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 bmr18716_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.63 _LACS_plot.Line_1_terminator_val_y_1 -3.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 7.46 _LACS_plot.Line_2_terminator_val_y_2 5.54 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 HIS 4.11 7.89 0 11 GLU 1.11 2.50 1 12 LEU 4.42 2.96 1 13 ASP 2.95 2.94 1 14 LYS 2.94 2.20 1 15 TRP 1.28 2.79 1 16 GLU 0.32 0.17 1 17 LYS -1.47 -0.63 1 18 ILE 2.64 2.02 1 19 ARG -0.15 0.49 1 20 LEU 3.98 3.13 1 21 ARG -2.58 -1.16 1 25 LYS -0.31 0.65 1 26 LYS 0.23 1.01 1 27 GLN -5.88 -1.23 1 28 TYR 4.69 3.11 1 29 LYS -7.63 -2.14 1 30 LEU 5.53 4.13 1 31 LYS 4.44 2.90 1 33 ILE 4.57 2.75 1 34 VAL 5.31 4.55 1 35 TRP 5.80 4.61 1 36 ALA 4.31 2.64 1 37 SER 5.47 4.50 1 38 ARG 3.30 2.41 1 39 GLU 1.91 1.68 1 40 LEU 5.42 3.20 1 41 GLU 3.21 2.97 1 42 ARG 3.84 2.60 1 43 PHE 0.17 -0.28 1 44 ALA 3.73 0.91 1 45 VAL -1.93 -1.41 1 46 ASN -0.69 -0.30 1 49 LEU 3.04 2.20 1 50 LEU 1.32 1.41 1 51 GLU 0.62 1.78 1 52 THR -6.91 -3.49 1 53 SER 5.60 4.36 1 54 GLU 3.97 3.07 1 57 ARG 5.16 3.71 1 58 GLN 4.87 3.70 1 59 ILE 5.50 4.55 1 60 LEU 5.17 3.55 1 62 GLN 2.46 2.17 1 63 LEU -0.72 1.08 1 64 GLN 1.17 1.40 1 66 SER 3.48 2.85 1 67 LEU 3.74 2.77 1 68 GLN -0.13 -0.51 1 69 THR -1.78 -0.98 1 71 SER 3.38 2.78 1 72 GLU 4.15 3.71 1 73 GLU 4.05 2.83 1 74 LEU 5.38 3.68 1 75 ARG 5.32 4.37 1 76 SER 4.34 3.86 1 77 LEU 4.51 4.90 1 78 TYR 3.75 2.69 1 79 ASN 6.72 6.06 1 80 THR 5.73 3.42 1 81 ILE 4.61 3.35 1 82 ALA 7.47 5.27 1 83 VAL 3.46 3.21 1 84 LEU 5.43 4.92 1 85 TYR 5.53 4.22 1 87 VAL 2.04 2.12 1 88 HIS -1.96 -0.41 1 89 GLN 6.03 1.18 1 90 ARG -0.57 -0.44 1 91 ILE 1.54 0.84 1 92 ASP -5.69 -3.08 1 93 VAL -0.44 0.47 1 94 LYS -4.87 -1.37 1 95 ASP 3.67 4.15 1 96 THR 4.60 3.43 1 97 LYS 2.85 3.20 1 98 GLU 2.24 2.90 1 99 ALA 3.79 2.88 1 100 LEU 4.53 3.15 1 101 ASP 3.73 2.16 1 102 LYS 4.88 3.51 1 103 ILE 0.17 3.03 1 104 GLU 2.97 2.67 1 105 GLU 2.77 2.74 1 106 GLU 3.27 2.71 1 107 GLN 2.16 1.78 1 108 ASN 2.52 2.11 1 109 LYS 1.82 1.46 1 110 SER 1.46 1.13 1 111 LYS 3.26 2.93 1 112 LYS 1.23 0.99 1 113 LYS 0.59 0.53 1 114 ALA 0.41 0.62 1 116 GLN 0.38 0.34 1 117 ALA 0.04 0.14 1 118 ALA 0.17 0.24 1 119 ALA 0.03 0.06 1 120 ASP 0.38 0.17 1 121 THR 1.99 1.63 1 123 ASN 0.44 0.35 1 124 ASN 0.42 0.55 1 125 SER 0.75 0.52 1 126 GLN 0.59 0.46 1 127 VAL 0.14 0.10 1 128 SER 0.48 0.45 1 129 GLN 0.60 0.29 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18716_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.63 _LACS_plot.Line_1_terminator_val_y_1 4.