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 bmr15954_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 -2.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 6.02 _LACS_plot.Line_2_terminator_val_y_2 4.69 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 LYS 4.03 -0.54 0 36 ARG -3.46 -4.89 0 11 ASP -0.51 0.00 1 12 ALA 0.75 0.73 1 14 ALA -0.46 0.01 1 15 SER -0.31 0.02 1 16 ALA 0.99 1.70 1 17 THR -6.04 -2.75 1 18 PHE -1.72 -0.91 1 20 MET 0.27 -0.47 1 21 GLN 1.79 1.89 1 23 SER 2.83 1.71 1 24 ALA -0.95 -0.24 1 25 LEU 0.14 0.07 1 26 ARG -6.20 -2.52 1 27 LYS 3.54 2.60 1 28 ASN 4.93 3.28 1 30 PHE -4.54 -1.08 1 31 VAL -2.88 -0.97 1 32 VAL 2.43 -0.01 1 33 LEU -4.95 -1.87 1 39 LYS -3.11 -1.51 1 40 ILE 3.14 2.31 1 41 VAL -0.48 -0.49 1 42 GLU -3.93 -0.46 1 43 MET -3.13 0.01 1 44 SER -2.49 -0.95 1 45 THR -0.72 -0.09 1 46 SER -2.25 -0.71 1 47 LYS -0.33 0.18 1 48 THR 0.01 0.15 1 50 LYS 1.36 1.15 1 51 HIS 0.65 0.90 1 53 HIS -0.80 0.66 1 54 ALA -1.43 -0.24 1 55 LYS -3.48 -1.03 1 56 VAL -2.42 -1.22 1 57 HIS -3.23 -1.28 1 58 LEU -4.77 -0.48 1 59 VAL -1.44 -0.97 1 61 ILE -3.89 -3.02 1 62 ASP -2.20 0.97 1 63 ILE 4.82 3.03 1 64 PHE 1.04 2.56 1 65 THR -1.93 0.15 1 67 LYS 0.40 0.91 1 68 LYS -1.05 -0.54 1 69 TYR -5.29 -0.55 1 70 GLU -7.33 -2.40 1 71 ASP -5.59 -0.97 1 72 ILE -2.68 -0.84 1 75 SER 5.02 4.14 1 76 THR -0.24 -0.82 1 77 HIS -1.78 1.14 1 78 ASN 0.09 0.13 1 79 MET -4.34 -2.41 1 80 ASP -0.75 0.24 1 81 VAL -3.63 -3.40 1 83 ASN 0.33 0.13 1 84 ILE -1.23 -0.60 1 85 LYS -3.72 -1.51 1 86 ARG -3.78 -1.31 1 87 ASN -5.72 -0.35 1 88 ASP -3.17 -1.21 1 89 PHE -7.44 -2.04 1 90 GLN 0.83 1.17 1 91 LEU -0.10 -0.41 1 92 ILE -0.51 -0.12 1 94 ILE -1.71 0.61 1 95 GLN -2.08 -0.53 1 96 ASP 1.91 1.21 1 98 TYR -0.93 0.42 1 99 LEU -1.07 -1.14 1 100 SER 0.90 -0.22 1 101 LEU -3.98 -2.35 1 102 LEU -3.25 -0.41 1 103 GLN -2.32 -0.53 1 104 ASP 3.86 2.91 1 105 SER -0.07 0.02 1 107 GLU -1.27 -0.46 1 108 VAL -1.93 -0.73 1 109 ARG -3.06 -1.31 1 110 GLU -2.00 -1.19 1 111 ASP 0.22 0.00 1 112 LEU -0.59 -0.90 1 113 ARG -0.63 -0.34 1 114 LEU -1.23 0.37 1 116 GLU -1.51 -0.46 1 118 ASP -0.75 -0.97 1 119 LEU 3.52 2.73 1 121 LYS 3.54 2.60 1 122 GLU 3.09 2.93 1 123 ILE 6.03 5.45 1 124 GLU 3.58 4.14 1 125 GLN 4.70 3.83 1 126 LYS 4.03 3.33 1 127 TYR 3.43 3.57 1 128 ASP 3.13 2.91 1 131 GLU -0.30 0.02 1 132 GLU -0.30 -0.22 1 133 ILE -5.11 -1.09 1 134 LEU -4.22 -2.11 1 135 ILE -3.89 -3.75 1 136 THR 0.98 0.64 1 137 VAL -2.17 -0.97 1 138 LEU -5.67 -1.62 1 139 SER -3.70 -2.16 1 140 ALA -3.36 0.01 1 141 MET 1.97 1.47 1 142 THR 2.67 2.09 1 143 GLU -3.44 -0.94 1 144 GLU -6.60 -1.67 1 145 ALA -4.82 -0.48 1 146 ALA -0.33 -0.35 1 147 VAL -2.65 -0.97 1 148 ALA -4.10 -0.24 1 149 ILE -4.14 -1.33 1 150 LYS -3.72 -1.03 1 151 ALA -0.61 -0.14 1 152 MET 0.75 0.74 1 153 ALA -0.22 1.