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 bmr10236_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.70 _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 -1.43 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 4.69 _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 87 PHE -7.14 -0.45 0 11 LYS 0.24 0.07 1 12 THR 0.01 -0.10 1 13 GLU -0.63 -0.16 1 14 LEU 0.10 0.02 1 15 VAL -0.92 -0.42 1 16 GLN -2.59 -0.44 1 17 LYS -3.05 -1.09 1 18 PHE -4.29 -1.35 1 19 ARG 0.96 0.17 1 20 VAL -6.00 -2.72 1 21 GLN -5.70 -0.78 1 22 TYR -5.95 -3.44 1 23 LEU 4.45 3.83 1 25 MET -4.39 -3.27 1 26 LEU -6.22 -1.27 1 28 VAL -6.62 -3.30 1 29 ASP -0.13 0.59 1 30 ARG -4.25 -1.69 1 32 VAL -8.15 -4.15 1 34 MET 3.73 0.13 1 35 ASP 5.31 2.73 1 36 THR 5.77 4.44 1 37 LEU 1.88 3.67 1 38 ASN 4.31 3.42 1 39 SER 4.82 3.55 1 40 ALA 3.13 2.57 1 41 ILE 5.28 5.43 1 42 GLU 3.70 2.85 1 43 ASN 3.40 3.34 1 44 LEU 3.28 2.78 1 45 MET 2.53 3.30 1 46 THR 1.70 1.73 1 47 SER 0.24 0.77 1 48 SER -2.56 -0.63 1 49 SER -2.64 -1.43 1 50 LYS 2.06 1.06 1 51 GLU 2.74 1.49 1 52 ASP -0.28 0.43 1 53 TRP -2.12 -2.64 1 55 SER 1.29 0.83 1 56 VAL -6.43 -3.47 1 57 ASN -3.27 -1.02 1 58 MET -4.02 -1.02 1 59 ASN -2.84 -1.27 1 60 VAL 0.14 -0.11 1 61 ALA -4.29 -1.33 1 62 ASP 3.18 1.91 1 63 ALA 0.47 0.27 1 64 THR -2.72 0.06 1 65 VAL -1.52 -0.79 1 66 THR -1.59 -0.66 1 67 VAL -0.61 -0.91 1 68 ILE -4.06 -1.29 1 69 SER 0.49 0.60 1 70 GLU 1.65 1.74 1 71 LYS 0.41 0.57 1 72 ASN -0.02 -0.12 1 73 GLU 2.03 1.37 1 74 GLU 0.30 -0.12 1 75 GLU -1.04 -0.74 1 76 VAL 1.69 0.57 1 77 LEU 1.06 1.52 1 78 VAL -3.84 -0.97 1 79 GLU -3.27 -1.15 1 81 ARG 1.40 0.35 1 82 VAL 6.15 4.28 1 83 ARG 2.96 1.67 1 84 PHE 0.17 0.00 1 85 LEU -0.48 0.35 1 86 SER 3.33 2.30 1 88 MET -5.06 -1.09 1 90 VAL -5.51 -2.68 1 92 LYS 3.84 3.01 1 93 ASP -2.73 -1.29 1 94 VAL 2.59 1.39 1 95 HIS 6.34 3.15 1 96 THR -3.47 -1.34 1 97 PHE -7.99 -2.87 1 98 ALA -8.70 -2.60 1 99 PHE -6.34 -2.73 1 100 ILE -1.55 -0.47 1 101 MET -7.30 -2.16 1 102 ASP -3.75 -1.32 1 103 THR 1.27 0.22 1 105 ASN 1.41 0.37 1 106 GLN 4.89 1.33 1 107 ARG -0.77 -1.34 1 108 PHE -2.82 -1.23 1 109 GLU -5.86 -1.57 1 111 HIS -4.48 0.53 1 112 VAL -1.32 -0.67 1 113 PHE -4.48 -0.85 1 114 TRP -2.50 -0.82 1 116 GLU -2.39 -0.64 1 118 ASN -0.13 -0.52 1 119 ALA -1.48 0.13 1 120 ALA 6.04 5.20 1 121 ASN 4.71 3.01 1 122 VAL 4.41 3.14 1 123 SER 3.40 2.99 1 124 GLU 3.88 3.37 1 125 ALA 2.56 2.32 1 126 VAL 6.39 4.73 1 127 GLN 5.54 4.63 1 128 ALA 3.60 2.30 1 129 ALA 3.08 1.64 1 131 SER 0.55 0.93 1 134 SER -0.50 -0.