NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
642096 |
6pqe   |
30629 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | simple |
# Restraints file 2: test_noe.tbl assign (resid 253 and name HG1* ) (resid 255 and name HG2* ) 3.56 1.76 1.76 !peak 5 #SUP 1.00 assign (resid 205 and name HG2* ) (resid 255 and name HG2* ) 3.61 1.81 1.81 !peak 6 #SUP 1.00 #QF 0.66 assign (resid 255 and name HG2* ) (resid 255 and name HG11 ) 2.54 0.74 0.74 !peak 7 #SUP 0.99 #QF 0.99 assign (resid 173 and name HB* ) (resid 197 and name HD1* ) 3.40 1.60 1.60 !peak 16 #SUP 0.52 #QF 0.52 assign (resid 173 and name HB* ) (resid 219 and name HG2* ) 3.09 1.29 1.29 !peak 21 #SUP 0.99 #QF 0.99 assign (resid 212 and name HB* ) (resid 219 and name HG2* ) 2.81 1.01 1.01 !peak 23 #SUP 0.85 #QF 0.85 assign (resid 212 and name HB* ) (resid 251 and name HD2* ) 2.73 0.93 0.93 !peak 32 #SUP 0.89 #QF 0.89 assign (resid 213 and name HE* ) (resid 215 and name HD2* ) 3.29 1.49 1.49 !peak 48 #SUP 0.23 #QF 0.23 assign (resid 215 and name HB2 ) (resid 215 and name HD1* ) 2.68 0.88 0.88 !peak 50 #SUP 1.00 #QF 0.98 assign (resid 199 and name HG2* ) (resid 203 and name HG2* ) 3.18 1.38 1.38 !peak 56 #SUP 0.99 #QF 0.92 assign (resid 203 and name HG2* ) (resid 223 and name HG1* ) 2.58 0.78 0.78 !peak 57 #SUP 0.98 #QF 0.98 assign (resid 203 and name HG2* ) (resid 206 and name HG1* ) 3.05 1.25 1.25 !peak 58 #SUP 1.00 assign (resid 203 and name HG2* ) (resid 204 and name HB* ) 2.97 1.17 1.17 !peak 60 #SUP 1.00 assign (resid 203 and name HG2* ) (resid 203 and name HG12 ) 2.51 0.71 0.71 !peak 65 #SUP 0.99 #QF 0.99 assign (resid 197 and name HD2* ) (resid 199 and name HG1* ) 3.47 1.67 1.67 !peak 69 #SUP 0.99 #QF 0.99 assign (resid 199 and name HG1* ) (resid 223 and name HG2* ) 2.58 0.78 0.78 !peak 71 #SUP 0.98 #QF 0.96 assign (resid 219 and name HG1* ) (resid 249 and name HD2* ) 3.36 1.56 1.56 !peak 78 #SUP 0.94 #QF 0.94 assign (resid 235 and name HD2* ) (resid 249 and name HD2* ) 3.12 1.32 1.32 !peak 79 #SUP 0.99 #QF 0.99 assign (resid 238 and name HB1 ) (resid 249 and name HD2* ) 3.02 1.22 1.22 !peak 83 #SUP 0.93 #QF 0.76 assign (resid 219 and name HG2* ) (resid 249 and name HD2* ) 3.36 1.56 1.56 !peak 85 #SUP 0.91 #QF 0.91 assign (resid 172 and name HG2* ) (resid 173 and name HB* ) 3.16 1.36 1.36 !peak 91 #SUP 0.90 #QF 0.90 assign (resid 199 and name HG1* ) (resid 255 and name HD1* ) 2.74 0.94 0.94 !peak 98 #SUP 0.99 #QF 0.49 assign (resid 199 and name HG2* ) (resid 255 and name HD1* ) 2.74 0.94 0.94 !peak 99 #SUP 0.97 #QF 0.97 assign (resid 253 and name HG1* ) (resid 255 and name HD1* ) 2.49 0.69 0.69 !peak 100 #SUP 0.98 #QF 0.98 assign (resid 229 and name HB* ) (resid 255 and name HD1* ) 2.92 1.12 1.12 !peak 101 #SUP 0.99 #QF 0.99 assign (resid 204 and name HB* ) (resid 255 and name HD1* ) 2.30 0.50 0.50 !peak 102 #SUP 1.00 #QF 0.98 assign (resid 199 and name HG1* ) (resid 203 and name HD1* ) 3.78 1.98 1.98 !peak 110 #SUP 1.00 assign (resid 203 and name HD1* ) (resid 210 and name HG1* ) 3.11 1.31 1.31 !peak 111 #SUP 0.99 #QF 0.99 assign (resid 201 and name HB* ) (resid 205 and name HG2* ) 2.90 1.10 1.10 !peak 126 #SUP 0.90 #QF 0.90 assign (resid 201 and name HB* ) (resid 205 and name HG1* ) 3.83 2.03 2.03 !peak 127 #SUP 0.96 #QF 0.96 assign (resid 204 and name HB* ) (resid 255 and name HG11 ) 2.98 1.18 1.18 !peak 137 #SUP 0.97 #QF 0.91 assign (resid 204 and name HB* ) (resid 255 and name HG12 ) 3.46 1.66 1.66 !peak 137 #SUP 0.97 #QF 0.91 assign (resid 199 and name HG1* ) (resid 204 and name HB* ) 2.82 1.02 1.02 !peak 138 #SUP 0.99 #QF 0.49 assign (resid 199 and name HG2* ) (resid 204 and name HB* ) 2.82 1.02 1.02 !peak 139 #SUP 0.96 #QF 0.96 assign (resid 204 and name HB* ) (resid 223 and name HG1* ) 2.61 0.81 0.81 !peak 140 #SUP 0.93 #QF 0.93 assign (resid 204 and name HB* ) (resid 255 and name HG2* ) 2.47 0.67 0.67 !peak 143 #SUP 1.00 assign (resid 229 and name HB* ) (resid 255 and name HG11 ) 2.84 1.04 1.04 !peak 150 #SUP 1.00 #QF 0.99 assign (resid 229 and name HB* ) (resid 255 and name HG2* ) 3.06 1.26 1.26 !peak 154 #SUP 1.00 assign (resid 243 and name HG2 ) (resid 244 and name HB* ) 2.87 1.07 1.07 !peak 160 #SUP 0.94 #QF 0.94 assign (resid 209 and name HG1 ) (resid 222 and name HB* ) 2.75 0.95 0.95 !peak 167 #SUP 0.88 #QF 0.88 assign (resid 203 and name HG12 ) (resid 206 and name HG1* ) 3.03 1.23 1.23 !peak 187 #SUP 0.65 #QF 0.65 assign (resid 219 and name HG2* ) (resid 235 and name HG ) 3.52 1.72 1.72 !peak 214 #SUP 0.85 #QF 0.85 assign (resid 253 and name HG1* ) (resid 255 and name HG12 ) 2.67 0.87 0.87 !peak 221 #SUP 0.71 #QF 0.71 assign (resid 221 and name HG1* ) (resid 233 and name HD1* ) 2.58 0.78 0.78 !peak 228 #SUP 0.43 #QF 0.43 assign (resid 221 and name HG1* ) (resid 233 and name HD2* ) 2.88 1.08 1.08 !peak 229 #SUP 0.59 #QF 0.59 assign (resid 229 and name HB* ) (resid 253 and name HG1* ) 2.98 1.18 1.18 !peak 237 #SUP 0.96 #QF 0.96 assign (resid 197 and name HD2* ) (resid 199 and name HG2* ) 3.47 1.67 1.67 !peak 258 #SUP 0.81 #QF 0.81 assign (resid 199 and name HG2* ) (resid 223 and name HG2* ) 2.58 0.78 0.78 !peak 264 #SUP 0.99 #QF 0.99 assign (resid 203 and name HG2* ) (resid 223 and name HG2* ) 2.66 0.86 0.86 !peak 268 #SUP 0.98 #QF 0.98 assign (resid 199 and name HG2* ) (resid 203 and name HD1* ) 3.78 1.98 1.98 !peak 273 #SUP 0.84 #QF 0.84 assign (resid 197 and name HD1* ) (resid 212 and name HB* ) 2.28 0.48 0.47 !peak 284 #SUP 0.93 #QF 0.93 assign (resid 197 and name HD1* ) (resid 221 and name HG1* ) 2.57 0.77 0.77 !peak 285 #SUP 0.73 #QF 0.73 assign (resid 199 and name HG1* ) (resid 203 and name HG2* ) 3.18 1.38 1.38 !peak 298 #SUP 0.73 #QF 0.73 assign (resid 212 and name HB* ) (resid 249 and name HD2* ) 2.87 1.07 1.07 !peak 345 #SUP 0.98 #QF 0.50 assign (resid 212 and name HB* ) (resid 235 and name HD2* ) 3.26 1.46 1.46 !peak 346 #SUP 1.00 assign (resid 212 and name HB* ) (resid 251 and name HD1* ) 2.73 0.93 0.93 !peak 347 #SUP 1.00 #QF 0.99 assign (resid 212 and name HB* ) (resid 219 and name HG1* ) 2.81 1.01 1.01 !peak 350 #SUP 0.86 #QF 0.86 assign (resid 196 and name HG2* ) (resid 197 and name HD1* ) 3.92 2.12 2.12 !peak 362 #SUP 0.60 #QF 0.60 assign (resid 172 and name HG2* ) (resid 235 and name HD2* ) 3.50 1.70 1.70 !peak 387 #SUP 0.98 #QF 0.98 assign (resid 172 and name HG2* ) (resid 235 and name HD1* ) 3.34 1.54 1.54 !peak 388 #SUP 0.96 #QF 0.96 assign (resid 255 and name HG2* ) (resid 256 and name HG2* ) 3.13 1.33 1.33 !peak 414 #SUP 0.92 #QF 0.92 assign (resid 197 and name HD2* ) (resid 227 and name HG2* ) 3.67 1.87 1.87 !peak 454 #SUP 0.63 #QF 0.63 assign (resid 227 and name HG2* ) (resid 229 and name HB* ) 3.68 1.88 1.88 !peak 458 #SUP 0.90 #QF 0.90 assign (resid 227 and name HG2* ) (resid 255 and name HD1* ) 2.85 1.05 1.05 !peak 460 #SUP 0.95 #QF 0.95 assign (resid 219 and name HG1* ) (resid 235 and name HG ) 3.52 1.72 1.72 !peak 469 #SUP 0.95 #QF 0.95 assign (resid 219 and name HG1* ) (resid 235 and name HD2* ) 2.90 1.10 1.10 !peak 471 #SUP 1.00 assign (resid 173 and name HB* ) (resid 219 and name HG1* ) 3.09 1.29 1.29 !peak 480 #SUP 0.92 #QF 0.92 assign (resid 197 and name HD2* ) (resid 210 and name HG1* ) 3.22 1.42 1.42 !peak 491 #SUP 0.96 #QF 0.96 assign (resid 203 and name HG2* ) (resid 210 and name HG1* ) 2.97 1.17 1.17 !peak 495 #SUP 0.99 #QF 0.99 assign (resid 197 and name HD2* ) (resid 223 and name HG1* ) 3.19 1.39 1.39 !peak 499 #SUP 0.96 #QF 0.96 assign (resid 199 and name HG1* ) (resid 223 and name HG1* ) 2.60 0.80 0.80 !peak 501 #SUP 0.91 #QF 0.52 assign (resid 199 and name HG2* ) (resid 223 and name HG1* ) 2.60 0.80 0.80 !peak 502 #SUP 1.00 #QF 0.90 assign (resid 206 and name HG1* ) (resid 223 and name HG1* ) 3.88 2.08 2.08 !peak 504 #SUP 0.66 #QF 0.66 assign (resid 223 and name HG1* ) (resid 255 and name HD1* ) 2.98 1.18 1.18 !peak 511 #SUP 0.85 #QF 0.85 assign (resid 203 and name HG2* ) (resid 210 and name HG2* ) 2.97 1.17 1.17 !peak 519 #SUP 0.85 #QF 0.85 assign (resid 203 and name HD1* ) (resid 210 and name HG2* ) 3.11 1.31 1.31 !peak 523 #SUP 0.98 #QF 0.98 assign (resid 219 and name HG2* ) (resid 235 and name HD2* ) 2.90 1.10 1.10 !peak 543 #SUP 1.00 assign (resid 212 and name HB* ) (resid 235 and name HD1* ) 2.98 1.18 1.18 !peak 556 #SUP 0.99 #QF 0.99 assign (resid 219 and name HG1* ) (resid 235 and name HD1* ) 2.63 0.83 0.83 !peak 557 #SUP 0.97 #QF 0.97 assign (resid 219 and name HG2* ) (resid 235 and name HD1* ) 2.63 0.83 0.83 !peak 558 #SUP 1.00 assign (resid 235 and name HB1 ) (resid 235 and name HD1* ) 2.83 1.03 1.03 !peak 559 #SUP 0.99 #QF 0.88 assign (resid 235 and name HB2 ) (resid 235 and name HD1* ) 2.97 1.17 1.17 !peak 559 #SUP 0.99 #QF 0.88 assign (resid 197 and name HD2* ) (resid 233 and name HD1* ) 3.07 1.27 1.27 !peak 630 #SUP 0.97 #QF 0.97 assign (resid 197 and name HD2* ) (resid 233 and name HD2* ) 3.18 1.38 1.38 !peak 631 #SUP 0.90 #QF 0.83 assign (resid 197 and name HD2* ) (resid 212 and name HB* ) 2.94 1.14 1.14 !peak 634 #SUP 1.00 assign (resid 197 and name HD2* ) (resid 223 and name HG2* ) 2.71 0.91 0.91 !peak 635 #SUP 0.95 #QF 0.95 assign (resid 197 and name HD2* ) (resid 221 and name HG1* ) 2.55 0.75 0.75 !peak 636 #SUP 0.98 #QF 0.95 assign (resid 197 and name HD2* ) (resid 210 and name HG2* ) 3.22 1.42 1.42 !peak 637 #SUP 1.00 assign (resid 197 and name HG ) (resid 233 and name HD1* ) 3.23 1.43 1.43 !peak 639 #SUP 0.92 #QF 0.92 assign (resid 212 and name HB* ) (resid 233 and name HD1* ) 3.37 1.57 1.57 !peak 642 #SUP 0.91 #QF 0.63 assign (resid 204 and name HB* ) (resid 227 and name HB ) 2.90 1.10 1.10 !peak 11 #SUP 0.97 #QF 0.97 assign (resid 227 and name HG2* ) (resid 231 and name HG1 ) 3.08 1.28 1.28 !peak 14 #SUP 0.99 #QF 0.99 assign (resid 204 and name HB* ) (resid 227 and name HG2* ) 2.90 1.10 1.10 !peak 16 #SUP 0.99 #QF 0.99 assign (resid 227 and name HG2* ) (resid 231 and name HB2 ) 2.97 1.17 1.17 !peak 21 #SUP 0.88 #QF 0.80 assign (resid 227 and name HG2* ) (resid 253 and name HB ) 3.31 1.51 1.51 !peak 21 #SUP 0.88 #QF 0.80 assign (resid 176 and name HE3 ) (resid 227 and name HG2* ) 3.29 1.49 1.49 !peak 24 #SUP 0.93 #QF 0.93 assign (resid 227 and name HG2* ) (resid 228 and name HN ) 3.10 1.30 1.30 !peak 25 #SUP 0.94 #QF 0.94 assign (resid 227 and name HN ) (resid 227 and name HG2* ) 3.13 1.33 1.33 !peak 26 #SUP 0.98 #QF 0.98 assign (resid 223 and name HA ) (resid 223 and name HG1* ) 2.74 0.94 0.94 !peak 34 #SUP 0.95 #QF 0.65 assign (resid 223 and name HA ) (resid 223 and name HG2* ) 2.89 1.09 1.09 !peak 34 #SUP 0.95 #QF 0.65 assign (resid 221 and name HG1* ) (resid 223 and name HA ) 2.99 1.19 1.19 !peak 35 #SUP 0.88 #QF 0.88 assign (resid 223 and name HA ) (resid 224 and name HG1 ) 3.34 1.54 1.54 !peak 36 #SUP 0.33 #QF 0.33 assign (resid 229 and name HA ) (resid 255 and name HB ) 3.46 1.66 1.66 !peak 54 #SUP 0.93 #QF 0.93 assign (resid 229 and name HA ) (resid 231 and name HG1 ) 3.51 1.71 1.71 !peak 55 #SUP 0.92 #QF 0.92 assign (resid 229 and name HA ) (resid 255 and name HG12 ) 2.97 1.17 1.17 !peak 57 #SUP 1.00 assign (resid 229 and name HA ) (resid 253 and name HG1* ) 2.69 0.89 0.89 !peak 58 #SUP 0.98 #QF 0.98 assign (resid 229 and name HA ) (resid 254 and name HA ) 3.25 1.45 1.45 !peak 59 #SUP 0.83 #QF 0.83 assign (resid 249 and name HD1* ) (resid 251 and name HB1 ) 2.91 1.11 1.11 !peak 73 #SUP 0.88 #QF 0.88 assign (resid 249 and name HN ) (resid 249 and name HD1* ) 3.49 1.69 1.69 !peak 83 #SUP 0.74 #QF 0.74 assign (resid 194 and name HA ) (resid 249 and name HD1* ) 3.25 1.45 1.45 !peak 84 #SUP 0.96 #QF 0.96 assign (resid 249 and name HA ) (resid 249 and name HD1* ) 2.70 0.90 0.90 !peak 85 #SUP 0.97 #QF 0.97 assign (resid 215 and name HB1 ) (resid 215 and name HD1* ) 2.83 1.03 1.03 !peak 117 #SUP 0.98 #QF 0.98 assign (resid 241 and name HB2 ) (resid 242 and name HA2 ) 3.28 1.48 1.48 !peak 133 #SUP 0.67 #QF 0.67 assign (resid 242 and name HA1 ) (resid 243 and name HG2 ) 3.28 1.48 1.48 !peak 134 #SUP 0.91 #QF 0.91 assign (resid 194 and name HA ) (resid 195 and name HA ) 3.46 1.66 1.66 !peak 147 #SUP 0.69 #QF 0.69 assign (resid 194 and name HA ) (resid 250 and name HB1 ) 3.38 1.58 1.58 !peak 154 #SUP 0.95 #QF 0.95 assign (resid 194 and name HA ) (resid 250 and name HB2 ) 3.32 1.52 1.52 !peak 155 #SUP 0.95 #QF 0.95 assign (resid 194 and name HA ) (resid 195 and name HB* ) 3.35 1.55 1.55 !peak 156 #SUP 0.70 #QF 0.70 assign (resid 175 and name HA ) (resid 175 and name HG1 ) 3.08 1.28 1.28 !peak 167 #SUP 0.96 #QF 0.96 assign (resid 175 and name HA ) (resid 175 and name HG2 ) 3.08 1.28 1.28 !peak 168 #SUP 0.87 #QF 0.87 assign (resid 216 and name HA ) (resid 216 and name HG2 ) 2.91 1.11 1.11 !peak 173 #SUP 0.91 #QF 0.91 assign (resid 176 and name HB1 ) (resid 176 and name HE3 ) 3.09 1.29 1.29 !peak 191 #SUP 0.51 #QF 0.51 assign (resid 220 and name HN ) (resid 220 and name HB1 ) 2.84 1.04 1.04 !peak 194 #SUP 0.54 #QF 0.54 assign (resid 236 and name HA ) (resid 236 and name HG2 ) 2.98 1.18 1.18 !peak 208 #SUP 0.97 #QF 0.97 assign (resid 236 and name HA ) (resid 236 and name HG1 ) 2.91 1.11 1.11 !peak 209 #SUP 0.99 #QF 0.99 assign (resid 236 and name HA ) (resid 248 and name HA ) 2.96 1.16 1.16 !peak 214 #SUP 0.99 #QF 0.99 assign (resid 219 and name HA ) (resid 219 and name HB ) 2.54 0.74 0.74 !peak 391 #SUP 0.95 #QF 0.95 assign (resid 218 and name HG2 ) (resid 219 and name HA ) 3.57 1.77 1.77 !peak 392 #SUP 0.89 #QF 0.89 assign (resid 219 and name HA ) (resid 220 and name HB2 ) 3.23 1.43 1.43 !peak 393 #SUP 0.67 #QF 0.67 assign (resid 199 and name HG1* ) (resid 200 and name HD2 ) 3.38 1.58 1.58 !peak 404 #SUP 0.79 #QF 0.79 assign (resid 199 and name HA ) (resid 199 and name HG1* ) 2.86 1.06 1.06 !peak 408 #SUP 0.74 #QF 0.74 assign (resid 215 and name HD1* ) (resid 240 and name HD1 ) 2.95 1.15 1.15 !peak 411 #SUP 0.93 #QF 0.93 assign (resid 195 and name HB* ) (resid 196 and name HB ) 3.46 1.66 1.66 !peak 418 #SUP 0.48 #QF 0.48 assign (resid 196 and name HB ) (resid 254 and name HG1 ) 3.57 1.77 1.77 !peak 420 #SUP 0.77 #QF 0.77 assign (resid 172 and name HB ) (resid 173 and name HB* ) 2.95 1.15 1.15 !peak 426 #SUP 0.89 #QF 0.89 assign (resid 172 and name HB ) (resid 173 and name HN ) 2.93 1.13 1.14 !peak 428 #SUP 0.98 #QF 0.98 assign (resid 205 and name HA ) (resid 227 and name HN ) 3.03 1.23 1.23 !peak 433 #SUP 0.90 #QF 0.90 assign (resid 205 and name HA ) (resid 205 and name HG2* ) 2.40 0.60 0.60 !peak 436 #SUP 0.98 #QF 0.98 assign (resid 205 and name HA ) (resid 205 and name HG1* ) 2.44 0.64 0.64 !peak 437 #SUP 0.99 #QF 0.99 assign (resid 205 and name HA ) (resid 226 and name HB1 ) 3.33 1.53 1.53 !peak 439 #SUP 0.99 #QF 0.99 assign (resid 204 and name HB* ) (resid 205 and name HA ) 3.07 1.27 1.27 !peak 441 #SUP 0.99 #QF 0.99 assign (resid 205 and name HA ) (resid 226 and name HA ) 2.61 0.81 0.81 !peak 443 #SUP 0.97 #QF 0.97 assign (resid 227 and name HA ) (resid 228 and name HB2 ) 3.35 1.55 1.55 !peak 448 #SUP 0.97 #QF 0.97 assign (resid 227 and name HA ) (resid 227 and name HG2* ) 2.64 0.84 0.84 !peak 450 #SUP 0.99 #QF 0.99 assign (resid 223 and name HG1* ) (resid 227 and name HA ) 3.70 1.90 1.90 !peak 451 #SUP 0.99 #QF 0.99 assign (resid 227 and name HA ) (resid 228 and name HN ) 2.63 0.83 0.83 !peak 454 #SUP 0.96 #QF 0.96 assign (resid 201 and name HB* ) (resid 202 and name HA ) 3.10 1.30 1.30 !peak 461 #SUP 0.54 #QF 0.54 assign (resid 202 and name HA ) (resid 204 and name HB* ) 3.77 1.97 1.97 !peak 463 #SUP 0.49 #QF 0.49 assign (resid 202 and name HA ) (resid 205 and name HG1* ) 3.09 1.29 1.29 !peak 464 #SUP 0.94 #QF 0.94 assign (resid 202 and name HA ) (resid 205 and name HB ) 2.63 0.83 0.83 !peak 468 #SUP 0.64 #QF 0.64 assign (resid 202 and name HA ) (resid 204 and name HN ) 3.30 1.50 1.50 !peak 477 #SUP 0.88 #QF 0.88 assign (resid 242 and name HA1 ) (resid 243 and name HA ) 3.57 1.77 1.77 !peak 481 #SUP 0.98 #QF 0.98 assign (resid 243 and name HA ) (resid 245 and name HN ) 3.35 1.55 1.55 !peak 485 #SUP 0.96 #QF 0.96 assign (resid 206 and name HA ) (resid 207 and name HN ) 2.85 1.05 1.05 !peak 487 #SUP 1.00 assign (resid 206 and name HA ) (resid 225 and name HA ) 3.08 1.28 1.28 !peak 491 #SUP 0.97 #QF 0.97 assign (resid 206 and name HA ) (resid 206 and name HB ) 2.39 0.59 0.59 !peak 492 #SUP 0.97 #QF 0.97 assign (resid 206 and name HA ) (resid 206 and name HG2* ) 2.40 0.60 0.60 !peak 496 #SUP 0.94 #QF 0.94 assign (resid 205 and name HG1* ) (resid 206 and name HA ) 2.78 0.98 0.98 !peak 497 #SUP 0.99 #QF 0.99 assign (resid 241 and name HA ) (resid 246 and name HG1 ) 2.92 1.12 1.12 !peak 500 #SUP 0.98 #QF 0.98 assign (resid 241 and name HA ) (resid 246 and name HG2 ) 2.80 1.00 1.00 !peak 502 #SUP 0.99 #QF 0.99 assign (resid 241 and name HA ) (resid 242 and name HA2 ) 3.43 1.63 1.63 !peak 504 #SUP 0.99 #QF 0.99 assign (resid 241 and name HA ) (resid 242 and name HA1 ) 3.41 1.61 1.61 !peak 505 #SUP 0.67 #QF 0.67 assign (resid 241 and name HA ) (resid 247 and name HN ) 3.15 1.35 1.36 !peak 506 #SUP 0.97 #QF 0.97 assign (resid 172 and name HA ) (resid 172 and name HG2* ) 2.28 0.48 0.47 !peak 515 #SUP 0.81 #QF 0.81 assign (resid 200 and name HA ) (resid 201 and name HB* ) 3.20 1.40 1.40 !peak 522 #SUP 0.97 #QF 0.97 assign (resid 200 and name HA ) (resid 256 and name HG2* ) 3.06 1.26 1.26 !peak 523 #SUP 0.84 #QF 0.76 assign (resid 200 and name HA ) (resid 256 and name HN ) 2.80 1.00 1.00 !peak 525 #SUP 0.57 #QF 0.57 assign (resid 213 and name HN ) (resid 218 and name HA ) 3.82 2.02 2.02 !peak 528 #SUP 0.84 #QF 0.84 assign (resid 214 and name HB ) (resid 218 and name HA ) 2.94 1.14 1.14 !peak 533 #SUP 0.24 #QF 0.24 assign (resid 218 and name HA ) (resid 219 and name HA ) 3.47 1.67 1.67 !peak 535 #SUP 0.92 #QF 0.92 assign (resid 212 and name HB* ) (resid 218 and name HA ) 3.48 1.68 1.68 !peak 545 #SUP 0.84 #QF 0.84 assign (resid 196 and name HA ) (resid 252 and name HN ) 2.79 0.99 0.99 !peak 546 #SUP 0.65 #QF 0.65 assign (resid 196 and name HA ) (resid 196 and name HG2* ) 2.66 0.86 0.86 !peak 551 #SUP 0.88 #QF 0.88 assign (resid 221 and name HA ) (resid 222 and name HB* ) 3.13 1.33 1.33 !peak 553 #SUP 0.96 #QF 0.96 assign (resid 203 and name HG2* ) (resid 223 and name HA ) 3.67 1.87 1.87 !peak 559 #SUP 0.87 #QF 0.70 assign (resid 223 and name HA ) (resid 233 and name HD2* ) 3.91 2.11 2.11 !peak 559 #SUP 0.87 #QF 0.70 assign (resid 176 and name HZ2 ) (resid 223 and name HA ) 3.03 1.23 1.23 !peak 562 #SUP 0.82 #QF 0.82 assign (resid 210 and name HA ) (resid 210 and name HG1* ) 2.73 0.93 0.93 !peak 567 #SUP 0.93 #QF 0.93 assign (resid 210 and name HA ) (resid 210 and name HG2* ) 2.73 0.93 0.93 !peak 569 #SUP 0.95 #QF 0.95 assign (resid 210 and name HA ) (resid 210 and name HB ) 2.55 0.75 0.75 !peak 570 #SUP 0.25 #QF 0.25 assign (resid 210 and name HA ) (resid 211 and name HA ) 3.30 1.50 1.50 !peak 574 #SUP 0.81 #QF 0.81 assign (resid 209 and name HA ) (resid 210 and name HA ) 3.40 1.60 1.60 !peak 575 #SUP 0.83 #QF 0.83 assign (resid 210 and name HA ) (resid 211 and name HN ) 2.43 0.63 0.63 !peak 577 #SUP 0.83 #QF 0.83 assign (resid 199 and name HA ) (resid 200 and name HD2 ) 2.70 0.90 0.90 !peak 578 #SUP 0.92 #QF 0.92 assign (resid 199 and name HA ) (resid 199 and name HG2* ) 2.86 1.06 1.06 !peak 580 #SUP 0.74 #QF 0.74 assign (resid 199 and name HA ) (resid 255 and name HD1* ) 3.68 1.88 1.88 !peak 581 #SUP 0.67 #QF 0.67 assign (resid 199 and name HA ) (resid 210 and name HB ) 3.03 1.23 1.23 !peak 582 #SUP 0.25 #QF 0.25 assign (resid 199 and name HA ) (resid 200 and name HD1 ) 2.65 0.85 0.85 !peak 585 #SUP 0.92 #QF 0.92 assign (resid 199 and name HN ) (resid 255 and name HA ) 3.06 1.26 1.26 !peak 588 #SUP 0.91 #QF 0.91 assign (resid 199 and name HB ) (resid 255 and name HA ) 3.04 1.24 1.24 !peak 591 #SUP 1.00 #QF 0.41 assign (resid 255 and name HA ) (resid 255 and name HG11 ) 3.00 1.20 1.20 !peak 592 #SUP 0.79 #QF 0.79 assign (resid 255 and name HA ) (resid 255 and name HG12 ) 3.05 1.25 1.25 !peak 593 #SUP 0.84 #QF 0.84 assign (resid 255 and name HA ) (resid 255 and name HD1* ) 2.71 0.91 0.91 !peak 596 #SUP 0.94 #QF 0.94 assign (resid 255 and name HA ) (resid 255 and name HG2* ) 2.58 0.78 0.78 !peak 597 #SUP 0.92 #QF 0.92 assign (resid 203 and name HA ) (resid 208 and name HA1 ) 3.27 1.47 1.47 !peak 599 #SUP 0.89 #QF 0.89 assign (resid 203 and name HA ) (resid 208 and name HA2 ) 3.48 1.68 1.68 !peak 600 #SUP 0.98 #QF 0.98 assign (resid 200 and name HD2 ) (resid 203 and name HA ) 3.66 1.86 1.86 !peak 603 #SUP 0.98 #QF 0.98 assign (resid 203 and name HA ) (resid 206 and name HB ) 3.62 1.82 1.82 !peak 604 #SUP 1.00 assign (resid 200 and name HG2 ) (resid 203 and name HA ) 3.34 1.54 1.54 !peak 605 #SUP 0.82 #QF 0.82 assign (resid 203 and name HA ) (resid 203 and name HG12 ) 2.77 0.97 0.97 !peak 607 #SUP 1.00 assign (resid 203 and name HA ) (resid 204 and name HB* ) 3.79 1.99 1.99 !peak 608 #SUP 0.93 #QF 0.93 assign (resid 203 and name HA ) (resid 206 and name HG1* ) 2.61 0.81 0.80 !peak 609 #SUP 0.88 #QF 0.68 assign (resid 203 and name HA ) (resid 203 and name HG2* ) 2.54 0.74 0.74 !peak 611 #SUP 1.00 assign (resid 203 and name HA ) (resid 207 and name HN ) 3.09 1.29 1.29 !peak 616 #SUP 0.95 #QF 0.95 assign (resid 209 and name HA ) (resid 222 and name HA ) 2.69 0.89 0.89 !peak 619 #SUP 0.99 #QF 0.99 assign (resid 209 and name HA ) (resid 220 and name HG2 ) 3.31 1.51 1.51 !peak 620 #SUP 0.70 #QF 0.70 assign (resid 209 and name HA ) (resid 209 and name HG2 ) 3.00 1.20 1.20 !peak 624 #SUP 0.98 #QF 0.98 assign (resid 209 and name HA ) (resid 209 and name HG1 ) 2.89 1.09 1.09 !peak 625 #SUP 0.95 #QF 0.95 assign (resid 209 and name HA ) (resid 223 and name HG2* ) 2.93 1.13 1.13 !peak 626 #SUP 0.99 #QF 0.83 assign (resid 209 and name HA ) (resid 221 and name HG1* ) 3.31 1.51 1.51 !peak 631 #SUP 0.92 #QF 0.92 assign (resid 209 and name HA ) (resid 221 and name HN ) 3.29 1.49 1.49 !peak 632 #SUP 0.99 #QF 0.99 assign (resid 232 and name HA ) (resid 253 and name HG2* ) 3.46 1.66 1.66 !peak 644 #SUP 0.91 #QF 0.91 assign (resid 232 and name HA ) (resid 233 and name HD1* ) 3.98 2.18 2.18 !peak 645 #SUP 0.62 #QF 0.26 assign (resid 232 and name HA ) (resid 253 and name HG1* ) 3.68 1.88 1.88 !peak 646 #SUP 0.86 #QF 0.86 assign (resid 232 and name HA ) (resid 232 and name HG1 ) 3.05 1.25 1.24 !peak 647 #SUP 0.74 #QF 0.74 assign (resid 232 and name HA ) (resid 252 and name HA ) 2.98 1.18 1.18 !peak 649 #SUP 0.89 #QF 0.89 assign (resid 198 and name HA ) (resid 256 and name HG2* ) 2.77 0.97 0.97 !peak 652 #SUP 0.88 #QF 0.88 assign (resid 198 and name HA ) (resid 254 and name HB1 ) 3.16 1.36 1.36 !peak 655 #SUP 0.94 #QF 0.94 assign (resid 196 and name HG2* ) (resid 198 and name HA ) 3.27 1.47 1.47 !peak 657 #SUP 0.95 #QF 0.60 assign (resid 197 and name HB1 ) (resid 198 and name HA ) 3.81 2.01 2.01 !peak 657 #SUP 0.95 #QF 0.60 assign (resid 198 and name HA ) (resid 254 and name HG1 ) 3.49 1.69 1.69 !peak 658 #SUP 0.91 #QF 0.91 assign (resid 198 and name HA ) (resid 254 and name HB2 ) 3.16 1.36 1.36 !peak 659 #SUP 0.67 #QF 0.67 assign (resid 198 and name HA ) (resid 253 and name HA ) 4.04 2.24 2.24 !peak 661 #SUP 0.62 #QF 0.62 assign (resid 198 and name HA ) (resid 199 and name HA ) 3.38 1.58 1.57 !peak 662 #SUP 0.64 #QF 0.64 assign (resid 198 and name HA ) (resid 256 and name HN ) 3.60 1.80 1.80 !peak 667 #SUP 0.89 #QF 0.89 assign (resid 213 and name HE* ) (resid 215 and name HA ) 3.26 1.46 1.47 !peak 669 #SUP 0.32 #QF 0.32 assign (resid 215 and name HA ) (resid 215 and name HD2* ) 2.46 0.66 0.66 !peak 673 #SUP 0.87 #QF 0.87 assign (resid 214 and name HB ) (resid 215 and name HA ) 3.55 1.75 1.75 !peak 680 #SUP 0.76 #QF 0.76 assign (resid 215 and name HA ) (resid 240 and name HD1 ) 3.51 1.71 1.71 !peak 684 #SUP 0.74 #QF 0.74 assign (resid 215 and name HA ) (resid 240 and name HE1 ) 3.06 1.26 1.26 !peak 687 #SUP 0.76 #QF 0.76 assign (resid 226 and name HA ) (resid 226 and name HD2 ) 3.30 1.50 1.50 !peak 689 #SUP 0.94 #QF 0.94 assign (resid 205 and name HG2* ) (resid 226 and name HA ) 3.08 1.28 1.28 !peak 695 #SUP 0.98 #QF 0.98 assign (resid 205 and name HG1* ) (resid 226 and name HA ) 3.18 1.38 1.38 !peak 697 #SUP 0.97 #QF 0.97 assign (resid 201 and name HA ) (resid 256 and name HN ) 3.52 1.72 1.72 !peak 706 #SUP 0.99 #QF 0.99 assign (resid 201 and name HA ) (resid 204 and name HN ) 3.02 1.22 1.22 !peak 707 #SUP 0.93 #QF 0.93 assign (resid 200 and name HA ) (resid 201 and name HA ) 3.32 1.52 1.52 !peak 709 #SUP 0.96 #QF 0.96 assign (resid 201 and name HA ) (resid 255 and name HA ) 3.54 1.74 1.74 !peak 710 #SUP 0.97 #QF 0.97 assign (resid 201 and name HA ) (resid 255 and name HG2* ) 2.45 0.65 0.65 !peak 712 #SUP 0.89 #QF 0.89 assign (resid 201 and name HA ) (resid 255 and name HD1* ) 2.83 1.03 1.03 !peak 713 #SUP 1.00 assign (resid 201 and name HA ) (resid 204 and name HB* ) 2.65 0.85 0.85 !peak 715 #SUP 0.90 #QF 0.90 assign (resid 231 and name HA ) (resid 231 and name HD2 ) 3.50 1.70 1.70 !peak 717 #SUP 0.99 #QF 0.99 assign (resid 231 and name HA ) (resid 231 and name HD1 ) 3.60 1.80 1.80 !peak 719 #SUP 0.98 #QF 0.98 assign (resid 231 and name HA ) (resid 232 and name HB1 ) 3.14 1.34 1.34 !peak 723 #SUP 0.67 #QF 0.67 assign (resid 229 and name HB* ) (resid 254 and name HA ) 2.76 0.96 0.96 !peak 741 #SUP 0.85 #QF 0.85 assign (resid 254 and name HA ) (resid 256 and name HG2* ) 3.55 1.75 1.75 !peak 742 #SUP 0.86 #QF 0.86 assign (resid 254 and name HA ) (resid 255 and name HG12 ) 3.06 1.26 1.26 !peak 745 #SUP 0.95 #QF 0.95 assign (resid 254 and name HA ) (resid 254 and name HD2 ) 3.23 1.43 1.43 !peak 746 #SUP 0.93 #QF 0.93 assign (resid 232 and name HD1 ) (resid 250 and name HA ) 3.60 1.80 1.80 !peak 749 #SUP 0.78 #QF 0.67 assign (resid 235 and name HG ) (resid 250 and name HA ) 3.85 2.05 2.05 !peak 749 #SUP 0.78 #QF 0.67 assign (resid 204 and name HA ) (resid 223 and name HB ) 3.20 1.40 1.40 !peak 752 #SUP 0.75 #QF 0.75 assign (resid 204 and name HA ) (resid 227 and name HG2* ) 3.18 1.38 1.38 !peak 754 #SUP 0.99 #QF 0.99 assign (resid 204 and name HA ) (resid 223 and name HG1* ) 2.57 0.77 0.77 !peak 755 #SUP 0.90 #QF 0.90 assign (resid 203 and name HG2* ) (resid 204 and name HA ) 3.10 1.30 1.30 !peak 757 #SUP 0.99 #QF 0.99 assign (resid 204 and name HA ) (resid 255 and name HD1* ) 3.23 1.43 1.43 !peak 758 #SUP 1.00 assign (resid 204 and name HA ) (resid 227 and name HN ) 3.02 1.22 1.22 !peak 760 #SUP 0.98 #QF 0.98 assign (resid 203 and name HN ) (resid 204 and name HA ) 3.91 2.11 2.11 !peak 763 #SUP 0.90 #QF 0.90 assign (resid 172 and name HG2* ) (resid 173 and name HA ) 3.35 1.55 1.55 !peak 806 #SUP 0.89 #QF 0.89 assign (resid 232 and name HG1 ) (resid 251 and name HA ) 3.43 1.63 1.63 !peak 812 #SUP 0.95 #QF 0.95 assign (resid 232 and name HB2 ) (resid 251 and name HA ) 3.21 1.41 1.41 !peak 816 #SUP 0.43 #QF 0.43 assign (resid 251 and name HA ) (resid 252 and name HN ) 2.73 0.93 0.93 !peak 818 #SUP 0.91 #QF 0.91 assign (resid 222 and name HA ) (resid 223 and name HG2* ) 3.13 1.33 1.33 !peak 821 #SUP 0.96 #QF 0.96 assign (resid 210 and name HN ) (resid 222 and name HA ) 3.16 1.36 1.36 !peak 824 #SUP 0.97 #QF 0.97 assign (resid 197 and name HD1* ) (resid 212 and name HA ) 2.70 0.90 0.90 !peak 831 #SUP 0.98 #QF 0.98 assign (resid 200 and name HD1 ) (resid 210 and name HG1* ) 3.67 1.87 1.87 !peak 837 #SUP 0.99 #QF 0.99 assign (resid 200 and name HD1 ) (resid 203 and name HD1* ) 2.79 0.99 0.99 !peak 838 #SUP 0.98 #QF 0.98 assign (resid 199 and name HG2* ) (resid 200 and name HD2 ) 3.38 1.58 1.58 !peak 840 #SUP 1.00 #QF 0.98 assign (resid 201 and name HB* ) (resid 202 and name HD2 ) 2.53 0.73 0.73 !peak 861 #SUP 0.99 #QF 0.99 assign (resid 201 and name HB* ) (resid 202 and name HD1 ) 2.70 0.90 0.90 !peak 862 #SUP 1.00 assign (resid 207 and name HA2 ) (resid 225 and name HD1 ) 3.38 1.58 1.57 !peak 866 #SUP 0.75 #QF 0.75 assign (resid 200 and name HB2 ) (resid 202 and name HD2 ) 3.03 1.23 1.23 !peak 870 #SUP 1.00 assign (resid 200 and name HB2 ) (resid 202 and name HD1 ) 2.92 1.12 1.12 !peak 871 #SUP 0.99 #QF 0.99 assign (resid 200 and name HB1 ) (resid 202 and name HD2 ) 2.85 1.05 1.05 !peak 878 #SUP 0.72 #QF 0.72 assign (resid 224 and name HB2 ) (resid 225 and name HD2 ) 3.30 1.50 1.50 !peak 880 #SUP 0.69 #QF 0.69 assign (resid 202 and name HD1 ) (resid 203 and name HN ) 3.08 1.28 1.28 !peak 884 #SUP 0.98 #QF 0.98 assign (resid 240 and name HB1 ) (resid 241 and name HD1 ) 3.07 1.27 1.27 !peak 891 #SUP 0.95 #QF 0.95 assign (resid 240 and name HB2 ) (resid 241 and name HD1 ) 3.48 1.68 1.68 !peak 892 #SUP 0.96 #QF 0.96 assign (resid 240 and name HB1 ) (resid 241 and name HD2 ) 3.07 1.27 1.27 !peak 893 #SUP 0.78 #QF 0.78 assign (resid 240 and name HB2 ) (resid 241 and name HD2 ) 3.48 1.68 1.68 !peak 894 #SUP 0.89 #QF 0.89 assign (resid 240 and name HD1 ) (resid 241 and name HD1 ) 3.13 1.33 1.33 !peak 898 #SUP 0.98 #QF 0.98 assign (resid 240 and name HD1 ) (resid 241 and name HD2 ) 3.13 1.33 1.33 !peak 899 #SUP 0.55 #QF 0.55 assign (resid 242 and name HA2 ) (resid 243 and name HD1 ) 2.57 0.77 0.77 !peak 911 #SUP 0.91 #QF 0.91 assign (resid 242 and name HA1 ) (resid 243 and name HD1 ) 2.63 0.83 0.83 !peak 912 #SUP 0.99 #QF 0.99 assign (resid 242 and name HA2 ) (resid 243 and name HD2 ) 2.58 0.78 0.78 !peak 913 #SUP 0.97 #QF 0.97 assign (resid 242 and name HA1 ) (resid 243 and name HD2 ) 2.59 0.79 0.79 !peak 914 #SUP 0.97 #QF 0.97 assign (resid 242 and name HN ) (resid 243 and name HD1 ) 3.77 1.97 1.97 !peak 922 #SUP 0.81 #QF 0.81 assign (resid 242 and name HN ) (resid 243 and name HD2 ) 3.40 1.60 1.60 !peak 923 #SUP 0.96 #QF 0.96 assign (resid 195 and name HB* ) (resid 251 and name HB1 ) 3.22 1.42 1.42 !peak 928 #SUP 0.33 #QF 0.33 assign (resid 199 and name HB ) (resid 227 and name HG2* ) 3.66 1.86 1.86 !peak 929 #SUP 0.58 #QF 0.23 assign (resid 232 and name HB1 ) (resid 253 and name HG2* ) 3.82 2.02 2.02 !peak 929 #SUP 0.58 #QF 0.23 assign (resid 196 and name HG2* ) (resid 252 and name HA ) 3.79 1.99 1.99 !peak 941 #SUP 0.50 #QF 0.50 assign (resid 195 and name HB* ) (resid 196 and name HG2* ) 3.64 1.84 1.84 !peak 946 #SUP 0.47 #QF 0.47 assign (resid 196 and name HG2* ) (resid 254 and name HG1 ) 2.93 1.13 1.13 !peak 947 #SUP 0.27 #QF 0.27 assign (resid 236 and name HB1 ) (resid 237 and name HA1 ) 3.22 1.42 1.42 !peak 992 #SUP 0.70 #QF 0.70 assign (resid 229 and name HA ) (resid 230 and name HA1 ) 3.41 1.61 1.61 !peak 1000 #SUP 0.65 #QF 0.65 assign (resid 229 and name HB* ) (resid 230 and name HA2 ) 3.28 1.48 1.48 !peak 1005 #SUP 0.54 #QF 0.54 assign (resid 203 and name HG2* ) (resid 208 and name HA1 ) 2.90 1.10 1.10 !peak 1013 #SUP 0.99 #QF 0.99 assign (resid 203 and name HG2* ) (resid 208 and name HA2 ) 2.96 1.16 1.16 !peak 1015 #SUP 0.73 #QF 0.73 assign (resid 208 and name HA2 ) (resid 209 and name HN ) 2.69 0.89 0.89 !peak 1019 #SUP 0.87 #QF 0.87 assign (resid 203 and name HD1* ) (resid 208 and name HA1 ) 3.23 1.43 1.43 !peak 1027 #SUP 0.97 #QF 0.97 assign (resid 206 and name HA ) (resid 207 and name HA2 ) 3.80 2.00 2.00 !peak 1034 #SUP 0.50 #QF 0.50 assign (resid 207 and name HA1 ) (resid 223 and name HG1* ) 3.52 1.72 1.72 !peak 1039 #SUP 0.41 #QF 0.41 assign (resid 207 and name HA2 ) (resid 223 and name HG1* ) 3.20 1.40 1.40 !peak 1040 #SUP 0.90 #QF 0.90 assign (resid 231 and name HB2 ) (resid 231 and name HD2 ) 2.88 1.08 1.08 !peak 1041 #SUP 0.88 #QF 0.88 assign (resid 231 and name HB1 ) (resid 231 and name HD2 ) 2.74 0.94 0.94 !peak 1042 #SUP 1.00 #QF 0.60 assign (resid 227 and name HG2* ) (resid 231 and name HD2 ) 2.95 1.15 1.15 !peak 1043 #SUP 0.99 #QF 0.99 assign (resid 176 and name HE3 ) (resid 231 and name HD2 ) 3.20 1.40 1.40 !peak 1051 #SUP 0.98 #QF 0.98 assign (resid 227 and name HG2* ) (resid 231 and name HD1 ) 2.95 1.15 1.15 !peak 1052 #SUP 0.99 #QF 0.96 assign (resid 231 and name HB1 ) (resid 231 and name HD1 ) 2.74 0.94 0.94 !peak 1054 #SUP 1.00 #QF 0.85 assign (resid 231 and name HB2 ) (resid 231 and name HD1 ) 2.88 1.08 1.08 !peak 1055 #SUP 0.98 #QF 0.98 assign (resid 226 and name HA ) (resid 226 and name HD1 ) 3.27 1.47 1.47 !peak 1059 #SUP 0.46 #QF 0.46 assign (resid 254 and name HA ) (resid 254 and name HD1 ) 3.04 1.24 1.24 !peak 1061 #SUP 0.87 #QF 0.87 assign (resid 205 and name HG2* ) (resid 226 and name HD2 ) 3.17 1.37 1.37 !peak 1063 #SUP 0.97 #QF 0.97 assign (resid 205 and name HG1* ) (resid 226 and name HD2 ) 3.17 1.37 1.37 !peak 1064 #SUP 0.76 #QF 0.76 assign (resid 226 and name HB2 ) (resid 226 and name HD2 ) 2.82 1.02 1.03 !peak 1065 #SUP 0.99 #QF 0.99 assign (resid 226 and name HB1 ) (resid 226 and name HD2 ) 3.15 1.35 1.35 !peak 1066 #SUP 1.00 assign (resid 205 and name HA ) (resid 226 and name HD2 ) 3.10 1.30 1.30 !peak 1070 #SUP 0.96 #QF 0.96 assign (resid 226 and name HN ) (resid 226 and name HD2 ) 3.51 1.71 1.71 !peak 1071 #SUP 0.97 #QF 0.97 assign (resid 226 and name HB2 ) (resid 226 and name HD1 ) 2.68 0.88 0.88 !peak 1072 #SUP 0.88 #QF 0.88 assign (resid 254 and name HB1 ) (resid 254 and name HD2 ) 2.89 1.09 1.09 !peak 1098 #SUP 0.95 #QF 0.95 assign (resid 196 and name HG2* ) (resid 254 and name HD1 ) 2.82 1.02 1.03 !peak 1100 #SUP 0.95 #QF 0.95 assign (resid 220 and name HG1 ) (resid 221 and name HN ) 3.24 1.44 1.44 !peak 1123 #SUP 0.95 #QF 0.95 assign (resid 211 and name HN ) (resid 220 and name HG2 ) 3.24 1.44 1.44 !peak 1125 #SUP 0.85 #QF 0.85 assign (resid 211 and name HN ) (resid 220 and name HG1 ) 3.03 1.23 1.23 !peak 1126 #SUP 0.85 #QF 0.85 assign (resid 220 and name HA ) (resid 220 and name HG2 ) 3.01 1.21 1.21 !peak 1127 #SUP 1.00 assign (resid 211 and name HA ) (resid 220 and name HG1 ) 3.22 1.42 1.42 !peak 1128 #SUP 0.53 #QF 0.53 assign (resid 220 and name HA ) (resid 220 and name HG1 ) 3.01 1.21 1.21 !peak 1129 #SUP 0.90 #QF 0.90 assign (resid 216 and name HA ) (resid 216 and name HG1 ) 2.91 1.11 1.11 !peak 1136 #SUP 0.79 #QF 0.79 assign (resid 216 and name HN ) (resid 216 and name HG2 ) 3.38 1.58 1.57 !peak 1140 #SUP 0.98 #QF 0.98 assign (resid 216 and name HN ) (resid 216 and name HG1 ) 3.38 1.58 1.57 !peak 1141 #SUP 1.00 assign (resid 203 and name HB ) (resid 255 and name HD1* ) 3.83 2.03 2.03 !peak 1145 #SUP 0.83 #QF 0.83 assign (resid 203 and name HB ) (resid 204 and name HN ) 3.16 1.36 1.36 !peak 1149 #SUP 0.99 #QF 0.99 assign (resid 229 and name HB* ) (resid 255 and name HB ) 2.87 1.07 1.07 !peak 1153 #SUP 0.99 #QF 0.91 assign (resid 254 and name HA ) (resid 255 and name HB ) 3.52 1.72 1.72 !peak 1157 #SUP 0.99 #QF 0.99 assign (resid 212 and name HB* ) (resid 219 and name HB ) 3.47 1.67 1.67 !peak 1161 #SUP 0.58 #QF 0.58 assign (resid 219 and name HB ) (resid 220 and name HN ) 2.69 0.89 0.89 !peak 1165 #SUP 0.21 #QF 0.21 assign (resid 209 and name HB1 ) (resid 220 and name HG1 ) 3.28 1.48 1.48 !peak 1181 #SUP 0.58 #QF 0.58 assign (resid 209 and name HB2 ) (resid 210 and name HN ) 3.23 1.43 1.43 !peak 1186 #SUP 0.98 #QF 0.98 assign (resid 199 and name HB ) (resid 204 and name HB* ) 3.45 1.65 1.65 !peak 1192 #SUP 0.76 #QF 0.40 assign (resid 220 and name HA ) (resid 221 and name HB ) 3.28 1.48 1.48 !peak 1195 #SUP 0.86 #QF 0.86 assign (resid 210 and name HN ) (resid 221 and name HB ) 3.76 1.96 1.96 !peak 1200 #SUP 0.99 #QF 0.99 assign (resid 221 and name HB ) (resid 222 and name HN ) 3.23 1.43 1.43 !peak 1201 #SUP 1.00 assign (resid 191 and name HA ) (resid 191 and name HG2 ) 2.91 1.11 1.11 !peak 1206 #SUP 0.91 #QF 0.91 assign (resid 191 and name HA ) (resid 191 and name HG1 ) 2.96 1.16 1.16 !peak 1207 #SUP 0.96 #QF 0.96 assign (resid 191 and name HG1 ) (resid 242 and name HA2 ) 3.99 2.19 2.19 !peak 1208 #SUP 0.92 #QF 0.27 assign (resid 191 and name HG2 ) (resid 242 and name HA2 ) 3.30 1.50 1.50 !peak 1209 #SUP 0.59 #QF 0.59 assign (resid 191 and name HG1 ) (resid 242 and name HA1 ) 3.70 1.90 1.90 !peak 1210 #SUP 0.94 #QF 0.94 assign (resid 191 and name HG2 ) (resid 242 and name HA1 ) 3.28 1.48 1.48 !peak 1211 #SUP 0.90 #QF 0.90 assign (resid 228 and name HB1 ) (resid 228 and name HG1 ) 2.45 0.65 0.65 !peak 1221 #SUP 0.94 #QF 0.94 assign (resid 228 and name HG1 ) (resid 229 and name HN ) 2.92 1.12 1.12 !peak 1226 #SUP 0.94 #QF 0.94 assign (resid 228 and name HN ) (resid 228 and name HG1 ) 3.22 1.42 1.42 !peak 1227 #SUP 0.95 #QF 0.95 assign (resid 227 and name HG2* ) (resid 228 and name HG1 ) 3.84 2.04 2.04 !peak 1230 #SUP 0.82 #QF 0.82 assign (resid 200 and name HB2 ) (resid 203 and name HD1* ) 3.28 1.48 1.48 !peak 1238 #SUP 0.99 #QF 0.99 assign (resid 206 and name HB ) (resid 207 and name HN ) 3.18 1.38 1.38 !peak 1243 #SUP 0.96 #QF 0.96 assign (resid 224 and name HA ) (resid 225 and name HD1 ) 2.59 0.79 0.79 !peak 1279 #SUP 0.98 #QF 0.98 assign (resid 224 and name HA ) (resid 225 and name HD2 ) 2.64 0.84 0.84 !peak 1280 #SUP 0.99 #QF 0.99 assign (resid 243 and name HB2 ) (resid 244 and name HN ) 3.26 1.46 1.46 !peak 1293 #SUP 0.98 #QF 0.98 assign (resid 243 and name HB2 ) (resid 244 and name HB* ) 3.25 1.45 1.45 !peak 1294 #SUP 0.99 #QF 0.99 assign (resid 224 and name HB1 ) (resid 225 and name HD2 ) 3.30 1.50 1.50 !peak 1296 #SUP 0.99 #QF 0.92 assign (resid 206 and name HA ) (resid 225 and name HB1 ) 3.23 1.43 1.43 !peak 1304 #SUP 0.91 #QF 0.91 assign (resid 205 and name HB ) (resid 226 and name HA ) 3.55 1.75 1.75 !peak 1309 #SUP 0.68 #QF 0.68 assign (resid 235 and name HA ) (resid 236 and name HB2 ) 3.35 1.55 1.55 !peak 1341 #SUP 0.84 #QF 0.84 assign (resid 236 and name HN ) (resid 236 and name HB2 ) 2.98 1.18 1.18 !peak 1350 #SUP 0.91 #QF 0.91 assign (resid 236 and name HN ) (resid 236 and name HB1 ) 2.91 1.11 1.11 !peak 1351 #SUP 0.93 #QF 0.93 assign (resid 236 and name HB2 ) (resid 237 and name HN ) 3.34 1.54 1.54 !peak 1352 #SUP 1.00 assign (resid 203 and name HG2* ) (resid 223 and name HB ) 3.13 1.33 1.33 !peak 1365 #SUP 0.96 #QF 0.96 assign (resid 211 and name HB2 ) (resid 220 and name HG1 ) 3.28 1.48 1.48 !peak 1371 #SUP 0.93 #QF 0.93 assign (resid 211 and name HN ) (resid 211 and name HB2 ) 2.84 1.04 1.04 !peak 1375 #SUP 0.86 #QF 0.86 assign (resid 211 and name HB1 ) (resid 212 and name HN ) 3.08 1.28 1.28 !peak 1377 #SUP 0.93 #QF 0.93 assign (resid 211 and name HB2 ) (resid 212 and name HN ) 3.15 1.35 1.35 !peak 1378 #SUP 0.89 #QF 0.89 assign (resid 211 and name HB2 ) (resid 220 and name HA ) 3.38 1.58 1.58 !peak 1384 #SUP 0.67 #QF 0.67 assign (resid 210 and name HA ) (resid 211 and name HB1 ) 3.47 1.67 1.67 !peak 1385 #SUP 0.92 #QF 0.92 assign (resid 220 and name HB1 ) (resid 221 and name HN ) 3.30 1.50 1.50 !peak 1390 #SUP 0.71 #QF 0.71 assign (resid 231 and name HB2 ) (resid 253 and name HG2* ) 3.03 1.23 1.23 !peak 1397 #SUP 0.95 #QF 0.73 assign (resid 231 and name HB1 ) (resid 253 and name HG2* ) 3.03 1.23 1.23 !peak 1398 #SUP 0.91 #QF 0.91 assign (resid 228 and name HA ) (resid 228 and name HG1 ) 2.59 0.79 0.79 !peak 1415 #SUP 0.93 #QF 0.93 assign (resid 228 and name HA ) (resid 255 and name HG11 ) 2.72 0.92 0.92 !peak 1418 #SUP 0.66 #QF 0.66 assign (resid 204 and name HB* ) (resid 228 and name HA ) 3.31 1.51 1.51 !peak 1419 #SUP 0.52 #QF 0.52 assign (resid 227 and name HG2* ) (resid 228 and name HA ) 3.17 1.37 1.37 !peak 1420 #SUP 0.90 #QF 0.90 assign (resid 228 and name HA ) (resid 255 and name HD1* ) 2.80 1.00 1.00 !peak 1421 #SUP 0.92 #QF 0.92 assign (resid 228 and name HA ) (resid 229 and name HN ) 2.45 0.65 0.65 !peak 1423 #SUP 0.85 #QF 0.85 assign (resid 235 and name HA ) (resid 236 and name HA ) 3.45 1.65 1.65 !peak 1426 #SUP 0.74 #QF 0.74 assign (resid 235 and name HA ) (resid 235 and name HG ) 2.91 1.11 1.11 !peak 1429 #SUP 0.33 #QF 0.33 assign (resid 238 and name HA ) (resid 238 and name HG2 ) 2.89 1.09 1.09 !peak 1431 #SUP 0.47 #QF 0.47 assign (resid 229 and name HA ) (resid 253 and name HB ) 3.05 1.25 1.24 !peak 1437 #SUP 0.55 #QF 0.55 assign (resid 227 and name HG2* ) (resid 229 and name HA ) 3.08 1.28 1.28 !peak 1438 #SUP 0.54 #QF 0.54 assign (resid 228 and name HA ) (resid 229 and name HA ) 3.51 1.71 1.71 !peak 1439 #SUP 0.90 #QF 0.78 assign (resid 229 and name HA ) (resid 230 and name HA2 ) 3.76 1.96 1.96 !peak 1439 #SUP 0.90 #QF 0.78 assign (resid 209 and name HA ) (resid 209 and name HD1 ) 3.43 1.63 1.63 !peak 1468 #SUP 0.97 #QF 0.97 assign (resid 209 and name HA ) (resid 209 and name HD2 ) 3.43 1.63 1.63 !peak 1469 #SUP 0.78 #QF 0.78 assign (resid 203 and name HG2* ) (resid 203 and name HG11 ) 2.86 1.06 1.06 !peak 1478 #SUP 0.91 #QF 0.91 assign (resid 203 and name HA ) (resid 203 and name HG11 ) 2.93 1.13 1.14 !peak 1483 #SUP 0.98 #QF 0.98 assign (resid 201 and name HB* ) (resid 202 and name HG2 ) 3.50 1.70 1.70 !peak 1494 #SUP 0.91 #QF 0.91 assign (resid 200 and name HG1 ) (resid 203 and name HD1* ) 3.33 1.53 1.53 !peak 1514 #SUP 0.99 #QF 0.45 assign (resid 211 and name HA ) (resid 211 and name HG1 ) 3.05 1.25 1.24 !peak 1542 #SUP 0.84 #QF 0.84 assign (resid 211 and name HA ) (resid 211 and name HG2 ) 3.02 1.22 1.22 !peak 1548 #SUP 0.95 #QF 0.95 assign (resid 229 and name HB* ) (resid 255 and name HG12 ) 2.60 0.80 0.80 !peak 1574 #SUP 0.88 #QF 0.88 assign (resid 229 and name HA ) (resid 255 and name HG11 ) 3.25 1.45 1.45 !peak 1582 #SUP 0.92 #QF 0.92 assign (resid 254 and name HA ) (resid 254 and name HG2 ) 3.02 1.22 1.22 !peak 1609 #SUP 0.75 #QF 0.75 assign (resid 196 and name HG2* ) (resid 254 and name HG2 ) 3.28 1.48 1.48 !peak 1622 #SUP 