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 bmr16598_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.96 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.02 _LACS_plot.Line_2_terminator_val_x_2 9.00 _LACS_plot.Line_2_terminator_val_y_2 6.54 _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 92 MET -7.96 -0.46 0 10 ASP 2.47 3.20 1 11 ALA 3.67 2.94 1 12 GLU 5.01 4.42 1 13 ASP 3.21 3.03 1 14 GLN 3.69 2.86 1 15 LEU -0.76 -0.27 1 17 ALA -6.86 -1.78 1 18 ARG -2.64 -0.25 1 19 VAL -2.26 -0.91 1 21 TYR -7.62 -1.20 1 22 ILE -4.41 -0.54 1 23 GLU -7.16 -2.44 1 24 LEU -6.76 -2.04 1 25 ASP -0.81 1.34 1 26 LEU 2.93 3.75 1 27 ASN 3.35 3.28 1 28 SER -1.15 0.89 1 30 LYS 0.07 0.68 1 31 ILE 2.59 1.37 1 32 LEU 0.91 0.74 1 33 GLU -5.60 -1.62 1 34 SER -3.01 0.15 1 35 PHE -1.92 2.23 1 36 ARG 5.45 3.85 1 38 GLU -1.63 -1.79 1 39 GLU -1.79 -0.42 1 40 ARG -1.99 -0.92 1 41 PHE -4.81 -2.03 1 47 PHE 1.65 1.70 1 48 LYS 5.17 3.97 1 49 VAL 4.25 4.00 1 50 LEU 3.92 2.16 1 51 LEU 2.40 2.44 1 54 ALA 4.47 2.49 1 55 VAL 5.43 4.73 1 56 LEU 4.37 2.80 1 57 SER 5.08 3.65 1 58 ARG 3.92 3.34 1 59 VAL 4.70 2.89 1 60 ASP 3.39 3.09 1 61 ALA -0.56 -0.18 1 63 GLN -0.77 -0.07 1 64 GLU -7.44 -3.67 1 65 GLN -2.91 -0.85 1 66 LEU 3.38 2.55 1 68 ARG 1.00 2.02 1 69 ARG -0.21 0.55 1 70 ILE -1.00 -0.86 1 71 HIS -1.64 0.40 1 72 TYR -1.87 -1.91 1 73 SER -4.87 -1.29 1 74 GLN 4.59 3.40 1 75 ASN 2.69 1.98 1 76 ASP -0.02 1.56 1 77 LEU 0.66 0.24 1 78 VAL -4.94 -3.37 1 79 GLU 1.00 1.33 1 80 TYR 5.29 2.62 1 81 SER -2.23 -0.59 1 83 VAL 2.13 2.37 1 84 THR 2.70 2.17 1 85 GLU 3.55 2.24 1 86 LYS 0.23 -0.31 1 87 HIS 0.51 0.24 1 88 LEU 3.50 3.12 1 89 THR 3.53 2.60 1 90 ASP 0.39 -0.25 1 93 THR -2.81 -1.63 1 94 VAL 7.11 5.97 1 95 ARG 3.75 4.20 1 96 GLU 1.66 1.84 1 97 LEU 4.21 2.94 1 99 SER 4.29 3.10 1 100 ALA 4.72 3.14 1 101 ALA 4.18 2.62 1 102 ILE 4.54 3.92 1 104 MET -2.76 -2.31 1 107 ASN 3.13 3.14 1 108 THR 9.00 6.19 1 109 ALA 3.11 2.76 1 110 ALA 1.91 2.08 1 111 ASN 4.81 2.73 1 112 LEU 2.96 2.67 1 113 LEU 1.84 2.27 1 114 LEU 3.29 3.29 1 115 THR 6.43 4.97 1 116 THR 4.74 3.66 1 117 ILE -0.14 -0.02 1 121 LYS 4.47 3.54 