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 bmr19015_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.32 _LACS_plot.Line_1_terminator_val_y_1 -3.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.26 _LACS_plot.Line_2_terminator_val_x_2 8.18 _LACS_plot.Line_2_terminator_val_y_2 5.43 _LACS_plot.Y_axis_chem_shift_offset 0.71 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 326 THR -6.32 -0.03 0 10 LEU 0.64 -0.35 1 11 SER -0.59 -0.89 1 12 ALA 2.15 0.82 1 13 GLU 2.04 0.80 1 14 ASP 1.70 0.67 1 15 LYS 2.95 1.29 1 16 ALA 2.31 0.73 1 17 ALA 2.54 0.99 1 18 VAL 3.09 1.47 1 19 GLU 1.87 0.81 1 20 ARG 2.95 1.13 1 21 SER 2.35 1.06 1 22 LYS 1.92 0.23 1 23 MET 1.45 0.12 1 24 ILE 1.33 0.09 1 25 ASP 0.59 -0.06 1 26 ARG 1.91 0.10 1 27 ASN 1.20 0.18 1 28 LEU 1.51 -0.05 1 29 ARG 1.39 -0.24 1 30 GLU 0.58 -0.31 1 31 ASP 0.96 -0.01 1 33 GLU 0.27 -0.52 1 34 LYS 1.02 -0.29 1 35 ALA 0.20 -0.57 1 36 ALA 0.44 -0.47 1 37 LYS 0.61 -0.77 1 38 GLU -2.54 -1.65 1 39 VAL -1.85 -1.79 1 40 LYS -0.98 -0.93 1 41 LEU -5.43 -2.40 1 46 ALA -0.21 -1.02 1 48 GLU 5.44 0.92 1 49 SER 2.72 2.11 1 52 SER 1.95 -1.73 1 57 GLN 5.26 2.07 1 58 MET 2.14 0.63 1 60 ILE 5.12 3.75 1 61 ILE 3.12 2.83 1 62 HIS -1.24 0.99 1 63 GLU -1.10 -1.96 1 64 ASP 1.88 0.29 1 66 TYR 0.44 0.30 1 67 SER -2.17 -1.34 1 68 GLU 5.06 4.08 1 69 ASP 4.27 3.26 1 70 GLU 2.63 2.29 1 72 LYS 5.92 4.35 1 73 GLN 3.91 1.58 1 74 TYR 2.59 1.88 1 75 LYS 7.41 5.13 1 76 VAL 4.87 2.49 1 77 VAL 4.86 2.77 1 78 VAL 6.82 4.41 1 79 TYR 4.73 0.21 1 80 SER 5.11 3.25 1 81 ASN 3.41 2.76 1 83 ILE 5.51 3.65 1 84 GLN 5.18 2.73 1 85 SER 1.87 4.29 1 87 ILE 8.18 5.71 1 88 ALA 4.34 2.53 1 89 ILE 4.40 4.09 1 91 ARG 5.24 3.24 1 92 ALA 5.05 1.61 1 95 ARG 3.48 2.06 1 96 LEU 2.11 -0.02 1 97 LYS 6.34 0.28 1 98 ILE -1.66 -0.88 1 99 ASP -2.16 -1.42 1 100 PHE 1.98 1.78 1 102 GLU -3.99 -2.23 1 103 ALA 4.12 2.31 1 104 ALA 2.75 1.30 1 105 ARG 0.98 0.84 1 106 ALA 4.79 2.32 1 107 ASP 3.71 2.56 1 108 ASP 4.55 3.09 1 109 ALA 4.11 2.28 1 110 ARG 5.16 3.36 1 111 GLN 3.42 2.01 1 112 LEU 5.23 2.70 1 113 PHE 5.36 3.11 1 114 VAL 4.90 3.10 1 115 LEU 1.14 1.00 1 116 ALA 3.42 1.97 1 118 SER 0.99 0.42 1 119 ALA 0.88 -0.11 1 120 GLU 1.11 0.20 1 121 GLU 0.82 -0.15 1 123 VAL -1.56 -1.07 