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 bmr10055_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.86 _LACS_plot.Line_1_terminator_val_y_1 -3.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.72 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 5.46 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ARG -9.86 -2.12 0 10 SER -0.04 0.23 1 11 LEU 0.06 0.14 1 12 VAL -0.40 0.00 1 13 VAL -0.21 -0.26 1 15 GLU -3.37 -1.78 1 16 VAL 1.33 0.54 1 17 ASP -2.04 1.05 1 19 GLU 3.28 2.68 1 20 LEU 3.76 2.13 1 21 LYS 5.77 4.86 1 22 GLU 2.94 2.03 1 23 THR 6.80 5.93 1 24 LEU 3.42 3.06 1 25 ARG 4.96 3.97 1 26 LYS 3.87 3.32 1 27 PHE 2.90 3.64 1 28 ARG 3.03 2.31 1 29 PHE -0.26 -0.88 1 30 ARG 1.48 0.76 1 31 LYS 0.00 -0.34 1 32 GLU 0.79 1.02 1 33 THR -0.42 -1.29 1 34 ASN -0.96 -0.97 1 35 ASN 0.14 0.13 1 36 ALA -4.02 -0.17 1 37 ALA -8.84 -2.23 1 38 ILE -2.05 -0.65 1 39 ILE -0.14 0.00 1 40 MET -6.16 -0.40 1 41 LYS -6.99 -3.23 1 42 VAL -1.06 -0.22 1 43 ASP -2.71 -1.42 1 44 LYS 3.40 3.00 1 45 ASP 3.41 3.08 1 46 ARG -0.91 0.15 1 47 GLN 4.67 1.20 1 48 MET -8.25 -1.91 1 49 VAL 1.13 0.34 1 50 VAL -6.14 -3.07 1 51 LEU 0.53 1.52 1 52 GLU -1.56 0.95 1 53 ASP -4.66 -0.56 1 54 GLU -3.82 -1.27 1 55 LEU -4.55 -1.54 1 56 GLN -2.97 -0.71 1 57 ASN 3.75 1.56 1 58 ILE -5.38 -2.57 1 59 SER 0.29 0.50 1 61 GLU 4.69 3.61 1 62 GLU 1.65 2.01 1 63 LEU 3.97 2.74 1 64 LYS 5.55 3.82 1 65 LEU 1.86 1.29 1 66 GLU -0.44 -0.90 1 67 LEU -0.65 -1.08 1 69 GLU 0.99 1.79 1 70 ARG -1.66 -1.38 1 71 GLN -3.84 -0.38 1 74 PHE -6.28 -3.49 1 75 VAL -5.49 -2.12 1 76 VAL -1.52 -0.74 1 77 TYR -7.51 -3.48 1 78 SER -1.46 -1.41 1 79 TYR -7.21 -3.13 1 80 LYS 1.14 -0.12 1 81 TYR -3.66 -3.52 1 82 VAL 1.57 -0.11 1 83 HIS -0.71 0.40 1 84 ASP 4.20 3.08 1 85 ASP -0.18 -1.18 1 87 ARG 1.33 1.05 1 88 VAL -2.74 -1.17 1 89 SER -3.55 -1.39 1 90 TYR -0.93 -0.68 1 92 LEU -3.15 -1.56 1 94 PHE -3.22 -1.70 1 95 ILE -4.91 -1.36 1 96 PHE -4.41 -5.07 1 97 SER -0.46 -1.99 1 98 SER -1.86 -3.06 1 100 VAL 3.12 2.18 1 103 LYS 1.47 0.83 1 105 GLU 4.47 3.27 1 106 GLN 2.89 2.83 1 107 GLN 6.35 5.16 1 108 MET 3.65 3.45 1 109 MET 3.48 3.58 1 110 TYR 4.77 4.20 1 111 ALA 4.60 3.66 1 113 SER 1.04 1.57 1 114 LYS 4.52 3.97 1 115 ASN 5.07 3.22 1 116 ARG 3.85 2.24 1 117 LEU 3.48 2.54 1 118 VAL 6.18 4.80 1 119 GLN 3.71 2.69 1 120 THR 5.76 