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 bmr5513_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 -4.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.36 _LACS_plot.Line_2_terminator_val_x_2 7.24 _LACS_plot.Line_2_terminator_val_y_2 3.70 _LACS_plot.Y_axis_chem_shift_offset 1.94 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 112 LYS 0.56 -4.44 0 10 LYS -1.26 -2.76 1 11 LEU -6.86 -3.91 1 12 GLN -0.99 -2.65 1 13 LEU -6.55 -4.01 1 15 ALA 0.06 -0.95 1 17 LYS -1.84 -3.31 1 18 ALA 1.00 -0.55 1 19 THR -0.09 -1.72 1 21 ALA 2.08 -1.04 1 24 VAL 6.51 3.35 1 27 ALA 2.14 0.20 1 28 LEU 2.74 0.04 1 30 GLN 3.41 -0.08 1 31 HIS -2.48 -1.21 1 33 VAL -0.63 -2.41 1 34 ASN 2.00 -1.48 1 35 ILE 4.20 2.01 1 36 MET 4.86 0.71 1 37 GLU 3.16 0.65 1 38 PHE 7.17 3.19 1 40 LYS 4.05 1.70 1 41 ARG 3.21 1.54 1 42 PHE 5.47 2.52 1 43 ASN 5.62 0.99 1 44 ALA 3.18 0.44 1 45 GLU 1.67 -0.29 1 46 THR -0.43 -2.40 1 47 ALA 3.91 1.35 1 48 ASP 2.38 -1.25 1 49 LYS -0.30 -3.13 1 50 ALA 2.19 -0.11 1 52 MET -2.13 -2.01 1 53 ILE 0.95 -2.77 1 54 LEU -4.44 -4.01 1 56 VAL -5.30 -4.68 1 57 VAL -0.48 -2.32 1 58 ILE -1.88 -2.14 1 59 THR 1.32 -0.62 1 60 VAL -2.06 -3.63 1 61 TYR -0.30 -1.38 1 62 GLU 3.11 0.89 1 63 ASP 0.61 -2.74 1 64 LYS 7.24 1.12 1 65 SER 0.01 -1.02 1 66 PHE -4.54 -3.23 1 67 THR -4.42 -3.53 1 68 PHE -4.61 -3.32 1 69 ILE -5.37 -3.75 1 70 ILE -1.26 -3.15 1 71 LYS -1.26 -3.62 1 72 THR -1.44 -3.83 1 79 LEU 3.01 0.56 1 80 LYS 5.35 2.42 1 81 LYS 3.30 0.37 1 82 ALA 3.22 0.44 1 83 ALA -1.16 -2.54 1 85 ILE -0.13 -2.19 1 86 GLU 0.45 -1.46 1 87 LYS 0.23 -1.67 1 89 SER -0.44 -1.98 1 90 SER 0.35 -1.67 1 91 GLU -0.58 -1.67 1 93 LYS 1.23 -1.40 1 94 ARG -0.64 -2.08 1 95 LYS 0.98 -1.14 1 96 ILE -0.79 -3.17 1 97 VAL -0.51 -2.29 1 99 LYS -4.62 -3.30 1 100 VAL -6.50 -5.53 1 101 THR -4.20 -4.15 1 102 ARG 5.75 2.14 1 103 LYS 3.91 0.76 1 104 GLN 3.40 1.67 1 105 ILE 6.02 0.52 1 106 GLU 3.76 1.80 1 107 GLU 3.06 0.97 1 108 ILE 5.02 2.76 1 109 ALA 3.75 1.51 1 110 LYS 4.66 2.22 1 111 THR 5.12 2.49 1 113 MET -0.29 -1.20 1 115 ASP -2.11 -2.65 1 116 LEU 1.92 -1.80 1 117 ASN -3.50 -3.47 1 118 ALA 0.45 -1.54 1 119 ASN -3.92 -3.64 1 120 SER 4.10 0.89 1 121 LEU 4.91 1.95 1 122 GLU 2.83 0.46 1 123 ALA 2.71 0.77 1 124 ALA 5.10 3.21 1 125 MET 4.25 1.26 1 126 LYS 4.57 2.00 1 127 ILE 5.27 -0.43 1 128 ILE 4.37 2.02 1 129 GLU 6.50 3.12 1 131 THR 6.12 1.58 1 132 ALA 4.78 1.69 1 133 LYS 3.84 1.21 1 134 SER -1.49 -1.12 1 135 MET -1.10 -2.69 1 137 ILE -2.60 -2.89 1 138 GLU -0.10 -2.85 1 139 VAL -3.44 -4.00 1 140 VAL 2.03 0.84 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5513_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 2.