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 bmr27528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -3.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 4.09 _LACS_plot.Y_axis_chem_shift_offset 0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 245 ASN -7.81 -0.04 0 118 ASN 5.57 -0.97 0 158 HIS -4.81 2.31 0 11 VAL 1.44 0.69 1 12 LYS -1.23 -0.98 1 14 ASN -0.23 -1.93 1 15 TYR 3.77 3.79 1 16 ALA -5.03 -2.32 1 17 LEU 3.00 0.99 1 18 LYS -1.32 -1.25 1 19 PHE -5.48 -1.32 1 20 THR 0.68 0.56 1 21 LEU 2.29 -1.36 1 22 ALA -3.11 -2.30 1 24 HIS 2.42 2.91 1 25 THR 1.04 0.14 1 26 LYS -6.71 -2.50 1 27 ALA 0.14 0.99 1 28 VAL 2.53 0.45 1 29 SER -2.91 -1.14 1 30 SER -2.03 -0.75 1 31 VAL -5.59 -4.13 1 32 LYS -7.02 -2.65 1 33 PHE 0.69 0.89 1 34 SER 3.37 -0.70 1 36 ASN 1.51 -1.24 1 38 GLU 2.02 1.05 1 39 TRP -3.65 -3.95 1 40 LEU -5.42 -2.62 1 42 SER -6.39 -2.85 1 43 SER -5.83 -2.41 1 44 SER -1.97 -2.79 1 45 ALA 2.52 1.51 1 46 ASP 1.90 0.11 1 47 LYS 4.57 1.90 1 48 LEU -1.52 -1.74 1 52 TRP -6.20 -4.19 1 54 ALA 2.06 2.16 1 55 TYR 1.22 0.22 1 56 ASP -2.84 -2.67 1 58 LYS 1.48 0.64 1 60 GLU -0.82 -0.20 1 61 LYS -0.37 -0.58 1 62 THR -1.17 -0.87 1 63 ILE 0.33 -0.04 1 64 SER -4.66 -2.19 1 66 HIS 4.37 4.37 1 67 LYS 0.52 0.66 1 68 LEU -7.21 -2.29 1 70 ILE -3.11 -0.85 1 71 SER 1.11 2.25 1 72 ASP -4.56 -1.35 1 73 VAL -7.34 -4.58 1 74 ALA -4.23 -0.84 1 75 TRP -4.38 -1.13 1 76 SER 1.26 -0.23 1 77 SER 3.43 2.71 1 78 ASP -0.25 -1.20 1 80 ASN -0.01 0.85 1 85 ALA -4.41 -2.28 1 86 SER -2.94 -3.13 1 87 ASP 2.80 1.39 1 88 ASP 1.85 -0.05 1 89 LYS 6.65 2.76 1 90 THR -3.75 -1.35 1 93 ILE -1.32 -1.55 1 94 TRP -4.60 -3.03 1 95 ASP -1.92 -1.22 1 96 VAL 6.65 4.61 1 97 SER 4.20 2.85 1 98 SER -1.35 0.04 1 100 LYS -0.92 -0.50 1 102 LEU 1.04 0.82 1 103 LYS -5.55 -1.94 1 104 THR 0.76 0.11 1 105 LEU 4.37 -1.25 1 106 LYS -2.34 -1.18 1 108 HIS 4.48 3.99 1 109 SER -0.52 -0.75 1 110 ASN -4.95 -2.33 1 111 TYR -0.26 -1.19 1 112 VAL 3.53 1.24 1 113 PHE -3.64 -0.15 1 116 ASN -6.27 0.91 1 117 PHE -1.64 0.24 1 120 GLN 3.85 1.92 1 121 SER 3.50 0.96 1 