 1 51 VAL -4.41 0.40 1 52 GLU -3.51 1.13 1 53 ILE -6.39 0.53 1 54 THR -2.05 1.04 1 55 SER -2.14 0.41 1 56 GLU 1.48 -0.04 1 57 ASP -4.33 0.26 1 58 ARG 4.25 -0.26 1 59 VAL 6.17 -0.35 1 60 SER 5.41 -0.14 1 61 LEU 2.06 0.02 1 62 LEU 6.16 -0.65 1 63 TYR 5.45 -0.83 1 64 ASP 4.15 -0.36 1 65 TRP 0.69 -0.09 1 66 LEU 3.98 -0.89 1 67 ASP 1.89 -0.49 1 68 GLU 4.19 -0.06 1 69 LEU 2.88 -0.36 1 70 LEU 3.58 -0.38 1 71 PHE 4.80 -0.24 1 72 ILE 5.17 -0.65 1 73 HIS 6.12 -0.17 1 74 ASP 2.24 -0.60 1 75 THR 0.51 -0.36 1 76 GLU -1.29 -0.03 1 77 PHE 4.70 -0.61 1 78 ILE -5.29 0.23 1 79 LEU -6.21 0.04 1 80 PHE -5.92 0.17 1 81 SER -5.61 0.10 1 82 LYS -4.11 0.37 1 83 PHE -5.52 0.88 1 84 LYS -3.07 0.68 1 85 VAL -3.39 0.49 1 86 LYS -3.81 0.43 1 87 ILE -3.04 0.64 1 88 ASP -4.95 0.41 1 89 GLU -0.29 0.23 1 90 LYS -4.02 0.52 1 91 ASP 3.58 -0.25 1 92 ASP 0.19 0.04 1 94 LEU -3.16 0.57 1 95 HIS -2.79 0.51 1 96 LEU -4.24 0.80 1 97 THR -0.48 0.61 1 99 THR -1.84 0.86 1 100 ALA -4.92 0.65 1 101 MET -5.97 1.31 1 103 GLU -4.56 0.55 1 104 GLU -0.21 0.08 1 105 ILE 1.73 0.25 1 106 LYS -5.35 0.48 1 107 GLU 3.23 -0.31 1 109 HIS -1.30 0.03 1 110 GLU -1.88 0.01 1 111 ARG 0.36 0.31 1 112 ARG 1.34 0.25 1 113 ASP -3.69 0.33 1 114 GLU -2.04 0.06 1 115 VAL 1.03 -0.26 1 116 LYS 1.76 -0.03 1 117 ALA -3.19 0.02 1 118 VAL 0.16 0.03 1 119 THR 1.45 0.20 1 120 PHE 3.18 -0.33 1 121 HIS 3.13 -0.56 1 122 MET -0.22 -0.17 1 123 MET -0.56 0.09 1 124 GLU -5.74 0.31 1 125 ILE -1.06 0.83 1 126 LEU -4.44 0.48 1 127 ASP -1.90 0.60 1 128 GLU -3.53 0.23 1 129 ASP 2.47 -0.26 1 131 LEU -3.95 0.39 1 132 ILE -1.02 0.67 1 133 LYS -6.11 1.37 1 134 ALA -6.66 1.30 1 135 ARG -2.03 -0.12 1 136 VAL -2.03 -0.26 1 137 ILE -2.37 0.47 1 138 LEU -4.83 0.50 1 139 ASP -2.01 0.11 1 140 LEU -0.59 0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.66 _LACS_plot.Line_1_terminator_val_y_1 -2.74 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.18 _LACS_plot.Line_2_terminator_val_x_2 6.58 _LACS_plot.Line_2_terminator_val_y_2 1.62 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 140 LEU -0.59 4.45 0 10 THR 2.88 -0.09 1 11 ALA 0.52 -1.17 1 12 ASP -1.00 -2.19 1 13 ALA -3.43 -2.07 1 15 PHE -3.67 -2.19 1 16 TRP -4.83 -0.01 1 17 ALA -5.23 -2.39 1 18 TYR -5.98 -0.12 1 20 HIS 2.64 -0.18 1 21 ASP -3.75 -1.07 1 22 LEU 2.88 0.28 1 23 GLU 