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 bmr15249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 -2.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.30 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 5.34 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 PHE -5.56 -1.19 0 64 GLU -4.67 -0.43 0 110 HIS 0.25 2.89 0 106 LEU -6.80 -2.03 0 70 ALA 2.07 -0.50 0 71 THR 4.86 1.26 0 10 PHE 2.69 2.39 1 11 VAL 4.67 3.66 1 12 ARG 3.26 2.25 1 13 ASN 3.36 2.21 1 14 TRP 3.60 2.82 1 15 GLN 3.51 2.63 1 16 LEU 2.57 2.43 1 17 VAL 4.53 2.97 1 18 ALA 2.14 1.36 1 19 ALA -1.10 -0.24 1 20 VAL 0.40 -0.19 1 22 LEU 2.85 3.06 1 23 PHE 2.70 0.26 1 24 GLN 3.19 2.04 1 25 LYS 0.49 0.10 1 26 LEU -1.54 -0.72 1 29 ALA 3.32 2.46 1 30 VAL 3.35 2.52 1 31 LEU 3.98 3.27 1 32 VAL 5.81 4.65 1 33 GLU 2.56 1.98 1 34 ILE 3.38 0.73 1 35 VAL 6.99 4.96 1 36 ARG 3.04 2.57 1 37 ALA -0.27 0.40 1 38 LEU -0.95 0.41 1 39 ARG -3.21 -2.10 1 40 ALA -2.22 -0.76 1 41 ARG -3.94 -0.11 1 42 THR -0.84 -0.28 1 43 VAL -3.04 -1.55 1 45 ALA 1.82 1.17 1 47 ALA -0.38 -0.09 1 48 VAL 2.37 1.69 1 49 ILE 1.37 2.24 1 51 ARG -3.59 -1.34 1 52 ILE 1.87 1.33 1 54 GLU 0.15 0.06 1 57 ASP -1.65 -1.39 1 58 ARG -3.22 -1.94 1 59 MET -0.64 -1.51 1 61 PHE -3.01 -1.34 1 62 VAL 2.62 1.43 1 63 VAL 2.31 1.92 1 66 SER -4.47 -1.94 1 67 VAL -4.52 -3.66 1 68 SER -2.19 -2.00 1 69 VAL 0.29 -0.96 1 73 ASN -0.99 -1.01 1 75 VAL -4.70 -1.58 1 76 GLU -4.08 -2.06 1 77 LEU -3.08 -1.73 1 81 ALA -4.73 -1.19 1 82 PHE -7.30 -3.51 1 83 PHE -2.60 -1.35 1 85 GLU 2.00 0.67 1 86 MET 5.63 5.11 1 87 ALA 1.55 2.57 1 88 LEU 3.49 1.42 1 89 ILE 1.72 2.42 1 90 SER -1.18 0.99 1 92 GLU 0.63 0.60 1 94 ARG 0.13 0.00 1 95 SER -0.40 1.53 1 96 ALA -4.08 -1.13 1 97 THR -0.32 -0.33 1 98 VAL -2.06 -1.29 1 99 SER -4.84 -2.31 1 100 ALA 0.34 0.53 1 101 ALA 1.85 1.52 1 102 THR -4.96 -2.12 1 103 THR 4.63 3.56 1 104 VAL -5.77 -2.61 1 105 SER -1.99 -1.46 1 107 LEU -5.60 -1.74 1 108 SER -4.81 -2.01 1 109 LEU -6.50 -2.30 1 111 SER 4.85 3.91 1 112 ALA 4.21 3.42 1 113 ASP 1.36 2.55 1 114 PHE 4.61 3.99 1 115 GLN 5.19 3.31 1 116 MET 5.01 3.60 1 117 LEU 4.40 3.32 1 119 SER 3.30 2.58 1 120 SER 1.93 2.26 1 121 SER -1.31 -1.80 1 123 GLU 3.86 3.23 1 124 ILE 4.97 2.88 1 125 ALA 4.28 3.47 1 126 GLU 2.63 2.07 1 127 ILE 5.53 4.47 1 128 PHE 4.28 2.81 1 129 ARG 4.63 4.39 1 130 LYS 4.30 3.59 1 131 THR 6.60 5.52 1 132 ALA 3.07 3.02 1 133 LEU 3.29 2.88 1 134 GLU 2.83 2.46 1 135 ARG 2.49 2.89 1 136 ARG 2.32 2.05 1 138 ALA -0.05 0.16 1 139 ALA 0.14 0.03 1 140 ALA -0.35 -0.04 1 141 SER -0.34 -0.07 1 142 ALA 0.31 1.44 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 4.