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 bmr7220_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.83 _LACS_plot.Line_1_terminator_val_y_1 -1.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.90 _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 5.79 _LACS_plot.Line_2_terminator_val_y_2 3.96 _LACS_plot.Y_axis_chem_shift_offset -0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 ASN 3.68 6.34 0 10 TYR 0.40 -0.10 1 11 TRP 3.38 -0.20 1 12 ASN -3.00 0.30 1 14 SER 1.12 1.35 1 15 ASN 1.36 0.74 1 16 SER 1.93 1.80 1 17 LYS 2.96 2.42 1 18 PHE 2.12 -0.10 1 19 LEU 0.57 3.86 1 22 GLN -3.08 1.28 1 24 LEU -3.67 -0.28 1 25 VAL -0.69 -0.32 1 26 LEU -7.70 -1.80 1 27 TYR -0.25 -0.35 1 29 GLN -3.42 -3.02 1 30 ILE 3.85 -0.47 1 32 ASP -0.08 1.20 1 33 LYS -4.61 -0.64 1 34 LEU -7.41 -1.01 1 35 ASP -2.27 -0.80 1 36 ILE -1.48 -0.48 1 37 ILE -5.23 -0.82 1 40 LYS 3.10 1.12 1 41 VAL -1.22 -0.43 1 42 ASP -1.83 -0.27 1 43 SER 3.09 2.69 1 44 LYS 1.47 1.08 1 45 THR -0.14 0.26 1 46 VAL 1.89 1.36 1 48 GLN -1.71 -0.52 1 49 TYR 1.04 1.50 1 50 GLU -6.60 -4.00 1 51 TYR -4.35 -3.08 1 52 TYR -6.24 0.57 1 53 LYS -2.62 0.59 1 54 VAL -0.60 0.22 1 55 TYR -4.86 0.24 1 56 MET -1.66 0.05 1 57 VAL -6.66 -2.80 1 58 ASP -2.98 -1.60 1 59 LYS 3.42 4.16 1 60 ASP 3.40 3.80 1 61 GLN 2.76 4.49 1 62 ALA 3.29 3.01 1 63 ASP 3.90 3.20 1 64 ARG -0.30 0.00 1 66 THR -3.14 -0.54 1 67 ILE -3.34 -2.16 1 68 LYS -2.14 -0.84 1 69 LYS 3.10 2.65 1 70 GLU 2.67 1.44 1 71 ASN -1.08 0.80 1 72 THR -2.92 -1.62 1 74 LEU 0.32 0.88 1 75 LEU -4.65 0.17 1 78 ALA -0.68 0.62 1 81 ASP -0.80 -0.90 1 82 GLN -4.62 -0.72 1 83 ASP 0.24 0.90 1 84 ILE -1.52 -0.20 1 85 LYS -5.93 -1.47 1 86 PHE -3.88 0.70 1 87 THR -0.67 0.09 1 88 ILE -0.64 0.30 1 89 LYS -1.60 -1.20 1 90 PHE 3.51 1.15 1 91 GLN -4.44 -1.77 1 92 GLU -1.35 0.81 1 93 PHE -1.30 -0.20 1 94 SER -2.58 -1.31 1 96 ASN -1.23 -0.16 1 97 LEU 1.79 1.57 1 98 TRP 0.71 0.18 1 100 LEU -0.72 0.08 1 101 GLU -4.17 -1.33 1 102 PHE -3.46 -0.20 1 103 GLN -4.69 -1.80 1 104 LYS 1.64 2.29 1 105 ASN 4.06 2.36 1 106 LYS -3.46 -0.57 1 107 ASP -2.97 -1.50 1 108 TYR -4.40 -0.45 1 109 TYR -4.75 -0.31 1 110 ILE -4.42 -1.30 1 111 ILE -7.83 -1.20 1 112 SER -3.70 0.37 1 113 THR 2.66 0.56 1 114 SER 2.37 