4.74 1 121 ALA 0.20 -0.15 1 122 GLU 3.84 0.56 1 123 LEU -2.31 -1.33 1 124 THR -0.16 0.15 1 125 LYS 0.21 -0.78 1 126 VAL -2.45 -0.99 1 127 PHE -6.37 -3.47 1 128 GLU -4.28 -1.18 1 129 ILE -3.64 -1.63 1 130 ARG -0.29 -1.04 1 131 THR -1.83 -2.06 1 132 THR 5.20 3.19 1 133 ASP 2.31 1.92 1 134 ASP 1.46 0.96 1 135 LEU 2.75 0.47 1 136 THR -6.82 -3.36 1 137 GLU 4.58 4.16 1 138 THR 5.92 4.90 1 139 TRP 3.69 3.96 1 140 LEU 2.55 2.54 1 141 LYS 5.50 4.66 1 142 GLU 3.61 2.75 1 143 LYS 3.90 0.53 1 144 LEU 1.76 1.42 1 145 ALA 0.95 0.95 1 146 SER 0.24 0.55 1 149 SER -0.02 0.21 1 150 SER -0.05 0.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10055_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.86 _LACS_plot.Line_1_terminator_val_y_1 6.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.28 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ARG -9.86 7.74 0 10 SER -0.04 0.27 1 11 LEU 0.06 0.08 1 12 VAL -0.40 0.40 1 13 VAL -0.21 -0.05 1 15 GLU -3.37 1.59 1 16 VAL 1.33 -0.79 1 17 ASP -2.04 3.09 1 19 GLU 3.28 -0.60 1 20 LEU 3.76 -1.63 1 21 LYS 5.77 -0.91 1 22 GLU 2.94 -0.91 1 23 THR 6.80 -0.87 1 24 LEU 3.42 -0.36 1 25 ARG 4.96 -0.99 1 26 LYS 3.87 -0.55 1 27 PHE 2.90 0.74 1 28 ARG 3.03 -0.72 1 29 PHE -0.26 -0.62 1 30 ARG 1.48 -0.72 1 31 LYS 0.00 -0.34 1 32 GLU 0.79 0.23 1 33 THR -0.42 -0.87 1 34 ASN -0.96 -0.01 1 35 ASN 0.14 -0.01 1 36 ALA -4.02 3.85 1 37 ALA -8.84 6.61 1 38 ILE -2.05 1.40 1 39 ILE -0.14 0.14 1 40 MET -6.16 5.76 1 41 LYS -6.99 3.76 1 42 VAL -1.06 0.84 1 43 ASP -2.71 1.29 1 44 LYS 3.40 -0.40 1 45 ASP 3.41 -0.33 1 46 ARG -0.91 1.06 1 47 GLN 4.67 -3.47 1 48 MET -8.25 6.34 1 49 VAL 1.13 -0.79 1 50 VAL -6.14 3.07 1 51 LEU 0.53 0.99 1 52 GLU -1.56 2.51 1 53 ASP -4.66 4.10 1 54 GLU -3.82 2.55 1 55 LEU -4.55 3.01 1 56 GLN -2.97 2.26 1 57 ASN 3.75 -2.19 1 58 ILE -5.38 2.81 1 59 SER 0.29 0.21 1 61 GLU 4.69 -1.08 1 62 GLU 1.65 0.36 1 63 LEU 3.97 -1.23 1 64 LYS 5.55 -1.73 1 65 LEU 1.86 -0.57 1 66 GLU -0.44 -0.46 1 67 LEU -0.65 -0.43 1 69 GLU 0.99 0.80 1 70 ARG -1.66 0.28 1 71 GLN -3.84 3.46 1 74 PHE -6.28 2.79 1 75 VAL -5.49 3.37 1 76 VAL -1.52 0.78 1 77 TYR -7.51 4.03 1 78 SER -1.46 0.05 1 79 TYR -7.21 4.08 1 80 LYS 1.14 -1.26 1 81 TYR -3.66 0.14 1 82 VAL 1.57 -1.68 1 83 HIS -0.71 1.11 1 84 ASP 4.20 -1.12 1 85 ASP -0.18 -1.00 1 87 ARG 1.33 -0.28 1 88 