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 bmr18464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.82 _LACS_plot.Line_1_terminator_val_y_1 -3.18 _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 -1.35 _LACS_plot.Line_2_terminator_val_x_2 4.34 _LACS_plot.Line_2_terminator_val_y_2 3.58 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 GLU -7.64 -1.87 0 10 HIS -1.52 2.55 0 11 ALA 0.86 0.89 1 13 ILE 0.18 -0.78 1 14 PHE -1.60 -0.04 1 15 THR -2.42 -1.56 1 16 PHE 1.86 2.39 1 17 GLU 1.04 2.48 1 19 ASP -0.13 1.09 1 20 THR -3.43 -0.36 1 21 ILE -5.57 -1.57 1 22 HIS -1.93 -0.63 1 23 VAL -6.63 -3.46 1 24 SER -1.23 -1.08 1 25 GLU 1.43 1.54 1 26 SER -0.60 -0.72 1 27 ILE 1.71 2.04 1 29 VAL -1.49 -0.79 1 30 MET -3.28 -1.06 1 31 GLU -4.48 -1.59 1 32 VAL -4.91 -2.69 1 33 LYS -1.49 0.28 1 34 VAL 0.15 0.42 1 35 LEU -2.46 -1.15 1 36 ARG -5.29 -2.34 1 37 THR -3.24 -1.71 1 40 ALA -3.42 -2.63 1 41 ARG 0.95 0.57 1 43 THR -0.44 -0.33 1 44 VAL -5.49 -1.90 1 45 ILE -3.30 -2.62 1 46 VAL -2.84 -0.78 1 48 PHE -5.58 -1.10 1 49 ARG -3.10 -0.52 1 50 THR -2.50 -0.97 1 51 VAL -3.98 -0.63 1 52 GLU 1.61 2.20 1 54 THR 2.20 1.92 1 55 ALA -1.47 -1.41 1 56 LYS -3.47 -2.49 1 60 GLU 3.62 1.97 1 61 ASP -0.79 0.96 1 62 PHE -1.85 -1.42 1 63 GLU -1.72 -1.36 1 64 ASP 0.88 1.40 1 65 ALA -3.75 -0.65 1 66 TYR -3.77 -2.38 1 68 GLU -4.56 -1.44 1 69 LEU -3.94 -1.76 1 70 GLU -2.92 -1.38 1 71 PHE -1.51 -1.22 1 72 LYS -0.66 -0.46 1 73 ASN 1.84 3.17 1 74 ASP 4.35 3.49 1 75 GLU -0.60 0.72 1 76 THR -0.22 0.55 1 77 VAL -2.82 -0.67 1 78 LYS -7.13 -2.85 1 79 THR -3.80 -1.62 1 80 ILE -3.18 -0.39 1 81 ARG -3.32 -1.59 1 82 VAL -4.92 -1.64 1 83 LYS 0.24 0.33 1 84 ILE -0.91 -2.42 1 85 VAL 1.25 0.95 1 86 ASP -0.91 -1.21 1 93 GLN 2.10 2.19 1 95 ASN -6.01 -2.89 1 96 PHE -2.01 -0.91 1 97 PHE -5.87 -2.38 1 98 ILE 0.05 0.28 1 99 ALA -3.91 -1.31 1 100 LEU -1.15 -0.92 1 102 GLU -0.34 0.45 1 104 LYS -3.14 -1.32 1 105 TRP -3.89 -2.81 1 106 MET 0.92 -0.53 1 107 GLU -1.39 -0.56 1 108 ARG 0.72 0.46 1 110 ILE -0.69 -0.22 1 111 SER 0.11 0.09 1 112 GLU -0.63 -0.06 1 113 VAL 0.53 0.31 1 114 THR -0.39 -0.16 1 115 ASP 0.41 0.17 1 116 ARG -0.76 -0.50 1 117 LYS 0.41 0.01 1 118 LEU -0.17 -0.04 1 119 THR -1.48 -0.46 1 120 VAL 3.88 3.00 1 121 GLU 3.29 2.75 1 122 GLU 1.48 2.28 1 123 GLU 3.31 2.90 1 124 GLU 2.86 2.33 1 125 ALA 3.45 2.48 1 126 LYS 3.39 2.91 1 127 ARG 3.59 3.06 1 128 ILE 3.50 2.80 1 129 ALA 2.77 2.11 1 130 GLU 1.38 1.45 1 131 MET 1.81 1.77 1 133 LYS 1.33 0.24 1 135 VAL -7.82 -3.18 1 136 LEU -1.44 -0.67 1 138 GLU 2.29 2.69 1 139 HIS -2.30 -2.23 1 141 LYS -3.51 -0.74 1 142 LEU -3.50 -1.82 1 143 GLU -2.59 -1.58 1 144 VAL -0.20 -1.86 1 145 ILE -1.29 -1.46 1 146 ILE -0.22 -0.03 1 152 PHE 0.07 0.14 1 153 LYS -0.60 -0.25 1 154 SER -0.12 0.03 1 155 THR -0.29 -0.15 1 156 VAL -0.07 -0.03 1 157 ASP 0.28 1.64 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.82 _LACS_plot.Line_1_terminator_val_y_1 4.