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 bmr4675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.16 _LACS_plot.Line_1_terminator_val_y_1 -4.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.57 _LACS_plot.Line_2_terminator_val_x_2 6.65 _LACS_plot.Line_2_terminator_val_y_2 5.57 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 LEU -8.16 -0.93 0 13 LEU -0.08 0.01 1 14 VAL -0.19 -0.02 1 16 ARG 0.44 0.44 1 18 SER 0.22 0.28 1 20 MET 0.21 0.27 1 21 LEU 0.11 0.14 1 22 GLU 0.63 2.07 1 26 ALA -0.11 0.10 1 27 VAL 0.54 0.30 1 28 THR -0.39 -0.23 1 32 LYS 0.34 0.28 1 35 SER -0.04 0.09 1 36 ARG 0.09 0.04 1 37 ARG 0.67 0.72 1 38 ASN -1.05 -0.94 1 39 ALA 1.48 1.20 1 40 TRP -0.13 -0.52 1 42 ASN 0.82 0.69 1 43 GLN -0.45 0.47 1 44 SER -1.98 -0.84 1 45 TYR 5.30 5.12 1 46 ALA 5.06 3.58 1 47 GLU 2.97 2.82 1 48 LEU 2.65 3.12 1 49 ILE 5.11 4.46 1 50 SER 5.54 4.65 1 51 GLN 4.08 3.18 1 52 ALA 4.59 2.27 1 53 ILE 5.37 5.06 1 54 GLU 2.34 2.27 1 55 SER 0.81 0.98 1 56 ALA -0.84 -0.18 1 59 LYS 3.79 -0.19 1 60 ARG -3.86 -2.07 1 62 THR -2.54 -1.20 1 63 LEU 4.24 3.58 1 64 ALA 3.68 2.86 1 65 GLN 1.72 2.82 1 66 ILE 6.65 5.57 1 67 TYR 3.37 1.41 1 68 GLU 3.14 2.99 1 69 TRP 5.73 5.16 1 70 MET 4.57 3.34 1 71 VAL 3.59 2.78 1 72 ARG 1.58 1.90 1 73 THR 2.72 2.67 1 74 VAL 0.52 0.21 1 76 TYR 2.18 2.55 1 77 PHE 2.12 0.68 1 78 LYS 2.78 2.56 1 79 ASP 0.25 -0.14 1 80 LYS -0.22 -0.64 1 82 ASP -0.75 -0.46 1 83 SER 2.29 1.91 1 84 ASN 1.66 1.52 1 85 SER 1.66 1.56 1 86 SER 0.68 0.93 1 87 ALA 1.79 1.58 1 89 TRP 2.81 2.00 1 90 LYS 4.77 4.57 1 91 ASN 3.96 3.12 1 92 SER 5.52 4.28 1 93 ILE 5.69 3.73 1 94 ARG 5.29 4.31 1 95 HIS 2.75 4.17 1 96 ASN 2.76 4.60 1 97 LEU 4.27 2.47 1 98 SER 1.64 1.83 1 99 LEU -0.31 0.53 1 100 HIS 0.25 1.94 1 101 SER 2.37 1.52 1 102 LYS 1.56 1.31 1 103 PHE -3.77 -1.81 1 104 ILE -4.98 -1.58 1 105 LYS -1.42 -1.62 1 106 VAL -2.89 -1.06 1 107 HIS -0.19 1.36 1 108 ASN -0.57 -0.50 1 109 GLU 1.58 1.38 1 110 ALA 0.54 0.46 1 111 THR 0.90 0.62 1 113 LYS -0.76 -0.54 1 114 SER -0.01 0.12 1 115 SER 0.37 0.59 1 116 TRP -4.06 -1.12 1 117 TRP -2.05 -0.64 1 118 MET -6.28 -1.10 1 119 LEU 0.16 -0.27 1 120 ASN -1.16 -0.67 1 122 GLU -0.05 -0.01 1 125 LYS 0.40 0.29 1 126 SER 0.32 0.34 1 128 LYS -0.39 -0.27 1 129 ALA -1.06 -1.92 1 133 ARG -0.01 0.08 1 134 ALA -0.26 -0.02 1 135 ALA -0.08 0.09 1 136 SER 0.07 0.07 1 137 MET 0.16 0.24 1 138 ASP -0.14 0.20 1 139 SER 0.88 0.74 1 140 SER 1.29 1.09 1 141 SER 1.11 0.84 1 142 LYS 1.14 0.79 1 143 LEU 0.57 0.42 1 144 LEU 0.41 0.22 1 145 ARG 0.58 0.36 1 147 ARG -0.02 0.02 1 148 SER 0.14 0.20 1 149 LYS 0.04 0.14 1 150 ALA 0.26 1.38 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.16 _LACS_plot.Line_1_terminator_val_y_1 4.