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 bmr7264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -3.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.45 _LACS_plot.Line_2_terminator_val_x_2 9.39 _LACS_plot.Line_2_terminator_val_y_2 6.31 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ARG 3.40 -1.94 0 11 ALA -1.63 -0.99 1 13 ARG -7.25 -3.57 1 14 ASP -2.29 -0.86 1 15 PHE -3.01 -1.05 1 17 PHE -6.45 -4.08 1 18 ALA 0.00 -3.48 1 19 LEU -2.57 -1.25 1 20 ASP -3.10 -2.23 1 22 ASN 3.46 2.03 1 24 LEU 3.24 1.39 1 25 SER 1.12 0.32 1 26 GLU 0.05 -1.33 1 27 ALA 4.35 3.32 1 28 GLN 3.97 2.89 1 29 TYR 4.51 3.01 1 30 LYS 3.84 2.84 1 31 ALA 3.61 2.22 1 32 ILE 4.16 3.37 1 33 ALA 2.63 2.05 1 34 ASP 3.47 2.85 1 35 SER -0.42 1.83 1 36 GLU 2.58 1.43 1 37 PHE -6.16 -1.52 1 38 ASN -2.21 -1.07 1 39 LEU -1.27 -0.58 1 40 VAL -5.81 -3.21 1 41 VAL -7.36 -4.37 1 42 ALA -2.01 -1.52 1 43 GLU 2.36 2.24 1 45 ALA 1.93 2.35 1 46 MET 0.52 0.06 1 47 LYS -1.15 0.82 1 48 TRP 3.88 2.48 1 49 ASP 6.18 2.78 1 50 ALA -0.75 0.45 1 51 THR -2.88 0.01 1 52 GLU -3.40 -1.39 1 54 SER -3.04 -2.04 1 55 GLN 5.46 2.06 1 56 ASN 1.13 0.72 1 57 SER -1.64 -2.27 1 58 PHE -1.85 -0.86 1 59 SER -3.59 -3.25 1 60 PHE -0.55 -0.69 1 62 ALA 4.20 2.88 1 64 ASP 5.15 3.18 1 65 ARG 4.58 3.21 1 66 VAL 6.85 4.16 1 67 ALA 4.09 2.59 1 68 SER 4.38 3.37 1 69 TYR 5.27 4.00 1 70 ALA 4.54 2.72 1 71 ALA 3.21 1.99 1 72 ASP 2.84 2.42 1 73 THR -0.82 -0.91 1 75 LYS -4.09 -1.17 1 76 GLU -1.44 -0.55 1 77 LEU -2.73 -2.04 1 78 TYR -4.71 -1.72 1 80 HIS -6.72 -3.58 1 81 THR -2.42 -1.35 1 82 LEU 5.21 3.51 1 83 VAL 1.94 1.39 1 90 ASP 4.62 3.32 1 91 TRP 3.45 1.11 1 92 ALA 4.64 1.31 1 93 LYS 3.99 2.52 1 94 ASN -0.30 -0.15 1 95 LEU -2.30 -1.16 1 96 ASN -5.12 -1.29 1 98 SER 3.95 2.74 1 99 ALA 3.16 2.26 1 100 PHE 4.79 2.74 1 101 GLU 4.05 3.90 1 102 SER 4.25 3.15 1 103 ALA 3.31 2.28 1 104 MET 4.97 4.07 1 105 VAL 6.98 5.40 1 106 ASN 3.60 3.90 1 107 HIS 6.48 5.97 1 108 VAL 5.42 4.02 1 109 THR 5.27 4.45 1 110 LYS 4.20 2.01 1 112 ALA 5.24 2.48 1 113 ASP 1.58 3.05 1 114 HIS 5.34 4.29 1 115 PHE 0.31 