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 bmr15928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.03 _LACS_plot.Line_1_terminator_val_y_1 -3.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.33 _LACS_plot.Line_2_terminator_val_x_2 6.18 _LACS_plot.Line_2_terminator_val_y_2 4.43 _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 83 GLN 5.10 0.70 0 50 HIS 0.56 3.63 0 14 SER -8.03 -1.65 0 10 THR -0.46 -0.60 1 11 GLU -6.67 -2.75 1 12 PHE -4.88 -2.10 1 13 ILE 0.01 1.17 1 15 ARG -5.59 -0.90 1 16 HIS -3.27 -0.94 1 17 ASN -1.57 -2.00 1 18 ILE 4.03 3.30 1 19 GLU 0.57 0.55 1 21 ILE 1.89 -0.80 1 22 PHE 1.54 1.92 1 23 THR 0.42 -0.19 1 24 PHE -1.12 1.44 1 25 VAL -3.44 -0.66 1 26 ASP -2.24 -0.88 1 27 HIS 2.79 4.16 1 28 ARG 3.28 2.20 1 30 VAL 5.15 3.70 1 31 ALA 1.10 1.22 1 32 THR 3.59 2.93 1 33 VAL -3.60 -1.60 1 35 TYR -2.59 -0.61 1 36 GLN 1.30 0.06 1 38 GLN 4.91 2.77 1 39 GLU -0.05 1.00 1 40 LEU -0.55 0.24 1 41 LEU 2.19 1.95 1 43 LYS -2.70 -1.84 1 44 ASN -2.39 -0.84 1 45 ILE 6.18 4.02 1 46 VAL 5.38 3.50 1 47 GLU 2.45 1.40 1 48 PHE 0.20 0.03 1 52 GLU 2.47 1.92 1 53 ASP -2.61 -0.11 1 54 GLN 5.33 4.38 1 55 GLN 5.11 3.11 1 56 LEU 3.41 2.60 1 57 LEU 2.92 2.60 1 58 ARG 4.70 4.12 1 59 ASP 3.89 3.00 1 60 SER 4.38 3.68 1 61 PHE 2.12 -0.92 1 62 GLN 3.85 2.54 1 63 GLN 3.36 2.71 1 64 VAL 5.33 3.91 1 65 VAL 3.17 2.00 1 66 LYS 1.86 1.99 1 67 LEU -0.57 -1.99 1 68 LYS 3.08 2.19 1 70 GLN -1.06 -0.35 1 71 VAL -1.06 -1.00 1 72 LEU -4.56 -2.20 1 73 SER -4.25 -1.71 1 74 VAL -5.37 -2.80 1 75 MET -3.23 -1.38 1 76 PHE -4.37 -1.90 1 77 ARG -3.32 -1.78 1 78 PHE -7.46 -2.53 1 79 ARG 0.80 -0.74 1 80 SER -1.24 -0.11 1 81 LYS 4.50 3.04 1 82 ASN 1.13 -0.34 1 84 GLU -3.69 -1.88 1 85 TRP -2.42 -1.91 1 86 LEU -4.13 -2.00 1 87 TRP 1.57 1.71 1 88 MET -6.08 -2.84 1 89 ARG -5.23 -1.73 1 90 THR -3.86 -1.47 1 91 SER 0.63 0.92 1 92 SER -2.10 0.52 1 93 GLN -5.17 -1.44 1 94 THR 3.58 2.67 1 95 ALA -0.55 -0.65 1 96 GLN -1.68 -1.08 1 97 ASN 2.48 1.63 1 99 TYR -0.46 -2.06 1 100 SER 2.80 2.27 1 101 ASP 0.90 -0.10 1 102 GLU -3.51 -1.64 1 103 ILE -2.66 -0.68 1 104 GLU -4.13 -1.70 1 105 THR -0.91 -0.33 1 106 ILE 0.69 0.32 1 107 ILE 1.66 0.36 1 109 THR 1.83 1.67 1 110 ASN -0.91 0.00 1 111 THR 0.50 0.10 1 117 SER 0.33 0.26 1 118 GLN -0.20 0.06 1 119 GLU 0.29 1.49 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.03 _LACS_plot.Line_1_terminator_val_y_1 4.