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 bmr15598_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -2.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 8.65 _LACS_plot.Line_2_terminator_val_y_2 6.78 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 LEU -7.24 -1.64 0 107 HIS -0.43 3.32 0 93 PHE -0.58 -3.19 0 10 GLU -2.54 -0.84 1 11 VAL -6.29 -2.70 1 12 LEU -3.79 -2.51 1 13 ASP -1.31 -1.32 1 14 ALA 2.85 2.40 1 15 ASP -0.16 -0.17 1 16 HIS 6.80 3.64 1 17 LYS -1.18 -1.32 1 19 TYR -2.99 -0.70 1 20 ASN 1.57 -1.42 1 21 LEU 1.10 2.67 1 22 VAL 3.00 1.61 1 23 GLN 3.32 1.78 1 24 HIS -0.12 0.18 1 25 LYS 3.07 1.86 1 27 SER -1.73 -0.07 1 29 LEU -2.93 0.08 1 31 ILE -1.58 -0.15 1 32 TYR -4.60 -0.35 1 33 ASN -1.00 -1.40 1 34 VAL -5.62 -3.85 1 35 ALA -0.90 -0.20 1 36 SER 1.76 1.20 1 37 LYS 3.73 3.14 1 40 TYR 0.15 0.45 1 41 THR 1.67 1.43 1 42 LYS 1.89 1.14 1 45 TYR 3.92 3.33 1 46 GLU 4.43 3.63 1 47 THR 6.25 4.90 1 48 ALA 3.15 3.25 1 49 THR 6.85 5.75 1 50 THR 6.71 5.17 1 51 LEU 3.06 3.24 1 52 TYR 4.22 4.18 1 53 ASN 3.63 3.06 1 54 LYS 2.45 3.30 1 55 TYR 0.58 1.01 1 56 LYS 6.25 3.30 1 57 SER 3.83 2.30 1 58 GLN -0.70 0.06 1 60 PHE -2.54 -0.50 1 61 THR -1.51 -0.88 1 62 VAL -4.56 -2.70 1 63 LEU -6.15 -2.51 1 64 ALA -6.28 -3.07 1 65 PHE -1.72 -0.88 1 67 SER -4.02 -0.82 1 69 GLN 1.62 1.80 1 70 PHE 0.02 -1.08 1 73 GLN -0.34 -0.23 1 74 GLU -0.20 0.12 1 77 ASN -0.28 0.02 1 78 GLU 0.76 1.01 1 79 GLU 0.36 0.49 1 80 GLU -0.23 0.33 1 81 ILE 0.61 0.12 1 82 LYS 1.15 1.00 1 83 GLU -0.19 0.11 1 84 PHE -0.16 -0.10 1 85 VAL 0.03 -0.03 1 87 THR 0.52 -0.29 1 88 LYS 0.51 0.33 1 89 PHE 0.59 0.64 1 90 LYS -1.80 -1.30 1 91 ALA -1.99 -1.29 1 92 GLU -0.82 0.05 1 95 ILE -2.11 -1.84 1 96 MET -2.27 -2.71 1 97 ALA 0.93 0.16 1 98 LYS 0.48 0.13 1 99 ILE -6.77 -1.60 1 100 ASN -0.39 -0.51 1 101 VAL -0.82 -1.26 1 102 ASN -6.15 -1.95 1 104 GLU 2.59 2.03 1 105 ASN -0.97 -1.37 1 106 ALA -0.03 -0.48 1 109 LEU 3.70 3.25 1 110 TYR 5.97 5.80 1 111 GLU 3.32 2.71 1 112 TYR 2.93 2.56 1 113 MET 7.70 5.82 1 115 LYS 2.19 1.28 1 116 THR 6.01 4.31 1 120 ILE 1.29 0.99 1 121 LEU 1.97 -0.20 1 122 ALA 2.84 1.24 1 123 THR -1.26 -1.50 1 125 ALA 0.83 0.67 1 126 ILE 1.01 -1.31 1 127 