VAL -2.74 1.57 1 89 SER -3.55 2.16 1 90 TYR -0.93 0.25 1 92 LEU -3.15 1.59 1 94 PHE -3.22 1.52 1 95 ILE -4.91 3.55 1 96 PHE -4.41 -0.66 1 97 SER -0.46 -1.53 1 98 SER -1.86 -1.20 1 100 VAL 3.12 -0.94 1 103 LYS 1.47 -0.64 1 105 GLU 4.47 -1.20 1 106 GLN 2.89 -0.06 1 107 GLN 6.35 -1.19 1 108 MET 3.65 -0.20 1 109 MET 3.48 0.10 1 110 TYR 4.77 -0.57 1 111 ALA 4.60 -0.94 1 113 SER 1.04 0.53 1 114 LYS 4.52 -0.55 1 115 ASN 5.07 -1.85 1 116 ARG 3.85 -1.61 1 117 LEU 3.48 -0.94 1 118 VAL 6.18 -1.38 1 119 GLN 3.71 -1.02 1 120 THR 5.76 -1.02 1 121 ALA 0.20 -0.35 1 122 GLU 3.84 -3.28 1 123 LEU -2.31 0.98 1 124 THR -0.16 0.31 1 125 LYS 0.21 -0.99 1 126 VAL -2.45 1.46 1 127 PHE -6.37 2.90 1 128 GLU -4.28 3.10 1 129 ILE -3.64 2.01 1 130 ARG -0.29 -0.75 1 131 THR -1.83 -0.23 1 132 THR 5.20 -2.01 1 133 ASP 2.31 -0.39 1 134 ASP 1.46 -0.50 1 135 LEU 2.75 -2.28 1 136 THR -6.82 3.46 1 137 GLU 4.58 -0.42 1 138 THR 5.92 -1.02 1 139 TRP 3.69 0.27 1 140 LEU 2.55 -0.01 1 141 LYS 5.50 -0.84 1 142 GLU 3.61 -0.86 1 143 LYS 3.90 -3.37 1 144 LEU 1.76 -0.34 1 145 ALA 0.95 0.00 1 146 SER 0.24 0.31 1 149 SER -0.02 0.23 1 150 SER -0.05 0.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10055_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.86 _LACS_plot.Line_1_terminator_val_y_1 1.25 _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 0.28 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _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 73 ARG -9.86 0.22 0 10 SER -0.04 -0.04 1 11 LEU 0.06 0.02 1 12 VAL -0.40 -0.07 1 13 VAL -0.21 -0.21 1 15 GLU -3.37 0.08 1 16 VAL 1.33 -0.16 1 17 ASP -2.04 -0.10 1 19 GLU 3.28 -0.16 1 20 LEU 3.76 -0.14 1 21 LYS 5.77 -0.64 1 22 GLU 2.94 0.03 1 23 THR 6.80 -0.43 1 24 LEU 3.42 -0.39 1 25 ARG 4.96 -0.31 1 26 LYS 3.87 -0.27 1 27 PHE 2.90 -0.32 1 28 ARG 3.03 -0.42 1 29 PHE -0.26 0.18 1 30 ARG 1.48 -0.06 1 31 LYS 0.00 -0.09 1 32 GLU 0.79 -0.28 1 33 THR -0.42 -0.31 1 34 ASN -0.96 -0.06 1 35 ASN 0.14 0.48 1 36 ALA -4.02 0.86 1 37 ALA -8.84 1.66 1 38 ILE -2.05 0.34 1 39 ILE -0.14 0.65 1 40 MET -6.16 0.68 1 41 LYS -6.99 1.12 1 42 VAL -1.06 0.06 1 43 ASP -2.71 0.14 1 44 LYS 3.40 -0.50 1 45 ASP 3.41 -0.14 1 46 ARG -0.91 -0.08 1 47 GLN 4.67 -0.66 1 48 MET -8.25 0.97 1 49 VAL 1.13 0.38 1 50 VAL -6.14 0.72 1 51 LEU 0.53 -0.34 1 52 GLU -1.56 0.30 1 53 