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.67 _LACS_plot.Line_2_terminator_val_x_2 6.18 _LACS_plot.Line_2_terminator_val_y_2 -1.75 _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 83 GLN 5.10 -4.40 0 50 HIS 0.56 3.07 0 14 SER -8.03 6.38 0 10 THR -0.46 -0.14 1 11 GLU -6.67 3.92 1 12 PHE -4.88 2.78 1 13 ILE 0.01 1.16 1 15 ARG -5.59 4.69 1 16 HIS -3.27 2.33 1 17 ASN -1.57 -0.43 1 18 ILE 4.03 -0.73 1 19 GLU 0.57 -0.02 1 21 ILE 1.89 -2.69 1 22 PHE 1.54 0.38 1 23 THR 0.42 -0.61 1 24 PHE -1.12 2.56 1 25 VAL -3.44 2.78 1 26 ASP -2.24 1.36 1 27 HIS 2.79 1.37 1 28 ARG 3.28 -1.08 1 30 VAL 5.15 -1.45 1 31 ALA 1.10 0.12 1 32 THR 3.59 -0.66 1 33 VAL -3.60 2.00 1 35 TYR -2.59 1.98 1 36 GLN 1.30 -1.24 1 38 GLN 4.91 -2.14 1 39 GLU -0.05 1.05 1 40 LEU -0.55 0.79 1 41 LEU 2.19 -0.24 1 43 LYS -2.70 0.86 1 44 ASN -2.39 1.55 1 45 ILE 6.18 -2.16 1 46 VAL 5.38 -1.88 1 47 GLU 2.45 -1.05 1 48 PHE 0.20 -0.17 1 52 GLU 2.47 -0.55 1 53 ASP -2.61 2.50 1 54 GLN 5.33 -0.95 1 55 GLN 5.11 -2.00 1 56 LEU 3.41 -0.81 1 57 LEU 2.92 -0.32 1 58 ARG 4.70 -0.58 1 59 ASP 3.89 -0.89 1 60 SER 4.38 -0.70 1 61 PHE 2.12 -3.04 1 62 GLN 3.85 -1.31 1 63 GLN 3.36 -0.65 1 64 VAL 5.33 -1.42 1 65 VAL 3.17 -1.17 1 66 LYS 1.86 0.13 1 67 LEU -0.57 -1.42 1 68 LYS 3.08 -0.89 1 70 GLN -1.06 0.71 1 71 VAL -1.06 0.06 1 72 LEU -4.56 2.36 1 73 SER -4.25 2.54 1 74 VAL -5.37 2.57 1 75 MET -3.23 1.85 1 76 PHE -4.37 2.47 1 77 ARG -3.32 1.54 1 78 PHE -7.46 4.93 1 79 ARG 0.80 -1.54 1 80 SER -1.24 1.13 1 81 LYS 4.50 -1.46 1 82 ASN 1.13 -1.47 1 84 GLU -3.69 1.81 1 85 TRP -2.42 0.51 1 86 LEU -4.13 2.13 1 87 TRP 1.57 0.14 1 88 MET -6.08 3.24 1 89 ARG -5.23 3.50 1 90 THR -3.86 2.39 1 91 SER 0.63 0.29 1 92 SER -2.10 2.62 1 93 GLN -5.17 3.73 1 94 THR 3.58 -0.91 1 95 ALA -0.55 -0.10 1 96 GLN -1.68 0.60 1 97 ASN 2.48 -0.85 1 99 TYR -0.46 -1.60 1 100 SER 2.80 -0.53 1 101 ASP 0.90 -1.00 1 102 GLU -3.51 1.87 1 103 ILE -2.66 1.98 1 104 GLU -4.13 2.43 1 105 THR -0.91 0.58 1 106 ILE 0.69 -0.37 1 107 ILE 1.66 -1.30 1 109 THR 1.83 -0.16 1 110 ASN -0.91 0.91 1 111 THR 0.50 -0.40 1 117 SER 0.33 -0.07 1 118 GLN -0.20 0.26 1 119 GLU 0.29 1.