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 bmr5347_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -2.74 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 5.56 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 132 ALA -3.17 2.65 0 10 GLU -2.84 -1.09 1 12 ILE 0.15 -0.03 1 13 VAL 4.44 2.85 1 15 ALA -1.99 -1.76 1 16 GLU -0.34 0.81 1 17 THR -0.84 -0.51 1 18 PHE -3.24 -1.53 1 19 TYR 0.54 -0.72 1 20 VAL -3.84 -3.25 1 21 ASP -5.27 -0.54 1 23 ALA -3.51 0.16 1 24 ALA -5.74 -1.97 1 25 ASN -2.20 -0.66 1 26 ARG 3.31 2.76 1 27 GLU 2.05 2.23 1 28 THR -0.33 0.05 1 29 LYS 5.65 1.75 1 30 LEU -2.33 -0.82 1 32 LYS -6.26 -1.13 1 33 ALA -6.92 -2.27 1 35 TYR -7.22 -2.55 1 36 VAL -4.38 -1.14 1 37 THR -7.40 -4.18 1 38 ASN 2.51 1.16 1 39 ARG 0.05 -0.72 1 41 ARG -0.58 0.53 1 42 GLN -4.38 -0.96 1 43 LYS -1.76 0.11 1 44 VAL -4.09 -1.67 1 45 VAL -4.61 -2.61 1 46 THR 0.37 0.44 1 47 LEU -4.59 -1.42 1 48 THR -2.59 -1.57 1 49 ASP 2.28 0.94 1 50 THR -2.34 -1.80 1 51 THR -6.48 -3.12 1 52 ASN 5.01 4.68 1 53 GLN 5.57 4.28 1 54 LYS 4.88 4.33 1 55 THR 6.30 4.79 1 56 GLU 4.31 3.13 1 57 LEU 2.66 2.50 1 58 GLN 5.11 3.04 1 59 ALA 3.42 3.43 1 60 ILE 5.21 4.34 1 61 TYR 4.37 3.38 1 62 LEU 2.35 2.70 1 63 ALA 1.28 1.38 1 64 LEU 3.50 2.54 1 65 GLN 2.92 3.32 1 66 ASP 2.06 0.45 1 67 SER -5.87 -2.14 1 69 LEU 2.05 2.50 1 70 GLU -3.45 -0.99 1 71 VAL -3.02 -1.11 1 72 ASN -4.05 -1.25 1 73 ILE -2.43 -0.26 1 74 VAL -2.20 -1.36 1 75 THR -3.98 -3.60 1 76 ASP -1.89 -1.47 1 77 SER -0.49 -1.52 1 78 GLN 4.56 3.27 1 79 TYR 2.65 2.49 1 80 ALA 2.55 2.15 1 81 LEU 3.58 2.94 1 83 ILE 3.43 1.89 1 84 ILE 4.10 3.05 1 85 GLN 2.78 2.10 1 86 ALA 0.66 0.47 1 87 GLN 2.87 1.68 1 89 ASP -0.24 0.06 1 90 GLN 0.09 0.23 1 91 SER 0.07 0.22 1 92 GLU 0.91 0.39 1 93 SER -0.10 -0.97 1 94 GLU 3.57 2.88 1 95 LEU 2.29 2.39 1 96 VAL 7.11 5.26 1 97 ASN 4.85 3.76 1 98 GLN 4.81 3.41 1 99 ILE 5.53 5.23 1 100 ILE 6.09 4.74 1 101 GLU 3.50 3.13 1 102 GLN 1.80 2.08 1 103 LEU 4.15 3.55 1 104 ILE 3.69 3.47 1 105 LYS 0.73 0.90 1 106 LYS -1.22 -1.84 1 107 GLU 1.20 1.92 1 108 LYS -6.46 -0.05 1 109 VAL -3.73 -1.67 1 110 TYR -3.26 -1.63 1 111 LEU -5.74 -2.31 1 112 ALA -5.72 -1.72 1 113 TRP -5.90 -2.41 1 114 VAL -3.22 -1.22 1 118 LYS -0.08 -0.23 1 120 ILE 0.64 0.21 1 123 ASN 1.44 4.38 1 134 ILE -0.13 -0.43 1 135 ARG -0.75 -0.26 1 136 LYS 0.02 0.18 1 137 VAL 0.30 