0.57 1 116 GLU 3.75 1.85 1 118 LYS 0.65 0.62 1 119 VAL 0.23 -0.69 1 120 ALA 0.01 0.69 1 121 SER -5.53 -2.38 1 122 TRP -7.27 -1.94 1 123 ASP 0.06 -0.68 1 124 VAL 5.65 3.21 1 125 VAL -4.20 -1.85 1 126 ASN -6.33 -2.83 1 127 GLU 3.61 0.28 1 128 ALA -0.32 0.37 1 129 PHE 0.63 1.38 1 130 ALA -3.85 -2.63 1 135 ARG -1.97 -2.50 1 136 ARG 2.67 1.12 1 137 GLN 1.21 0.40 1 138 ASP 0.89 -1.92 1 139 SER -3.99 -4.15 1 140 ALA 3.37 2.03 1 141 PHE 6.35 3.46 1 142 GLN 1.64 1.57 1 143 GLN 3.72 2.69 1 144 LYS 1.22 2.22 1 145 LEU -1.44 -1.27 1 147 ASN 2.40 1.62 1 149 TYR 2.28 2.13 1 150 ILE 6.94 4.40 1 151 GLU 5.20 3.23 1 152 THR 6.22 4.20 1 153 ALA 4.99 3.47 1 154 PHE 7.42 6.30 1 155 ARG 6.60 4.42 1 156 ALA 3.30 1.61 1 157 ALA 3.73 2.58 1 158 ARG 3.38 -0.08 1 159 ALA 2.62 1.08 1 160 ALA -1.70 0.25 1 161 ASP -1.85 -1.63 1 163 THR 0.20 0.45 1 164 ALA 0.42 -0.42 1 165 LYS 0.79 -1.26 1 166 LEU 0.88 -0.97 1 168 ILE -5.57 -2.55 1 169 ASN -5.62 -1.36 1 170 ASP -5.63 -0.46 1 171 TYR -4.63 -3.17 1 172 ASN 3.67 0.99 1 173 VAL -1.34 -3.23 1 174 GLU 7.80 5.14 1 176 ILE 6.01 1.99 1 177 ASN -1.21 -1.52 1 178 ALA 3.78 2.84 1 179 LYS 4.16 4.34 1 180 SER 3.22 2.47 1 181 ASN 5.06 2.42 1 182 SER 4.77 4.37 1 183 LEU 3.65 2.44 1 184 TYR 5.22 3.88 1 185 ASP 3.77 2.79 1 186 LEU 4.84 3.17 1 187 VAL 7.13 4.47 1 188 LYS 4.82 3.71 1 189 ASP 1.63 2.80 1 190 PHE 4.56 1.84 1 191 LYS 4.47 -0.13 1 192 ALA 3.40 2.23 1 193 ARG 0.38 0.47 1 195 VAL 1.27 0.52 1 197 LEU 2.23 1.89 1 198 ASP -3.38 0.53 1 200 VAL -3.09 -1.59 1 202 PHE -1.77 -2.63 1 203 GLN 3.67 3.11 1 204 SER 2.56 0.15 1 205 HIS 1.74 -0.25 1 206 LEU -4.01 -2.29 1 207 ILE -2.57 -0.94 1 208 VAL 1.60 0.24 1 210 GLN -0.68 -2.10 1 211 VAL 3.09 1.97 1 214 ASP 0.54 -2.47 1 215 PHE 0.89 0.25 1 216 ARG 7.17 4.35 1 217 GLN 5.36 3.50 1 218 ASN 2.51 2.61 1 219 LEU 2.83 3.09 1 220 GLN 2.65 1.76 1 221 ARG 6.65 2.64 1 222 PHE 5.53 5.39 1 223 ALA 2.42 1.66 1 224 ASP 2.93 2.11 1 225 LEU 0.72 0.10 1 227 VAL -5.30 -4.24 1 228 ASP -1.82 -0.62 1 229 VAL -6.58 -4.40 1 230 ARG -3.77 -0.11 1 231 ILE 0.33 -0.80 1 232 THR 1.96 1.18 1 233 