0.73 #QF 0.73 assign (resid 212 and name HA ) (resid 251 and name HD2* ) 3.76 1.96 1.96 !peak 1626 #SUP 0.93 #QF 0.61 assign (resid 251 and name HB2 ) (resid 251 and name HD2* ) 3.19 1.39 1.39 !peak 1628 #SUP 0.94 #QF 0.94 assign (resid 232 and name HG2 ) (resid 252 and name HA ) 3.53 1.73 1.73 !peak 1642 #SUP 0.97 #QF 0.97 assign (resid 232 and name HG1 ) (resid 252 and name HA ) 3.30 1.50 1.50 !peak 1643 #SUP 0.70 #QF 0.70 assign (resid 232 and name HN ) (resid 232 and name HG1 ) 3.54 1.74 1.74 !peak 1646 #SUP 0.96 #QF 0.96 assign (resid 209 and name HN ) (resid 209 and name HG1 ) 3.58 1.78 1.78 !peak 1660 #SUP 0.98 #QF 0.76 assign (resid 209 and name HG1 ) (resid 222 and name HN ) 3.68 1.88 1.88 !peak 1660 #SUP 0.98 #QF 0.76 assign (resid 209 and name HG2 ) (resid 222 and name HN ) 3.20 1.40 1.40 !peak 1661 #SUP 0.68 #QF 0.68 assign (resid 249 and name HD2* ) (resid 251 and name HB1 ) 3.09 1.29 1.29 !peak 1668 #SUP 0.81 #QF 0.81 assign (resid 235 and name HD1* ) (resid 249 and name HD2* ) 2.57 0.77 0.77 !peak 1669 #SUP 1.00 #QF 0.78 assign (resid 235 and name HG ) (resid 249 and name HD2* ) 3.14 1.34 1.34 !peak 1670 #SUP 1.00 #QF 0.87 assign (resid 195 and name HB* ) (resid 249 and name HD2* ) 3.26 1.46 1.46 !peak 1671 #SUP 1.00 #QF 0.94 assign (resid 197 and name HB2 ) (resid 197 and name HD2* ) 2.88 1.08 1.08 !peak 1674 #SUP 0.93 #QF 0.93 assign (resid 197 and name HB1 ) (resid 197 and name HD2* ) 2.74 0.94 0.94 !peak 1676 #SUP 0.88 #QF 0.88 assign (resid 197 and name HD2* ) (resid 253 and name HG2* ) 2.83 1.03 1.03 !peak 1677 #SUP 0.92 #QF 0.92 assign (resid 214 and name HB ) (resid 249 and name HD2* ) 3.25 1.45 1.45 !peak 1680 #SUP 0.38 #QF 0.38 assign (resid 235 and name HD2* ) (resid 238 and name HB1 ) 3.87 2.07 2.07 !peak 1686 #SUP 0.95 #QF 0.95 assign (resid 221 and name HB ) (resid 235 and name HD2* ) 3.44 1.64 1.64 !peak 1687 #SUP 0.26 #QF 0.26 assign (resid 235 and name HB1 ) (resid 235 and name HD2* ) 2.86 1.06 1.06 !peak 1688 #SUP 1.00 assign (resid 173 and name HB* ) (resid 235 and name HD2* ) 2.56 0.76 0.76 !peak 1689 #SUP 0.58 #QF 0.58 assign (resid 235 and name HB2 ) (resid 235 and name HD2* ) 2.70 0.90 0.90 !peak 1690 #SUP 0.95 #QF 0.95 assign (resid 235 and name HA ) (resid 235 and name HD2* ) 2.98 1.18 1.18 !peak 1692 #SUP 0.91 #QF 0.91 assign (resid 173 and name HA ) (resid 235 and name HD2* ) 3.10 1.30 1.30 !peak 1693 #SUP 1.00 #QF 0.98 assign (resid 235 and name HD2* ) (resid 236 and name HN ) 3.33 1.53 1.53 !peak 1696 #SUP 0.90 #QF 0.90 assign (resid 215 and name HA ) (resid 215 and name HD1* ) 3.15 1.35 1.36 !peak 1698 #SUP 0.73 #QF 0.73 assign (resid 219 and name HB ) (resid 235 and name HD1* ) 3.26 1.46 1.47 !peak 1703 #SUP 0.65 #QF 0.65 assign (resid 251 and name HB2 ) (resid 251 and name HD1* ) 3.19 1.39 1.39 !peak 1704 #SUP 0.89 #QF 0.57 assign (resid 173 and name HB* ) (resid 235 and name HD1* ) 2.63 0.83 0.83 !peak 1707 #SUP 0.66 #QF 0.66 assign (resid 235 and name HD1* ) (resid 238 and name HG1 ) 2.74 0.94 0.94 !peak 1709 #SUP 1.00 #QF 0.98 assign (resid 251 and name HA ) (resid 251 and name HD1* ) 3.14 1.34 1.34 !peak 1711 #SUP 0.94 #QF 0.94 assign (resid 212 and name HA ) (resid 251 and name HD1* ) 3.76 1.96 1.96 !peak 1712 #SUP 0.70 #QF 0.70 assign (resid 235 and name HA ) (resid 235 and name HD1* ) 2.98 1.18 1.18 !peak 1713 #SUP 0.99 #QF 0.99 assign (resid 235 and name HD1* ) (resid 236 and name HN ) 3.64 1.84 1.84 !peak 1718 #SUP 0.97 #QF 0.97 assign (resid 197 and name HD1* ) (resid 251 and name HA ) 4.24 2.44 2.44 !peak 1720 #SUP 0.95 #QF 0.94 assign (resid 197 and name HD1* ) (resid 211 and name HA ) 3.30 1.50 1.50 !peak 1722 #SUP 0.46 #QF 0.46 assign (resid 197 and name HA ) (resid 197 and name HD1* ) 2.51 0.71 0.71 !peak 1723 #SUP 0.97 #QF 0.92 assign (resid 197 and name HD1* ) (resid 253 and name HA ) 3.50 1.70 1.70 !peak 1724 #SUP 0.83 #QF 0.83 assign (resid 197 and name HD1* ) (resid 210 and name HB ) 3.15 1.35 1.36 !peak 1726 #SUP 0.37 #QF 0.37 assign (resid 197 and name HB2 ) (resid 197 and name HD1* ) 2.80 1.00 1.00 !peak 1727 #SUP 0.95 #QF 0.88 assign (resid 215 and name HB1 ) (resid 215 and name HD2* ) 2.89 1.09 1.09 !peak 1727 #SUP 0.95 #QF 0.88 assign (resid 197 and name HD1* ) (resid 221 and name HN ) 3.39 1.59 1.59 !peak 1730 #SUP 0.82 #QF 0.82 assign (resid 197 and name HD1* ) (resid 211 and name HN ) 3.40 1.60 1.60 !peak 1731 #SUP 0.98 #QF 0.56 assign (resid 197 and name HD1* ) (resid 213 and name HN ) 3.50 1.70 1.70 !peak 1731 #SUP 0.98 #QF 0.56 assign (resid 215 and name HB2 ) (resid 215 and name HD2* ) 2.76 0.96 0.96 !peak 1733 #SUP 0.89 #QF 0.89 assign (resid 197 and name HD1* ) (resid 251 and name HB2 ) 2.87 1.07 1.07 !peak 1734 #SUP 0.49 #QF 0.49 assign (resid 215 and name HD2* ) (resid 240 and name HD1 ) 2.84 1.04 1.04 !peak 1735 #SUP 0.90 #QF 0.90 assign (resid 195 and name HB* ) (resid 249 and name HD1* ) 2.76 0.96 0.96 !peak 1737 #SUP 0.80 #QF 0.80 assign (resid 195 and name HB* ) (resid 252 and name HN ) 3.35 1.55 1.55 !peak 1742 #SUP 0.90 #QF 0.90 assign (resid 195 and name HB* ) (resid 197 and name HN ) 3.51 1.71 1.71 !peak 1743 #SUP 0.71 #QF 0.71 assign (resid 195 and name HB* ) (resid 251 and name HB2 ) 3.22 1.42 1.42 !peak 1749 #SUP 0.81 #QF 0.81 assign (resid 230 and name HN ) (resid 255 and name HD1* ) 4.01 2.21 2.21 !peak 1759 #SUP 0.91 #QF 0.91 assign (resid 227 and name HN ) (resid 255 and name HD1* ) 3.12 1.32 1.32 !peak 1760 #SUP 0.99 #QF 0.55 assign (resid 229 and name HN ) (resid 255 and name HD1* ) 3.09 1.29 1.29 !peak 1760 #SUP 0.99 #QF 0.55 assign (resid 255 and name HN ) (resid 255 and name HD1* ) 2.96 1.16 1.16 !peak 1761 #SUP 1.00 #QF 0.99 assign (resid 255 and name HD1* ) (resid 256 and name HN ) 3.18 1.38 1.38 !peak 1761 #SUP 1.00 #QF 0.99 assign (resid 204 and name HN ) (resid 255 and name HD1* ) 3.33 1.53 1.53 !peak 1762 #SUP 0.99 #QF 0.99 assign (resid 228 and name HB1 ) (resid 255 and name HD1* ) 4.00 2.20 2.20 !peak 1767 #SUP 0.99 #QF 0.83 assign (resid 253 and name HB ) (resid 255 and name HD1* ) 3.61 1.81 1.81 !peak 1767 #SUP 0.99 #QF 0.83 assign (resid 199 and name HB ) (resid 255 and name HD1* ) 2.91 1.11 1.11 !peak 1768 #SUP 1.00 #QF 0.48 assign (resid 203 and name HN ) (resid 203 and name HD1* ) 3.11 1.31 1.31 !peak 1776 #SUP 0.99 #QF 0.99 assign (resid 199 and name HA ) (resid 203 and name HD1* ) 3.24 1.44 1.44 !peak 1777 #SUP 0.99 #QF 0.65 assign (resid 203 and name HD1* ) (resid 210 and name HA ) 2.97 1.17 1.17 !peak 1777 #SUP 0.99 #QF 0.65 assign (resid 203 and name HA ) (resid 203 and name HD1* ) 2.94 1.14 1.14 !peak 1780 #SUP 1.00 assign (resid 200 and name HD2 ) (resid 203 and name HD1* ) 2.91 1.11 1.11 !peak 1781 #SUP 0.99 #QF 0.99 assign (resid 200 and name HG2 ) (resid 203 and name HD1* ) 2.80 1.00 1.00 !peak 1783 #SUP 0.98 #QF 0.98 assign (resid 203 and name HB ) (resid 203 and name HD1* ) 2.77 0.97 0.97 !peak 1784 #SUP 0.99 #QF 0.99 assign (resid 203 and name HD1* ) (resid 204 and name HB* ) 3.97 2.17 2.17 !peak 1786 #SUP 0.85 #QF 0.85 assign (resid 199 and name HA ) (resid 203 and name HG2* ) 3.41 1.61 1.61 !peak 1804 #SUP 1.00 #QF 0.85 assign (resid 200 and name HD1 ) (resid 203 and name HG2* ) 3.31 1.51 1.51 !peak 1806 #SUP 1.00 #QF 0.61 assign (resid 203 and name HG2* ) (resid 255 and name HD1* ) 3.64 1.84 1.84 !peak 1807 #SUP 0.86 #QF 0.86 assign (resid 201 and name HB* ) (resid 202 and name HG1 ) 3.50 1.70 1.70 !peak 1814 #SUP 0.96 #QF 0.96 assign (resid 201 and name HB* ) (resid 202 and name HB1 ) 3.34 1.54 1.54 !peak 1815 #SUP 0.81 #QF 0.81 assign (resid 201 and name HB* ) (resid 255 and name HG2* ) 2.68 0.88 0.88 !peak 1818 #SUP 0.98 #QF 0.98 assign (resid 201 and name HB* ) (resid 255 and name HD1* ) 3.56 1.76 1.76 !peak 1819 #SUP 0.99 #QF 0.99 assign (resid 229 and name HN ) (resid 229 and name HB* ) 2.60 0.80 0.80 !peak 1827 #SUP 0.98 #QF 0.98 assign (resid 229 and name HB* ) (resid 255 and name HN ) 3.10 1.30 1.30 !peak 1828 #SUP 0.97 #QF 0.97 assign (resid 229 and name HB* ) (resid 231 and name HN ) 3.39 1.59 1.59 !peak 1829 #SUP 0.95 #QF 0.95 assign (resid 228 and name HA ) (resid 229 and name HB* ) 3.23 1.43 1.43 !peak 1831 #SUP 0.97 #QF 0.97 assign (resid 229 and name HB* ) (resid 230 and name HA1 ) 3.35 1.55 1.55 !peak 1833 #SUP 0.88 #QF 0.88 assign (resid 228 and name HB1 ) (resid 229 and name HB* ) 3.33 1.53 1.53 !peak 1834 #SUP 0.93 #QF 0.93 assign (resid 222 and name HB* ) (resid 223 and name HN ) 2.84 1.04 1.04 !peak 1851 #SUP 0.99 #QF 0.99 assign (resid 209 and name HA ) (resid 222 and name HB* ) 3.26 1.46 1.47 !peak 1853 #SUP 0.95 #QF 0.95 assign (resid 209 and name HD1 ) (resid 222 and name HB* ) 3.17 1.37 1.37 !peak 1859 #SUP 0.87 #QF 0.87 assign (resid 222 and name HB* ) (resid 223 and name HG2* ) 3.46 1.66 1.66 !peak 1862 #SUP 0.70 #QF 0.70 assign (resid 221 and name HG1* ) (resid 222 and name HB* ) 3.47 1.67 1.67 !peak 1863 #SUP 0.98 #QF 0.98 assign (resid 173 and name HB* ) (resid 235 and name HG ) 3.11 1.31 1.31 !peak 1867 #SUP 0.60 #QF 0.60 assign (resid 219 and name HN ) (resid 219 and name HG2* ) 3.07 1.27 1.27 !peak 1886 #SUP 0.62 #QF 0.62 assign (resid 219 and name HG2* ) (resid 220 and name HN ) 3.35 1.55 1.55 !peak 1887 #SUP 0.70 #QF 0.70 assign (resid 218 and name HA ) (resid 219 and name HG2* ) 3.85 2.05 2.05 !peak 1890 #SUP 0.53 #QF 0.53 assign (resid 219 and name HA ) (resid 219 and name HG2* ) 3.12 1.32 1.32 !peak 1891 #SUP 0.99 #QF 0.99 assign (resid 210 and name HN ) (resid 221 and name HG1* ) 3.12 1.32 1.32 !peak 1901 #SUP 0.99 #QF 0.99 assign (resid 221 and name HG1* ) (resid 222 and name HN ) 2.90 1.10 1.10 !peak 1902 #SUP 0.99 #QF 0.99 assign (resid 176 and name HE3 ) (resid 253 and name HG1* ) 3.51 1.71 1.71 !peak 1903 #SUP 0.99 #QF 0.82 assign (resid 231 and name HN ) (resid 253 and name HG1* ) 3.26 1.46 1.47 !peak 1903 #SUP 0.99 #QF 0.82 assign (resid 176 and name HZ2 ) (resid 221 and name HG1* ) 3.20 1.40 1.40 !peak 1904 #SUP 0.95 #QF 0.92 assign (resid 253 and name HG1* ) (resid 255 and name HA ) 3.38 1.58 1.58 !peak 1905 #SUP 0.97 #QF 0.97 assign (resid 211 and name HA ) (resid 221 and name HG1* ) 3.73 1.93 1.93 !peak 1906 #SUP 0.42 #QF 0.42 assign (resid 253 and name HG1* ) (resid 254 and name HA ) 2.94 1.14 1.14 !peak 1907 #SUP 0.76 #QF 0.76 assign (resid 221 and name HA ) (resid 221 and name HG1* ) 2.70 0.90 0.90 !peak 1908 #SUP 1.00 assign (resid 173 and name HB* ) (resid 221 and name HG1* ) 2.95 1.15 1.15 !peak 1914 #SUP 0.55 #QF 0.55 assign (resid 197 and name HG ) (resid 221 and name HG1* ) 2.99 1.19 1.19 !peak 1915 #SUP 0.98 #QF 0.98 assign (resid 227 and name HG2* ) (resid 253 and name HG1* ) 2.55 0.75 0.75 !peak 1916 #SUP 0.89 #QF 0.67 assign (resid 209 and name HN ) (resid 223 and name HG2* ) 3.36 1.56 1.56 !peak 1923 #SUP 0.62 #QF 0.62 assign (resid 200 and name HD1 ) (resid 223 and name HG2* ) 4.14 2.34 2.34 !peak 1926 #SUP 0.86 #QF 0.55 assign (resid 208 and name HA2 ) (resid 223 and name HG2* ) 4.59 2.79 2.79 !peak 1926 #SUP 0.86 #QF 0.55 assign (resid 223 and name HG2* ) (resid 227 and name HB ) 4.45 2.65 2.65 !peak 1926 #SUP 0.86 #QF 0.55 assign (resid 210 and name HB ) (resid 223 and name HG2* ) 3.28 1.48 1.48 !peak 1928 #SUP 0.36 #QF 0.36 assign (resid 197 and name HD1* ) (resid 212 and name HN ) 3.23 1.43 1.43 !peak 1948 #SUP 0.97 #QF 0.97 assign (resid 197 and name HD1* ) (resid 198 and name HN ) 2.73 0.93 0.93 !peak 1949 #SUP 0.99 #QF 0.99 assign (resid 197 and name HD1* ) (resid 233 and name HD2* ) 3.32 1.52 1.52 !peak 1955 #SUP 0.74 #QF 0.74 assign (resid 194 and name HD1 ) (resid 249 and name HD1* ) 3.85 2.05 2.05 !peak 1964 #SUP 0.70 #QF 0.70 assign (resid 215 and name HD1* ) (resid 238 and name HA ) 3.39 1.59 1.59 !peak 1969 #SUP 0.76 #QF 0.59 assign (resid 251 and name HA ) (resid 251 and name HD2* ) 3.14 1.34 1.34 !peak 1971 #SUP 0.96 #QF 0.96 assign (resid 206 and name HG2* ) (resid 207 and name HN ) 3.25 1.45 1.45 !peak 1975 #SUP 0.85 #QF 0.85 assign (resid 206 and name HN ) (resid 206 and name HG2* ) 3.09 1.29 1.29 !peak 1977 #SUP 0.78 #QF 0.78 assign (resid 206 and name HG2* ) (resid 207 and name HA2 ) 3.86 2.06 2.06 !peak 1979 #SUP 0.76 #QF 0.76 assign (resid 206 and name HG2* ) (resid 225 and name HA ) 3.82 2.02 2.02 !peak 1980 #SUP 0.97 #QF 0.97 assign (resid 203 and name HA ) (resid 206 and name HG2* ) 3.69 1.89 1.89 !peak 1983 #SUP 0.66 #QF 0.66 assign (resid 212 and name HB* ) (resid 213 and name HN ) 2.87 1.07 1.07 !peak 1991 #SUP 0.99 #QF 0.99 assign (resid 211 and name HA ) (resid 212 and name HB* ) 3.06 1.26 1.26 !peak 1992 #SUP 0.96 #QF 0.96 assign (resid 212 and name HB* ) (resid 221 and name HB ) 3.17 1.37 1.37 !peak 1994 #SUP 0.84 #QF 0.84 assign (resid 212 and name HB* ) (resid 251 and name HB2 ) 3.20 1.40 1.40 !peak 1995 #SUP 0.85 #QF 0.85 assign (resid 195 and name HB* ) (resid 212 and name HB* ) 3.36 1.56 1.56 !peak 1996 #SUP 0.97 #QF 0.45 assign (resid 197 and name HB2 ) (resid 212 and name HB* ) 3.51 1.71 1.71 !peak 1996 #SUP 0.97 #QF 0.45 assign (resid 197 and name HG ) (resid 212 and name HB* ) 3.31 1.51 1.51 !peak 1997 #SUP 0.95 #QF 0.95 assign (resid 196 and name HG2* ) (resid 254 and name HB1 ) 2.85 1.05 1.05 !peak 2004 #SUP 0.82 #QF 0.82 assign (resid 196 and name HG2* ) (resid 254 and name HB2 ) 2.85 1.05 1.05 !peak 2005 #SUP 0.78 #QF 0.78 assign (resid 172 and name HG2* ) (resid 219 and name HB ) 3.39 1.59 1.59 !peak 2019 #SUP 0.73 #QF 0.73 assign (resid 236 and name HG1 ) (resid 237 and name HN ) 4.06 2.26 2.26 !peak 2024 #SUP 1.00 #QF 0.97 assign (resid 237 and name HN ) (resid 238 and name HG2 ) 4.28 2.48 2.48 !peak 2024 #SUP 1.00 #QF 0.97 assign (resid 236 and name HN ) (resid 238 and name HG2 ) 3.21 1.41 1.41 !peak 2025 #SUP 0.90 #QF 0.90 assign (resid 209 and name HG1 ) (resid 222 and name HA ) 3.20 1.40 1.40 !peak 2029 #SUP 0.99 #QF 0.99 assign (resid 235 and name HD1* ) (resid 238 and name HG2 ) 3.15 1.35 1.36 !peak 2031 #SUP 0.77 #QF 0.77 assign (resid 199 and name HN ) (resid 256 and name HG2* ) 3.22 1.42 1.42 !peak 2035 #SUP 0.95 #QF 0.95 assign (resid 256 and name HN ) (resid 256 and name HG2* ) 2.97 1.17 1.17 !peak 2036 #SUP 0.98 #QF 0.98 assign (resid 255 and name HA ) (resid 256 and name HG2* ) 3.28 1.48 1.48 !peak 2038 #SUP 0.87 #QF 0.87 assign (resid 254 and name HB1 ) (resid 256 and name HG2* ) 3.19 1.39 1.39 !peak 2043 #SUP 0.75 #QF 0.75 assign (resid 254 and name HG2 ) (resid 256 and name HG2* ) 3.52 1.72 1.72 !peak 2046 #SUP 0.76 #QF 0.76 assign (resid 254 and name HG1 ) (resid 256 and name HG2* ) 3.11 1.31 1.31 !peak 2047 #SUP 0.68 #QF 0.68 assign (resid 205 and name HN ) (resid 205 and name HG1* ) 2.99 1.19 1.19 !peak 2050 #SUP 0.90 #QF 0.90 assign (resid 205 and name HG1* ) (resid 225 and name HA ) 3.48 1.68 1.68 !peak 2054 #SUP 0.69 #QF 0.69 assign (resid 205 and name HG1* ) (resid 226 and name HB1 ) 3.92 2.12 2.12 !peak 2061 #SUP 0.72 #QF 0.72 assign (resid 196 and name HA ) (resid 197 and name HD1* ) 3.75 1.95 1.95 !peak 2075 #SUP 0.82 #QF 0.82 assign (resid 230 and name HA2 ) (resid 253 and name HB ) 3.72 1.92 1.92 !peak 2088 #SUP 0.95 #QF 0.95 assign (resid 215 and name HD1* ) (resid 241 and name HD1 ) 3.48 1.68 1.68 !peak 2102 #SUP 0.98 #QF 0.85 assign (resid 202 and name HD2 ) (resid 255 and name HG2* ) 3.54 1.74 1.74 !peak 2108 #SUP 0.86 #QF 0.86 assign (resid 200 and name HD2 ) (resid 203 and name HG2* ) 3.39 1.59 1.59 !peak 2110 #SUP 0.91 #QF 0.91 assign (resid 204 and name HA ) (resid 227 and name HB ) 2.68 0.88 0.88 !peak 2116 #SUP 0.97 #QF 0.97 assign (resid 203 and name HA ) (resid 204 and name HA ) 3.52 1.72 1.72 !peak 2117 #SUP 0.76 #QF 0.76 assign (resid 204 and name HA ) (resid 206 and name HG1* ) 3.77 1.97 1.97 !peak 2118 #SUP 0.90 #QF 0.90 assign (resid 253 and name HA ) (resid 254 and name HA ) 3.41 1.61 1.61 !peak 2122 #SUP 0.69 #QF 0.69 assign (resid 236 and name HA ) (resid 248 and name HB1 ) 3.19 1.39 1.39 !peak 2128 #SUP 0.86 #QF 0.86 assign (resid 225 and name HB2 ) (resid 226 and name HA ) 3.75 1.95 1.95 !peak 2129 #SUP 0.95 #QF 0.95 assign (resid 172 and name HG2* ) (resid 219 and name HA ) 3.15 1.35 1.35 !peak 2169 #SUP 0.57 #QF 0.57 assign (resid 210 and name HA ) (resid 220 and name HA ) 3.63 1.83 1.83 !peak 2186 #SUP 0.40 #QF 0.40 assign (resid 200 and name HD1 ) (resid 210 and name HA ) 3.90 2.10 2.10 !peak 2188 #SUP 0.62 #QF 0.62 assign (resid 206 and name HA ) (resid 226 and name HN ) 3.20 1.40 1.40 !peak 2189 #SUP 0.99 #QF 0.99 assign (resid 243 and name HA ) (resid 244 and name HA ) 3.43 1.63 1.63 !peak 2192 #SUP 0.76 #QF 0.76 assign (resid 243 and name HA ) (resid 244 and name HB* ) 3.53 1.73 1.73 !peak 2194 #SUP 0.92 #QF 0.92 assign (resid 215 and name HD2* ) (resid 238 and name HA ) 3.58 1.78 1.78 !peak 2223 #SUP 0.48 #QF 0.48 assign (resid 234 and name HA ) (resid 235 and name HA ) 3.35 1.55 1.55 !peak 2234 #SUP 0.93 #QF 0.93 assign (resid 196 and name HB ) (resid 197 and name HA ) 3.78 1.98 1.98 !peak 2258 #SUP 0.69 #QF 0.69 assign (resid 197 and name HA ) (resid 197 and name HD2* ) 3.07 1.27 1.27 !peak 2277 #SUP 0.82 #QF 0.82 assign (resid 243 and name HG2 ) (resid 244 and name HA ) 3.56 1.76 1.76 !peak 2291 #SUP 0.47 #QF 0.47 assign (resid 212 and name HA ) (resid 251 and name HB2 ) 3.56 1.76 1.76 !peak 2300 #SUP 0.91 #QF 0.91 assign (resid 197 and name HB2 ) (resid 212 and name HA ) 3.68 1.88 1.88 !peak 2301 #SUP 0.30 #QF 0.30 assign (resid 203 and name HG12 ) (resid 208 and name HA1 ) 3.34 1.54 1.54 !peak 2308 #SUP 0.97 #QF 0.97 assign (resid 207 and name HA2 ) (resid 225 and name HA ) 3.19 1.39 1.39 !peak 2339 #SUP 0.92 #QF 0.92 assign (resid 203 and name HG2* ) (resid 207 and name HA2 ) 3.39 1.59 1.59 !peak 2344 #SUP 0.97 #QF 0.97 assign (resid 198 and name HA ) (resid 253 and name HG1* ) 3.82 2.02 2.02 !peak 2355 #SUP 0.98 #QF 0.98 assign (resid 239 and name HN ) (resid 248 and name HA ) 3.28 1.48 1.48 !peak 2366 #SUP 0.47 #QF 0.47 assign (resid 238 and name HB2 ) (resid 248 and name HA ) 3.17 1.37 1.37 !peak 2388 #SUP 0.37 #QF 0.37 assign (resid 236 and name HG2 ) (resid 248 and name HA ) 3.78 1.98 1.98 !peak 2390 #SUP 0.51 #QF 0.51 assign (resid 194 and name HA ) (resid 249 and name HA ) 3.85 2.05 2.05 !peak 2410 #SUP 0.29 #QF 0.29 assign (resid 249 and name HA ) (resid 249 and name HD2* ) 3.10 1.30 1.30 !peak 2434 #SUP 0.96 #QF 0.96 assign (resid 250 and name HN ) (resid 251 and name HA ) 3.70 1.90 1.90 !peak 2438 #SUP 0.57 #QF 0.57 assign (resid 195 and name HA ) (resid 252 and name HN ) 3.70 1.90 1.90 !peak 2444 #SUP 0.52 #QF 0.52 assign (resid 194 and name HD1 ) (resid 195 and name HA ) 3.36 1.56 1.56 !peak 2450 #SUP 0.28 #QF 0.28 assign (resid 195 and name HA ) (resid 249 and name HD1* ) 3.29 1.49 1.49 !peak 2458 #SUP 0.68 #QF 0.68 assign (resid 233 and name HN ) (resid 250 and name HA ) 3.53 1.73 1.73 !peak 2461 #SUP 0.34 #QF 0.34 assign (resid 232 and name HG1 ) (resid 250 and name HA ) 3.03 1.23 1.23 !peak 2473 #SUP 0.49 #QF 0.49 assign (resid 249 and name HB1 ) (resid 250 and name HA ) 3.70 1.90 1.90 !peak 2474 #SUP 0.56 #QF 0.56 assign (resid 254 and name HA ) (resid 255 and name HA ) 3.33 1.53 1.53 !peak 2481 #SUP 0.49 #QF 0.49 assign (resid 200 and name HA ) (resid 255 and name HA ) 3.31 1.51 1.51 !peak 2489 #SUP 0.40 #QF 0.40 assign (resid 200 and name HA ) (resid 202 and name HD2 ) 3.03 1.23 1.23 !peak 2493 #SUP 0.44 #QF 0.44 assign (resid 200 and name HA ) (resid 202 and name HD1 ) 3.50 1.70 1.70 !peak 2495 #SUP 0.73 #QF 0.73 assign (resid 200 and name HA ) (resid 255 and name HD1* ) 3.55 1.75 1.75 !peak 2501 #SUP 0.92 #QF 0.92 assign (resid 223 and name HA ) (resid 224 and name HA ) 3.39 1.59 1.59 !peak 2515 #SUP 0.70 #QF 0.70 assign (resid 207 and name HA2 ) (resid 224 and name HA ) 3.13 1.33 1.33 !peak 2517 #SUP 0.91 #QF 0.91 assign (resid 224 and name HA ) (resid 225 and name HB1 ) 3.64 1.84 1.84 !peak 2521 #SUP 0.79 #QF 0.79 assign (resid 223 and name HG1* ) (resid 224 and name HA ) 3.29 1.49 1.49 !peak 2523 #SUP 0.66 #QF 0.66 assign (resid 219 and name HN ) (resid 220 and name HA ) 3.60 1.80 1.80 !peak 2556 #SUP 0.66 #QF 0.66 assign (resid 211 and name HA ) (resid 220 and name HA ) 2.68 0.88 0.88 !peak 2564 #SUP 0.53 #QF 0.53 assign (resid 241 and name HA ) (resid 246 and name HA ) 2.65 0.85 0.85 !peak 2566 #SUP 0.48 #QF 0.48 assign (resid 220 and name HA ) (resid 221 and name HA ) 3.37 1.57 1.57 !peak 2568 #SUP 0.59 #QF 0.59 assign (resid 191 and name HG2 ) (resid 246 and name HA ) 3.72 1.92 1.92 !peak 2579 #SUP 0.58 #QF 0.58 assign (resid 197 and name HD1* ) (resid 220 and name HA ) 3.44 1.64 1.64 !peak 2584 #SUP 0.46 #QF 0.46 assign (resid 221 and name HA ) (resid 222 and name HA ) 3.34 1.54 