6.26 1.37 1 24 GLU 2.15 2.47 1 25 VAL 6.02 1.21 1 26 PHE 4.84 4.28 1 27 GLU 4.60 1.61 1 28 ASN 3.21 1.81 1 29 ALA 2.22 -0.32 1 30 ALA 5.63 0.06 1 31 LEU 3.75 -0.12 1 32 ALA 5.37 0.54 1 33 MET 4.22 1.85 1 34 PHE 6.59 2.54 1 35 GLU 0.82 3.17 1 36 VAL 5.46 0.36 1 37 MET -1.68 1.77 1 39 ASP -1.28 2.62 1 40 THR 4.88 1.57 1 41 SER 4.11 0.65 1 42 LEU -1.33 -1.82 1 43 VAL -0.14 -0.80 1 44 GLU -0.86 -1.29 1 45 ALA -0.15 -1.94 1 46 ALA -0.92 -0.30 1 47 GLU -4.50 -2.07 1 48 GLU -5.74 0.68 1 49 ARG -4.31 -2.36 1 50 ARG -2.84 -0.72 1 51 VAL -4.41 -1.97 1 52 GLU -3.51 -1.39 1 53 ILE -6.39 -2.08 1 54 THR -2.05 -0.76 1 55 SER -2.14 -0.57 1 56 GLU 1.48 -1.01 1 57 ASP -4.33 -0.52 1 58 ARG 4.25 -0.56 1 59 VAL 6.17 1.23 1 60 SER 5.41 1.14 1 61 LEU 2.06 0.21 1 62 LEU 6.16 0.21 1 63 TYR 5.45 -0.12 1 64 ASP 4.15 2.67 1 65 TRP 0.69 -0.77 1 66 LEU 3.98 1.16 1 67 ASP 1.89 2.64 1 68 GLU 4.19 2.66 1 69 LEU 2.88 2.23 1 70 LEU 3.58 0.34 1 71 PHE 4.80 4.02 1 72 ILE 5.17 2.01 1 73 HIS 6.12 2.89 1 74 ASP 2.24 0.59 1 75 THR 0.51 1.16 1 76 GLU -1.29 -1.21 1 77 PHE 4.70 -2.52 1 78 ILE -5.29 -2.65 1 79 LEU -6.21 -4.41 1 80 PHE -5.92 -3.18 1 81 SER -5.61 -1.69 1 82 LYS -4.11 -3.04 1 83 PHE -5.52 -1.49 1 84 LYS -3.07 -1.07 1 85 VAL -3.39 -3.18 1 86 LYS -3.81 -1.10 1 87 ILE -3.04 -1.97 1 88 ASP -4.95 -1.68 1 89 GLU -0.29 -1.40 1 90 LYS -4.02 0.23 1 91 ASP 3.58 0.17 1 92 ASP 0.19 -0.96 1 94 LEU -3.16 -2.36 1 95 HIS -2.79 -1.10 1 96 LEU -4.24 -2.18 1 97 THR -0.48 -0.62 1 99 THR -1.84 -2.27 1 100 ALA -4.92 -2.80 1 101 MET -5.97 -0.08 1 103 GLU -4.56 -2.31 1 104 GLU -0.21 -0.41 1 105 ILE 1.73 -0.40 1 106 LYS -5.35 0.92 1 107 GLU 3.23 0.45 1 109 HIS -1.30 2.21 1 110 GLU -1.88 -0.38 1 111 ARG 0.36 -0.46 1 112 ARG 1.34 -1.60 1 113 ASP -3.69 -2.29 1 114 GLU -2.04 -1.12 1 115 VAL 1.03 -0.91 1 116 LYS 1.76 0.50 1 117 ALA -3.19 -3.15 1 118 VAL 0.16 -0.62 1 119 THR 1.45 0.22 1 120 PHE 3.18 1.86 1 121 HIS 3.13 0.87 1 122 MET -0.22 -1.43 1 123 MET -0.56 -0.12 1 124 GLU -5.74 -2.53 1 125 ILE -1.06 -2.23 1 126 LEU -4.44 -2.98 1 127 ASP -1.90 -0.85 1 128 GLU -3.53 -1.54 1 129 ASP 2.47 -0.58 1 131 LEU -3.95 -2.84 1 132 ILE -1.02 -2.20 1 133 LYS -6.11 -2.22 1 134 ALA -6.66 -2.99 1 135 ARG -2.03 -2.31 1 136 VAL -2.03 -3.36 1 137 ILE -2.37 -1.44 1 138 LEU -4.83 -3.30 1 139 ASP -2.01 -2.00 1 stop_ save_