ASP -4.66 0.27 1 54 GLU -3.82 0.73 1 55 LEU -4.55 0.56 1 56 GLN -2.97 0.42 1 57 ASN 3.75 -0.16 1 58 ILE -5.38 0.88 1 59 SER 0.29 0.10 1 61 GLU 4.69 -0.36 1 62 GLU 1.65 -0.37 1 63 LEU 3.97 -0.62 1 64 LYS 5.55 -0.74 1 65 LEU 1.86 -0.28 1 66 GLU -0.44 -0.12 1 67 LEU -0.65 -0.19 1 69 GLU 0.99 -0.35 1 70 ARG -1.66 -0.08 1 71 GLN -3.84 0.19 1 74 PHE -6.28 0.94 1 75 VAL -5.49 1.10 1 76 VAL -1.52 0.96 1 77 TYR -7.51 1.25 1 78 SER -1.46 0.56 1 79 TYR -7.21 0.05 1 80 LYS 1.14 -0.52 1 81 TYR -3.66 -0.14 1 82 VAL 1.57 0.08 1 83 HIS -0.71 -0.43 1 84 ASP 4.20 -0.29 1 85 ASP -0.18 -0.10 1 87 ARG 1.33 -0.16 1 88 VAL -2.74 0.82 1 89 SER -3.55 0.22 1 90 TYR -0.93 0.83 1 92 LEU -3.15 0.85 1 94 PHE -3.22 0.85 1 95 ILE -4.91 0.77 1 96 PHE -4.41 0.96 1 97 SER -0.46 0.01 1 98 SER -1.86 -0.59 1 100 VAL 3.12 -0.29 1 103 LYS 1.47 -0.07 1 105 GLU 4.47 -0.18 1 106 GLN 2.89 0.05 1 107 GLN 6.35 -0.47 1 108 MET 3.65 -0.20 1 109 MET 3.48 -0.14 1 110 TYR 4.77 -0.60 1 111 ALA 4.60 -0.31 1 113 SER 1.04 0.21 1 114 LYS 4.52 -1.08 1 115 ASN 5.07 -0.58 1 116 ARG 3.85 -0.34 1 117 LEU 3.48 -0.54 1 118 VAL 6.18 -1.21 1 119 GLN 3.71 -0.29 1 120 THR 5.76 -0.40 1 121 ALA 0.20 -0.13 1 122 GLU 3.84 -0.53 1 123 LEU -2.31 0.34 1 124 THR -0.16 0.03 1 125 LYS 0.21 0.09 1 126 VAL -2.45 0.47 1 127 PHE -6.37 0.86 1 128 GLU -4.28 1.12 1 129 ILE -3.64 0.55 1 130 ARG -0.29 0.17 1 131 THR -1.83 0.19 1 132 THR 5.20 -0.69 1 133 ASP 2.31 -0.47 1 134 ASP 1.46 -0.43 1 135 LEU 2.75 -0.84 1 136 THR -6.82 0.21 1 137 GLU 4.58 -0.42 1 138 THR 5.92 -0.50 1 139 TRP 3.69 -0.59 1 140 LEU 2.55 -1.09 1 141 LYS 5.50 -0.74 1 142 GLU 3.61 -0.41 1 143 LYS 3.90 -0.75 1 144 LEU 1.76 -0.29 1 145 ALA 0.95 -0.02 1 146 SER 0.24 0.02 1 149 SER -0.02 0.08 1 150 SER -0.05 0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10055_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.86 _LACS_plot.Line_1_terminator_val_y_1 -3.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.14 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 2.52 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 135 LEU 2.75 -4.84 0 10 SER -0.04 -0.48 1 11 LEU 0.06 -0.86 1 12 VAL -0.40 -1.60 1 13 VAL -0.21 -0.23 1 15 GLU -3.37 -1.50 1 16 VAL 1.33 -1.16 1 17 ASP -2.04 0.75 1 19 GLU 3.28 3.21 1 20 LEU 3.76 0.53 1 21 LYS 5.77 2.33 1 22 GLU 2.94 1.84 1 23 THR 