122 ASN 1.19 0.09 1 123 LEU -5.45 -1.67 1 124 ILE -6.93 -2.60 1 125 VAL -5.67 -4.73 1 126 SER -5.52 -1.57 1 128 SER -3.96 -3.56 1 129 PHE 3.24 2.49 1 130 ASP 1.13 -0.38 1 131 GLU 7.61 2.39 1 132 SER -5.11 -1.27 1 133 VAL -4.16 -2.66 1 134 ARG -4.75 -2.23 1 135 ILE -2.31 -1.42 1 136 TRP -4.67 -2.78 1 137 ASP -2.59 -0.60 1 138 VAL 4.88 4.20 1 139 LYS 4.37 2.93 1 140 THR -1.50 -0.08 1 142 LYS -0.62 -0.45 1 144 LEU 0.75 0.83 1 145 LYS -4.93 -1.07 1 146 THR 0.74 -0.33 1 147 LEU -0.65 -2.41 1 149 ALA -1.49 2.52 1 150 HIS -5.23 0.10 1 151 SER 0.53 0.59 1 154 VAL 1.22 0.23 1 155 SER -2.76 -1.16 1 156 ALA -1.65 0.64 1 157 VAL -7.02 -3.80 1 159 PHE -1.47 0.13 1 160 ASN 2.17 -1.11 1 161 ARG 4.26 2.64 1 162 ASP -1.72 -2.32 1 164 SER 3.00 2.28 1 165 LEU -6.39 -2.22 1 166 ILE -6.37 -2.46 1 167 VAL -5.15 -4.70 1 168 SER -6.58 -1.97 1 169 SER -5.31 -2.38 1 170 SER -1.86 -2.93 1 171 TYR 2.57 1.32 1 172 ASP 2.23 0.93 1 174 LEU -1.18 -0.87 1 176 ARG -4.48 -1.19 1 177 ILE -1.18 -2.00 1 178 TRP -4.38 -3.16 1 179 ASP -2.32 -0.71 1 180 THR 5.41 4.55 1 181 ALA 2.89 2.00 1 182 SER -1.66 0.18 1 184 GLN -0.91 -0.68 1 186 LEU 0.71 0.70 1 187 LYS -2.97 -0.83 1 188 THR -0.41 -0.22 1 189 LEU 1.52 -1.47 1 190 ILE -2.94 -1.03 1 191 ASP -4.27 -2.07 1 192 ASP 3.03 2.36 1 193 ASP -0.50 -0.08 1 194 ASN 0.82 1.57 1 197 VAL 0.66 -1.38 1 198 SER -0.41 -0.07 1 199 PHE 0.16 2.08 1 200 VAL -4.91 -3.18 1 201 LYS -3.17 -0.50 1 202 PHE 1.04 1.99 1 203 SER 0.27 -1.78 1 207 LYS 2.12 1.35 1 208 TYR -7.47 -4.09 1 209 ILE -4.21 -1.42 1 210 LEU -4.51 -2.10 1 211 ALA -6.27 -2.79 1 212 ALA -5.39 -1.84 1 213 THR -5.31 -3.79 1 214 LEU 3.61 -0.99 1 215 ASP -0.50 -2.08 1 216 ASN 2.22 1.08 1 217 THR -0.37 1.33 1 218 LEU -3.23 -1.17 1 219 LYS -4.30 -0.93 1 220 LEU -4.98 -2.18 1 221 TRP -2.32 -0.71 1 222 ASP -0.45 -0.60 1 223 TYR 2.33 1.54 1 224 SER 4.10 2.68 1 225 LYS -0.67 -0.50 1 227 LYS -5.52 -2.43 1 229 LEU -0.54 0.79 1 230 LYS -6.63 -1.97 1 231 THR -3.42 -2.35 1 232 TYR 0.34 -1.71 1 233 THR -4.30 -2.04 1 235 HIS -0.53 -0.25 1 236 LYS -3.43 -2.79 1 237 ASN 0.22 -0.53 1 238 GLU -4.09 -1.42 1 239 LYS -1.77 1.46 1 240 TYR -1.53 0.41 1 242 ILE -1.17 -1.12 1 243 PHE -0.33 0.53 1 244 ALA -5.04 -2.49 1 246 PHE 0.31 -0.37 1 247 SER -1.38 -1.78 1 248 VAL -2.00 -1.80 1 249 THR 3.16 1.74 1 252 LYS 1.17 -2.25 1 253 TRP -2.20 -2.95 1 254 ILE -5.02 -2.44 1 255 VAL -2.54 -0.10 1 256 SER -0.90 -1.56 1 258 SER 3.17 0.16 1 259 GLU -0.15 -1.77 1 260 ASP 5.90 1.73 1 261 ASN -2.90 -1.50 1 262 LEU -0.09 -1.19 1 263 VAL -2.46 -0.16 1 264 TYR -0.86 -1.37 1 265 ILE -4.51 -0.17 1 266 TRP 0.48 1.24 1 267 ASN 3.15 3.95 1 268 LEU 3.42 2.67 1 269 GLN 0.57 0.41 1 270 THR 7.16 1.97 1 271 LYS -1.45 -0.71 1 272 GLU 3.40 1.87 1 273 ILE -0.80 -1.41 1 274 VAL -2.29 1.44 1 275 GLN -3.09 -2.25 1 276 LYS 2.87 -2.01 1 277 LEU -2.45 -1.28 1 278 GLN 3.17 3.17 1 280 HIS 0.63 -1.14 1 281 THR -6.54 -2.83 1 282 ASP 1.89 1.77 1 283 VAL 1.11 -1.11 1 284 VAL -4.28 -2.51 1 285 ILE -1.21 -0.73 1 286 SER -7.55 -3.57 1 287 THR -4.30 -0.85 1 288 ALA 0.48 3.11 1 290 HIS 0.06 0.85 1 292 THR -5.03 -3.13 1 293 GLU 1.32 -1.46 1 294 ASN -4.98 -1.56 1 295 ILE -5.30 -2.16 1 296 ILE -7.25 -3.31 1 297 ALA -4.68 -2.03 1 298 SER -6.94 -1.81 1 299 ALA 3.00 -0.42 1 301 LEU 3.16 3.62 1 302 GLU 2.40 0.91 1 303 ASN -2.55 1.72 1 304 ASP 5.26 2.37 1 305 LYS -3.38 -0.87 1 306 THR -4.69 -3.06 1 307 ILE -2.53 -1.51 1 308 LYS -4.16 -2.34 1 309 LEU -4.82 -3.35 1 310 TRP -5.25 -1.18 1 311 LYS -2.26 -3.85 1 312 SER 1.62 1.40 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 4.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 -3.52 _LACS_plot.Y_axis_chem_shift_offset 0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 245 ASN -7.81 7.77 0 118 ASN 5.57 -6.54 0 158 HIS -4.81 7.12 0 11 VAL 1.44 -0.75 1 12 LYS -1.23 0.25 1 14 ASN -0.23 -1.70 1 15 TYR 3.77 0.02 1 16 ALA -5.03 2.71 1 17 LEU 3.00 -2.01 1 18 LYS -1.32 0.07 1 19 PHE -5.48 4.16 1 20 THR 0.68 -0.12 1 21 LEU 2.29 -3.65 1 22 ALA -3.11 0.81 1 24 HIS 2.42 0.49 1 25 THR 1.04 -0.90 1 26 LYS -6.71 4.21 1 27 ALA 0.14 0.85 1 28 VAL 2.53 -2.08 1 29 SER -2.91 1.77 1 30 SER -2.03 1.28 