GLU -5.61 -4.06 1 234 LEU 1.44 0.75 1 236 ILE 0.03 -1.11 1 237 ARG -2.72 -1.17 1 238 MET -7.09 -2.98 1 239 ARG 1.95 -0.24 1 240 THR 0.24 -2.39 1 244 ALA 4.03 3.18 1 245 THR 5.90 4.32 1 246 LYS 2.22 3.91 1 247 LEU 3.30 2.55 1 248 ALA 3.81 2.31 1 249 THR 6.17 4.56 1 250 GLN 2.24 3.17 1 251 ALA 4.97 3.29 1 252 ALA 3.79 2.14 1 253 ASP 3.29 3.46 1 256 LYS 3.72 3.23 1 257 VAL 6.17 4.38 1 258 VAL 7.61 4.58 1 259 GLN 4.72 3.66 1 260 ALA 5.61 2.74 1 262 MET 3.20 0.35 1 263 GLN 0.87 0.39 1 264 VAL -0.91 -1.05 1 265 THR 5.66 4.23 1 266 ARG 1.64 -0.03 1 268 GLN -0.31 0.41 1 270 VAL -5.73 -1.87 1 271 THR -2.46 -2.12 1 272 VAL -4.18 -3.57 1 273 TRP 0.08 -2.01 1 275 ILE 0.45 2.29 1 276 THR -5.47 -5.73 1 277 ASP 2.00 2.78 1 278 LYS 2.49 2.78 1 279 TYR -3.34 -3.50 1 280 SER -1.76 -1.28 1 281 TRP 2.39 0.90 1 284 ASP 1.86 1.58 1 285 VAL 0.62 1.02 1 286 PHE -0.58 -1.42 1 289 GLU -5.76 -2.68 1 291 ALA 0.90 -0.41 1 292 ALA -2.09 1.31 1 293 LEU 0.23 -0.76 1 294 VAL 5.84 3.22 1 295 TRP -2.35 0.55 1 296 ASP -1.29 -2.15 1 297 ALA 2.89 1.70 1 298 SER -1.06 -0.96 1 299 TYR 9.39 4.02 1 300 ALA -1.38 -1.64 1 301 LYS 1.42 1.06 1 302 LYS 3.92 0.85 1 304 ALA 1.62 1.91 1 305 TYR 5.74 4.56 1 306 ALA 2.60 1.41 1 307 ALA 0.85 2.00 1 308 VAL 6.97 4.52 1 309 MET 4.76 3.71 1 310 GLU 2.04 1.58 1 311 ALA 1.18 1.83 1 312 PHE 1.66 1.63 1 314 ALA -2.10 -1.38 1 315 SER -2.30 -2.41 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 3.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.55 _LACS_plot.Line_2_terminator_val_x_2 9.39 _LACS_plot.Line_2_terminator_val_y_2 -3.08 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 23 ARG 3.40 -5.34 0 11 ALA -1.63 0.64 1 13 ARG -7.25 3.68 1 14 ASP -2.29 1.43 1 15 PHE -3.01 1.96 1 17 PHE -6.45 2.37 1 18 ALA 0.00 -3.48 1 19 LEU -2.57 1.32 1 20 ASP -3.10 0.87 1 22 ASN 3.46 -1.43 1 24 LEU 3.24 -1.85 1 25 SER 1.12 -0.80 1 26 GLU 0.05 -1.38 1 27 ALA 4.35 -1.03 1 28 GLN 3.97 -1.08 1 29 TYR 4.51 -1.50 1 30 LYS 3.84 -1.00 1 31 ALA 3.61 -1.39 1 32 ILE 4.16 -0.79 1 33 ALA 2.63 -0.58 1 34 ASP 3.47 -0.62 1 35 SER -0.42 2.25 1 36 