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15954_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 5.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 6.02 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 LYS 4.03 -4.57 0 36 ARG -3.46 -1.43 0 11 ASP -0.51 0.51 1 12 ALA 0.75 -0.02 1 14 ALA -0.46 0.47 1 15 SER -0.31 0.33 1 16 ALA 0.99 0.71 1 17 THR -6.04 3.29 1 18 PHE -1.72 0.81 1 20 MET 0.27 -0.74 1 21 GLN 1.79 0.10 1 23 SER 2.83 -1.12 1 24 ALA -0.95 0.71 1 25 LEU 0.14 -0.07 1 26 ARG -6.20 3.68 1 27 LYS 3.54 -0.94 1 28 ASN 4.93 -1.65 1 30 PHE -4.54 3.46 1 31 VAL -2.88 1.91 1 32 VAL 2.43 -2.44 1 33 LEU -4.95 3.08 1 39 LYS -3.11 1.60 1 40 ILE 3.14 -0.83 1 41 VAL -0.48 -0.01 1 42 GLU -3.93 3.47 1 43 MET -3.13 3.14 1 44 SER -2.49 1.54 1 45 THR -0.72 0.63 1 46 SER -2.25 1.54 1 47 LYS -0.33 0.51 1 48 THR 0.01 0.14 1 50 LYS 1.36 -0.21 1 51 HIS 0.65 0.25 1 53 HIS -0.80 1.46 1 54 ALA -1.43 1.19 1 55 LYS -3.48 2.45 1 56 VAL -2.42 1.20 1 57 HIS -3.23 1.95 1 58 LEU -4.77 4.29 1 59 VAL -1.44 0.47 1 61 ILE -3.89 0.87 1 62 ASP -2.20 3.17 1 63 ILE 4.82 -1.79 1 64 PHE 1.04 1.52 1 65 THR -1.93 2.08 1 67 LYS 0.40 0.51 1 68 LYS -1.05 0.51 1 69 TYR -5.29 4.74 1 70 GLU -7.33 4.93 1 71 ASP -5.59 4.62 1 72 ILE -2.68 1.84 1 75 SER 5.02 -0.88 1 76 THR -0.24 -0.58 1 77 HIS -1.78 2.92 1 78 ASN 0.09 0.04 1 79 MET -4.34 1.93 1 80 ASP -0.75 0.99 1 81 VAL -3.63 0.23 1 83 ASN 0.33 -0.20 1 84 ILE -1.23 0.63 1 85 LYS -3.72 2.21 1 86 ARG -3.78 2.47 1 87 ASN -5.72 5.37 1 88 ASP -3.17 1.96 1 89 PHE -7.44 5.40 1 90 GLN 0.83 0.34 1 91 LEU -0.10 -0.31 1 92 ILE -0.51 0.39 1 94 ILE -1.71 2.32 1 95 GLN -2.08 1.55 1 96 ASP 1.91 -0.70 1 98 TYR -0.93 1.35 1 99 LEU -1.07 -0.07 1 100 SER 0.90 -1.12 1 101 LEU -3.98 1.63 1 102 LEU -3.25 2.84 1 103 GLN -2.32 1.79 1 104 ASP 3.86 -0.95 1 105 SER -0.07 0.09 1 107 GLU -1.27 0.81 1 108 VAL -1.93 1.20 1 109 ARG -3.06 1.75 1 110 GLU -2.00 0.81 1 111 ASP 0.22 -0.22 1 112 LEU -0.59 -0.31 1 113 ARG -0.63 0.29 1 114 LEU -1.23 1.60 1 116 GLU -1.51 1.05 1 118 ASP -0.75 -0.22 1 119 LEU 3.52 -0.79 1 121 LYS 3.54 -0.94 1 122 GLU 3.09 -0.16 1 123 ILE 6.03 -0.58 1 124 GLU 3.58 0.56 1 125 GLN 4.70 -0.87 1 126 LYS 4.03 -0.70 1 127 TYR 3.43 0.14 1 128 ASP 3.13 -0.22 1 131 GLU -0.30 0.32 1 132 GLU -0.30 0.08 1 133 ILE -5.11 4.02 1 134 LEU -4.22 2.11 1 135 ILE -3.89 0.14 1 136 THR 0.98 -0.34 1 137 VAL -2.17 1.20 1 138 LEU -5.67 4.05 1 139 SER -3.70 1.54 1 140 ALA -3.36 3.37 1 141 MET 1.97 -0.50 1 142 THR 2.67 -0.58 1 143 GLU -3.44 2.50 1 144 GLU -6.60 4.93 1 145 ALA -4.82 4.34 1 146 ALA -0.33 -0.02 1 147 VAL -2.65 1.68 1 148 ALA -4.10 3.86 1 149 ILE -4.14 2.81 1 150 LYS -3.72 2.69 1 151 ALA -0.61 0.47 1 152 MET 0.75 -0.01 1 153 ALA -0.22 1.44 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15954_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.44 _LACS_plot.Line_1_terminator_val_y_1 0.