1 31 VAL -5.59 1.46 1 32 LYS -7.02 4.37 1 33 PHE 0.69 0.20 1 34 SER 3.37 -4.07 1 36 ASN 1.51 -2.75 1 38 GLU 2.02 -0.97 1 39 TRP -3.65 -0.30 1 40 LEU -5.42 2.80 1 42 SER -6.39 3.54 1 43 SER -5.83 3.42 1 44 SER -1.97 -0.82 1 45 ALA 2.52 -1.01 1 46 ASP 1.90 -1.79 1 47 LYS 4.57 -2.67 1 48 LEU -1.52 -0.22 1 52 TRP -6.20 2.01 1 54 ALA 2.06 0.10 1 55 TYR 1.22 -1.00 1 56 ASP -2.84 0.17 1 58 LYS 1.48 -0.84 1 60 GLU -0.82 0.62 1 61 LYS -0.37 -0.21 1 62 THR -1.17 0.30 1 63 ILE 0.33 -0.37 1 64 SER -4.66 2.47 1 66 HIS 4.37 0.00 1 67 LYS 0.52 0.14 1 68 LEU -7.21 4.92 1 70 ILE -3.11 2.26 1 71 SER 1.11 1.14 1 72 ASP -4.56 3.21 1 73 VAL -7.34 2.76 1 74 ALA -4.23 3.39 1 75 TRP -4.38 3.25 1 76 SER 1.26 -1.49 1 77 SER 3.43 -0.72 1 78 ASP -0.25 -0.95 1 80 ASN -0.01 0.86 1 85 ALA -4.41 2.13 1 86 SER -2.94 -0.19 1 87 ASP 2.80 -1.41 1 88 ASP 1.85 -1.90 1 89 LYS 6.65 -3.89 1 90 THR -3.75 2.40 1 93 ILE -1.32 -0.23 1 94 TRP -4.60 1.57 1 95 ASP -1.92 0.70 1 96 VAL 6.65 -2.04 1 97 SER 4.20 -1.35 1 98 SER -1.35 1.39 1 100 LYS -0.92 0.42 1 102 LEU 1.04 -0.22 1 103 LYS -5.55 3.61 1 104 THR 0.76 -0.65 1 105 LEU 4.37 -5.62 1 106 LYS -2.34 1.16 1 108 HIS 4.48 -0.49 1 109 SER -0.52 -0.23 1 110 ASN -4.95 2.62 1 111 TYR -0.26 -0.93 1 112 VAL 3.53 -2.29 1 113 PHE -3.64 3.49 1 116 ASN -6.27 7.18 1 117 PHE -1.64 1.88 1 120 GLN 3.85 -1.93 1 121 SER 3.50 -2.54 1 122 ASN 1.19 -1.10 1 123 LEU -5.45 3.78 1 124 ILE -6.93 4.33 1 125 VAL -5.67 0.94 1 126 SER -5.52 3.95 1 128 SER -3.96 0.40 1 129 PHE 3.24 -0.75 1 130 ASP 1.13 -1.51 1 131 GLU 7.61 -5.22 1 132 SER -5.11 3.84 1 133 VAL -4.16 1.50 1 134 ARG -4.75 2.52 1 135 ILE -2.31 0.89 1 136 TRP -4.67 1.89 1 137 ASP -2.59 1.99 1 138 VAL 4.88 -0.68 1 139 LYS 4.37 -1.44 1 140 THR -1.50 1.42 1 142 LYS -0.62 0.17 1 144 LEU 0.75 0.08 1 145 LYS -4.93 3.86 1 146 THR 0.74 -1.07 1 147 LEU -0.65 -1.76 1 149 ALA -1.49 4.01 1 150 HIS -5.23 5.33 1 151 SER 0.53 0.06 1 154 VAL 1.22 -0.99 1 155 SER -2.76 1.60 1 156 ALA -1.65 2.29 1 157 VAL -7.02 3.22 1 159 PHE -1.47 1.60 1 160 ASN 2.17 -3.28 1 161 ARG 4.26 -1.62 1 162 ASP -1.72 -0.60 1 164 SER 3.00 -0.72 1 165 LEU -6.39 4.17 1 166 ILE -6.37 3.91 1 167 VAL -5.15 0.45 1 168 SER -6.58 4.61 1 169 SER -5.31 2.93 1 170 SER -1.86 -1.07 1 171 TYR 2.57 -1.25 1 172 ASP 2.23 -1.30 1 174 LEU -1.18 0.31 1 176 ARG -4.48 3.29 1 177 ILE -1.18 -0.82 1 178 TRP -4.38 1.22 1 179 ASP -2.32 1.61 1 180 THR 5.41 -0.86 1 181 ALA 2.89 -0.89 1 182 SER -1.66 1.84 1 184 GLN -0.91 0.23 1 186 LEU 0.71 -0.01 1 187 LYS -2.97 2.14 1 188 THR -0.41 0.19 1 189 LEU 1.52 -2.99 1 190 ILE -2.94 1.91 1 191 ASP -4.27 2.20 1 192 ASP 3.03 -0.67 1 193 ASP -0.50 0.42 1 194 ASN 0.82 0.75 1 197 VAL 0.66 -2.04 1 198 SER -0.41 0.34 1 199 PHE 0.16 1.92 1 200 VAL -4.91 1.73 1 201 LYS -3.17 2.67 1 202 PHE 1.04 0.95 1 203 SER 0.27 -2.05 1 207 LYS 2.12 -0.77 1 208 TYR -7.47 3.38 1 209 ILE -4.21 2.79 1 210 LEU -4.51 2.41 1 211 ALA -6.27 3.48 1 212 ALA -5.39 3.55 1 213 THR -5.31 1.52 1 214 LEU 3.61 -4.60 1 215 ASP -0.50 -1.58 1 216 ASN 2.22 -1.14 1 217 THR -0.37 1.70 1 218 LEU -3.23 2.06 1 219 LYS -4.30 3.37 1 220 LEU -4.98 2.80 1 221 TRP -2.32 1.61 1 222 ASP -0.45 -0.15 1 223 TYR 2.33 -0.79 1 224 SER 4.10 -1.42 1 225 LYS -0.67 0.17 1 227 LYS -5.52 3.09 1 229 LEU -0.54 1.33 1 230 LYS -6.63 4.66 1 231 THR -3.42 1.07 1 232 TYR 0.34 -2.05 1 233 THR -4.30 2.26 1 235 HIS -0.53 0.28 1 236 LYS -3.43 0.64 1 237 ASN 0.22 -0.75 1 238 GLU -4.09 2.67 1 239 LYS -1.77 3.23 1 240 TYR -1.53 1.94 1 242 ILE -1.17 0.05 1 243 PHE -0.33 0.86 1 244 ALA -5.04 2.55 1 246 PHE 0.31 -0.68 1 247 SER -1.38 -0.40 1 248 VAL -2.00 0.20 1 249 THR 3.16 -1.42 1 252 LYS 1.17 -3.42 1 253 TRP -2.20 -0.75 1 254 ILE -5.02 2.58 1 255 VAL -2.54 2.44 1 256 SER -0.90 -0.66 1 258 SER 3.17 -3.01 1 259 GLU -0.15 -1.62 1 260 ASP 5.90 -4.17 1 261 ASN -2.90 1.40 1 262 LEU -0.09 -1.10 1 263 VAL -2.46 2.30 1 264 TYR -0.86 -0.51 1 265 ILE -4.51 4.34 1 266 TRP 0.48 0.76 1 267 ASN 3.15 0.80 1 268 LEU 3.42 -0.75 1 269 GLN 0.57 -0.16 1 270 THR 7.16 -5.19 1 271 LYS -1.45 0.74 1 272 GLU 3.40 -1.53 1 273 ILE -0.80 -0.61 1 274 VAL -2.29 3.73 1 275 GLN -3.09 0.84 1 276 LYS 2.87 -4.88 1 277 