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.65 _LACS_plot.Line_2_terminator_val_x_2 4.34 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 GLU -7.64 5.77 0 10 HIS -1.52 4.07 0 11 ALA 0.86 0.03 1 13 ILE 0.18 -0.96 1 14 PHE -1.60 1.56 1 15 THR -2.42 0.86 1 16 PHE 1.86 0.53 1 17 GLU 1.04 1.44 1 19 ASP -0.13 1.22 1 20 THR -3.43 3.07 1 21 ILE -5.57 4.00 1 22 HIS -1.93 1.30 1 23 VAL -6.63 3.17 1 24 SER -1.23 0.15 1 25 GLU 1.43 0.11 1 26 SER -0.60 -0.12 1 27 ILE 1.71 0.33 1 29 VAL -1.49 0.70 1 30 MET -3.28 2.22 1 31 GLU -4.48 2.89 1 32 VAL -4.91 2.22 1 33 LYS -1.49 1.77 1 34 VAL 0.15 0.27 1 35 LEU -2.46 1.31 1 36 ARG -5.29 2.95 1 37 THR -3.24 1.53 1 40 ALA -3.42 0.79 1 41 ARG 0.95 -0.38 1 43 THR -0.44 0.11 1 44 VAL -5.49 3.59 1 45 ILE -3.30 0.68 1 46 VAL -2.84 2.06 1 48 PHE -5.58 4.48 1 49 ARG -3.10 2.58 1 50 THR -2.50 1.53 1 51 VAL -3.98 3.35 1 52 GLU 1.61 0.59 1 54 THR 2.20 -0.28 1 55 ALA -1.47 0.06 1 56 LYS -3.47 0.98 1 60 GLU 3.62 -1.65 1 61 ASP -0.79 1.75 1 62 PHE -1.85 0.43 1 63 GLU -1.72 0.36 1 64 ASP 0.88 0.52 1 65 ALA -3.75 3.10 1 66 TYR -3.77 1.39 1 68 GLU -4.56 3.12 1 69 LEU -3.94 2.18 1 70 GLU -2.92 1.54 1 71 PHE -1.51 0.29 1 72 LYS -0.66 0.20 1 73 ASN 1.84 1.33 1 74 ASP 4.35 -0.86 1 75 GLU -0.60 1.32 1 76 THR -0.22 0.77 1 77 VAL -2.82 2.15 1 78 LYS -7.13 4.28 1 79 THR -3.80 2.18 1 80 ILE -3.18 2.79 1 81 ARG -3.32 1.73 1 82 VAL -4.92 3.28 1 83 LYS 0.24 0.09 1 84 ILE -0.91 -1.51 1 85 VAL 1.25 -0.30 1 86 ASP -0.91 -0.30 1 93 GLN 2.10 0.09 1 95 ASN -6.01 3.12 1 96 PHE -2.01 1.10 1 97 PHE -5.87 3.49 1 98 ILE 0.05 0.23 1 99 ALA -3.91 2.60 1 100 LEU -1.15 0.23 1 102 GLU -0.34 0.79 1 104 LYS -3.14 1.82 1 105 TRP -3.89 1.08 1 106 MET 0.92 -1.45 1 107 GLU -1.39 0.83 1 108 ARG 0.72 -0.26 1 110 ILE -0.69 0.47 1 111 SER 0.11 -0.02 1 112 GLU -0.63 0.57 1 113 VAL 0.53 -0.22 1 114 THR -0.39 0.23 1 115 ASP 0.41 -0.24 1 116 ARG -0.76 0.26 1 117 LYS 0.41 -0.40 1 118 LEU -0.17 0.13 1 119 THR -1.48 1.02 1 120 VAL 3.88 -0.88 1 121 GLU 3.29 -0.54 1 122 GLU 1.48 0.80 1 123 GLU 3.31 -0.41 1 124 GLU 2.86 -0.53 1 125 ALA 3.45 -0.97 1 126 LYS 3.39 -0.48 1 127 ARG 3.59 -0.53 1 128 ILE 3.50 -0.70 1 129 ALA 2.77 -0.66 1 130 GLU 1.38 0.07 1 131 MET 1.81 -0.04 1 133 LYS 1.33 -1.09 1 135 VAL -7.82 4.64 1 136 LEU -1.44 0.77 1 138 GLU 2.29 0.40 1 139 HIS -2.30 0.07 1 141 