1 124 MET -0.48 -2.41 1 125 THR 0.82 -0.90 1 127 GLU 4.52 2.82 1 128 LEU 4.58 1.85 1 129 ALA 4.99 2.66 1 131 VAL 5.70 3.86 1 132 ILE 7.69 5.33 1 133 LYS 5.02 3.65 1 134 ARG 4.65 4.20 1 135 LEU 3.96 3.00 1 136 TRP 0.09 0.38 1 137 ARG 0.46 -1.04 1 138 ASP -2.02 0.75 1 141 VAL 6.53 3.65 1 142 GLN 4.43 2.26 1 143 ALA 4.95 2.27 1 145 PHE 4.87 3.30 1 146 SER 3.73 2.42 1 147 ARG 1.58 -0.53 1 148 SER 4.41 2.74 1 149 ARG 4.91 1.46 1 150 GLU 0.90 0.20 1 151 TYR 1.37 -2.04 1 152 GLN 0.83 -1.10 1 153 LEU -2.95 -1.63 1 154 ASN 2.45 0.86 1 155 ASP 3.59 3.19 1 156 SER 0.47 -0.66 1 157 ALA 4.90 3.59 1 158 SER 4.26 2.36 1 159 TYR 5.49 2.93 1 160 TYR 2.52 1.73 1 161 LEU 7.32 2.38 1 162 ASN 2.98 1.07 1 163 ASP -0.87 -2.32 1 164 LEU 2.89 2.05 1 165 ASP 5.37 3.41 1 166 ARG 3.39 2.72 1 167 ILE 3.05 1.10 1 168 SER 0.46 0.17 1 169 GLN 0.96 0.02 1 171 ASN 0.81 -1.27 1 172 TYR 0.01 0.15 1 173 ILE -2.97 -1.50 1 175 THR -3.45 -2.21 1 176 GLN 5.74 4.07 1 177 GLN 5.12 2.27 1 178 ASP 5.99 2.80 1 181 ARG 0.91 -1.17 1 182 THR -1.83 0.60 1 183 ARG -1.81 -2.01 1 184 VAL -2.28 -1.38 1 189 ILE 0.15 -0.35 1 192 THR -1.41 -1.03 1 193 HIS -5.61 -2.58 1 194 PHE 0.00 -1.30 1 195 THR -1.62 -1.46 1 196 PHE -1.64 -0.74 1 197 LYS 6.10 1.37 1 198 ASP 3.51 1.36 1 199 LEU -2.11 -1.78 1 200 TYR -0.86 -1.76 1 201 PHE -0.78 -0.57 1 202 LYS -1.10 -1.52 1 203 MET -4.44 -1.90 1 217 ILE 1.21 0.08 1 218 HIS 2.40 2.28 1 220 PHE 1.70 -1.25 1 221 GLU 0.18 -0.40 1 223 VAL 3.04 1.11 1 224 THR 4.84 3.36 1 225 ALA -3.83 -2.25 1 228 PHE -2.66 -1.90 1 230 VAL -4.48 -2.11 1 231 ALA -1.24 -2.79 1 232 LEU 4.31 2.98 1 233 SER 2.63 0.53 1 234 ASP 1.83 0.43 1 235 TYR 5.18 2.09 1 236 ASP -1.55 -3.36 1 237 LEU -1.65 -1.48 1 238 VAL -2.66 -2.57 1 239 LEU 1.27 -0.06 1 240 ALA 1.84 0.56 1 244 GLU 0.54 -0.42 1 245 MET -1.90 -2.02 1 246 ASN 0.25 0.51 1 247 ARG 5.36 4.34 1 253 LYS 4.75 2.70 1 254 LEU 3.49 2.19 1 255 PHE 6.33 4.14 1 256 ASP 2.41 2.64 1 257 SER 3.71 2.55 1 258 ILE 2.83 0.90 1 260 ASN -0.06 -0.36 1 261 ASN 0.43 0.59 1 262 LYS 4.64 2.10 1 263 TRP 2.68 0.74 1 264 PHE -1.26 -3.20 1 265 THR 6.50 4.80 1 266 GLU 0.28 -1.00 1 267 THR 0.42 0.97 1 268 SER 3.12 2.01 1 269 ILE 1.32 -0.46 1 270 ILE -3.94 -2.39 1 272 PHE -3.16 -2.51 1 273 LEU -3.10 -1.08 1 274 ASN 5.48 1.02 1 275 LYS 6.01 3.07 1 276 LYS 3.68 1.22 1 277 ASP 2.94 0.92 1 278 LEU 3.70 4.32 1 279 PHE 4.60 2.93 1 280 GLU 1.56 1.05 1 281 GLU 0.51 -2.10 1 283 ILE 2.36 1.14 1 284 LYS -1.62 -0.58 1 285 ARG -2.14 -2.88 1 286 SER 2.77 1.00 1 288 LEU 1.46 0.22 1 289 THR 3.90 3.13 1 290 ILE 1.67 -0.77 1 294 GLU 1.54 0.35 1 295 TYR -2.34 -3.40 1 296 THR -0.85 -0.78 1 298 SER 1.91 -0.36 1 299 ASN -4.77 -3.37 1 300 THR 5.25 4.26 1 301 TYR 5.61 3.74 1 302 GLU 3.60 2.73 1 303 GLU 2.44 2.14 1 304 ALA 5.40 2.65 1 305 ALA 3.58 1.74 1 306 ALA 2.54 4.21 1 307 TYR 7.98 4.30 1 309 GLN 2.98 1.94 1 311 GLN 5.08 4.21 1 312 PHE 5.01 3.16 1 313 GLU 2.76 1.32 1 314 ASP 2.27 0.18 1 315 LEU 0.60 -0.73 1 316 ASN 2.76 0.25 1 317 ARG 0.98 -1.41 1 318 ARG 3.63 2.18 1 319 LYS 2.35 0.82 1 320 ASP -0.26 -0.36 1 321 THR -0.24 -0.70 1 322 LYS -1.59 -1.58 1 323 GLU -1.58 -2.36 1 324 ILE 0.02 -1.13 1 325 TYR 2.08 0.65 1 327 HIS 0.11 -0.95 1 328 PHE -4.01 -1.50 1 329 THR 3.79 1.74 1 331 ALA 3.82 -0.23 1 332 THR -1.69 -2.15 1 333 ASP 6.02 5.11 1 334 THR 5.40 2.69 1 335 LYS 2.93 3.71 1 336 ASN 8.04 4.38 1 337 VAL 2.91 3.87 1 338 GLN 4.39 3.06 1 339 PHE 5.95 3.23 1 340 VAL 7.22 4.80 1 341 PHE 4.45 3.71 1 342 ASP 4.04 1.85 1 343 ALA 6.00 3.34 1 344 VAL 7.23 6.04 1 345 THR 4.94 3.42 1 346 ASP 6.29 3.62 1 347 VAL 4.78 3.21 1 348 ILE 5.68 4.12 1 349 ILE 4.15 2.57 1 350 LYS 1.82 1.21 1 351 ASN 0.70 1.44 1 352 ASN 1.99 0.07 1 353 LEU 2.03 0.58 1 354 LYS 0.82 -0.15 1 355 GLU 0.66 -0.33 1 358 LEU 0.63 0.59 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19015_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.32 _LACS_plot.Line_1_terminator_val_y_1 3.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.26 _LACS_plot.Line_2_terminator_val_x_2 8.18 _LACS_plot.Line_2_terminator_val_y_2 -2.75 _LACS_plot.Y_axis_chem_shift_offset 0.71 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 326 THR -6.32 6.29 0 10 LEU 0.64 -0.99 1 11 SER -0.59 -0.30 1 12 ALA 2.15 -1.33 1 13 GLU 2.04 -1.24 1 14 ASP 1.70 -1.03 1 15 LYS 2.95 -1.66 1 16 ALA 2.31 -1.58 1 17 ALA 2.54 -1.55 1 18 VAL 3.09 -1.62 1 19 GLU 1.87 -1.06 1 20 ARG 2.95 -1.82 1 21 SER 2.35 -1.29 1 22 LYS 1.92 -1.69 1 23 MET 1.45 -1.33 1 24 ILE 1.33 -1.24 1 25 ASP 0.59 -0.65 1 26 ARG 1.91 -1.81 1 27 ASN 1.20 -1.02 1 28 LEU 1.51 -1.56 1 29 ARG 1.39 -1.63 1 30 GLU 0.58 -0.89 1 31 ASP 0.96 -0.97 1 33 GLU 0.27 -0.79 1 34 LYS 1.02 -1.31 1 35 ALA 0.20 -0.77 1 36 ALA 0.44 -0.91 1 37 LYS 0.61 -1.38 1 38 GLU -2.54 0.89 1 39 VAL -1.85 0.06 1 40 LYS -0.98 0.05 1 41 LEU -5.43 3.03 1 46 ALA -0.21 -0.81 1 48 GLU 5.44 -4.52 1 49 SER 2.72 -0.61 1 52 SER 1.95 -3.68 1 57 GLN 5.26 -3.19 1 58 MET 2.14 -1.51 1 60 ILE 5.12 -1.37 1 61 ILE 3.12 -0.29 1 62 HIS -1.24 2.23 1 63 GLU -1.10 -0.86 1 64 ASP 1.88 -1.59 1 66 TYR 0.44 -0.14 1 67 SER -2.17 0.83 1 68 GLU 5.06 -0.98 1 69 ASP 4.27 -1.01 1 70 GLU 2.63 -0.34 1 72 LYS 5.92 -1.57 1 73 GLN 3.91 -2.33 1 74 TYR 2.59 -0.71 1 75 LYS 7.41 -2.28 1 76 VAL 4.87 -2.38 1 77 VAL 4.86 -2.09 1 78 VAL 6.82 -2.41 1 79 TYR 4.73 -4.52 1 80 SER 5.11 -1.86 1 81 ASN 3.41 -0.65 1 83 ILE 5.51 -1.86 1 84 GLN 5.18 -2.45 1 85 SER 1.87 2.42 1 87 ILE 8.18 -2.47 1 88 ALA 4.34 -1.81 1 89 ILE 4.40 -0.31 1 91 ARG 5.24 -2.00 1 92 ALA 5.05 -3.44 1 95 ARG 3.48 -1.42 1 96 LEU 2.11 -2.13 1 97 LYS 6.34 -6.06 1 98 ILE -1.66 0.78 1 99 ASP -2.16 0.74 1 100 PHE 1.98 -0.20 1 102 GLU -3.99 1.76 1 103 ALA 4.12 -1.81 1 104 ALA 2.75 -1.45 1 105 ARG 0.98 -0.14 1 106 ALA 4.79 -2.47 1 107 ASP 3.71 -1.15 1 108 ASP 4.55 -1.46 1 109 ALA 4.11 -1.83 1 110 ARG 5.16 -1.80 1 111 GLN 3.42 -1.41 1 112 LEU 5.23 -2.53 1 113 PHE 5.36 -2.25 1 114 VAL 4.90 -1.80 1 115 LEU 1.14 -0.14 1 116 ALA 3.42 -1.45 1 118 SER 0.99 -0.57 1 119 ALA 0.88 -0.99 1 120 GLU 1.11 -0.91 1 121 GLU 0.82 -0.97 1 123 VAL -1.56 0.49 1 124 MET -0.48 -1.93 1 125 THR 0.82 -1.72 1 127 GLU 4.52 -1.70 1 128 LEU 4.58 -2.73 1 129 ALA 4.99 -2.33 1 131 VAL 5.70 -1.84 1 132 ILE 7.69 -2.36 1 133 LYS 5.02 -1.37 1 134 ARG 4.65 -0.45 1 135 LEU 3.96 -0.96 1 136 TRP 0.09 0.29 1 137 ARG 0.46 -1.50 1 138 ASP -2.02 2.77 1 141 VAL 6.53 -2.88 1 142 GLN 4.43 -2.17 1 143 ALA 4.95 -2.68 1 145 PHE 4.87 -1.57 1 146 SER 3.73 -1.31 1 147 ARG 1.58 -2.11 1 148 SER 4.41 -1.67 1 149 ARG 4.91 -3.45 1 150 GLU 0.90 -0.70 1 151 TYR 1.37 -3.41 1 152 GLN 0.83 -1.93 1 153 LEU -2.95 1.32 1 154 ASN 2.45 -1.59 1 155 ASP 3.59 -0.40 1 156 SER 0.47 -1.13 1 157 ALA 4.90 -1.31 1 158 SER 4.26 -1.90 1 159 TYR 5.49 -2.56 1 160 