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 bmr5522_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.91 _LACS_plot.Line_1_terminator_val_y_1 -2.08 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.55 _LACS_plot.Line_2_terminator_val_x_2 6.76 _LACS_plot.Line_2_terminator_val_y_2 5.12 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 131 ASN 0.01 -1.78 0 135 HIS -6.91 -1.72 0 117 VAL -5.66 -4.65 0 11 MET -0.70 0.62 1 13 THR -3.28 0.26 1 14 VAL 6.28 4.86 1 15 MET 2.93 0.69 1 16 ASP 4.60 3.97 1 17 VAL 5.36 3.85 1 18 LEU 2.93 2.24 1 19 LYS 3.46 2.91 1 21 ASP -4.46 -1.52 1 22 ASN 3.46 2.86 1 23 ARG 2.46 2.04 1 24 PHE -0.29 -1.42 1 25 SER 6.54 4.46 1 26 MET 5.49 4.04 1 27 LEU 4.38 3.02 1 28 VAL 6.77 5.55 1 29 ALA 3.98 2.57 1 30 ALA 3.69 2.50 1 31 ILE 5.25 4.79 1 32 GLN 4.82 2.86 1 33 SER 3.74 3.54 1 34 ALA -1.15 -0.29 1 36 LEU -2.82 -0.19 1 37 THR 5.71 4.92 1 38 GLU 4.62 3.15 1 39 THR 5.65 5.33 1 40 LEU 1.63 0.57 1 41 ASN -3.05 -0.88 1 42 ARG -2.09 -0.35 1 43 GLU 1.58 1.25 1 45 VAL -3.62 -2.78 1 46 TYR -4.89 -1.14 1 47 THR -0.96 0.43 1 48 VAL -1.87 -0.92 1 49 PHE 1.16 0.13 1 50 ALA -6.18 -1.41 1 52 THR -2.90 -0.86 1 53 ASN 4.89 3.26 1 54 GLU 3.95 3.17 1 55 ALA 2.05 2.57 1 56 PHE 3.98 4.39 1 57 ARG 3.55 2.99 1 58 ALA 0.38 0.24 1 59 LEU -0.27 0.19 1 62 ARG 4.82 3.42 1 63 GLU 2.03 1.82 1 64 ARG 5.30 4.22 1 65 SER 3.60 3.35 1 66 ARG 3.60 3.05 1 67 LEU 2.79 2.74 1 68 LEU 2.52 1.09 1 70 ASP -2.67 -1.58 1 71 ALA 3.53 3.22 1 72 LYS 4.51 3.10 1 73 GLU 2.50 1.83 1 74 LEU 4.12 2.96 1 75 ALA 4.45 3.48 1 76 ASN 3.69 4.11 1 77 ILE 4.05 2.99 1 78 LEU 4.17 3.45 1 79 LYS 5.37 4.65 1 80 TYR 0.97 1.20 1 81 HIS 4.81 4.01 1 82 ILE -3.20 -1.47 1 84 ASP -0.06 -0.29 1 85 GLU -5.36 -2.11 1 86 ILE 1.79 1.38 1 87 LEU -2.51 -1.10 1 88 VAL -3.11 -2.61 1 89 SER 6.45 4.64 1 92 ILE 1.64 1.89 1 94 ALA 1.32 1.91 1 95 LEU 0.02 1.11 1 96 VAL -3.46 -0.76 1 97 ARG -0.16 -1.08 1 98 LEU -5.08 -1.83 1 99 LYS 3.07 2.32 1 100 SER -3.78 0.10 1 101 LEU 3.67 2.43 1 102 GLN 2.23 0.32 1 104 ASP -0.18 0.68 1 105 LYS -0.80 -0.01 1 106 LEU -1.32 1.22 1 107 GLU -1.38 -0.93 1 108 VAL -0.86 -0.99 1 109 SER -5.51 -1.58 1 110 LEU -3.16 -0.69 1 111 LYS -2.01 -0.45 1 112 ASN 3.82 2.16 1 113 ASN 2.86 2.09 1 114 VAL -1.49 -0.06 1 115 VAL 0.43 -0.34 1 116 SER -4.14 -1.13 1 118 ASN 3.86 0.92 1 119 LYS 5.03 2.37 1 120 GLU -1.16 -1.21 1 122 VAL 0.77 0.02 1 123 ALA 1.00 1.60 1 124 GLU -2.86 -0.54 1 126 ASP 4.16 0.78 1 127 ILE 3.74 1.72 1 128 MET 1.36 -0.42 1 129 ALA -6.55 -2.42 1 130 THR 4.00 2.78 1 133 VAL -5.40 -3.51 1 134 VAL -3.11 -1.65 1 136 VAL 2.31 