1 122 GLU 2.66 1.93 1 123 LEU 4.54 2.68 1 125 ASP 4.49 3.98 1 126 PHE 4.86 3.33 1 127 LEU 5.00 2.32 1 128 ARG 3.58 1.43 1 129 GLN 4.22 3.01 1 130 ILE 1.58 0.08 1 132 ASP -0.62 -1.36 1 133 LYS 0.21 0.10 1 134 GLU -2.26 1.00 1 135 THR 6.56 3.53 1 136 ARG -4.10 -1.35 1 137 LEU -5.08 -1.62 1 138 ASP -3.27 1.32 1 139 ARG -5.17 -1.10 1 140 ILE -0.78 -1.66 1 143 ASP 3.26 3.16 1 144 LEU 3.58 2.01 1 145 ASN -0.72 0.73 1 146 GLU 3.10 3.86 1 148 LYS 2.76 1.80 1 149 LEU 2.54 1.78 1 151 ASP -2.22 -1.04 1 152 LEU -0.20 0.20 1 153 ARG 1.40 1.16 1 154 ASP 0.12 1.49 1 155 THR -7.55 -2.27 1 156 THR -0.44 -1.81 1 157 THR -1.47 -2.18 1 159 LYS 3.47 3.97 1 160 ALA 3.45 3.14 1 161 ILE 7.15 4.89 1 162 ALA 2.94 3.31 1 163 SER 4.63 3.58 1 164 THR 7.39 5.04 1 165 LEU 4.15 3.16 1 166 ARG 6.88 4.88 1 167 LYS 4.15 3.72 1 168 LEU 2.66 2.66 1 169 LEU 0.35 1.33 1 170 THR -3.17 -0.82 1 172 GLU -0.22 -0.49 1 173 LEU 1.98 2.70 1 174 LEU -4.64 -2.49 1 175 THR -1.61 0.29 1 176 LEU 4.66 3.81 1 177 ALA 3.39 2.48 1 178 SER 4.07 4.57 1 179 ARG 4.16 4.20 1 180 GLN 2.89 1.88 1 181 GLN 2.08 1.29 1 182 LEU 3.98 3.14 1 183 ILE 5.02 4.55 1 184 ASP 4.50 3.38 1 185 TRP 2.85 2.13 1 186 MET 1.40 4.19 1 187 GLU 1.22 3.11 1 188 ALA -0.78 -0.74 1 197 ARG 5.46 3.81 1 198 SER 3.13 2.68 1 199 ALA -2.38 -1.84 1 200 LEU -2.35 -0.08 1 202 ALA 1.75 0.95 1 204 TRP 2.26 1.56 1 205 PHE -3.51 -0.85 1 206 ILE -2.03 -0.64 1 207 ALA -4.33 -1.86 1 208 ASP -5.33 -1.20 1 222 ALA -6.81 -1.19 1 223 ALA -3.71 -2.16 1 224 LEU -4.21 0.01 1 227 ASP 2.52 0.75 1 229 LYS -3.93 -1.90 1 231 SER -1.26 0.69 1 232 ARG -5.51 -0.16 1 233 ILE -4.00 -2.32 1 234 VAL -5.95 -2.57 1 235 VAL -4.73 -1.82 1 236 ILE -4.10 -0.96 1 237 TYR -7.15 -0.98 1 238 THR -3.28 -2.26 1 241 SER -1.20 0.64 1 242 GLN 0.39 0.04 1 243 ALA -1.71 -0.22 1 244 THR -1.27 -0.12 1 245 MET 4.63 2.64 1 246 ASP 4.01 3.57 1 247 GLU 2.15 2.34 1 248 ARG 4.48 4.76 1 249 ASN 3.85 2.21 1 250 ARG 4.10 3.32 1 251 GLN 4.28 2.63 1 253 ALA 4.84 3.46 1 254 GLU 3.15 3.06 1 255 ILE 6.22 5.49 1 257 ALA 3.99 2.71 1 258 SER 4.40 3.54 1 259 LEU 4.49 3.01 1 260 ILE 3.90 2.77 1 261 LYS 3.37 2.81 1 262 HIS 0.83 -0.16 1 263 TRP 4.03 4.88 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16598_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.96 _LACS_plot.Line_1_terminator_val_y_1 5.