LYS -0.33 -0.39 1 129 ASN -1.82 -0.22 1 130 PHE 8.65 4.39 1 131 THR 4.55 3.74 1 132 SER -3.99 -1.97 1 133 PHE -5.71 -1.63 1 134 LEU -3.75 -1.32 1 135 ILE -1.59 -3.32 1 136 ASP -1.65 -1.37 1 137 ARG 4.01 2.98 1 138 ASP -1.12 0.12 1 140 VAL -0.76 -0.01 1 142 VAL -1.63 -0.69 1 143 GLU -5.54 -1.56 1 144 ARG -4.10 -1.97 1 145 PHE -0.89 -0.50 1 146 SER 0.56 0.50 1 149 ALA 0.30 0.09 1 150 SER -4.19 -1.88 1 151 VAL 6.13 5.12 1 152 LYS 3.81 3.01 1 153 ASP 3.60 3.02 1 154 ILE 4.71 3.26 1 155 GLU 4.10 4.04 1 156 GLU 2.78 2.60 1 157 LYS -1.58 -1.08 1 158 LEU 0.85 2.38 1 159 ILE 0.53 0.66 1 161 LEU 1.09 0.77 1 162 LEU -0.37 -0.08 1 164 SER -0.27 0.00 1 165 ALA 0.29 -0.15 1 166 ARG 0.53 1.51 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15598_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 4.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.51 _LACS_plot.Line_2_terminator_val_x_2 8.65 _LACS_plot.Line_2_terminator_val_y_2 -1.87 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 LEU -7.24 5.60 0 107 HIS -0.43 3.75 0 93 PHE -0.58 -2.61 0 10 GLU -2.54 1.70 1 11 VAL -6.29 3.59 1 12 LEU -3.79 1.28 1 13 ASP -1.31 -0.01 1 14 ALA 2.85 -0.45 1 15 ASP -0.16 -0.01 1 16 HIS 6.80 -3.16 1 17 LYS -1.18 -0.14 1 19 TYR -2.99 2.29 1 20 ASN 1.57 -2.99 1 21 LEU 1.10 1.57 1 22 VAL 3.00 -1.39 1 23 GLN 3.32 -1.54 1 24 HIS -0.12 0.30 1 25 LYS 3.07 -1.21 1 27 SER -1.73 1.66 1 29 LEU -2.93 3.01 1 31 ILE -1.58 1.43 1 32 TYR -4.60 4.25 1 33 ASN -1.00 -0.40 1 34 VAL -5.62 1.77 1 35 ALA -0.90 0.70 1 36 SER 1.76 -0.56 1 37 LYS 3.73 -0.59 1 40 TYR 0.15 0.30 1 41 THR 1.67 -0.24 1 42 LYS 1.89 -0.75 1 45 TYR 3.92 -0.59 1 46 GLU 4.43 -0.80 1 47 THR 6.25 -1.35 1 48 ALA 3.15 0.10 1 49 THR 6.85 -1.10 1 50 THR 6.71 -1.54 1 51 LEU 3.06 0.18 1 52 TYR 4.22 -0.04 1 53 ASN 3.63 -0.57 1 54 LYS 2.45 0.85 1 55 TYR 0.58 0.43 1 56 LYS 6.25 -2.95 1 57 SER 3.83 -1.53 1 58 GLN -0.70 0.76 1 60 PHE -2.54 2.04 1 61 THR -1.51 0.63 1 62 VAL -4.56 1.86 1 63 LEU -6.15 3.64 1 64 ALA -6.28 3.21 1 65 PHE -1.72 0.84 1 67 SER -4.02 3.20 1 69 GLN 1.62 0.18 1 70 PHE 0.02 -1.10 1 73 GLN -0.34 0.11 1 74 GLU -0.20 0.32 1 77 ASN -0.28 0.30 1 78 GLU 0.76 0.25 1 79 GLU 0.36 0.13 1 80 GLU -0.23 