2.56 1 137 ILE -4.52 -0.81 1 138 THR -0.03 -0.68 1 139 ASN -4.65 -0.40 1 140 VAL 0.95 0.26 1 141 LEU 1.20 0.05 1 142 GLN -3.67 -1.57 1 145 ALA 0.01 0.24 1 146 ASN 0.20 0.15 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5522_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.91 _LACS_plot.Line_1_terminator_val_y_1 4.83 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.45 _LACS_plot.Line_2_terminator_val_x_2 6.76 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 131 ASN 0.01 -1.79 0 135 HIS -6.91 5.19 0 117 VAL -5.66 1.01 0 11 MET -0.70 1.32 1 13 THR -3.28 3.54 1 14 VAL 6.28 -1.42 1 15 MET 2.93 -2.24 1 16 ASP 4.60 -0.63 1 17 VAL 5.36 -1.51 1 18 LEU 2.93 -0.69 1 19 LYS 3.46 -0.55 1 21 ASP -4.46 2.94 1 22 ASN 3.46 -0.60 1 23 ARG 2.46 -0.42 1 24 PHE -0.29 -1.13 1 25 SER 6.54 -2.08 1 26 MET 5.49 -1.45 1 27 LEU 4.38 -1.36 1 28 VAL 6.77 -1.22 1 29 ALA 3.98 -1.41 1 30 ALA 3.69 -1.19 1 31 ILE 5.25 -0.46 1 32 GLN 4.82 -1.96 1 33 SER 3.74 -0.20 1 34 ALA -1.15 0.86 1 36 LEU -2.82 2.63 1 37 THR 5.71 -0.79 1 38 GLU 4.62 -1.47 1 39 THR 5.65 -0.32 1 40 LEU 1.63 -1.06 1 41 ASN -3.05 2.17 1 42 ARG -2.09 1.74 1 43 GLU 1.58 -0.33 1 45 VAL -3.62 0.84 1 46 TYR -4.89 3.75 1 47 THR -0.96 1.39 1 48 VAL -1.87 0.95 1 49 PHE 1.16 -1.03 1 50 ALA -6.18 4.77 1 52 THR -2.90 2.04 1 53 ASN 4.89 -1.63 1 54 GLU 3.95 -0.78 1 55 ALA 2.05 0.52 1 56 PHE 3.98 0.41 1 57 ARG 3.55 -0.56 1 58 ALA 0.38 -0.14 1 59 LEU -0.27 0.46 1 62 ARG 4.82 -1.40 1 63 GLU 2.03 -0.21 1 64 ARG 5.30 -1.08 1 65 SER 3.60 -0.25 1 66 ARG 3.60 -0.55 1 67 LEU 2.79 -0.05 1 68 LEU 2.52 -1.43 1 70 ASP -2.67 1.09 1 71 ALA 3.53 -0.31 1 72 LYS 4.51 -1.41 1 73 GLU 2.50 -0.67 1 74 LEU 4.12 -1.16 1 75 ALA 4.45 -0.97 1 76 ASN 3.69 0.42 1 77 ILE 4.05 -1.06 1 78 LEU 4.17 -0.72 1 79 LYS 5.37 -0.72 1 80 TYR 0.97 0.23 1 81 HIS 4.81 -0.80 1 82 ILE -3.20 1.73 1 84 ASP -0.06 -0.23 1 85 GLU -5.36 3.25 1 86 ILE 1.79 -0.41 1 87 LEU -2.51 1.41 1 88 VAL -3.11 0.50 1 89 SER 6.45 -1.81 1 92 ILE 1.64 0.25 1 94 ALA 1.32 0.59 1 95 LEU 0.02 1.09 1 96 VAL -3.46 2.70 1 97 ARG -0.16 -0.92 1 98 LEU -5.08 3.25 1 99 LYS 3.07 -0.75 1 100 SER -3.78 3.88 1 101 LEU 3.67 -1.24 1 102 GLN 2.23 -1.91 1 104 ASP -0.18 0.86 1 105 LYS -0.80 0.79 1 106 LEU -1.32 2.54 1 107 GLU -1.38 0.45 1 108 VAL -0.86 -0.13 1 109 SER -5.51 3.93 1 110 LEU -3.16 2.47 1 111 LYS -2.01 1.56 1 112 ASN 3.82 -1.66 1 113 ASN 2.86 -0.77 1 114 VAL -1.49 1.43 1 115 VAL 0.43 -0.77 1 116 SER -4.14 3.01 1 118 ASN 3.86 -2.94 1 119 LYS 5.03 -2.66 1 120 GLU -1.16 -0.05 1 122 VAL 0.77 -0.75 1 123 ALA 1.00 0.60 1 124 GLU -2.86 2.32 1 126 ASP 4.16 -3.38 1 127 ILE 3.74 -2.02 1 128 MET 1.36 -1.78 1 129 ALA -6.55 4.13 1 130 THR 4.00 -1.22 1 133 VAL -5.40 1.89 1 134 VAL -3.11 1.46 1 136 VAL 2.31 0.25 1 137 ILE -4.52 3.71 1 138 THR -0.03 -0.65 1 139 ASN -4.65 4.25 1 140 VAL 0.95 -0.69 1 141 LEU 1.20 -1.15 1 142 GLN -3.67 2.10 1 145 ALA 0.01 0.23 1 146 ASN 0.20 -0.