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 bmr34248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.62 _LACS_plot.Line_1_terminator_val_y_1 -3.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.03 _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 9.97 _LACS_plot.Line_2_terminator_val_y_2 7.31 _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 MET -2.83 1.30 0 113 ILE 3.95 -0.08 0 63 SER 5.64 7.14 0 127 LEU 4.99 0.46 0 10 ILE -0.78 -0.34 1 11 ASP -0.24 -0.29 1 12 GLU 1.06 0.88 1 13 THR 0.35 0.25 1 14 ALA -0.10 -0.04 1 15 PHE -4.11 -1.36 1 16 VAL -3.84 -2.11 1 17 GLN -5.83 -2.34 1 18 ALA -0.73 -0.27 1 19 GLU -1.67 -0.30 1 20 GLN 3.25 2.18 1 22 LYS -1.71 -1.27 1 23 THR 1.08 0.51 1 24 ASN -0.98 -0.49 1 25 LEU -0.66 0.27 1 26 MET 0.78 1.59 1 27 PHE 2.57 1.41 1 28 SER 1.75 1.47 1 29 ASP -2.73 -0.93 1 30 GLU 3.31 3.22 1 31 LYS 4.58 2.91 1 32 GLN 2.75 3.27 1 33 GLN 5.20 2.75 1 34 ALA 3.38 2.69 1 35 ARG 5.17 3.86 1 36 PHE 4.94 3.79 1 37 GLU 5.25 4.03 1 38 LEU 2.95 2.06 1 40 VAL 7.67 5.63 1 41 SER 3.97 3.40 1 43 VAL 6.18 4.76 1 44 ILE 5.97 2.34 1 45 TYR 5.15 4.74 1 46 LYS 1.82 0.63 1 47 TRP -2.07 -2.87 1 48 ASP 4.92 4.37 1 49 ALA 3.54 2.19 1 50 LEU 1.82 0.45 1 51 ASP 2.44 4.34 1 52 VAL 4.53 3.61 1 53 ALA 1.77 1.88 1 54 VAL 5.95 4.67 1 55 GLU 3.07 2.47 1 56 ASN 0.38 0.00 1 57 SER 3.60 0.65 1 58 TRP 0.83 -0.10 1 62 ASP 0.53 -0.47 1 64 ALA 5.48 3.69 1 65 GLU 2.22 3.45 1 66 LYS 2.61 3.74 1 67 ARG 5.66 3.88 1 68 ASP 3.83 2.80 1 69 TRP 4.34 3.56 1 70 ILE 7.66 4.99 1 71 THR 8.20 5.47 1 73 ILE 5.72 3.68 1 74 VAL 6.69 4.73 1 75 VAL 6.93 5.65 1 76 ASP 3.75 3.19 1 77 LEU 3.47 3.38 1 78 PHE 3.11 2.50 1 79 LYS 2.73 2.70 1 80 ASN -1.95 0.84 1 81 GLU -4.02 -2.06 1 82 LYS -0.01 0.69 1 83 VAL -3.41 -1.28 1 84 VAL -2.34 -0.15 1 85 ASP -6.62 -3.54 1 86 ALA 3.87 2.86 1 87 ALA 3.79 2.63 1 88 LEU 3.11 2.71 1 89 ILE 5.71 4.99 1 90 GLU 3.96 3.81 1 91 GLU 3.07 3.24 1 92 THR 6.60 5.55 1 93 LEU 4.19 3.20 1 94 LEU 4.09 3.20 1 95 TYR 4.65 2.99 1 96 ALA 3.73 3.52 1 97 MET 4.88 2.42 1 98 ILE 3.77 4.36 1 99 ASP 3.82 3.60 1 100 GLU -1.46 -1.36 1 101 PHE -0.19 0.42 1 102 GLU 2.51 0.72 1 103 THR -1.89 0.54 1 104 ASN -1.50 -1.31 1 105 VAL 2.78 1.28 1 106 GLU -1.60 -0.44 1 107 ASP -0.73 -0.82 1 108 ASP 3.29 1.82 1 109 SER 2.52 2.44 1 110 ALA 1.04 1.23 1 111 LEU 9.97 6.43 1 114 ALA 2.29 3.32 1 115 VAL 5.55 4.74 1 116 GLU 3.28 