GLU 2.58 -1.15 1 37 PHE -6.16 4.64 1 38 ASN -2.21 1.14 1 39 LEU -1.27 0.69 1 40 VAL -5.81 2.60 1 41 VAL -7.36 2.99 1 42 ALA -2.01 0.49 1 43 GLU 2.36 -0.12 1 45 ALA 1.93 0.42 1 46 MET 0.52 -0.46 1 47 LYS -1.15 1.97 1 48 TRP 3.88 -1.40 1 49 ASP 6.18 -3.40 1 50 ALA -0.75 1.20 1 51 THR -2.88 2.89 1 52 GLU -3.40 2.01 1 54 SER -3.04 1.00 1 55 GLN 5.46 -3.40 1 56 ASN 1.13 -0.41 1 57 SER -1.64 -0.63 1 58 PHE -1.85 0.99 1 59 SER -3.59 0.34 1 60 PHE -0.55 -0.14 1 62 ALA 4.20 -1.32 1 64 ASP 5.15 -1.97 1 65 ARG 4.58 -1.37 1 66 VAL 6.85 -2.69 1 67 ALA 4.09 -1.50 1 68 SER 4.38 -1.01 1 69 TYR 5.27 -1.27 1 70 ALA 4.54 -1.82 1 71 ALA 3.21 -1.22 1 72 ASP 2.84 -0.42 1 73 THR -0.82 -0.09 1 75 LYS -4.09 2.92 1 76 GLU -1.44 0.89 1 77 LEU -2.73 0.69 1 78 TYR -4.71 2.99 1 80 HIS -6.72 3.14 1 81 THR -2.42 1.07 1 82 LEU 5.21 -1.70 1 83 VAL 1.94 -0.55 1 90 ASP 4.62 -1.30 1 91 TRP 3.45 -2.34 1 92 ALA 4.64 -3.33 1 93 LYS 3.99 -1.47 1 94 ASN -0.30 0.15 1 95 LEU -2.30 1.14 1 96 ASN -5.12 3.83 1 98 SER 3.95 -1.21 1 99 ALA 3.16 -0.90 1 100 PHE 4.79 -2.05 1 101 GLU 4.05 -0.15 1 102 SER 4.25 -1.10 1 103 ALA 3.31 -1.03 1 104 MET 4.97 -0.90 1 105 VAL 6.98 -1.58 1 106 ASN 3.60 0.30 1 107 HIS 6.48 -0.51 1 108 VAL 5.42 -1.40 1 109 THR 5.27 -0.82 1 110 LYS 4.20 -2.19 1 112 ALA 5.24 -2.76 1 113 ASP 1.58 1.47 1 114 HIS 5.34 -1.05 1 115 PHE 0.31 0.26 1 116 GLU 3.75 -1.90 1 118 LYS 0.65 -0.03 1 119 VAL 0.23 -0.92 1 120 ALA 0.01 0.68 1 121 SER -5.53 3.15 1 122 TRP -7.27 5.33 1 123 ASP 0.06 -0.74 1 124 VAL 5.65 -2.44 1 125 VAL -4.20 2.35 1 126 ASN -6.33 3.50 1 127 GLU 3.61 -3.33 1 128 ALA -0.32 0.69 1 129 PHE 0.63 0.75 1 130 ALA -3.85 1.22 1 135 ARG -1.97 -0.53 1 136 ARG 2.67 -1.55 1 137 GLN 1.21 -0.81 1 138 ASP 0.89 -2.81 1 139 SER -3.99 -0.16 1 140 ALA 3.37 -1.34 1 141 PHE 6.35 -2.89 1 142 GLN 1.64 -0.07 1 143 GLN 3.72 -1.03 1 144 LYS 1.22 1.00 1 145 LEU -1.44 0.17 1 147 ASN 2.40 -0.78 1 149 TYR 2.28 -0.15 1 150 ILE 6.94 -2.54 1 151 GLU 5.20 -1.97 1 152 THR 6.22 -2.02 1 153 ALA 4.99 -1.52 1 154 PHE 7.42 -1.12 1 155 ARG 6.60 -2.18 1 156 ALA 3.30 -1.69 1 157 ALA 3.73 -1.15 1 158 ARG 3.38 -3.46 1 159 ALA 2.62 -1.54 1 160 ALA -1.70 1.95 1 161 ASP -1.85 0.22 1 163 THR 0.20 0.25 1 164 ALA 0.42 -0.84 1 165 LYS 0.79 -2.05 1 166 LEU 0.88 -1.85 1 168 ILE -5.57 3.02 1 169 ASN -5.62 4.26 1 170 ASP -5.63 5.17 1 171 TYR -4.63 1.46 1 172 ASN 3.67 -2.68 1 173 VAL -1.34 -1.89 1 174 GLU 7.80 -2.66 1 176 ILE 6.01 -4.02 1 177 ASN -1.21 -0.31 1 178 ALA 3.78 -0.94 1 179 LYS 4.16 0.18 1 180 SER 3.22 -0.75 1 181 ASN 5.06 -2.64 1 182 SER 4.77 -0.40 1 183 LEU 3.65 -1.21 1 184 TYR 5.22 -1.34 1 185 ASP 3.77 -0.98 1 186 LEU 4.84 -1.67 1 187 VAL 7.13 -2.66 1 188 LYS 4.82 -1.11 1 189 ASP 1.63 1.17 1 190 PHE 4.56 -2.72 1 191 LYS 4.47 -4.60 1 192 ALA 3.40 -1.17 1 193 ARG 0.38 0.09 1 195 VAL 1.27 -0.75 1 197 LEU 2.23 -0.34 1 198 ASP -3.38 3.91 1 200 VAL -3.09 1.50 1 202 PHE -1.77 -0.86 1 203 GLN 3.67 -0.56 1 204 SER 2.56 -2.41 1 205 HIS 1.74 -1.99 1 206 LEU -4.01 1.72 1 207 ILE -2.57 1.63 1 208 VAL 1.60 -1.36 1 210 GLN -0.68 -1.42 1 211 VAL 3.09 -1.12 1 214 ASP 0.54 -3.01 1 215 PHE 0.89 -0.64 1 216 ARG 7.17 -2.82 1 217 GLN 5.36 -1.86 1 218 ASN 2.51 0.10 1 219 LEU 2.83 0.26 1 220 GLN 2.65 -0.89 1 221 ARG 6.65 -4.01 1 222 PHE 5.53 -0.14 1 223 ALA 2.42 -0.76 1 224 ASP 2.93 -0.82 1 225 LEU 0.72 -0.62 1 227 VAL -5.30 1.06 1 228 ASP -1.82 1.20 1 229 VAL -6.58 2.18 1 230 ARG -3.77 3.66 1 231 ILE 0.33 -1.13 1 232 THR 1.96 -0.78 1 233 GLU -5.61 1.55 1 234 LEU 1.44 -0.69 1 236 ILE 0.03 -1.14 1 237 ARG -2.72 1.55 1 238 MET -7.09 4.11 1 239 ARG 1.95 -2.19 1 240 THR 0.24 -2.63 1 244 ALA 4.03 -0.85 1 245 THR 5.90 -1.58 1 246 LYS 2.22 1.69 1 247 LEU 3.30 -0.75 1 248 ALA 3.81 -1.50 1 249 THR 6.17 -1.61 1 250 GLN 2.24 0.93 1 251 ALA 4.97 -1.68 1 252 ALA 3.79 -1.65 1 253 ASP 3.29 0.17 1 256 LYS 3.72 -0.49 1 257 VAL 6.17 -1.79 1 258 VAL 7.61 -3.03 1 259 GLN 4.72 -1.06 1 260 ALA 5.61 -2.87 1 262 MET 3.20 -2.85 1 263 GLN 0.87 -0.48 1 264 VAL -0.91 -0.14 1 265 THR 5.66 -1.43 1 266 ARG 1.64 -1.67 1 268 GLN -0.31 0.72 1 270 VAL -5.73 3.86 1 271 THR -2.46 0.34 1 272 VAL -4.18 0.61 1 273 TRP 0.08 -2.09 1 275 ILE 0.45 1.84 1 276 THR -5.47 -0.26 1 277 ASP 2.00 0.78 1 278 LYS 2.49 0.29 1 279 TYR -3.34 -0.16 1 280 SER -1.76 0.48 1 281 TRP 2.39 -1.49 1 284 ASP 1.86 -0.28 1 285 VAL 0.62 0.40 1 286 PHE -0.58 -0.84 1 289 GLU -5.76 3.08 1 291 ALA 0.90 -1.31 1 292 ALA -2.09 3.40 1 293 LEU 0.23 -0.99 1 294 VAL 5.84 -2.62 1 295 TRP -2.35 2.90 1 296 ASP -1.29 -0.86 1 297 ALA 2.89 -1.19 1 298 SER -1.06 0.10 1 299 TYR 9.39 -5.37 1 300 ALA -1.38 -0.26 1 301 LYS 1.42 -0.36 1 302 LYS 3.92 -3.07 1 304 ALA 1.62 0.29 1 305 TYR 5.74 -1.18 1 306 ALA 2.60 -1.19 1 307 ALA 0.85 1.15 1 308 VAL 6.97 -2.45 1 309 MET 4.76 -1.05 1 310 GLU 2.04 -0.46 1 311 ALA 1.18 0.65 1 312 PHE 1.66 -0.03 1 314 ALA -2.10 0.72 1 315 SER -2.30 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.36 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _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 -0.70 _LACS_plot.Line_2_terminator_val_x_2 9.39 _LACS_plot.Line_2_terminator_val_y_2 2.74 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 299 TYR 9.39 -2.55 0 11 ALA -1.63 -0.14 1 13 ARG -7.25 -1.40 1 14 ASP -2.29 -0.32 1 15 PHE -3.01 -0.78 1 17 PHE -6.45 -3.52 1 18 ALA 0.00 -3.16 1 19 LEU -2.57 -1.35 1 20 ASP -3.10 0.53 1 22 ASN 3.46 1.81 1 23 ARG 3.40 -0.05 1 24 LEU 3.24 -1.43 1 25 SER 1.12 -0.75 1 26 GLU 0.05 -0.60 1 27 ALA 4.35 2.77 1 28 GLN 3.97 1.36 1 29 TYR 4.51 0.75 1 30 LYS 3.84 0.18 1 31 ALA 3.61 3.53 1 32 ILE 4.16 0.00 1 33 ALA 2.63 1.63 1 34 ASP 3.47 2.54 1 35 SER -0.42 1.87 1 36 GLU 2.58 -3.53 1 37 PHE -6.16 0.70 1 38 ASN -2.21 -0.71 1 39 LEU -1.27 -4.53 1 40 VAL -5.81 -5.84 1 41 VAL -7.36 -2.92 1 42 ALA -2.01 -1.59 1 43 GLU 2.36 -0.78 1 45 ALA 1.93 -1.56 1 46 MET 0.52 -1.53 1 47 LYS -1.15 2.79 1 48 TRP 3.88 2.42 1 49 ASP 6.18 0.59 1 50 ALA -0.75 0.82 1 51 THR -2.88 1.04 1 52 GLU -3.40 -2.01 1 54 SER -3.04 -2.85 1 55 GLN 5.46 1.08 1 56 ASN 1.13 -1.37 1 57 SER -1.64 -2.05 1 58 PHE -1.85 1.02 1 59 SER -3.59 -0.04 1 60 PHE -0.55 -0.22 1 62 ALA 4.20 2.46 1 64 ASP 5.15 3.24 1 65 ARG 4.58 3.73 1 66 VAL 6.85 0.43 1 67 ALA 4.09 2.64 1 68 SER 4.38 0.74 1 69 TYR 5.27 2.46 1 70 ALA 4.54 