2.24 1 115 ASN -0.28 -0.10 1 117 SER -3.35 -0.62 1 118 LEU 5.80 4.55 1 119 GLU 4.13 2.85 1 121 LEU 1.74 3.80 1 122 ASP 0.68 0.65 1 123 ASN 2.43 2.53 1 124 GLN -0.29 1.60 1 125 GLU -4.86 -1.46 1 128 VAL 5.52 4.62 1 130 GLN 0.25 2.07 1 131 THR 3.09 2.95 1 132 ARG -2.94 -1.42 1 133 ALA 2.50 0.92 1 134 MET 4.03 1.00 1 135 LYS -6.12 -2.00 1 136 ILE -3.83 -1.02 1 137 LEU -2.41 -1.35 1 138 MET -3.00 -1.30 1 139 LYS 4.54 -0.30 1 140 VAL 3.83 2.15 1 142 GLN -3.18 -0.16 1 143 ASP -2.46 -0.36 1 144 ALA 1.38 1.03 1 145 SER 1.40 1.54 1 146 SER 0.49 0.81 1 147 ALA 0.46 0.76 1 149 SER -0.10 0.50 1 150 THR 0.13 0.62 1 151 ARG 1.29 2.04 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7220_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.83 _LACS_plot.Line_1_terminator_val_y_1 5.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.10 _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 5.79 _LACS_plot.Line_2_terminator_val_y_2 -1.83 _LACS_plot.Y_axis_chem_shift_offset -0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 ASN 3.68 2.66 0 10 TYR 0.40 -0.50 1 11 TRP 3.38 -3.58 1 12 ASN -3.00 3.30 1 14 SER 1.12 0.23 1 15 ASN 1.36 -0.62 1 16 SER 1.93 -0.13 1 17 LYS 2.96 -0.54 1 18 PHE 2.12 -2.22 1 19 LEU 0.57 3.29 1 22 GLN -3.08 4.36 1 24 LEU -3.67 3.39 1 25 VAL -0.69 0.37 1 26 LEU -7.70 5.90 1 27 TYR -0.25 -0.10 1 29 GLN -3.42 0.40 1 30 ILE 3.85 -4.32 1 32 ASP -0.08 1.28 1 33 LYS -4.61 3.97 1 34 LEU -7.41 6.40 1 35 ASP -2.27 1.47 1 36 ILE -1.48 1.00 1 37 ILE -5.23 4.41 1 40 LYS 3.10 -1.98 1 41 VAL -1.22 0.79 1 42 ASP -1.83 1.56 1 43 SER 3.09 -0.40 1 44 LYS 1.47 -0.39 1 45 THR -0.14 0.40 1 46 VAL 1.89 -0.53 1 48 GLN -1.71 1.19 1 49 TYR 1.04 0.46 1 50 GLU -6.60 2.60 1 51 TYR -4.35 1.27 1 52 TYR -6.24 6.81 1 53 LYS -2.62 3.21 1 54 VAL -0.60 0.82 1 55 TYR -4.86 5.10 1 56 MET -1.66 1.71 1 57 VAL -6.66 3.86 1 58 ASP -2.98 1.38 1 59 LYS 3.42 0.74 1 60 ASP 3.40 0.40 1 61 GLN 2.76 1.73 1 62 ALA 3.29 -0.28 1 63 ASP 3.90 -0.70 1 64 ARG -0.30 0.30 1 66 THR -3.14 2.60 1 67 ILE -3.34 1.18 1 68 LYS -2.14 1.30 1 69 LYS 3.10 -0.45 1 70 GLU 2.67 -1.23 1 71 ASN -1.08 1.88 1 72 THR -2.92 1.30 1 74 LEU 0.32 0.56 1 75 LEU -4.65 4.82 1 78 ALA -0.68 1.30 1 81 ASP -0.80 -0.10 1 82 GLN -4.62 3.90 1 83 ASP 