0.56 1 81 ILE 0.61 -0.49 1 82 LYS 1.15 -0.15 1 83 GLU -0.19 0.30 1 84 PHE -0.16 0.06 1 85 VAL 0.03 -0.06 1 87 THR 0.52 -0.81 1 88 LYS 0.51 -0.18 1 89 PHE 0.59 0.05 1 90 LYS -1.80 0.50 1 91 ALA -1.99 0.70 1 92 GLU -0.82 0.87 1 95 ILE -2.11 0.27 1 96 MET -2.27 -0.44 1 97 ALA 0.93 -0.77 1 98 LYS 0.48 -0.35 1 99 ILE -6.77 5.17 1 100 ASN -0.39 -0.12 1 101 VAL -0.82 -0.44 1 102 ASN -6.15 4.20 1 104 GLU 2.59 -0.56 1 105 ASN -0.97 -0.40 1 106 ALA -0.03 -0.45 1 109 LEU 3.70 -0.45 1 110 TYR 5.97 -0.17 1 111 GLU 3.32 -0.61 1 112 TYR 2.93 -0.37 1 113 MET 7.70 -1.88 1 115 LYS 2.19 -0.91 1 116 THR 6.01 -1.70 1 120 ILE 1.29 -0.30 1 121 LEU 1.97 -2.17 1 122 ALA 2.84 -1.60 1 123 THR -1.26 -0.24 1 125 ALA 0.83 -0.16 1 126 ILE 1.01 -2.32 1 127 LYS -0.33 -0.06 1 129 ASN -1.82 1.60 1 130 PHE 8.65 -4.26 1 131 THR 4.55 -0.81 1 132 SER -3.99 2.02 1 133 PHE -5.71 4.08 1 134 LEU -3.75 2.43 1 135 ILE -1.59 -1.73 1 136 ASP -1.65 0.28 1 137 ARG 4.01 -1.03 1 138 ASP -1.12 1.24 1 140 VAL -0.76 0.75 1 142 VAL -1.63 0.94 1 143 GLU -5.54 3.98 1 144 ARG -4.10 2.13 1 145 PHE -0.89 0.39 1 146 SER 0.56 -0.06 1 149 ALA 0.30 -0.21 1 150 SER -4.19 2.31 1 151 VAL 6.13 -1.01 1 152 LYS 3.81 -0.80 1 153 ASP 3.60 -0.58 1 154 ILE 4.71 -1.45 1 155 GLU 4.10 -0.06 1 156 GLU 2.78 -0.18 1 157 LYS -1.58 0.50 1 158 LEU 0.85 1.53 1 159 ILE 0.53 0.13 1 161 LEU 1.09 -0.32 1 162 LEU -0.37 0.29 1 164 SER -0.27 0.27 1 165 ALA 0.29 -0.44 1 166 ARG 0.53 0.98 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15598_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _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 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 8.65 _LACS_plot.Line_2_terminator_val_y_2 -0.86 _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 56 LYS 6.25 0.65 0 10 GLU -2.54 0.46 1 11 VAL -6.29 0.98 1 12 LEU -3.79 0.71 1 13 ASP -1.31 0.21 1 14 ALA 2.85 -0.69 1 15 ASP -0.16 0.23 1 16 HIS 6.80 -0.80 1 17 LYS -1.18 0.36 1 19 TYR -2.99 0.16 1 20 ASN 1.57 0.16 1 21 LEU 1.10 0.05 1 22 VAL 3.00 -0.49 1 23 GLN 3.32 -0.13 1 24 HIS -0.12 0.07 1 25 LYS 3.07 -0.08 1 27 SER -1.73 0.40 1 29 LEU -2.93 0.78 1 30 LEU -7.24 1.17 1 31 ILE -1.58 0.90 1 32 TYR -4.60 0.91 1 