TYR 2.52 -0.79 1 161 LEU 7.32 -4.94 1 162 ASN 2.98 -1.91 1 163 ASP -0.87 -1.45 1 164 LEU 2.89 -0.84 1 165 ASP 5.37 -1.96 1 166 ARG 3.39 -0.67 1 167 ILE 3.05 -1.95 1 168 SER 0.46 -0.29 1 169 GLN 0.96 -0.94 1 171 ASN 0.81 -2.08 1 172 TYR 0.01 0.14 1 173 ILE -2.97 1.47 1 175 THR -3.45 1.24 1 176 GLN 5.74 -1.67 1 177 GLN 5.12 -2.85 1 178 ASP 5.99 -3.19 1 181 ARG 0.91 -2.08 1 182 THR -1.83 2.43 1 183 ARG -1.81 -0.20 1 184 VAL -2.28 0.90 1 189 ILE 0.15 -0.50 1 192 THR -1.41 0.38 1 193 HIS -5.61 3.03 1 194 PHE 0.00 -1.30 1 195 THR -1.62 0.16 1 196 PHE -1.64 0.90 1 197 LYS 6.10 -4.73 1 198 ASP 3.51 -2.15 1 199 LEU -2.11 0.33 1 200 TYR -0.86 -0.90 1 201 PHE -0.78 0.21 1 202 LYS -1.10 -0.42 1 203 MET -4.44 2.54 1 217 ILE 1.21 -1.13 1 218 HIS 2.40 -0.12 1 220 PHE 1.70 -2.95 1 221 GLU 0.18 -0.58 1 223 VAL 3.04 -1.93 1 224 THR 4.84 -1.48 1 225 ALA -3.83 1.58 1 228 PHE -2.66 0.76 1 230 VAL -4.48 2.37 1 231 ALA -1.24 -1.55 1 232 LEU 4.31 -1.33 1 233 SER 2.63 -2.10 1 234 ASP 1.83 -1.40 1 235 TYR 5.18 -3.09 1 236 ASP -1.55 -1.81 1 237 LEU -1.65 0.17 1 238 VAL -2.66 0.09 1 239 LEU 1.27 -1.33 1 240 ALA 1.84 -1.28 1 244 GLU 0.54 -0.96 1 245 MET -1.90 -0.12 1 246 ASN 0.25 0.26 1 247 ARG 5.36 -1.02 1 253 LYS 4.75 -2.05 1 254 LEU 3.49 -1.30 1 255 PHE 6.33 -2.19 1 256 ASP 2.41 0.23 1 257 SER 3.71 -1.16 1 258 ILE 2.83 -1.93 1 260 ASN -0.06 -0.30 1 261 ASN 0.43 0.16 1 262 LYS 4.64 -2.54 1 263 TRP 2.68 -1.94 1 264 PHE -1.26 -1.94 1 265 THR 6.50 -1.70 1 266 GLU 0.28 -1.28 1 267 THR 0.42 0.55 1 268 SER 3.12 -1.11 1 269 ILE 1.32 -1.78 1 270 ILE -3.94 1.55 1 272 PHE -3.16 0.65 1 273 LEU -3.10 2.02 1 274 ASN 5.48 -4.46 1 275 LYS 6.01 -2.94 1 276 LYS 3.68 -2.46 1 277 ASP 2.94 -2.02 1 278 LEU 3.70 0.62 1 279 PHE 4.60 -1.67 1 280 GLU 1.56 -0.51 1 281 GLU 0.51 -2.61 1 283 ILE 2.36 -1.22 1 284 LYS -1.62 1.04 1 285 ARG -2.14 -0.74 1 286 SER 2.77 -1.77 1 288 LEU 1.46 -1.24 1 289 THR 3.90 -0.77 1 290 ILE 1.67 -2.44 1 294 GLU 1.54 -1.19 1 295 TYR -2.34 -1.06 1 296 THR -0.85 0.07 1 298 SER 1.91 -2.27 1 299 ASN -4.77 1.40 1 300 THR 5.25 -0.99 1 301 TYR 5.61 -1.87 1 302 GLU 3.60 -0.87 1 303 GLU 2.44 -0.30 1 304 ALA 5.40 -2.75 1 305 ALA 3.58 -1.84 1 306 ALA 2.54 1.67 1 307 TYR 7.98 -3.68 1 309 GLN 2.98 -1.04 1 