0.24 0.66 1 84 ILE -1.52 1.32 1 85 LYS -5.93 4.46 1 86 PHE -3.88 4.58 1 87 THR -0.67 0.76 1 88 ILE -0.64 0.94 1 89 LYS -1.60 0.40 1 90 PHE 3.51 -2.36 1 91 GLN -4.44 2.67 1 92 GLU -1.35 2.16 1 93 PHE -1.30 1.10 1 94 SER -2.58 1.27 1 96 ASN -1.23 1.07 1 97 LEU 1.79 -0.22 1 98 TRP 0.71 -0.53 1 100 LEU -0.72 0.80 1 101 GLU -4.17 2.84 1 102 PHE -3.46 3.26 1 103 GLN -4.69 2.89 1 104 LYS 1.64 0.65 1 105 ASN 4.06 -1.70 1 106 LYS -3.46 2.89 1 107 ASP -2.97 1.47 1 108 TYR -4.40 3.95 1 109 TYR -4.75 4.44 1 110 ILE -4.42 3.12 1 111 ILE -7.83 6.63 1 112 SER -3.70 4.07 1 113 THR 2.66 -2.10 1 114 SER 2.37 -0.13 1 115 ASN -0.28 0.18 1 117 SER -3.35 2.73 1 118 LEU 5.80 -1.25 1 119 GLU 4.13 -1.28 1 121 LEU 1.74 2.06 1 122 ASP 0.68 -0.03 1 123 ASN 2.43 0.10 1 124 GLN -0.29 1.89 1 125 GLU -4.86 3.40 1 128 VAL 5.52 -0.90 1 130 GLN 0.25 1.82 1 131 THR 3.09 -0.14 1 132 ARG -2.94 1.52 1 133 ALA 2.50 -1.58 1 134 MET 4.03 -3.03 1 135 LYS -6.12 4.12 1 136 ILE -3.83 2.81 1 137 LEU -2.41 1.06 1 138 MET -3.00 1.70 1 139 LYS 4.54 -4.84 1 140 VAL 3.83 -1.68 1 142 GLN -3.18 3.02 1 143 ASP -2.46 2.10 1 144 ALA 1.38 -0.35 1 145 SER 1.40 0.14 1 146 SER 0.49 0.32 1 147 ALA 0.46 0.30 1 149 SER -0.10 0.60 1 150 THR 0.13 0.49 1 151 ARG 1.29 0.75 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7220_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.83 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 5.79 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 118 LEU 5.80 -1.20 0 111 ILE -7.83 1.41 0 134 MET 4.03 -1.29 0 128 VAL 5.52 0.29 0 10 TYR 0.40 0.50 1 11 TRP 3.38 -0.62 1 12 ASN -3.00 -0.14 1 15 ASN 1.36 -0.08 1 16 SER 1.93 -0.10 1 17 LYS 2.96 -0.31 1 18 PHE 2.12 -0.49 1 19 LEU 0.57 0.22 1 22 GLN -3.08 0.21 1 24 LEU -3.67 0.45 1 25 VAL -0.69 0.81 1 26 LEU -7.70 0.35 1 27 TYR -0.25 -0.05 1 29 GLN -3.42 -0.14 1 30 ILE 3.85 -0.23 1 32 ASP -0.08 0.42 1 33 LYS -4.61 1.12 1 34 LEU -7.41 0.33 1 35 ASP -2.27 0.78 1 36 ILE -1.48 0.69 1 37 ILE -5.23 0.85 1 40 LYS 3.10 -0.08 1 41 VAL -1.22 0.14 1 42 ASP -1.83 -0.01 1 43 SER 3.09 -0.25 1 44 LYS 1.47 0.03 1 45 THR -0.14 0.05 1 46 VAL 1.89 -0.11 1 48 GLN -1.71 0.19 1 49 TYR 1.04 -0.42 1 51 TYR -4.35 0.10 1 52 TYR -6.24 0.37 1 53 LYS -2.62 0.18 1 54 VAL -0.60 