LEU -2.45 1.17 1 278 GLN 3.17 0.00 1 280 HIS 0.63 -1.77 1 281 THR -6.54 3.71 1 282 ASP 1.89 -0.12 1 283 VAL 1.11 -2.22 1 284 VAL -4.28 1.77 1 285 ILE -1.21 0.48 1 286 SER -7.55 3.98 1 287 THR -4.30 3.45 1 288 ALA 0.48 2.63 1 290 HIS 0.06 0.79 1 292 THR -5.03 1.90 1 293 GLU 1.32 -2.78 1 294 ASN -4.98 3.42 1 295 ILE -5.30 3.14 1 296 ILE -7.25 3.94 1 297 ALA -4.68 2.65 1 298 SER -6.94 5.13 1 299 ALA 3.00 -3.42 1 301 LEU 3.16 0.46 1 302 GLU 2.40 -1.49 1 303 ASN -2.55 4.27 1 304 ASP 5.26 -2.89 1 305 LYS -3.38 2.51 1 306 THR -4.69 1.63 1 307 ILE -2.53 1.02 1 308 LYS -4.16 1.82 1 309 LEU -4.82 1.47 1 310 TRP -5.25 4.07 1 311 LYS -2.26 -1.59 1 312 SER 1.62 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -1.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.97 _LACS_plot.Line_2_terminator_val_x_2 7.61 _LACS_plot.Line_2_terminator_val_y_2 0.26 _LACS_plot.Y_axis_chem_shift_offset 0.69 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 LYS -7.02 2.33 0 131 GLU 7.61 -2.82 0 11 VAL 1.44 -0.87 1 12 LYS -1.23 -2.09 1 14 ASN -0.23 0.16 1 15 TYR 3.77 0.86 1 16 ALA -5.03 -1.11 1 17 LEU 3.00 -0.99 1 18 LYS -1.32 -0.96 1 19 PHE -5.48 -2.16 1 20 THR 0.68 -1.65 1 21 LEU 2.29 -2.45 1 22 ALA -3.11 -0.93 1 24 HIS 2.42 2.86 1 25 THR 1.04 0.12 1 26 LYS -6.71 -3.19 1 27 ALA 0.14 -0.88 1 28 VAL 2.53 -3.11 1 29 SER -2.91 -1.59 1 30 SER -2.03 -1.64 1 31 VAL -5.59 -1.25 1 33 PHE 0.69 0.02 1 34 SER 3.37 2.16 1 36 ASN 1.51 1.42 1 38 GLU 2.02 1.34 1 39 TRP -3.65 -0.65 1 42 SER -6.39 -1.98 1 43 SER -5.83 -0.03 1 44 SER -1.97 -0.15 1 45 ALA 2.52 -1.19 1 46 ASP 1.90 -0.62 1 47 LYS 4.57 -1.10 1 52 TRP -6.20 0.97 1 54 ALA 2.06 -2.09 1 55 TYR 1.22 1.83 1 56 ASP -2.84 -0.48 1 58 LYS 1.48 1.65 1 60 GLU -0.82 -1.54 1 61 LYS -0.37 -3.82 1 62 THR -1.17 -1.11 1 63 ILE 0.33 -2.60 1 66 HIS 4.37 2.96 1 67 LYS 0.52 -0.17 1 68 LEU -7.21 -2.31 1 70 ILE -3.11 0.38 1 71 SER 1.11 -2.76 1 72 ASP -4.56 -2.62 1 73 VAL -7.34 -3.73 1 74 ALA -4.23 -2.17 1 75 TRP -4.38 1.79 1 76 SER 1.26 2.23 1 77 SER 3.43 0.61 1 78 ASP -0.25 -0.33 1 80 ASN -0.01 0.20 1 85 