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 bmr6944_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 -2.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 5.50 _LACS_plot.Y_axis_chem_shift_offset -0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 TYR 1.40 5.55 0 10 SER 0.73 0.31 1 11 ASP -0.46 0.51 1 12 GLN 3.14 1.94 1 13 PHE 1.60 -0.36 1 15 ARG 2.57 2.23 1 16 TYR -5.34 -0.89 1 21 LEU 0.80 1.65 1 22 ILE -2.30 -0.51 1 23 ALA -5.43 -2.53 1 24 LYS -4.37 -1.30 1 25 VAL -0.16 -0.14 1 26 GLU -6.09 -1.89 1 28 LYS -4.29 -1.22 1 30 ASN 2.26 1.00 1 32 ILE 1.24 1.26 1 33 LYS -2.81 -0.63 1 34 THR 0.61 1.14 1 35 VAL -1.34 -1.02 1 36 ILE 3.59 0.07 1 37 VAL 4.27 4.00 1 38 ASN -0.40 -1.66 1 39 MET 2.20 2.83 1 40 VAL 7.22 5.47 1 41 ASP 3.05 3.13 1 42 VAL 6.33 5.47 1 43 ALA 5.19 3.37 1 44 LYS 4.27 3.50 1 45 ALA 2.94 2.01 1 46 LEU -0.37 -1.00 1 47 ASN 1.96 1.00 1 51 THR 2.98 1.74 1 55 LYS 1.03 0.88 1 57 PHE 2.78 0.53 1 60 GLU 1.46 1.98 1 61 LEU -0.67 0.18 1 63 ALA -7.12 -2.45 1 64 GLN 0.48 0.46 1 65 THR -6.16 -2.68 1 66 GLN -3.95 -0.72 1 67 PHE -5.19 -4.49 1 69 VAL 4.29 3.13 1 70 LYS 3.68 2.62 1 71 ASN -0.99 -0.48 1 72 ASP 3.06 1.67 1 73 ARG -3.42 -1.10 1 74 TYR 1.40 1.42 1 75 ILE -4.95 -0.80 1 76 VAL -3.69 -1.90 1 77 ASN 3.17 2.80 1 79 SER -1.87 -2.43 1 80 HIS -4.84 -0.62 1 81 GLU -0.80 -0.14 1 82 ALA 4.89 3.96 1 83 ASN 5.20 3.65 1 84 LYS 3.68 2.62 1 85 LEU 3.68 2.17 1 86 GLN 2.79 3.06 1 88 MET 2.51 4.01 1 90 ASP 5.72 4.62 1 92 PHE 2.49 4.07 1 94 LYS 4.27 3.80 1 95 LYS 0.73 2.32 1 96 PHE 0.12 0.82 1 97 VAL 1.62 2.82 1 101 GLU 0.38 1.63 1 103 GLU 4.81 2.52 1 104 ASN -0.65 2.42 1 106 GLU 1.26 -0.44 1 108 ASP -4.61 -0.99 1 109 LEU -3.92 -1.89 1 110 HIS -2.17 -0.61 1 111 VAL 0.42 0.74 1 112 ASN -1.75 -1.33 1 114 LYS 3.68 2.91 1 115 LYS -0.75 -0.63 1 116 GLN 5.20 1.35 1 117 THR -5.11 -2.52 1 118 ILE -1.81 -0.02 1 120 ASN -3.35 -1.36 1 121 SER -3.06 -1.25 1 123 LYS 2.50 2.32 1 124 ALA 1.06 2.19 1 127 TYR 1.78 2.69 1 128 ARG -3.15 -1.13 1 130 MET -3.09 -1.30 1 131 LEU -0.38 -0.12 1 132 ASP -0.18 0.49 1 133 THR 1.57 0.33 1 134 HIS 3.20 2.77 1 135 HIS 0.16 3.96 1 137 LEU 2.28 2.24 1 139 THR 5.93 4.69 1 140 PHE 4.52 4.33 1 141 ILE 5.66 4.80 1 142 LEU 3.17 3.13 1 143 LYS -0.45 0.26 1 144 ASN -1.16 -0.15 1 147 GLU -0.22 0.15 1 148 ASN 0.11 0.12 1 149 SER 0.22 0.39 1 150 ASP -0.04 0.16 1 151 SER 0.66 0.58 1 153 THR 0.57 0.51 1 164 LYS 0.14 0.23 1 166 LYS 0.08 0.18 1 167 ASP 1.41 -1.03 1 169 GLU -0.62 0.02 1 170 ASN 0.13 1.69 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6944_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 4.