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.36 _LACS_plot.Line_2_terminator_val_x_2 7.24 _LACS_plot.Line_2_terminator_val_y_2 -3.54 _LACS_plot.Y_axis_chem_shift_offset 1.94 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 112 LYS 0.56 -5.00 0 10 LYS -1.26 -1.50 1 11 LEU -6.86 2.95 1 12 GLN -0.99 -1.66 1 13 LEU -6.55 2.54 1 15 ALA 0.06 -1.01 1 17 LYS -1.84 -1.47 1 18 ALA 1.00 -1.55 1 19 THR -0.09 -1.63 1 21 ALA 2.08 -3.12 1 24 VAL 6.51 -3.16 1 27 ALA 2.14 -1.94 1 28 LEU 2.74 -2.70 1 30 GLN 3.41 -3.49 1 31 HIS -2.48 1.27 1 33 VAL -0.63 -1.78 1 34 ASN 2.00 -3.48 1 35 ILE 4.20 -2.19 1 36 MET 4.86 -4.15 1 37 GLU 3.16 -2.51 1 38 PHE 7.17 -3.98 1 40 LYS 4.05 -2.35 1 41 ARG 3.21 -1.67 1 42 PHE 5.47 -2.95 1 43 ASN 5.62 -4.63 1 44 ALA 3.18 -2.74 1 45 GLU 1.67 -1.96 1 46 THR -0.43 -1.97 1 47 ALA 3.91 -2.56 1 48 ASP 2.38 -3.63 1 49 LYS -0.30 -2.83 1 50 ALA 2.19 -2.30 1 52 MET -2.13 0.12 1 53 ILE 0.95 -3.72 1 54 LEU -4.44 0.43 1 56 VAL -5.30 0.62 1 57 VAL -0.48 -1.84 1 58 ILE -1.88 -0.26 1 59 THR 1.32 -1.94 1 60 VAL -2.06 -1.57 1 61 TYR -0.30 -1.08 1 62 GLU 3.11 -2.22 1 63 ASP 0.61 -3.35 1 64 LYS 7.24 -6.12 1 65 SER 0.01 -1.03 1 66 PHE -4.54 1.31 1 67 THR -4.42 0.89 1 68 PHE -4.61 1.29 1 69 ILE -5.37 1.62 1 70 ILE -1.26 -1.89 1 71 LYS -1.26 -2.36 1 72 THR -1.44 -2.39 1 79 LEU 3.01 -2.45 1 80 LYS 5.35 -2.93 1 81 LYS 3.30 -2.93 1 82 ALA 3.22 -2.78 1 83 ALA -1.16 -1.38 1 85 ILE -0.13 -2.06 1 86 GLU 0.45 -1.91 1 87 LYS 0.23 -1.90 1 89 SER -0.44 -1.54 1 90 SER 0.35 -2.02 1 91 GLU -0.58 -1.09 1 93 LYS 1.23 -2.63 1 94 ARG -0.64 -1.44 1 95 LYS 0.98 -2.12 1 96 ILE -0.79 -2.38 1 97 VAL -0.51 -1.78 1 99 LYS -4.62 1.32 1 100 VAL -6.50 0.97 1 101 THR -4.20 0.05 1 102 ARG 5.75 -3.61 1 103 LYS 3.91 -3.15 1 104 GLN 3.40 -1.73 1 105 ILE 6.02 -5.50 1 106 GLU 3.76 -1.96 1 107 GLU 3.06 -2.09 1 108 ILE 5.02 -2.26 1 109 ALA 3.75 -2.24 1 110 LYS 4.66 -2.44 1 111 THR 5.12 -2.63 1 113 MET -0.29 -0.91 1 115 ASP -2.11 -0.54 1 116 LEU 1.92 -3.72 1 117 ASN -3.50 0.03 1 118 ALA 0.45 -1.99 1 119 ASN -3.92 0.28 1 120 SER 4.10 -3.21 1 121 LEU 4.91 -2.96 1 122 GLU 2.83 -2.37 1 123 ALA 2.71 -1.94 1 124 ALA 5.10 -1.89 1 125 MET 4.25 -2.99 1 126 LYS 4.57 -2.57 1 127 ILE 5.27 -5.70 1 128 ILE 4.37 -2.35 1 129 GLU 6.50 -3.38 1 131 THR 6.12 -4.54 1 132 ALA 4.78 -3.09 1 133 LYS 3.84 -2.63 1 134 SER -1.49 0.37 1 135 MET -1.10 -1.59 1 137 ILE -2.60 -0.29 1 138 GLU -0.10 -2.75 1 139 VAL -3.44 -0.56 1 140 VAL 2.03 -1.