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 bmr18392_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.25 _LACS_plot.Line_1_terminator_val_y_1 -3.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.01 _LACS_plot.Line_2_terminator_val_x_2 9.49 _LACS_plot.Line_2_terminator_val_y_2 6.33 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 PHE 9.49 1.08 0 67 SER 3.59 7.62 0 10 VAL -4.47 -2.55 1 11 GLU -2.84 -1.24 1 12 VAL 1.83 -0.08 1 14 ALA -5.99 -3.29 1 15 ASN -1.83 -2.97 1 16 ILE -4.81 -1.76 1 18 THR -3.69 -2.54 1 23 GLU 4.62 2.88 1 25 ALA 5.62 2.69 1 26 GLU 4.01 2.33 1 27 ARG 4.17 2.45 1 28 ASN -0.89 0.18 1 30 ALA 0.68 0.82 1 31 GLU 0.51 -1.71 1 33 VAL -1.38 -1.21 1 35 LEU 3.08 1.76 1 36 TYR -1.95 -4.61 1 37 ARG 0.35 -0.63 1 39 GLU 3.81 2.37 1 40 PHE -1.42 0.14 1 41 LEU 0.39 -0.64 1 42 PHE 0.55 1.08 1 43 MET -0.97 -0.52 1 44 ASP 3.24 0.82 1 45 ARG -2.19 -1.89 1 46 ASP -0.28 -0.23 1 47 ALA -4.51 -2.57 1 48 LEU 0.98 -0.16 1 50 THR -2.61 -1.29 1 51 GLU 3.45 2.89 1 52 GLU 3.99 2.65 1 53 GLU -0.79 -1.03 1 56 ALA 4.35 2.12 1 57 ALA 3.51 1.89 1 58 TYR 2.05 -0.84 1 59 LYS 5.04 3.01 1 60 ALA 4.17 1.96 1 61 VAL 6.48 4.41 1 62 ALA 4.04 2.07 1 63 GLU 2.70 1.97 1 64 ALA 2.62 1.46 1 68 GLN -0.11 -0.45 1 69 ALA -2.00 -1.72 1 70 VAL -2.74 -1.97 1 71 ILE 2.96 0.12 1 72 VAL 1.45 -0.25 1 73 ARG -3.32 -2.37 1 74 THR 4.03 1.48 1 75 MET 2.78 2.18 1 77 ILE -3.51 -1.57 1 80 ASP 1.54 -0.17 1 81 LYS -1.23 -2.35 1 82 GLU 0.77 -0.43 1 83 LEU -1.81 -1.58 1 85 TYR 1.46 -1.19 1 86 MET 0.00 -1.50 1 87 ASN 1.57 0.01 1 88 PHE 2.37 0.92 1 90 LYS 2.32 -0.14 1 91 GLU -4.45 -1.93 1 92 GLU 1.66 1.32 1 93 ASN -5.26 -2.43 1 96 LEU -1.68 -2.14 1 98 TRP 4.20 0.84 1 99 ARG -5.12 -3.26 1 100 ALA 2.02 0.40 1 101 ILE -0.91 -0.72 1 102 ARG 5.19 2.49 1 103 ILE 4.69 2.34 1 104 ALA 2.13 1.27 1 105 MET 3.24 2.14 1 106 ASP 0.56 1.72 1 107 ARG 1.06 -2.67 1 108 LYS 5.76 1.80 1 109 GLU 5.39 2.48 1 110 ILE 4.78 3.31 1 111 LEU 3.44 2.29 1 112 ARG 5.18 3.17 1 113 ASP 5.17 3.55 1 114 GLN 5.54 3.47 1 115 LEU 5.56 2.92 1 116 ARG 7.31 4.96 1 117 ALA 3.66 3.73 1 118 ILE 6.46 5.22 1 119 LEU 4.17 2.63 1 120 ARG 2.59 3.18 1 121 ALA 3.09 2.61 1 122 SER 4.36 2.83 1 123 ALA 1.27 0.01 1 124 PHE 0.90 0.41 1 126 LYS 0.53 -2.06 1 127 LEU -4.31 -2.72 1 128 ARG -5.05 -2.60 1 129 