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 bmr11451_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.31 _LACS_plot.Line_1_terminator_val_y_1 -3.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.38 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.03 _LACS_plot.Line_2_terminator_val_x_2 8.12 _LACS_plot.Line_2_terminator_val_y_2 5.70 _LACS_plot.Y_axis_chem_shift_offset 0.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 MET 6.27 -0.75 0 10 ASP -0.29 0.11 1 11 ILE -2.68 0.18 1 12 VAL 0.77 0.11 1 13 ILE -4.12 -1.36 1 14 LYS -4.76 -2.36 1 15 THR -1.51 -1.99 1 16 PHE -1.18 -4.41 1 17 ASP 5.91 3.76 1 18 ASP 2.16 0.82 1 19 LYS -1.58 -0.81 1 20 ALA -0.51 -0.38 1 22 GLU 4.44 3.02 1 23 THR 6.94 4.75 1 24 VAL 8.12 6.11 1 25 LYS 5.44 4.04 1 26 ASN 1.67 3.46 1 27 PHE 3.00 3.23 1 28 LEU 3.92 2.77 1 29 ASP 5.70 3.63 1 30 TYR 4.91 3.85 1 32 ARG 4.25 3.72 1 33 GLU 0.49 -0.15 1 35 PHE 3.43 3.90 1 36 TYR 1.12 -0.22 1 37 ASN 4.13 1.08 1 38 ASN 1.98 1.62 1 39 THR -4.81 -1.82 1 40 ILE -3.22 -2.30 1 41 PHE 3.31 1.12 1 42 HIS -1.06 1.60 1 43 ARG -2.05 -0.68 1 44 VAL -2.12 0.17 1 45 ILE -1.79 -0.64 1 46 ASN 3.47 1.24 1 48 PHE 1.07 -0.20 1 49 MET -2.61 -0.39 1 50 ILE -2.83 -1.37 1 51 GLN -3.93 -1.65 1 55 PHE -3.25 -1.00 1 56 GLU -0.25 0.00 1 60 LYS -0.45 -1.24 1 61 GLN 2.04 1.08 1 62 LYS 0.82 0.49 1 63 ALA 0.88 0.15 1 64 THR -3.15 -1.25 1 65 LYS -0.23 -0.85 1 66 GLU 2.53 1.68 1 68 ILE -4.85 -2.13 1 69 LYS -0.18 -1.14 1 70 ASN 1.99 0.23 1 71 GLU -0.88 -1.00 1 72 ALA 3.21 2.62 1 73 ASN 3.45 -0.77 1 74 ASN 0.16 -0.33 1 76 LEU 0.81 -0.50 1 77 LYS -2.80 -1.20 1 78 ASN 2.98 1.21 1 79 THR -1.58 -1.03 1 80 ARG 4.48 2.49 1 82 THR -2.54 -0.11 1 83 LEU -1.87 -0.75 1 84 ALA -8.31 -3.43 1 85 MET 0.41 -2.69 1 86 ALA -1.61 -1.29 1 87 ARG 0.95 -0.23 1 88 THR 0.12 -1.25 1 89 GLN 4.24 3.21 1 90 ALA 0.16 -0.77 1 92 HIS -0.11 -0.80 1 93 SER -2.72 -0.60 1 94 ALA 0.40 1.67 1 95 THR -2.43 -2.07 1 96 ALA -5.08 -0.96 1 97 GLN 0.33 1.69 1 98 PHE -6.67 -3.04 1 99 PHE -7.07 -2.65 1 100 ILE -2.62 -1.75 1 101 ASN 1.60 2.63 1 102 VAL 2.24 -0.29 1 103 VAL -5.15 -2.54 1 104 ASP 3.31 1.30 1 105 ASN -1.80 -1.57 1 106 ASP 3.89 2.59 1 107 PHE 2.52 -0.30 1 108 LEU -0.32 -0.62 1 109 ASN 0.65 -0.13 1 110 PHE 1.16 1.35 1 111 SER -1.60 -0.78 1 113 GLU 1.61 -1.63 1 115 LEU 5.14 3.86 1 116 GLN 2.63 