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.43 _LACS_plot.Line_2_terminator_val_x_2 6.65 _LACS_plot.Line_2_terminator_val_y_2 -1.08 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 LEU -8.16 7.23 0 13 LEU -0.08 0.09 1 14 VAL -0.19 0.17 1 16 ARG 0.44 0.00 1 18 SER 0.22 0.06 1 20 MET 0.21 0.06 1 21 LEU 0.11 0.03 1 22 GLU 0.63 1.44 1 26 ALA -0.11 0.21 1 27 VAL 0.54 -0.24 1 28 THR -0.39 0.16 1 32 LYS 0.34 -0.06 1 35 SER -0.04 0.13 1 36 ARG 0.09 -0.05 1 37 ARG 0.67 0.05 1 38 ASN -1.05 0.11 1 39 ALA 1.48 -0.28 1 40 TRP -0.13 -0.39 1 42 ASN 0.82 -0.13 1 43 GLN -0.45 0.92 1 44 SER -1.98 1.14 1 45 TYR 5.30 -0.18 1 46 ALA 5.06 -1.48 1 47 GLU 2.97 -0.15 1 48 LEU 2.65 0.47 1 49 ILE 5.11 -0.65 1 50 SER 5.54 -0.89 1 51 GLN 4.08 -0.90 1 52 ALA 4.59 -2.32 1 53 ILE 5.37 -0.31 1 54 GLU 2.34 -0.07 1 55 SER 0.81 0.17 1 56 ALA -0.84 0.66 1 59 LYS 3.79 -3.98 1 60 ARG -3.86 1.79 1 62 THR -2.54 1.34 1 63 LEU 4.24 -0.66 1 64 ALA 3.68 -0.82 1 65 GLN 1.72 1.10 1 66 ILE 6.65 -1.08 1 67 TYR 3.37 -1.96 1 68 GLU 3.14 -0.15 1 69 TRP 5.73 -0.57 1 70 MET 4.57 -1.23 1 71 VAL 3.59 -0.81 1 72 ARG 1.58 0.32 1 73 THR 2.72 -0.05 1 74 VAL 0.52 -0.31 1 76 TYR 2.18 0.37 1 77 PHE 2.12 -1.44 1 78 LYS 2.78 -0.22 1 79 ASP 0.25 -0.39 1 80 LYS -0.22 -0.42 1 82 ASP -0.75 0.29 1 83 SER 2.29 -0.38 1 84 ASN 1.66 -0.14 1 85 SER 1.66 -0.10 1 86 SER 0.68 0.25 1 87 ALA 1.79 -0.21 1 89 TRP 2.81 -0.81 1 90 LYS 4.77 -0.20 1 91 ASN 3.96 -0.84 1 92 SER 5.52 -1.24 1 93 ILE 5.69 -1.96 1 94 ARG 5.29 -0.98 1 95 HIS 2.75 1.42 1 96 ASN 2.76 1.84 1 97 LEU 4.27 -1.80 1 98 SER 1.64 0.19 1 99 LEU -0.31 0.84 1 100 HIS 0.25 1.69 1 101 SER 2.37 -0.85 1 102 LYS 1.56 -0.25 1 103 PHE -3.77 1.96 1 104 ILE -4.98 3.40 1 105 LYS -1.42 -0.20 1 106 VAL -2.89 1.83 1 107 HIS -0.19 1.55 1 108 ASN -0.57 0.07 1 109 GLU 1.58 -0.20 1 110 ALA 0.54 -0.08 1 111 THR 0.90 -0.28 1 113 LYS -0.76 0.22 1 114 SER -0.01 0.13 1 115 SER 0.37 0.22 1 116 TRP -4.06 2.94 1 117 TRP -2.05 1.41 1 118 MET -6.28 5.18 1 119 LEU 0.16 -0.43 1 120 ASN -1.16 0.49 1 122 GLU -0.05 0.04 1 125 LYS 0.40 -0.11 1 126 SER 0.32 0.02 1 128 LYS -0.39 0.12 1 129 ALA -1.06 -0.86 1 133 ARG -0.01 0.09 1 134 ALA -0.26 0.24 1 135 ALA -0.08 0.17 1 136 SER 0.07 0.00 1 137 MET 0.16 0.08 1 138 ASP -0.14 0.34 1 139 SER 0.88 -0.14 1 140 SER 1.29 -0.20 1 141 SER 1.11 -0.27 1 142 LYS 1.14 -0.35 1 143 LEU 0.57 -0.15 1 144 LEU 0.41 -0.19 1 145 ARG 0.58 -0.22 1 147 ARG -0.02 0.04 1 148 SER 0.14 0.06 1 149 LYS 0.04 0.10 1 150 ALA 0.26 1.12 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.16 _LACS_plot.Line_1_terminator_val_y_1 0.