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.88 _LACS_plot.Line_2_terminator_val_x_2 7.46 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 HIS 4.11 3.78 0 11 GLU 1.11 1.39 1 12 LEU 4.42 -1.46 1 13 ASP 2.95 -0.01 1 14 LYS 2.94 -0.74 1 15 TRP 1.28 1.51 1 16 GLU 0.32 -0.15 1 17 LYS -1.47 0.84 1 18 ILE 2.64 -0.62 1 19 ARG -0.15 0.64 1 20 LEU 3.98 -0.85 1 21 ARG -2.58 1.42 1 25 LYS -0.31 0.96 1 26 LYS 0.23 0.78 1 27 GLN -5.88 4.65 1 28 TYR 4.69 -1.58 1 29 LYS -7.63 5.49 1 30 LEU 5.53 -1.40 1 31 LYS 4.44 -1.54 1 33 ILE 4.57 -1.82 1 34 VAL 5.31 -0.76 1 35 TRP 5.80 -1.19 1 36 ALA 4.31 -1.67 1 37 SER 5.47 -0.97 1 38 ARG 3.30 -0.89 1 39 GLU 1.91 -0.23 1 40 LEU 5.42 -2.22 1 41 GLU 3.21 -0.24 1 42 ARG 3.84 -1.24 1 43 PHE 0.17 -0.45 1 44 ALA 3.73 -2.82 1 45 VAL -1.93 0.52 1 46 ASN -0.69 0.39 1 49 LEU 3.04 -0.84 1 50 LEU 1.32 0.09 1 51 GLU 0.62 1.16 1 52 THR -6.91 3.42 1 53 SER 5.60 -1.24 1 54 GLU 3.97 -0.90 1 57 ARG 5.16 -1.45 1 58 GLN 4.87 -1.17 1 59 ILE 5.50 -0.95 1 60 LEU 5.17 -1.62 1 62 GLN 2.46 -0.29 1 63 LEU -0.72 1.80 1 64 GLN 1.17 0.23 1 66 SER 3.48 -0.63 1 67 LEU 3.74 -0.97 1 68 GLN -0.13 -0.38 1 69 THR -1.78 0.80 1 71 SER 3.38 -0.60 1 72 GLU 4.15 -0.44 1 73 GLU 4.05 -1.22 1 74 LEU 5.38 -1.70 1 75 ARG 5.32 -0.95 1 76 SER 4.34 -0.48 1 77 LEU 4.51 0.39 1 78 TYR 3.75 -1.06 1 79 ASN 6.72 -0.66 1 80 THR 5.73 -2.31 1 81 ILE 4.61 -1.26 1 82 ALA 7.47 -2.20 1 83 VAL 3.46 -0.25 1 84 LEU 5.43 -0.51 1 85 TYR 5.53 -1.31 1 87 VAL 2.04 0.08 1 88 HIS -1.96 1.55 1 89 GLN 6.03 -4.85 1 90 ARG -0.57 0.13 1 91 ILE 1.54 -0.70 1 92 ASP -5.69 2.61 1 93 VAL -0.44 0.91 1 94 LYS -4.87 3.50 1 95 ASP 3.67 0.48 1 96 THR 4.60 -1.17 1 97 LYS 2.85 0.35 1 98 GLU 2.24 0.66 1 99 ALA 3.79 -0.91 1 100 LEU 4.53 -1.38 1 101 ASP 3.73 -1.57 1 102 LYS 4.88 -1.37 1 103 ILE 0.17 2.86 1 104 GLU 2.97 -0.30 1 105 GLU 2.77 -0.03 1 106 GLU 3.27 -0.56 1 107 GLN 2.16 -0.38 1 108 ASN 2.52 -0.41 1 109 LYS 1.82 -0.36 1 110 SER 1.46 -0.33 1 111 LYS 3.26 -0.33 1 112 LYS 1.23 -0.24 1 113 LYS 0.59 -0.06 1 114 ALA 0.41 0.21 1 116 GLN 0.38 -0.04 1 117 ALA 0.04 0.10 1 118 ALA 0.17 0.07 1 119 ALA 0.03 0.03 1 120 ASP 0.38 -0.21 1 121 THR 1.99 -0.36 1 123 ASN 0.44 -0.09 1 124 ASN 0.42 0.13 1 125 SER 0.75 -0.23 1 126 GLN 0.59 -0.13 1 127 VAL 0.14 -0.04 1 128 SER 0.48 -0.03 1 129 GLN 0.60 -0.31 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18716_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.63 _LACS_plot.Line_1_terminator_val_y_1 0.