ILE -1.07 -0.30 1 130 MET -5.62 -2.35 1 131 PHE -4.52 -3.57 1 134 ILE -1.25 -3.62 1 135 ILE -2.52 -0.20 1 136 SER -3.92 -1.54 1 137 VAL 5.36 3.35 1 138 GLU 7.29 4.94 1 139 GLU 2.23 2.54 1 140 VAL 6.91 4.25 1 141 ARG 5.87 3.99 1 142 ALA 4.23 2.20 1 143 LEU 4.37 2.37 1 144 ARG 6.30 3.69 1 145 LYS 5.32 3.03 1 146 GLU 4.04 1.56 1 147 ILE 6.83 4.67 1 148 GLU 4.04 2.16 1 149 ILE 6.36 3.78 1 150 TYR 3.35 0.13 1 151 LYS 3.88 3.53 1 152 GLN 5.53 2.65 1 153 GLU 3.66 2.63 1 154 LEU 6.37 2.99 1 155 ARG 5.36 3.63 1 156 ASP 4.53 2.89 1 157 GLU -0.84 -0.43 1 159 LYS -2.55 -1.25 1 160 ALA -0.82 -0.86 1 161 PHE -3.58 -1.86 1 162 ASP -0.52 -1.58 1 163 GLU 3.31 1.91 1 164 SER -1.23 -1.88 1 165 ILE 1.78 1.07 1 166 GLU -2.67 -0.89 1 167 ILE -4.05 -2.58 1 175 ALA 2.01 2.60 1 176 ALA 3.40 1.61 1 177 ALA 2.71 1.28 1 178 THR 5.66 4.32 1 179 ILE 0.92 -1.29 1 180 ALA 4.44 3.46 1 181 ARG 5.87 2.62 1 182 HIS 0.33 2.56 1 183 LEU 3.46 2.42 1 184 ALA 3.25 1.20 1 185 LYS 1.63 1.11 1 186 GLU -1.93 -0.66 1 189 PHE 0.13 -1.94 1 190 PHE -7.25 -3.88 1 191 SER -1.78 -1.44 1 192 ILE 1.57 -0.31 1 202 LEU 1.74 -1.17 1 203 ALA 3.21 -0.56 1 204 VAL -4.97 -2.24 1 205 ASP -3.30 -3.38 1 206 ARG 3.35 1.67 1 208 ASN -1.17 -1.74 1 209 ASP 3.20 2.30 1 210 MET 3.04 1.01 1 211 ILE -1.77 -1.92 1 215 TYR 3.83 1.50 1 216 GLN -2.37 -1.81 1 218 MET 1.27 -2.37 1 219 SER -1.63 -0.83 1 221 SER 4.19 1.89 1 222 VAL 5.93 4.18 1 223 LEU 4.63 2.68 1 224 ASN 4.88 4.39 1 225 LEU 4.49 2.92 1 226 ILE 7.06 4.79 1 227 LYS 3.36 1.64 1 228 GLN 4.48 3.02 1 229 VAL 6.09 3.98 1 230 ILE 5.18 3.93 1 231 ASP 5.64 3.13 1 232 ALA 3.37 1.87 1 233 SER 4.14 3.13 1 234 HIS 2.36 1.19 1 235 ALA 4.11 1.90 1 236 GLU -2.74 -2.94 1 238 LYS -0.59 -3.02 1 239 TRP -4.57 -3.17 1 240 THR -1.34 0.73 1 242 MET -1.73 0.86 1 245 GLU -1.67 1.78 1 246 LEU 1.81 1.50 1 247 ALA 3.09 1.64 1 249 ASP -2.26 -1.65 1 250 GLU 2.59 1.08 1 251 ARG 3.57 1.30 1 252 ALA -2.03 -1.33 1 253 THR 6.74 5.73 1 254 LEU 4.94 3.20 1 256 LEU 3.93 2.33 1 257 LEU 3.12 2.81 1 259 MET 1.24 2.11 1 261 LEU 1.72 1.46 1 262 ASP 0.62 2.64 1 263 GLU -1.73 -1.92 1 264 PHE -4.29 -1.93 1 265 SER -1.52 -1.33 1 266 MET -4.12 -1.29 1 267 SER 1.59 0.85 1 268 ALA 4.19 2.76 1 269 ILE 3.15 1.66 1 270 SER 1.73 1.77 1 271 ILE 3.87 2.03 1 273 ARG 5.65 1.54 1 274 ILE 6.54 