1.43 1 118 TRP 4.22 4.79 1 120 TYR -1.52 -0.58 1 122 VAL 1.87 0.45 1 123 PHE -4.80 -2.76 1 124 ALA -5.28 -1.74 1 125 GLU -4.82 -1.95 1 126 VAL 2.16 1.07 1 127 VAL -0.29 -0.71 1 128 ASP -1.75 0.20 1 130 MET 4.68 0.55 1 131 ASP 4.86 2.44 1 132 VAL 5.94 3.82 1 133 VAL 6.96 4.88 1 134 ASP 3.35 2.06 1 135 LYS 3.80 2.71 1 136 ILE 5.71 4.21 1 137 LYS 3.43 1.69 1 139 VAL -0.41 -0.46 1 140 ALA 1.08 0.35 1 141 THR -5.91 -2.42 1 143 ARG -1.25 -0.80 1 144 SER -0.81 -1.44 1 147 HIS -1.51 1.08 1 148 GLN -3.53 -1.24 1 150 VAL -1.11 -0.63 1 152 LYS 3.71 2.40 1 153 GLU -3.22 -2.38 1 154 ASP 2.46 1.90 1 155 VAL 1.54 0.11 1 156 ILE -4.52 -0.41 1 157 ILE 3.84 1.41 1 158 GLU 2.21 2.31 1 159 SER -1.39 -0.79 1 160 VAL -3.76 -1.64 1 161 THR -1.33 -0.35 1 162 VAL -0.02 -0.44 1 163 SER -1.39 -0.78 1 164 GLU 0.89 1.53 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11451_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.31 _LACS_plot.Line_1_terminator_val_y_1 5.18 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.62 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.03 _LACS_plot.Line_2_terminator_val_x_2 8.12 _LACS_plot.Line_2_terminator_val_y_2 -2.42 _LACS_plot.Y_axis_chem_shift_offset 0.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 MET 6.27 -7.02 0 10 ASP -0.29 0.40 1 11 ILE -2.68 2.86 1 12 VAL 0.77 -0.66 1 13 ILE -4.12 2.76 1 14 LYS -4.76 2.40 1 15 THR -1.51 -0.48 1 16 PHE -1.18 -3.23 1 17 ASP 5.91 -2.15 1 18 ASP 2.16 -1.34 1 19 LYS -1.58 0.77 1 20 ALA -0.51 0.13 1 22 GLU 4.44 -1.42 1 23 THR 6.94 -2.19 1 24 VAL 8.12 -2.01 1 25 LYS 5.44 -1.40 1 26 ASN 1.67 1.79 1 27 PHE 3.00 0.23 1 28 LEU 3.92 -1.15 1 29 ASP 5.70 -2.07 1 30 TYR 4.91 -1.06 1 32 ARG 4.25 -0.53 1 33 GLU 0.49 -0.64 1 35 PHE 3.43 0.47 1 36 TYR 1.12 -1.34 1 37 ASN 4.13 -3.05 1 38 ASN 1.98 -0.36 1 39 THR -4.81 2.99 1 40 ILE -3.22 0.92 1 41 PHE 3.31 -2.19 1 42 HIS -1.06 2.66 1 43 ARG -2.05 1.37 1 44 VAL -2.12 2.29 1 45 ILE -1.79 1.15 1 46 ASN 3.47 -2.23 1 48 PHE 1.07 -1.27 1 49 MET -2.61 2.22 1 50 ILE -2.83 1.46 1 51 GLN -3.93 2.28 1 55 PHE -3.25 2.25 1 56 GLU -0.25 0.25 1 60 LYS -0.45 -0.79 1 61 GLN 2.04 -0.96 1 62 LYS 0.82 -0.33 1 63 ALA 0.88 -0.73 1 64 THR -3.15 1.90 1 65 LYS -0.23 -0.62 1 66 GLU 2.53 -0.85 1 68 ILE -4.85 2.72 1 69 LYS -0.18 -0.96 1 70 ASN 1.99 -1.76 1 71 GLU -0.88 -0.12 1 72 