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.70 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 PHE -5.56 4.37 0 64 GLU -4.67 4.24 0 110 HIS 0.25 2.64 0 106 LEU -6.80 4.77 0 70 ALA 2.07 -2.57 0 71 THR 4.86 -3.60 0 10 PHE 2.69 -0.30 1 11 VAL 4.67 -1.01 1 12 ARG 3.26 -1.01 1 13 ASN 3.36 -1.15 1 14 TRP 3.60 -0.78 1 15 GLN 3.51 -0.88 1 16 LEU 2.57 -0.14 1 17 VAL 4.53 -1.56 1 18 ALA 2.14 -0.78 1 19 ALA -1.10 0.86 1 20 VAL 0.40 -0.59 1 22 LEU 2.85 0.21 1 23 PHE 2.70 -2.44 1 24 GLN 3.19 -1.15 1 25 LYS 0.49 -0.39 1 26 LEU -1.54 0.82 1 29 ALA 3.32 -0.86 1 30 VAL 3.35 -0.83 1 31 LEU 3.98 -0.71 1 32 VAL 5.81 -1.16 1 33 GLU 2.56 -0.58 1 34 ILE 3.38 -2.65 1 35 VAL 6.99 -2.03 1 36 ARG 3.04 -0.47 1 37 ALA -0.27 0.67 1 38 LEU -0.95 1.36 1 39 ARG -3.21 1.11 1 40 ALA -2.22 1.46 1 41 ARG -3.94 3.83 1 42 THR -0.84 0.56 1 43 VAL -3.04 1.49 1 45 ALA 1.82 -0.65 1 47 ALA -0.38 0.29 1 48 VAL 2.37 -0.68 1 49 ILE 1.37 0.87 1 51 ARG -3.59 2.25 1 52 ILE 1.87 -0.54 1 54 GLU 0.15 -0.09 1 57 ASP -1.65 0.26 1 58 ARG -3.22 1.28 1 59 MET -0.64 -0.87 1 61 PHE -3.01 1.67 1 62 VAL 2.62 -1.19 1 63 VAL 2.31 -0.39 1 66 SER -4.47 2.53 1 67 VAL -4.52 0.86 1 68 SER -2.19 0.19 1 69 VAL 0.29 -1.25 1 73 ASN -0.99 -0.02 1 75 VAL -4.70 3.12 1 76 GLU -4.08 2.02 1 77 LEU -3.08 1.35 1 81 ALA -4.73 3.54 1 82 PHE -7.30 3.79 1 83 PHE -2.60 1.25 1 85 GLU 2.00 -1.33 1 86 MET 5.63 -0.52 1 87 ALA 1.55 1.02 1 88 LEU 3.49 -2.07 1 89 ILE 1.72 0.70 1 90 SER -1.18 2.17 1 92 GLU 0.63 -0.03 1 94 ARG 0.13 -0.13 1 95 SER -0.40 1.93 1 96 ALA -4.08 2.95 1 97 THR -0.32 -0.01 1 98 VAL -2.06 0.77 1 99 SER -4.84 2.53 1 100 ALA 0.34 0.19 1 101 ALA 1.85 -0.33 1 102 THR -4.96 2.84 1 103 THR 4.63 -1.07 1 104 VAL -5.77 3.16 1 105 SER -1.99 0.53 1 107 LEU -5.60 3.86 1 108 SER -4.81 2.80 1 109 LEU -6.50 4.20 1 111 SER 4.85 -0.94 1 112 ALA 4.21 -0.79 1 113 ASP 1.36 1.19 1 114 PHE 4.61 -0.62 1 115 GLN 5.19 -1.88 1 116 MET 5.01 -1.41 1 117 LEU 4.40 -1.08 1 119 SER 3.30 -0.72 1 120 SER 1.93 0.33 1 121 SER -1.31 -0.49 1 123 GLU 3.86 -0.63 1 124 ILE 4.97 -2.09 1 125 ALA 4.28 -0.81 1 126 GLU 2.63 -0.56 1 127 ILE 5.53 -1.06 1 128 PHE 4.28 -1.47 1 129 ARG 4.63 -0.24 1 130 LYS 4.30 -0.71 1 131 THR 6.60 -1.08 1 132 ALA 3.07 -0.05 1 133 LEU 3.29 -0.41 1 134 GLU 2.83 -0.37 1 135 ARG 2.49 0.40 1 136 ARG 2.32 -0.27 1 138 ALA -0.05 0.21 1 139 ALA 0.14 -0.11 1 140 ALA -0.35 0.31 1 141 SER -0.34 0.27 1 142 ALA 0.31 1.