1.54 !peak 2591 #SUP 0.85 #QF 0.85 assign (resid 223 and name HA ) (resid 227 and name HG2* ) 3.51 1.71 1.71 !peak 2593 #SUP 0.94 #QF 0.23 assign (resid 227 and name HA ) (resid 228 and name HA ) 3.42 1.62 1.62 !peak 2602 #SUP 0.97 #QF 0.97 assign (resid 204 and name HB* ) (resid 227 and name HA ) 3.23 1.43 1.43 !peak 2604 #SUP 0.72 #QF 0.72 assign (resid 211 and name HA ) (resid 220 and name HG2 ) 3.22 1.42 1.42 !peak 2615 #SUP 0.86 #QF 0.86 assign (resid 209 and name HB1 ) (resid 220 and name HG2 ) 3.15 1.35 1.35 !peak 2618 #SUP 0.97 #QF 0.66 assign (resid 209 and name HD2 ) (resid 220 and name HG2 ) 3.41 1.61 1.61 !peak 2618 #SUP 0.97 #QF 0.66 assign (resid 220 and name HG2 ) (resid 221 and name HG1* ) 3.68 1.88 1.88 !peak 2620 #SUP 0.97 #QF 0.97 assign (resid 210 and name HB ) (resid 211 and name HN ) 2.75 0.95 0.95 !peak 2628 #SUP 0.25 #QF 0.25 assign (resid 209 and name HD2 ) (resid 220 and name HG1 ) 3.61 1.81 1.81 !peak 2634 #SUP 0.82 #QF 0.77 assign (resid 209 and name HG2 ) (resid 220 and name HG1 ) 3.57 1.77 1.77 !peak 2635 #SUP 0.65 #QF 0.28 assign (resid 199 and name HB ) (resid 210 and name HG1* ) 3.08 1.28 1.28 !peak 2643 #SUP 0.89 #QF 0.89 assign (resid 199 and name HB ) (resid 210 and name HG2* ) 3.08 1.28 1.28 !peak 2644 #SUP 0.60 #QF 0.34 assign (resid 199 and name HB ) (resid 223 and name HG2* ) 2.91 1.11 1.11 !peak 2644 #SUP 0.60 #QF 0.34 assign (resid 199 and name HB ) (resid 253 and name HG1* ) 3.00 1.20 1.20 !peak 2646 #SUP 0.77 #QF 0.77 assign (resid 225 and name HB2 ) (resid 226 and name HB2 ) 2.81 1.01 1.01 !peak 2675 #SUP 0.75 #QF 0.75 assign (resid 202 and name HB1 ) (resid 203 and name HN ) 3.25 1.45 1.45 !peak 2679 #SUP 0.93 #QF 0.93 assign (resid 211 and name HB1 ) (resid 212 and name HA ) 3.67 1.87 1.87 !peak 2685 #SUP 0.55 #QF 0.55 assign (resid 228 and name HG1 ) (resid 255 and name HG11 ) 3.28 1.48 1.48 !peak 2725 #SUP 0.68 #QF 0.68 assign (resid 205 and name HB ) (resid 206 and name HB ) 3.32 1.52 1.52 !peak 2731 #SUP 0.97 #QF 0.97 assign (resid 205 and name HG1* ) (resid 206 and name HB ) 3.23 1.43 1.43 !peak 2732 #SUP 0.98 #QF 0.98 assign (resid 238 and name HB1 ) (resid 249 and name HB2 ) 2.97 1.17 1.17 !peak 2736 #SUP 0.37 #QF 0.37 assign (resid 242 and name HA1 ) (resid 243 and name HB1 ) 3.93 2.13 2.13 !peak 2739 #SUP 0.72 #QF 0.72 assign (resid 231 and name HG1 ) (resid 232 and name HN ) 3.50 1.70 1.70 !peak 2759 #SUP 0.93 #QF 0.93 assign (resid 231 and name HA ) (resid 231 and name HG1 ) 3.11 1.31 1.31 !peak 2762 #SUP 0.96 #QF 0.96 assign (resid 231 and name HG1 ) (resid 253 and name HG2* ) 3.49 1.69 1.69 !peak 2769 #SUP 0.98 #QF 0.97 assign (resid 231 and name HG1 ) (resid 253 and name HG1* ) 3.40 1.60 1.60 !peak 2771 #SUP 0.79 #QF 0.79 assign (resid 209 and name HD1 ) (resid 220 and name HB2 ) 3.51 1.71 1.71 !peak 2781 #SUP 0.63 #QF 0.63 assign (resid 236 and name HG2 ) (resid 248 and name HB1 ) 3.02 1.22 1.22 !peak 2793 #SUP 0.61 #QF 0.61 assign (resid 229 and name HN ) (resid 255 and name HG11 ) 3.30 1.50 1.50 !peak 2796 #SUP 0.85 #QF 0.85 assign (resid 255 and name HN ) (resid 255 and name HG11 ) 3.03 1.23 1.23 !peak 2797 #SUP 0.98 #QF 0.98 assign (resid 223 and name HG2* ) (resid 233 and name HD1* ) 3.31 1.51 1.51 !peak 2810 #SUP 0.60 #QF 0.60 assign (resid 252 and name HA ) (resid 253 and name HG2* ) 3.33 1.53 1.53 !peak 2816 #SUP 0.48 #QF 0.48 assign (resid 253 and name HA ) (resid 253 and name HG2* ) 2.80 1.00 1.00 !peak 2818 #SUP 0.66 #QF 0.66 assign (resid 197 and name HB2 ) (resid 253 and name HG2* ) 3.13 1.33 1.33 !peak 2819 #SUP 0.78 #QF 0.78 assign (resid 204 and name HB* ) (resid 205 and name HG2* ) 2.81 1.01 1.01 !peak 2820 #SUP 0.96 #QF 0.96 assign (resid 197 and name HG ) (resid 253 and name HG2* ) 3.30 1.50 1.50 !peak 2821 #SUP 0.87 #QF 0.87 assign (resid 219 and name HN ) (resid 219 and name HG1* ) 3.07 1.27 1.27 !peak 2822 #SUP 0.95 #QF 0.95 assign (resid 219 and name HG1* ) (resid 220 and name HN ) 3.35 1.55 1.55 !peak 2823 #SUP 0.99 #QF 0.99 assign (resid 218 and name HA ) (resid 219 and name HG1* ) 3.85 2.05 2.05 !peak 2824 #SUP 1.00 assign (resid 219 and name HA ) (resid 219 and name HG1* ) 3.12 1.32 1.32 !peak 2828 #SUP 1.00 assign (resid 223 and name HN ) (resid 223 and name HG1* ) 3.20 1.40 1.40 !peak 2846 #SUP 1.00 assign (resid 223 and name HG1* ) (resid 227 and name HN ) 3.44 1.64 1.64 !peak 2847 #SUP 0.68 #QF 0.68 assign (resid 208 and name HN ) (resid 223 and name HG1* ) 3.31 1.51 1.51 !peak 2848 #SUP 0.99 #QF 0.99 assign (resid 223 and name HG1* ) (resid 227 and name HB ) 2.76 0.96 0.96 !peak 2851 #SUP 0.98 #QF 0.98 assign (resid 200 and name HD2 ) (resid 223 and name HG1* ) 3.66 1.86 1.86 !peak 2853 #SUP 0.56 #QF 0.56 assign (resid 223 and name HG1* ) (resid 227 and name HG2* ) 2.67 0.87 0.87 !peak 2857 #SUP 0.93 #QF 0.93 assign (resid 223 and name HG1* ) (resid 253 and name HG1* ) 2.86 1.06 1.06 !peak 2859 #SUP 0.47 #QF 0.47 assign (resid 210 and name HG2* ) (resid 211 and name HN ) 3.09 1.29 1.29 !peak 2865 #SUP 0.92 #QF 0.92 assign (resid 200 and name HD1 ) (resid 210 and name HG2* ) 3.67 1.87 1.87 !peak 2868 #SUP 0.60 #QF 0.60 assign (resid 197 and name HG ) (resid 210 and name HG2* ) 3.36 1.56 1.56 !peak 2874 #SUP 0.82 #QF 0.82 assign (resid 210 and name HG1* ) (resid 211 and name HN ) 3.09 1.29 1.29 !peak 2885 #SUP 0.92 #QF 0.92 assign (resid 256 and name HN ) (resid 256 and name HB ) 2.88 1.08 1.08 !peak 2905 #SUP 0.95 #QF 0.95 assign (resid 227 and name HB ) (resid 228 and name HN ) 3.20 1.40 1.40 !peak 2934 #SUP 0.97 #QF 0.97 assign (resid 227 and name HB ) (resid 253 and name HG1* ) 3.36 1.56 1.56 !peak 2940 #SUP 0.69 #QF 0.69 assign (resid 227 and name HB ) (resid 255 and name HD1* ) 3.38 1.58 1.58 !peak 2941 #SUP 0.92 #QF 0.92 assign (resid 205 and name HA ) (resid 206 and name HA ) 3.53 1.73 1.73 !peak 2943 #SUP 0.86 #QF 0.86 assign (resid 214 and name HB ) (resid 215 and name HB2 ) 3.27 1.47 1.47 !peak 2989 #SUP 0.62 #QF 0.62 assign (resid 172 and name HB ) (resid 219 and name HB ) 3.25 1.45 1.45 !peak 3129 #SUP 0.55 #QF 0.55 assign (resid 209 and name HD2 ) (resid 220 and name HB1 ) 3.31 1.51 1.51 !peak 3131 #SUP 0.94 #QF 0.33 assign (resid 209 and name HD1 ) (resid 220 and name HB1 ) 3.24 1.44 1.44 !peak 3132 #SUP 0.60 #QF 0.60 assign (resid 173 and name HB* ) (resid 220 and name HB1 ) 3.66 1.86 1.86 !peak 3133 #SUP 0.36 #QF 0.36 assign (resid 235 and name HB2 ) (resid 238 and name HG2 ) 3.25 1.45 1.45 !peak 3146 #SUP 0.79 #QF 0.79 assign (resid 235 and name HB1 ) (resid 238 and name HG1 ) 3.31 1.51 1.51 !peak 3152 #SUP 1.00 assign (resid 196 and name HA ) (resid 197 and name HB2 ) 3.31 1.51 1.51 !peak 3164 #SUP 0.69 #QF 0.69 assign (resid 249 and name HB2 ) (resid 249 and name HD2* ) 3.16 1.36 1.36 !peak 3171 #SUP 0.99 #QF 0.99 assign (resid 205 and name HA ) (resid 226 and name HD1 ) 3.26 1.46 1.46 !peak 3204 #SUP 0.94 #QF 0.75 assign (resid 226 and name HB1 ) (resid 226 and name HD1 ) 2.76 0.96 0.96 !peak 3205 #SUP 0.86 #QF 0.86 assign (resid 205 and name HG1* ) (resid 226 and name HD1 ) 3.42 1.62 1.62 !peak 3207 #SUP 0.65 #QF 0.65 assign (resid 225 and name HB2 ) (resid 226 and name HD2 ) 3.50 1.70 1.70 !peak 3210 #SUP 0.87 #QF 0.87 assign (resid 206 and name HA ) (resid 207 and name HA1 ) 3.51 1.71 1.71 !peak 3256 #SUP 0.67 #QF 0.67 assign (resid 207 and name HA1 ) (resid 225 and name HD1 ) 2.87 1.07 1.07 !peak 3258 #SUP 0.71 #QF 0.71 assign (resid 207 and name HA1 ) (resid 225 and name HD2 ) 3.31 1.51 1.51 !peak 3259 #SUP 0.43 #QF 0.43 assign (resid 237 and name HA2 ) (resid 246 and name HN ) 3.36 1.56 1.56 !peak 3263 #SUP 0.25 #QF 0.25 assign (resid 237 and name HA2 ) (resid 248 and name HA ) 3.34 1.54 1.54 !peak 3268 #SUP 0.74 #QF 0.74 assign (resid 236 and name HA ) (resid 237 and name HA2 ) 3.34 1.54 1.54 !peak 3269 #SUP 0.80 #QF 0.80 assign (resid 199 and name HA ) (resid 200 and name HG2 ) 3.39 1.59 1.59 !peak 3281 #SUP 0.74 #QF 0.74 assign (resid 255 and name HN ) (resid 255 and name HG12 ) 3.13 1.33 1.33 !peak 3291 #SUP 0.91 #QF 0.91 assign (resid 197 and name HG ) (resid 212 and name HA ) 3.55 1.75 1.75 !peak 3295 #SUP 0.56 #QF 0.56 assign (resid 197 and name HG ) (resid 210 and name HG1* ) 3.36 1.56 1.56 !peak 3302 #SUP 0.31 #QF 0.31 assign (resid 222 and name HA ) (resid 223 and name HA ) 3.67 1.87 1.87 !peak 3337 #SUP 0.91 #QF 0.85 assign (resid 221 and name HG1* ) (resid 222 and name HA ) 3.24 1.44 1.44 !peak 3341 #SUP 0.99 #QF 0.99 assign (resid 215 and name HD1* ) (resid 241 and name HD2 ) 3.48 1.68 1.68 !peak 3349 #SUP 0.68 #QF 0.37 assign (resid 236 and name HN ) (resid 237 and name HA1 ) 4.00 2.20 2.20 !peak 3353 #SUP 0.69 #QF 0.48 assign (resid 237 and name HA1 ) (resid 246 and name HN ) 4.29 2.49 2.49 !peak 3353 #SUP 0.69 #QF 0.48 assign (resid 236 and name HA ) (resid 237 and name HA1 ) 3.38 1.58 1.58 !peak 3362 #SUP 0.25 #QF 0.25 assign (resid 208 and name HA2 ) (resid 209 and name HA ) 3.54 1.74 1.74 !peak 3372 #SUP 0.91 #QF 0.91 assign (resid 235 and name HB1 ) (resid 238 and name HB2 ) 3.34 1.54 1.54 !peak 3387 #SUP 0.82 #QF 0.62 assign (resid 238 and name HB2 ) (resid 249 and name HB2 ) 3.42 1.62 1.62 !peak 3387 #SUP 0.82 #QF 0.62 assign (resid 197 and name HN ) (resid 197 and name HD2* ) 3.30 1.50 1.50 !peak 3413 #SUP 0.92 #QF 0.81 assign (resid 197 and name HD2* ) (resid 210 and name HN ) 3.81 2.01 2.01 !peak 3413 #SUP 0.92 #QF 0.81 assign (resid 240 and name HA ) (resid 240 and name HD1 ) 3.08 1.28 1.28 !peak 1 #SUP 0.91 #QF 0.91 assign (resid 215 and name HB2 ) (resid 240 and name HD1 ) 3.56 1.76 1.76 !peak 9 #SUP 0.78 #QF 0.78 assign (resid 176 and name HE3 ) (resid 231 and name HB1 ) 2.97 1.17 1.17 !peak 13 #SUP 0.72 #QF 0.72 assign (resid 176 and name HA ) (resid 176 and name HE3 ) 3.32 1.52 1.52 !peak 14 #SUP 0.80 #QF 0.80 assign (resid 175 and name HA ) (resid 176 and name HD1 ) 3.08 1.28 1.28 !peak 16 #SUP 0.77 #QF 0.77 assign (resid 176 and name HD1 ) (resid 224 and name HG1 ) 3.61 1.81 1.81 !peak 23 #SUP 0.43 #QF 0.43 assign (resid 176 and name HH2 ) (resid 253 and name HG1* ) 3.35 1.55 1.55 !peak 34 #SUP 0.80 #QF 0.61 assign (resid 194 and name HE1 ) (resid 232 and name HG1 ) 3.70 1.90 1.90 !peak 40 #SUP 0.90 #QF 0.90 assign (resid 194 and name HA ) (resid 194 and name HE1 ) 3.33 1.53 1.53 !peak 43 #SUP 0.59 #QF 0.59 assign (resid 194 and name HD1 ) (resid 250 and name HB2 ) 3.17 1.37 1.37 !peak 50 #SUP 0.63 #QF 0.63 assign (resid 194 and name HA ) (resid 194 and name HD1 ) 3.08 1.28 1.28 !peak 52 #SUP 0.95 #QF 0.95 assign (resid 176 and name HZ3 ) (resid 227 and name HG2* ) 2.98 1.18 1.18 !peak 57 #SUP 0.68 #QF 0.58 assign (resid 176 and name HD1 ) (resid 221 and name HG1* ) 3.41 1.61 1.61 !peak 58 #SUP 0.69 #QF 0.69 assign (resid 215 and name HD2* ) (resid 240 and name HE1 ) 3.02 1.22 1.22 !peak 61 #SUP 0.91 #QF 0.91 assign (resid 232 and name HG1 ) (resid 250 and name HD2 ) 3.45 1.65 1.65 !peak 72 #SUP 0.84 #QF 0.64 assign (resid 232 and name HD1 ) (resid 250 and name HD2 ) 3.38 1.58 1.57 !peak 73 #SUP 0.48 #QF 0.48 assign (resid 232 and name HG2 ) (resid 250 and name HD2 ) 3.72 1.92 1.92 !peak 74 #SUP 0.79 #QF 0.32 assign (resid 234 and name HA ) (resid 250 and name HD2 ) 3.30 1.50 1.50 !peak 80 #SUP 0.67 #QF 0.67 assign (resid 250 and name HA ) (resid 250 and name HD2 ) 3.13 1.33 1.33 !peak 82 #SUP 0.85 #QF 0.85 assign (resid 250 and name HN ) (resid 250 and name HD1 ) 3.36 1.56 1.56 !peak 83 #SUP 0.77 #QF 0.44 assign (resid 250 and name HN ) (resid 250 and name HD2 ) 3.08 1.28 1.28 !peak 83 #SUP 0.77 #QF 0.44 assign (resid 234 and name HN ) (resid 250 and name HD2 ) 3.45 1.65 1.65 !peak 85 #SUP 0.62 #QF 0.62 assign (resid 194 and name HD1 ) (resid 250 and name HB1 ) 3.20 1.40 1.40 !peak 88 #SUP 0.77 #QF 0.77 assign (resid 176 and name HA ) (resid 176 and name HD1 ) 3.05 1.25 1.24 !peak 93 #SUP 0.80 #QF 0.80 assign (resid 176 and name HE3 ) (resid 231 and name HD1 ) 3.20 1.40 1.40 !peak 97 #SUP 0.78 #QF 0.78 assign (resid 176 and name HB2 ) (resid 176 and name HE3 ) 3.09 1.29 1.29 !peak 98 #SUP 0.65 #QF 0.65 assign (resid 234 and name HG1 ) (resid 250 and name HE2 ) 3.57 1.77 1.77 !peak 101 #SUP 0.57 #QF 0.57 assign (resid 234 and name HG2 ) (resid 250 and name HE2 ) 3.57 1.77 1.77 !peak 102 #SUP 0.66 #QF 0.66 assign (resid 234 and name HB1 ) (resid 250 and name HE2 ) 2.88 1.08 1.08 !peak 103 #SUP 0.75 #QF 0.75 assign (resid 234 and name HB2 ) (resid 250 and name HE2 ) 2.88 1.08 1.08 !peak 105 #SUP 0.52 #QF 0.52 assign (resid 248 and name HB2 ) (resid 250 and name HE2 ) 2.98 1.18 1.18 !peak 107 #SUP 0.31 #QF 0.31 assign (resid 176 and name HE1 ) (resid 223 and name HA ) 2.83 1.03 1.03 !peak 7 #SUP 0.85 #QF 0.85 assign (resid 176 and name HE1 ) (resid 222 and name HN ) 3.33 1.53 1.53 !peak 8 #SUP 0.77 #QF 0.77 assign (resid 198 and name HN ) (resid 199 and name HN ) 3.17 1.37 1.37 !peak 10 #SUP 0.98 #QF 0.98 assign (resid 197 and name HB1 ) (resid 198 and name HN ) 3.06 1.26 1.26 !peak 12 #SUP 0.92 #QF 0.92 assign (resid 197 and name HD2* ) (resid 198 and name HN ) 3.39 1.59 1.59 !peak 14 #SUP 0.97 #QF 0.97 assign (resid 197 and name HB2 ) (resid 198 and name HN ) 3.42 1.62 1.62 !peak 16 #SUP 0.94 #QF 0.94 assign (resid 198 and name HN ) (resid 198 and name HB2 ) 2.79 0.99 0.99 !peak 17 #SUP 0.74 #QF 0.74 assign (resid 198 and name HN ) (resid 198 and name HB1 ) 2.79 0.99 0.99 !peak 18 #SUP 0.74 #QF 0.74 assign (resid 205 and name HB ) (resid 206 and name HN ) 2.32 0.52 0.52 !peak 22 #SUP 0.86 #QF 0.86 assign (resid 216 and name HN ) (resid 217 and name HN ) 2.40 0.60 0.60 !peak 25 #SUP 0.86 #QF 0.86 assign (resid 214 and name HB ) (resid 216 and name HN ) 2.51 0.71 0.71 !peak 29 #SUP 0.93 #QF 0.93 assign (resid 216 and name HN ) (resid 216 and name HB2 ) 2.85 1.05 1.05 !peak 33 #SUP 0.68 #QF 0.68 assign (resid 176 and name HE1 ) (resid 223 and name HG2* ) 3.06 1.26 1.26 !peak 36 #SUP 0.70 #QF 0.70 assign (resid 176 and name HE1 ) (resid 221 and name HG1* ) 2.85 1.05 1.05 !peak 37 #SUP 0.83 #QF 0.83 assign (resid 176 and name HE1 ) (resid 222 and name HB* ) 3.23 1.43 1.43 !peak 39 #SUP 0.85 #QF 0.85 assign (resid 253 and name HA ) (resid 254 and name HN ) 2.35 0.55 0.55 !peak 41 #SUP 0.80 #QF 0.80 assign (resid 198 and name HA ) (resid 254 and name HN ) 3.12 1.32 1.32 !peak 43 #SUP 0.87 #QF 0.87 assign (resid 197 and name HN ) (resid 254 and name HN ) 3.07 1.27 1.27 !peak 45 #SUP 0.42 #QF 0.42 assign (resid 199 and name HN ) (resid 254 and name HN ) 2.86 1.06 1.06 !peak 49 #SUP 0.73 #QF 0.73 assign (resid 253 and name HB ) (resid 254 and name HN ) 3.28 1.48 1.48 !peak 50 #SUP 0.99 #QF 0.99 assign (resid 254 and name HN ) (resid 254 and name HB1 ) 2.61 0.81 0.81 !peak 51 #SUP 1.00 assign (resid 254 and name HN ) (resid 254 and name HB2 ) 2.61 0.81 0.81 !peak 52 #SUP 0.75 #QF 0.75 assign (resid 254 and name HN ) (resid 254 and name HG1 ) 3.39 1.59 1.59 !peak 54 #SUP 0.56 #QF 0.56 assign (resid 197 and name HB1 ) (resid 254 and name HN ) 2.72 0.92 0.92 !peak 55 #SUP 0.38 #QF 0.38 assign (resid 253 and name HG1* ) (resid 254 and name HN ) 2.51 0.71 0.71 !peak 58 #SUP 0.90 #QF 0.90 assign (resid 235 and name HN ) (resid 250 and name HA ) 3.05 1.25 1.25 !peak 59 #SUP 0.64 #QF 0.64 assign (resid 234 and name HA ) (resid 235 and name HN ) 2.54 0.74 0.74 !peak 61 #SUP 0.80 #QF 0.80 assign (resid 235 and name HN ) (resid 249 and name HD2* ) 3.45 1.65 1.65 !peak 62 #SUP 0.88 #QF 0.88 assign (resid 235 and name HN ) (resid 235 and name HD2* ) 2.76 0.96 0.96 !peak 63 #SUP 0.66 #QF 0.66 assign (resid 235 and name HN ) (resid 235 and name HG ) 2.62 0.82 0.82 !peak 65 #SUP 0.73 #QF 0.73 assign (resid 235 and name HN ) (resid 235 and name HB2 ) 2.72 0.92 0.92 !peak 67 #SUP 0.92 #QF 0.92 assign (resid 234 and name HN ) (resid 235 and name HN ) 3.14 1.34 1.34 !peak 68 #SUP 0.78 #QF 0.78 assign (resid 235 and name HN ) (resid 251 and name HN ) 3.70 1.90 1.90 !peak 71 #SUP 0.93 #QF 0.93 assign (resid 222 and name HN ) (resid 222 and name HB* ) 2.25 0.45 0.45 !peak 73 #SUP 0.81 #QF 0.81 assign (resid 221 and name HA ) (resid 222 and name HN ) 2.26 0.46 0.46 !peak 75 #SUP 0.85 #QF 0.85 assign (resid 209 and name HA ) (resid 222 and name HN ) 3.60 1.80 1.80 !peak 78 #SUP 0.78 #QF 0.78 assign (resid 221 and name HN ) (resid 222 and name HN ) 3.41 1.61 1.61 !peak 80 #SUP 0.95 #QF 0.95 assign (resid 232 and name HA ) (resid 253 and name HN ) 2.92 1.12 1.12 !peak 82 #SUP 0.67 #QF 0.67 assign (resid 212 and name HN ) (resid 218 and name HA ) 3.36 1.56 1.56 !peak 87 #SUP 0.91 #QF 0.91 assign (resid 212 and name HN ) (resid 212 and name HB* ) 2.36 0.56 0.56 !peak 92 #SUP 0.89 #QF 0.89 assign (resid 200 and name HA ) (resid 201 and name HN ) 2.26 0.46 0.46 !peak 95 #SUP 0.86 #QF 0.86 assign (resid 201 and name HN ) (resid 201 and name HA ) 2.49 0.69 0.69 !peak 97 #SUP 0.98 #QF 0.98 assign (resid 201 and name HN ) (resid 202 and name HD2 ) 2.58 0.78 0.78 !peak 98 #SUP 0.97 #QF 0.97 assign (resid 201 and name HN ) (resid 202 and name HD1 ) 2.65 0.85 0.85 !peak 99 #SUP 0.98 #QF 0.98 assign (resid 200 and name HB2 ) (resid 201 and name HN ) 2.65 0.85 0.85 !peak 100 #SUP 0.94 #QF 0.94 assign (resid 201 and name HN ) (resid 201 and name HB* ) 2.24 0.44 0.44 !peak 102 #SUP 0.88 #QF 0.88 assign (resid 232 and name HA ) (resid 233 and name HN ) 2.69 0.89 0.89 !peak 103 #SUP 0.93 #QF 0.93 assign (resid 232 and name HB1 ) (resid 233 and name HN ) 3.31 1.51 1.51 !peak 105 #SUP 0.44 #QF 0.44 assign (resid 232 and name HG2 ) (resid 233 and name HN ) 3.10 1.30 1.30 !peak 107 #SUP 0.87 #QF 0.87 assign (resid 233 and name HN ) (resid 253 and name HG2* ) 3.29 1.49 1.49 !peak 110 #SUP 0.49 #QF 0.49 assign (resid 194 and name HA ) (resid 250 and name HN ) 2.92 1.12 1.12 !peak 115 #SUP 0.82 #QF 0.82 assign (resid 249 and name HA ) (resid 250 and name HN ) 2.57 0.77 0.77 !peak 116 #SUP 0.86 #QF 0.86 assign (resid 250 and name HN ) (resid 250 and name HB1 ) 3.05 1.25 1.24 !peak 118 #SUP 0.87 #QF 0.87 assign (resid 249 and name HD1* ) (resid 250 and name HN ) 2.59 0.79 0.79 !peak 122 #SUP 0.80 #QF 0.80 assign (resid 222 and name HA ) (resid 223 and name HN ) 2.31 0.51 0.51 !peak 123 #SUP 0.82 #QF 0.82 assign (resid 207 and name HA2 ) (resid 223 and name HN ) 3.71 1.91 1.91 !peak 125 #SUP 0.69 #QF 0.69 assign (resid 209 and name HA ) (resid 223 and name HN ) 2.61 0.81 0.81 !peak 126 #SUP 0.95 #QF 0.95 assign (resid 210 and name HN ) (resid 223 and name HN ) 2.98 1.18 1.18 !peak 128 #SUP 0.83 #QF 0.83 assign (resid 222 and name HN ) (resid 223 and name HN ) 3.28 1.48 1.48 !peak 129 #SUP 0.67 #QF 0.67 assign (resid 223 and name HN ) (resid 223 and name HB ) 2.47 0.67 0.67 !peak 132 #SUP 0.76 #QF 0.76 assign (resid 223 and name HN ) (resid 223 and name HG2* ) 2.38 0.58 0.58 !peak 134 #SUP 0.79 #QF 0.79 assign (resid 197 and name HN ) (resid 252 and name HN ) 2.86 1.06 1.06 !peak 138 #SUP 0.50 #QF 0.50 assign (resid 196 and name HA ) (resid 197 and name HN ) 2.30 0.50 0.50 !peak 140 #SUP 0.68 #QF 0.68 assign (resid 197 and name HN ) (resid 253 and name HA ) 2.78 0.98 0.98 !peak 143 #SUP 0.52 #QF 0.52 assign (resid 197 and name HN ) (resid 197 and name HB2 ) 2.60 0.80 0.80 !peak 146 #SUP 0.82 #QF 0.82 assign (resid 196 and name HG2* ) (resid 197 and name HN ) 2.65 0.85 0.85 !peak 147 #SUP 0.99 #QF 0.85 assign (resid 197 and name HN ) (resid 197 and name HB1 ) 2.81 1.01 1.01 !peak 147 #SUP 0.99 #QF 0.85 assign (resid 197 and name HN ) (resid 197 and name HD1* ) 3.07 1.27 1.27 !peak 148 #SUP 0.97 #QF 0.97 assign (resid 235 and name HA ) (resid 236 and name HN ) 2.35 0.55 0.55 !peak 155 #SUP 0.86 #QF 0.86 assign (resid 235 and name HB1 ) (resid 236 and name HN ) 2.56 0.76 0.76 !peak 158 #SUP 0.69 #QF 0.69 assign (resid 236 and name HN ) (resid 236 and name HG2 ) 2.92 1.12 1.12 !peak 159 #SUP 0.92 #QF 0.92 assign (resid 236 and name HN ) (resid 238 and name HG1 ) 3.43 1.63 1.63 !peak 160 #SUP 0.71 #QF 0.25 assign (resid 173 and name HN ) (resid 173 and name HB* ) 2.35 0.55 0.55 !peak 162 #SUP 0.81 #QF 0.81 assign (resid 172 and name HG2* ) (resid 173 and name HN ) 2.90 1.10 1.10 !peak 163 #SUP 0.95 #QF 0.95 assign (resid 255 and name HA ) (resid 256 and name HN ) 2.23 0.43 0.43 !peak 166 #SUP 0.56 #QF 0.56 assign (resid 250 and name HN ) (resid 250 and name HB2 ) 2.90 1.10 1.10 !peak 169 #SUP 0.97 #QF 0.97 assign (resid 249 and name HB2 ) (resid 250 and name HN ) 3.32 1.52 1.52 !peak 170 #SUP 0.99 #QF 0.99 assign (resid 250 and name HN ) (resid 251 and name HN ) 3.30 1.50 1.50 !peak 172 #SUP 0.44 #QF 0.44 assign (resid 199 and name HN ) (resid 256 and name HN ) 2.90 1.10 1.10 !peak 174 #SUP 0.81 #QF 0.81 assign (resid 198 and name HA ) (resid 199 and name HN ) 2.30 0.50 0.50 !peak 176 #SUP 0.90 #QF 0.90 assign (resid 199 and name HN ) (resid 199 and name HB ) 2.76 0.96 0.96 !peak 180 #SUP 0.91 #QF 0.91 assign (resid 199 and name HN ) (resid 254 and name HB2 ) 3.06 1.26 1.26 !peak 181 #SUP 0.71 #QF 0.71 assign (resid 220 and name HG2 ) (resid 221 and name HN ) 2.87 1.07 1.07 !peak 186 #SUP 0.89 #QF 0.89 assign (resid 221 and name HN ) (resid 221 and name HB ) 2.64 0.84 0.84 !peak 187 #SUP 0.91 #QF 0.91 assign (resid 209 and name HG2 ) (resid 221 and name HN ) 3.14 1.34 1.34 !peak 190 #SUP 0.84 #QF 0.70 assign (resid 221 and name HN ) (resid 221 and name HG1* ) 2.39 0.59 0.59 !peak 191 #SUP 0.92 #QF 0.92 assign (resid 220 and name HA ) (resid 221 and name HN ) 2.37 0.57 0.57 !peak 193 #SUP 0.82 #QF 0.82 assign (resid 232 and name HG1 ) (resid 251 and name HN ) 2.91 1.11 1.11 !peak 205 #SUP 0.89 #QF 0.89 assign (resid 251 and name HN ) (resid 251 and name HB1 ) 2.78 0.98 0.98 !peak 206 #SUP 0.93 #QF 0.93 assign (resid 251 and name HN ) (resid 251 and name HB2 ) 2.92 1.12 1.12 !peak 207 #SUP 0.92 #QF 0.92 assign (resid 250 and name HB2 ) (resid 251 and name HN ) 3.44 1.64 1.64 !peak 208 #SUP 0.97 #QF 0.97 assign (resid 250 and name HB1 ) (resid 251 and name HN ) 3.02 1.22 1.22 !peak 209 #SUP 0.98 #QF 0.98 assign (resid 234 and name HA ) (resid 251 and name HN ) 3.18 1.38 1.38 !peak 210 #SUP 0.70 #QF 0.70 assign (resid 250 and name HA ) (resid 251 and name HN ) 2.35 0.55 0.55 !peak 211 #SUP 0.85 #QF 0.85 assign (resid 232 and name HA ) (resid 251 and name HN ) 3.46 1.66 1.66 !peak 212 #SUP 0.97 #QF 0.97 assign (resid 250 and name HD2 ) (resid 251 and name HN ) 3.21 1.41 1.41 !peak 213 #SUP 0.84 #QF 0.84 assign (resid 233 and name HN ) (resid 251 and name HN ) 2.70 0.90 0.90 !peak 215 #SUP 0.70 #QF 0.70 assign (resid 233 and name HN ) (resid 234 and name HN ) 3.37 1.57 1.57 !peak 219 #SUP 0.81 #QF 0.81 assign (resid 233 and name HA ) (resid 234 and name HN ) 2.56 0.76 0.76 !peak 221 #SUP 0.68 #QF 0.68 assign (resid 234 and name HN ) (resid 234 and name HB2 ) 2.98 1.18 1.18 !peak 222 #SUP 0.97 #QF 0.97 assign (resid 234 and name HN ) (resid 234 and name HB1 ) 2.98 1.18 1.18 !peak 223 #SUP 0.95 #QF 0.95 assign (resid 234 and name HN ) (resid 234 and name HG2 ) 3.00 1.20 1.20 !peak 225 #SUP 0.91 #QF 0.91 assign (resid 234 and name HN ) (resid 234 and name HG1 ) 3.00 1.20 1.20 !peak 226 #SUP 0.98 #QF 0.38 assign (resid 231 and name HB2 ) (resid 232 and name HN ) 2.75 0.95 0.95 !peak 227 #SUP 0.96 #QF 0.96 assign (resid 232 and name HN ) (resid 232 and name HB1 ) 2.73 0.93 0.93 !peak 228 #SUP 0.93 #QF 0.93 assign (resid 231 and name HB1 ) (resid 232 and name HN ) 2.50 0.70 0.70 !peak 229 #SUP 0.89 #QF 0.89 assign (resid 232 and name HN ) (resid 232 and name HG2 ) 2.78 0.98 0.98 !peak 230 #SUP 0.89 #QF 0.89 assign (resid 232 and name HN ) (resid 253 and name HG2* ) 3.18 1.38 1.38 !peak 232 #SUP 0.70 #QF 0.70 assign (resid 231 and name HA ) (resid 232 and name HN ) 2.44 0.64 0.64 !peak 236 #SUP 0.94 #QF 0.94 assign (resid 232 and name HN ) (resid 252 and name HA ) 3.41 1.61 1.61 !peak 237 #SUP 0.99 #QF 0.99 assign (resid 232 and name HN ) (resid 233 and name HN ) 3.21 1.41 1.41 !peak 241 #SUP 0.98 #QF 0.98 assign (resid 211 and name HN ) (resid 211 and name HB1 ) 2.23 0.43 0.43 !peak 250 #SUP 0.70 #QF 0.70 assign (resid 175 and name HN ) (resid 234 and name HN ) 3.25 1.45 1.45 !peak 254 #SUP 0.61 #QF 0.61 assign (resid 175 and name HN ) (resid 175 and name HG1 ) 2.90 1.10 1.10 !peak 258 #SUP 0.84 #QF 0.84 assign (resid 174 and name HA2 ) (resid 175 and name HN ) 2.55 0.75 0.75 !peak 262 #SUP 0.94 #QF 0.94 assign (resid 174 and name HA1 ) (resid 175 and name HN ) 2.64 0.84 0.84 !peak 263 #SUP 0.86 #QF 0.86 assign (resid 208 and name HA1 ) (resid 209 and name HN ) 2.28 0.48 0.48 !peak 271 #SUP 0.85 #QF 0.85 assign (resid 209 and name HN ) (resid 209 and name HB2 ) 2.46 0.66 0.66 !peak 274 #SUP 0.73 #QF 0.73 assign (resid 203 and name HG12 ) (resid 209 and name HN ) 2.92 1.12 1.12 !peak 275 #SUP 0.98 #QF 0.93 assign (resid 209 and name HN ) (resid 209 and name HB1 ) 2.64 0.84 0.84 !peak 275 #SUP 0.98 #QF 0.93 assign (resid 203 and name HD1* ) (resid 209 and name HN ) 2.59 0.79 0.79 !peak 280 #SUP 0.88 #QF 0.88 assign (resid 203 and name HG2* ) (resid 209 and name HN ) 2.58 0.78 0.78 !peak 281 #SUP 0.95 #QF 0.95 assign (resid 209 and name HN ) (resid 223 and name HN ) 3.30 1.50 1.50 !peak 282 #SUP 0.65 #QF 0.65 assign (resid 208 and name HN ) (resid 209 and name HN ) 2.98 1.18 1.18 !peak 286 #SUP 0.88 #QF 0.88 assign (resid 204 and name HN ) (resid 204 and name HB* ) 2.24 0.44 0.44 !peak 287 #SUP 0.87 #QF 0.87 assign (resid 203 and name HA ) (resid 204 and name HN ) 2.86 1.06 1.06 !peak 292 #SUP 0.97 #QF 0.97 assign (resid 173 and name HA ) (resid 174 and name HN ) 2.53 0.73 0.73 !peak 297 #SUP 0.96 #QF 0.96 assign (resid 173 and name HB* ) (resid 174 and name HN ) 2.59 0.79 0.79 !peak 302 #SUP 0.91 #QF 0.91 assign (resid 172 and name HN ) (resid 172 and name HG2* ) 3.05 1.25 1.24 !peak 306 #SUP 0.94 #QF 0.94 assign (resid 172 and name HN ) (resid 172 and name HB ) 2.61 0.81 0.81 !peak 308 #SUP 0.88 #QF 0.88 assign (resid 172 and name HN ) (resid 173 and name HN ) 2.97 1.17 1.17 !peak 309 #SUP 0.48 #QF 0.48 assign (resid 211 and name HA ) (resid 212 and name HN ) 2.22 0.42 0.42 !peak 311 #SUP 0.78 #QF 0.78 assign (resid 225 and name HB1 ) (resid 226 and name HN ) 3.12 1.32 1.32 !peak 312 #SUP 0.93 #QF 0.93 assign (resid 226 and name HN ) (resid 226 and name HB2 ) 2.71 0.91 0.91 !peak 313 #SUP 0.94 #QF 0.94 assign (resid 226 and name HN ) (resid 226 and name HB1 ) 3.20 1.40 1.40 !peak 314 #SUP 0.99 #QF 0.99 assign (resid 225 and name HB2 ) (resid 226 and name HN ) 2.71 0.91 0.91 !peak 315 #SUP 0.78 #QF 0.78 assign (resid 204 and name HB* ) (resid 226 and name HN ) 3.34 1.54 1.54 !peak 317 #SUP 0.71 #QF 0.71 assign (resid 205 and name HG2* ) (resid 226 and name HN ) 2.99 1.19 1.19 !peak 318 #SUP 0.92 #QF 0.92 assign (resid 205 and name HG1* ) (resid 226 and name HN ) 2.94 1.14 1.14 !peak 319 #SUP 0.99 #QF 0.99 assign (resid 226 and name HN ) (resid 226 and name HA ) 2.24 0.44 0.44 !peak 321 #SUP 0.44 #QF 0.44 assign (resid 205 and name HA ) (resid 226 and name HN ) 2.47 0.67 0.67 !peak 322 #SUP 0.97 #QF 0.97 assign (resid 205 and name HN ) (resid 226 and name HN ) 3.17 1.37 1.37 !peak 326 #SUP 0.63 #QF 0.63 assign (resid 230 and name HN ) (resid 231 and name HN ) 2.52 0.72 0.72 !peak 329 #SUP 0.94 #QF 0.94 assign (resid 231 and name HN ) (resid 232 and name HN ) 3.40 1.60 1.60 !peak 330 #SUP 0.84 #QF 0.84 assign (resid 230 and name HA2 ) (resid 231 and name HN ) 2.86 1.06 1.06 !peak 332 #SUP 0.94 #QF 0.94 assign (resid 231 and name HN ) (resid 231 and name HA ) 2.49 0.69 0.69 !peak 333 #SUP 0.74 #QF 0.74 assign (resid 229 and name HA ) (resid 231 and name HN ) 2.88 1.08 1.08 !peak 334 #SUP 0.58 #QF 0.58 assign (resid 231 and name HN ) (resid 231 and name HB2 ) 2.49 0.69 0.69 !peak 337 #SUP 0.82 #QF 0.71 assign (resid 231 and name HN ) (resid 253 and name HB ) 2.61 0.81 0.80 !peak 337 #SUP 0.82 #QF 0.71 assign (resid 231 and name HN ) (resid 231 and name HG1 ) 2.29 0.49 0.49 !peak 338 #SUP 0.67 #QF 0.67 assign (resid 236 and name HA ) (resid 249 and name HN ) 3.25 1.45 1.45 !peak 342 #SUP 0.87 #QF 0.87 assign (resid 248 and name HA ) (resid 249 and name HN ) 2.46 0.66 0.66 !peak 343 #SUP 0.92 #QF 0.92 assign (resid 248 and name HB2 ) (resid 249 and name HN ) 2.69 0.89 0.89 !peak 344 #SUP 0.64 #QF 0.64 assign (resid 248 and name HB1 ) (resid 249 and name HN ) 2.98 1.18 1.18 !peak 345 #SUP 0.85 #QF 0.85 assign (resid 249 and name HN ) (resid 249 and name HB2 ) 2.71 0.91 0.91 !peak 346 #SUP 0.93 #QF 0.93 assign (resid 238 and name HB2 ) (resid 249 and name HN ) 2.74 0.94 0.94 !peak 347 #SUP 0.45 #QF 0.45 assign (resid 249 and name HN ) (resid 249 and name HB1 ) 2.69 0.89 0.89 !peak 349 #SUP 0.89 #QF 0.89 assign (resid 235 and name HN ) (resid 249 and name HN ) 2.82 1.02 1.02 !peak 355 #SUP 0.94 #QF 0.94 assign (resid 236 and name HN ) (resid 249 and name HN ) 3.61 1.81 1.81 !peak 357 #SUP 0.81 #QF 0.81 assign (resid 239 and name HN ) (resid 249 and name HN ) 2.93 1.13 1.13 !peak 358 #SUP 0.98 #QF 0.98 assign (resid 175 and name HN ) (resid 233 and name HD2* ) 3.63 1.83 1.83 !peak 359 #SUP 0.70 #QF 0.70 assign (resid 212 and name HA ) (resid 213 and name HN ) 2.52 0.72 0.72 !peak 360 #SUP 0.97 #QF 0.97 assign (resid 246 and name HN ) (resid 246 and name HG1 ) 2.67 0.87 0.87 !peak 363 #SUP 0.59 #QF 0.59 assign (resid 243 and name HB1 ) (resid 244 and name HN ) 3.16 1.36 1.36 !peak 365 #SUP 0.98 #QF 0.98 assign (resid 243 and name HG2 ) (resid 244 and name HN ) 2.51 0.71 0.71 !peak 366 #SUP 0.52 #QF 0.52 assign (resid 244 and name HN ) (resid 244 and name HB* ) 2.29 0.49 0.49 !peak 367 #SUP 0.84 #QF 0.84 assign (resid 243 and name HD2 ) (resid 244 and name HN ) 2.71 0.91 0.91 !peak 370 #SUP 0.95 #QF 0.95 assign (resid 243 and name HD1 ) (resid 244 and name HN ) 3.09 1.29 1.29 !peak 371 #SUP 0.93 #QF 0.93 assign (resid 191 and name HN ) (resid 191 and name HG2 ) 2.86 1.06 1.06 !peak 376 #SUP 0.53 #QF 0.53 assign (resid 218 and name HA ) (resid 219 and name HN ) 2.37 0.57 0.57 !peak 386 #SUP 0.98 #QF 0.98 assign (resid 211 and name HA ) (resid 219 and name HN ) 3.23 1.43 1.43 !peak 389 #SUP 0.69 #QF 0.69 assign (resid 218 and name HB2 ) (resid 219 and name HN ) 2.78 0.98 0.98 !peak 392 #SUP 0.97 #QF 0.97 assign (resid 219 and name HN ) (resid 219 and name HB ) 2.93 1.13 1.13 !peak 393 #SUP 0.98 #QF 0.98 assign (resid 218 and name HB1 ) (resid 219 and name HN ) 2.78 0.98 0.98 !peak 394 #SUP 0.95 #QF 0.95 assign (resid 212 and name HB* ) (resid 219 and name HN ) 2.80 1.00 1.00 !peak 397 #SUP 0.89 #QF 0.89 assign (resid 247 and name HA1 ) (resid 248 and name HN ) 2.55 0.75 0.75 !peak 400 #SUP 0.90 #QF 0.90 assign (resid 247 and name HA2 ) (resid 248 and name HN ) 2.55 0.75 0.75 !peak 404 #SUP 0.90 #QF 0.90 assign (resid 191 and name HB2 ) (resid 248 and name HN ) 3.28 1.48 1.48 !peak 407 #SUP 0.69 #QF 0.69 assign (resid 248 and name HN ) (resid 248 and name HB2 ) 2.92 1.12 1.12 !peak 408 #SUP 0.93 #QF 0.93 assign (resid 191 and name HB1 ) (resid 248 and name HN ) 3.28 1.48 1.48 !peak 409 #SUP 0.82 #QF 0.82 assign (resid 248 and name HN ) (resid 248 and name HB1 ) 2.79 0.99 0.99 !peak 410 #SUP 0.74 #QF 0.74 assign (resid 248 and name HN ) (resid 249 and name HN ) 3.52 1.72 1.72 !peak 414 #SUP 1.00 assign (resid 209 and name HA ) (resid 210 and name HN ) 2.29 0.49 0.49 !peak 416 #SUP 0.95 #QF 0.95 assign (resid 210 and name HN ) (resid 220 and name HA ) 3.20 1.40 1.40 !peak 417 #SUP 0.94 #QF 0.94 assign (resid 210 and name HN ) (resid 221 and name HN ) 2.60 0.80 0.80 !peak 419 #SUP 0.98 #QF 0.98 assign (resid 210 and name HN ) (resid 220 and name HG2 ) 2.69 0.89 0.89 !peak 423 #SUP 0.58 #QF 0.58 assign (resid 209 and name HB1 ) (resid 210 and name HN ) 2.81 1.01 1.01 !peak 425 #SUP 0.97 #QF 0.97 assign (resid 209 and name HG2 ) (resid 210 and name HN ) 2.85 1.05 1.05 !peak 426 #SUP 0.96 #QF 0.96 assign (resid 209 and name HG1 ) (resid 210 and name HN ) 3.05 1.25 1.24 !peak 427 #SUP 0.99 #QF 0.99 assign (resid 210 and name HN ) (resid 210 and name HG1* ) 2.72 0.92 0.92 !peak 428 #SUP 0.98 #QF 0.98 assign (resid 210 and name HN ) (resid 210 and name HG2* ) 2.72 0.92 0.92 !peak 429 #SUP 0.91 #QF 0.80 assign (resid 210 and name HN ) (resid 223 and name HG2* ) 2.71 0.91 0.91 !peak 429 #SUP 0.91 #QF 0.80 assign (resid 169 and name HB1 ) (resid 170 and name HN ) 3.23 1.43 1.43 !peak 431 #SUP 0.87 #QF 0.87 assign (resid 169 and name HA ) (resid 170 and name HN ) 2.34 0.54 0.54 !peak 432 #SUP 0.77 #QF 0.77 assign (resid 169 and name HB2 ) (resid 170 and name HN ) 3.23 1.43 1.43 !peak 435 #SUP 0.86 #QF 0.86 assign (resid 200 and name HB2 ) (resid 203 and name HN ) 2.77 0.97 0.97 !peak 437 #SUP 0.82 #QF 0.82 assign (resid 202 and name HB2 ) (resid 203 and name HN ) 2.71 0.91 0.91 !peak 438 #SUP 0.91 #QF 0.91 assign (resid 203 and name HN ) (resid 203 and name HB ) 2.29 0.49 0.49 !peak 439 #SUP 0.75 #QF 0.75 assign (resid 203 and name HN ) (resid 203 and name HG12 ) 2.90 1.10 1.10 !peak 440 #SUP 0.98 #QF 0.98 assign (resid 203 and name HN ) (resid 203 and name HG11 ) 2.51 0.71 0.71 !peak 442 #SUP 0.96 #QF 0.96 assign (resid 203 and name HN ) (resid 203 and name HG2* ) 2.95 1.15 1.15 !peak 446 #SUP 0.99 #QF 0.99 assign (resid 202 and name HD2 ) (resid 203 and name HN ) 2.69 0.89 0.89 !peak 449 #SUP 0.93 #QF 0.93 assign (resid 200 and name HD2 ) (resid 203 and name HN ) 3.08 1.28 1.28 !peak 452 #SUP 0.93 #QF 0.93 assign (resid 203 and name HN ) (resid 204 and name HN ) 2.41 0.61 0.61 !peak 455 #SUP 0.96 #QF 0.96 assign (resid 201 and name HN ) (resid 203 and name HN ) 3.38 1.58 1.57 !peak 458 #SUP 0.72 #QF 0.72 assign (resid 238 and name HN ) (resid 238 and name HB2 ) 2.56 0.76 0.76 !peak 461 #SUP 0.83 #QF 0.83 assign (resid 238 and name HN ) (resid 249 and name HB1 ) 3.30 1.50 1.50 !peak 463 #SUP 0.30 #QF 0.30 assign (resid 238 and name HN ) (resid 238 and name HB1 ) 2.94 1.14 1.14 !peak 464 #SUP 0.99 #QF 0.99 assign (resid 236 and name HA ) (resid 238 and name HN ) 2.85 1.05 1.05 !peak 466 #SUP 0.98 #QF 0.98 assign (resid 237 and name HA1 ) (resid 238 and name HN ) 2.79 0.99 0.99 !peak 467 #SUP 0.97 #QF 0.97 assign (resid 237 and name HA2 ) (resid 238 and name HN ) 2.79 0.99 0.99 !peak 468 #SUP 0.88 #QF 0.88 assign (resid 238 and name HN ) (resid 248 and name HA ) 2.57 0.77 0.77 !peak 469 #SUP 0.87 #QF 0.87 assign (resid 237 and name HN ) (resid 238 and name HN ) 2.61 0.81 0.81 !peak 471 #SUP 0.99 #QF 0.99 assign (resid 236 and name HN ) (resid 238 and name HN ) 3.16 1.36 1.36 !peak 472 #SUP 0.73 #QF 0.73 assign (resid 238 and name HN ) (resid 239 and name HN ) 2.52 0.72 0.72 !peak 473 #SUP 0.96 #QF 0.96 assign (resid 238 and name HN ) (resid 249 and name HN ) 2.94 1.14 1.14 !peak 474 #SUP 0.95 #QF 0.95 assign (resid 230 and name HN ) (resid 230 and name HA2 ) 2.47 0.67 0.67 !peak 475 #SUP 0.95 #QF 0.95 assign (resid 229 and name HA ) (resid 230 and name HN ) 2.31 0.51 0.51 !peak 476 #SUP 0.96 #QF 0.96 assign (resid 230 and name HN ) (resid 253 and name HB ) 2.75 0.95 0.95 !peak 478 #SUP 0.82 #QF 0.82 assign (resid 230 and name HN ) (resid 231 and name HG1 ) 3.49 1.69 1.69 !peak 480 #SUP 0.93 #QF 0.93 assign (resid 230 and name HN ) (resid 254 and name HG2 ) 3.78 1.98 1.98 !peak 481 #SUP 0.29 #QF 0.29 assign (resid 229 and name HB* ) (resid 230 and name HN ) 2.44 0.64 0.64 !peak 482 #SUP 0.95 #QF 0.95 assign (resid 230 and name HN ) (resid 253 and name HG1* ) 2.99 1.19 1.19 !peak 485 #SUP 0.98 #QF 0.98 assign (resid 236 and name HN ) (resid 237 and name HN ) 3.35 1.55 1.55 !peak 490 #SUP 0.99 #QF 0.99 assign (resid 237 and name HN ) (resid 239 and name HN ) 3.08 1.28 1.28 !peak 491 #SUP 0.90 #QF 0.90 assign (resid 237 and name HN ) (resid 249 and name HN ) 3.47 1.67 1.67 !peak 492 #SUP 0.86 #QF 0.86 assign (resid 237 and name HN ) (resid 248 and name HA ) 2.71 0.91 0.91 !peak 494 #SUP 0.96 #QF 0.96 assign (resid 237 and name HN ) (resid 238 and name HA ) 3.80 2.00 2.00 !peak 495 #SUP 0.94 #QF 0.94 assign (resid 236 and name HA ) (resid 237 and name HN ) 2.40 0.60 0.60 !peak 496 #SUP 0.98 #QF 0.98 assign (resid 237 and name HN ) (resid 248 and name HB2 ) 3.22 1.42 1.42 !peak 499 #SUP 0.80 #QF 0.80 assign (resid 237 and name HN ) (resid 248 and name HB1 ) 3.08 1.28 1.28 !peak 500 #SUP 0.77 #QF 0.77 assign (resid 236 and name HB1 ) (resid 237 and name HN ) 2.87 1.07 1.07 !peak 501 #SUP 0.84 #QF 0.84 assign (resid 207 and name HN ) (resid 207 and name HA2 ) 2.37 0.57 0.57 !peak 506 #SUP 0.95 #QF 0.95 assign (resid 207 and name HN ) (resid 225 and name HA ) 2.57 0.77 0.77 !peak 507 #SUP 0.62 #QF 0.62 assign (resid 207 and name HN ) (resid 207 and name HA1 ) 2.51 0.71 0.71 !peak 508 #SUP 1.00 assign (resid 203 and name HB ) (resid 207 and name HN ) 3.97 2.17 2.17 !peak 511 #SUP 0.88 #QF 0.88 assign (resid 204 and name HB* ) (resid 207 and name HN ) 3.48 1.68 1.68 !peak 513 #SUP 0.88 #QF 0.88 assign (resid 206 and name HG1* ) (resid 207 and name HN ) 2.40 0.60 0.60 !peak 514 #SUP 0.90 #QF 0.90 assign (resid 203 and name HG2* ) (resid 207 and name HN ) 3.16 1.36 1.36 !peak 516 #SUP 0.99 #QF 0.99 assign (resid 206 and name HN ) (resid 207 and name HN ) 2.29 0.49 0.49 !peak 517 #SUP 0.98 #QF 0.98 assign (resid 206 and name HN ) (resid 225 and name HA ) 3.38 1.58 1.57 !peak 523 #SUP 0.77 #QF 0.77 assign (resid 203 and name HA ) (resid 206 and name HN ) 3.11 1.31 1.31 !peak 525 #SUP 0.74 #QF 0.74 assign (resid 206 and name HN ) (resid 206 and name HB ) 2.42 0.62 0.62 !peak 526 #SUP 0.95 #QF 0.95 assign (resid 206 and name HN ) (resid 206 and name HG1* ) 2.22 0.42 0.42 !peak 532 #SUP 0.69 #QF 0.69 assign (resid 205 and name HG1* ) (resid 206 and name HN ) 2.52 0.72 0.72 !peak 533 #SUP 0.95 #QF 0.95 assign (resid 205 and name HN ) (resid 207 and name HN ) 2.97 1.17 1.17 !peak 535 #SUP 0.67 #QF 0.67 assign (resid 204 and name HN ) (resid 205 and name HN ) 2.40 0.60 0.60 !peak 536 #SUP 0.95 #QF 0.95 assign (resid 202 and name HA ) (resid 205 and name HN ) 2.81 1.01 1.01 !peak 538 #SUP 0.92 #QF 0.92 assign (resid 205 and name HN ) (resid 205 and name HB ) 2.24 0.44 0.44 !peak 543 #SUP 0.87 #QF 0.87 assign (resid 204 and name HB* ) (resid 205 and name HN ) 2.43 0.63 0.63 !peak 545 #SUP 0.90 #QF 0.90 assign (resid 205 and name HN ) (resid 205 and name HG2* ) 2.47 0.67 0.67 !peak 546 #SUP 0.97 #QF 0.97 assign (resid 242 and name HN ) (resid 246 and name HN ) 3.16 1.36 1.36 !peak 567 #SUP 0.55 #QF 0.55 assign (resid 191 and name HE22 ) (resid 242 and name HN ) 2.92 1.12 1.12 !peak 572 #SUP 0.98 #QF 0.98 assign (resid 242 and name HN ) (resid 246 and name HA ) 2.56 0.76 0.76 !peak 573 #SUP 0.91 #QF 0.91 assign (resid 241 and name HA ) (resid 242 and name HN ) 2.28 0.48 0.48 !peak 574 #SUP 0.95 #QF 0.95 assign (resid 242 and name HN ) (resid 242 and name HA1 ) 2.42 0.62 0.62 !peak 576 #SUP 0.95 #QF 0.95 assign (resid 241 and name HB1 ) (resid 242 and name HN ) 3.03 1.23 1.23 !peak 582 #SUP 0.97 #QF 0.97 assign (resid 241 and name HB2 ) (resid 242 and name HN ) 2.61 0.81 0.80 !peak 583 #SUP 0.95 #QF 0.95 assign (resid 242 and name HN ) (resid 246 and name HG1 ) 2.90 1.10 1.10 !peak 584 #SUP 1.00 assign (resid 242 and name HN ) (resid 246 and name HG2 ) 2.78 0.98 0.98 !peak 586 #SUP 0.92 #QF 0.92 assign (resid 244 and name HA ) (resid 245 and name HN ) 2.57 0.77 0.77 !peak 588 #SUP 0.94 #QF 0.94 assign (resid 242 and name HA1 ) (resid 245 and name HN ) 2.89 1.09 1.09 !peak 590 #SUP 0.92 #QF 0.92 assign (resid 244 and name HN ) (resid 245 and name HN ) 2.36 0.56 0.56 !peak 596 #SUP 0.96 #QF 0.96 assign (resid 242 and name HN ) (resid 245 and name HN ) 2.87 1.07 1.07 !peak 597 #SUP 0.98 #QF 0.98 assign (resid 191 and name HE22 ) (resid 245 and name HN ) 3.37 1.57 1.57 !peak 600 #SUP 0.66 #QF 0.66 assign (resid 214 and name HB ) (resid 217 and name HN ) 2.69 0.89 0.89 !peak 604 #SUP 0.87 #QF 0.87 assign (resid 207 and name HN ) (resid 208 and name HN ) 2.73 0.93 0.93 !peak 613 #SUP 0.96 #QF 0.96 assign (resid 203 and name HG2* ) (resid 208 and name HN ) 2.60 0.80 0.80 !peak 615 #SUP 0.92 #QF 0.92 assign (resid 208 and name HN ) (resid 223 and name HB ) 2.40 0.60 0.60 !peak 619 #SUP 0.65 #QF 0.65 assign (resid 207 and name HA2 ) (resid 208 and name HN ) 2.32 0.52 0.52 !peak 621 #SUP 0.49 #QF 0.49 assign (resid 226 and name HN ) (resid 227 and name HN ) 2.68 0.88 0.88 !peak 633 #SUP 0.99 #QF 0.99 assign (resid 226 and name HA ) (resid 227 and name HN ) 2.38 0.59 0.59 !peak 634 #SUP 0.93 #QF 0.70 assign (resid 227 and name HN ) (resid 227 and name HB ) 2.52 0.72 0.72 !peak 634 #SUP 0.93 #QF 0.70 assign (resid 226 and name HB1 ) (resid 227 and name HN ) 3.28 1.48 1.48 !peak 635 #SUP 0.93 #QF 0.93 assign (resid 204 and name HB* ) (resid 227 and name HN ) 2.66 0.86 0.86 !peak 637 #SUP 0.77 #QF 0.77 assign (resid 226 and name HB2 ) (resid 227 and name HN ) 3.48 1.68 1.68 !peak 643 #SUP 0.82 #QF 0.82 assign (resid 246 and name HG1 ) (resid 247 and name HN ) 3.31 1.51 1.51 !peak 660 #SUP 0.94 #QF 0.94 assign (resid 246 and name HG2 ) (resid 247 and name HN ) 3.35 1.55 1.55 !peak 661 #SUP 0.82 #QF 0.82 assign (resid 246 and name HN ) (resid 247 and name HN ) 3.53 1.73 1.73 !peak 662 #SUP 1.00 assign (resid 247 and name HN ) (resid 248 and name HN ) 3.28 1.48 1.48 !peak 663 #SUP 0.93 #QF 0.93 assign (resid 175 and name HN ) (resid 235 and name HD2* ) 3.61 1.81 1.81 !peak 664 #SUP 0.79 #QF 0.67 assign (resid 174 and name HN ) (resid 