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 6.65 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 ALA 4.59 -2.32 0 13 LEU -0.08 0.00 1 14 VAL -0.19 -0.07 1 16 ARG 0.44 -0.05 1 18 SER 0.22 -0.09 1 20 MET 0.21 -0.09 1 21 LEU 0.11 -0.03 1 22 GLU 0.63 -0.39 1 26 ALA -0.11 0.00 1 27 VAL 0.54 0.03 1 28 THR -0.39 0.04 1 35 SER -0.04 -0.05 1 36 ARG 0.09 0.00 1 37 ARG 0.67 -0.22 1 38 ASN -1.05 -0.29 1 39 ALA 1.48 -0.41 1 40 TRP -0.13 -0.32 1 42 ASN 0.82 -0.12 1 43 GLN -0.45 0.11 1 44 SER -1.98 0.18 1 45 TYR 5.30 -0.32 1 46 ALA 5.06 -0.28 1 47 GLU 2.97 -0.30 1 48 LEU 2.65 -0.22 1 49 ILE 5.11 -1.16 1 50 SER 5.54 -0.38 1 51 GLN 4.08 -0.50 1 53 ILE 5.37 -1.00 1 54 GLU 2.34 -0.45 1 55 SER 0.81 -0.12 1 56 ALA -0.84 0.09 1 59 LYS 3.79 -0.08 1 60 ARG -3.86 0.97 1 61 LEU -8.16 0.92 1 62 THR -2.54 0.63 1 63 LEU 4.24 -0.65 1 64 ALA 3.68 -0.39 1 65 GLN 1.72 -0.16 1 66 ILE 6.65 -0.64 1 67 TYR 3.37 -0.01 1 68 GLU 3.14 -0.35 1 69 TRP 5.73 -0.70 1 70 MET 4.57 -0.56 1 71 VAL 3.59 -0.71 1 72 ARG 1.58 -0.26 1 73 THR 2.72 -0.47 1 74 VAL 0.52 -0.19 1 76 TYR 2.18 -0.54 1 77 PHE 2.12 -0.74 1 78 LYS 2.78 -0.11 1 79 ASP 0.25 0.05 1 80 LYS -0.22 0.29 1 82 ASP -0.75 0.08 1 83 SER 2.29 -0.26 1 84 ASN 1.66 -0.09 1 86 SER 0.68 -0.19 1 87 ALA 1.79 -0.31 1 89 TRP 2.81 -0.13 1 90 LYS 4.77 -0.97 1 91 ASN 3.96 -0.40 1 92 SER 5.52 -0.25 1 93 ILE 5.69 -0.70 1 94 ARG 5.29 -0.71 1 95 HIS 2.75 -0.39 1 96 ASN 2.76 -0.49 1 97 LEU 4.27 -0.64 1 98 SER 1.64 -0.05 1 99 LEU -0.31 -0.05 1 100 HIS 0.25 0.04 1 102 LYS 1.56 -0.21 1 103 PHE -3.77 1.03 1 104 ILE -4.98 0.56 1 105 LYS -1.42 -0.08 1 106 VAL -2.89 0.02 1 107 HIS -0.19 -0.27 1 108 ASN -0.57 -0.24 1 109 GLU 1.58 -0.29 1 110 ALA 0.54 0.00 1 111 THR 0.90 -0.15 1 113 LYS -0.76 0.08 1 114 SER -0.01 -0.05 1 115 SER 0.37 -0.18 1 116 TRP -4.06 0.00 1 117 TRP -2.05 0.65 1 118 MET -6.28 0.58 1 119 LEU 0.16 0.57 1 120 ASN -1.16 -0.38 1 122 GLU -0.05 -0.11 1 125 LYS 0.40 0.01 1 128 LYS -0.39 0.00 1 129 ALA -1.06 0.24 1 133 ARG -0.01 -0.05 1 134 ALA -0.26 -0.04 1 135 ALA -0.08 -0.02 1 136 SER 0.07 -0.06 1 137 MET 0.16 0.02 1 138 ASP -0.14 -0.01 1 139 SER 0.88 -0.06 1 140 SER 1.29 -0.06 1 141 SER 1.11 -0.09 1 142 LYS 1.14 -0.08 1 143 LEU 0.57 -0.05 1 144 LEU 0.41 -0.03 1 145 ARG 0.58 -0.04 1 147 ARG -0.02 0.05 1 149 LYS 0.04 0.00 1 150 ALA 0.26 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4675_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.16 _LACS_plot.Line_1_terminator_val_y_1 -3.