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10236_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 5.52 _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 0.57 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _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 87 PHE -7.14 6.69 0 11 LYS 0.24 -0.17 1 12 THR 0.01 -0.11 1 13 GLU -0.63 0.47 1 14 LEU 0.10 -0.08 1 15 VAL -0.92 0.50 1 16 GLN -2.59 2.15 1 17 LYS -3.05 1.96 1 18 PHE -4.29 2.94 1 19 ARG 0.96 -0.79 1 20 VAL -6.00 3.28 1 21 GLN -5.70 4.92 1 22 TYR -5.95 2.51 1 23 LEU 4.45 -0.62 1 25 MET -4.39 1.12 1 26 LEU -6.22 4.95 1 28 VAL -6.62 3.32 1 29 ASP -0.13 0.72 1 30 ARG -4.25 2.56 1 32 VAL -8.15 4.00 1 34 MET 3.73 -3.60 1 35 ASP 5.31 -2.58 1 36 THR 5.77 -1.33 1 37 LEU 1.88 1.79 1 38 ASN 4.31 -0.89 1 39 SER 4.82 -1.27 1 40 ALA 3.13 -0.56 1 41 ILE 5.28 0.15 1 42 GLU 3.70 -0.85 1 43 ASN 3.40 -0.06 1 44 LEU 3.28 -0.50 1 45 MET 2.53 0.77 1 46 THR 1.70 0.03 1 47 SER 0.24 0.53 1 48 SER -2.56 1.93 1 49 SER -2.64 1.21 1 50 LYS 2.06 -1.00 1 51 GLU 2.74 -1.25 1 52 ASP -0.28 0.71 1 53 TRP -2.12 -0.52 1 55 SER 1.29 -0.46 1 56 VAL -6.43 2.96 1 57 ASN -3.27 2.25 1 58 MET -4.02 3.00 1 59 ASN -2.84 1.57 1 60 VAL 0.14 -0.25 1 61 ALA -4.29 2.96 1 62 ASP 3.18 -1.27 1 63 ALA 0.47 -0.20 1 64 THR -2.72 2.78 1 65 VAL -1.52 0.73 1 66 THR -1.59 0.93 1 67 VAL -0.61 -0.30 1 68 ILE -4.06 2.77 1 69 SER 0.49 0.11 1 70 GLU 1.65 0.09 1 71 LYS 0.41 0.16 1 72 ASN -0.02 -0.10 1 73 GLU 2.03 -0.66 1 74 GLU 0.30 -0.42 1 75 GLU -1.04 0.30 1 76 VAL 1.69 -1.12 1 77 LEU 1.06 0.46 1 78 VAL -3.84 2.87 1 79 GLU -3.27 2.12 1 81 ARG 1.40 -1.05 1 82 VAL 6.15 -1.87 1 83 ARG 2.96 -1.29 1 84 PHE 0.17 -0.17 1 85 LEU -0.48 0.83 1 86 SER 3.33 -1.03 1 88 MET -5.06 3.97 1 90 VAL -5.51 2.83 1 92 LYS 3.84 -0.83 1 93 ASP -2.73 1.44 1 94 VAL 2.59 -1.20 1 95 HIS 6.34 -3.19 1 96 THR -3.47 2.13 1 97 PHE -7.99 5.12 1 98 ALA -8.70 6.10 1 99 PHE -6.34 3.61 1 100 ILE -1.55 1.08 1 101 MET -7.30 5.14 1 102 ASP -3.75 2.43 1 103 THR 1.27 -1.05 1 105 ASN 1.41 -1.04 1 106 GLN 4.89 -3.56 1 107 ARG -0.77 -0.57 1 108 PHE -2.82 1.59 1 109 GLU -5.86 4.29 1 111 HIS -4.48 5.01 1 112 VAL -1.32 0.65 1 113 PHE -4.48 3.63 1 114 TRP -2.50 1.68 1 116 GLU -2.39 1.75 1 118 ASN -0.13 -0.39 1 119 ALA -1.48 1.61 1 120 ALA 6.04 -0.84 1 121 ASN 4.71 -1.70 1 122 VAL 4.41 -1.27 1 123 SER 3.40 -0.41 1 124 GLU 3.88 -0.51 1 125 ALA 2.56 -0.24 1 126 VAL 6.39 -1.66 1 127 GLN 5.54 -0.91 1 128 ALA 3.60 -1.30 1 129 ALA 3.08 -1.44 1 131 SER 0.55 0.38 1 134 SER -0.50 0.