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 bmr10235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 -3.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 6.44 _LACS_plot.Line_2_terminator_val_y_2 4.71 _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 111 HIS -4.53 0.59 0 87 PHE -3.85 1.20 0 11 LYS 0.34 0.31 1 12 THR 0.29 0.20 1 13 GLU -0.76 -0.28 1 14 LEU 0.15 0.17 1 15 VAL -1.07 -0.47 1 16 GLN -2.65 -0.48 1 17 LYS -3.16 -1.11 1 18 PHE -4.08 -1.07 1 19 ARG 1.13 0.30 1 20 VAL -6.02 -2.77 1 21 GLN -5.57 -0.76 1 22 TYR -6.21 -3.40 1 23 LEU 4.41 3.77 1 25 MET -4.27 -3.10 1 26 LEU -6.01 -1.00 1 28 VAL -6.36 -3.24 1 29 ASP 0.09 0.70 1 30 ARG -4.18 -1.56 1 32 VAL -7.82 -3.89 1 34 MET 3.38 0.98 1 35 ASP 5.10 2.64 1 36 THR 5.56 4.20 1 37 LEU 2.27 3.52 1 38 ASN 4.16 3.48 1 39 SER 4.80 3.58 1 40 ALA 2.75 2.68 1 41 ILE 5.08 5.18 1 42 GLU 3.59 2.99 1 43 ASN 3.31 3.40 1 44 LEU 3.20 2.77 1 45 MET 2.63 3.39 1 46 THR 1.72 1.79 1 47 SER 0.28 0.80 1 48 SER -2.47 -0.63 1 49 SER -2.67 -1.44 1 50 LYS 1.89 0.90 1 51 GLU 2.66 1.50 1 52 ASP -0.37 0.33 1 53 TRP -2.10 -2.52 1 55 SER 1.16 0.84 1 56 VAL -6.38 -3.32 1 57 ASN -3.26 -1.00 1 58 MET -4.09 -0.97 1 59 ASN -2.99 -1.25 1 60 VAL 0.13 -0.12 1 61 ALA -4.17 -1.22 1 62 ASP 3.19 1.94 1 63 ALA 0.32 0.25 1 64 THR -2.58 0.20 1 65 VAL -1.68 -0.82 1 66 THR -1.54 -0.60 1 67 VAL -0.82 -0.93 1 68 ILE -4.04 -1.23 1 69 SER 0.49 0.65 1 70 GLU 1.56 1.71 1 71 LYS 0.54 0.81 1 72 ASN -0.15 -0.15 1 73 GLU 1.84 1.31 1 74 GLU 0.17 -0.14 1 75 GLU -1.01 -0.57 1 76 VAL 1.63 0.62 1 77 LEU 1.23 1.63 1 78 VAL -3.76 -0.93 1 79 GLU -3.20 -0.96 1 81 ARG 1.91 0.84 1 82 VAL 6.03 3.92 1 83 ARG 3.40 1.84 1 84 PHE -0.19 -0.63 1 85 LEU 1.30 0.89 1 86 SER 1.37 1.85 1 88 MET -4.18 -0.51 1 90 VAL -2.25 -1.42 1 92 LYS 3.62 2.92 1 93 ASP -2.37 -0.96 1 94 VAL 3.28 1.56 1 95 HIS 5.87 3.07 1 96 THR -3.69 -1.42 1 97 PHE -7.13 -2.15 1 98 ALA -8.91 -2.71 1 99 PHE -6.36 -2.70 1 100 ILE -1.41 -0.43 1 101 MET -6.31 -1.77 1 102 ASP -1.83 -0.96 1 103 THR 0.81 -0.06 1 105 ASN 1.06 0.28 1 106 GLN 4.42 1.09 1 107 ARG -0.96 -1.30 1 108 PHE -2.66 -1.88 1 109 GLU -5.24 -1.31 1 112 VAL -1.31 -0.52 1 113 PHE -4.21 -0.85 1 114 TRP -2.71 -0.65 1 116 GLU -2.73 -0.92 1 118 ASN 0.05 -0.15 1 119 ALA -2.10 -0.11 1 120 ALA 5.03 4.29 1 121 ASN 4.65 2.94 1 122 VAL 4.74 3.38 1 123 SER 3.25 2.38 1 124 GLU 2.97 2.70 1 125 ALA 2.57 2.50 1 126 VAL 6.45 4.86 1 127 GLN 4.62 4.07 1 128 ALA 3.48 2.35 1 129 ALA 2.71 1.74 1 131 SER 0.62 0.78 1 134 SER -0.09 0.01 1 135 SER -0.22 0.07 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 5.