LYS -3.51 2.77 1 142 LEU -3.50 1.68 1 143 GLU -2.59 1.01 1 144 VAL -0.20 -1.66 1 145 ILE -1.29 -0.17 1 146 ILE -0.22 0.19 1 152 PHE 0.07 0.07 1 153 LYS -0.60 0.35 1 154 SER -0.12 0.15 1 155 THR -0.29 0.14 1 156 VAL -0.07 0.04 1 157 ASP 0.28 1.36 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.82 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.34 _LACS_plot.Line_2_terminator_val_x_2 4.34 _LACS_plot.Line_2_terminator_val_y_2 -0.37 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 THR -0.44 1.45 0 36 ARG -5.29 -0.54 0 10 HIS -1.52 -0.40 1 11 ALA 0.86 0.17 1 13 ILE 0.18 0.50 1 14 PHE -1.60 0.71 1 15 THR -2.42 0.17 1 16 PHE 1.86 0.64 1 17 GLU 1.04 -0.17 1 19 ASP -0.13 0.21 1 20 THR -3.43 1.15 1 21 ILE -5.57 0.43 1 22 HIS -1.93 0.68 1 23 VAL -6.63 0.55 1 24 SER -1.23 -0.01 1 25 GLU 1.43 -0.51 1 26 SER -0.60 -0.11 1 27 ILE 1.71 -0.20 1 29 VAL -1.49 0.38 1 30 MET -3.28 0.09 1 31 GLU -4.48 0.93 1 32 VAL -4.91 0.45 1 33 LYS -1.49 0.39 1 34 VAL 0.15 -0.11 1 35 LEU -2.46 0.54 1 37 THR -3.24 0.33 1 40 ALA -3.42 0.25 1 41 ARG 0.95 0.11 1 44 VAL -5.49 0.86 1 45 ILE -3.30 1.10 1 46 VAL -2.84 -0.02 1 48 PHE -5.58 1.22 1 49 ARG -3.10 1.15 1 50 THR -2.50 1.16 1 51 VAL -3.98 0.36 1 52 GLU 1.61 0.18 1 54 THR 2.20 0.02 1 55 ALA -1.47 0.43 1 56 LYS -3.47 0.22 1 60 GLU 3.62 -0.13 1 61 ASP -0.79 0.74 1 62 PHE -1.85 0.38 1 63 GLU -1.72 -0.09 1 64 ASP 0.88 -0.17 1 65 ALA -3.75 0.59 1 66 TYR -3.77 0.20 1 68 GLU -4.56 0.51 1 69 LEU -3.94 0.26 1 70 GLU -2.92 0.51 1 71 PHE -1.51 0.13 1 73 ASN 1.84 -0.02 1 74 ASP 4.35 -0.16 1 75 GLU -0.60 0.33 1 76 THR -0.22 0.54 1 77 VAL -2.82 1.35 1 78 LYS -7.13 0.31 1 79 THR -3.80 0.96 1 80 ILE -3.18 -0.38 1 81 ARG -3.32 1.08 1 82 VAL -4.92 0.57 1 83 LYS 0.24 0.27 1 84 ILE -0.91 0.14 1 85 VAL 1.25 -0.24 1 86 ASP -0.91 0.21 1 93 GLN 2.10 0.05 1 94 GLU -7.64 0.33 1 95 ASN -6.01 1.43 1 96 PHE -2.01 -0.14 1 97 PHE -5.87 1.17 1 98 ILE 0.05 0.54 1 99 ALA -3.91 0.88 1 100 LEU -1.15 0.83 1 102 GLU -0.34 -0.33 1 104 LYS -3.14 0.34 1 105 TRP -3.89 0.45 1 106 MET 0.92 0.21 1 107 GLU -1.39 -0.13 1 108 ARG 0.72 -0.38 1 110 ILE -0.69 0.07 1 111 SER 0.11 -0.02 1 112 GLU -0.63 0.00 1 113 VAL 0.53 0.08 1 115 ASP 0.41 -0.03 1 116 ARG -0.76 0.08 1 117 LYS 0.41 0.01 1 118 LEU -0.17 0.19 1 119 THR -1.48 0.10 1 120 VAL 3.88 -0.15 1 121 GLU 3.29 -0.17 1 122 GLU 1.48 -0.26 1 123 GLU 3.31 -0.31 1 124 GLU 2.86 -0.16 1 125 ALA 3.45 -0.24 1 126 LYS 3.39 -0.24 1 127 ARG 3.59 -0.20 1 128 ILE 3.50 -0.32 1 129 ALA 2.77 -0.07 1 130 GLU 1.38 -0.10 1 131 MET 1.81 -0.14 1 133 LYS 1.33 -1.14 1 135 VAL -7.82 0.61 1 136 LEU -1.44 0.66 1 138 GLU 2.29 -0.62 1 139 HIS -2.30 0.64 1 141 LYS -3.51 1.10 1 142 LEU -3.50 0.09 1 143 GLU -2.59 -0.22 1 144 VAL -0.20 -0.13 1 145 ILE -1.29 0.16 1 146 ILE -0.22 0.17 1 152 PHE 0.07 -0.08 1 153 LYS -0.60 0.00 1 154 SER -0.12 -0.02 1 155 THR -0.29 0.60 1 156 VAL -0.07 0.10 1 157 ASP 0.28 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.82 _LACS_plot.Line_1_terminator_val_y_1 -2.