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5513_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 0.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _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 7.24 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _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 66 PHE -4.54 1.70 0 10 LYS -1.26 0.96 1 11 LEU -6.86 0.39 1 12 GLN -0.99 0.72 1 13 LEU -6.55 0.32 1 15 ALA 0.06 -0.44 1 17 LYS -1.84 0.35 1 18 ALA 1.00 0.12 1 19 THR -0.09 -0.79 1 21 ALA 2.08 -0.17 1 24 VAL 6.51 -0.92 1 27 ALA 2.14 -0.10 1 28 LEU 2.74 -0.26 1 30 GLN 3.41 -0.24 1 31 HIS -2.48 0.00 1 33 VAL -0.63 -0.21 1 34 ASN 2.00 -0.11 1 35 ILE 4.20 -0.82 1 36 MET 4.86 -0.18 1 37 GLU 3.16 -0.22 1 38 PHE 7.17 -0.56 1 40 LYS 4.05 -0.35 1 41 ARG 3.21 -0.11 1 42 PHE 5.47 -0.94 1 43 ASN 5.62 -0.60 1 44 ALA 3.18 -0.08 1 45 GLU 1.67 -0.09 1 46 THR -0.43 0.02 1 47 ALA 3.91 -0.46 1 48 ASP 2.38 -0.14 1 49 LYS -0.30 0.15 1 50 ALA 2.19 -0.38 1 52 MET -2.13 0.15 1 53 ILE 0.95 0.15 1 54 LEU -4.44 0.42 1 56 VAL -5.30 1.14 1 57 VAL -0.48 0.76 1 58 ILE -1.88 0.60 1 59 THR 1.32 0.18 1 60 VAL -2.06 0.42 1 61 TYR -0.30 0.61 1 62 GLU 3.11 -0.22 1 63 ASP 0.61 0.05 1 64 LYS 7.24 -0.51 1 65 SER 0.01 0.14 1 67 THR -4.42 0.31 1 68 PHE -4.61 1.37 1 69 ILE -5.37 0.55 1 70 ILE -1.26 0.70 1 71 LYS -1.26 0.42 1 72 THR -1.44 0.27 1 79 LEU 3.01 -0.42 1 80 LYS 5.35 -0.65 1 81 LYS 3.30 -0.31 1 82 ALA 3.22 -0.21 1 83 ALA -1.16 0.23 1 85 ILE -0.13 0.26 1 86 GLU 0.45 -0.11 1 87 LYS 0.23 0.06 1 89 SER -0.44 0.04 1 90 SER 0.35 0.04 1 91 GLU -0.58 0.03 1 93 LYS 1.23 -0.05 1 94 ARG -0.64 0.05 1 95 LYS 0.98 -0.04 1 96 ILE -0.79 0.30 1 97 VAL -0.51 0.21 1 99 LYS -4.62 1.26 1 100 VAL -6.50 0.71 1 101 THR -4.20 0.77 1 102 ARG 5.75 -0.52 1 103 LYS 3.91 -0.16 1 104 GLN 3.40 -0.21 1 105 ILE 6.02 -0.56 1 106 GLU 3.76 -0.48 1 107 GLU 3.06 -0.33 1 108 ILE 5.02 -0.53 1 109 ALA 3.75 -0.66 1 110 LYS 4.66 -0.42 1 111 THR 5.12 -0.35 1 112 LYS 0.56 0.15 1 113 MET -0.29 0.11 1 115 ASP -2.11 0.11 1 116 LEU 1.92 -0.19 1 117 ASN -3.50 0.24 1 118 ALA 0.45 -0.03 1 119 ASN -3.92 0.23 1 120 SER 4.10 -0.08 1 121 LEU 4.91 -0.39 1 122 GLU 2.83 -0.17 1 123 ALA 2.71 -0.35 1 124 ALA 5.10 -0.83 1 125 MET 4.25 -0.16 1 126 LYS 4.57 -0.32 1 127 ILE 5.27 -0.48 1 128 ILE 4.37 -0.57 1 129 GLU 6.50 -0.39 1 131 THR 6.12 -0.48 1 132 ALA 4.78 -0.16 1 133 LYS 3.84 -0.13 1 134 SER -1.49 -0.05 1 135 MET -1.10 -0.05 1 137 ILE -2.60 -0.05 1 138 GLU -0.10 0.64 1 139 VAL -3.44 0.41 1 140 VAL 2.03 