0.64 1 71 ALA 3.21 3.45 1 72 ASP 2.84 2.01 1 73 THR -0.82 0.89 1 75 LYS -4.09 -0.62 1 76 GLU -1.44 -2.31 1 77 LEU -2.73 -3.61 1 78 TYR -4.71 -0.83 1 80 HIS -6.72 -1.24 1 81 THR -2.42 -2.75 1 82 LEU 5.21 -3.79 1 83 VAL 1.94 -3.49 1 90 ASP 4.62 2.01 1 91 TRP 3.45 1.88 1 92 ALA 4.64 0.26 1 93 LYS 3.99 0.21 1 94 ASN -0.30 0.08 1 95 LEU -2.30 -2.09 1 96 ASN -5.12 0.55 1 98 SER 3.95 2.23 1 99 ALA 3.16 2.96 1 100 PHE 4.79 1.05 1 101 GLU 4.05 1.81 1 102 SER 4.25 2.60 1 103 ALA 3.31 2.86 1 104 MET 4.97 1.26 1 105 VAL 6.98 2.92 1 106 ASN 3.60 0.42 1 107 HIS 6.48 1.63 1 108 VAL 5.42 -0.23 1 109 THR 5.27 0.64 1 110 LYS 4.20 4.17 1 112 ALA 5.24 3.10 1 113 ASP 1.58 1.97 1 114 HIS 5.34 2.21 1 115 PHE 0.31 -2.60 1 116 GLU 3.75 0.88 1 118 LYS 0.65 -0.24 1 119 VAL 0.23 -1.61 1 120 ALA 0.01 0.87 1 121 SER -5.53 -3.55 1 122 TRP -7.27 -0.26 1 123 ASP 0.06 0.03 1 124 VAL 5.65 -1.96 1 125 VAL -4.20 -4.13 1 126 ASN -6.33 -1.25 1 127 GLU 3.61 -2.21 1 128 ALA -0.32 1.67 1 129 PHE 0.63 -2.15 1 130 ALA -3.85 0.74 1 135 ARG -1.97 0.82 1 136 ARG 2.67 -0.72 1 137 GLN 1.21 1.11 1 138 ASP 0.89 -1.60 1 139 SER -3.99 0.67 1 140 ALA 3.37 0.44 1 141 PHE 6.35 0.32 1 142 GLN 1.64 3.08 1 143 GLN 3.72 2.53 1 144 LYS 1.22 1.84 1 145 LEU -1.44 0.47 1 147 ASN 2.40 5.34 1 149 TYR 2.28 -0.52 1 150 ILE 6.94 0.86 1 151 GLU 5.20 1.13 1 152 THR 6.22 1.98 1 153 ALA 4.99 0.90 1 154 PHE 7.42 2.53 1 155 ARG 6.60 3.28 1 156 ALA 3.30 1.92 1 157 ALA 3.73 -0.27 1 158 ARG 3.38 0.86 1 159 ALA 2.62 0.55 1 160 ALA -1.70 -1.01 1 161 ASP -1.85 -1.30 1 163 THR 0.20 0.57 1 164 ALA 0.42 0.17 1 165 LYS 0.79 -0.16 1 166 LEU 0.88 -1.81 1 168 ILE -5.57 -4.91 1 169 ASN -5.62 0.26 1 170 ASP -5.63 -4.59 1 171 TYR -4.63 0.63 1 172 ASN 3.67 -1.34 1 173 VAL -1.34 -3.44 1 174 GLU 7.80 0.27 1 176 ILE 6.01 -1.89 1 177 ASN -1.21 -1.52 1 178 ALA 3.78 1.80 1 179 LYS 4.16 1.86 1 180 SER 3.22 2.84 1 181 ASN 5.06 2.66 1 182 SER 4.77 1.30 1 183 LEU 3.65 -0.97 1 184 TYR 5.22 0.17 1 185 ASP 3.77 2.95 1 186 LEU 4.84 -0.08 1 187 VAL 7.13 0.88 1 188 LYS 4.82 2.32 1 189 ASP 1.63 0.66 1 190 PHE 4.56 3.64 1 191 