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 bmr15270_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.21 _LACS_plot.Line_1_terminator_val_y_1 -2.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 7.35 _LACS_plot.Line_2_terminator_val_y_2 5.33 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 LYS 5.65 0.09 0 10 THR 0.69 0.36 1 11 TYR 2.98 3.64 1 12 ASP 2.45 1.80 1 13 ASP -2.39 -0.98 1 18 LEU 5.09 1.95 1 19 LEU 4.79 2.60 1 20 ALA 0.48 0.23 1 21 ARG 4.40 0.61 1 22 THR 2.11 1.34 1 23 ARG -4.64 -1.56 1 24 SER -1.72 -1.00 1 25 ALA -0.27 0.28 1 26 ALA 0.87 2.45 1 29 GLU 5.21 3.88 1 30 ALA 2.60 2.00 1 31 LEU 4.55 1.90 1 33 ARG 5.86 4.32 1 34 SER 3.24 2.68 1 35 ARG 4.70 4.12 1 36 TYR 5.60 4.85 1 37 ALA 3.65 2.80 1 38 ALA 3.88 2.98 1 39 TYR 7.35 4.30 1 40 ALA 3.76 2.36 1 41 LEU 0.81 -0.70 1 43 ASP -2.20 -2.85 1 44 PHE 4.54 3.95 1 45 ASP 4.46 3.26 1 46 TYR 4.87 4.42 1 47 ILE 4.77 0.71 1 48 VAL 6.28 5.42 1 49 GLU 1.86 2.25 1 50 THR -0.25 -0.42 1 51 THR 3.39 2.25 1 52 ASP -2.38 -0.26 1 54 GLU 0.93 0.55 1 55 ARG -2.24 -1.56 1 56 ARG 4.38 4.14 1 57 ASP 2.34 1.18 1 58 LEU 0.20 -0.29 1 59 PHE -1.40 -0.55 1 61 HIS 2.40 4.65 1 62 ASP 4.51 3.57 1 63 VAL 4.05 3.43 1 64 ASN 3.49 3.81 1 65 ARG 5.44 4.00 1 66 ALA 4.41 2.99 1 67 TRP 3.84 2.79 1 68 MET 4.83 4.49 1 69 GLU 2.83 2.95 1 70 GLU -1.57 -0.18 1 71 SER -0.48 0.45 1 72 ASP -3.48 -1.70 1 73 PHE 3.58 2.30 1 74 LEU -1.16 0.75 1 75 GLU -3.07 0.54 1 76 LEU -1.33 -1.78 1 77 ARG -3.11 -1.38 1 78 VAL 2.27 1.49 1 79 LEU 0.95 0.91 1 81 SER -3.54 -1.04 1 82 SER -3.18 -0.78 1 83 GLU -3.71 -0.52 1 84 LYS -1.05 -0.46 1 86 SER 0.49 -0.09 1 87 ARG -4.24 -1.46 1 89 THR -3.74 -0.66 1 90 VAL -4.09 -0.17 1 91 GLU -4.31 -2.65 1 92 PHE -5.34 -1.57 1 93 ILE -4.09 -0.62 1 94 ALA -5.66 -2.67 1 95 ARG -4.02 -1.35 1 96 PHE -4.10 -1.96 1 97 ARG -4.79 -1.05 1 98 ARG -1.93 -0.71 1 103 GLU 0.96 1.13 1 104 GLN -5.57 -1.65 1 105 SER -2.71 -1.05 1 106 HIS -3.78 0.85 1 107 HIS -5.68 -3.42 1 108 GLU -7.21 -2.59 1 109 ARG -1.38 -0.33 1 110 SER -1.99 0.73 1 111 GLN -2.48 -1.72 1 112 PHE -5.93 -1.19 1 113 ARG -6.23 -1.35 1 114 LYS -1.69 -2.37 1 115 ALA -3.23 -1.09 1 116 ARG 3.52 0.58 1 118 ARG -4.74 -2.05 1 119 TRP -2.23 -0.01 1 120 TYR -4.06 -0.61 1 121 PHE 0.31 0.82 1 122 SER 1.28 2.00 1 123 GLU -3.29 -1.02 1 125 GLU -5.37 -2.16 1 126 ALA -0.53 -0.48 1 127 VAL -0.42 -0.74 1 128 ASP 0.60 1.75 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15270_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.21 _LACS_plot.Line_1_terminator_val_y_1 4.