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5513_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.86 _LACS_plot.Line_1_terminator_val_y_1 -4.68 _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 -2.75 _LACS_plot.Line_2_terminator_val_x_2 7.24 _LACS_plot.Line_2_terminator_val_y_2 0.57 _LACS_plot.Y_axis_chem_shift_offset 1.99 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 LEU -6.55 -1.61 0 140 VAL 2.03 2.66 0 64 LYS 7.24 -3.11 0 101 THR -4.20 0.53 0 10 LYS -1.26 -3.13 1 11 LEU -6.86 -4.65 1 12 GLN -0.99 -2.74 1 15 ALA 0.06 -0.62 1 17 LYS -1.84 -2.62 1 18 ALA 1.00 -1.87 1 19 THR -0.09 -2.86 1 21 ALA 2.08 -2.83 1 24 VAL 6.51 -0.96 1 27 ALA 2.14 -0.65 1 28 LEU 2.74 0.51 1 30 GLN 3.41 -2.11 1 31 HIS -2.48 -0.93 1 33 VAL -0.63 -3.48 1 34 ASN 2.00 -2.68 1 35 ILE 4.20 -0.40 1 36 MET 4.86 0.78 1 37 GLU 3.16 0.46 1 38 PHE 7.17 -1.94 1 40 LYS 4.05 1.36 1 41 ARG 3.21 0.42 1 42 PHE 5.47 1.42 1 43 ASN 5.62 0.11 1 44 ALA 3.18 0.80 1 45 GLU 1.67 -0.66 1 46 THR -0.43 -1.59 1 47 ALA 3.91 -1.01 1 48 ASP 2.38 -1.63 1 49 LYS -0.30 -4.60 1 50 ALA 2.19 -1.98 1 52 MET -2.13 -2.99 1 53 ILE 0.95 -2.97 1 54 LEU -4.44 -2.25 1 56 VAL -5.30 -3.58 1 57 VAL -0.48 -1.46 1 58 ILE -1.88 -3.31 1 59 THR 1.32 -4.85 1 60 VAL -2.06 -2.49 1 61 TYR -0.30 0.32 1 62 GLU 3.11 -3.00 1 63 ASP 0.61 -1.58 1 65 SER 0.01 -3.88 1 66 PHE -4.54 -2.83 1 67 THR -4.42 -3.82 1 68 PHE -4.61 -4.77 1 69 ILE -5.37 -3.91 1 70 ILE -1.26 -2.07 1 71 LYS -1.26 -3.12 1 72 THR -1.44 -3.91 1 79 LEU 3.01 -3.67 1 80 LYS 5.35 0.05 1 81 LYS 3.30 1.18 1 82 ALA 3.22 -1.41 1 83 ALA -1.16 -2.05 1 85 ILE -0.13 -2.52 1 86 GLU 0.45 -2.24 1 87 LYS 0.23 -1.82 1 89 SER -0.44 -1.67 1 90 SER 0.35 -2.48 1 91 GLU -0.58 -2.37 1 93 LYS 1.23 -2.05 1 94 ARG -0.64 -2.71 1 95 LYS 0.98 -2.58 1 96 ILE -0.79 -2.11 1 97 VAL -0.51 -2.25 1 99 LYS -4.62 -3.63 1 100 VAL -6.50 -4.01 1 102 ARG 5.75 0.54 1 103 LYS 3.91 0.51 1 104 GLN 3.40 1.47 1 105 ILE 6.02 -1.11 1 106 GLU 3.76 -0.87 1 107 GLU 3.06 1.34 1 108 ILE 5.02 -0.98 1 109 ALA 3.75 -1.39 1 110 LYS 4.66 0.99 1 111 THR 5.12 -0.89 1 112 LYS 0.56 -1.95 1 113 MET -0.29 -1.47 1 115 ASP -2.11 -3.04 1 116 LEU 1.92 -3.36 1 117 ASN -3.50 -2.66 1 118 ALA 0.45 -2.76 1 119 ASN -3.92 -2.64 1 120 SER 4.10 -1.02 1 121 LEU 4.91 0.48 1 122 GLU 2.83 1.03 1 123 ALA 2.71 -0.55 1 124 ALA 5.10 -0.53 1 125 MET 4.25 1.73 1 126 LYS 4.57 1.16 1 127 ILE 5.27 -0.36 1 128 ILE 4.37 0.19 1 129 GLU 6.50 -0.29 1 131 THR 6.12 -0.70 1 132 ALA 4.78 2.58 1 133 LYS 3.84 -1.47 1 134 SER -1.49 -2.35 1 135 MET -1.10 -3.47 1 137 ILE -2.60 -4.12 1 138 GLU -0.10 -1.57 1 139 VAL -3.44 -3.92 1 stop_ save_