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 6.44 _LACS_plot.Line_2_terminator_val_y_2 -1.73 _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 111 HIS -4.53 5.12 0 87 PHE -3.85 5.05 0 11 LYS 0.34 -0.03 1 12 THR 0.29 -0.09 1 13 GLU -0.76 0.48 1 14 LEU 0.15 0.02 1 15 VAL -1.07 0.60 1 16 GLN -2.65 2.17 1 17 LYS -3.16 2.05 1 18 PHE -4.08 3.01 1 19 ARG 1.13 -0.83 1 20 VAL -6.02 3.25 1 21 GLN -5.57 4.81 1 22 TYR -6.21 2.81 1 23 LEU 4.41 -0.64 1 25 MET -4.27 1.17 1 26 LEU -6.01 5.01 1 28 VAL -6.36 3.12 1 29 ASP 0.09 0.61 1 30 ARG -4.18 2.62 1 32 VAL -7.82 3.93 1 34 MET 3.38 -2.40 1 35 ASP 5.10 -2.46 1 36 THR 5.56 -1.36 1 37 LEU 2.27 1.25 1 38 ASN 4.16 -0.68 1 39 SER 4.80 -1.22 1 40 ALA 2.75 -0.07 1 41 ILE 5.08 0.10 1 42 GLU 3.59 -0.60 1 43 ASN 3.31 0.09 1 44 LEU 3.20 -0.43 1 45 MET 2.63 0.76 1 46 THR 1.72 0.07 1 47 SER 0.28 0.52 1 48 SER -2.47 1.84 1 49 SER -2.67 1.23 1 50 LYS 1.89 -0.99 1 51 GLU 2.66 -1.16 1 52 ASP -0.37 0.70 1 53 TRP -2.10 -0.42 1 55 SER 1.16 -0.32 1 56 VAL -6.38 3.06 1 57 ASN -3.26 2.26 1 58 MET -4.09 3.12 1 59 ASN -2.99 1.74 1 60 VAL 0.13 -0.25 1 61 ALA -4.17 2.95 1 62 ASP 3.19 -1.25 1 63 ALA 0.32 -0.07 1 64 THR -2.58 2.78 1 65 VAL -1.68 0.86 1 66 THR -1.54 0.94 1 67 VAL -0.82 -0.11 1 68 ILE -4.04 2.81 1 69 SER 0.49 0.16 1 70 GLU 1.56 0.15 1 71 LYS 0.54 0.27 1 72 ASN -0.15 0.00 1 73 GLU 1.84 -0.53 1 74 GLU 0.17 -0.31 1 75 GLU -1.01 0.44 1 76 VAL 1.63 -1.01 1 77 LEU 1.23 0.40 1 78 VAL -3.76 2.83 1 79 GLU -3.20 2.24 1 81 ARG 1.91 -1.07 1 82 VAL 6.03 -2.11 1 83 ARG 3.40 -1.56 1 84 PHE -0.19 -0.44 1 85 LEU 1.30 -0.41 1 86 SER 1.37 0.48 1 88 MET -4.18 3.67 1 90 VAL -2.25 0.83 1 92 LYS 3.62 -0.70 1 93 ASP -2.37 1.41 1 94 VAL 3.28 -1.72 1 95 HIS 5.87 -2.80 1 96 THR -3.69 2.27 1 97 PHE -7.13 4.98 1 98 ALA -8.91 6.20 1 99 PHE -6.36 3.66 1 100 ILE -1.41 0.98 1 101 MET -6.31 4.54 1 102 ASP -1.83 0.87 1 103 THR 0.81 -0.87 1 105 ASN 1.06 -0.78 1 106 GLN 4.42 -3.33 1 107 ARG -0.96 -0.34 1 108 PHE -2.66 0.78 1 109 GLU -5.24 3.93 1 112 VAL -1.31 0.79 1 113 PHE -4.21 3.36 1 114 TRP -2.71 2.06 1 116 GLU -2.73 1.81 1 118 ASN 0.05 -0.20 1 119 ALA -2.10 1.99 1 120 ALA 5.03 -0.74 1 121 ASN 4.65 -1.71 1 122 VAL 4.74 -1.36 1 123 SER 3.25 -0.87 1 124 GLU 2.97 -0.27 1 125 ALA 2.57 -0.07 1 126 VAL 6.45 -1.59 1 127 GLN 4.62 -0.55 1 128 ALA 3.48 -1.13 1 129 ALA 2.71 -0.97 1 131 SER 0.62 0.16 1 134 SER -0.09 0.10 1 135 SER -0.22 0.29 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 1.