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.98 _LACS_plot.Line_2_terminator_val_x_2 9.00 _LACS_plot.Line_2_terminator_val_y_2 -2.46 _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 92 MET -7.96 7.50 0 10 ASP 2.47 0.73 1 11 ALA 3.67 -0.73 1 12 GLU 5.01 -0.59 1 13 ASP 3.21 -0.18 1 14 GLN 3.69 -0.83 1 15 LEU -0.76 0.49 1 17 ALA -6.86 5.08 1 18 ARG -2.64 2.39 1 19 VAL -2.26 1.35 1 21 TYR -7.62 6.42 1 22 ILE -4.41 3.87 1 23 GLU -7.16 4.72 1 24 LEU -6.76 4.72 1 25 ASP -0.81 2.15 1 26 LEU 2.93 0.82 1 27 ASN 3.35 -0.07 1 28 SER -1.15 2.04 1 30 LYS 0.07 0.61 1 31 ILE 2.59 -1.22 1 32 LEU 0.91 -0.17 1 33 GLU -5.60 3.98 1 34 SER -3.01 3.16 1 35 PHE -1.92 4.15 1 36 ARG 5.45 -1.60 1 38 GLU -1.63 -0.16 1 39 GLU -1.79 1.37 1 40 ARG -1.99 1.07 1 41 PHE -4.81 2.78 1 47 PHE 1.65 0.05 1 48 LYS 5.17 -1.20 1 49 VAL 4.25 -0.25 1 50 LEU 3.92 -1.76 1 51 LEU 2.40 0.04 1 54 ALA 4.47 -1.98 1 55 VAL 5.43 -0.70 1 56 LEU 4.37 -1.57 1 57 SER 5.08 -1.43 1 58 ARG 3.92 -0.58 1 59 VAL 4.70 -1.81 1 60 ASP 3.39 -0.30 1 61 ALA -0.56 0.38 1 63 GLN -0.77 0.70 1 64 GLU -7.44 3.77 1 65 GLN -2.91 2.06 1 66 LEU 3.38 -0.83 1 68 ARG 1.00 1.02 1 69 ARG -0.21 0.76 1 70 ILE -1.00 0.14 1 71 HIS -1.64 2.04 1 72 TYR -1.87 -0.04 1 73 SER -4.87 3.58 1 74 GLN 4.59 -1.19 1 75 ASN 2.69 -0.71 1 76 ASP -0.02 1.58 1 77 LEU 0.66 -0.42 1 78 VAL -4.94 1.57 1 79 GLU 1.00 0.33 1 80 TYR 5.29 -2.67 1 81 SER -2.23 1.64 1 83 VAL 2.13 0.24 1 84 THR 2.70 -0.53 1 85 GLU 3.55 -1.31 1 86 LYS 0.23 -0.54 1 87 HIS 0.51 -0.27 1 88 LEU 3.50 -0.38 1 89 THR 3.53 -0.93 1 90 ASP 0.39 -0.64 1 93 THR -2.81 1.18 1 94 VAL 7.11 -1.14 1 95 ARG 3.75 0.45 1 96 GLU 1.66 0.18 1 97 LEU 4.21 -1.27 1 99 SER 4.29 -1.19 1 100 ALA 4.72 -1.58 1 101 ALA 4.18 -1.56 1 102 ILE 4.54 -0.62 1 104 MET -2.76 0.45 1 107 ASN 3.13 0.01 1 108 THR 9.00 -2.81 1 109 ALA 3.11 -0.35 1 110 ALA 1.91 0.17 1 111 ASN 4.81 -2.08 1 112 LEU 2.96 -0.29 1 113 LEU 1.84 0.43 1 114 LEU 3.29 