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 7.46 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 LYS -4.87 0.92 0 29 LYS -7.63 0.90 0 52 THR -6.91 0.05 0 11 GLU 1.11 -0.40 1 12 LEU 4.42 -0.23 1 13 ASP 2.95 -0.25 1 14 LYS 2.94 -0.27 1 15 TRP 1.28 -0.63 1 16 GLU 0.32 0.34 1 17 LYS -1.47 0.18 1 18 ILE 2.64 -0.61 1 19 ARG -0.15 0.09 1 20 LEU 3.98 -0.91 1 21 ARG -2.58 0.19 1 25 LYS -0.31 -0.06 1 26 LYS 0.23 -0.01 1 27 GLN -5.88 0.48 1 28 TYR 4.69 -0.82 1 30 LEU 5.53 -0.16 1 31 LYS 4.44 -0.18 1 32 HIS 4.11 -0.13 1 33 ILE 4.57 -0.38 1 34 VAL 5.31 -0.51 1 35 TRP 5.80 -0.43 1 36 ALA 4.31 -0.93 1 37 SER 5.47 -0.56 1 38 ARG 3.30 -0.19 1 39 GLU 1.91 -0.56 1 40 LEU 5.42 -0.38 1 41 GLU 3.21 -0.22 1 42 ARG 3.84 -0.31 1 43 PHE 0.17 0.00 1 44 ALA 3.73 -0.31 1 45 VAL -1.93 -0.03 1 46 ASN -0.69 -0.40 1 49 LEU 3.04 -0.20 1 50 LEU 1.32 -0.11 1 51 GLU 0.62 -0.30 1 53 SER 5.60 -0.43 1 54 GLU 3.97 -0.28 1 57 ARG 5.16 -0.79 1 58 GLN 4.87 -0.29 1 59 ILE 5.50 -0.56 1 60 LEU 5.17 -0.44 1 62 GLN 2.46 -0.19 1 63 LEU -0.72 -0.08 1 64 GLN 1.17 0.02 1 66 SER 3.48 -0.52 1 67 LEU 3.74 -0.27 1 68 GLN -0.13 0.13 1 69 THR -1.78 0.15 1 71 SER 3.38 -0.26 1 72 GLU 4.15 -0.09 1 73 GLU 4.05 -0.16 1 74 LEU 5.38 -0.41 1 75 ARG 5.32 -0.21 1 76 SER 4.34 0.08 1 77 LEU 4.51 -0.89 1 78 TYR 3.75 -0.46 1 79 ASN 6.72 -0.41 1 80 THR 5.73 -0.50 1 81 ILE 4.61 -0.43 1 82 ALA 7.47 -0.79 1 83 VAL 3.46 -0.53 1 84 LEU 5.43 -0.64 1 85 TYR 5.53 -0.24 1 87 VAL 2.04 0.15 1 88 HIS -1.96 0.04 1 89 GLN 6.03 -0.33 1 90 ARG -0.57 -0.19 1 91 ILE 1.54 -0.15 1 92 ASP -5.69 0.51 1 93 VAL -0.44 0.07 1 95 ASP 3.67 -0.69 1 96 THR 4.60 -0.38 1 97 LYS 2.85 -0.27 1 98 GLU 2.24 0.07 1 99 ALA 3.79 -0.32 1 100 LEU 4.53 -0.27 1 101 ASP 3.73 -0.16 1 102 LYS 4.88 -0.36 1 103 ILE 0.17 -0.31 1 104 GLU 2.97 -0.26 1 105 GLU 2.77 -0.28 1 106 GLU 3.27 -0.19 1 107 GLN 2.16 -0.12 1 108 ASN 2.52 -0.09 1 109 LYS 1.82 -0.10 1 110 SER 1.46 -0.07 1 111 LYS 3.26 -0.17 1 112 LYS 1.23 -0.06 1 113 LYS 0.59 -0.05 1 114 ALA 0.41 -0.07 1 116 GLN 0.38 -0.04 1 117 ALA 0.04 -0.03 1 118 ALA 0.17 -0.04 1 119 ALA 0.03 0.04 1 120 ASP 0.38 0.01 1 121 THR 1.99 -0.13 1 123 ASN 0.44 -0.02 1 124 ASN 0.42 -0.08 1 125 SER 0.75 -0.02 1 126 GLN 0.59 -0.01 1 127 VAL 0.14 -0.33 1 128 SER 0.48 0.02 1 129 GLN 0.60 -0.12 1 stop_ save_