33 ASN -1.00 1.37 1 34 VAL -5.62 0.00 1 35 ALA -0.90 0.40 1 36 SER 1.76 -0.07 1 40 TYR 0.15 -0.05 1 41 THR 1.67 -0.23 1 42 LYS 1.89 0.18 1 45 TYR 3.92 -0.48 1 46 GLU 4.43 -0.28 1 47 THR 6.25 -0.61 1 48 ALA 3.15 -0.40 1 49 THR 6.85 -0.18 1 50 THR 6.71 -0.31 1 51 LEU 3.06 -0.34 1 52 TYR 4.22 -0.14 1 53 ASN 3.63 -0.47 1 54 LYS 2.45 -0.39 1 55 TYR 0.58 0.42 1 57 SER 3.83 -0.06 1 58 GLN -0.70 0.39 1 60 PHE -2.54 0.41 1 61 THR -1.51 0.16 1 62 VAL -4.56 0.66 1 63 LEU -6.15 0.62 1 64 ALA -6.28 1.18 1 65 PHE -1.72 -0.22 1 67 SER -4.02 0.71 1 69 GLN 1.62 -0.22 1 70 PHE 0.02 0.16 1 73 GLN -0.34 0.11 1 74 GLU -0.20 -0.05 1 77 ASN -0.28 0.04 1 78 GLU 0.76 -0.12 1 79 GLU 0.36 -0.07 1 80 GLU -0.23 -0.08 1 81 ILE 0.61 -0.07 1 82 LYS 1.15 0.08 1 83 GLU -0.19 -0.08 1 84 PHE -0.16 0.05 1 85 VAL 0.03 -0.01 1 87 THR 0.52 0.03 1 88 LYS 0.51 -0.04 1 89 PHE 0.59 -0.27 1 90 LYS -1.80 -0.08 1 91 ALA -1.99 -0.22 1 92 GLU -0.82 -0.17 1 93 PHE -0.58 -0.32 1 95 ILE -2.11 0.51 1 96 MET -2.27 0.11 1 97 ALA 0.93 -0.25 1 98 LYS 0.48 0.22 1 99 ILE -6.77 0.73 1 100 ASN -0.39 0.13 1 101 VAL -0.82 -0.07 1 102 ASN -6.15 0.10 1 104 GLU 2.59 -0.27 1 105 ASN -0.97 0.23 1 106 ALA -0.03 -0.76 1 107 HIS -0.43 -0.49 1 109 LEU 3.70 -1.31 1 110 TYR 5.97 -1.13 1 111 GLU 3.32 -0.18 1 112 TYR 2.93 -0.34 1 113 MET 7.70 -1.59 1 115 LYS 2.19 -0.39 1 116 THR 6.01 -0.55 1 120 ILE 1.29 0.08 1 121 LEU 1.97 -0.01 1 122 ALA 2.84 -0.34 1 123 THR -1.26 0.14 1 125 ALA 0.83 -0.20 1 126 ILE 1.01 0.11 1 127 LYS -0.33 -0.12 1 129 ASN -1.82 -0.34 1 130 PHE 8.65 -0.44 1 131 THR 4.55 0.03 1 132 SER -3.99 1.08 1 133 PHE -5.71 0.80 1 134 LEU -3.75 0.79 1 135 ILE -1.59 0.41 1 136 ASP -1.65 0.01 1 137 ARG 4.01 -0.42 1 138 ASP -1.12 0.40 1 140 VAL -0.76 0.39 1 142 VAL -1.63 0.38 1 143 GLU -5.54 0.22 1 144 ARG -4.10 0.39 1 145 PHE -0.89 0.27 1 146 SER 0.56 0.04 1 149 ALA 0.30 0.09 1 150 SER -4.19 0.12 1 151 VAL 6.13 -0.72 1 152 LYS 3.81 -0.09 1 153 ASP 3.60 -0.36 1 154 ILE 4.71 -0.75 1 155 GLU 4.10 -0.71 1 156 GLU 2.78 -0.37 1 157 LYS -1.58 0.20 1 158 LEU 0.85 -0.22 1 159 ILE 0.53 0.02 1 161 LEU 1.09 -0.09 1 162 LEU -0.37 0.05 1 164 SER -0.27 0.06 1 165 ALA 0.29 0.07 1 166 ARG 0.53 -0.10 1 stop_ save_