311 GLN 5.08 -0.87 1 312 PHE 5.01 -1.85 1 313 GLU 2.76 -1.44 1 314 ASP 2.27 -2.09 1 315 LEU 0.60 -1.33 1 316 ASN 2.76 -2.51 1 317 ARG 0.98 -2.39 1 318 ARG 3.63 -1.45 1 319 LYS 2.35 -1.53 1 320 ASP -0.26 -0.10 1 321 THR -0.24 -0.46 1 322 LYS -1.59 0.01 1 323 GLU -1.58 -0.78 1 324 ILE 0.02 -1.15 1 325 TYR 2.08 -1.43 1 327 HIS 0.11 -1.06 1 328 PHE -4.01 2.51 1 329 THR 3.79 -2.05 1 331 ALA 3.82 -4.05 1 332 THR -1.69 -0.46 1 333 ASP 6.02 -0.91 1 334 THR 5.40 -2.71 1 335 LYS 2.93 0.78 1 336 ASN 8.04 -3.66 1 337 VAL 2.91 0.96 1 338 GLN 4.39 -1.33 1 339 PHE 5.95 -2.72 1 340 VAL 7.22 -2.42 1 341 PHE 4.45 -0.74 1 342 ASP 4.04 -2.19 1 343 ALA 6.00 -2.66 1 344 VAL 7.23 -1.19 1 345 THR 4.94 -1.52 1 346 ASP 6.29 -2.67 1 347 VAL 4.78 -1.57 1 348 ILE 5.68 -1.56 1 349 ILE 4.15 -1.58 1 350 LYS 1.82 -0.61 1 351 ASN 0.70 0.74 1 352 ASN 1.99 -1.92 1 353 LEU 2.03 -1.45 1 354 LYS 0.82 -0.97 1 355 GLU 0.66 -0.99 1 358 LEU 0.63 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19015_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.32 _LACS_plot.Line_1_terminator_val_y_1 -2.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.80 _LACS_plot.Line_2_terminator_val_x_2 8.18 _LACS_plot.Line_2_terminator_val_y_2 2.60 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 269 ILE 1.32 -3.67 0 97 LYS 6.34 -1.57 0 235 TYR 5.18 -2.24 0 197 LYS 6.10 -1.92 0 151 TYR 1.37 -3.97 0 193 HIS -5.61 0.16 0 326 THR -6.32 -0.75 0 358 LEU 0.63 4.46 0 10 LEU 0.64 -0.31 1 11 SER -0.59 -0.08 1 12 ALA 2.15 1.23 1 13 GLU 2.04 0.75 1 14 ASP 1.70 1.14 1 15 LYS 2.95 1.13 1 16 ALA 2.31 1.17 1 17 ALA 2.54 1.68 1 18 VAL 3.09 1.57 1 19 GLU 1.87 1.45 1 20 ARG 2.95 1.36 1 21 SER 2.35 0.50 1 22 LYS 1.92 0.41 1 23 MET 1.45 0.12 1 24 ILE 1.33 -0.28 1 25 ASP 0.59 0.31 1 26 ARG 1.91 0.14 1 27 ASN 1.20 0.10 1 28 LEU 1.51 -0.09 1 29 ARG 1.39 0.35 1 30 GLU 0.58 -0.10 1 31 ASP 0.96 0.57 1 33 GLU 0.27 0.03 1 34 LYS 1.02 -0.26 1 35 ALA 0.20 -0.45 1 36 ALA 0.44 -0.19 1 37 LYS 0.61 -1.71 1 38 GLU -2.54 -1.22 1 39 VAL -1.85 -2.59 1 40 LYS -0.98 -1.66 1 41 LEU -5.43 -2.99 1 46 ALA -0.21 0.76 1 48 GLU 5.44 -1.51 1 49 SER 2.72 -0.31 1 57 GLN 5.26 2.55 1 58 MET 2.14 2.14 1 60 ILE 5.12 0.56 1 61 ILE 3.12 1.31 1 62 HIS -1.24 2.53 1 63 GLU -1.10 -1.34 1 64 ASP 1.88 0.05 1 66 TYR 0.44 0.66 1 67 SER -2.17 0.66 1 68 GLU 5.06 1.77 1 69 ASP 4.27 2.94 1 70 GLU 2.63 3.51 1 72 LYS 5.92 2.97 1 73 GLN 3.91 1.09 1 74 TYR 2.59 0.68 1 75 LYS 7.41 0.01 1 76 VAL 4.87 0.88 1 78 VAL 6.82 4.01 1 79 TYR 4.73 1.76 1 80 SER 5.11 2.82 1 81 ASN 3.41 3.12 1 83 ILE 5.51 1.12 1 84 GLN 5.18 3.78 1 87 ILE 8.18 0.68 1 88 ALA 4.34 3.24 1 91 ARG 5.24 3.25 1 92 ALA 5.05 0.75 1 95 ARG 3.48 1.68 1 96 LEU 2.11 -1.71 1 98 ILE -1.66 -1.54 1 99 ASP -2.16 0.93 1 100 PHE 1.98 1.50 1 102 GLU -3.99 -0.25 1 103 ALA 4.12 2.68 1 104 ALA 2.75 1.67 1 105 ARG 0.98 1.26 1 106 ALA 4.79 2.97 1 107 ASP 3.71 2.38 1 108 ASP 4.55 0.76 1 109 ALA 4.11 -0.10 1 110 ARG 5.16 3.54 1 111 GLN 3.42 1.78 1 112 LEU 5.23 -0.46 1 113 PHE 5.36 3.41 1 114 VAL 4.90 2.60 1 115 LEU 1.14 2.14 1 116 ALA 3.42 1.49 1 118 SER 0.99 0.26 1 119 ALA 0.88 0.58 1 120 GLU 1.11 0.15 1 121 GLU 0.82 0.81 1 123 VAL -1.56 -1.99 1 124 MET -0.48 -1.75 1 125 THR 0.82 -0.06 1 127 GLU 4.52 2.39 1 128 LEU 4.58 0.01 1 129 ALA 4.99 1.74 1 131 VAL 5.70 1.05 1 132 ILE 7.69 0.66 1 133 LYS 5.02 2.56 1 134 ARG 4.65 3.97 1 135 LEU 3.96 0.11 1 136 TRP 0.09 -0.40 1 137 ARG 0.46 0.03 1 138 ASP -2.02 0.79 1 141 VAL 6.53 3.40 1 142 GLN 4.43 3.07 1 143 ALA 4.95 2.92 1 145 PHE 4.87 1.64 1 146 SER 3.73 0.29 1 147 ARG 1.58 -0.81 1 148 SER 4.41 0.04 1 149 ARG 4.91 1.05 1 150 GLU 0.90 -1.40 1 152 GLN 0.83 -1.19 1 153 LEU -2.95 -2.02 1 154 ASN 2.45 1.04 1 155 ASP 3.59 1.99 1 156 SER 0.47 -1.39 1 157 ALA 4.90 0.58 1 158 SER 4.26 0.42 1 159 TYR 5.49 1.38 1 160 TYR 2.52 2.45 1 161 LEU 7.32 1.77 1 162 ASN 2.98 0.76 1 163 ASP -0.87 0.36 1 164 LEU 2.89 1.47 1 165 ASP 5.37 1.00 1 166 ARG 3.39 2.53 1 167 ILE 3.05 -1.03 1 168 SER 0.46 -0.49 1 169 GLN 0.96 2.21 1 171 ASN 0.81 -0.37 1 172 TYR 0.01 -1.04 1 173 ILE -2.97 -2.29 1 175 THR -3.45 0.90 1 176 GLN 5.74 2.13 1 177 GLN 5.12 1.27 1 178 ASP 5.99 4.08 1 181 ARG 0.91 1.76 1 182 THR -1.83 -0.63 1 183 ARG -1.81 -0.96 1 189 ILE 0.15 -0.13 1 192 THR -1.41 -2.64 1 194 PHE 0.00 -3.41 1 195 THR -1.62 -0.62 1 196 PHE -1.64 -1.97 1 198 ASP 3.51 -2.06 1 199 LEU -2.11 -2.57 1 200 TYR -0.86 -1.82 1 201 PHE -0.78 -0.86 1 202 LYS -1.10 -2.96 1 203 MET -4.44 -2.08 1 217 ILE 1.21 -0.05 1 218 