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.93 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset -0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 TYR 1.40 4.15 0 10 SER 0.73 -0.42 1 11 ASP -0.46 0.97 1 12 GLN 3.14 -1.20 1 13 PHE 1.60 -1.96 1 15 ARG 2.57 -0.34 1 16 TYR -5.34 4.45 1 21 LEU 0.80 0.85 1 22 ILE -2.30 1.79 1 23 ALA -5.43 2.90 1 24 LYS -4.37 3.07 1 25 VAL -0.16 0.02 1 26 GLU -6.09 4.20 1 28 LYS -4.29 3.07 1 30 ASN 2.26 -1.26 1 32 ILE 1.24 0.02 1 33 LYS -2.81 2.18 1 34 THR 0.61 0.53 1 35 VAL -1.34 0.32 1 36 ILE 3.59 -3.52 1 37 VAL 4.27 -0.27 1 38 ASN -0.40 -1.26 1 39 MET 2.20 0.63 1 40 VAL 7.22 -1.75 1 41 ASP 3.05 0.08 1 42 VAL 6.33 -0.86 1 43 ALA 5.19 -1.82 1 44 LYS 4.27 -0.77 1 45 ALA 2.94 -0.93 1 46 LEU -0.37 -0.63 1 47 ASN 1.96 -0.96 1 51 THR 2.98 -1.24 1 55 LYS 1.03 -0.15 1 57 PHE 2.78 -2.25 1 60 GLU 1.46 0.52 1 61 LEU -0.67 0.85 1 63 ALA -7.12 4.67 1 64 GLN 0.48 -0.02 1 65 THR -6.16 3.48 1 66 GLN -3.95 3.23 1 67 PHE -5.19 0.70 1 69 VAL 4.29 -1.16 1 70 LYS 3.68 -1.06 1 71 ASN -0.99 0.51 1 72 ASP 3.06 -1.39 1 73 ARG -3.42 2.32 1 74 TYR 1.40 0.02 1 75 ILE -4.95 4.15 1 76 VAL -3.69 1.79 1 77 ASN 3.17 -0.37 1 79 SER -1.87 -0.56 1 80 HIS -4.84 4.22 1 81 GLU -0.80 0.66 1 82 ALA 4.89 -0.93 1 83 ASN 5.20 -1.55 1 84 LYS 3.68 -1.06 1 85 LEU 3.68 -1.51 1 86 GLN 2.79 0.27 1 88 MET 2.51 1.50 1 90 ASP 5.72 -1.10 1 92 PHE 2.49 1.58 1 94 LYS 4.27 -0.47 1 95 LYS 0.73 1.59 1 96 PHE 0.12 0.70 1 97 VAL 1.62 1.20 1 101 GLU 0.38 1.25 1 103 GLU 4.81 -2.29 1 104 ASN -0.65 3.07 1 106 GLU 1.26 -1.70 1 108 ASP -4.61 3.62 1 109 LEU -3.92 2.03 1 110 HIS -2.17 1.56 1 111 VAL 0.42 0.32 1 112 ASN -1.75 0.42 1 114 LYS 3.68 -0.77 1 115 LYS -0.75 0.12 1 116 GLN 5.20 -3.85 1 117 THR -5.11 2.59 1 118 ILE -1.81 1.79 1 120 ASN -3.35 1.99 1 121 SER -3.06 1.81 1 123 LYS 2.50 -0.18 1 124 ALA 1.06 1.13 1 127 TYR 1.78 0.91 1 128 ARG -3.15 2.02 1 130 MET -3.09 1.79 1 131 LEU -0.38 0.26 1 132 ASP -0.18 0.67 1 133 THR 1.57 -1.24 1 134 HIS 3.20 -0.43 1 135 HIS 0.16 3.80 1 137 LEU 2.28 -0.04 1 139 THR 5.93 -1.24 1 140 PHE 4.52 -0.19 1 141 ILE 5.66 -0.86 1 142 LEU 3.17 -0.04 1 143 LYS -0.45 0.71 1 144 ASN -1.16 1.01 1 147 GLU -0.22 0.37 1 148 ASN 0.11 0.01 1 149 SER 0.22 0.17 1 150 ASP -0.04 0.20 1 151 SER 0.66 -0.08 1 153 THR 0.57 -0.06 1 164 LYS 0.14 0.09 1 166 LYS 0.08 0.10 1 167 ASP 1.41 -2.44 1 169 GLU -0.62 0.64 1 170 ASN 0.13 1.56 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6944_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 0.