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.85 _LACS_plot.Line_2_terminator_val_x_2 4.34 _LACS_plot.Line_2_terminator_val_y_2 1.64 _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 96 PHE -2.01 -5.24 0 13 ILE 0.18 1.23 1 14 PHE -1.60 -0.16 1 15 THR -2.42 -2.92 1 16 PHE 1.86 2.46 1 23 VAL -6.63 -2.67 1 24 SER -1.23 1.70 1 25 GLU 1.43 -0.72 1 26 SER -0.60 0.45 1 27 ILE 1.71 -2.07 1 29 VAL -1.49 -1.19 1 30 MET -3.28 -2.69 1 31 GLU -4.48 -1.03 1 32 VAL -4.91 -2.00 1 33 LYS -1.49 -0.89 1 34 VAL 0.15 -2.09 1 35 LEU -2.46 -2.94 1 36 ARG -5.29 -0.57 1 37 THR -3.24 -0.28 1 40 ALA -3.42 -1.56 1 41 ARG 0.95 0.66 1 43 THR -0.44 0.10 1 44 VAL -5.49 -2.21 1 45 ILE -3.30 -0.77 1 48 PHE -5.58 -1.81 1 49 ARG -3.10 -1.02 1 50 THR -2.50 0.71 1 51 VAL -3.98 -0.24 1 52 GLU 1.61 -0.05 1 54 THR 2.20 2.12 1 55 ALA -1.47 -1.42 1 56 LYS -3.47 0.30 1 60 GLU 3.62 -1.09 1 61 ASP -0.79 0.39 1 62 PHE -1.85 -2.76 1 63 GLU -1.72 -1.09 1 64 ASP 0.88 -0.91 1 65 ALA -3.75 -3.47 1 66 TYR -3.77 -1.46 1 68 GLU -4.56 -1.24 1 69 LEU -3.94 -2.51 1 70 GLU -2.92 -2.11 1 71 PHE -1.51 -0.73 1 72 LYS -0.66 0.27 1 73 ASN 1.84 1.07 1 74 ASP 4.35 -1.10 1 75 GLU -0.60 1.90 1 76 THR -0.22 -1.15 1 77 VAL -2.82 -1.97 1 78 LYS -7.13 -1.86 1 79 THR -3.80 -0.97 1 80 ILE -3.18 -2.22 1 81 ARG -3.32 -0.52 1 82 VAL -4.92 -1.66 1 83 LYS 0.24 -2.11 1 84 ILE -0.91 0.14 1 94 GLU -7.64 -1.97 1 95 ASN -6.01 -1.13 1 97 PHE -5.87 -0.24 1 98 ILE 0.05 -2.43 1 99 ALA -3.91 -0.47 1 100 LEU -1.15 0.07 1 108 ARG 0.72 0.35 1 110 ILE -0.69 -0.26 1 111 SER 0.11 -0.36 1 112 GLU -0.63 -0.28 1 113 VAL 0.53 0.11 1 114 THR -0.39 -0.18 1 115 ASP 0.41 -0.83 1 116 ARG -0.76 -1.04 1 117 LYS 0.41 0.16 1 118 LEU -0.17 0.84 1 119 THR -1.48 0.69 1 120 VAL 3.88 1.78 1 121 GLU 3.29 2.69 1 122 GLU 1.48 2.62 1 123 GLU 3.31 2.62 1 124 GLU 2.86 1.51 1 125 ALA 3.45 2.61 1 126 LYS 3.39 1.36 1 127 ARG 3.59 2.82 1 128 ILE 3.50 2.07 1 129 ALA 2.77 1.86 1 130 GLU 1.38 1.52 1 131 MET 1.81 0.90 1 135 VAL -7.82 -0.91 1 136 LEU -1.44 0.68 1 138 GLU 2.29 -0.34 1 141 LYS -3.51 -3.44 1 142 LEU -3.50 -3.07 1 143 GLU -2.59 -3.55 1 144 VAL -0.20 -1.96 1 145 ILE -1.29 -1.17 1 152 PHE 0.07 -0.48 1 153 LYS -0.60 -0.69 1 154 SER -0.12 0.16 1 155 THR -0.29 -0.28 1 156 VAL -0.07 -1.32 1 stop_ save_