LYS 4.47 3.56 1 192 ALA 3.40 2.41 1 193 ARG 0.38 0.43 1 195 VAL 1.27 0.23 1 197 LEU 2.23 -2.17 1 198 ASP -3.38 -0.36 1 200 VAL -3.09 -2.89 1 202 PHE -1.77 2.20 1 203 GLN 3.67 -0.24 1 204 SER 2.56 -0.26 1 205 HIS 1.74 1.19 1 206 LEU -4.01 -2.41 1 207 ILE -2.57 -1.68 1 208 VAL 1.60 0.99 1 210 GLN -0.68 1.12 1 211 VAL 3.09 0.66 1 214 ASP 0.54 -0.64 1 215 PHE 0.89 2.79 1 216 ARG 7.17 1.45 1 217 GLN 5.36 3.09 1 218 ASN 2.51 1.27 1 219 LEU 2.83 1.98 1 220 GLN 2.65 1.59 1 221 ARG 6.65 3.21 1 222 PHE 5.53 1.26 1 223 ALA 2.42 4.44 1 224 ASP 2.93 1.60 1 225 LEU 0.72 -0.16 1 227 VAL -5.30 -2.72 1 228 ASP -1.82 -0.11 1 229 VAL -6.58 -1.38 1 230 ARG -3.77 -2.85 1 231 ILE 0.33 0.64 1 232 THR 1.96 0.08 1 233 GLU -5.61 -3.30 1 234 LEU 1.44 0.44 1 236 ILE 0.03 -1.37 1 237 ARG -2.72 -2.56 1 238 MET -7.09 -1.62 1 239 ARG 1.95 0.73 1 240 THR 0.24 -1.59 1 244 ALA 4.03 2.92 1 245 THR 5.90 2.63 1 246 LYS 2.22 3.28 1 247 LEU 3.30 2.65 1 248 ALA 3.81 3.24 1 249 THR 6.17 0.33 1 250 GLN 2.24 1.54 1 251 ALA 4.97 -0.43 1 252 ALA 3.79 2.82 1 253 ASP 3.29 1.68 1 256 LYS 3.72 3.40 1 257 VAL 6.17 0.39 1 258 VAL 7.61 2.26 1 259 GLN 4.72 1.55 1 260 ALA 5.61 0.11 1 262 MET 3.20 2.29 1 263 GLN 0.87 -1.08 1 264 VAL -0.91 0.73 1 265 THR 5.66 1.65 1 266 ARG 1.64 0.29 1 268 GLN -0.31 0.36 1 270 VAL -5.73 -3.17 1 271 THR -2.46 -2.13 1 272 VAL -4.18 1.93 1 273 TRP 0.08 -0.72 1 275 ILE 0.45 -1.65 1 276 THR -5.47 -0.36 1 277 ASP 2.00 1.20 1 278 LYS 2.49 -0.39 1 279 TYR -3.34 -1.14 1 280 SER -1.76 1.02 1 281 TRP 2.39 0.49 1 284 ASP 1.86 0.45 1 285 VAL 0.62 -1.62 1 286 PHE -0.58 -3.02 1 289 GLU -5.76 -0.21 1 291 ALA 0.90 0.24 1 292 ALA -2.09 1.12 1 293 LEU 0.23 -0.60 1 294 VAL 5.84 -2.98 1 295 TRP -2.35 0.14 1 296 ASP -1.29 3.26 1 297 ALA 2.89 -2.00 1 298 SER -1.06 -0.58 1 300 ALA -1.38 0.63 1 301 LYS 1.42 1.00 1 302 LYS 3.92 1.46 1 304 ALA 1.62 -1.58 1 305 TYR 5.74 0.10 1 306 ALA 2.60 1.75 1 307 ALA 0.85 1.44 1 308 VAL 6.97 0.65 1 309 MET 4.76 2.26 1 310 GLU 2.04 3.93 1 311 ALA 1.18 1.22 1 312 PHE 1.66 0.88 1 314 ALA -2.10 -1.23 1 315 SER -2.30 -1.81 1 stop_ save_