0.00 1 115 THR 6.43 -1.46 1 116 THR 4.74 -1.08 1 117 ILE -0.14 0.12 1 121 LYS 4.47 -0.93 1 122 GLU 2.66 -0.73 1 123 LEU 4.54 -1.86 1 125 ASP 4.49 -0.51 1 126 PHE 4.86 -1.53 1 127 LEU 5.00 -2.68 1 128 ARG 3.58 -2.15 1 129 GLN 4.22 -1.21 1 130 ILE 1.58 -1.50 1 132 ASP -0.62 -0.74 1 133 LYS 0.21 -0.11 1 134 GLU -2.26 3.26 1 135 THR 6.56 -3.03 1 136 ARG -4.10 2.75 1 137 LEU -5.08 3.46 1 138 ASP -3.27 4.59 1 139 ARG -5.17 4.07 1 140 ILE -0.78 -0.88 1 143 ASP 3.26 -0.10 1 144 LEU 3.58 -1.57 1 145 ASN -0.72 1.45 1 146 GLU 3.10 0.76 1 148 LYS 2.76 -0.96 1 149 LEU 2.54 -0.76 1 151 ASP -2.22 1.18 1 152 LEU -0.20 0.40 1 153 ARG 1.40 -0.24 1 154 ASP 0.12 1.37 1 155 THR -7.55 5.28 1 156 THR -0.44 -1.37 1 157 THR -1.47 -0.71 1 159 LYS 3.47 0.50 1 160 ALA 3.45 -0.31 1 161 ILE 7.15 -2.26 1 162 ALA 2.94 0.37 1 163 SER 4.63 -1.05 1 164 THR 7.39 -2.35 1 165 LEU 4.15 -0.99 1 166 ARG 6.88 -2.00 1 167 LYS 4.15 -0.43 1 168 LEU 2.66 0.00 1 169 LEU 0.35 0.98 1 170 THR -3.17 2.35 1 172 GLU -0.22 -0.27 1 173 LEU 1.98 0.72 1 174 LEU -4.64 2.15 1 175 THR -1.61 1.90 1 176 LEU 4.66 -0.85 1 177 ALA 3.39 -0.91 1 178 SER 4.07 0.50 1 179 ARG 4.16 0.04 1 180 GLN 2.89 -1.01 1 181 GLN 2.08 -0.79 1 182 LEU 3.98 -0.84 1 183 ILE 5.02 -0.47 1 184 ASP 4.50 -1.12 1 185 TRP 2.85 -0.72 1 186 MET 1.40 2.79 1 187 GLU 1.22 1.89 1 188 ALA -0.78 0.04 1 197 ARG 5.46 -1.65 1 198 SER 3.13 -0.45 1 199 ALA -2.38 0.54 1 200 LEU -2.35 2.27 1 202 ALA 1.75 -0.80 1 204 TRP 2.26 -0.70 1 205 PHE -3.51 2.66 1 206 ILE -2.03 1.39 1 207 ALA -4.33 2.47 1 208 ASP -5.33 4.13 1 222 ALA -6.81 5.62 1 223 ALA -3.71 1.55 1 224 LEU -4.21 4.22 1 227 ASP 2.52 -1.77 1 229 LYS -3.93 2.03 1 231 SER -1.26 1.95 1 232 ARG -5.51 5.35 1 233 ILE -4.00 1.68 1 234 VAL -5.95 3.38 1 235 VAL -4.73 2.91 1 236 ILE -4.10 3.14 1 237 TYR -7.15 6.17 1 238 THR -3.28 1.02 1 241 SER -1.20 1.84 1 242 GLN 0.39 -0.35 1 243 ALA -1.71 1.49 1 244 THR -1.27 1.15 1 245 MET 4.63 -1.99 1 246 ASP 4.01 -0.44 1 247 GLU 2.15 0.19 1 248 ARG 4.48 0.28 1 249 ASN 3.85 -1.64 1 250 ARG 4.10 -0.78 1 251 GLN 4.28 -1.65 1 253 ALA 4.84 -1.38 1 254 GLU 3.15 -0.09 1 255 ILE 6.22 -0.73 1 257 ALA 3.99 -1.28 1 258 SER 4.40 -0.86 1 259 LEU 4.49 -1.48 1 260 ILE 3.90 -1.13 1 261 LYS 3.37 -0.56 1 262 HIS 0.83 -0.99 1 263 TRP 4.03 0.85 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16598_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.96 _LACS_plot.Line_1_terminator_val_y_1 -2.