0.02 1 55 TYR -4.86 0.11 1 56 MET -1.66 1.05 1 57 VAL -6.66 0.85 1 58 ASP -2.98 0.27 1 59 LYS 3.42 0.31 1 60 ASP 3.40 -0.45 1 61 GLN 2.76 -0.46 1 62 ALA 3.29 -0.36 1 63 ASP 3.90 -0.49 1 64 ARG -0.30 -0.05 1 66 THR -3.14 0.77 1 67 ILE -3.34 0.11 1 68 LYS -2.14 0.10 1 69 LYS 3.10 -0.30 1 70 GLU 2.67 -0.18 1 71 ASN -1.08 0.06 1 72 THR -2.92 -0.30 1 74 LEU 0.32 -0.64 1 75 LEU -4.65 0.02 1 76 ASN 3.68 -0.32 1 78 ALA -0.68 0.46 1 81 ASP -0.80 -0.02 1 82 GLN -4.62 0.29 1 83 ASP 0.24 0.31 1 84 ILE -1.52 0.25 1 85 LYS -5.93 1.19 1 86 PHE -3.88 -0.06 1 87 THR -0.67 0.56 1 88 ILE -0.64 -0.45 1 89 LYS -1.60 0.22 1 90 PHE 3.51 -0.68 1 91 GLN -4.44 0.53 1 92 GLU -1.35 0.51 1 93 PHE -1.30 0.09 1 94 SER -2.58 -0.08 1 96 ASN -1.23 -0.13 1 97 LEU 1.79 -0.31 1 98 TRP 0.71 0.01 1 100 LEU -0.72 -0.13 1 101 GLU -4.17 0.16 1 102 PHE -3.46 -0.06 1 103 GLN -4.69 0.38 1 104 LYS 1.64 -0.57 1 105 ASN 4.06 -0.53 1 106 LYS -3.46 0.23 1 107 ASP -2.97 0.92 1 108 TYR -4.40 0.30 1 109 TYR -4.75 -0.03 1 110 ILE -4.42 1.28 1 112 SER -3.70 0.62 1 113 THR 2.66 0.56 1 114 SER 2.37 -0.40 1 115 ASN -0.28 0.37 1 117 SER -3.35 0.53 1 119 GLU 4.13 -0.39 1 121 LEU 1.74 0.02 1 122 ASP 0.68 0.17 1 123 ASN 2.43 -0.34 1 124 GLN -0.29 -0.10 1 125 GLU -4.86 0.99 1 130 GLN 0.25 -0.14 1 131 THR 3.09 -0.19 1 132 ARG -2.94 0.34 1 133 ALA 2.50 -0.33 1 135 LYS -6.12 1.22 1 136 ILE -3.83 1.13 1 137 LEU -2.41 0.34 1 138 MET -3.00 -0.02 1 139 LYS 4.54 0.33 1 140 VAL 3.83 -0.18 1 142 GLN -3.18 0.24 1 143 ASP -2.46 -0.13 1 144 ALA 1.38 -0.91 1 145 SER 1.40 -0.17 1 146 SER 0.49 -0.06 1 147 ALA 0.46 -0.01 1 149 SER -0.10 0.05 1 150 THR 0.13 -0.02 1 151 ARG 1.29 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7220_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.83 _LACS_plot.Line_1_terminator_val_y_1 -5.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.74 _LACS_plot.Line_2_terminator_val_x_2 5.79 _LACS_plot.Line_2_terminator_val_y_2 -1.39 _LACS_plot.Y_axis_chem_shift_offset 3.