4.87 1 275 LYS 5.10 3.30 1 276 LYS 5.15 3.91 1 277 ILE 6.05 4.61 1 278 ILE 2.37 1.20 1 279 ARG -1.50 -0.33 1 280 ASN -0.43 0.42 1 281 THR -1.29 -1.03 1 282 ASN 3.18 2.59 1 283 PHE 4.51 2.64 1 284 GLU 3.23 2.20 1 285 ASP 4.54 1.84 1 286 ALA 8.16 2.83 1 287 LYS 5.39 3.37 1 288 VAL 5.81 1.89 1 289 LEU 4.37 2.38 1 290 ALA 3.77 2.38 1 291 GLU 3.40 2.27 1 292 GLN 4.33 2.75 1 293 ALA 4.58 1.58 1 294 LEU -0.03 -0.88 1 295 ALA 0.08 -1.17 1 296 GLN -6.34 -3.59 1 298 THR 2.95 5.70 1 299 THR 4.47 3.48 1 300 ASP 3.13 2.92 1 301 GLU 5.37 4.82 1 302 LEU 4.63 1.21 1 303 MET 6.31 4.84 1 304 THR 4.24 2.85 1 305 LEU 5.91 4.19 1 306 VAL 4.31 2.76 1 307 ASN 4.31 2.52 1 308 LYS 3.49 3.12 1 309 PHE 4.44 3.35 1 310 ILE 2.48 1.70 1 311 GLU 1.54 0.94 1 312 GLU 0.99 -1.09 1 313 LYS 0.93 0.41 1 314 THR 0.80 -0.31 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18392_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.25 _LACS_plot.Line_1_terminator_val_y_1 3.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.01 _LACS_plot.Line_2_terminator_val_x_2 9.49 _LACS_plot.Line_2_terminator_val_y_2 -3.16 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 PHE 9.49 -8.41 0 67 SER 3.59 4.03 0 10 VAL -4.47 1.92 1 11 GLU -2.84 1.60 1 12 VAL 1.83 -1.91 1 14 ALA -5.99 2.70 1 15 ASN -1.83 -1.14 1 16 ILE -4.81 3.05 1 18 THR -3.69 1.15 1 23 GLU 4.62 -1.74 1 25 ALA 5.62 -2.93 1 26 GLU 4.01 -1.68 1 27 ARG 4.17 -1.72 1 28 ASN -0.89 1.07 1 30 ALA 0.68 0.14 1 31 GLU 0.51 -2.22 1 33 VAL -1.38 0.17 1 35 LEU 3.08 -1.32 1 36 TYR -1.95 -2.66 1 37 ARG 0.35 -0.98 1 39 GLU 3.81 -1.44 1 40 PHE -1.42 1.56 1 41 LEU 0.39 -1.03 1 42 PHE 0.55 0.53 1 43 MET -0.97 0.45 1 44 ASP 3.24 -2.42 1 45 ARG -2.19 0.30 1 46 ASP -0.28 0.05 1 47 ALA -4.51 1.94 1 48 LEU 0.98 -1.14 1 50 THR -2.61 1.32 1 51 GLU 3.45 -0.56 1 52 GLU 3.99 -1.34 1 53 GLU -0.79 -0.24 1 56 ALA 4.35 -2.23 1 57 ALA 3.51 -1.62 1 58 TYR 2.05 -2.89 1 59 LYS 5.04 -2.03 1 60 ALA 4.17 -2.21 1 61 VAL 6.48 -2.07 1 62 ALA 4.04 -1.97 1 63 GLU 2.70 -0.73 1 64 ALA 2.62 -1.16 1 68 GLN -0.11 -0.34 1 69 ALA -2.00 0.28 1 70 VAL -2.74 0.77 1 71 ILE 2.96 -2.84 1 72 VAL 1.45 -1.70 1 73 ARG -3.32 0.95 1 74 THR 4.03 -2.55 1 75 MET 2.78 -0.60 1 77 ILE -3.51 1.94 1 80 ASP 1.54 -1.71 1 81 LYS -1.23 -1.12 1 82 GLU 0.77 -1.20 1 83 LEU -1.81 0.23 