ALA -4.41 -2.29 1 86 SER -2.94 1.15 1 87 ASP 2.80 -0.96 1 88 ASP 1.85 -1.22 1 89 LYS 6.65 -0.76 1 90 THR -3.75 -0.51 1 93 ILE -1.32 -1.72 1 94 TRP -4.60 -0.35 1 95 ASP -1.92 0.15 1 96 VAL 6.65 0.38 1 97 SER 4.20 1.04 1 98 SER -1.35 1.95 1 100 LYS -0.92 -0.63 1 102 LEU 1.04 0.30 1 103 LYS -5.55 -2.69 1 104 THR 0.76 -2.04 1 105 LEU 4.37 -2.10 1 106 LYS -2.34 -0.89 1 108 HIS 4.48 2.68 1 109 SER -0.52 -0.73 1 110 ASN -4.95 -1.77 1 111 TYR -0.26 1.14 1 112 VAL 3.53 -2.22 1 113 PHE -3.64 -3.08 1 116 ASN -6.27 0.13 1 117 PHE -1.64 2.02 1 118 ASN 5.57 -0.45 1 120 GLN 3.85 -0.40 1 121 SER 3.50 -2.93 1 122 ASN 1.19 0.00 1 123 LEU -5.45 -1.99 1 124 ILE -6.93 -1.64 1 125 VAL -5.67 -3.88 1 126 SER -5.52 -1.85 1 128 SER -3.96 0.36 1 129 PHE 3.24 -1.81 1 130 ASP 1.13 -0.20 1 132 SER -5.11 -1.64 1 133 VAL -4.16 -0.87 1 134 ARG -4.75 -2.76 1 135 ILE -2.31 -1.55 1 136 TRP -4.67 -1.00 1 137 ASP -2.59 0.27 1 138 VAL 4.88 -0.08 1 139 LYS 4.37 2.43 1 140 THR -1.50 2.50 1 142 LYS -0.62 -0.64 1 144 LEU 0.75 0.31 1 145 LYS -4.93 -2.82 1 146 THR 0.74 -1.23 1 147 LEU -0.65 0.15 1 149 ALA -1.49 -1.56 1 150 HIS -5.23 -0.33 1 151 SER 0.53 -1.05 1 154 VAL 1.22 -2.13 1 155 SER -2.76 -0.97 1 156 ALA -1.65 -2.81 1 157 VAL -7.02 -0.96 1 158 HIS -4.81 0.55 1 159 PHE -1.47 0.06 1 160 ASN 2.17 2.65 1 161 ARG 4.26 -0.08 1 162 ASP -1.72 0.99 1 164 SER 3.00 -0.32 1 165 LEU -6.39 -2.08 1 166 ILE -6.37 -1.02 1 167 VAL -5.15 -4.39 1 168 SER -6.58 -1.96 1 169 SER -5.31 -0.50 1 170 SER -1.86 -0.13 1 171 TYR 2.57 -1.33 1 172 ASP 2.23 0.41 1 174 LEU -1.18 -1.32 1 176 ARG -4.48 -3.80 1 177 ILE -1.18 -2.02 1 178 TRP -4.38 -0.72 1 179 ASP -2.32 0.06 1 180 THR 5.41 0.31 1 181 ALA 2.89 1.79 1 182 SER -1.66 2.48 1 184 GLN -0.91 -0.38 1 186 LEU 0.71 -0.03 1 187 LYS -2.97 -3.19 1 188 THR -0.41 -1.39 1 189 LEU 1.52 -2.84 1 190 ILE -2.94 -2.37 1 191 ASP -4.27 0.11 1 192 ASP 3.03 -0.10 1 193 ASP -0.50 -1.32 1 194 ASN 0.82 -2.01 1 197 VAL 0.66 -0.59 1 198 SER -0.41 -1.68 1 199 PHE 0.16 -3.31 1 200 VAL -4.91 -4.44 1 201 LYS -3.17 -0.75 1 202 PHE 1.04 1.64 1 203 SER 