0.22 1 138 LEU 0.61 1.65 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5347_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 4.66 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -1.54 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 132 ALA -3.17 5.82 0 10 GLU -2.84 1.75 1 12 ILE 0.15 -0.18 1 13 VAL 4.44 -1.59 1 15 ALA -1.99 0.23 1 16 GLU -0.34 1.15 1 17 THR -0.84 0.33 1 18 PHE -3.24 1.71 1 19 TYR 0.54 -1.26 1 20 VAL -3.84 0.59 1 21 ASP -5.27 4.73 1 23 ALA -3.51 3.67 1 24 ALA -5.74 3.77 1 25 ASN -2.20 1.54 1 26 ARG 3.31 -0.55 1 27 GLU 2.05 0.18 1 28 THR -0.33 0.38 1 29 LYS 5.65 -3.90 1 30 LEU -2.33 1.51 1 32 LYS -6.26 5.13 1 33 ALA -6.92 4.65 1 35 TYR -7.22 4.67 1 36 VAL -4.38 3.24 1 37 THR -7.40 3.22 1 38 ASN 2.51 -1.35 1 39 ARG 0.05 -0.77 1 41 ARG -0.58 1.11 1 42 GLN -4.38 3.42 1 43 LYS -1.76 1.87 1 44 VAL -4.09 2.42 1 45 VAL -4.61 2.00 1 46 THR 0.37 0.07 1 47 LEU -4.59 3.17 1 48 THR -2.59 1.02 1 49 ASP 2.28 -1.34 1 50 THR -2.34 0.54 1 51 THR -6.48 3.36 1 52 ASN 5.01 -0.33 1 53 GLN 5.57 -1.29 1 54 LYS 4.88 -0.55 1 55 THR 6.30 -1.51 1 56 GLU 4.31 -1.18 1 57 LEU 2.66 -0.16 1 58 GLN 5.11 -2.07 1 59 ALA 3.42 0.01 1 60 ILE 5.21 -0.87 1 61 TYR 4.37 -0.99 1 62 LEU 2.35 0.35 1 63 ALA 1.28 0.10 1 64 LEU 3.50 -0.96 1 65 GLN 2.92 0.40 1 66 ASP 2.06 -1.61 1 67 SER -5.87 3.73 1 69 LEU 2.05 0.45 1 70 GLU -3.45 2.46 1 71 VAL -3.02 1.91 1 72 ASN -4.05 2.80 1 73 ILE -2.43 2.17 1 74 VAL -2.20 0.84 1 75 THR -3.98 0.38 1 76 ASP -1.89 0.42 1 77 SER -0.49 -1.03 1 78 GLN 4.56 -1.29 1 79 TYR 2.65 -0.16 1 80 ALA 2.55 -0.40 1 81 LEU 3.58 -0.64 1 83 ILE 3.43 -1.54 1 84 ILE 4.10 -1.05 1 85 GLN 2.78 -0.68 1 86 ALA 0.66 -0.19 1 87 GLN 2.87 -1.19 1 89 ASP -0.24 0.30 1 90 GLN 0.09 0.14 1 91 SER 0.07 0.15 1 92 GLU 0.91 -0.52 1 93 SER -0.10 -0.87 1 94 GLU 3.57 -0.69 1 95 LEU 2.29 0.10 1 96 VAL 7.11 -1.85 1 97 ASN 4.85 -1.09 1 98 GLN 4.81 -1.40 1 99 ILE 5.53 -0.30 1 100 ILE 6.09 -1.35 1 101 GLU 3.50 -0.37 1 102 GLN 1.80 0.28 1 103 LEU 4.15 -0.60 1 104 ILE 3.69 -0.22 1 105 LYS 0.73 0.17 1 106 LYS -1.22 -0.62 1 107 GLU 1.20 0.72 1 108 LYS -6.46 6.41 1 109 VAL -3.73 2.06 1 110 TYR -3.26 1.63 1 111 LEU -5.74 3.43 1 112 ALA -5.72 4.00 1 113 TRP -5.90 3.49 1 114 VAL -3.22 2.00 1 118 LYS -0.08 -0.15 1 120 ILE 0.64 -0.43 1 123 ASN 1.44 2.94 1 134 ILE -0.13 -0.30 1 135 ARG -0.75 0.49 1 136 LYS 0.02 