235 and name HD1* ) 3.57 1.77 1.77 !peak 678 #SUP 0.89 #QF 0.42 assign (resid 175 and name HN ) (resid 175 and name HG2 ) 2.90 1.10 1.10 !peak 681 #SUP 0.96 #QF 0.96 assign (resid 191 and name HN ) (resid 191 and name HG1 ) 2.75 0.95 0.95 !peak 683 #SUP 0.76 #QF 0.76 assign (resid 197 and name HG ) (resid 198 and name HN ) 2.70 0.90 0.90 !peak 684 #SUP 0.92 #QF 0.92 assign (resid 203 and name HG2* ) (resid 204 and name HN ) 2.75 0.95 0.95 !peak 689 #SUP 0.98 #QF 0.98 assign (resid 216 and name HN ) (resid 216 and name HB1 ) 2.85 1.05 1.05 !peak 695 #SUP 0.67 #QF 0.67 assign (resid 215 and name HB2 ) (resid 216 and name HN ) 2.60 0.80 0.80 !peak 696 #SUP 0.47 #QF 0.47 assign (resid 229 and name HN ) (resid 255 and name HG12 ) 2.72 0.92 0.92 !peak 700 #SUP 0.65 #QF 0.65 assign (resid 229 and name HN ) (resid 230 and name HA1 ) 3.96 2.16 2.16 !peak 704 #SUP 0.24 #QF 0.24 assign (resid 238 and name HN ) (resid 238 and name HG2 ) 2.48 0.68 0.68 !peak 716 #SUP 0.69 #QF 0.69 assign (resid 242 and name HA1 ) (resid 244 and name HN ) 2.87 1.07 1.07 !peak 718 #SUP 0.83 #QF 0.83 assign (resid 245 and name HN ) (resid 246 and name HN ) 3.35 1.55 1.55 !peak 722 #SUP 0.91 #QF 0.91 assign (resid 249 and name HN ) (resid 250 and name HN ) 3.36 1.56 1.56 !peak 726 #SUP 1.00 assign (resid 194 and name HD1 ) (resid 252 and name HN ) 2.94 1.14 1.14 !peak 727 #SUP 0.66 #QF 0.66 assign (resid 196 and name HG2* ) (resid 252 and name HN ) 3.19 1.39 1.39 !peak 728 #SUP 0.97 #QF 0.96 assign (resid 251 and name HB1 ) (resid 252 and name HN ) 3.41 1.61 1.61 !peak 728 #SUP 0.97 #QF 0.96 assign (resid 232 and name HN ) (resid 253 and name HN ) 3.42 1.62 1.62 !peak 732 #SUP 0.94 #QF 0.94 assign (resid 191 and name HG2 ) (resid 191 and name HE22 ) 2.93 1.13 1.14 !peak 733 #SUP 0.83 #QF 0.83 assign (resid 191 and name HE22 ) (resid 242 and name HA2 ) 3.17 1.37 1.37 !peak 735 #SUP 0.75 #QF 0.75 assign (resid 191 and name HE22 ) (resid 242 and name HA1 ) 2.89 1.09 1.09 !peak 736 #SUP 0.85 #QF 0.85 assign (resid 228 and name HG1 ) (resid 228 and name HE22 ) 2.92 1.12 1.12 !peak 738 #SUP 0.91 #QF 0.91 assign (resid 228 and name HB1 ) (resid 228 and name HE22 ) 3.44 1.64 1.64 !peak 739 #SUP 0.53 #QF 0.53 assign (resid 228 and name HB2 ) (resid 228 and name HE22 ) 3.03 1.23 1.23 !peak 740 #SUP 0.97 #QF 0.97 assign (resid 191 and name HE21 ) (resid 247 and name HN ) 3.00 1.20 1.20 !peak 742 #SUP 0.60 #QF 0.60 assign (resid 212 and name HB* ) (resid 221 and name HN ) 3.28 1.48 1.48 !peak 751 #SUP 0.42 #QF 0.42 assign (resid 199 and name HN ) (resid 200 and name HD2 ) 3.65 1.85 1.85 !peak 757 #SUP 0.95 #QF 0.95 assign (resid 200 and name HA ) (resid 203 and name HN ) 3.55 1.75 1.75 !peak 790 #SUP 0.84 #QF 0.84 assign (resid 230 and name HN ) (resid 254 and name HN ) 3.84 2.04 2.04 !peak 793 #SUP 0.38 #QF 0.38 assign (resid 230 and name HN ) (resid 252 and name HA ) 3.96 2.16 2.16 !peak 794 #SUP 0.40 #QF 0.40 assign (resid 194 and name HD1 ) (resid 250 and name HN ) 3.55 1.75 1.75 !peak 799 #SUP 0.95 #QF 0.95 assign (resid 197 and name HA ) (resid 198 and name HN ) 2.25 0.45 0.45 !peak 844 #SUP 0.82 #QF 0.82 assign (resid 254 and name HN ) (resid 255 and name HN ) 3.33 1.53 1.53 !peak 878 #SUP 0.96 #QF 0.96 assign (resid 254 and name HA ) (resid 255 and name HN ) 2.28 0.48 0.47 !peak 882 #SUP 0.66 #QF 0.66 assign (resid 229 and name HA ) (resid 255 and name HN ) 2.89 1.09 1.09 !peak 883 #SUP 0.60 #QF 0.60 assign (resid 254 and name HD2 ) (resid 255 and name HN ) 3.14 1.34 1.34 !peak 884 #SUP 0.66 #QF 0.66 assign (resid 255 and name HN ) (resid 255 and name HB ) 2.31 0.51 0.51 !peak 886 #SUP 0.50 #QF 0.50 assign (resid 170 and name HN ) (resid 171 and name HN ) 3.12 1.32 1.32 !peak 891 #SUP 0.40 #QF 0.40 assign (resid 209 and name HN ) (resid 223 and name HB ) 3.46 1.66 1.66 !peak 1020 #SUP 0.56 #QF 0.56 assign (resid 251 and name HB2 ) (resid 252 and name HN ) 3.27 1.47 1.47 !peak 1037 #SUP 0.49 #QF 0.49 assign (resid 232 and name HG1 ) (resid 252 and name HN ) 3.57 1.77 1.77 !peak 1038 #SUP 0.37 #QF 0.37 assign (resid 235 and name HN ) (resid 250 and name HD2 ) 3.18 1.38 1.38 !peak 1097 #SUP 0.68 #QF 0.68 assign (resid 235 and name HN ) (resid 249 and name HB1 ) 3.22 1.42 1.42 !peak 1100 #SUP 0.67 #QF 0.67 assign (resid 234 and name HN ) (resid 251 and name HN ) 3.93 2.13 2.13 !peak 1102 #SUP 0.50 #QF 0.50 assign (resid 249 and name HN ) (resid 250 and name HE2 ) 3.73 1.93 1.93 !peak 1114 #SUP 0.45 #QF 0.45 assign (resid 227 and name HN ) (resid 228 and name HN ) 3.48 1.68 1.68 !peak 1125 #SUP 0.52 #QF 0.52 assign (resid 191 and name HN ) (resid 191 and name HE21 ) 4.08 2.28 2.28 !peak 1153 #SUP 0.98 #QF 0.98 assign (resid 169 and name HN ) (resid 170 and name HN ) 3.40 1.60 1.60 !peak 1201 #SUP 0.98 #QF 0.98 assign (resid 239 and name HN ) (resid 248 and name HN ) 3.28 1.48 1.48 !peak 1232 #SUP 0.40 #QF 0.40 assign (resid 238 and name HB1 ) (resid 239 and name HN ) 3.33 1.53 1.53 !peak 1240 #SUP 0.50 #QF 0.50 assign (resid 238 and name HG2 ) (resid 239 and name HN ) 3.52 1.72 1.72 !peak 1242 #SUP 0.39 #QF 0.39 assign (resid 215 and name HD1* ) (resid 239 and name HN ) 3.74 1.94 1.94 !peak 1243 #SUP 0.56 #QF 0.33 assign (resid 215 and name HD2* ) (resid 239 and name HN ) 3.94 2.14 2.14 !peak 1243 #SUP 0.56 #QF 0.33 assign (resid 243 and name HD1 ) (resid 245 and name HN ) 3.80 2.00 2.00 !peak 1293 #SUP 1.00 assign (resid 215 and name HA ) (resid 217 and name HN ) 3.95 2.15 2.15 !peak 1302 #SUP 0.55 #QF 0.55 assign (resid 215 and name HB1 ) (resid 217 and name HN ) 3.97 2.17 2.17 !peak 1307 #SUP 0.34 #QF 0.34 assign (resid 206 and name HN ) (resid 208 and name HN ) 3.84 2.04 2.04 !peak 1313 #SUP 0.48 #QF 0.48 assign (resid 204 and name HN ) (resid 206 and name HN ) 3.29 1.49 1.49 !peak 1314 #SUP 0.82 #QF 0.82 assign (resid 212 and name HN ) (resid 213 and name HN ) 3.43 1.63 1.63 !peak 1318 #SUP 0.44 #QF 0.44 assign (resid 228 and name HN ) (resid 228 and name HB2 ) 3.06 1.26 1.26 !peak 1366 #SUP 0.89 #QF 0.89 assign (resid 191 and name HE22 ) (resid 246 and name HA ) 3.22 1.42 1.42 !peak 1384 #SUP 0.73 #QF 0.73 assign (resid 191 and name HE21 ) (resid 242 and name HN ) 3.05 1.25 1.24 !peak 1396 #SUP 0.95 #QF 0.95 assign (resid 191 and name HE21 ) (resid 246 and name HN ) 3.79 1.99 1.99 !peak 1399 #SUP 0.94 #QF 0.94 assign (resid 191 and name HE21 ) (resid 242 and name HA1 ) 2.89 1.09 1.09 !peak 1400 #SUP 1.00 assign (resid 191 and name HE21 ) (resid 242 and name HA2 ) 2.98 1.18 1.18 !peak 1402 #SUP 0.80 #QF 0.80 assign (resid 191 and name HA ) (resid 191 and name HE21 ) 3.18 1.38 1.38 !peak 1403 #SUP 0.94 #QF 0.94 assign (resid 191 and name HB1 ) (resid 191 and name HE21 ) 2.90 1.10 1.10 !peak 1404 #SUP 0.89 #QF 0.89 assign (resid 191 and name HB2 ) (resid 191 and name HE21 ) 2.90 1.10 1.10 !peak 1406 #SUP 0.56 #QF 0.56 assign (resid 228 and name HB2 ) (resid 228 and name HE21 ) 2.97 1.17 1.17 !peak 1412 #SUP 0.73 #QF 0.73 assign (resid 228 and name HG1 ) (resid 228 and name HE21 ) 2.54 0.74 0.74 !peak 1413 #SUP 0.78 #QF 0.78 assign (resid 228 and name HB1 ) (resid 228 and name HE21 ) 3.17 1.37 1.37 !peak 1414 #SUP 0.95 #QF 0.95 assign (resid 227 and name HA ) (resid 228 and name HE21 ) 3.08 1.28 1.28 !peak 1415 #SUP 0.86 #QF 0.86 assign (resid 228 and name HA ) (resid 228 and name HE21 ) 3.12 1.32 1.32 !peak 1416 #SUP 0.93 #QF 0.93 assign (resid 228 and name HE21 ) (resid 229 and name HN ) 3.64 1.84 1.84 !peak 1419 #SUP 0.92 #QF 0.92 assign (resid 227 and name HN ) (resid 228 and name HE22 ) 3.48 1.68 1.68 !peak 1421 #SUP 0.61 #QF 0.61 assign (resid 226 and name HA ) (resid 228 and name HE22 ) 3.47 1.67 1.67 !peak 1424 #SUP 0.96 #QF 0.31 assign (resid 227 and name HA ) (resid 228 and name HE22 ) 3.58 1.78 1.78 !peak 1424 #SUP 0.96 #QF 0.31 assign (resid 177 and name HA ) (resid 177 and name HE21 ) 3.36 1.56 1.56 !peak 1429 #SUP 0.92 #QF 0.92 assign (resid 169 and name HA ) (resid 169 and name HG* ) 2.61 0.81 0.80 !peak 729 assign (resid 169 and name HB* ) (resid 170 and name HN ) 2.78 0.98 0.98 !peak 431 assign (resid 169 and name HG* ) (resid 170 and name HN ) 3.11 1.31 1.31 !peak 430 assign (resid 172 and name HN ) (resid 219 and name HG* ) 3.38 1.58 1.58 !peak 1197 assign (resid 172 and name HA ) (resid 219 and name HG* ) 3.24 1.44 1.44 !peak 516 assign (resid 172 and name HB ) (resid 219 and name HG* ) 2.84 1.04 1.04 !peak 425 assign (resid 172 and name HG2* ) (resid 219 and name HG* ) 2.28 0.48 0.48 !peak 22 assign (resid 173 and name HN ) (resid 174 and name HA* ) 3.98 2.18 2.18 !peak 898 assign (resid 173 and name HN ) (resid 219 and name HG* ) 3.09 1.29 1.29 !peak 1391 assign (resid 173 and name HA ) (resid 174 and name HA* ) 3.43 1.63 1.63 !peak 164 assign (resid 173 and name HA ) (resid 219 and name HG* ) 3.26 1.46 1.46 !peak 805 assign (resid 173 and name HB* ) (resid 174 and name HA* ) 3.19 1.39 1.39 !peak 47 assign (resid 173 and name HB* ) (resid 219 and name HG* ) 2.76 0.96 0.96 !peak 21 assign (resid 173 and name HB* ) (resid 251 and name HD* ) 3.25 1.45 1.45 !peak 176 assign (resid 174 and name HN ) (resid 219 and name HG* ) 3.41 1.61 1.61 !peak 678 assign (resid 174 and name HA* ) (resid 175 and name HN ) 2.33 0.53 0.53 !peak 263 assign (resid 174 and name HA* ) (resid 175 and name HA ) 3.67 1.87 1.87 !peak 414 assign (resid 174 and name HA* ) (resid 233 and name HD2* ) 3.72 1.92 1.92 !peak 2338 assign (resid 174 and name HA* ) (resid 234 and name HG* ) 3.26 1.46 1.46 !peak 48 assign (resid 174 and name HA* ) (resid 235 and name HD2* ) 2.87 1.07 1.07 !peak 417 assign (resid 174 and name HA* ) (resid 236 and name HN ) 3.79 1.99 1.99 !peak 777 assign (resid 175 and name HN ) (resid 175 and name HB* ) 2.42 0.62 0.62 !peak 259 assign (resid 175 and name HN ) (resid 175 and name HG* ) 2.57 0.77 0.77 !peak 258 assign (resid 175 and name HN ) (resid 234 and name HG* ) 3.17 1.37 1.37 !peak 256 assign (resid 175 and name HG* ) (resid 176 and name HD1 ) 3.80 2.00 2.00 !peak 59 assign (resid 175 and name HG* ) (resid 234 and name HN ) 3.99 2.19 2.19 !peak 766 assign (resid 176 and name HB* ) (resid 176 and name HD1 ) 2.56 0.76 0.76 !peak 15 assign (resid 176 and name HB* ) (resid 176 and name HE3 ) 2.70 0.90 0.90 !peak 98 assign (resid 176 and name HD1 ) (resid 179 and name HB* ) 3.44 1.64 1.64 !peak 100 assign (resid 176 and name HD1 ) (resid 179 and name HG* ) 3.66 1.86 1.86 !peak 18 assign (resid 176 and name HD1 ) (resid 224 and name HD* ) 3.36 1.56 1.56 !peak 60 assign (resid 176 and name HE3 ) (resid 231 and name HD* ) 2.75 0.95 0.95 !peak 97 assign (resid 177 and name HB* ) (resid 177 and name HE21 ) 2.75 0.95 0.95 !peak 1426 assign (resid 177 and name HG* ) (resid 177 and name HE21 ) 2.32 0.52 0.52 !peak 1425 assign (resid 179 and name HA ) (resid 179 and name HG* ) 2.86 1.06 1.06 !peak 201 assign (resid 179 and name HA ) (resid 179 and name HD* ) 3.26 1.46 1.47 !peak 1461 assign (resid 179 and name HB* ) (resid 179 and name HD* ) 2.73 0.93 0.93 !peak 2786 assign (resid 179 and name HB* ) (resid 179 and name HE* ) 2.95 1.15 1.15 !peak 2666 assign (resid 179 and name HG* ) (resid 179 and name HE* ) 2.49 0.69 0.70 !peak 3223 assign (resid 190 and name HB* ) (resid 191 and name HN ) 2.68 0.88 0.88 !peak 381 assign (resid 191 and name HN ) (resid 191 and name HB* ) 2.82 1.02 1.02 !peak 377 assign (resid 191 and name HB* ) (resid 191 and name HE21 ) 2.49 0.69 0.69 !peak 1406 assign (resid 191 and name HB* ) (resid 191 and name HE22 ) 3.28 1.48 1.48 !peak 1408 assign (resid 191 and name HB* ) (resid 247 and name HN ) 3.16 1.36 1.36 !peak 646 assign (resid 191 and name HB* ) (resid 247 and name HA* ) 2.90 1.10 1.10 !peak 70 assign (resid 191 and name HB* ) (resid 248 and name HN ) 3.06 1.26 1.26 !peak 409 assign (resid 191 and name HG1 ) (resid 247 and name HA* ) 3.20 1.40 1.40 !peak 2721 assign (resid 191 and name HE21 ) (resid 247 and name HA* ) 2.99 1.19 1.19 !peak 1401 assign (resid 194 and name HB* ) (resid 194 and name HD2 ) 2.62 0.82 0.82 !peak 51 assign (resid 194 and name HD1 ) (resid 232 and name HE* ) 2.98 1.18 1.18 !peak 1109 assign (resid 194 and name HD1 ) (resid 252 and name HB* ) 3.65 1.85 1.85 !peak 87 assign (resid 194 and name HE1 ) (resid 232 and name HE* ) 2.67 0.87 0.87 !peak 35 assign (resid 194 and name HE1 ) (resid 252 and name HB* ) 3.04 1.24 1.24 !peak 38 assign (resid 195 and name HB* ) (resid 251 and name HD* ) 2.70 0.90 0.90 !peak 36 assign (resid 196 and name HA ) (resid 251 and name HD* ) 3.29 1.49 1.49 !peak 2076 assign (resid 197 and name HN ) (resid 251 and name HD* ) 2.92 1.12 1.12 !peak 149 assign (resid 197 and name HA ) (resid 198 and name HB* ) 3.28 1.48 1.48 !peak 2265 assign (resid 197 and name HA ) (resid 251 and name HD* ) 3.00 1.20 1.20 !peak 2275 assign (resid 197 and name HB2 ) (resid 199 and name HG* ) 3.66 1.86 1.86 !peak 403 assign (resid 197 and name HG ) (resid 199 and name HG* ) 3.07 1.27 1.27 !peak 3304 assign (resid 197 and name HG ) (resid 210 and name HG* ) 2.93 1.13 1.13 !peak 2874 assign (resid 197 and name HG ) (resid 251 and name HD* ) 2.76 0.96 0.96 !peak 3305 assign (resid 197 and name HD1* ) (resid 198 and name HB* ) 3.71 1.91 1.91 !peak 1951 assign (resid 197 and name HD1* ) (resid 210 and name HG* ) 2.45 0.65 0.65 !peak 286 assign (resid 197 and name HD1* ) (resid 219 and name HG* ) 3.54 1.74 1.74 !peak 473 assign (resid 197 and name HD1* ) (resid 251 and name HD* ) 2.48 0.68 0.68 !peak 1953 assign (resid 197 and name HD2* ) (resid 199 and name HG* ) 2.79 0.99 0.99 !peak 69 assign (resid 197 and name HD2* ) (resid 210 and name HG* ) 2.62 0.82 0.82 !peak 637 assign (resid 197 and name HD2* ) (resid 251 and name HD* ) 2.54 0.74 0.74 !peak 93 assign (resid 198 and name HN ) (resid 198 and name HB* ) 2.35 0.55 0.55 !peak 17 assign (resid 198 and name HA ) (resid 199 and name HG* ) 2.92 1.12 1.12 !peak 656 assign (resid 198 and name HB* ) (resid 256 and name HG2* ) 2.93 1.13 1.13 !peak 2042 assign (resid 199 and name HN ) (resid 199 and name HG* ) 2.46 0.66 0.66 !peak 184 assign (resid 199 and name HA ) (resid 199 and name HG* ) 2.49 0.69 0.70 !peak 580 assign (resid 199 and name HA ) (resid 210 and name HG* ) 2.67 0.87 0.87 !peak 2887 assign (resid 199 and name HB ) (resid 210 and name HG* ) 2.68 0.88 0.88 !peak 2644 assign (resid 199 and name HG* ) (resid 200 and name HA ) 3.45 1.65 1.65 !peak 2499 assign (resid 199 and name HG* ) (resid 200 and name HG2 ) 3.23 1.43 1.43 !peak 1937 assign (resid 199 and name HG* ) (resid 200 and name HD2 ) 2.83 1.03 1.03 !peak 840 assign (resid 199 and name HG* ) (resid 200 and name HD1 ) 2.98 1.18 1.18 !peak 1927 assign (resid 199 and name HG* ) (resid 201 and name HA ) 3.64 1.84 1.84 !peak 1925 assign (resid 199 and name HG* ) (resid 203 and name HN ) 3.21 1.41 1.41 !peak 1933 assign (resid 199 and name HG* ) (resid 203 and name HB ) 2.85 1.05 1.05 !peak 1144 assign (resid 199 and name HG* ) (resid 203 and name HG2* ) 2.35 0.55 0.55 !peak 56 assign (resid 199 and name HG* ) (resid 203 and name HG12 ) 3.50 1.70 1.70 !peak 1939 assign (resid 199 and name HG* ) (resid 203 and name HG11 ) 3.80 2.00 2.00 !peak 256 assign (resid 199 and name HG* ) (resid 203 and name HD1* ) 3.06 1.26 1.26 !peak 273 assign (resid 199 and name HG* ) (resid 204 and name HN ) 2.53 0.73 0.73 !peak 290 assign (resid 199 and name HG* ) (resid 204 and name HA ) 3.06 1.26 1.26 !peak 1935 assign (resid 199 and name HG* ) (resid 204 and name HB* ) 2.39 0.59 0.59 !peak 139 assign (resid 199 and name HG* ) (resid 210 and name HG* ) 2.48 0.68 0.68 !peak 1942 assign (resid 199 and name HG* ) (resid 223 and name HG1* ) 2.27 0.47 0.47 !peak 502 assign (resid 199 and name HG* ) (resid 223 and name HG2* ) 2.24 0.44 0.44 !peak 264 assign (resid 199 and name HG* ) (resid 227 and name HB ) 4.05 2.25 2.25 !peak 405 assign (resid 199 and name HG* ) (resid 227 and name HG2* ) 3.06 1.26 1.26 !peak 18 assign (resid 199 and name HG* ) (resid 229 and name HB* ) 3.82 2.02 2.02 !peak 151 assign (resid 199 and name HG* ) (resid 253 and name HA ) 3.27 1.47 1.47 !peak 407 assign (resid 199 and name HG* ) (resid 253 and name HG1* ) 2.43 0.63 0.63 !peak 232 assign (resid 199 and name HG* ) (resid 254 and name HN ) 2.73 0.93 0.93 !peak 57 assign (resid 199 and name HG* ) (resid 254 and name HB2 ) 3.35 1.55 1.55 !peak 400 assign (resid 199 and name HG* ) (resid 255 and name HA ) 3.30 1.50 1.50 !peak 2482 assign (resid 199 and name HG* ) (resid 255 and name HD1* ) 2.56 0.76 0.76 !peak 99 assign (resid 200 and name HB1 ) (resid 210 and name HG* ) 3.78 1.98 1.98 !peak 2892 assign (resid 200 and name HG2 ) (resid 210 and name HG* ) 3.51 1.71 1.71 !peak 527 assign (resid 200 and name HG1 ) (resid 210 and name HG* ) 3.56 1.76 1.76 !peak 527 assign (resid 200 and name HD2 ) (resid 210 and name HG* ) 3.03 1.23 1.23 !peak 839 assign (resid 200 and name HD1 ) (resid 210 and name HG* ) 2.97 1.17 1.17 !peak 837 assign (resid 201 and name HB* ) (resid 202 and name HG* ) 3.09 1.29 1.29 !peak 1814 assign (resid 202 and name HG* ) (resid 203 and name HN ) 3.26 1.46 1.47 !peak 2745 assign (resid 203 and name HG2* ) (resid 210 and name HG* ) 2.49 0.69 0.70 !peak 495 assign (resid 203 and name HG12 ) (resid 210 and name HG* ) 3.21 1.41 1.41 !peak 2894 assign (resid 203 and name HG11 ) (resid 210 and name HG* ) 3.73 1.93 1.93 !peak 328 assign (resid 203 and name HD1* ) (resid 210 and name HG* ) 2.42 0.62 0.62 !peak 111 assign (resid 204 and name HB* ) (resid 210 and name HG* ) 3.63 1.83 1.83 !peak 2896 assign (resid 208 and name HN ) (resid 210 and name HG* ) 3.47 1.67 1.67 !peak 1282 assign (resid 209 and name HN ) (resid 209 and name HE* ) 3.69 1.89 1.89 !peak 1016 assign (resid 209 and name HN ) (resid 210 and name HG* ) 2.99 1.19 1.19 !peak 279 assign (resid 209 and name HA ) (resid 209 and name HE* ) 3.27 1.47 1.47 !peak 3230 assign (resid 209 and name HA ) (resid 210 and name HG* ) 3.14 1.34 1.34 !peak 2866 assign (resid 209 and name HB1 ) (resid 210 and name HG* ) 3.82 2.02 2.02 !peak 2873 assign (resid 209 and name HG2 ) (resid 209 and name HE* ) 2.79 0.99 0.99 !peak 1106 assign (resid 209 and name HG2 ) (resid 210 and name HG* ) 4.12 2.32 2.32 !peak 2895 assign (resid 209 and name HG1 ) (resid 209 and name HE* ) 2.52 0.72 0.72 !peak 1107 assign (resid 209 and name HD2 ) (resid 209 and name HE* ) 2.31 0.51 0.51 !peak 1105 assign (resid 209 and name HE* ) (resid 222 and name HA ) 3.11 1.31 1.31 !peak 3231 assign (resid 209 and name HE* ) (resid 222 and name HB* ) 3.28 1.48 1.48 !peak 1856 assign (resid 210 and name HN ) (resid 210 and name HG* ) 2.38 0.58 0.58 !peak 429 assign (resid 210 and name HG* ) (resid 211 and name HN ) 2.75 0.95 0.95 !peak 2885 assign (resid 210 and name HG* ) (resid 211 and name HB1 ) 3.82 2.02 2.02 !peak 2872 assign (resid 210 and name HG* ) (resid 212 and name HB* ) 3.12 1.32 1.32 !peak 2876 assign (resid 210 and name HG* ) (resid 221 and name HN ) 3.34 1.54 1.54 !peak 2862 assign (resid 210 and name HG* ) (resid 221 and name HB ) 3.27 1.47 1.47 !peak 1194 assign (resid 210 and name HG* ) (resid 221 and name HG1* ) 2.46 0.66 0.66 !peak 235 assign (resid 210 and name HG* ) (resid 223 and name HA ) 3.90 2.10 2.10 !peak 2593 assign (resid 210 and name HG* ) (resid 223 and name HG2* ) 2.58 0.78 0.78 !peak 2897 assign (resid 210 and name HG* ) (resid 233 and name HD1* ) 3.42 1.62 1.62 !peak 514 assign (resid 210 and name HG* ) (resid 255 and name HD1* ) 3.85 2.05 2.05 !peak 498 assign (resid 211 and name HB2 ) (resid 211 and name HD* ) 2.85 1.05 1.05 !peak 1370 assign (resid 211 and name HB1 ) (resid 211 and name HD* ) 2.50 0.70 0.70 !peak 1095 assign (resid 211 and name HG* ) (resid 211 and name HD* ) 2.18 0.38 0.38 !peak 1096 assign (resid 211 and name HG* ) (resid 212 and name HN ) 2.63 0.83 0.83 !peak 692 assign (resid 211 and name HG* ) (resid 212 and name HA ) 3.39 1.59 1.59 !peak 2302 assign (resid 211 and name HG* ) (resid 212 and name HB* ) 3.66 1.86 1.86 !peak 1996 assign (resid 211 and name HG* ) (resid 218 and name HA ) 3.41 1.61 1.61 !peak 542 assign (resid 211 and name HG* ) (resid 218 and name HB* ) 3.02 1.22 1.22 !peak 3285 assign (resid 211 and name HG* ) (resid 218 and name HG2 ) 3.53 1.73 1.73 !peak 1540 assign (resid 211 and name HG* ) (resid 219 and name HN ) 3.01 1.21 1.21 !peak 396 assign (resid 211 and name HG* ) (resid 220 and name HG1 ) 3.66 1.86 1.86 !peak 2635 assign (resid 211 and name HD* ) (resid 212 and name HN ) 3.07 1.27 1.27 !peak 1088 assign (resid 211 and name HD* ) (resid 218 and name HA ) 3.38 1.58 1.58 !peak 538 assign (resid 211 and name HD* ) (resid 218 and