1 85 TYR 1.46 -2.65 1 86 MET 0.00 -1.50 1 87 ASN 1.57 -1.56 1 88 PHE 2.37 -1.45 1 90 LYS 2.32 -2.46 1 91 GLU -4.45 2.52 1 92 GLU 1.66 -0.34 1 93 ASN -5.26 2.83 1 96 LEU -1.68 -0.46 1 98 TRP 4.20 -3.36 1 99 ARG -5.12 1.86 1 100 ALA 2.02 -1.62 1 101 ILE -0.91 0.19 1 102 ARG 5.19 -2.70 1 103 ILE 4.69 -2.35 1 104 ALA 2.13 -0.86 1 105 MET 3.24 -1.10 1 106 ASP 0.56 1.16 1 107 ARG 1.06 -3.73 1 108 LYS 5.76 -3.96 1 109 GLU 5.39 -2.91 1 110 ILE 4.78 -1.47 1 111 LEU 3.44 -1.15 1 112 ARG 5.18 -2.01 1 113 ASP 5.17 -1.62 1 114 GLN 5.54 -2.07 1 115 LEU 5.56 -2.64 1 116 ARG 7.31 -2.35 1 117 ALA 3.66 0.07 1 118 ILE 6.46 -1.24 1 119 LEU 4.17 -1.54 1 120 ARG 2.59 0.59 1 121 ALA 3.09 -0.48 1 122 SER 4.36 -1.53 1 123 ALA 1.27 -1.26 1 124 PHE 0.90 -0.49 1 126 LYS 0.53 -2.59 1 127 LEU -4.31 1.59 1 128 ARG -5.05 2.45 1 129 ILE -1.07 0.77 1 130 MET -5.62 3.27 1 131 PHE -4.52 0.95 1 134 ILE -1.25 -2.37 1 135 ILE -2.52 2.32 1 136 SER -3.92 2.38 1 137 VAL 5.36 -2.01 1 138 GLU 7.29 -2.35 1 139 GLU 2.23 0.31 1 140 VAL 6.91 -2.66 1 141 ARG 5.87 -1.88 1 142 ALA 4.23 -2.03 1 143 LEU 4.37 -2.00 1 144 ARG 6.30 -2.61 1 145 LYS 5.32 -2.29 1 146 GLU 4.04 -2.48 1 147 ILE 6.83 -2.16 1 148 GLU 4.04 -1.88 1 149 ILE 6.36 -2.58 1 150 TYR 3.35 -3.22 1 151 LYS 3.88 -0.35 1 152 GLN 5.53 -2.88 1 153 GLU 3.66 -1.03 1 154 LEU 6.37 -3.38 1 155 ARG 5.36 -1.73 1 156 ASP 4.53 -1.64 1 157 GLU -0.84 0.41 1 159 LYS -2.55 1.30 1 160 ALA -0.82 -0.04 1 161 PHE -3.58 1.72 1 162 ASP -0.52 -1.06 1 163 GLU 3.31 -1.40 1 164 SER -1.23 -0.65 1 165 ILE 1.78 -0.71 1 166 GLU -2.67 1.78 1 167 ILE -4.05 1.47 1 175 ALA 2.01 0.59 1 176 ALA 3.40 -1.79 1 177 ALA 2.71 -1.43 1 178 THR 5.66 -1.34 1 179 ILE 0.92 -2.21 1 180 ALA 4.44 -0.98 1 181 ARG 5.87 -3.25 1 182 HIS 0.33 2.23 1 183 LEU 3.46 -1.04 1 184 ALA 3.25 -2.05 1 185 LYS 1.63 -0.52 1 186 GLU -1.93 1.27 1 189 PHE 0.13 -2.07 1 190 PHE -7.25 3.37 1 191 SER -1.78 0.34 1 192 ILE 1.57 -1.88 1 202 LEU 1.74 -2.91 1 203 ALA 3.21 -3.77 1 204 VAL -4.97 2.73 1 205 ASP -3.30 -0.08 1 206 ARG 3.35 -1.68 1 208 ASN -1.17 -0.57 1 209 ASP 3.20 -0.90 1 210 MET 3.04 -2.03 1 211 ILE -1.77 -0.15 1 215 TYR 3.83 -2.33 1 216 GLN -2.37 0.56 1 218 MET 1.27 -3.64 1 219 SER -1.63 0.80 1 221 SER 4.19 -2.30 1 222 VAL 5.93 -1.75 1 223 LEU 4.63 -1.95 1 224 ASN 4.88 -0.49 1 