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 151 ARG 1.29 1.87 0 134 MET 4.03 -6.98 0 14 SER 1.12 -3.03 1 15 ASN 1.36 -1.36 1 16 SER 1.93 -1.92 1 17 LYS 2.96 -2.19 1 18 PHE 2.12 -1.68 1 19 LEU 0.57 -5.70 1 22 GLN -3.08 -2.95 1 24 LEU -3.67 -5.71 1 25 VAL -0.69 -4.45 1 26 LEU -7.70 -5.87 1 27 TYR -0.25 -3.76 1 29 GLN -3.42 -2.91 1 30 ILE 3.85 -0.75 1 32 ASP -0.08 -3.54 1 33 LYS -4.61 -5.56 1 34 LEU -7.41 -7.01 1 35 ASP -2.27 -4.28 1 36 ILE -1.48 -4.05 1 37 ILE -5.23 -2.71 1 40 LYS 3.10 -2.16 1 41 VAL -1.22 -3.83 1 42 ASP -1.83 -1.98 1 43 SER 3.09 -1.96 1 44 LYS 1.47 -2.16 1 45 THR -0.14 -2.99 1 46 VAL 1.89 -2.39 1 48 GLN -1.71 -3.39 1 49 TYR 1.04 -4.41 1 52 TYR -6.24 -4.04 1 53 LYS -2.62 -3.47 1 54 VAL -0.60 -5.06 1 55 TYR -4.86 -4.82 1 56 MET -1.66 -3.01 1 57 VAL -6.66 -4.59 1 58 ASP -2.98 -3.62 1 59 LYS 3.42 -2.32 1 60 ASP 3.40 -0.67 1 61 GLN 2.76 -0.50 1 62 ALA 3.29 -0.83 1 63 ASP 3.90 -0.52 1 64 ARG -0.30 -3.54 1 66 THR -3.14 -3.42 1 67 ILE -3.34 -3.34 1 68 LYS -2.14 -2.07 1 69 LYS 3.10 -2.40 1 70 GLU 2.67 -2.90 1 71 ASN -1.08 -3.59 1 72 THR -2.92 -5.33 1 74 LEU 0.32 -4.27 1 75 LEU -4.65 -6.10 1 76 ASN 3.68 -3.04 1 78 ALA -0.68 -2.47 1 81 ASP -0.80 -3.17 1 82 GLN -4.62 -5.00 1 83 ASP 0.24 -2.83 1 84 ILE -1.52 -5.61 1 85 LYS -5.93 -4.44 1 86 PHE -3.88 -5.32 1 87 THR -0.67 -4.44 1 88 ILE -0.64 -4.99 1 89 LYS -1.60 -2.87 1 90 PHE 3.51 -4.52 1 91 GLN -4.44 -4.00 1 92 GLU -1.35 -3.51 1 93 PHE -1.30 -3.86 1 94 SER -2.58 -2.77 1 96 ASN -1.23 -2.78 1 97 LEU 1.79 -3.46 1 98 TRP 0.71 -2.49 1 100 LEU -0.72 -5.46 1 101 GLU -4.17 -4.46 1 102 PHE -3.46 -4.98 1 103 GLN -4.69 -4.10 1 104 LYS 1.64 -2.70 1 105 ASN 4.06 -4.66 1 106 LYS -3.46 -6.27 1 107 ASP -2.97 -3.54 1 108 TYR -4.40 -4.86 1 109 TYR -4.75 -3.52 1 110 ILE -4.42 -2.79 1 111 ILE -7.83 -5.06 1 112 SER -3.70 -3.56 1 113 THR 2.66 -2.51 1 114 SER 2.37 -3.71 1 115 ASN -0.28 -1.77 1 117 SER -3.35 -1.18 1 118 LEU 5.80 -0.93 1 119 GLU 4.13 -1.72 1 121 LEU 1.74 -0.89 1 122 ASP 0.68 -4.22 1 123 ASN 2.43 -0.06 1 124 GLN -0.29 -5.30 1 125 GLU -4.86 -3.84 1 128 VAL 5.52 0.04 1 130 GLN 0.25 -0.45 1 131 THR 3.09 -0.64 1 132 ARG -2.94 -4.81 1 133 ALA 2.50 -5.12 1 135 LYS -6.12 -4.66 1 136 ILE -3.83 -4.50 1 137 LEU -2.41 -6.36 1 138 MET -3.00 -5.47 1 139 LYS 4.54 -3.58 1 140 VAL 3.83 -3.58 1 142 GLN -3.18 -4.74 1 143 ASP -2.46 -3.25 1 144 ALA 1.38 -2.10 1 145 SER 1.40 -2.25 1 146 SER 0.49 -2.78 1 147 ALA 0.46 -2.28 1 149 SER -0.10 -2.55 1 150 THR 0.13 -3.77 1 stop_ save_