name HB* ) 2.97 1.17 1.17 !peak 1328 assign (resid 211 and name HD* ) (resid 218 and name HG1 ) 3.23 1.43 1.43 !peak 1094 assign (resid 211 and name HD* ) (resid 219 and name HN ) 3.23 1.43 1.43 !peak 1188 assign (resid 212 and name HA ) (resid 213 and name HB* ) 3.43 1.63 1.63 !peak 836 assign (resid 212 and name HA ) (resid 219 and name HG* ) 3.34 1.54 1.54 !peak 2827 assign (resid 212 and name HA ) (resid 251 and name HD* ) 2.89 1.09 1.09 !peak 1712 assign (resid 212 and name HB* ) (resid 219 and name HG* ) 2.21 0.41 0.41 !peak 350 assign (resid 212 and name HB* ) (resid 251 and name HD* ) 2.32 0.52 0.52 !peak 32 assign (resid 213 and name HB* ) (resid 213 and name HE* ) 3.17 1.37 1.37 !peak 46 assign (resid 213 and name HG* ) (resid 213 and name HE* ) 2.54 0.74 0.74 !peak 45 assign (resid 214 and name HB ) (resid 217 and name HA* ) 3.09 1.29 1.29 !peak 2965 assign (resid 214 and name HB ) (resid 219 and name HG* ) 3.15 1.35 1.35 !peak 2826 assign (resid 215 and name HD1* ) (resid 216 and name HG* ) 3.63 1.83 1.83 !peak 2623 assign (resid 215 and name HD1* ) (resid 241 and name HD* ) 3.08 1.28 1.28 !peak 3349 assign (resid 215 and name HD2* ) (resid 241 and name HD* ) 3.11 1.31 1.31 !peak 1950 assign (resid 216 and name HN ) (resid 216 and name HB* ) 2.38 0.58 0.58 !peak 695 assign (resid 216 and name HN ) (resid 216 and name HG* ) 3.03 1.23 1.23 !peak 1141 assign (resid 216 and name HN ) (resid 217 and name HA* ) 3.39 1.59 1.59 !peak 31 assign (resid 216 and name HA ) (resid 216 and name HG* ) 2.63 0.83 0.83 !peak 1136 assign (resid 216 and name HB* ) (resid 217 and name HN ) 3.14 1.34 1.34 !peak 609 assign (resid 217 and name HN ) (resid 218 and name HD* ) 3.50 1.70 1.70 !peak 1304 assign (resid 218 and name HA ) (resid 219 and name HG* ) 3.23 1.43 1.43 !peak 2824 assign (resid 218 and name HB* ) (resid 219 and name HN ) 2.49 0.69 0.70 !peak 394 assign (resid 218 and name HB* ) (resid 219 and name HG* ) 3.08 1.28 1.28 !peak 2835 assign (resid 218 and name HG2 ) (resid 219 and name HG* ) 3.85 2.05 2.05 !peak 2832 assign (resid 219 and name HA ) (resid 219 and name HG* ) 2.61 0.81 0.80 !peak 2828 assign (resid 219 and name HG* ) (resid 220 and name HN ) 2.96 1.16 1.16 !peak 1887 assign (resid 219 and name HG* ) (resid 220 and name HB2 ) 3.24 1.44 1.44 !peak 2688 assign (resid 219 and name HG* ) (resid 220 and name HB1 ) 3.46 1.66 1.66 !peak 195 assign (resid 219 and name HG* ) (resid 235 and name HB1 ) 3.51 1.71 1.71 !peak 2836 assign (resid 219 and name HG* ) (resid 235 and name HG ) 3.11 1.31 1.31 !peak 469 assign (resid 219 and name HG* ) (resid 235 and name HD1* ) 2.30 0.50 0.50 !peak 557 assign (resid 219 and name HG* ) (resid 235 and name HD2* ) 2.58 0.78 0.78 !peak 543 assign (resid 219 and name HG* ) (resid 238 and name HE* ) 2.97 1.17 1.17 !peak 2830 assign (resid 219 and name HG* ) (resid 249 and name HD2* ) 2.61 0.81 0.80 !peak 78 assign (resid 219 and name HG* ) (resid 251 and name HD* ) 2.89 1.09 1.09 !peak 581 assign (resid 221 and name HB ) (resid 251 and name HD* ) 3.51 1.71 1.71 !peak 1627 assign (resid 224 and name HB* ) (resid 225 and name HD2 ) 2.85 1.05 1.05 !peak 880 assign (resid 224 and name HB* ) (resid 225 and name HD1 ) 2.89 1.09 1.09 !peak 903 assign (resid 227 and name HA ) (resid 231 and name HD* ) 3.79 1.99 1.99 !peak 444 assign (resid 227 and name HG2* ) (resid 231 and name HD* ) 2.64 0.84 0.84 !peak 1052 assign (resid 228 and name HN ) (resid 231 and name HD* ) 3.54 1.74 1.74 !peak 1050 assign (resid 230 and name HN ) (resid 252 and name HG* ) 2.81 1.01 1.01 !peak 479 assign (resid 230 and name HA2 ) (resid 252 and name HG* ) 2.98 1.18 1.18 !peak 1004 assign (resid 230 and name HA1 ) (resid 252 and name HG* ) 3.47 1.67 1.67 !peak 998 assign (resid 231 and name HN ) (resid 231 and name HD* ) 3.34 1.54 1.54 !peak 336 assign (resid 231 and name HA ) (resid 231 and name HD* ) 3.28 1.48 1.48 !peak 719 assign (resid 231 and name HD* ) (resid 232 and name HN ) 3.49 1.69 1.69 !peak 234 assign (resid 231 and name HD* ) (resid 253 and name HG1* ) 3.07 1.27 1.27 !peak 1053 assign (resid 232 and name HA ) (resid 232 and name HE* ) 3.19 1.39 1.39 !peak 3215 assign (resid 232 and name HA ) (resid 252 and name HB* ) 3.61 1.81 1.81 !peak 2351 assign (resid 232 and name HB1 ) (resid 252 and name HG* ) 3.92 2.12 2.12 !peak 2642 assign (resid 232 and name HG1 ) (resid 232 and name HE* ) 2.60 0.80 0.80 !peak 1104 assign (resid 232 and name HE* ) (resid 250 and name HD2 ) 3.88 2.08 2.08 !peak 3214 assign (resid 232 and name HE* ) (resid 251 and name HN ) 3.46 1.66 1.66 !peak 3212 assign (resid 232 and name HE* ) (resid 252 and name HN ) 3.08 1.28 1.28 !peak 1031 assign (resid 232 and name HE* ) (resid 252 and name HA ) 2.89 1.09 1.09 !peak 3216 assign (resid 234 and name HN ) (resid 234 and name HB* ) 2.57 0.77 0.77 !peak 222 assign (resid 234 and name HN ) (resid 234 and name HG* ) 2.57 0.77 0.77 !peak 225 assign (resid 234 and name HN ) (resid 234 and name HD* ) 3.44 1.64 1.64 !peak 669 assign (resid 234 and name HA ) (resid 234 and name HD* ) 3.45 1.65 1.65 !peak 3194 assign (resid 234 and name HB* ) (resid 234 and name HD* ) 2.57 0.77 0.77 !peak 1079 assign (resid 234 and name HB* ) (resid 235 and name HN ) 2.92 1.12 1.12 !peak 712 assign (resid 234 and name HB* ) (resid 250 and name HE2 ) 2.62 0.82 0.82 !peak 105 assign (resid 234 and name HB* ) (resid 250 and name HD2 ) 3.23 1.43 1.43 !peak 72 assign (resid 234 and name HG* ) (resid 235 and name HD2* ) 3.41 1.61 1.61 !peak 646 assign (resid 234 and name HG* ) (resid 250 and name HE2 ) 3.23 1.43 1.43 !peak 102 assign (resid 234 and name HD* ) (resid 250 and name HE2 ) 2.93 1.13 1.14 !peak 1084 assign (resid 234 and name HD* ) (resid 250 and name HD2 ) 3.60 1.80 1.80 !peak 3192 assign (resid 235 and name HG ) (resid 251 and name HD* ) 2.86 1.06 1.06 !peak 1706 assign (resid 235 and name HD1* ) (resid 238 and name HE* ) 3.25 1.45 1.45 !peak 1716 assign (resid 235 and name HD1* ) (resid 251 and name HD* ) 2.30 0.50 0.50 !peak 572 assign (resid 235 and name HD2* ) (resid 238 and name HE* ) 3.50 1.70 1.70 !peak 1694 assign (resid 236 and name HN ) (resid 236 and name HD* ) 3.48 1.68 1.68 !peak 2785 assign (resid 236 and name HN ) (resid 236 and name HE* ) 3.98 2.18 2.18 !peak 780 assign (resid 236 and name HN ) (resid 238 and name HE* ) 4.19 2.39 2.39 !peak 780 assign (resid 236 and name HA ) (resid 236 and name HD* ) 2.60 0.80 0.80 !peak 207 assign (resid 236 and name HB2 ) (resid 236 and name HE* ) 3.33 1.53 1.53 !peak 1338 assign (resid 236 and name HB1 ) (resid 236 and name HE* ) 3.24 1.44 1.44 !peak 1339 assign (resid 236 and name HG2 ) (resid 236 and name HD* ) 2.31 0.51 0.51 !peak 2794 assign (resid 236 and name HG2 ) (resid 236 and name HE* ) 2.92 1.12 1.12 !peak 1656 assign (resid 236 and name HD* ) (resid 237 and name HN ) 2.59 0.79 0.79 !peak 680 assign (resid 236 and name HD* ) (resid 248 and name HA ) 3.09 1.29 1.29 !peak 2386 assign (resid 236 and name HE* ) (resid 237 and name HN ) 3.41 1.61 1.61 !peak 792 assign (resid 237 and name HA2 ) (resid 246 and name HB* ) 3.35 1.55 1.55 !peak 993 assign (resid 237 and name HA2 ) (resid 246 and name HD* ) 3.99 2.19 2.19 !peak 3204 assign (resid 238 and name HN ) (resid 238 and name HE* ) 3.55 1.75 1.75 !peak 459 assign (resid 238 and name HG2 ) (resid 238 and name HE* ) 2.81 1.01 1.01 !peak 1657 assign (resid 240 and name HB2 ) (resid 241 and name HD* ) 3.07 1.27 1.27 !peak 892 assign (resid 240 and name HB1 ) (resid 241 and name HG* ) 3.31 1.51 1.51 !peak 1570 assign (resid 241 and name HA ) (resid 246 and name HB* ) 2.87 1.07 1.07 !peak 501 assign (resid 241 and name HA ) (resid 246 and name HD* ) 3.26 1.46 1.47 !peak 503 assign (resid 242 and name HN ) (resid 245 and name HA* ) 3.24 1.44 1.44 !peak 577 assign (resid 242 and name HN ) (resid 246 and name HB* ) 3.26 1.46 1.46 !peak 585 assign (resid 244 and name HA ) (resid 245 and name HA* ) 3.45 1.65 1.65 !peak 2284 assign (resid 244 and name HB* ) (resid 245 and name HA* ) 3.13 1.33 1.33 !peak 138 assign (resid 245 and name HN ) (resid 245 and name HA* ) 2.26 0.46 0.46 !peak 591 assign (resid 245 and name HA* ) (resid 246 and name HN ) 2.33 0.53 0.53 !peak 1136 assign (resid 246 and name HN ) (resid 246 and name HD* ) 3.40 1.60 1.60 !peak 3199 assign (resid 246 and name HA ) (resid 246 and name HD* ) 3.15 1.35 1.35 !peak 3202 assign (resid 246 and name HA ) (resid 247 and name HA* ) 3.35 1.55 1.55 !peak 2567 assign (resid 246 and name HB* ) (resid 246 and name HD* ) 2.33 0.53 0.53 !peak 1073 assign (resid 246 and name HB* ) (resid 247 and name HN ) 2.89 1.09 1.09 !peak 644 assign (resid 246 and name HB* ) (resid 247 and name HA* ) 3.47 1.67 1.67 !peak 3382 assign (resid 246 and name HD* ) (resid 247 and name HN ) 3.44 1.64 1.64 !peak 731 assign (resid 249 and name HD1* ) (resid 251 and name HD* ) 2.79 0.99 0.99 !peak 309 assign (resid 249 and name HD2* ) (resid 251 and name HD* ) 2.69 0.89 0.89 !peak 1968 assign (resid 250 and name HA ) (resid 251 and name HD* ) 3.29 1.49 1.49 !peak 2475 assign (resid 251 and name HN ) (resid 251 and name HD* ) 2.93 1.13 1.14 !peak 204 assign (resid 251 and name HA ) (resid 251 and name HD* ) 2.85 1.05 1.05 !peak 1711 assign (resid 251 and name HA ) (resid 252 and name HB* ) 3.68 1.88 1.88 !peak 817 assign (resid 251 and name HB1 ) (resid 251 and name HD* ) 2.57 0.77 0.77 !peak 1710 assign (resid 252 and name HN ) (resid 252 and name HG* ) 3.31 1.51 1.51 !peak 2621 assign (resid 197 and name HD1* ) (resid 251 and name HD2* ) 3.15 1.35 1.36 !peak 93 #SUP 0.91 #QF 0.20 assign (resid 204 and name HB* ) (resid 253 and name HG1* ) 3.17 1.37 1.37 !peak 238 #SUP 0.93 #QF 0.93 assign (resid 197 and name HD2* ) (resid 251 and name HD2* ) 3.15 1.35 1.36 !peak 280 #SUP 0.85 #QF 0.85 assign (resid 201 and name HB* ) (resid 256 and name HG2* ) 3.83 2.03 2.03 !peak 417 #SUP 0.85 #QF 0.85 assign (resid 227 and name HG2* ) (resid 231 and name HG2 ) 2.99 1.19 1.19 !peak 453 #SUP 0.98 #QF 0.98 assign (resid 197 and name HD1* ) (resid 251 and name HD1* ) 3.15 1.35 1.36 !peak 631 #SUP 0.60 #QF 0.60 assign (resid 227 and name HG2* ) (resid 231 and name HB1 ) 3.53 1.73 1.73 !peak 21 #SUP 1.00 #QF 0.36 assign (resid 227 and name HG2* ) (resid 231 and name HN ) 3.84 2.04 2.04 !peak 24 #SUP 0.99 #QF 0.51 assign (resid 229 and name HA ) (resid 231 and name HB2 ) 3.51 1.71 1.71 !peak 55 #SUP 0.93 #QF 0.93 assign (resid 249 and name HN ) (resid 249 and name HD2* ) 3.49 1.69 1.69 !peak 83 #SUP 0.74 #QF 0.74 assign (resid 173 and name HB* ) (resid 174 and name HA1 ) 3.25 1.45 1.45 !peak 161 #SUP 0.97 #QF 0.97 assign (resid 174 and name HA1 ) (resid 175 and name HA ) 3.85 2.05 2.05 !peak 163 #SUP 0.88 #QF 0.61 assign (resid 173 and name HA ) (resid 174 and name HA1 ) 3.49 1.69 1.69 !peak 164 #SUP 0.49 #QF 0.49 assign (resid 227 and name HA ) (resid 231 and name HD1 ) 3.42 1.62 1.62 !peak 444 #SUP 0.98 #QF 0.98 assign (resid 211 and name HG1 ) (resid 218 and name HA ) 3.61 1.81 1.81 !peak 542 #SUP 0.78 #QF 0.78 assign (resid 209 and name HB1 ) (resid 210 and name HA ) 3.51 1.71 1.71 !peak 571 #SUP 0.70 #QF 0.70 assign (resid 255 and name HA ) (resid 256 and name HB ) 3.63 1.83 1.83 !peak 590 #SUP 0.98 #QF 0.98 assign (resid 232 and name HG2 ) (resid 250 and name HA ) 3.45 1.65 1.65 !peak 749 #SUP 0.67 #QF 0.67 assign (resid 173 and name HA ) (resid 235 and name HD1* ) 3.61 1.81 1.81 !peak 805 #SUP 1.00 #QF 0.83 assign (resid 251 and name HA ) (resid 252 and name HB1 ) 3.30 1.50 1.50 !peak 817 #SUP 0.61 #QF 0.61 assign (resid 208 and name HN ) (resid 222 and name HA ) 3.95 2.15 2.15 !peak 825 #SUP 0.93 #QF 0.93 assign (resid 237 and name HA1 ) (resid 246 and name HB2 ) 3.76 1.96 1.96 !peak 992 #SUP 0.79 #QF 0.70 assign (resid 231 and name HD1 ) (resid 253 and name HG1* ) 3.39 1.59 1.59 !peak 1044 #SUP 0.92 #QF 0.92 assign (resid 229 and name HA ) (resid 231 and name HD1 ) 3.96 2.16 2.16 !peak 1048 #SUP 0.96 #QF 0.94 assign (resid 228 and name HN ) (resid 231 and name HD1 ) 3.30 1.50 1.50 !peak 1050 #SUP 0.87 #QF 0.87 assign (resid 205 and name HG2* ) (resid 226 and name HD1 ) 3.63 1.83 1.83 !peak 1064 #SUP 0.79 #QF 0.79 assign (resid 220 and name HN ) (resid 220 and name HG1 ) 3.60 1.80 1.80 !peak 1125 #SUP 0.95 #QF 0.80 assign (resid 209 and name HB2 ) (resid 220 and name HB1 ) 4.02 2.22 2.22 !peak 1181 #SUP 0.78 #QF 0.41 assign (resid 228 and name HB2 ) (resid 228 and name HG2 ) 2.45 0.65 0.65 !peak 1221 #SUP 0.93 #QF 0.93 assign (resid 227 and name HA ) (resid 228 and name HG2 ) 4.13 2.33 2.33 !peak 1224 #SUP 0.95 #QF 0.95 assign (resid 228 and name HN ) (resid 228 and name HG2 ) 2.96 1.16 1.16 !peak 1227 #SUP 0.95 #QF 0.95 assign (resid 227 and name HG2* ) (resid 228 and name HG2 ) 4.10 2.30 2.30 !peak 1230 #SUP 0.82 #QF 0.82 assign (resid 235 and name HG ) (resid 238 and name HB2 ) 3.77 1.97 1.97 !peak 1331 #SUP 0.27 #QF 0.27 assign (resid 211 and name HB2 ) (resid 220 and name HG2 ) 3.42 1.62 1.62 !peak 1371 #SUP 0.96 #QF 0.96 assign (resid 228 and name HA ) (resid 228 and name HG2 ) 2.91 1.11 1.11 !peak 1415 #SUP 0.94 #QF 0.94 assign (resid 211 and name HG2 ) (resid 218 and name HB1 ) 3.28 1.48 1.48 !peak 1540 #SUP 0.85 #QF 0.58 assign (resid 254 and name HG1 ) (resid 255 and name HA ) 4.47 2.67 2.67 !peak 1607 #SUP 0.54 #QF 0.54 assign (resid 209 and name HN ) (resid 209 and name HG2 ) 3.72 1.92 1.92 !peak 1661 #SUP 0.99 #QF 0.97 assign (resid 219 and name HB ) (resid 235 and name HD2* ) 3.56 1.76 1.76 !peak 1687 #SUP 0.62 #QF 0.48 assign (resid 197 and name HA ) (resid 251 and name HD1* ) 3.70 1.90 1.90 !peak 1712 #SUP 0.95 #QF 0.89 assign (resid 203 and name HG2* ) (resid 210 and name HA ) 3.80 2.00 2.00 !peak 1804 #SUP 1.00 #QF 0.85 assign (resid 229 and name HB* ) (resid 253 and name HB ) 3.60 1.80 1.80 !peak 1834 #SUP 0.99 #QF 0.99 assign (resid 213 and name HE* ) (resid 215 and name HB1 ) 3.99 2.19 2.19 !peak 1884 #SUP 0.49 #QF 0.49 assign (resid 253 and name HG1* ) (resid 254 and name HB1 ) 3.51 1.71 1.71 !peak 1912 #SUP 0.99 #QF 0.99 assign (resid 197 and name HD2* ) (resid 251 and name HD1* ) 3.15 1.35 1.36 !peak 1968 #SUP 0.98 #QF 0.98 assign (resid 196 and name HA ) (resid 251 and name HD2* ) 3.64 1.84 1.84 !peak 1971 #SUP 0.97 #QF 0.36 assign (resid 172 and name HG2* ) (resid 220 and name HA ) 4.00 2.20 2.20 !peak 2015 #SUP 0.36 #QF 0.36 assign (resid 172 and name HG2* ) (resid 220 and name HB1 ) 3.83 2.03 2.03 !peak 2019 #SUP 0.77 #QF 0.66 assign (resid 199 and name HB ) (resid 256 and name HG2* ) 3.77 1.97 1.97 !peak 2043 #SUP 0.61 #QF 0.61 assign (resid 255 and name HB ) (resid 256 and name HG2* ) 4.27 2.47 2.47 !peak 2044 #SUP 0.59 #QF 0.44 assign (resid 196 and name HA ) (resid 251 and name HD1* ) 3.64 1.84 1.84 !peak 2076 #SUP 0.50 #QF 0.25 assign (resid 202 and name HD1 ) (resid 255 and name HG2* ) 3.94 2.14 2.14 !peak 2106 #SUP 0.94 #QF 0.94 assign (resid 197 and name HA ) (resid 251 and name HD2* ) 3.70 1.90 1.90 !peak 2275 #SUP 0.45 #QF 0.45 assign (resid 195 and name HB* ) (resid 212 and name HA ) 3.69 1.89 1.89 !peak 2302 #SUP 0.25 #QF 0.25 assign (resid 242 and name HA1 ) (resid 246 and name HG1 ) 3.86 2.06 2.06 !peak 2321 #SUP 0.23 #QF 0.23 assign (resid 232 and name HA ) (resid 252 and name HB1 ) 3.92 2.12 2.12 !peak 2351 #SUP 0.21 #QF 0.21 assign (resid 219 and name HA ) (resid 220 and name HG1 ) 3.99 2.19 2.19 !peak 2616 #SUP 0.69 #QF 0.69 assign (resid 211 and name HG2 ) (resid 220 and name HG1 ) 3.49 1.69 1.69 !peak 2619 #SUP 0.76 #QF 0.76 assign (resid 209 and name HB2 ) (resid 220 and name HG2 ) 3.70 1.90 1.90 !peak 2654 #SUP 0.38 #QF 0.38 assign (resid 211 and name HG1 ) (resid 218 and name HB2 ) 3.34 1.54 1.54 !peak 2668 #SUP 0.98 #QF 0.98 assign (resid 231 and name HG2 ) (resid 232 and name HN ) 3.21 1.41 1.41 !peak 2759 #SUP 0.92 #QF 0.92 assign (resid 231 and name HA ) (resid 231 and name HG2 ) 3.11 1.31 1.31 !peak 2762 #SUP 0.96 #QF 0.96 assign (resid 231 and name HG2 ) (resid 253 and name HG2* ) 3.47 1.67 1.67 !peak 2769 #SUP 1.00 #QF 0.97 assign (resid 231 and name HG2 ) (resid 253 and name HG1* ) 3.55 1.75 1.75 !peak 2771 #SUP 0.78 #QF 0.78 assign (resid 211 and name HG1 ) (resid 212 and name HN ) 3.27 1.47 1.47 !peak 2803 #SUP 0.92 #QF 0.92 assign (resid 211 and name HG1 ) (resid 220 and name HG1 ) 3.71 1.91 1.91 !peak 2806 #SUP 0.33 #QF 0.33 assign (resid 198 and name HA ) (resid 256 and name HB ) 3.85 2.05 2.05 !peak 2907 #SUP 0.91 #QF 0.91 assign (resid 214 and name HB ) (resid 215 and name HB1 ) 3.86 2.06 2.06 !peak 2989 #SUP 0.62 #QF 0.62 assign (resid 172 and name HB ) (resid 220 and name HB1 ) 3.11 1.31 1.31 !peak 3129 #SUP 0.28 #QF 0.28 assign (resid 225 and name HB2 ) (resid 226 and name HD1 ) 3.21 1.41 1.41 !peak 3210 #SUP 0.84 #QF 0.84 assign (resid 215 and name HB1 ) (resid 240 and name HD1 ) 3.40 1.60 1.60 !peak 9 #SUP 0.77 #QF 0.77 assign (resid 176 and name HE3 ) (resid 231 and name HG2 ) 2.97 1.17 1.17 !peak 13 #SUP 0.81 #QF 0.81 assign (resid 173 and name HB* ) (resid 176 and name HD1 ) 3.91 2.11 2.11 !peak 24 #SUP 0.44 #QF 0.44 assign (resid 194 and name HE1 ) (resid 252 and name HB1 ) 3.08 1.28 1.28 !peak 38 #SUP 0.29 #QF 0.29 assign (resid 194 and name HD1 ) (resid 252 and name HB1 ) 3.98 2.18 2.18 !peak 87 #SUP 0.91 #QF 0.87 assign (resid 194 and name HE1 ) (resid 250 and name HB1 ) 3.58 1.78 1.78 !peak 118 #SUP 0.85 #QF 0.85 assign (resid 234 and name HB1 ) (resid 235 and name HN ) 3.38 1.58 1.57 !peak 66 #SUP 0.93 #QF 0.93 assign (resid 235 and name HN ) (resid 235 and name HB1 ) 2.83 1.03 1.03 !peak 67 #SUP 0.94 #QF 0.94 assign (resid 235 and name HN ) (resid 236 and name HN ) 3.77 1.97 1.97 !peak 68 #SUP 0.99 #QF 0.79 assign (resid 201 and name HN ) (resid 256 and name HN ) 3.03 1.23 1.23 !peak 94 #SUP 0.99 #QF 0.99 assign (resid 197 and name HN ) (resid 252 and name HA ) 3.47 1.67 1.67 !peak 141 #SUP 0.59 #QF 0.59 assign (resid 199 and name HN ) (resid 254 and name HB1 ) 3.20 1.40 1.40 !peak 181 #SUP 0.78 #QF 0.78 assign (resid 199 and name HN ) (resid 253 and name HG1* ) 3.22 1.42 1.42 !peak 185 #SUP 0.91 #QF 0.91 assign (resid 232 and name HN ) (resid 232 and name HB2 ) 3.23 1.43 1.43 !peak 228 #SUP 0.94 #QF 0.94 assign (resid 231 and name HD2 ) (resid 232 and name HN ) 3.55 1.75 1.75 !peak 234 #SUP 1.00 assign (resid 174 and name HN ) (resid 174 and name HA2 ) 2.52 0.72 0.72 !peak 298 #SUP 0.99 #QF 0.99 assign (resid 174 and name HN ) (resid 174 and name HA1 ) 2.51 0.71 0.71 !peak 299 #SUP 1.00 assign (resid 226 and name HN ) (resid 226 and name HD1 ) 3.03 1.23 1.23 !peak 324 #SUP 0.95 #QF 0.95 assign (resid 231 and name HN ) (resid 231 and name HD1 ) 3.53 1.73 1.73 !peak 335 #SUP 0.89 #QF 0.89 assign (resid 231 and name HN ) (resid 231 and name HD2 ) 3.55 1.75 1.75 !peak 336 #SUP 0.88 #QF 0.88 assign (resid 211 and name HG2 ) (resid 219 and name HN ) 3.05 1.25 1.24 !peak 396 #SUP 0.56 #QF 0.56 assign (resid 230 and name HN ) (resid 231 and name HB2 ) 3.36 1.56 1.56 !peak 480 #SUP 0.92 #QF 0.92 assign (resid 245 and name HN ) (resid 245 and name HA2 ) 2.52 0.72 0.72 !peak 589 #SUP 0.97 #QF 0.97 assign (resid 245 and name HN ) (resid 245 and name HA1 ) 2.52 0.72 0.72 !peak 591 #SUP 0.99 #QF 0.99 assign (resid 244 and name HB* ) (resid 245 and name HN ) 3.01 1.21 1.21 !peak 595 #SUP 0.90 #QF 0.90 assign (resid 208 and name HN ) (resid 223 and name HN ) 2.92 1.12 1.12 !peak 614 #SUP 0.97 #QF 0.97 assign (resid 246 and name HB2 ) (resid 247 and name HN ) 2.92 1.12 1.12 !peak 644 #SUP 0.59 #QF 0.59 assign (resid 211 and name HG2 ) (resid 212 and name HN ) 2.68 0.88 0.88 !peak 692 #SUP 0.95 #QF 0.95 assign (resid 215 and name HB1 ) (resid 216 and name HN ) 3.02 1.22 1.22 !peak 696 #SUP 0.89 #QF 0.89 assign (resid 234 and name HB2 ) (resid 235 and name HN ) 3.38 1.58 1.57 !peak 712 #SUP 0.99 #QF 0.99 assign (resid 228 and name HG2 ) (resid 228 and name HE22 ) 2.92 1.12 1.12 !peak 738 #SUP 0.91 #QF 0.91 assign (resid 174 and name HA1 ) (resid 236 and name HN ) 3.58 1.78 1.78 !peak 777 #SUP 0.49 #QF 0.49 assign (resid 171 and name HN ) (resid 172 and name HN ) 3.76 1.96 1.96 !peak 892 #SUP 0.65 #QF 0.47 assign (resid 173 and name HN ) (resid 174 and name HA2 ) 4.08 2.28 2.28 !peak 898 #SUP 0.52 #QF 0.52 assign (resid 242 and name HN ) (resid 244 and name HN ) 3.74 1.94 1.94 !peak 1148 #SUP 0.62 #QF 0.62 assign (resid 197 and name HN ) (resid 213 and name HN ) 4.10 2.30 2.30 !peak 1319 #SUP 0.50 #QF 0.50 assign (resid 228 and name HN ) (resid 228 and name HB1 ) 3.06 1.26 1.26 !peak 1366 #SUP 0.89 #QF 0.89 assign (resid 191 and name HE21 ) (resid 247 and name HA1 ) 3.33 1.53 