225 LEU 4.49 -1.57 1 226 ILE 7.06 -2.27 1 227 LYS 3.36 -1.72 1 228 GLN 4.48 -1.46 1 229 VAL 6.09 -2.11 1 230 ILE 5.18 -1.25 1 231 ASP 5.64 -2.51 1 232 ALA 3.37 -1.50 1 233 SER 4.14 -1.01 1 234 HIS 2.36 -1.17 1 235 ALA 4.11 -2.21 1 236 GLU -2.74 -0.20 1 238 LYS -0.59 -2.43 1 239 TRP -4.57 1.40 1 240 THR -1.34 2.07 1 242 MET -1.73 2.59 1 245 GLU -1.67 3.45 1 246 LEU 1.81 -0.31 1 247 ALA 3.09 -1.45 1 249 ASP -2.26 0.61 1 250 GLU 2.59 -1.51 1 251 ARG 3.57 -2.27 1 252 ALA -2.03 0.70 1 253 THR 6.74 -1.01 1 254 LEU 4.94 -1.74 1 256 LEU 3.93 -1.60 1 257 LEU 3.12 -0.31 1 259 MET 1.24 0.87 1 261 LEU 1.72 -0.26 1 262 ASP 0.62 2.02 1 263 GLU -1.73 -0.19 1 264 PHE -4.29 2.36 1 265 SER -1.52 0.19 1 266 MET -4.12 2.83 1 267 SER 1.59 -0.74 1 268 ALA 4.19 -1.43 1 269 ILE 3.15 -1.49 1 270 SER 1.73 0.04 1 271 ILE 3.87 -1.84 1 273 ARG 5.65 -4.11 1 274 ILE 6.54 -1.67 1 275 LYS 5.10 -1.80 1 276 LYS 5.15 -1.24 1 277 ILE 6.05 -1.44 1 278 ILE 2.37 -1.17 1 279 ARG -1.50 1.17 1 280 ASN -0.43 0.85 1 281 THR -1.29 0.26 1 282 ASN 3.18 -0.59 1 283 PHE 4.51 -1.87 1 284 GLU 3.23 -1.03 1 285 ASP 4.54 -2.70 1 286 ALA 8.16 -5.33 1 287 LYS 5.39 -2.02 1 288 VAL 5.81 -3.92 1 289 LEU 4.37 -1.99 1 290 ALA 3.77 -1.39 1 291 GLU 3.40 -1.13 1 292 GLN 4.33 -1.58 1 293 ALA 4.58 -3.00 1 294 LEU -0.03 -0.85 1 295 ALA 0.08 -1.25 1 296 GLN -6.34 2.75 1 298 THR 2.95 2.75 1 299 THR 4.47 -0.99 1 300 ASP 3.13 -0.21 1 301 GLU 5.37 -0.55 1 302 LEU 4.63 -3.42 1 303 MET 6.31 -1.47 1 304 THR 4.24 -1.39 1 305 LEU 5.91 -1.72 1 306 VAL 4.31 -1.55 1 307 ASN 4.31 -1.79 1 308 LYS 3.49 -0.37 1 309 PHE 4.44 -1.09 1 310 ILE 2.48 -0.78 1 311 GLU 1.54 -0.60 1 312 GLU 0.99 -2.08 1 313 LYS 0.93 -0.52 1 314 THR 0.80 -1.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18392_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.25 _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 0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.92 _LACS_plot.Line_2_terminator_val_x_2 8.16 _LACS_plot.Line_2_terminator_val_y_2 2.70 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 190 PHE -7.25 -4.70 0 14 ALA -5.99 -5.80 0 296 GLN -6.34 0.80 0 35 LEU 3.08 -5.10 0 126 LYS 0.53 -6.30 0 10 VAL -4.47 -1.70 1 11 GLU -2.84 -2.30 1 12 VAL 1.83 0.00 1 15 ASN -1.83 1.80 1 16 ILE -4.81 -0.50 1 18 THR -3.69 -2.00 1 25 ALA 5.62 -1.50 1 26 GLU 4.01 2.10 1 27 ARG 4.17 4.90 1 28 ASN -0.89 2.40 1 30 ALA 0.68 -2.40 1 31 GLU 0.51 1.50 1 33 VAL -1.38 -4.30 1 36 TYR -1.95 -3.50 1 37 ARG 0.35 -1.70 1 40 PHE -1.42 3.80 1 41 LEU 0.39 -1.20 1 43 MET -0.97 0.40 1 44 ASP 3.24 -0.70 1 45 ARG -2.19 -2.00 1 46 ASP -0.28 -1.60 1 47 ALA -4.51 -3.10 1 48 LEU 0.98 -1.30 1 50 THR -2.61 2.80 1 51 GLU 3.45 -0.90 1 52 GLU 3.99 1.90 1 53 GLU -0.79 1.70 1 56 ALA 4.35 -2.30 1 57 ALA 3.51 2.70 1 58 TYR 2.05 4.40 1 59 LYS 5.04 1.70 1 60 ALA 4.17 -0.80 1 61 VAL 6.48 5.00 1 62 ALA 4.04 -1.50 1 63 GLU 2.70 3.40 1 64 ALA 2.62 2.10 1 67 SER 3.59 0.40 1 68 GLN -0.11 -1.30 1 69 ALA -2.00 -3.80 1 70 VAL -2.74 0.80 1 71 ILE 2.96 -1.20 1 72 VAL 1.45 -2.90 1 73 ARG -3.32 -2.20 1 74 THR 4.03 1.70 1 75 MET 2.78 -3.60 1 80 ASP 1.54 -2.00 1 81 LYS -1.23 -0.50 1 82 GLU 0.77 -1.20 1 83 LEU -1.81 0.00 1 85 TYR 1.46 2.00 1 86 MET 0.00 -0.40 1 88 PHE 2.37 0.30 1 90 LYS 2.32 -0.70 1 91 GLU -4.45 0.10 1 92 GLU 1.66 -0.50 1 93 ASN -5.26 0.80 1 96 LEU -1.68 -1.60 1 98 TRP 4.20 -2.10 1 99 ARG -5.12 -3.90 1 100 ALA 2.02 -2.80 1 101 ILE -0.91 0.50 1 103 ILE 4.69 2.10 1 104 ALA 2.13 0.10 1 105 MET 3.24 0.10 1 106 ASP 0.56 1.40 1 107 ARG 1.06 0.70 1 108 LYS 5.76 -1.00 1 109 GLU 5.39 1.10 1 110 ILE 4.78 1.50 1 111 LEU 3.44 2.00 1 112 ARG 5.18 1.10 1 113 ASP 5.17 1.60 1 114 GLN 5.54 1.90 1 115 LEU 5.56 1.10 1 116 ARG 7.31 3.80 1 117 ALA 3.66 1.00 1 118 ILE 6.46 3.70 1 119 LEU 4.17 0.50 1 120 ARG 2.59 4.90 1 121 ALA 3.09 2.90 1 122 SER 4.36 3.80 1 123 ALA 1.27 -4.00 1 124 PHE 0.90 2.00 1 127 LEU -4.31 -4.30 1 128 ARG -5.05 0.10 1 129 ILE -1.07 -1.60 1 130 MET -5.62 -2.30 1 131 PHE -4.52 -2.30 1 134 ILE -1.25 -3.00 1 135 ILE -2.52 2.10 1 136 SER -3.92 0.50 1 137 VAL 5.36 -2.80 1 138 GLU 7.29 1.20 1 139 GLU 2.23 3.80 1 140 VAL 6.91 2.30 1 141 ARG 5.87 1.50 1 142 ALA 4.23 1.70 1 143 LEU 4.37 3.30 1 144 ARG 6.30 2.80 1 145 LYS 5.32 2.10 1 146 GLU 4.04 2.50 1 147 ILE 6.83 1.00 1 148 GLU 4.04 0.90 1 149 ILE 6.36 3.80 1 150 TYR 3.35 3.20 1 151 LYS 3.88 2.20 1 152 GLN 5.53 1.80 1 153 GLU 3.66 1.30 1 154 LEU 6.37 1.70 1 155 ARG 5.36 3.80 1 156 ASP 4.53 5.10 1 157 GLU -0.84 2.00 1 159 LYS -2.55 -1.60 1 160 ALA -0.82 -2.50 1 161 PHE -3.58 0.60 1 162 ASP -0.52 -3.50 1 163 GLU 3.31 -0.20 1 164 SER -1.23 