0.16 1 137 VAL 0.30 -0.08 1 138 LEU 0.61 1.04 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5347_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 1.08 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.32 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _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 63 ALA 1.28 -1.06 0 67 SER -5.87 0.07 0 37 THR -7.40 1.91 0 10 GLU -2.84 -0.09 1 12 ILE 0.15 -0.29 1 13 VAL 4.44 -0.48 1 15 ALA -1.99 0.24 1 16 GLU -0.34 -0.10 1 17 THR -0.84 0.96 1 18 PHE -3.24 -0.30 1 19 TYR 0.54 0.49 1 20 VAL -3.84 1.42 1 21 ASP -5.27 0.45 1 23 ALA -3.51 0.38 1 24 ALA -5.74 0.77 1 25 ASN -2.20 0.13 1 26 ARG 3.31 -0.21 1 27 GLU 2.05 -0.05 1 28 THR -0.33 -0.07 1 29 LYS 5.65 -0.45 1 30 LEU -2.33 0.54 1 32 LYS -6.26 1.18 1 33 ALA -6.92 0.97 1 35 TYR -7.22 1.42 1 36 VAL -4.38 1.04 1 38 ASN 2.51 -0.16 1 39 ARG 0.05 0.30 1 41 ARG -0.58 0.36 1 42 GLN -4.38 0.87 1 43 LYS -1.76 0.02 1 44 VAL -4.09 0.79 1 45 VAL -4.61 0.60 1 46 THR 0.37 0.59 1 47 LEU -4.59 0.43 1 48 THR -2.59 0.31 1 49 ASP 2.28 -0.33 1 50 THR -2.34 0.52 1 52 ASN 5.01 -0.81 1 53 GLN 5.57 -0.63 1 54 LYS 4.88 -0.42 1 55 THR 6.30 -0.55 1 56 GLU 4.31 -0.44 1 57 LEU 2.66 -0.27 1 58 GLN 5.11 -0.31 1 59 ALA 3.42 -0.32 1 60 ILE 5.21 -0.63 1 61 TYR 4.37 -0.52 1 62 LEU 2.35 -0.50 1 64 LEU 3.50 -0.96 1 65 GLN 2.92 -0.66 1 66 ASP 2.06 0.13 1 69 LEU 2.05 -0.27 1 70 GLU -3.45 1.45 1 71 VAL -3.02 0.52 1 72 ASN -4.05 1.19 1 73 ILE -2.43 0.72 1 74 VAL -2.20 0.77 1 75 THR -3.98 0.84 1 76 ASP -1.89 0.78 1 77 SER -0.49 0.38 1 78 GLN 4.56 -0.73 1 79 TYR 2.65 -0.42 1 80 ALA 2.55 -0.77 1 81 LEU 3.58 -0.58 1 83 ILE 3.43 -0.40 1 84 ILE 4.10 -0.55 1 85 GLN 2.78 -0.18 1 86 ALA 0.66 -0.07 1 87 GLN 2.87 0.19 1 89 ASP -0.24 -0.06 1 90 GLN 0.09 0.02 1 91 SER 0.07 -0.06 1 92 GLU 0.91 -0.04 1 93 SER -0.10 -0.03 1 94 GLU 3.57 -0.26 1 95 LEU 2.29 -0.28 1 96 VAL 7.11 -0.78 1 97 ASN 4.85 -0.33 1 98 GLN 4.81 -0.27 1 99 ILE 5.53 -0.66 1 100 ILE 6.09 -0.78 1 101 GLU 3.50 -0.44 1 102 GLN 1.80 -0.41 1 103 LEU 4.15 -0.77 1 104 ILE 3.69 -0.37 1 105 LYS 0.73 -0.11 1 106 LYS -1.22 -0.06 1 107 GLU 1.20 0.06 1 108 LYS -6.46 0.62 1 109 VAL -3.73 0.79 1 110 TYR -3.26 0.32 1 111 LEU -5.74 0.95 1 112 ALA -5.72 0.11 1 113 TRP -5.90 0.47 1 114 VAL -3.22 1.19 1 118 LYS -0.08 0.54 1 120 ILE 0.64 -0.07 1 123 ASN 1.44 -0.35 1 132 ALA -3.17 -0.01 1 134 ILE -0.13 0.00 1 135 ARG -0.75 0.11 1 136 LYS 0.02 -0.04 1 137 VAL 0.30 -0.01 1 138 LEU 0.61 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5347_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -3.11 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 2.69 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 71 VAL -3.02 -6.08 0 29 LYS 5.65 -2.98 0 37 THR -7.40 1.97 0 12 ILE 0.15 1.96 1 13 VAL 4.44 1.28 1 15 ALA -1.99 -1.17 1 16 GLU -0.34 -1.77 1 17 THR -0.84 -1.83 1 18 PHE -3.24 -2.83 1 19 TYR 0.54 0.15 1 20 VAL -3.84 -0.73 1 21 ASP -5.27 -3.34 1 23 ALA -3.51 -2.76 1 24 ALA -5.74 -2.42 1 25 ASN -2.20 1.50 1 26 ARG 3.31 0.40 1 27 GLU 2.05 1.81 1 28 THR -0.33 1.32 1 30 LEU -2.33 -0.49 1 32 LYS -6.26 -2.28 1 33 ALA -6.92 -2.15 1 35 TYR -7.22 -1.75 1 36 VAL -4.38 -0.55 1 38 ASN 2.51 0.35 1 39 ARG 0.05 0.02 1 41 ARG -0.58 -1.07 1 42 GLN -4.38 -1.97 1 44 VAL -4.09 -1.78 1 45 VAL -4.61 -1.75 1 46 THR 0.37 -0.71 1 47 LEU -4.59 -2.62 1 48 THR -2.59 -1.13 1 49 ASP 2.28 -1.24 1 50 THR -2.34 -0.90 1 52 ASN 5.01 2.19 1 53 GLN 5.57 1.74 1 54 LYS 4.88 3.21 1 55 THR 6.30 2.11 1 56 GLU 4.31 3.52 1 57 LEU 2.66 1.39 1 58 GLN 5.11 1.84 1 59 ALA 3.42 0.76 1 60 ILE 5.21 0.60 1 61 TYR 4.37 0.99 1 62 LEU 2.35 0.43 1 63 ALA 1.28 1.53 1 64 LEU 3.50 0.12 1 65 GLN 2.92 2.33 1 66 ASP 2.06 -1.09 1 67 SER -5.87 1.24 1 69 LEU 2.05 -1.08 1 70 GLU -3.45 -1.60 1 72 ASN -4.05 -0.98 1 73 ILE -2.43 -3.41 1 74 VAL -2.20 -1.12 1 75 THR -3.98 -3.59 1 76 ASP -1.89 1.64 1 77 SER -0.49 0.64 1 78 GLN 4.56 2.78 1 79 TYR 2.65 1.17 1 80 ALA 2.55 0.89 1 81 LEU 3.58 1.00 1 83 ILE 3.43 1.18 1 84 ILE 4.10 2.21 1 85 GLN 2.78 0.40 1 86 ALA 0.66 -1.00 1 89 ASP -0.24 0.04 1 90 GLN 0.09 -0.52 1 91 SER 0.07 0.43 1 92 GLU 0.91 -0.16 1 93 SER -0.10 0.57 1 94 GLU 3.57 1.48 1 95 LEU 2.29 1.06 1 96 VAL 7.11 1.26 1 97 ASN 4.85 3.09 1 98 GLN 4.81 3.35 1 99 ILE 5.53 0.85 1 100 ILE 6.09 0.76 1 101 GLU 3.50 2.74 1 102 GLN 1.80 2.76 1 103 LEU 4.15 1.66 1 104 ILE 3.69 0.30 1 105 LYS 0.73 1.08 1 106 LYS -1.22 0.76 1 107 GLU 1.20 1.21 1 108 LYS -6.46 -2.35 1 109 VAL -3.73 -3.35 1 110 TYR -3.26 -3.52 1 111 LEU -5.74 -3.53 1 112 ALA -5.72 -3.43 1 113 TRP -5.90 -2.30 1 118 LYS -0.08 -0.18 1 120 ILE 0.64 0.71 1 132 ALA -3.17 -0.11 1 134 ILE -0.13 -0.56 1 135 ARG -0.75 -0.77 1 136 LYS 0.02 -0.54 1 137 VAL 0.30 -1.30 1 stop_ save_