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 bmr17524_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.50 _LACS_plot.Line_1_terminator_val_y_1 -1.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.77 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 6.93 _LACS_plot.Y_axis_chem_shift_offset 0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 MET 4.02 -0.09 0 139 GLN 4.77 0.41 0 141 GLU -4.50 -1.46 0 11 MET -0.46 -0.67 1 12 ASP 0.19 0.45 1 13 THR -0.37 -0.87 1 15 GLU 4.03 2.80 1 16 ASN 2.58 2.01 1 17 VAL 5.68 3.91 1 18 LEU 4.05 2.36 1 19 GLN 4.76 3.17 1 20 MET 3.96 3.00 1 21 LEU 4.57 2.36 1 22 GLU 4.17 3.15 1 23 ALA 3.78 2.19 1 24 HIS 3.03 4.42 1 26 GLN 3.71 2.42 1 27 SER -0.68 -0.39 1 28 TYR 1.26 0.92 1 29 LYS -1.77 -2.25 1 32 ASP -0.91 -0.98 1 34 LEU 4.30 2.57 1 36 GLU 1.07 0.96 1 37 TRP 6.39 4.52 1 38 GLU 2.56 2.83 1 39 ARG 4.27 3.10 1 40 TYR 4.07 4.15 1 41 ILE 6.26 4.97 1 42 GLN 4.65 2.98 1 43 TRP 6.14 4.32 1 44 VAL 5.82 4.22 1 45 GLU 3.14 3.13 1 46 GLU 1.02 1.17 1 47 ASN 1.15 1.77 1 48 PHE 0.07 -0.64 1 50 GLU 0.10 -0.73 1 51 ASN -0.95 -0.76 1 52 LYS 3.23 1.62 1 53 GLU 4.39 2.72 1 54 TYR 3.76 2.75 1 55 LEU 3.24 2.52 1 56 ILE 6.02 4.98 1 57 THR 5.79 4.67 1 58 LEU 3.99 3.40 1 59 LEU 3.38 2.51 1 60 GLU 3.22 2.73 1 61 HIS 5.48 5.77 1 62 LEU 4.26 3.23 1 63 MET 3.67 2.60 1 64 LYS 3.72 2.93 1 65 GLU 1.92 0.90 1 66 PHE 1.25 1.20 1 67 LEU 4.46 3.98 1 68 ASP -0.90 -1.54 1 69 LYS -0.17 -2.33 1 70 LYS 3.57 1.94 1 71 LYS 3.32 1.91 1 72 TYR 1.03 0.66 1 73 HIS 1.39 3.53 1 74 ASN -1.51 -0.67 1 75 ASP -3.19 -0.65 1 77 ARG 2.67 1.89 1 78 PHE 3.25 2.70 1 79 ILE 5.25 2.96 1 80 SER 5.34 3.83 1 81 TYR 5.40 3.73 1 83 LEU 4.98 2.48 1 84 LYS 2.95 2.40 1 85 PHE 1.31 0.48 1 86 ALA 3.04 2.24 1 87 GLU 2.26 1.38 1 88 TYR 0.16 -0.83 1 89 ASN -2.11 -0.50 1 90 SER 2.03 1.43 1 91 ASP -0.98 -1.44 1 92 LEU 5.26 3.07 1 93 HIS 3.15 5.03 1 94 GLN 3.77 2.49 1 95 PHE 3.73 3.28 1 96 PHE 7.58 3.68 1 97 GLU 3.69 2.99 1 98 PHE 5.03 3.31 1 99 LEU 5.22 2.94 1 100 TYR 3.25 3.81 1 101 ASN 3.08 1.63 1 102 HIS 2.33 2.38 1 104 ILE 1.82 0.21 1 106 THR 3.45 1.93 1 107 LEU -0.30 -1.40 1 108 SER -1.74 -1.76 1 109 SER 9.27 7.59 1 111 LEU 4.92 4.14 1 112 TYR 4.64 3.88 1 113 ILE 4.17 2.76 1 114 ALA 2.49 2.11 1 115 TRP -1.07 0.10 1 116 ALA 3.38 2.58 1 118 HIS 3.70 4.63 1 119 LEU 3.76 2.67 1 120 GLU 4.13 3.24 1 121 ALA 3.55 1.95 1 122 GLN -0.37 -0.92 1 124 GLU -0.61 -2.98 1 125 LEU 4.31 3.18 1 126 GLN 5.54 3.18 1 127 HIS 0.80 2.27 1 128 ALA 3.70 2.95 1 129 SER 3.80 3.09 1 130 ALA 3.42 2.15 1 131 VAL 7.01 4.85 1 132 LEU 3.73 3.15 1 133 GLN 4.22 3.09 1 134 ARG 3.68 2.39 1 136 ILE 4.79 3.54 1 137 GLN 4.14 2.64 1 138 ASN 0.41 -0.27 1 140 ALA 0.56 0.17 1 143 ARG 3.88 3.42 1 145 PHE 2.10 1.46 1 146 LEU 3.59 2.65 1 147 GLN 4.91 3.59 1 148 GLN 4.59 3.04 1 149 GLN 4.17 2.17 1 150 TYR 3.81 3.13 1 151 ARG 4.66 3.22 1 152 LEU 3.56 2.51 1 153 PHE 4.33 2.97 1 154 GLN 3.57 2.75 1 155 THR 4.44 3.39 1 156 ARG 2.85 2.08 1 157 LEU 1.14 0.76 1 158 THR 0.28 0.15 1 159 GLU -0.38 -0.26 1 160 THR 0.34 1.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17524_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.50 _LACS_plot.Line_1_terminator_val_y_1 2.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 -2.34 _LACS_plot.Y_axis_chem_shift_offset 0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 MET 4.02 -4.11 0 139 GLN 4.77 -4.36 0 141 GLU -4.50 3.04 0 11 MET -0.46 -0.21 1 12 ASP 0.19 0.26 1 13 THR -0.37 -0.50 1 15 GLU 4.03 -1.23 1 16 ASN 2.58 -0.57 1 17 VAL 5.68 -1.77 1 18 LEU 4.05 -1.69 1 19 GLN 4.76 -1.59 1 20 MET 3.96 -0.96 1 21 LEU 4.57 -2.21 1 22 GLU 4.17 -1.02 1 23 ALA 3.78 -1.59 1 24 HIS 3.03 1.39 1 26 GLN 3.71 -1.29 1 27 SER -0.68 0.29 1 28 TYR 1.26 -0.34 1 29 LYS -1.77 -0.48 1 32 ASP -0.91 -0.07 1 34 LEU 4.30 -1.73 1 36 GLU 1.07 -0.11 1 37 TRP 6.39 -1.87 1 38 GLU 2.56 0.27 1 39 ARG 4.27 -1.17 1 40 TYR 4.07 0.08 1 41 ILE 6.26 -1.29 1 42 GLN 4.65 -1.67 1 43 TRP 6.14 -1.82 1 44 VAL 5.82 -1.60 1 45 GLU 3.14 -0.01 1 46 GLU 1.02 0.15 1 47 ASN 1.15 0.62 1 48 PHE 0.07 -0.71 1 50 GLU 0.10 -0.83 1 51 ASN -0.95 0.19 1 52 LYS 3.23 -1.61 1 53 GLU 4.39 -1.67 1 54 TYR 3.76 -1.01 1 55 LEU 3.24 -0.72 1 56 ILE 6.02 -1.04 1 57 THR 5.79 -1.12 1 58 LEU 3.99 -0.59 1 59 LEU 3.38 -0.87 1 60 GLU 3.22 -0.49 1 61 HIS 5.48 0.29 1 62 LEU 4.26 -1.03 1 63 MET 3.67 -1.07 1 64 LYS 3.72 -0.79 1 65 GLU 1.92 -1.02 1 66 PHE 1.25 -0.05 1 67 LEU 4.46 -0.48 1 68 ASP -0.90 -0.64 1 69 LYS -0.17 -2.16 1 70 LYS 3.57 -1.63 1 71 LYS 3.32 -1.41 1 72 TYR 1.03 -0.37 1 73 HIS 1.39 2.14 1 74 ASN -1.51 0.84 1 75 ASP -3.19 2.54 1 77 ARG 2.67 -0.78 1 78 PHE 3.25 -0.55 1 79 ILE 5.25 -2.29 1 80 SER 5.34 -1.51 1 81 TYR 5.40 -1.67 1 83 LEU 4.98 -2.50 1 84 LYS 2.95 -0.55 1 85 PHE 1.31 -0.83 1 86 ALA 3.04 -0.80 1 87 