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5522_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.91 _LACS_plot.Line_1_terminator_val_y_1 0.62 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 5.70 _LACS_plot.Line_2_terminator_val_y_2 -0.45 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 THR 5.71 0.36 0 50 ALA -6.18 -0.11 0 13 THR -3.28 -0.04 1 15 MET 2.93 -0.18 1 21 ASP -4.46 0.33 1 22 ASN 3.46 -0.03 1 23 ARG 2.46 -0.25 1 26 MET 5.49 -0.57 1 27 LEU 4.38 -0.47 1 30 ALA 3.69 -0.26 1 32 GLN 4.82 -0.17 1 33 SER 3.74 -0.40 1 34 ALA -1.15 -0.29 1 36 LEU -2.82 0.08 1 39 THR 5.65 -0.66 1 40 LEU 1.63 -0.47 1 41 ASN -3.05 0.24 1 42 ARG -2.09 0.15 1 45 VAL -3.62 -0.05 1 46 TYR -4.89 0.57 1 47 THR -0.96 0.41 1 48 VAL -1.87 0.40 1 49 PHE 1.16 0.67 1 52 THR -2.90 -0.04 1 56 PHE 3.98 -0.67 1 58 ALA 0.38 -0.13 1 59 LEU -0.27 -0.17 1 62 ARG 4.82 0.37 1 63 GLU 2.03 -0.07 1 65 SER 3.60 -0.36 1 66 ARG 3.60 -0.27 1 67 LEU 2.79 -0.31 1 68 LEU 2.52 -0.11 1 70 ASP -2.67 0.22 1 71 ALA 3.53 0.36 1 73 GLU 2.50 -0.09 1 74 LEU 4.12 -0.32 1 75 ALA 4.45 -0.44 1 76 ASN 3.69 -0.34 1 77 ILE 4.05 -0.33 1 78 LEU 4.17 -0.29 1 79 LYS 5.37 -0.46 1 81 HIS 4.81 -0.66 1 82 ILE -3.20 0.96 1 85 GLU -5.36 0.07 1 86 ILE 1.79 -0.64 1 87 LEU -2.51 0.41 1 88 VAL -3.11 0.60 1 92 ILE 1.64 -0.38 1 94 ALA 1.32 -0.01 1 95 LEU 0.02 0.32 1 96 VAL -3.46 0.15 1 97 ARG -0.16 0.86 1 98 LEU -5.08 0.17 1 99 LYS 3.07 -0.35 1 101 LEU 3.67 -0.11 1 104 ASP -0.18 0.25 1 105 LYS -0.80 0.74 1 106 LEU -1.32 -0.02 1 108 VAL -0.86 0.88 1 109 SER -5.51 0.42 1 110 LEU -3.16 0.66 1 112 ASN 3.82 -0.03 1 113 ASN 2.86 -0.64 1 115 VAL 0.43 0.44 1 116 SER -4.14 0.87 1 117 VAL -5.66 0.67 1 118 ASN 3.86 -0.54 1 119 LYS 5.03 -0.74 1 120 GLU -1.16 0.04 1 122 VAL 0.77 0.16 1 123 ALA 1.00 0.02 1 124 GLU -2.86 0.18 1 126 ASP 4.16 -0.83 1 127 ILE 3.74 -0.18 1 128 MET 1.36 0.07 1 129 ALA -6.55 0.50 1 130 THR 4.00 -0.40 1 131 ASN 0.01 0.30 1 134 VAL -3.11 0.45 1 135 HIS -6.91 0.74 1 136 VAL 2.31 0.32 1 137 ILE -4.52 0.95 1 138 THR -0.03 0.27 1 139 ASN -4.65 0.04 1 141 LEU 1.20 -0.18 1 142 GLN -3.67 0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5522_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.91 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.45 _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 6.76 _LACS_plot.Line_2_terminator_val_y_2 2.30 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 135 HIS -6.91 1.66 0 100 SER -3.78 3.57 0 11 MET -0.70 -0.25 1 13 THR -3.28 1.71 1 14 VAL 6.28 0.88 1 15 MET 2.93 1.95 1 16 ASP 4.60 3.50 1 17 VAL 5.36 2.85 1 18 LEU 2.93 1.63 1 19 LYS 3.46 1.56 1 21 ASP -4.46 0.26 1 22 ASN 3.46 1.67 1 23 ARG 2.46 0.06 1 24 PHE -0.29 0.88 1 25 SER 6.54 4.07 1 26 MET 5.49 1.95 1 27 LEU 4.38 0.69 1 28 VAL 6.77 2.00 1 29 ALA 3.98 2.57 1 30 ALA 3.69 1.02 1 31 ILE 5.25 1.62 1 32 GLN 4.82 4.34 1 33 SER 3.74 1.14 1 34 ALA -1.15 -0.78 1 36 LEU -2.82 -1.75 1 37 THR 5.71 0.83 1 38 GLU 4.62 2.90 1 39 THR 5.65 1.27 1 40 LEU 1.63 -1.34 1 41 ASN -3.05 -0.36 1 42 ARG -2.09 -0.86 1 43 GLU 1.58 -0.22 1 45 VAL -3.62 -3.19 1 46 TYR -4.89 0.28 1 47 THR -0.96 -1.19 1 48 VAL -1.87 -2.16 1 49 PHE 1.16 -2.23 1 50 ALA -6.18 -1.57 1 52 THR -2.90 1.87 1 53 ASN 4.89 3.19 1 54 GLU 3.95 1.70 1 55 ALA 2.05 2.70 1 56 PHE 3.98 2.96 1 57 ARG 3.55 0.18 1 58 ALA 0.38 1.00 1 59 LEU -0.27 -1.22 1 62 ARG 4.82 2.82 1 63 GLU 2.03 1.91 1 64 ARG 5.30 1.74 1 65 SER 3.60 2.61 1 66 ARG 3.60 2.00 1 67 LEU 2.79 -0.18 1 68 LEU 2.52 1.47 1 70 ASP -2.67 -1.40 1 71 ALA 3.53 2.40 1 72 LYS 4.51 3.11 1 73 GLU 2.50 2.86 1 74 LEU 4.12 1.00 1 75 ALA 4.45 1.16 1 76 ASN 3.69 1.38 1 77 ILE 4.05 3.43 1 78 LEU 4.17 2.25 1 79 LYS 5.37 1.27 1 80 TYR 0.97 -3.83 1 81 HIS 4.81 -0.27 1 82 ILE -3.20 -0.61 1 84 ASP -0.06 -1.51 1 85 GLU -5.36 -1.21 1 86 ILE 1.79 -1.50 1 87 LEU -2.51 -3.37 1 88 VAL -3.11 2.20 1 89 SER 6.45 2.64 1 92 ILE 1.64 -0.63 1 94 ALA 1.32 -0.18 1 95 LEU 0.02 -2.04 1 96 VAL -3.46 -2.13 1 97 ARG -0.16 -1.28 1 98 LEU -5.08 -2.50 1 99 LYS 3.07 -2.12 1 101 LEU 3.67 0.84 1 102 GLN 2.23 0.26 1 104 ASP -0.18 1.20 1 105 LYS -0.80 0.67 1 106 LEU -1.32 -1.58 1 107 GLU -1.38 -1.49 1 108 VAL -0.86 -2.48 1 109 SER -5.51 -2.62 1 110 LEU -3.16 -1.82 1 111 LYS -2.01 -0.28 1 112 ASN 3.82 -1.00 1 113 ASN 2.86 -1.25 1 114 VAL -1.49 0.16 1 115 VAL 0.43 -1.53 1 116 SER -4.14 -2.56 1 117 VAL -5.66 -2.31 1 118 ASN 3.86 0.10 1 119 LYS 5.03 -0.91 1 120 GLU -1.16 -0.60 1 122 VAL 0.77 0.30 1 123 ALA 1.00 0.65 1 124 GLU -2.86 -2.95 1 126 ASP 4.16 -1.30 1 127 ILE 3.74 -0.39 1 128 MET 1.36 -1.46 1 129 ALA -6.55 0.07 1 130 THR 4.00 1.59 1 131 ASN 0.01 -1.81 1 133 VAL -5.40 -5.35 1 134 VAL -3.11 -3.28 1 136 VAL 2.31 0.13 1 137 ILE -4.52 -1.22 1 138 THR -0.03 -1.54 1 139 ASN -4.65 -2.90 1 140 VAL 0.95 0.54 1 141 LEU 1.20 -1.89 1 142 GLN -3.67 -1.18 1 145 ALA 0.01 0.00 1 146 ASN 0.20 0.35 1 stop_ save_