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 0.89 _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 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _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 103 THR 4.63 0.29 0 42 THR -0.84 1.07 0 10 PHE 2.69 -0.28 1 11 VAL 4.67 -0.41 1 12 ARG 3.26 -0.20 1 13 ASN 3.36 -0.43 1 14 TRP 3.60 -0.65 1 15 GLN 3.51 -0.35 1 16 LEU 2.57 -0.24 1 17 VAL 4.53 -0.62 1 18 ALA 2.14 -0.33 1 19 ALA -1.10 0.04 1 20 VAL 0.40 0.03 1 22 LEU 2.85 -0.45 1 23 PHE 2.70 -0.32 1 24 GLN 3.19 -0.20 1 25 LYS 0.49 -0.07 1 26 LEU -1.54 -0.05 1 29 ALA 3.32 -0.16 1 30 VAL 3.35 -0.32 1 31 LEU 3.98 -0.54 1 32 VAL 5.81 -0.52 1 33 GLU 2.56 -0.31 1 34 ILE 3.38 -0.37 1 35 VAL 6.99 -0.94 1 36 ARG 3.04 -0.46 1 37 ALA -0.27 -0.03 1 38 LEU -0.95 0.23 1 39 ARG -3.21 0.53 1 40 ALA -2.22 0.94 1 41 ARG -3.94 0.34 1 43 VAL -3.04 0.25 1 45 ALA 1.82 -0.95 1 47 ALA -0.38 -0.06 1 48 VAL 2.37 -0.41 1 49 ILE 1.37 -0.33 1 51 ARG -3.59 0.41 1 52 ILE 1.87 -0.86 1 54 GLU 0.15 0.12 1 57 ASP -1.65 -0.16 1 58 ARG -3.22 0.39 1 59 MET -0.64 -0.06 1 60 PHE -5.56 0.65 1 61 PHE -3.01 0.51 1 62 VAL 2.62 -0.13 1 63 VAL 2.31 0.06 1 64 GLU -4.67 0.12 1 66 SER -4.47 0.99 1 67 VAL -4.52 0.75 1 68 SER -2.19 0.41 1 69 VAL 0.29 -0.18 1 70 ALA 2.07 0.14 1 71 THR 4.86 -0.23 1 73 ASN -0.99 0.16 1 75 VAL -4.70 0.16 1 76 GLU -4.08 0.90 1 77 LEU -3.08 0.34 1 81 ALA -4.73 0.26 1 82 PHE -7.30 1.14 1 83 PHE -2.60 1.01 1 85 GLU 2.00 -0.78 1 86 MET 5.63 -0.74 1 87 ALA 1.55 -0.08 1 88 LEU 3.49 -0.56 1 89 ILE 1.72 -0.31 1 90 SER -1.18 0.01 1 92 GLU 0.63 -0.19 1 94 ARG 0.13 0.01 1 95 SER -0.40 -0.21 1 96 ALA -4.08 0.13 1 97 THR -0.32 0.37 1 98 VAL -2.06 0.77 1 99 SER -4.84 0.75 1 100 ALA 0.34 -0.08 1 101 ALA 1.85 -0.01 1 102 THR -4.96 0.14 1 104 VAL -5.77 1.04 1 105 SER -1.99 0.71 1 106 LEU -6.80 1.29 1 107 LEU -5.60 0.97 1 108 SER -4.81 0.90 1 109 LEU -6.50 0.59 1 110 HIS 0.25 -0.31 1 111 SER 4.85 -0.70 1 112 ALA 4.21 -0.12 1 113 ASP 1.36 -0.03 1 114 PHE 4.61 -0.58 1 115 GLN 5.19 -0.53 1 116 MET 5.01 -0.39 1 117 LEU 4.40 -0.52 1 119 SER 3.30 -0.36 1 120 SER 1.93 -0.14 1 121 SER -1.31 0.17 1 123 GLU 3.86 -0.34 1 124 ILE 4.97 -0.67 1 125 ALA 4.28 -0.32 1 126 GLU 2.63 -0.15 1 127 ILE 5.53 -0.42 1 128 PHE 4.28 -0.22 1 129 ARG 4.63 -0.35 1 130 LYS 4.30 -0.31 1 131 THR 6.60 -0.37 1 132 ALA 3.07 -0.37 1 133 LEU 3.29 -0.31 1 134 GLU 2.83 -0.33 1 135 ARG 2.49 -0.46 1 136 ARG 2.32 -0.24 1 138 ALA -0.05 0.02 1 139 ALA 0.14 0.02 1 140 ALA -0.35 0.02 1 141 SER -0.34 -0.05 1 142 ALA 0.31 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 -2.