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.83 _LACS_plot.Line_2_terminator_val_x_2 7.35 _LACS_plot.Line_2_terminator_val_y_2 -2.02 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 LYS 5.65 -5.56 0 10 THR 0.69 -0.33 1 11 TYR 2.98 0.66 1 12 ASP 2.45 -0.65 1 13 ASP -2.39 1.41 1 18 LEU 5.09 -3.14 1 19 LEU 4.79 -2.19 1 20 ALA 0.48 -0.25 1 21 ARG 4.40 -3.79 1 22 THR 2.11 -0.77 1 23 ARG -4.64 3.08 1 24 SER -1.72 0.72 1 25 ALA -0.27 0.55 1 26 ALA 0.87 1.58 1 29 GLU 5.21 -1.33 1 30 ALA 2.60 -0.60 1 31 LEU 4.55 -2.65 1 33 ARG 5.86 -1.54 1 34 SER 3.24 -0.56 1 35 ARG 4.70 -0.58 1 36 TYR 5.60 -0.75 1 37 ALA 3.65 -0.85 1 38 ALA 3.88 -0.90 1 39 TYR 7.35 -3.05 1 40 ALA 3.76 -1.40 1 41 LEU 0.81 -1.51 1 43 ASP -2.20 -0.65 1 44 PHE 4.54 -0.59 1 45 ASP 4.46 -1.20 1 46 TYR 4.87 -0.45 1 47 ILE 4.77 -4.06 1 48 VAL 6.28 -0.86 1 49 GLU 1.86 0.39 1 50 THR -0.25 -0.17 1 51 THR 3.39 -1.14 1 52 ASP -2.38 2.12 1 54 GLU 0.93 -0.38 1 55 ARG -2.24 0.68 1 56 ARG 4.38 -0.24 1 57 ASP 2.34 -1.16 1 58 LEU 0.20 -0.49 1 59 PHE -1.40 0.85 1 61 HIS 2.40 2.25 1 62 ASP 4.51 -0.94 1 63 VAL 4.05 -0.62 1 64 ASN 3.49 0.32 1 65 ARG 5.44 -1.44 1 66 ALA 4.41 -1.42 1 67 TRP 3.84 -1.05 1 68 MET 4.83 -0.34 1 69 GLU 2.83 0.12 1 70 GLU -1.57 1.39 1 71 SER -0.48 0.93 1 72 ASP -3.48 1.78 1 73 PHE 3.58 -1.28 1 74 LEU -1.16 1.91 1 75 GLU -3.07 3.61 1 76 LEU -1.33 -0.45 1 77 ARG -3.11 1.73 1 78 VAL 2.27 -0.78 1 79 LEU 0.95 -0.04 1 81 SER -3.54 2.50 1 82 SER -3.18 2.40 1 83 GLU -3.71 3.19 1 84 LYS -1.05 0.59 1 86 SER 0.49 -0.58 1 87 ARG -4.24 2.78 1 89 THR -3.74 3.08 1 90 VAL -4.09 3.92 1 91 GLU -4.31 1.66 1 92 PHE -5.34 3.77 1 93 ILE -4.09 3.47 1 94 ALA -5.66 2.99 1 95 ARG -4.02 2.67 1 96 PHE -4.10 2.14 1 97 ARG -4.79 3.74 1 98 ARG -1.93 1.22 1 103 GLU 0.96 0.17 1 104 GLN -5.57 3.92 1 105 SER -2.71 1.66 1 106 HIS -3.78 4.63 1 107 HIS -5.68 2.26 1 108 GLU -7.21 4.62 1 109 ARG -1.38 1.05 1 110 SER -1.99 2.72 1 111 GLN -2.48 0.76 1 112 PHE -5.93 4.74 1 113 ARG -6.23 4.88 1 114 LYS -1.69 -0.68 1 115 ALA -3.23 2.14 1 116 ARG 3.52 -2.94 1 118 ARG -4.74 2.69 1 119 TRP -2.23 2.22 1 120 TYR -4.06 3.45 1 121 PHE 0.31 0.51 1 122 SER 1.28 0.72 1 123 GLU -3.29 2.27 1 125 GLU -5.37 3.21 1 126 ALA -0.53 0.05 1 127 VAL -0.42 -0.32 1 128 ASP 0.60 1.15 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15270_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.21 _LACS_plot.Line_1_terminator_val_y_1 0.95 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 7.35 _LACS_plot.Line_2_terminator_val_y_2 -0.87 _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 52 ASP -2.38 -1.19 0 10 THR 0.69 0.13 1 11 TYR 2.98 0.07 1 12 ASP 2.45 -0.46 1 13 ASP -2.39 0.16 1 18 LEU 5.09 0.12 1 19 LEU 4.79 -0.72 1 20 ALA 0.48 -0.08 1 21 ARG 4.40 -0.35 1 22 THR 2.11 -0.15 1 23 ARG -4.64 0.18 1 24 SER -1.72 0.11 1 25 ALA -0.27 -0.20 1 26 ALA 0.87 -0.18 1 29 GLU 5.21 -0.97 1 30 ALA 2.60 -0.42 1 31 LEU 4.55 -0.36 1 33 ARG 5.86 -0.86 1 34 SER 3.24 0.27 1 35 ARG 4.70 -0.33 1 36 TYR 5.60 -0.71 1 37 ALA 3.65 -0.74 1 38 ALA 3.88 -0.59 1 39 TYR 7.35 -0.86 1 40 ALA 3.76 -0.36 1 41 LEU 0.81 -0.06 1 42 LYS 5.65 0.03 1 43 ASP -2.20 0.24 1 44 PHE 4.54 -0.72 1 45 ASP 4.46 -0.40 1 46 TYR 4.87 -0.86 1 47 ILE 4.77 -1.09 1 48 VAL 6.28 -1.07 1 49 GLU 1.86 -0.39 1 50 THR -0.25 0.23 1 51 THR 3.39 0.27 1 54 GLU 0.93 -0.19 1 55 ARG -2.24 0.33 1 56 ARG 4.38 -0.39 1 57 ASP 2.34 0.01 1 58 LEU 0.20 -0.01 1 59 PHE -1.40 -0.05 1 61 HIS 2.40 -0.40 1 62 ASP 4.51 -0.29 1 63 VAL 4.05 -0.35 1 64 ASN 3.49 0.06 1 65 ARG 5.44 -0.86 1 66 ALA 4.41 -0.17 1 67 TRP 3.84 -0.52 1 68 MET 4.83 -0.74 1 69 GLU 2.83 -0.35 1 70 GLU -1.57 0.02 1 71 SER -0.48 0.80 1 72 ASP -3.48 0.35 1 73 PHE 3.58 -0.31 1 74 LEU -1.16 0.09 1 75 GLU -3.07 0.03 1 76 LEU -1.33 0.43 1 77 ARG -3.11 0.33 1 78 VAL 2.27 -0.01 1 79 LEU 0.95 0.00 1 81 SER -3.54 0.87 1 82 SER -3.18 0.28 1 83 GLU -3.71 0.54 1 84 LYS -1.05 0.26 1 86 SER 0.49 -0.15 1 87 ARG -4.24 1.27 1 89 THR -3.74 1.51 1 90 VAL -4.09 0.66 1 91 GLU -4.31 1.43 1 92 PHE -5.34 1.00 1 93 ILE -4.09 1.03 1 94 ALA -5.66 1.54 1 95 ARG -4.02 1.27 1 96 PHE -4.10 0.75 1 97 ARG -4.79 0.19 1 98 ARG -1.93 0.53 1 103 GLU 0.96 -0.35 1 104 GLN -5.57 0.16 1 105 SER -2.71 0.89 1 106 HIS -3.78 0.27 1 107 HIS -5.68 0.85 1 108 GLU -7.21 0.51 1 109 ARG -1.38 0.61 1 110 SER -1.99 0.84 1 111 GLN -2.48 0.90 1 112 PHE -5.93 0.87 1 113 ARG -6.23 1.27 1 114 LYS -1.69 0.34 1 115 ALA -3.23 0.26 1 116 ARG 3.52 -0.50 1 118 ARG -4.74 0.21 1 119 TRP -2.23 -0.09 1 120 TYR -4.06 0.39 1 121 PHE 0.31 -0.43 1 122 SER 1.28 0.05 1 123 GLU -3.29 -0.09 1 125 GLU -5.37 0.34 1 126 ALA -0.53 0.15 1 127 VAL -0.42 -0.24 1 128 ASP 0.60 -0.34 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15270_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.21 _LACS_plot.Line_1_terminator_val_y_1 -2.