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _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 6.44 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 50 LYS 1.89 -2.94 0 11 LYS 0.34 0.02 1 12 THR 0.29 -0.06 1 13 GLU -0.76 -0.02 1 14 LEU 0.15 0.00 1 15 VAL -1.07 0.15 1 16 GLN -2.65 0.01 1 17 LYS -3.16 0.78 1 18 PHE -4.08 0.13 1 19 ARG 1.13 0.96 1 20 VAL -6.02 1.22 1 21 GLN -5.57 1.44 1 22 TYR -6.21 0.58 1 23 LEU 4.41 -0.99 1 25 MET -4.27 0.69 1 26 LEU -6.01 0.15 1 28 VAL -6.36 0.68 1 29 ASP 0.09 0.10 1 30 ARG -4.18 -0.13 1 32 VAL -7.82 -0.23 1 34 MET 3.38 0.02 1 35 ASP 5.10 -0.25 1 36 THR 5.56 -0.63 1 37 LEU 2.27 -0.57 1 38 ASN 4.16 -0.28 1 39 SER 4.80 -0.25 1 40 ALA 2.75 -0.25 1 41 ILE 5.08 -0.80 1 42 GLU 3.59 -0.42 1 43 ASN 3.31 -0.40 1 44 LEU 3.20 -0.23 1 45 MET 2.63 -0.23 1 46 THR 1.72 0.09 1 47 SER 0.28 0.11 1 48 SER -2.47 0.25 1 49 SER -2.67 -0.06 1 51 GLU 2.66 -0.56 1 52 ASP -0.37 -0.05 1 53 TRP -2.10 0.28 1 55 SER 1.16 0.59 1 56 VAL -6.38 0.91 1 57 ASN -3.26 0.88 1 58 MET -4.09 0.47 1 59 ASN -2.99 0.69 1 60 VAL 0.13 0.42 1 61 ALA -4.17 0.40 1 62 ASP 3.19 -0.33 1 63 ALA 0.32 -0.18 1 64 THR -2.58 0.57 1 65 VAL -1.68 0.59 1 66 THR -1.54 0.73 1 67 VAL -0.82 0.75 1 68 ILE -4.04 0.72 1 69 SER 0.49 -0.07 1 70 GLU 1.56 -0.14 1 71 LYS 0.54 -0.03 1 72 ASN -0.15 0.01 1 73 GLU 1.84 -0.17 1 74 GLU 0.17 -0.14 1 75 GLU -1.01 -0.02 1 76 VAL 1.63 -0.05 1 77 LEU 1.23 0.03 1 78 VAL -3.76 0.10 1 79 GLU -3.20 0.55 1 81 ARG 1.91 0.41 1 82 VAL 6.03 -0.40 1 83 ARG 3.40 -0.18 1 84 PHE -0.19 0.33 1 85 LEU 1.30 0.50 1 86 SER 1.37 -0.03 1 87 PHE -3.85 0.05 1 88 MET -4.18 0.72 1 90 VAL -2.25 0.79 1 92 LYS 3.62 -0.46 1 93 ASP -2.37 0.31 1 94 VAL 3.28 -0.16 1 95 HIS 5.87 -0.76 1 96 THR -3.69 0.86 1 97 PHE -7.13 0.66 1 98 ALA -8.91 1.20 1 99 PHE -6.36 0.77 1 100 ILE -1.41 0.91 1 101 MET -6.31 1.22 1 102 ASP -1.83 0.40 1 103 THR 0.81 -0.12 1 105 ASN 1.06 -0.24 1 106 GLN 4.42 -0.99 1 107 ARG -0.96 -0.04 1 108 PHE -2.66 0.92 1 109 GLU -5.24 0.28 1 111 HIS -4.53 0.04 1 112 VAL -1.31 0.44 1 113 PHE -4.21 0.84 1 114 TRP -2.71 0.23 1 116 GLU -2.73 0.07 1 118 ASN 0.05 -0.80 1 119 ALA -2.10 -0.16 1 120 ALA 5.03 -0.54 1 121 ASN 4.65 -0.40 1 122 VAL 4.74 -1.90 1 123 SER 3.25 -1.15 1 124 GLU 2.97 -0.48 1 125 ALA 2.57 -0.13 1 126 VAL 6.45 -0.76 1 127 GLN 4.62 -0.48 1 128 ALA 3.48 -0.22 1 129 ALA 2.71 -0.12 1 131 SER 0.62 -0.01 1 135 SER -0.22 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10235_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.91 _LACS_plot.Line_1_terminator_val_y_1 -3.