GLU 2.26 -0.88 1 88 TYR 0.16 -0.99 1 89 ASN -2.11 1.61 1 90 SER 2.03 -0.60 1 91 ASP -0.98 -0.46 1 92 LEU 5.26 -2.19 1 93 HIS 3.15 1.88 1 94 GLN 3.77 -1.28 1 95 PHE 3.73 -0.45 1 96 PHE 7.58 -3.90 1 97 GLU 3.69 -0.70 1 98 PHE 5.03 -1.72 1 99 LEU 5.22 -2.28 1 100 TYR 3.25 0.56 1 101 ASN 3.08 -1.45 1 102 HIS 2.33 0.05 1 104 ILE 1.82 -1.61 1 106 THR 3.45 -1.52 1 107 LEU -0.30 -1.10 1 108 SER -1.74 -0.02 1 109 SER 9.27 -1.68 1 111 LEU 4.92 -0.78 1 112 TYR 4.64 -0.76 1 113 ILE 4.17 -1.41 1 114 ALA 2.49 -0.38 1 115 TRP -1.07 1.17 1 116 ALA 3.38 -0.80 1 118 HIS 3.70 0.93 1 119 LEU 3.76 -1.09 1 120 GLU 4.13 -0.89 1 121 ALA 3.55 -1.60 1 122 GLN -0.37 -0.55 1 124 GLU -0.61 -2.37 1 125 LEU 4.31 -1.13 1 126 GLN 5.54 -2.36 1 127 HIS 0.80 1.47 1 128 ALA 3.70 -0.75 1 129 SER 3.80 -0.71 1 130 ALA 3.42 -1.27 1 131 VAL 7.01 -2.16 1 132 LEU 3.73 -0.58 1 133 GLN 4.22 -1.13 1 134 ARG 3.68 -1.29 1 136 ILE 4.79 -1.25 1 137 GLN 4.14 -1.50 1 138 ASN 0.41 -0.68 1 140 ALA 0.56 -0.39 1 143 ARG 3.88 -0.46 1 145 PHE 2.10 -0.64 1 146 LEU 3.59 -0.94 1 147 GLN 4.91 -1.32 1 148 GLN 4.59 -1.55 1 149 GLN 4.17 -2.00 1 150 TYR 3.81 -0.68 1 151 ARG 4.66 -1.44 1 152 LEU 3.56 -1.05 1 153 PHE 4.33 -1.36 1 154 GLN 3.57 -0.82 1 155 THR 4.44 -1.05 1 156 ARG 2.85 -0.77 1 157 LEU 1.14 -0.38 1 158 THR 0.28 -0.13 1 159 GLU -0.38 0.12 1 160 THR 0.34 0.74 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17524_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.50 _LACS_plot.Line_1_terminator_val_y_1 0.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 -0.95 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 70 LYS 3.57 -2.02 0 11 MET -0.46 -0.01 1 12 ASP 0.19 0.15 1 13 THR -0.37 0.08 1 15 GLU 4.03 -0.50 1 16 ASN 2.58 -0.16 1 17 VAL 5.68 -0.37 1 18 LEU 4.05 -0.55 1 19 GLN 4.76 -0.39 1 20 MET 3.96 -0.42 1 21 LEU 4.57 -1.10 1 22 GLU 4.17 -0.66 1 23 ALA 3.78 -0.25 1 24 HIS 3.03 -0.52 1 25 MET 4.02 -0.03 1 26 GLN 3.71 -0.19 1 27 SER -0.68 0.06 1 28 TYR 1.26 -0.22 1 29 LYS -1.77 0.11 1 32 ASP -0.91 0.70 1 34 LEU 4.30 -0.55 1 36 GLU 1.07 -0.26 1 37 TRP 6.39 -0.69 1 38 GLU 2.56 -0.22 1 39 ARG 4.27 -0.26 1 40 TYR 4.07 -0.37 1 41 ILE 6.26 -0.60 1 42 GLN 4.65 -0.14 1 43 TRP 6.14 -0.45 1 44 VAL 5.82 -0.62 1 45 GLU 3.14 -0.46 1 46 GLU 1.02 -0.37 1 47 ASN 1.15 -0.64 1 48 PHE 0.07 0.11 1 50 GLU 0.10 0.05 1 51 ASN -0.95 0.30 1 52 LYS 3.23 -0.17 1 53 GLU 4.39 -0.37 1 54 