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 6.02 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _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 123 ILE 6.03 -0.82 0 87 ASN -5.72 0.10 0 139 SER -3.70 1.27 0 89 PHE -7.44 0.40 0 114 LEU -1.23 -0.63 0 11 ASP -0.51 -0.05 1 12 ALA 0.75 -0.08 1 14 ALA -0.46 0.04 1 15 SER -0.31 0.07 1 16 ALA 0.99 0.11 1 17 THR -6.04 0.90 1 18 PHE -1.72 0.25 1 20 MET 0.27 0.12 1 21 GLN 1.79 -0.04 1 23 SER 2.83 -0.44 1 24 ALA -0.95 0.14 1 25 LEU 0.14 -0.08 1 26 ARG -6.20 0.34 1 27 LYS 3.54 -0.86 1 28 ASN 4.93 -0.70 1 30 PHE -4.54 1.20 1 31 VAL -2.88 0.59 1 32 VAL 2.43 0.45 1 33 LEU -4.95 0.38 1 34 LYS 4.03 -0.55 1 36 ARG -3.46 0.12 1 40 ILE 3.14 -0.29 1 41 VAL -0.48 0.45 1 42 GLU -3.93 0.15 1 43 MET -3.13 0.74 1 44 SER -2.49 0.42 1 45 THR -0.72 0.78 1 46 SER -2.25 0.22 1 47 LYS -0.33 0.22 1 48 THR 0.01 0.06 1 50 LYS 1.36 -0.18 1 51 HIS 0.65 -0.08 1 53 HIS -0.80 0.05 1 54 ALA -1.43 0.38 1 55 LYS -3.48 0.40 1 56 VAL -2.42 0.56 1 57 HIS -3.23 0.57 1 58 LEU -4.77 0.56 1 59 VAL -1.44 0.50 1 61 ILE -3.89 0.71 1 62 ASP -2.20 0.41 1 63 ILE 4.82 -0.12 1 64 PHE 1.04 0.17 1 65 THR -1.93 0.30 1 67 LYS 0.40 -0.24 1 68 LYS -1.05 0.69 1 69 TYR -5.29 0.20 1 70 GLU -7.33 1.22 1 71 ASP -5.59 0.29 1 72 ILE -2.68 1.10 1 75 SER 5.02 -0.50 1 76 THR -0.24 0.02 1 77 HIS -1.78 -0.16 1 78 ASN 0.09 0.17 1 79 MET -4.34 0.19 1 80 ASP -0.75 0.15 1 81 VAL -3.63 0.17 1 83 ASN 0.33 0.08 1 84 ILE -1.23 0.32 1 85 LYS -3.72 0.39 1 86 ARG -3.78 0.88 1 88 ASP -3.17 0.98 1 90 GLN 0.83 0.26 1 91 LEU -0.10 0.38 1 92 ILE -0.51 0.71 1 94 ILE -1.71 0.36 1 95 GLN -2.08 0.30 1 96 ASP 1.91 -0.30 1 98 TYR -0.93 0.11 1 99 LEU -1.07 -0.03 1 100 SER 0.90 0.50 1 101 LEU -3.98 0.88 1 102 LEU -3.25 0.39 1 103 GLN -2.32 0.29 1 104 ASP 3.86 -0.27 1 105 SER -0.07 -0.15 1 107 GLU -1.27 -0.05 1 108 VAL -1.93 0.79 1 109 ARG -3.06 0.46 1 110 GLU -2.00 1.07 1 111 ASP 0.22 -0.18 1 112 LEU -0.59 0.25 1 113 ARG -0.63 -0.39 1 116 GLU -1.51 -0.05 1 118 ASP -0.75 0.14 1 119 LEU 3.52 0.00 1 121 LYS 3.54 -0.14 1 122 GLU 3.09 -0.29 1 124 GLU 3.58 -0.55 1 125 GLN 4.70 -0.20 1 126 LYS 4.03 -0.33 1 127 TYR 3.43 -0.25 1 128 ASP 3.13 -0.36 1 131 GLU -0.30 -0.12 1 132 GLU -0.30 0.16 1 133 ILE -5.11 0.70 1 134 LEU -4.22 0.72 1 135 ILE -3.89 0.68 1 136 THR 0.98 0.46 1 137 VAL -2.17 0.67 1 138 LEU -5.67 0.88 1 140 ALA -3.36 0.27 1 141 MET 1.97 -0.55 1 142 THR 2.67 -0.23 1 143 GLU -3.44 0.11 1 144 GLU -6.60 1.33 1 145 ALA -4.82 0.27 1 146 ALA -0.33 0.51 1 147 VAL -2.65 0.55 1 148 ALA -4.10 0.32 1 149 ILE -4.14 0.91 1 150 LYS -3.72 0.21 1 151 ALA -0.61 0.19 1 152 MET 0.75 -0.18 1 153 ALA -0.22 -0.18 1 stop_ save_