3.10 1 165 ILE 1.78 -1.90 1 166 GLU -2.67 -2.30 1 167 ILE -4.05 -0.40 1 175 ALA 2.01 1.10 1 176 ALA 3.40 0.00 1 177 ALA 2.71 -0.10 1 178 THR 5.66 4.30 1 179 ILE 0.92 0.20 1 180 ALA 4.44 -1.50 1 181 ARG 5.87 2.10 1 182 HIS 0.33 3.40 1 183 LEU 3.46 3.00 1 185 LYS 1.63 -0.10 1 186 GLU -1.93 1.10 1 191 SER -1.78 2.00 1 192 ILE 1.57 -1.00 1 202 LEU 1.74 -3.10 1 203 ALA 3.21 -4.60 1 204 VAL -4.97 -1.10 1 205 ASP -3.30 -3.80 1 206 ARG 3.35 0.50 1 208 ASN -1.17 -2.00 1 209 ASP 3.20 -0.80 1 210 MET 3.04 1.50 1 211 ILE -1.77 1.70 1 215 TYR 3.83 1.90 1 216 GLN -2.37 -0.90 1 218 MET 1.27 -0.90 1 219 SER -1.63 0.80 1 221 SER 4.19 4.80 1 222 VAL 5.93 -1.50 1 223 LEU 4.63 0.90 1 224 ASN 4.88 3.90 1 225 LEU 4.49 0.50 1 226 ILE 7.06 2.20 1 227 LYS 3.36 0.80 1 228 GLN 4.48 0.80 1 229 VAL 6.09 3.10 1 230 ILE 5.18 0.50 1 231 ASP 5.64 3.90 1 232 ALA 3.37 1.40 1 233 SER 4.14 5.30 1 234 HIS 2.36 2.70 1 235 ALA 4.11 0.60 1 236 GLU -2.74 2.00 1 238 LYS -0.59 -1.80 1 239 TRP -4.57 -2.40 1 240 THR -1.34 -0.30 1 242 MET -1.73 -2.50 1 246 LEU 1.81 -4.00 1 247 ALA 3.09 -0.60 1 249 ASP -2.26 -3.80 1 250 GLU 2.59 1.10 1 251 ARG 3.57 1.30 1 252 ALA -2.03 -1.20 1 253 THR 6.74 2.80 1 254 LEU 4.94 -2.00 1 257 LEU 3.12 2.00 1 259 MET 1.24 -1.70 1 261 LEU 1.72 -3.10 1 262 ASP 0.62 0.00 1 263 GLU -1.73 -0.90 1 264 PHE -4.29 -4.20 1 265 SER -1.52 -0.10 1 266 MET -4.12 -2.10 1 267 SER 1.59 0.90 1 268 ALA 4.19 -1.10 1 269 ILE 3.15 2.40 1 270 SER 1.73 2.60 1 271 ILE 3.87 3.80 1 273 ARG 5.65 1.60 1 274 ILE 6.54 2.20 1 275 LYS 5.10 1.30 1 276 LYS 5.15 2.00 1 277 ILE 6.05 3.20 1 278 ILE 2.37 0.70 1 279 ARG -1.50 1.90 1 280 ASN -0.43 -0.80 1 281 THR -1.29 -3.00 1 282 ASN 3.18 0.00 1 283 PHE 3.23 3.00 1 285 ASP 4.54 0.70 1 286 ALA 8.16 2.30 1 287 LYS 5.39 2.50 1 288 VAL 5.81 1.00 1 289 LEU 4.37 0.60 1 290 ALA 3.77 2.30 1 291 GLU 3.40 1.60 1 292 GLN 4.33 1.70 1 293 ALA 4.58 1.80 1 294 LEU -0.03 -0.70 1 295 ALA 0.08 3.50 1 298 THR 2.95 -0.40 1 299 THR 4.47 0.10 1 300 ASP 3.13 2.90 1 301 GLU 5.37 1.20 1 302 LEU 4.63 1.80 1 303 MET 6.31 4.40 1 304 THR 4.24 -1.20 1 305 LEU 5.91 3.10 1 306 VAL 4.31 2.30 1 307 ASN 4.31 -1.40 1 308 LYS 3.49 2.20 1 309 PHE 4.44 1.40 1 310 ILE 2.48 2.10 1 311 GLU 1.54 1.70 1 312 GLU 0.99 1.20 1 313 LYS 0.93 2.10 1 314 THR 0.80 -2.20 1 stop_ save_