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.81 _LACS_plot.Line_2_terminator_val_x_2 6.65 _LACS_plot.Line_2_terminator_val_y_2 2.65 _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 59 LYS 3.79 -2.73 0 61 LEU -8.16 -0.40 0 13 LEU -0.08 -0.56 1 16 ARG 0.44 0.69 1 20 MET 0.21 -0.50 1 26 ALA -0.11 0.05 1 27 VAL 0.54 0.12 1 28 THR -0.39 -0.01 1 32 LYS 0.34 0.44 1 35 SER -0.04 1.75 1 36 ARG 0.09 -0.18 1 37 ARG 0.67 -0.51 1 38 ASN -1.05 0.00 1 39 ALA 1.48 -0.49 1 40 TRP -0.13 -0.31 1 42 ASN 0.82 0.33 1 43 GLN -0.45 -0.05 1 44 SER -1.98 1.22 1 45 TYR 5.30 2.26 1 46 ALA 5.06 2.43 1 47 GLU 2.97 2.61 1 48 LEU 2.65 0.33 1 49 ILE 5.11 1.12 1 50 SER 5.54 0.61 1 51 GLN 4.08 2.34 1 52 ALA 4.59 1.72 1 53 ILE 5.37 1.35 1 54 GLU 2.34 1.13 1 55 SER 0.81 -0.70 1 60 ARG -3.86 -2.48 1 62 THR -2.54 0.86 1 63 LEU 4.24 0.15 1 64 ALA 3.68 3.35 1 65 GLN 1.72 4.08 1 66 ILE 6.65 1.46 1 67 TYR 3.37 2.34 1 68 GLU 3.14 1.85 1 69 TRP 5.73 3.47 1 71 VAL 3.59 1.19 1 72 ARG 1.58 1.80 1 73 THR 2.72 -0.52 1 76 TYR 2.18 -0.30 1 77 PHE 2.12 0.20 1 78 LYS 2.78 0.89 1 79 ASP 0.25 0.44 1 80 LYS -0.22 0.64 1 82 ASP -0.75 0.54 1 83 SER 2.29 0.78 1 84 ASN 1.66 1.45 1 85 SER 1.66 0.86 1 86 SER 0.68 -0.19 1 87 ALA 1.79 1.41 1 89 TRP 2.81 2.53 1 90 LYS 4.77 3.17 1 91 ASN 3.96 2.65 1 92 SER 5.52 3.03 1 93 ILE 5.69 0.11 1 94 ARG 5.29 2.56 1 95 HIS 2.75 3.59 1 96 ASN 2.76 1.79 1 97 LEU 4.27 -0.68 1 98 SER 1.64 0.41 1 101 SER 2.37 -0.05 1 102 LYS 1.56 -1.06 1 103 PHE -3.77 -1.04 1 104 ILE -4.98 -3.65 1 105 LYS -1.42 -0.08 1 106 VAL -2.89 -1.54 1 107 HIS -0.19 0.02 1 108 ASN -0.57 -0.07 1 109 GLU 1.58 0.33 1 110 ALA 0.54 0.34 1 111 THR 0.90 1.01 1 113 LYS -0.76 0.00 1 114 SER -0.01 -1.26 1 115 SER 0.37 -1.44 1 116 TRP -4.06 -1.67 1 117 TRP -2.05 -0.75 1 118 MET -6.28 -1.46 1 119 LEU 0.16 -0.11 1 122 GLU -0.05 0.58 1 125 LYS 0.40 0.32 1 126 SER 0.32 0.51 1 128 LYS -0.39 -0.56 1 133 ARG -0.01 -0.38 1 134 ALA -0.26 -0.39 1 135 ALA -0.08 0.02 1 136 SER 0.07 0.14 1 137 MET 0.16 -0.36 1 138 ASP -0.14 0.31 1 139 SER 0.88 0.61 1 140 SER 1.29 0.57 1 141 SER 1.11 0.50 1 142 LYS 1.14 0.17 1 143 LEU 0.57 -0.25 1 145 ARG 0.58 0.53 1 147 ARG -0.02 0.10 1 148 SER 0.14 -0.38 1 149 LYS 0.04 -1.48 1 stop_ save_