TYR 3.76 -0.53 1 55 LEU 3.24 -0.32 1 56 ILE 6.02 -0.88 1 57 THR 5.79 -0.19 1 58 LEU 3.99 -0.19 1 59 LEU 3.38 -0.47 1 60 GLU 3.22 -1.03 1 61 HIS 5.48 -0.60 1 62 LEU 4.26 -1.43 1 63 MET 3.67 -0.32 1 64 LYS 3.72 -0.45 1 65 GLU 1.92 -0.39 1 66 PHE 1.25 -0.30 1 67 LEU 4.46 -0.39 1 68 ASP -0.90 0.29 1 69 LYS -0.17 0.17 1 71 LYS 3.32 -0.32 1 72 TYR 1.03 0.24 1 73 HIS 1.39 -0.22 1 74 ASN -1.51 0.48 1 75 ASP -3.19 0.17 1 77 ARG 2.67 -0.26 1 78 PHE 3.25 -0.26 1 79 ILE 5.25 -0.83 1 80 SER 5.34 -0.42 1 81 TYR 5.40 -0.08 1 83 LEU 4.98 -0.26 1 84 LYS 2.95 -0.16 1 85 PHE 1.31 -0.19 1 86 ALA 3.04 -1.52 1 87 GLU 2.26 -0.59 1 88 TYR 0.16 -0.14 1 89 ASN -2.11 -0.33 1 90 SER 2.03 -0.28 1 91 ASP -0.98 0.17 1 92 LEU 5.26 -0.67 1 93 HIS 3.15 -0.21 1 94 GLN 3.77 -0.41 1 95 PHE 3.73 -0.47 1 96 PHE 7.58 -1.18 1 97 GLU 3.69 -0.72 1 98 PHE 5.03 -0.34 1 99 LEU 5.22 -0.91 1 100 TYR 3.25 -0.80 1 101 ASN 3.08 -0.44 1 102 HIS 2.33 -0.48 1 104 ILE 1.82 -0.24 1 106 THR 3.45 -0.25 1 107 LEU -0.30 0.45 1 108 SER -1.74 0.84 1 109 SER 9.27 -0.38 1 111 LEU 4.92 -0.38 1 112 TYR 4.64 -0.62 1 113 ILE 4.17 -0.57 1 114 ALA 2.49 -0.15 1 115 TRP -1.07 -0.87 1 116 ALA 3.38 -0.52 1 118 HIS 3.70 -0.17 1 119 LEU 3.76 -0.50 1 120 GLU 4.13 -0.77 1 121 ALA 3.55 -0.15 1 122 GLN -0.37 0.03 1 124 GLU -0.61 0.33 1 125 LEU 4.31 -0.48 1 126 GLN 5.54 -0.25 1 127 HIS 0.80 -0.23 1 128 ALA 3.70 -0.70 1 129 SER 3.80 -0.70 1 130 ALA 3.42 -0.30 1 131 VAL 7.01 -1.07 1 132 LEU 3.73 -0.63 1 133 GLN 4.22 -0.89 1 134 ARG 3.68 -0.41 1 136 ILE 4.79 -0.62 1 137 GLN 4.14 -0.40 1 138 ASN 0.41 -0.11 1 139 GLN 4.77 -0.50 1 140 ALA 0.56 -0.37 1 141 GLU -4.50 0.28 1 143 ARG 3.88 -0.14 1 145 PHE 2.10 -0.05 1 146 LEU 3.59 -0.50 1 147 GLN 4.91 -0.40 1 148 GLN 4.59 -0.27 1 149 GLN 4.17 -0.39 1 150 TYR 3.81 -0.31 1 151 ARG 4.66 -0.43 1 152 LEU 3.56 -0.30 1 153 PHE 4.33 -0.61 1 154 GLN 3.57 -0.65 1 155 THR 4.44 -0.34 1 156 ARG 2.85 -0.21 1 157 LEU 1.14 -0.24 1 158 THR 0.28 -0.04 1 159 GLU -0.38 0.02 1 160 THR 0.34 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17524_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.77 _LACS_plot.Line_1_terminator_val_y_1 -0.79 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.69 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 2.87 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 127 HIS 0.80 3.21 0 115 TRP -1.07 2.04 0 24 HIS 3.03 4.57 0 