HIS 2.40 2.46 1 220 PHE 1.70 -1.07 1 221 GLU 0.18 0.84 1 223 VAL 3.04 -0.24 1 224 THR 4.84 0.14 1 225 ALA -3.83 -3.89 1 228 PHE -2.66 -1.14 1 230 VAL -4.48 -1.79 1 231 ALA -1.24 -0.85 1 232 LEU 4.31 -1.32 1 233 SER 2.63 -1.29 1 234 ASP 1.83 1.32 1 236 ASP -1.55 -1.08 1 238 VAL -2.66 1.39 1 239 LEU 1.27 -0.31 1 240 ALA 1.84 1.52 1 244 GLU 0.54 -0.23 1 245 MET -1.90 -2.27 1 246 ASN 0.25 1.63 1 247 ARG 5.36 3.12 1 253 LYS 4.75 3.67 1 254 LEU 3.49 1.11 1 255 PHE 6.33 1.23 1 256 ASP 2.41 1.45 1 258 ILE 2.83 0.38 1 260 ASN -0.06 -1.26 1 261 ASN 0.43 2.49 1 262 LYS 4.64 1.34 1 263 TRP 2.68 1.77 1 264 PHE -1.26 1.01 1 265 THR 6.50 2.01 1 266 GLU 0.28 -0.71 1 267 THR 0.42 -0.02 1 268 SER 3.12 -2.23 1 270 ILE -3.94 -1.83 1 272 PHE -3.10 -0.01 1 274 ASN 5.48 2.14 1 275 LYS 6.01 0.22 1 276 LYS 3.68 2.17 1 277 ASP 2.94 2.99 1 278 LEU 3.70 -1.00 1 279 PHE 4.60 0.24 1 280 GLU 1.56 1.87 1 281 GLU 0.51 -1.96 1 283 ILE 2.36 1.07 1 284 LYS -1.62 -0.75 1 285 ARG 2.77 1.25 1 288 LEU 1.46 1.27 1 289 THR 3.90 -1.28 1 290 ILE 1.67 -0.35 1 294 GLU 1.54 1.19 1 295 TYR -2.34 0.07 1 296 THR -0.85 1.67 1 298 SER 1.91 -1.10 1 299 ASN -4.77 -0.73 1 300 THR 5.25 0.13 1 301 TYR 5.61 2.98 1 302 GLU 3.60 2.38 1 303 GLU 2.44 1.39 1 304 ALA 5.40 1.62 1 305 ALA 3.58 2.37 1 306 ALA 2.54 2.51 1 307 TYR 7.98 1.72 1 309 GLN 2.98 4.44 1 311 GLN 5.08 2.61 1 312 PHE 5.01 3.65 1 313 GLU 2.76 0.90 1 314 ASP 2.27 -0.60 1 315 LEU 0.60 0.00 1 316 ASN 2.76 0.36 1 317 ARG 0.98 -0.07 1 318 ARG 3.63 0.49 1 319 LYS 2.35 0.58 1 320 ASP -0.26 -0.61 1 321 THR -0.24 -2.09 1 322 LYS -1.59 -2.07 1 323 GLU -1.58 -0.94 1 324 ILE 0.02 -1.24 1 325 TYR 2.08 -0.10 1 327 HIS 0.11 0.97 1 328 PHE -4.01 -0.54 1 329 THR 3.79 -0.87 1 331 ALA 3.82 -1.93 1 332 THR -1.69 -1.40 1 333 ASP 6.02 0.42 1 334 THR 5.40 2.80 1 335 LYS 2.93 1.63 1 336 ASN 8.04 0.71 1 337 VAL 2.91 1.90 1 338 GLN 4.39 3.01 1 339 PHE 5.95 1.54 1 340 VAL 7.22 2.65 1 341 PHE 4.45 1.10 1 342 ASP 4.04 3.75 1 343 ALA 6.00 1.10 1 344 VAL 7.23 0.81 1 345 THR 4.94 2.38 1 346 ASP 6.29 1.57 1 347 VAL 4.78 2.36 1 348 ILE 5.68 1.89 1 349 ILE 4.15 1.91 1 350 LYS 1.82 1.33 1 351 ASN 0.70 0.34 1 352 ASN 1.99 -0.05 1 353 LEU 2.03 0.66 1 354 LYS 0.82 0.18 1 355 GLU 0.66 -1.71 1 stop_ save_