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.27 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _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 92 PHE 2.49 -1.19 0 36 ILE 3.59 0.70 0 12 GLN 3.14 -0.19 1 13 PHE 1.60 0.00 1 15 ARG 2.57 -0.55 1 16 TYR -5.34 0.13 1 21 LEU 0.80 -0.15 1 22 ILE -2.30 0.05 1 23 ALA -5.43 1.29 1 24 LYS -4.37 0.57 1 25 VAL -0.16 0.97 1 26 GLU -6.09 0.45 1 28 LYS -4.29 0.24 1 30 ASN 2.26 -0.07 1 32 ILE 1.24 0.16 1 33 LYS -2.81 0.80 1 34 THR 0.61 0.54 1 35 VAL -1.34 0.25 1 37 VAL 4.27 -0.30 1 38 ASN -0.40 0.78 1 39 MET 2.20 -0.29 1 40 VAL 7.22 -0.67 1 41 ASP 3.05 -0.15 1 42 VAL 6.33 -0.71 1 43 ALA 5.19 -0.61 1 44 LYS 4.27 -0.08 1 45 ALA 2.94 0.07 1 46 LEU -0.37 0.02 1 47 ASN 1.96 -0.26 1 51 THR 2.98 -0.98 1 56 TYR 1.40 -0.72 1 57 PHE 2.78 -0.07 1 60 GLU 1.46 -0.43 1 61 LEU -0.67 -0.04 1 63 ALA -7.12 0.50 1 64 GLN 0.48 -0.04 1 65 THR -6.16 0.77 1 66 GLN -3.95 0.02 1 67 PHE -5.19 0.58 1 69 VAL 4.29 -0.37 1 70 LYS 3.68 -0.16 1 71 ASN -0.99 0.22 1 72 ASP 3.06 -0.24 1 73 ARG -3.42 0.36 1 74 TYR 1.40 0.11 1 75 ILE -4.95 0.96 1 76 VAL -3.69 0.37 1 77 ASN 3.17 -0.22 1 79 SER -1.87 -0.42 1 80 HIS -4.84 0.08 1 81 GLU -0.80 -0.13 1 82 ALA 4.89 -0.61 1 83 ASN 5.20 -0.32 1 84 LYS 3.68 -0.04 1 85 LEU 3.68 -0.69 1 88 MET 2.51 0.06 1 90 ASP 5.72 -0.04 1 94 LYS 4.27 -0.59 1 95 LYS 0.73 -0.39 1 96 PHE 0.12 -0.19 1 97 VAL 1.62 -0.11 1 101 GLU 0.38 -0.02 1 103 GLU 4.81 -0.27 1 106 GLU 1.26 0.12 1 108 ASP -4.61 0.58 1 109 LEU -3.92 0.89 1 110 HIS -2.17 0.25 1 111 VAL 0.42 0.27 1 112 ASN -1.75 0.36 1 114 LYS 3.68 -0.08 1 115 LYS -0.75 0.02 1 116 GLN 5.20 -0.56 1 117 THR -5.11 0.42 1 118 ILE -1.81 0.43 1 120 ASN -3.35 1.15 1 121 SER -3.06 0.98 1 123 LYS 2.50 -0.08 1 124 ALA 1.06 0.11 1 127 TYR 1.78 -0.29 1 128 ARG -3.15 0.34 1 130 MET -3.09 0.77 1 131 LEU -0.38 0.12 1 132 ASP -0.18 0.04 1 133 THR 1.57 0.44 1 137 LEU 2.28 -0.12 1 139 THR 5.93 -0.37 1 140 PHE 4.52 -0.45 1 141 ILE 5.66 -1.06 1 142 LEU 3.17 -0.58 1 143 LYS -0.45 -0.09 1 144 ASN -1.16 -0.05 1 147 GLU -0.22 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6944_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 -2.