139 GLN 4.77 -1.51 0 11 MET -0.46 -0.73 1 12 ASP 0.19 -0.42 1 15 GLU 4.03 1.55 1 16 ASN 2.58 2.30 1 17 VAL 5.68 1.29 1 18 LEU 4.05 0.62 1 19 GLN 4.76 2.99 1 20 MET 3.96 2.18 1 21 LEU 4.57 0.47 1 22 GLU 4.17 2.70 1 23 ALA 3.78 2.68 1 25 MET 4.02 3.39 1 26 GLN 3.71 1.21 1 27 SER -0.68 -1.24 1 29 LYS -1.77 -0.50 1 34 LEU 4.30 0.28 1 36 GLU 1.07 2.25 1 37 TRP 6.39 2.14 1 38 GLU 2.56 0.94 1 39 ARG 4.27 2.85 1 40 TYR 4.07 1.55 1 41 ILE 6.26 1.17 1 42 GLN 4.65 2.31 1 43 TRP 6.14 3.20 1 44 VAL 5.82 1.49 1 45 GLU 3.14 1.83 1 46 GLU 1.02 1.16 1 47 ASN 1.15 -1.38 1 50 GLU 0.10 -0.59 1 51 ASN -0.95 0.39 1 52 LYS 3.23 0.20 1 53 GLU 4.39 2.60 1 54 TYR 3.76 0.95 1 55 LEU 3.24 0.50 1 56 ILE 6.02 1.02 1 57 THR 5.79 2.27 1 58 LEU 3.99 0.84 1 59 LEU 3.38 0.47 1 60 GLU 3.22 2.72 1 61 HIS 5.48 2.39 1 62 LEU 4.26 0.98 1 63 MET 3.67 1.41 1 64 LYS 3.72 2.19 1 65 GLU 1.92 0.68 1 66 PHE 1.25 1.02 1 67 LEU 4.46 0.07 1 68 ASP -0.90 -0.10 1 69 LYS -0.17 -2.03 1 71 LYS 3.32 0.75 1 72 TYR 1.03 0.51 1 73 HIS 1.39 0.68 1 74 ASN -1.51 -0.76 1 77 ARG 2.67 2.42 1 78 PHE 3.25 1.89 1 79 ILE 5.25 1.12 1 80 SER 5.34 2.99 1 81 TYR 5.40 2.05 1 83 LEU 4.98 2.03 1 84 LYS 2.95 1.69 1 85 PHE 1.31 1.51 1 86 ALA 3.04 0.00 1 87 GLU 2.26 0.12 1 88 TYR 0.16 -1.02 1 90 SER 2.03 -0.38 1 91 ASP -0.98 -0.24 1 92 LEU 5.26 0.11 1 93 HIS 3.15 2.44 1 94 GLN 3.77 2.12 1 95 PHE 3.73 0.35 1 96 PHE 7.58 1.12 1 97 GLU 3.69 1.19 1 98 PHE 5.03 2.51 1 99 LEU 5.22 0.90 1 100 TYR 3.25 3.95 1 101 ASN 3.08 1.55 1 102 HIS 2.33 -0.07 1 104 ILE 1.82 -1.74 1 106 THR 3.45 2.53 1 107 LEU -0.30 -0.34 1 108 SER -1.74 -0.91 1 111 LEU 4.92 -0.63 1 112 TYR 4.64 1.57 1 113 ILE 4.17 2.45 1 114 ALA 2.49 1.72 1 116 ALA 3.38 1.84 1 118 HIS 3.70 3.18 1 119 LEU 3.76 1.65 1 120 GLU 4.13 3.08 1 121 ALA 3.55 1.36 1 122 GLN -0.37 0.05 1 124 GLU -0.61 -0.09 1 125 LEU 4.31 1.51 1 128 ALA 3.70 0.56 1 129 SER 3.80 1.48 1 130 ALA 3.42 3.06 1 131 VAL 7.01 1.34 1 132 LEU 3.73 0.93 1 133 GLN 4.22 2.10 1 134 ARG 3.68 1.73 1 136 ILE 4.79 3.77 1 137 GLN 4.14 1.74 1 138 ASN 0.41 -1.46 1 140 ALA 0.56 -1.96 1 145 PHE 2.10 1.70 1 146 LEU 3.59 0.57 1 147 GLN 4.91 2.60 1 148 GLN 4.59 2.60 1 149 GLN 4.17 2.34 1 150 TYR 3.81 0.80 1 151 ARG 4.66 3.07 1 152 LEU 3.56 1.89 1 153 PHE 4.33 1.41 1 154 GLN 3.57 2.99 1 155 THR 4.44 1.14 1 156 ARG 2.85 1.25 1 157 LEU 1.14 0.04 1 158 THR 0.28 -0.35 1 159 GLU -0.38 -0.93 1 stop_ save_