0.27 0.13 1 207 LYS 2.12 -1.05 1 208 TYR -7.47 -0.17 1 209 ILE -4.21 -2.04 1 210 LEU -4.51 -3.97 1 211 ALA -6.27 -1.84 1 212 ALA -5.39 -2.12 1 213 THR -5.31 1.99 1 214 LEU 3.61 -1.75 1 215 ASP -0.50 1.27 1 216 ASN 2.22 -1.45 1 217 THR -0.37 -2.49 1 218 LEU -3.23 -1.91 1 219 LYS -4.30 -2.80 1 220 LEU -4.98 -2.29 1 221 TRP -2.32 1.12 1 222 ASP -0.45 1.23 1 223 TYR 2.33 -0.59 1 224 SER 4.10 1.60 1 225 LYS -0.67 0.88 1 227 LYS -5.52 -2.36 1 229 LEU -0.54 -0.20 1 230 LYS -6.63 -2.94 1 231 THR -3.42 1.07 1 232 TYR 0.34 -0.98 1 233 THR -4.30 -0.02 1 235 HIS -0.53 -0.63 1 236 LYS -3.43 -1.18 1 237 ASN 0.22 -4.61 1 238 GLU -4.09 -0.69 1 239 LYS -1.77 -1.15 1 240 TYR -1.53 -1.06 1 242 ILE -1.17 -0.39 1 243 PHE -0.33 -1.70 1 244 ALA -5.04 -2.00 1 245 ASN -7.81 -1.49 1 246 PHE 0.31 -1.58 1 247 SER -1.38 2.46 1 248 VAL -2.00 0.10 1 249 THR 3.16 0.92 1 252 LYS 1.17 -2.24 1 253 TRP -2.20 -1.64 1 254 ILE -5.02 -1.11 1 255 VAL -2.54 -0.11 1 256 SER -0.90 1.28 1 258 SER 3.17 -2.48 1 259 GLU -0.15 -0.75 1 260 ASP 5.90 -1.29 1 261 ASN -2.90 -2.15 1 262 LEU -0.09 -0.84 1 263 VAL -2.46 -2.40 1 264 TYR -0.86 -0.49 1 265 ILE -4.51 1.52 1 266 TRP 0.48 0.74 1 267 ASN 3.15 0.57 1 268 LEU 3.42 2.48 1 269 GLN 0.57 1.92 1 270 THR 7.16 -1.89 1 271 LYS -1.45 0.65 1 272 GLU 3.40 0.73 1 273 ILE -0.80 -0.54 1 274 VAL -2.29 -3.46 1 275 GLN -3.09 -0.75 1 276 LYS 2.87 -1.56 1 277 LEU -2.45 -1.25 1 278 GLN 3.17 3.03 1 280 HIS 0.63 -0.93 1 281 THR -6.54 -3.30 1 282 ASP 1.89 -0.83 1 283 VAL 1.11 -2.38 1 284 VAL -4.28 -2.60 1 285 ILE -1.21 -1.55 1 286 SER -7.55 -0.83 1 287 THR -4.30 -2.19 1 288 ALA 0.48 1.13 1 290 HIS 0.06 -0.48 1 292 THR -5.03 -1.10 1 293 GLU 1.32 -1.92 1 294 ASN -4.98 -1.37 1 295 ILE -5.30 -0.79 1 296 ILE -7.25 -2.07 1 297 ALA -4.68 -2.25 1 298 SER -6.94 -2.14 1 299 ALA 3.00 -0.01 1 301 LEU 3.16 -1.34 1 302 GLU 2.40 -1.14 1 303 ASN -2.55 -1.59 1 304 ASP 5.26 -1.61 1 305 LYS -3.38 -1.58 1 306 THR -4.69 -0.85 1 307 ILE -2.53 -2.40 1 308 LYS -4.16 -2.15 1 309 LEU -5.25 -1.62 1 311 LYS -2.26 -0.31 1 312 SER 1.62 -0.80 1 stop_ save_