6.80 2.54 1 24 LEU 3.42 0.79 1 25 ARG 4.96 2.23 1 26 LYS 3.87 3.12 1 27 PHE 2.90 1.86 1 28 ARG 3.03 0.66 1 29 PHE -0.26 -0.30 1 30 ARG 1.48 -0.39 1 31 LYS 0.00 0.77 1 32 GLU 0.79 -0.60 1 33 THR -0.42 -0.21 1 34 ASN -0.96 -1.12 1 35 ASN 0.14 0.65 1 36 ALA -4.02 -3.18 1 37 ALA -8.84 -2.25 1 38 ILE -2.05 -1.75 1 39 ILE -0.14 -0.47 1 40 MET -6.16 -2.98 1 41 LYS -6.99 -3.01 1 42 VAL -1.06 -0.70 1 43 ASP -2.71 0.11 1 44 LYS 3.40 0.96 1 45 ASP 3.41 1.67 1 46 ARG -0.91 -0.92 1 47 GLN 4.67 -1.40 1 48 MET -8.25 -1.60 1 49 VAL 1.13 -1.62 1 50 VAL -6.14 -1.08 1 51 LEU 0.53 -1.92 1 52 GLU -1.56 -1.59 1 53 ASP -4.66 -2.82 1 54 GLU -3.82 -2.13 1 55 LEU -4.55 -1.68 1 56 GLN -2.97 -0.63 1 57 ASN 3.75 -1.41 1 58 ILE -5.38 -1.86 1 59 SER 0.29 0.17 1 61 GLU 4.69 2.58 1 62 GLU 1.65 2.91 1 63 LEU 3.97 0.39 1 64 LYS 5.55 1.63 1 65 LEU 1.86 0.63 1 66 GLU -0.44 -0.04 1 67 LEU -0.65 -1.15 1 69 GLU 0.99 1.39 1 71 GLN -3.84 -3.26 1 73 ARG -9.86 -1.21 1 74 PHE -6.28 -1.53 1 75 VAL -5.49 -1.02 1 76 VAL -1.52 -2.59 1 77 TYR -7.51 -2.11 1 78 SER -1.46 -3.00 1 79 TYR -7.21 -3.58 1 80 LYS 1.14 -3.75 1 81 TYR -3.66 -2.56 1 82 VAL 1.57 -0.33 1 83 HIS -0.71 2.81 1 84 ASP 4.20 -0.01 1 85 ASP -0.18 1.11 1 87 ARG 1.33 -1.66 1 88 VAL -2.74 -0.23 1 89 SER -3.55 -3.86 1 90 TYR -0.93 -0.99 1 92 LEU -3.15 -0.73 1 94 PHE -3.22 -2.00 1 95 ILE -4.91 -2.22 1 96 PHE -4.41 -1.95 1 97 SER -0.46 -2.04 1 100 VAL 3.12 0.77 1 103 LYS 1.47 2.05 1 105 GLU 4.47 2.67 1 106 GLN 2.89 2.17 1 107 GLN 6.35 2.71 1 108 MET 3.65 2.88 1 109 MET 3.48 2.56 1 110 TYR 4.77 2.21 1 111 ALA 4.60 3.34 1 113 SER 1.04 -1.33 1 114 LYS 4.52 -0.27 1 115 ASN 5.07 2.46 1 116 ARG 3.85 2.77 1 117 LEU 3.48 0.01 1 118 VAL 6.18 1.78 1 119 GLN 3.71 3.68 1 120 THR 5.76 0.23 1 121 ALA 0.20 -3.05 1 122 GLU 3.84 -1.28 1 123 LEU -2.31 -0.82 1 124 THR -0.16 0.24 1 125 LYS 0.21 -3.35 1 126 VAL -2.45 -1.70 1 127 PHE -6.37 -1.24 1 128 GLU -4.28 -1.36 1 129 ILE -3.64 -1.67 1 130 ARG -0.29 -0.85 1 131 THR -1.83 0.61 1 132 THR 5.20 0.78 1 133 ASP 2.31 0.32 1 134 ASP 1.46 -0.69 1 136 THR -6.82 0.20 1 137 GLU 4.58 1.06 1 138 THR 5.92 1.23 1 139 TRP 3.69 1.61 1 140 LEU 2.55 0.68 1 141 LYS 5.50 2.43 1 142 GLU 3.61 3.17 1 143 LYS 3.90 3.21 1 144 LEU 1.76 0.40 1 145 ALA 0.95 0.59 1 146 SER 0.24 0.08 1 149 SER -0.02 0.13 1 150 SER -0.05 -0.61 1 stop_ save_