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10236_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 1.10 _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 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _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 50 LYS 2.06 -3.01 0 11 LYS 0.24 -0.02 1 12 THR 0.01 -0.09 1 13 GLU -0.63 -0.05 1 14 LEU 0.10 -0.02 1 15 VAL -0.92 0.12 1 16 GLN -2.59 -0.02 1 17 LYS -3.05 0.77 1 18 PHE -4.29 0.10 1 19 ARG 0.96 0.95 1 20 VAL -6.00 1.20 1 21 GLN -5.70 1.44 1 22 TYR -5.95 0.57 1 23 LEU 4.45 -1.04 1 25 MET -4.39 0.70 1 26 LEU -6.22 0.09 1 28 VAL -6.62 0.71 1 29 ASP -0.13 0.10 1 30 ARG -4.25 -0.09 1 32 VAL -8.15 -0.43 1 34 MET 3.73 0.27 1 35 ASP 5.31 -0.26 1 36 THR 5.77 -0.65 1 37 LEU 1.88 -0.60 1 38 ASN 4.31 -0.19 1 39 SER 4.82 -0.28 1 40 ALA 3.13 -0.24 1 41 ILE 5.28 -0.84 1 42 GLU 3.70 -0.45 1 43 ASN 3.40 -0.40 1 44 LEU 3.28 -0.26 1 45 MET 2.53 -0.23 1 46 THR 1.70 0.08 1 47 SER 0.24 0.08 1 48 SER -2.56 0.24 1 49 SER -2.64 -0.07 1 51 GLU 2.74 -0.59 1 52 ASP -0.28 -0.08 1 53 TRP -2.12 0.26 1 55 SER 1.29 0.56 1 56 VAL -6.43 0.90 1 57 ASN -3.27 0.87 1 58 MET -4.02 0.46 1 59 ASN -2.84 0.67 1 60 VAL 0.14 0.39 1 61 ALA -4.29 0.39 1 62 ASP 3.18 -0.34 1 63 ALA 0.47 -0.17 1 64 THR -2.72 0.60 1 65 VAL -1.52 0.56 1 66 THR -1.59 0.73 1 67 VAL -0.61 0.70 1 68 ILE -4.06 0.70 1 69 SER 0.49 -0.10 1 70 GLU 1.65 -0.16 1 71 LYS 0.41 -0.05 1 72 ASN -0.02 -0.03 1 73 GLU 2.03 -0.19 1 74 GLU 0.30 -0.16 1 75 GLU -1.04 -0.03 1 76 VAL 1.69 -0.07 1 77 LEU 1.06 0.02 1 78 VAL -3.84 0.08 1 79 GLU -3.27 0.47 1 81 ARG 1.40 0.39 1 82 VAL 6.15 -0.42 1 83 ARG 2.96 -0.25 1 84 PHE 0.17 0.44 1 85 LEU -0.48 0.49 1 86 SER 3.33 -0.54 1 87 PHE -7.14 0.88 1 88 MET -5.06 0.80 1 90 VAL -5.51 0.77 1 92 LYS 3.84 -0.51 1 93 ASP -2.73 0.29 1 94 VAL 2.59 -0.32 1 95 HIS 6.34 -0.79 1 96 THR -3.47 0.81 1 97 PHE -7.99 0.67 1 98 ALA -8.70 1.16 1 99 PHE -6.34 0.85 1 100 ILE -1.55 0.87 1 101 MET -7.30 1.32 1 102 ASP -3.75 0.43 1 103 THR 1.27 -0.07 1 105 ASN 1.41 -0.28 1 106 GLN 4.89 -1.07 1 107 ARG -0.77 -0.06 1 108 PHE -2.82 1.00 1 109 GLU -5.86 0.27 1 111 HIS -4.48 -0.04 1 112 VAL -1.32 0.46 1 113 PHE -4.48 0.82 1 114 TRP -2.50 0.20 1 116 GLU -2.39 0.07 1 118 ASN -0.13 -0.90 1 119 ALA -1.48 -0.13 1 120 ALA 6.04 -0.73 1 121 ASN 4.71 -0.48 1 122 VAL 4.41 -1.93 1 123 SER 3.40 -1.25 1 124 GLU 3.88 -0.71 1 125 ALA 2.56 -0.21 1 126 VAL 6.39 -0.79 1 127 GLN 5.54 -0.91 1 128 ALA 3.60 -0.32 1 129 ALA 3.08 -0.15 1 131 SER 0.55 -0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10236_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.70 _LACS_plot.Line_1_terminator_val_y_1 -3.