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.03 _LACS_plot.Line_1_terminator_val_y_1 0.96 _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 0.24 _LACS_plot.Line_2_terminator_val_x_2 6.18 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _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 50 HIS 0.56 -1.38 0 92 SER -2.10 1.73 0 10 THR -0.46 0.07 1 11 GLU -6.67 1.20 1 12 PHE -4.88 0.39 1 13 ILE 0.01 0.00 1 14 SER -8.03 1.12 1 15 ARG -5.59 1.49 1 16 HIS -3.27 0.82 1 17 ASN -1.57 0.16 1 18 ILE 4.03 -0.38 1 19 GLU 0.57 -0.13 1 21 ILE 1.89 -0.17 1 22 PHE 1.54 0.43 1 23 THR 0.42 0.05 1 24 PHE -1.12 -0.14 1 25 VAL -3.44 0.05 1 26 ASP -2.24 -0.17 1 27 HIS 2.79 -0.51 1 28 ARG 3.28 -0.13 1 30 VAL 5.15 -0.75 1 31 ALA 1.10 -0.19 1 32 THR 3.59 -0.23 1 33 VAL -3.60 0.38 1 35 TYR -2.59 -0.13 1 36 GLN 1.30 -0.36 1 38 GLN 4.91 -0.34 1 39 GLU -0.05 -0.15 1 40 LEU -0.55 -0.13 1 41 LEU 2.19 -0.66 1 43 LYS -2.70 0.36 1 44 ASN -2.39 -0.05 1 45 ILE 6.18 -0.28 1 46 VAL 5.38 -0.68 1 47 GLU 2.45 -0.36 1 48 PHE 0.20 -0.44 1 52 GLU 2.47 -0.23 1 53 ASP -2.61 0.26 1 54 GLN 5.33 -0.36 1 55 GLN 5.11 -0.56 1 56 LEU 3.41 -0.27 1 57 LEU 2.92 -0.76 1 58 ARG 4.70 -1.00 1 59 ASP 3.89 -0.30 1 60 SER 4.38 -0.35 1 61 PHE 2.12 -0.01 1 62 GLN 3.85 -0.30 1 63 GLN 3.36 -0.26 1 64 VAL 5.33 -0.46 1 65 VAL 3.17 -0.29 1 66 LYS 1.86 -0.14 1 67 LEU -0.57 0.21 1 68 LYS 3.08 -0.16 1 70 GLN -1.06 0.17 1 71 VAL -1.06 0.70 1 72 LEU -4.56 0.49 1 73 SER -4.25 0.74 1 74 VAL -5.37 0.59 1 75 MET -3.23 1.44 1 76 PHE -4.37 0.38 1 77 ARG -3.32 0.08 1 78 PHE -7.46 0.82 1 79 ARG 0.80 -0.14 1 80 SER -1.24 0.30 1 81 LYS 4.50 -0.65 1 82 ASN 1.13 -0.06 1 83 GLN 5.10 -0.96 1 84 GLU -3.69 -0.03 1 85 TRP -2.42 0.48 1 86 LEU -4.13 0.51 1 87 TRP 1.57 -0.20 1 88 MET -6.08 0.79 1 89 ARG -5.23 1.36 1 90 THR -3.86 1.27 1 91 SER 0.63 0.39 1 93 GLN -5.17 0.71 1 94 THR 3.58 -0.37 1 95 ALA -0.55 -0.16 1 96 GLN -1.68 -0.17 1 97 ASN 2.48 -0.61 1 99 TYR -0.46 0.45 1 100 SER 2.80 -0.20 1 101 ASP 0.90 0.05 1 102 GLU -3.51 0.10 1 103 ILE -2.66 -0.17 1 104 GLU -4.13 0.75 1 105 