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 6.44 _LACS_plot.Line_2_terminator_val_y_2 2.32 _LACS_plot.Y_axis_chem_shift_offset 0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 LEU 4.41 -1.92 0 106 GLN 4.42 -2.15 0 11 LYS 0.34 0.27 1 12 THR 0.29 -0.31 1 13 GLU -0.76 -0.62 1 14 LEU 0.15 -1.00 1 15 VAL -1.07 -0.79 1 16 GLN -2.65 -2.66 1 17 LYS -3.16 -1.41 1 18 PHE -4.08 -1.50 1 19 ARG 1.13 0.04 1 20 VAL -6.02 -1.73 1 21 GLN -5.57 -0.09 1 22 TYR -6.21 -2.26 1 25 MET -4.27 -0.75 1 26 LEU -6.01 -1.08 1 28 VAL -6.36 -0.19 1 29 ASP 0.09 -0.40 1 30 ARG -4.18 -1.25 1 32 VAL -7.82 -1.67 1 34 MET 3.38 1.97 1 35 ASP 5.10 2.62 1 36 THR 5.56 1.74 1 37 LEU 2.27 0.56 1 38 ASN 4.16 2.82 1 39 SER 4.80 1.73 1 40 ALA 2.75 1.01 1 41 ILE 5.08 1.36 1 42 GLU 3.59 2.77 1 43 ASN 3.31 3.42 1 44 LEU 3.20 2.16 1 45 MET 2.63 0.90 1 46 THR 1.72 1.06 1 47 SER 0.28 -1.19 1 48 SER -2.47 -2.41 1 49 SER -2.67 -1.14 1 50 LYS 1.89 0.66 1 51 GLU 2.66 0.34 1 52 ASP -0.37 0.45 1 53 TRP -2.10 -0.16 1 55 SER 1.16 -0.09 1 56 VAL -6.38 -2.71 1 57 ASN -3.26 -0.96 1 58 MET -4.09 -2.64 1 59 ASN -2.99 -0.57 1 60 VAL 0.13 -1.88 1 61 ALA -4.17 -1.87 1 62 ASP 3.19 0.49 1 63 ALA 0.32 -0.30 1 64 THR -2.58 -2.68 1 65 VAL -1.68 -1.78 1 66 THR -1.54 -1.40 1 67 VAL -0.82 -1.92 1 68 ILE -4.04 -0.98 1 69 SER 0.49 0.38 1 70 GLU 1.56 0.53 1 71 LYS 0.54 -0.22 1 72 ASN -0.15 -0.57 1 73 GLU 1.84 -0.95 1 74 GLU 0.17 -0.37 1 75 GLU -1.01 -2.67 1 76 VAL 1.63 0.28 1 77 LEU 1.23 -0.07 1 78 VAL -3.76 -3.61 1 79 GLU -3.20 -2.63 1 81 ARG 1.91 2.56 1 82 VAL 6.03 1.27 1 83 ARG 3.40 0.18 1 84 PHE -0.19 -1.72 1 85 LEU 1.30 -1.70 1 86 SER 1.37 0.80 1 87 PHE -3.85 -3.38 1 88 MET -4.18 -4.03 1 90 VAL -2.25 1.11 1 92 LYS 3.62 2.20 1 93 ASP -2.37 1.83 1 94 VAL 3.28 -0.17 1 95 HIS 5.87 1.80 1 96 THR -3.69 -2.17 1 97 PHE -7.13 -3.41 1 98 ALA -8.91 -3.51 1 99 PHE -6.36 -3.09 1 100 ILE -1.41 -2.15 1 101 MET -6.31 -1.75 1 102 ASP -1.83 0.56 1 103 THR 0.81 0.56 1 105 ASN 1.06 -1.04 1 107 ARG -0.96 -1.79 1 108 PHE -2.66 0.11 1 109 GLU -5.24 -2.44 1 111 HIS -4.53 0.17 1 112 VAL -1.31 -3.02 1 113 PHE -4.21 -2.43 1 114 TRP -2.71 -0.07 1 116 GLU -2.73 1.75 1 118 ASN 0.05 -1.61 1 119 ALA -2.10 -1.13 1 120 ALA 5.03 1.64 1 121 ASN 4.65 2.67 1 122 VAL 4.74 -0.20 1 123 SER 3.25 2.53 1 124 GLU 2.97 2.42 1 125 ALA 2.57 2.85 1 126 VAL 6.45 1.54 1 127 GLN 4.62 3.26 1 128 ALA 3.48 2.56 1 129 ALA 2.71 1.38 1 131 SER 0.62 0.00 1 134 SER -0.09 0.07 1 135 SER -0.22 -0.66 1 stop_ save_