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 6.98 _LACS_plot.Line_2_terminator_val_y_2 2.68 _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 33 GLU 2.56 -2.91 0 10 PHE 2.69 0.44 1 11 VAL 4.67 1.56 1 12 ARG 3.26 1.82 1 13 ASN 3.36 0.47 1 14 TRP 3.60 1.76 1 15 GLN 3.51 2.53 1 16 LEU 2.57 0.24 1 17 VAL 4.53 1.63 1 18 ALA 2.14 0.13 1 19 ALA -1.10 -1.18 1 22 LEU 2.85 0.27 1 23 PHE 2.70 1.67 1 24 GLN 3.19 0.93 1 25 LYS 0.49 0.12 1 26 LEU -1.54 -0.60 1 29 ALA 3.32 2.41 1 30 VAL 3.35 1.32 1 31 LEU 3.98 0.39 1 32 VAL 5.81 0.96 1 34 ILE 3.38 1.10 1 35 VAL 6.99 1.45 1 36 ARG 3.04 0.45 1 37 ALA -0.27 0.83 1 38 LEU -0.95 -0.53 1 39 ARG -3.21 -0.58 1 40 ALA -2.22 -0.21 1 41 ARG -3.94 -2.20 1 42 THR -0.84 -0.47 1 45 ALA 1.82 0.78 1 47 ALA -0.38 -0.75 1 48 VAL 2.37 -0.11 1 49 ILE 1.37 -0.27 1 51 ARG -3.59 -1.90 1 52 ILE 1.87 -1.73 1 57 ASP -1.65 -1.62 1 58 ARG -3.22 -3.33 1 59 MET -0.64 -3.70 1 60 PHE -5.56 -2.33 1 61 PHE -3.01 -0.21 1 62 VAL 2.62 -0.60 1 63 VAL 2.31 -1.11 1 64 GLU -4.67 -2.40 1 66 SER -4.47 -0.23 1 67 VAL -4.52 -2.70 1 68 SER -2.19 -1.02 1 69 VAL 0.29 -0.30 1 70 ALA 2.07 1.56 1 75 VAL -4.70 -2.48 1 76 GLU -4.08 -0.74 1 77 LEU -3.08 -2.31 1 81 ALA -4.73 -1.68 1 82 PHE -7.30 -1.73 1 83 PHE -2.60 -1.46 1 85 GLU 2.00 0.69 1 86 MET 5.63 2.47 1 87 ALA 1.55 2.32 1 88 LEU 3.49 0.96 1 89 ILE 1.72 0.99 1 90 SER -1.18 1.37 1 94 ARG 0.13 2.68 1 95 SER -0.40 -0.95 1 96 ALA -4.08 -3.30 1 97 THR -0.32 -1.04 1 98 VAL -2.06 -1.43 1 99 SER -4.84 -2.13 1 100 ALA 0.34 -0.24 1 101 ALA 1.85 -0.14 1 102 THR -4.96 -1.02 1 103 THR 4.63 1.97 1 104 VAL -5.77 -2.38 1 105 SER -1.99 -1.26 1 106 LEU -6.80 -0.56 1 107 LEU -5.60 -1.37 1 108 SER -4.81 -1.79 1 109 LEU -6.50 -2.55 1 110 HIS 0.25 2.18 1 111 SER 4.85 1.22 1 112 ALA 4.21 2.77 1 113 ASP 1.36 1.45 1 114 PHE 4.61 1.18 1 115 GLN 5.19 2.80 1 116 MET 5.01 2.47 1 117 LEU 4.40 0.23 1 119 SER 3.30 1.18 1 123 GLU 3.86 2.59 1 124 ILE 4.97 1.16 1 125 ALA 4.28 2.26 1 126 GLU 2.63 1.71 1 127 ILE 5.53 4.00 1 128 PHE 4.28 1.54 1 129 ARG 4.63 2.91 1 130 LYS 4.30 2.90 1 131 THR 6.60 0.76 1 132 ALA 3.07 1.80 1 133 LEU 3.29 2.71 1 134 GLU 2.83 3.08 1 135 ARG 2.49 1.02 1 136 ARG 2.32 1.73 1 138 ALA -0.05 -0.10 1 139 ALA 0.14 -0.24 1 140 ALA -0.35 -0.14 1 141 SER -0.34 -1.36 1 stop_ save_