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.58 _LACS_plot.Line_2_terminator_val_x_2 9.00 _LACS_plot.Line_2_terminator_val_y_2 3.28 _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 80 TYR 5.29 -3.78 0 84 THR 2.70 7.22 0 206 ILE -2.03 -6.88 0 10 ASP 2.47 1.85 1 11 ALA 3.67 1.72 1 12 GLU 5.01 3.78 1 13 ASP 3.21 2.85 1 14 GLN 3.69 3.10 1 15 LEU -0.76 1.32 1 17 ALA -6.86 -2.89 1 18 ARG -2.64 1.23 1 19 VAL -2.26 -3.56 1 21 TYR -7.62 -1.56 1 22 ILE -4.41 -5.92 1 23 GLU -7.16 -1.36 1 24 LEU -6.76 -1.58 1 25 ASP -0.81 0.60 1 26 LEU 2.93 -0.23 1 27 ASN 3.35 2.01 1 28 SER -1.15 1.93 1 30 LYS 0.07 -0.64 1 31 ILE 2.59 -0.24 1 32 LEU 0.91 -0.66 1 33 GLU -5.60 -2.15 1 34 SER -3.01 -2.93 1 35 PHE -1.92 -2.69 1 38 GLU -1.63 -0.39 1 39 GLU -1.79 -2.41 1 40 ARG -1.99 1.00 1 47 PHE 1.65 1.06 1 48 LYS 5.17 0.88 1 49 VAL 4.25 -0.26 1 50 LEU 3.92 0.46 1 51 LEU 2.40 -0.36 1 54 ALA 4.47 2.90 1 55 VAL 5.43 1.60 1 56 LEU 4.37 0.47 1 57 SER 5.08 3.41 1 58 ARG 3.92 3.08 1 59 VAL 4.70 4.51 1 60 ASP 3.39 1.48 1 61 ALA -0.56 0.12 1 63 GLN -0.77 -2.44 1 64 GLU -7.44 -3.90 1 65 GLN -2.91 0.03 1 66 LEU 3.38 -0.25 1 68 ARG 1.00 -1.60 1 69 ARG -0.21 -1.83 1 70 ILE -1.00 -1.89 1 71 HIS -1.64 0.05 1 72 TYR -1.87 -2.88 1 73 SER -4.87 1.05 1 74 GLN 4.59 1.95 1 75 ASN 2.69 0.41 1 76 ASP -0.02 -0.70 1 77 LEU 0.66 0.34 1 78 VAL -4.94 0.26 1 79 GLU 1.00 -1.67 1 83 VAL 2.13 2.76 1 85 GLU 3.55 -0.17 1 86 LYS 0.23 0.66 1 87 HIS 0.51 0.39 1 88 LEU 3.50 1.53 1 89 THR 3.53 0.91 1 90 ASP 0.39 1.35 1 92 MET -7.96 -1.18 1 93 THR -2.81 1.13 1 94 VAL 7.11 1.63 1 95 ARG 3.75 1.29 1 96 GLU 1.66 3.91 1 97 LEU 4.21 1.47 1 99 SER 4.29 4.38 1 100 ALA 4.72 2.41 1 101 ALA 4.18 0.64 1 102 ILE 4.54 0.21 1 104 MET -2.76 -0.09 1 107 ASN 3.13 2.75 1 108 THR 9.00 1.73 1 109 ALA 3.11 0.66 1 110 ALA 1.91 0.13 1 111 ASN 4.81 4.14 