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.00 _LACS_plot.Line_2_terminator_val_x_2 7.35 _LACS_plot.Line_2_terminator_val_y_2 2.35 _LACS_plot.Y_axis_chem_shift_offset 0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 LYS 5.65 -1.48 0 10 THR 0.69 1.10 1 11 TYR 2.98 3.00 1 12 ASP 2.45 -1.08 1 13 ASP -2.39 -1.09 1 18 LEU 5.09 3.61 1 19 LEU 4.79 1.85 1 20 ALA 0.48 -0.80 1 21 ARG 4.40 -0.19 1 22 THR 2.11 -0.06 1 23 ARG -4.64 -2.10 1 24 SER -1.72 -0.24 1 26 ALA 0.87 0.50 1 29 GLU 5.21 0.81 1 30 ALA 2.60 -0.40 1 31 LEU 4.55 1.65 1 33 ARG 5.86 0.99 1 34 SER 3.24 1.36 1 35 ARG 4.70 1.42 1 36 TYR 5.60 0.81 1 37 ALA 3.65 0.40 1 38 ALA 3.88 2.40 1 39 TYR 7.35 2.20 1 40 ALA 3.76 2.00 1 41 LEU 0.81 -1.35 1 43 ASP -2.20 -1.35 1 44 PHE 4.54 2.01 1 45 ASP 4.46 1.70 1 46 TYR 4.87 2.11 1 47 ILE 4.77 2.10 1 48 VAL 6.28 2.70 1 50 THR -0.25 -1.30 1 51 THR 3.39 -0.80 1 54 GLU 0.93 0.81 1 55 ARG -2.24 -2.78 1 56 ARG 4.38 0.91 1 57 ASP 2.34 0.50 1 58 LEU 0.20 -0.60 1 59 PHE -1.40 -1.38 1 61 HIS 2.40 3.10 1 62 ASP 4.51 3.20 1 63 VAL 4.05 2.64 1 64 ASN 3.49 1.62 1 65 ARG 5.44 1.52 1 66 ALA 4.41 1.40 1 67 TRP 3.84 2.31 1 68 MET 4.83 2.00 1 69 GLU 2.83 2.48 1 70 GLU -1.57 0.30 1 71 SER -0.48 -2.60 1 72 ASP -3.48 -0.99 1 73 PHE 3.58 -0.10 1 74 LEU -1.16 -0.65 1 75 GLU -3.07 -3.80 1 76 LEU -1.33 -1.90 1 77 ARG -3.11 -1.10 1 78 VAL 2.27 -0.20 1 79 LEU 0.95 -0.09 1 81 SER -3.54 -1.66 1 82 SER -3.18 -1.95 1 83 GLU -3.71 -2.00 1 86 SER 0.49 -1.79 1 87 ARG -4.24 -1.28 1 89 THR -3.74 -0.90 1 90 VAL -4.09 -2.66 1 91 GLU -4.31 -1.22 1 92 PHE -5.34 -3.95 1 93 ILE -4.09 -0.80 1 94 ALA -5.66 -1.60 1 95 ARG -4.02 0.55 1 96 PHE -4.10 -4.05 1 97 ARG -4.79 -1.48 1 98 ARG -1.93 1.05 1 103 GLU 0.96 -0.78 1 104 GLN -5.57 -1.97 1 105 SER -2.71 -1.00 1 106 HIS -3.78 -1.48 1 107 HIS -5.68 -0.89 1 108 GLU -7.21 -3.29 1 109 ARG -1.38 -0.05 1 110 SER -1.99 -2.16 1 111 GLN -2.48 -1.06 1 112 PHE -5.93 -0.59 1 113 ARG -6.23 -2.78 1 114 LYS -1.69 -0.70 1 116 ARG 3.52 0.91 1 118 ARG -4.74 -2.49 1 119 TRP -2.23 -0.60 1 120 TYR -4.06 0.62 1 121 PHE 0.31 -1.77 1 122 SER 1.28 -2.34 1 123 GLU -3.29 -3.49 1 125 GLU -5.37 -2.19 1 126 ALA -0.53 -0.20 1 127 VAL -0.42 -1.59 1 stop_ save_