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.96 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 1.84 _LACS_plot.Y_axis_chem_shift_offset 0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 103 GLU 4.81 -2.49 0 10 SER 0.73 0.00 1 11 ASP -0.46 1.19 1 12 GLN 3.14 1.11 1 13 PHE 1.60 -0.79 1 15 ARG 2.57 -0.88 1 16 TYR -5.34 -1.77 1 21 LEU 0.80 -1.49 1 22 ILE -2.30 -2.66 1 23 ALA -5.43 -2.01 1 24 LYS -4.37 -2.38 1 25 VAL -0.16 -0.18 1 26 GLU -6.09 -0.43 1 28 LYS -4.29 -0.26 1 30 ASN 2.26 0.61 1 32 ILE 1.24 -1.43 1 33 LYS -2.81 -3.11 1 34 THR 0.61 -2.10 1 35 VAL -1.34 -0.01 1 36 ILE 3.59 1.09 1 37 VAL 4.27 0.44 1 38 ASN -0.40 0.64 1 39 MET 2.20 1.22 1 40 VAL 7.22 1.38 1 41 ASP 3.05 2.99 1 42 VAL 6.33 0.15 1 43 ALA 5.19 1.72 1 44 LYS 4.27 3.65 1 45 ALA 2.94 0.10 1 46 LEU -0.37 -1.45 1 47 ASN 1.96 0.57 1 51 THR 2.98 1.14 1 55 LYS 1.03 1.88 1 56 TYR 1.40 0.75 1 57 PHE 2.78 2.29 1 60 GLU 1.46 2.13 1 61 LEU -0.67 0.19 1 63 ALA -7.12 -1.30 1 64 GLN 0.48 -1.46 1 65 THR -6.16 -0.75 1 66 GLN -3.95 -2.92 1 67 PHE -5.19 -1.04 1 69 VAL 4.29 2.77 1 70 LYS 3.68 -0.56 1 71 ASN -0.99 -2.20 1 72 ASP 3.06 -1.88 1 73 ARG -3.42 -3.11 1 74 TYR 1.40 -2.07 1 75 ILE -4.95 -1.68 1 76 VAL -3.69 -1.86 1 77 ASN 3.17 0.48 1 79 SER -1.87 -1.93 1 80 HIS -4.84 -0.43 1 81 GLU -0.80 1.01 1 82 ALA 4.89 1.11 1 83 ASN 5.20 1.70 1 84 LYS 3.68 2.83 1 85 LEU 3.68 0.46 1 86 GLN 2.79 2.93 1 88 MET 2.51 3.02 1 90 ASP 5.72 2.45 1 92 PHE 2.49 0.65 1 94 LYS 4.27 -0.22 1 95 LYS 0.73 1.58 1 96 PHE 0.12 -0.67 1 97 VAL 1.62 -2.40 1 101 GLU 0.38 0.58 1 106 GLU 1.26 -2.20 1 108 ASP -4.61 -1.61 1 109 LEU -3.92 -1.38 1 110 HIS -2.17 0.57 1 111 VAL 0.42 -1.78 1 114 LYS 3.68 1.60 1 115 LYS -0.75 -1.21 1 116 GLN 5.20 -1.78 1 117 THR -5.11 -1.53 1 118 ILE -1.81 -2.11 1 120 ASN -3.35 -1.33 1 121 SER -3.06 -2.43 1 123 LYS 2.50 -0.17 1 124 ALA 1.06 0.97 1 127 TYR 1.78 -1.66 1 128 ARG -3.15 -1.76 1 130 MET -3.09 0.17 1 131 LEU -0.38 -0.80 1 132 ASP -0.18 0.77 1 133 THR 1.57 -0.98 1 134 HIS 3.20 1.47 1 135 HIS 0.16 0.03 1 137 LEU 2.28 1.33 1 139 THR 5.93 0.79 1 140 PHE 4.52 1.83 1 141 ILE 5.66 0.32 1 142 LEU 3.17 0.44 1 143 LYS -0.45 -0.93 1 147 GLU -0.22 -0.36 1 149 SER 0.22 -0.31 1 150 ASP -0.04 0.15 1 151 SER 0.66 0.71 1 153 THR 0.57 0.73 1 164 LYS 0.14 0.31 1 166 LYS 0.08 -0.35 1 167 ASP 1.41 0.40 1 169 GLU -0.62 -1.31 1 stop_ save_