ALA 3.21 -0.59 1 73 ASN 3.45 -4.22 1 74 ASN 0.16 -0.49 1 76 LEU 0.81 -1.31 1 77 LYS -2.80 1.60 1 78 ASN 2.98 -1.77 1 79 THR -1.58 0.55 1 80 ARG 4.48 -1.99 1 82 THR -2.54 2.43 1 83 LEU -1.87 1.12 1 84 ALA -8.31 4.88 1 85 MET 0.41 -3.10 1 86 ALA -1.61 0.32 1 87 ARG 0.95 -1.18 1 88 THR 0.12 -1.37 1 89 GLN 4.24 -1.03 1 90 ALA 0.16 -0.93 1 92 HIS -0.11 -0.69 1 93 SER -2.72 2.12 1 94 ALA 0.40 1.27 1 95 THR -2.43 0.36 1 96 ALA -5.08 4.12 1 97 GLN 0.33 1.36 1 98 PHE -6.67 3.63 1 99 PHE -7.07 4.42 1 100 ILE -2.62 0.87 1 101 ASN 1.60 1.03 1 102 VAL 2.24 -2.53 1 103 VAL -5.15 2.61 1 104 ASP 3.31 -2.01 1 105 ASN -1.80 0.23 1 106 ASP 3.89 -1.30 1 107 PHE 2.52 -2.82 1 108 LEU -0.32 -0.30 1 109 ASN 0.65 -0.78 1 110 PHE 1.16 0.19 1 111 SER -1.60 0.82 1 113 GLU 1.61 -3.24 1 115 LEU 5.14 -1.28 1 116 GLN 2.63 -1.20 1 118 TRP 4.22 0.57 1 120 TYR -1.52 0.94 1 122 VAL 1.87 -1.42 1 123 PHE -4.80 2.04 1 124 ALA -5.28 3.54 1 125 GLU -4.82 2.87 1 126 VAL 2.16 -1.09 1 127 VAL -0.29 -0.42 1 128 ASP -1.75 1.95 1 130 MET 4.68 -4.13 1 131 ASP 4.86 -2.42 1 132 VAL 5.94 -2.12 1 133 VAL 6.96 -2.08 1 134 ASP 3.35 -1.29 1 135 LYS 3.80 -1.09 1 136 ILE 5.71 -1.50 1 137 LYS 3.43 -1.74 1 139 VAL -0.41 -0.05 1 140 ALA 1.08 -0.73 1 141 THR -5.91 3.49 1 143 ARG -1.25 0.45 1 144 SER -0.81 -0.63 1 147 HIS -1.51 2.59 1 148 GLN -3.53 2.29 1 150 VAL -1.11 0.48 1 152 LYS 3.71 -1.31 1 153 GLU -3.22 0.84 1 154 ASP 2.46 -0.56 1 155 VAL 1.54 -1.43 1 156 ILE -4.52 4.11 1 157 ILE 3.84 -2.43 1 158 GLU 2.21 0.10 1 159 SER -1.39 0.60 1 160 VAL -3.76 2.12 1 161 THR -1.33 0.98 1 162 VAL -0.02 -0.42 1 163 SER -1.39 0.61 1 164 GLU 0.89 0.64 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11451_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.31 _LACS_plot.Line_1_terminator_val_y_1 0.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 8.12 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _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 124 ALA -5.28 -0.67 0 113 GLU 1.61 -1.70 0 10 ASP -0.29 0.98 1 11 ILE -2.68 0.17 1 12 VAL 0.77 0.41 1 13 ILE -4.12 0.50 1 14 LYS -4.76 0.46 1 15 THR -1.51 -0.22 1 16 PHE -1.18 0.66 1 17 ASP 5.91 -0.88 1 18 ASP 2.16 -0.26 1 19 LYS -1.58 0.12 1 20 ALA -0.51 0.00 1 22 GLU 4.44 -0.34 1 23 THR 6.94 -0.77 1 24 VAL 8.12 -0.64 1 25 LYS 5.44 -0.45 1 26 ASN 1.67 -0.68 1 27 