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _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 6.39 _LACS_plot.Line_2_terminator_val_y_2 2.08 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 LEU 4.45 -1.94 0 106 GLN 4.89 -2.13 0 11 LYS 0.24 0.32 1 12 THR 0.01 -0.30 1 13 GLU -0.63 -0.65 1 14 LEU 0.10 -1.02 1 15 VAL -0.92 -0.79 1 16 GLN -2.59 -2.64 1 17 LYS -3.05 -1.40 1 18 PHE -4.29 -1.48 1 19 ARG 0.96 0.16 1 20 VAL -6.00 -1.56 1 21 GLN -5.70 -0.03 1 22 TYR -5.95 -2.28 1 25 MET -4.39 -0.71 1 28 VAL -6.62 -0.18 1 29 ASP -0.13 -0.38 1 32 VAL -8.15 -2.14 1 34 MET 3.73 2.58 1 35 ASP 5.31 2.89 1 36 THR 5.77 1.71 1 37 LEU 1.88 0.84 1 38 ASN 4.31 2.88 1 39 SER 4.82 1.93 1 40 ALA 3.13 0.96 1 41 ILE 5.28 1.46 1 42 GLU 3.70 2.89 1 43 ASN 3.40 3.46 1 44 LEU 3.28 2.25 1 45 MET 2.53 1.01 1 46 THR 1.70 1.03 1 47 SER 0.24 -1.15 1 48 SER -2.56 -2.43 1 49 SER -2.64 -1.15 1 50 LYS 2.06 0.63 1 51 GLU 2.74 0.37 1 52 ASP -0.28 0.50 1 55 SER 1.29 -0.06 1 56 VAL -6.43 -2.75 1 57 ASN -3.27 -0.95 1 58 MET -4.02 -2.60 1 59 ASN -2.84 -0.56 1 60 VAL 0.14 -1.93 1 61 ALA -4.29 -1.92 1 62 ASP 3.18 0.52 1 63 ALA 0.47 -0.23 1 64 THR -2.72 -2.80 1 65 VAL -1.52 -1.71 1 66 THR -1.59 -1.34 1 67 VAL -0.61 -1.93 1 68 ILE -4.06 -1.01 1 69 SER 0.49 0.36 1 70 GLU 1.65 0.53 1 71 LYS 0.41 -0.22 1 72 ASN -0.02 -0.58 1 73 GLU 2.03 -0.92 1 74 GLU 0.30 -0.36 1 75 GLU -1.04 -2.69 1 76 VAL 1.69 0.30 1 77 LEU 1.06 -0.08 1 78 VAL -3.84 -3.45 1 79 GLU -3.27 -2.90 1 81 ARG 1.40 2.48 1 82 VAL 6.15 0.71 1 83 ARG 2.96 -1.05 1 84 PHE 0.17 -2.83 1 85 LEU -0.48 -1.89 1 86 SER 3.33 2.12 1 87 PHE -7.14 -3.75 1 88 MET -5.06 -5.03 1 90 VAL -5.51 -1.30 1 92 LYS 3.84 1.38 1 93 ASP -2.73 1.83 1 94 VAL 2.59 -1.05 1 95 HIS 6.34 2.21 1 96 THR -3.47 -2.53 1 97 PHE -7.99 -3.32 1 98 ALA -8.70 -3.60 1 99 PHE -6.34 -3.39 1 100 ILE -1.55 -2.41 1 101 MET -7.30 -2.31 1 102 ASP -3.75 0.74 1 103 THR 1.27 0.42 1 105 ASN 1.41 -1.21 1 107 ARG -0.77 -1.47 1 108 PHE -2.82 0.49 1 109 GLU -5.86 -2.40 1 111 HIS -4.48 0.15 1 112 VAL -1.32 -2.82 1 113 PHE -4.48 -2.42 1 114 TRP -2.50 -0.01 1 118 ASN -0.13 -0.80 1 119 ALA -1.48 -0.11 1 120 ALA 6.04 -0.20 1 121 ASN 4.71 3.05 1 122 VAL 4.41 -0.06 1 123 SER 3.40 1.69 1 124 GLU 3.88 1.70 1 125 ALA 2.56 2.87 1 126 VAL 6.39 1.22 1 127 GLN 5.54 2.69 1 128 ALA 3.60 2.61 1 129 ALA 3.08 1.27 1 131 SER 0.55 0.40 1 stop_ save_