2.61 1 117 VAL 7.95 6.00 1 118 ILE 5.94 3.21 1 119 ASN 4.65 3.36 1 120 ILE 4.47 2.20 1 121 TYR 7.80 6.10 1 122 ASN 4.08 3.37 1 123 ASP 5.93 3.93 1 125 PHE 4.18 3.83 1 126 ASN -0.19 0.32 1 128 ASN -1.38 -2.12 1 129 TYR -1.17 -2.24 1 130 ASN 4.57 4.31 1 131 LYS 4.59 3.24 1 132 VAL 6.54 5.70 1 133 GLU 3.68 3.45 1 134 LYS 3.75 3.48 1 135 LEU 2.38 2.56 1 136 TYR 2.46 2.08 1 137 LEU 4.17 3.40 1 138 GLU 3.19 2.92 1 139 TRP 4.14 4.69 1 140 GLN 3.46 3.85 1 141 GLU 3.24 2.34 1 142 LYS 4.11 3.06 1 143 GLN 3.16 1.62 1 144 ARG 3.24 2.80 1 145 THR 1.76 1.41 1 146 LYS 1.74 1.32 1 147 LYS 0.81 0.55 1 148 SER 0.26 0.33 1 149 LYS 0.49 0.30 1 150 ARG 0.23 0.18 1 151 VAL -0.00 0.03 1 152 VAL 0.12 0.11 1 153 HIS -0.76 0.85 1 154 ILE -0.31 -0.19 1 155 GLU -0.70 -0.10 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.62 _LACS_plot.Line_1_terminator_val_y_1 3.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.97 _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 9.97 _LACS_plot.Line_2_terminator_val_y_2 -2.66 _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 MET -2.83 4.13 0 113 ILE 3.95 -4.03 0 63 SER 5.64 1.50 0 127 LEU 4.99 -4.53 0 10 ILE -0.78 0.44 1 11 ASP -0.24 -0.05 1 12 GLU 1.06 -0.18 1 13 THR 0.35 -0.10 1 14 ALA -0.10 0.06 1 15 PHE -4.11 2.75 1 16 VAL -3.84 1.73 1 17 GLN -5.83 3.49 1 18 ALA -0.73 0.46 1 19 GLU -1.67 1.37 1 20 GLN 3.25 -1.07 1 22 LYS -1.71 0.44 1 23 THR 1.08 -0.57 1 24 ASN -0.98 0.49 1 25 LEU -0.66 0.93 1 26 MET 0.78 0.81 1 27 PHE 2.57 -1.16 1 28 SER 1.75 -0.28 1 29 ASP -2.73 1.80 1 30 GLU 3.31 -0.09 1 31 LYS 4.58 -1.67 1 32 GLN 2.75 0.52 1 33 GLN 5.20 -2.45 1 34 ALA 3.38 -0.69 1 35 ARG 5.17 -1.31 1 36 PHE 4.94 -1.15 1 37 GLU 5.25 -1.22 1 38 LEU 2.95 -0.89 1 40 VAL 7.67 -2.04 1 41 SER 3.97 -0.57 1 43 VAL 6.18 -1.42 1 44 ILE 5.97 -3.63 1 45 TYR 5.15 -0.41 1 46 LYS 1.82 -1.19 1 47 TRP -2.07 -0.80 1 48 ASP 4.92 -0.55 1 49 ALA 3.54 -1.35 1 50 LEU 1.82 -1.37 1 51 ASP 2.44 1.90 1 52 VAL 4.53 -0.92 1 53 ALA 1.77 0.11 1 54 VAL 5.95 -1.28 1 55 GLU 3.07 -0.60 1 56 ASN 0.38 -0.38 1 57 SER 3.60 -2.95 1 58 TRP 0.83 -0.93 1 62 ASP 0.53 -1.00 1 64 ALA 5.48 -1.79 1 65 GLU 2.22 1.23 1 66 LYS 2.61 1.13 1 67 ARG 5.66 -1.78 1 68 ASP 3.83 -1.03 1 69 TRP 4.34 -0.78 1 70 ILE 7.66 -2.67 1 71 THR 8.20 -2.73 1 73 ILE 5.72 -2.04 1 74 VAL 6.69 -1.96 1 75 VAL 6.93 -1.28 1 76 ASP 3.75 -0.56 1 77 LEU 3.47 -0.09 1 78 PHE 3.11 -0.61 1 79 LYS 2.73 -0.03 1 80 ASN -1.95 2.79 1 81 GLU -4.02 1.96 1 82 LYS -0.01 0.70 1 83 VAL -3.41 2.13 1 84 VAL -2.34 2.19 1 85 ASP -6.62 3.08 1 86 ALA 3.87 -1.01 1 87 ALA 3.79 -1.16 1 88 LEU 3.11 -0.40 1 89 ILE 5.71 -0.72 1 90 GLU 3.96 -0.15 1 91 GLU 3.07 0.17 1 92 THR 6.60 -1.05 1 93 LEU 4.19 -0.99 1 94 LEU 4.09 -0.89 1 95 TYR 4.65 -1.66 1 96 ALA 3.73 -0.21 1 97 MET 4.88 -2.46 1 98 ILE 3.77 0.59 1 99 ASP 3.82 -0.22 1 100 GLU -1.46 0.10 1 101 PHE -0.19 0.61 1 102 GLU 2.51 -1.79 1 103 THR -1.89 2.43 1 104 ASN -1.50 0.19 1 105 VAL 2.78 -1.50 1 106 GLU -1.60 1.16 1 107 ASP -0.73 -0.09 1 108 ASP 3.29 -1.47 1 109 SER 2.52 -0.08 1 110 ALA 1.04 0.19 1 111 LEU 9.97 -3.54 1 114 ALA 2.29 1.03 1 115 VAL 5.55 -0.81 1 116 GLU 3.28 -0.67 1 117 VAL 7.95 -1.95 1 118 ILE 5.94 -2.73 1 119 ASN 4.65 -1.29 1 120 ILE 4.47 -2.27 1 121 TYR 7.80 -1.70 1 122 ASN 4.08 -0.71 1 123 ASP 5.93 -2.00 1 125 PHE 4.18 -0.35 1 126 ASN -0.19 0.51 1 128 ASN -1.38 -0.74 1 129 TYR -1.17 -1.07 1 130 ASN 4.57 -0.26 1 131 LYS 4.59 -1.35 1 132 VAL 6.54 -0.84 1 133 GLU 3.68 -0.23 1 134 LYS 3.75 -0.27 1 135 LEU 2.38 0.18 1 136 TYR 2.46 -0.38 1 137 LEU 4.17 -0.77 1 138 GLU 3.19 -0.27 1 139 TRP 4.14 0.55 1 140 GLN 3.46 0.39 1 141 GLU 3.24 -0.90 1 142 LYS 4.11 -1.05 1 143 GLN 3.16 -1.54 1 144 ARG 3.24 -0.44 1 145 THR 1.76 -0.35 1 146 LYS 1.74 -0.42 1 147 LYS 0.81 -0.26 1 148 SER 0.26 0.07 1 149 LYS 0.49 -0.19 1 150 ARG 0.23 -0.05 1 151 VAL -0.00 0.03 1 152 VAL 0.12 -0.01 1 153 HIS -0.76 1.61 1 154 ILE -0.31 0.12 1 155 GLU -0.70 0.60 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34248_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.62 _LACS_plot.Line_1_terminator_val_y_1 0.49 _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 0.11 _LACS_plot.Line_2_terminator_val_x_2 9.97 _LACS_plot.Line_2_terminator_val_y_2 -0.79 _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 85 ASP -6.62 0.68 0 17 GLN -5.83 0.90 0 71 THR 8.20 0.16 0 10 ILE -0.78 -0.07 1 11 ASP -0.24 -0.06 1 12 GLU 1.06 -0.18 1 13 THR 0.35 0.06 1 14 ALA -0.10 0.06 1 15 PHE -4.11 0.66 1 16 VAL -3.84 0.17 1 18 ALA -0.73 -0.18 1 19 GLU -1.67 -0.14 1 20 GLN 3.25 -0.28 1 22 LYS -1.71 0.38 1 23 THR 1.08 -0.17 1 24 ASN -0.98 -0.20 1 25 LEU -0.66 -0.06 1 26 MET 0.78 -0.42 1 27 PHE 2.57 0.07 1 28 SER 1.75 -0.14 1 29 ASP -2.73 0.15 1 30 GLU 3.31 -0.29 1 31 LYS 4.58 -0.27 1 32 GLN 2.75 -0.59 1 33 GLN 5.20 0.04 1 34 ALA 3.38 -0.23 1 35 ARG 5.17 -0.77 1 36 PHE 4.94 -0.17 1 37 GLU 5.25 -1.16 1 38 LEU 2.95 -0.65 1 40 VAL 7.67 -0.95 1 41 SER 3.97 -0.27 1 42 MET -2.83 -0.24 1 43 VAL 6.18 -0.51 1 44 ILE 5.97 -0.32 1 45 TYR 5.15 -0.37 1 46 LYS 1.82 0.16 1 47 TRP -2.07 0.43 1 48 ASP 4.92 -0.29 1 49 ALA 3.54 -0.57 1 50 LEU 1.82 -0.94 1 51 ASP 2.44 -0.55 1 52 VAL 4.53 -0.81 1 53 ALA 1.77 -0.98 1 54 VAL 5.95 -0.51 1 55 GLU 3.07 -0.47 1 56 ASN 0.38 -0.16 1 57 SER 3.60 -0.22 1 58 TRP 0.83 0.22 1 62 ASP 0.53 0.53 1 63 SER 5.64 -0.83 1 64 ALA 5.48 -0.20 1 65 GLU 2.22 0.05 1 66 LYS 2.61 -0.14 1 67 ARG 5.66 -0.04 1 68 ASP 3.83 0.40 1 69 TRP 4.34 0.03 1 70 ILE 7.66 -1.05 1 73 ILE 5.72 -0.01 1 74 VAL 6.69 -0.35 1 75 VAL 6.93 -0.34 1 76 ASP 3.75 -0.17 1 77 LEU 3.47 -0.26 1 78 PHE 3.11 -0.77 1 79 LYS 2.73 -0.37 1 80 ASN -1.95 0.16 1 81 GLU -4.02 0.35 1 82 LYS -0.01 -0.38 1 83 VAL -3.41 0.64 1 84 VAL -2.34 -0.25 1 86 ALA 3.87 -0.52 1 87 ALA 3.79 -0.20 1 88 LEU 3.11 -0.06 1 89 ILE 5.71 -0.78 1 90 GLU 3.96 -0.88 1 91 GLU 3.07 -0.50 1 92 THR 6.60 -0.33 1 93 LEU 4.19 -0.36 1 94 LEU 4.09 -0.11 1 95 TYR 4.65 0.08 1 96 ALA 3.73 0.47 1 97 MET 4.88 0.26 1 98 ILE 3.77 -0.49 1 99 ASP 3.82 -0.19 1 100 GLU -1.46 0.67 1 101 PHE -0.19 -0.04 1 102 GLU 2.51 -0.10 1 103 THR -1.89 0.02 1 104 ASN -1.50 0.05 1 105 VAL 2.78 -0.16 1 106 GLU -1.60 0.35 1 107 ASP -0.73 0.05 1 108 ASP 3.29 0.10 1 109 SER 2.52 -0.31 1 110 ALA 1.04 -0.84 1 111 LEU 9.97 -0.57 1 113 ILE 3.95 -0.55 1 114 ALA 2.29 -0.55 1 115 VAL 5.55 -0.77 1 116 GLU 3.28 -0.03 1 117 VAL 7.95 -0.64 1 118 ILE 5.94 -0.46 1 119 ASN 4.65 -0.16 1 120 ILE 4.47 -0.09 1 121 TYR 7.80 -0.78 1 122 ASN 4.08 -0.17 1 123 ASP 5.93 -0.10 1 125 PHE 4.18 -0.82 1 126 ASN -0.19 -0.20 1 127 LEU 4.99 -1.15 1 128 ASN -1.38 -0.13 1 129 TYR -1.17 0.17 1 130 ASN 4.57 -0.38 1 131 LYS 4.59 -0.20 1 132 VAL 6.54 -0.82 1 133 GLU 3.68 -0.42 1 134 LYS 3.75 -0.23 1 135 LEU 2.38 -0.22 1 136 TYR 2.46 -0.62 1 137 LEU 4.17 -0.32 1 138 GLU 3.19 -0.33 1 139 TRP 4.14 -0.51 1 140 GLN 3.46 -0.94 1 141 GLU 3.24 -0.33 1 142 LYS 4.11 -0.36 1 143 GLN 3.16 -0.68 1 144 ARG 3.24 -0.31 1 145 THR 1.76 -0.17 1 146 LYS 1.74 -0.16 1 147 LYS 0.81 -0.07 1 148 SER 0.26 -0.06 1 149 LYS 0.49 -0.01 1 150 ARG 0.23 -0.02 1 151 VAL -0.00 -0.02 1 152 VAL 0.12 -0.02 1 153 HIS -0.76 -0.04 1 154 ILE -0.31 -0.04 1 155 GLU -0.70 -0.05 1 stop_ save_