PHE 3.00 -0.08 1 28 LEU 3.92 -0.60 1 29 ASP 5.70 -0.35 1 30 TYR 4.91 -0.55 1 32 ARG 4.25 -0.48 1 33 GLU 0.49 -0.16 1 35 PHE 3.43 -0.95 1 36 TYR 1.12 -0.23 1 37 ASN 4.13 -0.91 1 38 ASN 1.98 -0.69 1 39 THR -4.81 0.66 1 40 ILE -3.22 1.50 1 41 PHE 3.31 0.34 1 42 HIS -1.06 -0.45 1 43 ARG -2.05 0.28 1 44 VAL -2.12 0.02 1 45 ILE -1.79 0.07 1 46 ASN 3.47 -0.58 1 48 PHE 1.07 0.52 1 49 MET -2.61 0.55 1 50 ILE -2.83 0.70 1 51 GLN -3.93 0.86 1 55 PHE -3.25 0.27 1 56 GLU -0.25 0.22 1 59 MET 6.27 -0.53 1 60 LYS -0.45 0.15 1 61 GLN 2.04 -0.95 1 62 LYS 0.82 -0.19 1 63 ALA 0.88 -0.04 1 64 THR -3.15 0.20 1 65 LYS -0.23 0.10 1 66 GLU 2.53 -0.47 1 68 ILE -4.85 0.27 1 69 LYS -0.18 -0.38 1 70 ASN 1.99 -0.52 1 71 GLU -0.88 0.30 1 72 ALA 3.21 -0.09 1 73 ASN 3.45 -1.56 1 74 ASN 0.16 -0.36 1 76 LEU 0.81 -0.03 1 77 LYS -2.80 0.13 1 78 ASN 2.98 -0.07 1 79 THR -1.58 -0.09 1 80 ARG 4.48 -1.14 1 82 THR -2.54 0.27 1 83 LEU -1.87 0.88 1 84 ALA -8.31 1.20 1 85 MET 0.41 0.76 1 86 ALA -1.61 0.36 1 87 ARG 0.95 0.29 1 88 THR 0.12 0.27 1 89 GLN 4.24 -0.49 1 90 ALA 0.16 -0.28 1 92 HIS -0.11 0.09 1 93 SER -2.72 -0.09 1 94 ALA 0.40 -0.04 1 95 THR -2.43 0.37 1 96 ALA -5.08 0.11 1 97 GLN 0.33 0.29 1 98 PHE -6.67 1.17 1 99 PHE -7.07 1.11 1 100 ILE -2.62 0.66 1 101 ASN 1.60 -0.28 1 102 VAL 2.24 0.29 1 103 VAL -5.15 0.23 1 104 ASP 3.31 -0.39 1 105 ASN -1.80 0.34 1 106 ASP 3.89 -0.37 1 107 PHE 2.52 -0.12 1 108 LEU -0.32 0.13 1 109 ASN 0.65 0.41 1 110 PHE 1.16 -0.37 1 111 SER -1.60 -0.29 1 115 LEU 5.14 -0.22 1 116 GLN 2.63 -0.08 1 118 TRP 4.22 -0.35 1 120 TYR -1.52 0.65 1 122 VAL 1.87 0.44 1 123 PHE -4.80 0.24 1 125 GLU -4.82 0.42 1 126 VAL 2.16 -0.21 1 127 VAL -0.29 0.23 1 128 ASP -1.75 0.28 1 130 MET 4.68 -0.01 1 131 ASP 4.86 -0.39 1 132 VAL 5.94 -0.68 1 133 VAL 6.96 -1.10 1 134 ASP 3.35 -0.39 1 135 LYS 3.80 -0.32 1 136 ILE 5.71 -1.11 1 137 LYS 3.43 -0.58 1 139 VAL -0.41 -0.04 1 140 ALA 1.08 -0.04 1 141 THR -5.91 0.57 1 143 ARG -1.25 0.46 1 144 SER -0.81 0.00 1 147 HIS -1.51 -0.31 1 148 GLN -3.53 0.13 1 150 VAL -1.11 -0.06 1 152 LYS 3.71 -0.45 1 153 GLU -3.22 0.04 1 154 ASP 2.46 -0.41 1 155 VAL 1.54 0.32 1 156 ILE -4.52 0.24 1 157 ILE 3.84 -0.49 1 158 GLU 2.21 -0.31 1 159 SER -1.39 -0.07 1 160 VAL -3.76 1.05 1 161 THR -1.33 0.31 1 162 VAL -0.02 0.37 1 163 SER -1.39 0.13 1 164 GLU 0.89 -0.27 1 stop_ save_