1 112 LEU 2.96 3.38 1 113 LEU 1.84 3.08 1 114 LEU 3.29 1.97 1 115 THR 6.43 2.87 1 116 THR 4.74 0.99 1 117 ILE -0.14 -1.21 1 121 LYS 4.47 2.36 1 122 GLU 2.66 3.93 1 123 LEU 4.54 0.30 1 125 ASP 4.49 2.48 1 126 PHE 4.86 0.48 1 127 LEU 5.00 1.22 1 128 ARG 3.58 5.49 1 129 GLN 4.22 2.49 1 130 ILE 1.58 0.08 1 132 ASP -0.62 0.00 1 133 LYS 0.21 -0.22 1 134 GLU -2.26 0.97 1 135 THR 6.56 -0.30 1 136 ARG -4.10 -5.23 1 137 LEU -5.08 -3.53 1 138 ASP -3.27 -0.83 1 139 ARG -5.17 -4.40 1 140 ILE -0.78 1.28 1 143 ASP 3.26 -0.22 1 144 LEU 3.58 -0.76 1 145 ASN -0.72 -0.31 1 146 GLU 3.10 0.34 1 148 LYS 2.76 1.22 1 149 LEU 2.54 1.17 1 151 ASP -2.22 0.70 1 152 LEU -0.20 0.98 1 153 ARG 1.40 0.86 1 154 ASP 0.12 1.46 1 155 THR -7.55 -1.41 1 156 THR -0.44 -1.31 1 159 LYS 3.47 1.61 1 160 ALA 3.45 2.25 1 161 ILE 7.15 0.94 1 162 ALA 2.94 1.13 1 163 SER 4.63 2.89 1 164 THR 7.39 0.80 1 165 LEU 4.15 0.43 1 166 ARG 6.88 2.12 1 167 LYS 4.15 1.74 1 168 LEU 2.66 -0.10 1 169 LEU 0.35 0.52 1 170 THR -3.17 0.06 1 172 GLU -0.22 -0.21 1 173 LEU 1.98 -0.55 1 174 LEU -4.64 -0.09 1 175 THR -1.61 0.61 1 176 LEU 4.66 1.51 1 177 ALA 3.39 3.67 1 178 SER 4.07 0.40 1 179 ARG 4.16 2.10 1 180 GLN 2.89 1.07 1 181 GLN 2.08 1.87 1 182 LEU 3.98 0.66 1 183 ILE 5.02 0.78 1 184 ASP 4.50 5.07 1 185 TRP 2.85 1.01 1 186 MET 1.40 3.85 1 187 GLU 1.22 1.55 1 197 ARG 5.46 1.13 1 198 SER 3.13 -0.59 1 199 ALA -2.38 -1.53 1 202 ALA 1.75 1.61 1 204 TRP 2.26 -0.78 1 205 PHE -3.51 -1.10 1 207 ALA -4.33 -2.91 1 222 ALA -6.81 -3.22 1 223 ALA -3.71 -2.22 1 224 LEU -4.21 -0.87 1 227 ASP 2.52 0.83 1 231 SER -1.26 -0.08 1 232 ARG -5.51 -1.80 1 233 ILE -4.00 -1.82 1 234 VAL -5.95 -2.96 1 235 VAL -4.73 -2.28 1 236 ILE -4.10 -1.88 1 237 TYR -7.15 -1.48 1 241 SER -1.20 1.22 1 242 GLN 0.39 -0.09 1 243 ALA -1.71 0.89 1 245 MET 4.63 1.50 1 246 ASP 4.01 2.39 1 247 GLU 2.15 2.68 1 248 ARG 4.48 1.22 1 249 ASN 3.85 1.33 1 250 ARG 4.10 2.53 1 251 GLN 4.28 2.48 1 253 ALA 4.84 2.62 1 254 GLU 3.15 4.08 1 255 ILE 6.22 1.61 1 257 ALA 3.99 2.39 1 258 SER 4.40 1.66 1 259 LEU 4.49 1.24 1 260 ILE 3.90 2.10 1 261 LYS 3.37 1.32 1 262 HIS 0.83 -0.45 1 stop_ save_