THR -0.91 0.88 1 106 ILE 0.69 0.32 1 107 ILE 1.66 0.07 1 109 THR 1.83 0.38 1 110 ASN -0.91 0.15 1 111 THR 0.50 0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15928_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.03 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 6.18 _LACS_plot.Line_2_terminator_val_y_2 1.70 _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 14 SER -8.03 -1.17 0 83 GLN 5.10 -1.79 0 90 THR -3.86 2.09 0 17 ASN -1.57 3.06 0 78 PHE -7.46 0.07 0 10 THR -0.46 -1.96 1 11 GLU -6.67 -3.54 1 12 PHE -4.88 -3.82 1 13 ILE 0.01 -2.97 1 15 ARG -5.59 -0.26 1 16 HIS -3.27 -0.04 1 18 ILE 4.03 -1.55 1 21 ILE 1.89 0.51 1 22 PHE 1.54 2.17 1 23 THR 0.42 0.89 1 24 PHE -1.12 -2.42 1 25 VAL -3.44 -3.20 1 26 ASP -2.24 -1.04 1 27 HIS 2.79 3.17 1 28 ARG 3.28 1.54 1 30 VAL 5.15 1.92 1 31 ALA 1.10 0.31 1 32 THR 3.59 0.96 1 33 VAL -3.60 -0.71 1 35 TYR -2.59 -1.41 1 38 GLN 4.91 1.12 1 39 GLU -0.05 -1.11 1 40 LEU -0.55 -1.18 1 41 LEU 2.19 0.15 1 43 LYS -2.70 -2.66 1 44 ASN -2.39 1.72 1 45 ILE 6.18 -0.26 1 46 VAL 5.38 2.11 1 47 GLU 2.45 1.06 1 48 PHE 0.20 -3.06 1 52 GLU 2.47 1.04 1 53 ASP -2.61 -0.66 1 54 GLN 5.33 1.42 1 55 GLN 5.11 1.40 1 56 LEU 3.41 2.44 1 57 LEU 2.92 0.87 1 58 ARG 4.70 3.41 1 59 ASP 3.89 2.83 1 60 SER 4.38 1.28 1 61 PHE 2.12 1.76 1 62 GLN 3.85 3.09 1 63 GLN 3.36 2.24 1 64 VAL 5.33 0.84 1 65 VAL 3.17 1.32 1 66 LYS 1.86 0.77 1 67 LEU -0.57 -2.07 1 68 LYS 3.08 1.39 1 70 GLN -1.06 -1.32 1 71 VAL -1.06 0.11 1 72 LEU -4.56 -2.19 1 73 SER -4.25 -0.04 1 74 VAL -5.37 -2.18 1 75 MET -3.23 -0.77 1 76 PHE -4.37 -4.18 1 77 ARG -3.32 -2.84 1 79 ARG 0.80 -0.98 1 80 SER -1.24 0.38 1 81 LYS 4.50 0.82 1 82 ASN 1.13 -1.25 1 85 TRP -2.42 -0.33 1 86 LEU -4.13 -0.61 1 87 TRP 1.57 -0.37 1 88 MET -6.08 -1.59 1 89 ARG -5.23 0.84 1 91 SER 0.63 0.57 1 92 SER -2.10 -2.85 1 93 GLN -5.17 -1.85 1 94 THR 3.58 -0.02 1 95 ALA -0.55 -1.52 1 96 GLN -1.68 0.23 1 99 TYR -0.46 0.52 1 100 SER 2.80 -0.46 1 101 ASP 0.90 -0.77 1 103 ILE -2.66 -2.34 1 104 GLU -4.13 -1.51 1 105 THR -0.91 0.18 1 106 ILE 0.69 -0.99 1 107 ILE 1.66 -2.59 1 109 THR 1.83 0.23 1 110 ASN -0.91 -0.37 1 111 THR 0.50 -0.51 1 117 SER 0.33 -0.36 1 118 GLN -0.20 -1.11 1 stop_ save_