1.53 !peak 1401 #SUP 0.76 #QF 0.76 assign (resid 191 and name HE21 ) (resid 247 and name HA2 ) 3.33 1.53 1.53 !peak 1402 #SUP 0.77 #QF 0.44 assign (resid 228 and name HG2 ) (resid 228 and name HE21 ) 2.54 0.74 0.74 !peak 1413 #SUP 0.74 #QF 0.74 assign (resid 226 and name HA ) (resid 228 and name HE21 ) 3.42 1.62 1.62 !peak 1415 #SUP 0.89 #QF 0.35 assign (resid 228 and name HE22 ) (resid 229 and name HN ) 4.40 2.60 2.60 !peak 1420 #SUP 0.65 #QF 0.65 assign (resid 172 and name HG2* ) (resid 235 and name HD* ) 3.07 1.27 1.27 !peak 388 assign (resid 173 and name HA ) (resid 235 and name HD* ) 3.17 1.37 1.37 !peak 1693 assign (resid 173 and name HB* ) (resid 209 and name HD* ) 3.92 2.12 2.12 !peak 174 assign (resid 173 and name HB* ) (resid 221 and name HG* ) 3.06 1.26 1.26 !peak 1914 assign (resid 173 and name HB* ) (resid 235 and name HB* ) 3.35 1.55 1.55 !peak 3144 assign (resid 173 and name HB* ) (resid 235 and name HD* ) 2.47 0.67 0.67 !peak 1689 assign (resid 174 and name HN ) (resid 235 and name HD* ) 2.84 1.04 1.04 !peak 678 assign (resid 174 and name HA2 ) (resid 235 and name HD* ) 3.34 1.54 1.54 !peak 416 assign (resid 174 and name HA1 ) (resid 233 and name HD* ) 3.47 1.67 1.67 !peak 2338 assign (resid 174 and name HA1 ) (resid 235 and name HD* ) 2.98 1.18 1.18 !peak 48 assign (resid 175 and name HN ) (resid 233 and name HD* ) 3.74 1.94 1.94 !peak 359 assign (resid 176 and name HD1 ) (resid 221 and name HG* ) 3.10 1.30 1.30 !peak 58 assign (resid 176 and name HE1 ) (resid 221 and name HG* ) 2.84 1.04 1.04 !peak 37 assign (resid 176 and name HE1 ) (resid 223 and name HG* ) 3.18 1.38 1.38 !peak 36 assign (resid 176 and name HZ2 ) (resid 221 and name HG* ) 3.10 1.30 1.30 !peak 1904 assign (resid 190 and name HB* ) (resid 191 and name HG* ) 3.75 1.95 1.95 !peak 1211 assign (resid 191 and name HN ) (resid 191 and name HG* ) 2.56 0.76 0.76 !peak 376 assign (resid 191 and name HG* ) (resid 191 and name HE21 ) 2.49 0.69 0.69 !peak 1405 assign (resid 191 and name HG* ) (resid 191 and name HE22 ) 2.82 1.02 1.02 !peak 1407 assign (resid 191 and name HG* ) (resid 242 and name HA2 ) 3.69 1.89 1.89 !peak 1208 assign (resid 191 and name HG* ) (resid 242 and name HA1 ) 3.36 1.56 1.56 !peak 1210 assign (resid 191 and name HG* ) (resid 247 and name HA* ) 3.30 1.50 1.50 !peak 2721 assign (resid 191 and name HE22 ) (resid 247 and name HA* ) 3.46 1.66 1.66 !peak 1409 assign (resid 194 and name HA ) (resid 249 and name HD* ) 3.51 1.71 1.71 !peak 157 assign (resid 194 and name HB* ) (resid 194 and name HD1 ) 2.69 0.89 0.89 !peak 51 assign (resid 194 and name HD1 ) (resid 249 and name HD* ) 3.96 2.16 2.16 !peak 1964 assign (resid 194 and name HD1 ) (resid 252 and name HG* ) 4.30 2.50 2.50 !peak 87 assign (resid 194 and name HE1 ) (resid 232 and name HD* ) 3.52 1.72 1.72 !peak 119 assign (resid 195 and name HA ) (resid 249 and name HD* ) 3.87 2.07 2.07 !peak 2458 assign (resid 195 and name HA ) (resid 251 and name HD* ) 4.14 2.35 2.35 !peak 2458 assign (resid 195 and name HB* ) (resid 249 and name HD* ) 2.72 0.92 0.92 !peak 1737 assign (resid 196 and name HA ) (resid 252 and name HG* ) 2.89 1.09 1.09 !peak 549 assign (resid 196 and name HG2* ) (resid 197 and name HD* ) 3.89 2.09 2.09 !peak 362 assign (resid 196 and name HG2* ) (resid 252 and name HG* ) 3.01 1.21 1.21 !peak 2004 assign (resid 196 and name HG2* ) (resid 254 and name HD* ) 3.03 1.23 1.23 !peak 1100 assign (resid 197 and name HN ) (resid 197 and name HD* ) 2.98 1.18 1.18 !peak 148 assign (resid 197 and name HN ) (resid 252 and name HG* ) 3.13 1.33 1.33 !peak 145 assign (resid 197 and name HA ) (resid 197 and name HD* ) 2.49 0.69 0.70 !peak 1723 assign (resid 197 and name HB2 ) (resid 197 and name HD* ) 2.54 0.74 0.74 !peak 1727 assign (resid 197 and name HB1 ) (resid 251 and name HD* ) 2.90 1.10 1.10 !peak 1710 assign (resid 197 and name HG ) (resid 221 and name HG* ) 3.26 1.46 1.46 !peak 1915 assign (resid 197 and name HG ) (resid 233 and name HD* ) 3.64 1.84 1.84 !peak 639 assign (resid 197 and name HD* ) (resid 198 and name HN ) 2.68 0.88 0.88 !peak 1949 assign (resid 197 and name HD* ) (resid 198 and name HB* ) 3.68 1.88 1.88 !peak 1951 assign (resid 197 and name HD* ) (resid 199 and name HG* ) 2.61 0.81 0.81 !peak 633 assign (resid 197 and name HD* ) (resid 210 and name HN ) 3.78 1.98 1.98 !peak 3413 assign (resid 197 and name HD* ) (resid 210 and name HB ) 3.27 1.47 1.47 !peak 1726 assign (resid 197 and name HD* ) (resid 210 and name HG* ) 2.34 0.54 0.54 !peak 515 assign (resid 197 and name HD* ) (resid 211 and name HA ) 3.29 1.49 1.49 !peak 1722 assign (resid 197 and name HD* ) (resid 211 and name HD* ) 3.86 2.06 2.06 !peak 3189 assign (resid 197 and name HD* ) (resid 212 and name HN ) 3.21 1.41 1.41 !peak 1948 assign (resid 197 and name HD* ) (resid 212 and name HA ) 2.68 0.88 0.88 !peak 1723 assign (resid 197 and name HD* ) (resid 212 and name HB* ) 2.26 0.46 0.46 !peak 284 assign (resid 197 and name HD* ) (resid 213 and name HN ) 3.12 1.32 1.32 !peak 1731 assign (resid 197 and name HD* ) (resid 219 and name HG* ) 3.66 1.86 1.86 !peak 473 assign (resid 197 and name HD* ) (resid 220 and name HA ) 3.55 1.75 1.75 !peak 2584 assign (resid 197 and name HD* ) (resid 221 and name HN ) 3.23 1.43 1.43 !peak 1730 assign (resid 197 and name HD* ) (resid 221 and name HG* ) 2.43 0.63 0.63 !peak 285 assign (resid 197 and name HD* ) (resid 223 and name HG* ) 2.68 0.88 0.88 !peak 635 assign (resid 197 and name HD* ) (resid 233 and name HD* ) 3.31 1.51 1.51 !peak 630 assign (resid 197 and name HD* ) (resid 251 and name HD* ) 2.38 0.59 0.59 !peak 280 assign (resid 197 and name HD* ) (resid 253 and name HG1* ) 2.95 1.15 1.15 !peak 636 assign (resid 197 and name HD* ) (resid 253 and name HG2* ) 2.87 1.07 1.07 !peak 1677 assign (resid 199 and name HB ) (resid 223 and name HG* ) 3.28 1.48 1.48 !peak 2644 assign (resid 199 and name HG* ) (resid 200 and name HB2 ) 3.60 1.80 1.80 !peak 1238 assign (resid 199 and name HG* ) (resid 210 and name HB ) 3.63 1.83 1.83 !peak 1937 assign (resid 199 and name HG* ) (resid 223 and name HG* ) 2.69 0.89 0.89 !peak 264 assign (resid 199 and name HG* ) (resid 253 and name HG2* ) 3.26 1.46 1.46 !peak 402 assign (resid 199 and name HG* ) (resid 254 and name HB1 ) 3.63 1.83 1.83 !peak 400 assign (resid 200 and name HD2 ) (resid 223 and name HG* ) 3.94 2.14 2.14 !peak 2853 assign (resid 201 and name HB* ) (resid 205 and name HG* ) 2.72 0.92 0.92 !peak 339 assign (resid 202 and name HA ) (resid 205 and name HG* ) 2.96 1.16 1.16 !peak 464 assign (resid 203 and name HA ) (resid 206 and name HG* ) 2.60 0.80 0.80 !peak 609 assign (resid 203 and name HG2* ) (resid 206 and name HG* ) 3.04 1.24 1.24 !peak 58 assign (resid 203 and name HG2* ) (resid 223 and name HG* ) 2.43 0.63 0.63 !peak 57 assign (resid 203 and name HG12 ) (resid 206 and name HG* ) 3.15 1.35 1.35 !peak 187 assign (resid 203 and name HD1* ) (resid 209 and name HG* ) 4.33 2.53 2.53 !peak 1786 assign (resid 204 and name HA ) (resid 206 and name HG* ) 3.74 1.94 1.94 !peak 2118 assign (resid 204 and name HA ) (resid 223 and name HG* ) 2.56 0.76 0.76 !peak 755 assign (resid 204 and name HB* ) (resid 205 and name HG* ) 2.81 1.01 1.01 !peak 2820 assign (resid 204 and name HB* ) (resid 223 and name HG* ) 2.61 0.81 0.80 !peak 140 assign (resid 205 and name HN ) (resid 205 and name HG* ) 2.35 0.55 0.55 !peak 547 assign (resid 205 and name HA ) (resid 205 and name HG* ) 2.34 0.54 0.54 !peak 436 assign (resid 205 and name HG* ) (resid 206 and name HN ) 2.42 0.62 0.62 !peak 533 assign (resid 205 and name HG* ) (resid 206 and name HA ) 2.77 0.97 0.97 !peak 497 assign (resid 205 and name HG* ) (resid 206 and name HB ) 3.22 1.42 1.42 !peak 2732 assign (resid 205 and name HG* ) (resid 225 and name HA ) 3.91 2.11 2.11 !peak 2054 assign (resid 205 and name HG* ) (resid 226 and name HN ) 3.00 1.20 1.20 !peak 318 assign (resid 205 and name HG* ) (resid 226 and name HA ) 2.96 1.16 1.16 !peak 695 assign (resid 205 and name HG* ) (resid 226 and name HD2 ) 2.67 0.87 0.87 !peak 1052 assign (resid 205 and name HG* ) (resid 226 and name HD1 ) 3.25 1.45 1.45 !peak 1063 assign (resid 206 and name HN ) (resid 206 and name HG* ) 2.36 0.56 0.56 !peak 532 assign (resid 206 and name HA ) (resid 206 and name HG* ) 2.38 0.58 0.58 !peak 496 assign (resid 206 and name HG* ) (resid 207 and name HN ) 2.38 0.58 0.58 !peak 514 assign (resid 206 and name HG* ) (resid 207 and name HA2 ) 3.97 2.17 2.17 !peak 1979 assign (resid 206 and name HG* ) (resid 223 and name HG* ) 3.67 1.87 1.87 !peak 504 assign (resid 206 and name HG* ) (resid 225 and name HA ) 3.94 2.14 2.14 !peak 1980 assign (resid 207 and name HA2 ) (resid 223 and name HG* ) 3.19 1.39 1.39 !peak 1040 assign (resid 207 and name HA1 ) (resid 223 and name HG* ) 3.35 1.55 1.55 !peak 1039 assign (resid 208 and name HN ) (resid 223 and name HG* ) 3.29 1.49 1.49 !peak 2848 assign (resid 209 and name HN ) (resid 223 and name HG* ) 3.49 1.69 1.69 !peak 1923 assign (resid 209 and name HA ) (resid 209 and name HD* ) 3.11 1.31 1.31 !peak 1468 assign (resid 209 and name HA ) (resid 221 and name HG* ) 3.30 1.50 1.50 !peak 631 assign (resid 209 and name HA ) (resid 223 and name HG* ) 3.22 1.42 1.42 !peak 626 assign (resid 209 and name HB2 ) (resid 209 and name HD* ) 2.29 0.49 0.49 !peak 1463 assign (resid 209 and name HB2 ) (resid 209 and name HE* ) 2.42 0.62 0.62 !peak 1105 assign (resid 209 and name HG* ) (resid 209 and name HE* ) 2.56 0.76 0.76 !peak 1107 assign (resid 209 and name HG* ) (resid 210 and name HN ) 2.71 0.91 0.91 !peak 426 assign (resid 209 and name HG* ) (resid 210 and name HA ) 3.85 2.05 2.05 !peak 2029 assign (resid 209 and name HG* ) (resid 210 and name HG* ) 3.57 1.77 1.77 !peak 514 assign (resid 209 and name HG* ) (resid 220 and name HG2 ) 3.30 1.50 1.50 !peak 2635 assign (resid 209 and name HG* ) (resid 221 and name HN ) 3.09 1.29 1.29 !peak 190 assign (resid 209 and name HG* ) (resid 222 and name HN ) 3.58 1.78 1.78 !peak 1659 assign (resid 209 and name HG* ) (resid 222 and name HA ) 4.13 2.33 2.33 !peak 2029 assign (resid 209 and name HD* ) (resid 220 and name HB1 ) 3.02 1.22 1.22 !peak 3132 assign (resid 209 and name HD* ) (resid 220 and name HG2 ) 3.02 1.22 1.22 !peak 2634 assign (resid 209 and name HD* ) (resid 220 and name HG1 ) 3.69 1.89 1.89 !peak 2618 assign (resid 209 and name HD* ) (resid 221 and name HN ) 3.07 1.27 1.27 !peak 189 assign (resid 209 and name HD* ) (resid 222 and name HN ) 3.30 1.50 1.50 !peak 2787 assign (resid 209 and name HD* ) (resid 222 and name HB* ) 2.91 1.11 1.11 !peak 166 assign (resid 209 and name HE* ) (resid 222 and name HN ) 3.91 2.11 2.11 !peak 867 assign (resid 210 and name HN ) (resid 221 and name HG* ) 3.11 1.31 1.31 !peak 1901 assign (resid 210 and name HN ) (resid 223 and name HG* ) 3.28 1.48 1.48 !peak 1921 assign (resid 210 and name HA ) (resid 210 and name HG* ) 2.56 0.76 0.76 !peak 567 assign (resid 210 and name HB ) (resid 223 and name HG* ) 3.41 1.61 1.61 !peak 1928 assign (resid 210 and name HG* ) (resid 221 and name HG* ) 2.46 0.66 0.66 !peak 235 assign (resid 210 and name HG* ) (resid 223 and name HG* ) 3.29 1.49 1.49 !peak 1929 assign (resid 210 and name HG* ) (resid 233 and name HD* ) 3.90 2.10 2.10 !peak 514 assign (resid 211 and name HA ) (resid 211 and name HD* ) 3.10 1.30 1.30 !peak 1089 assign (resid 211 and name HG2 ) (resid 211 and name HD* ) 2.31 0.51 0.51 !peak 1097 assign (resid 211 and name HD* ) (resid 213 and name HN ) 3.08 1.28 1.28 !peak 1086 assign (resid 211 and name HD* ) (resid 218 and name HB2 ) 3.25 1.45 1.45 !peak 1327 assign (resid 211 and name HD* ) (resid 218 and name HB1 ) 3.03 1.23 1.23 !peak 1093 assign (resid 212 and name HB* ) (resid 233 and name HD* ) 3.35 1.55 1.55 !peak 642 assign (resid 212 and name HB* ) (resid 235 and name HD* ) 2.93 1.13 1.14 !peak 541 assign (resid 212 and name HB* ) (resid 249 and name HD* ) 3.15 1.35 1.35 !peak 603 assign (resid 212 and name HB* ) (resid 251 and name HB* ) 3.57 1.77 1.77 !peak 1995 assign (resid 213 and name HE* ) (resid 215 and name HD* ) 3.86 2.06 2.06 !peak 48 assign (resid 214 and name HB ) (resid 215 and name HD* ) 2.87 1.07 1.07 !peak 3003 assign (resid 214 and name HB ) (resid 218 and name HD* ) 3.79 1.99 1.99 !peak 2968 assign (resid 214 and name HB ) (resid 249 and name HD* ) 3.53 1.73 1.73 !peak 1682 assign (resid 215 and name HA ) (resid 215 and name HD* ) 2.84 1.04 1.04 !peak 1732 assign (resid 215 and name HB1 ) (resid 215 and name HD* ) 2.63 0.83 0.83 !peak 1733 assign (resid 215 and name HD* ) (resid 216 and name HN ) 2.50 0.70 0.70 !peak 35 assign (resid 215 and name HD* ) (resid 216 and name HA ) 3.33 1.53 1.53 !peak 1724 assign (resid 215 and name HD* ) (resid 216 and name HB* ) 2.73 0.93 0.93 !peak 1734 assign (resid 215 and name HD* ) (resid 216 and name HG* ) 3.29 1.49 1.49 !peak 2623 assign (resid 215 and name HD* ) (resid 217 and name HN ) 3.18 1.38 1.38 !peak 607 assign (resid 215 and name HD* ) (resid 238 and name HA ) 3.17 1.37 1.37 !peak 2223 assign (resid 215 and name HD* ) (resid 239 and name HN ) 3.74 1.94 1.94 !peak 1243 assign (resid 215 and name HD* ) (resid 240 and name HD1 ) 2.78 0.98 0.98 !peak 65 assign (resid 215 and name HD* ) (resid 240 and name HE1 ) 3.01 1.21 1.21 !peak 61 assign (resid 215 and name HD* ) (resid 241 and name HG* ) 2.82 1.02 1.03 !peak 52 assign (resid 215 and name HD* ) (resid 241 and name HD* ) 2.93 1.13 1.14 !peak 3349 assign (resid 218 and name HB2 ) (resid 219 and name HG* ) 3.54 1.74 1.74 !peak 2835 assign (resid 218 and name HB1 ) (resid 219 and name HG* ) 3.77 1.97 1.97 !peak 2833 assign (resid 219 and name HB ) (resid 235 and name HD* ) 3.22 1.42 1.42 !peak 1687 assign (resid 219 and name HG* ) (resid 235 and name HB* ) 3.56 1.76 1.76 !peak 2836 assign (resid 219 and name HG* ) (resid 235 and name HD* ) 2.21 0.41 0.41 !peak 542 assign (resid 219 and name HG* ) (resid 249 and name HD* ) 2.60 0.80 0.80 !peak 78 assign (resid 220 and name HG2 ) (resid 221 and name HG* ) 3.79 1.99 1.99 !peak 2637 assign (resid 221 and name HN ) (resid 221 and name HG* ) 2.39 0.59 0.59 !peak 191 assign (resid 221 and name HB ) (resid 235 and name HD* ) 3.64 1.84 1.84 !peak 1687 assign (resid 221 and name HG* ) (resid 222 and name HN ) 2.90 1.10 1.10 !peak 1902 assign (resid 221 and name HG* ) (resid 222 and name HA ) 3.23 1.43 1.43 !peak 3341 assign (resid 221 and name HG* ) (resid 222 and name HB* ) 3.32 1.52 1.52 !peak 1863 assign (resid 221 and name HG* ) (resid 223 and name HA ) 3.11 1.31 1.31 !peak 35 assign (resid 221 and name HG* ) (resid 233 and name HD* ) 2.56 0.76 0.76 !peak 228 assign (resid 221 and name HG* ) (resid 251 and name HD* ) 3.25 1.45 1.45 !peak 581 assign (resid 222 and name HA ) (resid 223 and name HG* ) 3.12 1.32 1.32 !peak 821 assign (resid 222 and name HB* ) (resid 223 and name HG* ) 3.48 1.68 1.68 !peak 266 assign (resid 223 and name HN ) (resid 223 and name HG* ) 2.36 0.56 0.56 !peak 134 assign (resid 223 and name HA ) (resid 223 and name HG* ) 2.61 0.81 0.81 !peak 34 assign (resid 223 and name HA ) (resid 224 and name HG* ) 3.28 1.48 1.48 !peak 36 assign (resid 223 and name HG* ) (resid 224 and name HA ) 3.28 1.48 1.48 !peak 2523 assign (resid 223 and name HG* ) (resid 227 and name HN ) 3.28 1.48 1.48 !peak 2847 assign (resid 223 and name HG* ) (resid 227 and name HA ) 3.53 1.73 1.73 !peak 451 assign (resid 223 and name HG* ) (resid 227 and name HB ) 2.73 0.93 0.93 !peak 2851 assign (resid 223 and name HG* ) (resid 227 and name HG2* ) 2.48 0.68 0.68 !peak 501 assign (resid 223 and name HG* ) (resid 233 and name HD* ) 3.68 1.88 1.88 !peak 2810 assign (resid 223 and name HG* ) (resid 253 and name HG1* ) 2.97 1.17 1.17 !peak 2859 assign (resid 223 and name HG* ) (resid 253 and name HG2* ) 3.64 1.84 1.84 !peak 1929 assign (resid 229 and name HA ) (resid 230 and name HA* ) 3.26 1.46 1.46 !peak 1000 assign (resid 229 and name HB* ) (resid 230 and name HA* ) 3.05 1.25 1.25 !peak 1005 assign (resid 230 and name HA* ) (resid 253 and name HB ) 3.78 1.98 1.98 !peak 2088 assign (resid 231 and name HA ) (resid 232 and name HB* ) 3.18 1.38 1.38 !peak 3319 assign (resid 232 and name HN ) (resid 232 and name HE* ) 3.83 2.03 2.03 !peak 908 assign (resid 232 and name HB* ) (resid 233 and name HN ) 3.22 1.42 1.42 !peak 106 assign (resid 232 and name HE* ) (resid 253 and name HN ) 3.31 1.51 1.51 !peak 3212 assign (resid 233 and name HD* ) (resid 234 and name HN ) 3.01 1.21 1.21 !peak 226 assign (resid 233 and name HD* ) (resid 235 and name HD* ) 3.80 2.00 2.00 !peak 2811 assign (resid 233 and name HD* ) (resid 249 and name HD* ) 3.04 1.24 1.24 !peak 641 assign (resid 235 and name HN ) (resid 235 and name HB* ) 2.57 0.77 0.77 !peak 67 assign (resid 235 and name HN ) (resid 235 and name HD* ) 3.17 1.37 1.37 !peak 1695 assign (resid 235 and name HN ) (resid 249 and name HB* ) 3.45 1.65 1.65 !peak 1100 assign (resid 235 and name HN ) (resid 249 and name HD* ) 3.16 1.36 1.36 !peak 62 assign (resid 235 and name HA ) (resid 235 and name HD* ) 2.55 0.75 0.75 !peak 1430 assign (resid 235 and name HB* ) (resid 235 and name HD* ) 2.43 0.63 0.63 !peak 1690 assign (resid 235 and name HB* ) (resid 238 and name HB2 ) 3.01 1.21 1.21 !peak 3387 assign (resid 235 and name HB* ) (resid 238 and name HB1 ) 2.93 1.13 1.14 !peak 2736 assign (resid 235 and name HB* ) (resid 238 and name HG2 ) 3.48 1.68 1.68 !peak 3146 assign (resid 235 and name HB* ) (resid 249 and name HN ) 2.98 1.18 1.18 !peak 346 assign (resid 235 and name HB* ) (resid 249 and name HD* ) 2.93 1.13 1.14 !peak 1670 assign (resid 235 and name HG ) (resid 249 and name HD* ) 3.58 1.78 1.78 !peak 1671 assign (resid 235 and name HD* ) (resid 236 and name HN ) 2.63 0.83 0.83 !peak 156 assign (resid 235 and name HD* ) (resid 236 and name HA ) 3.52 1.72 1.72 !peak 704 assign (resid 235 and name HD* ) (resid 238 and name HN ) 3.35 1.55 1.55 !peak 714 assign (resid 235 and name HD* ) (resid 238 and name HB1 ) 3.84 2.04 2.04 !peak 1686 assign (resid 235 and name HD* ) (resid 238 and name HG2 ) 3.17 1.37 1.37 !peak 2031 assign (resid 235 and name HD* ) (resid 238 and name HG1 ) 2.73 0.93 0.93 !peak 1709 assign (resid 235 and name HD* ) (resid 238 and name HE* ) 3.08 1.28 1.28 !peak 1716 assign (resid 235 and name HD* ) (resid 249 and name HD* ) 2.53 0.73 0.73 !peak 79 assign (resid 236 and name HN ) (resid 236 and name HG* ) 3.59 1.79 1.79 !peak 2025 assign (resid 236 and name HA ) (resid 236 and name HG* ) 2.72 0.92 0.92 !peak 209 assign (resid 236 and name HA ) (resid 248 and name HB* ) 3.15 1.35 1.35 !peak 2128 assign (resid 236 and name HG* ) (resid 236 and name HD* ) 2.19 0.39 0.39 !peak 2794 assign (resid 236 and name HG* ) (resid 236 and name HE* ) 2.67 0.87 0.87 !peak 1657 assign (resid 236 and name HG* ) (resid 237 and name HN ) 3.29 1.49 1.49 !peak 502 assign (resid 236 and name HG* ) (resid 248 and name HA ) 3.57 1.77 1.77 !peak 2390 assign (resid 236 and name HG* ) (resid 248 and name HB* ) 2.95 1.15 1.15 !peak 2793 assign (resid 238 and name HN ) (resid 249 and name HB* ) 3.39 1.59 1.59 !peak 463 assign (resid 238 and name HN ) (resid 249 and name HD* ) 3.44 1.64 1.64 !peak 715 assign (resid 238 and name HA ) (resid 249 and name HD* ) 3.65 1.85 1.85 !peak 1682 assign (resid 238 and name HB2 ) (resid 249 and name HD* ) 3.30 1.50 1.50 !peak 83 assign (resid 238 and name HB1 ) (resid 249 and name HD* ) 3.17 1.37 1.37 !peak 83 assign (resid 238 and name HG2 ) (resid 249 and name HD* ) 3.08 1.28 1.28 !peak 1668 assign (resid 239 and name HN ) (resid 249 and name HD* ) 3.91 2.11 2.11 !peak 1243 assign (resid 242 and name HN ) (resid 246 and name HD* ) 3.54 1.74 1.74 !peak 587 assign (resid 245 and name HA* ) (resid 246 and name HB2 ) 3.55 1.75 1.75 !peak 3382 assign (resid 246 and name HB2 ) (resid 246 and name HD* ) 3.46 1.66 1.66 !peak 1073 assign (resid 247 and name HA* ) (resid 248 and name HB* ) 4.30 2.50 2.50 !peak 69 assign (resid 248 and name HN ) (resid 248 and name HB* ) 2.67 0.87 0.87 !peak 410 assign (resid 248 and name HB* ) (resid 249 and name HN ) 2.69 0.89 0.89 !peak 344 assign (resid 248 and name HB* ) (resid 250 and name HE2 ) 2.84 1.04 1.04 !peak 107 assign (resid 249 and name HN ) (resid 249 and name HB* ) 2.63 0.83 0.83 !peak 349 assign (resid 249 and name HN ) (resid 249 and name HD* ) 3.08 1.28 1.28 !peak 350 assign (resid 249 and name HA ) (resid 249 and name HD* ) 2.65 0.85 0.85 !peak 85 assign (resid 249 and name HB* ) (resid 250 and name HN ) 3.02 1.22 1.22 !peak 170 assign (resid 249 and name HD* ) (resid 250 and name HN ) 2.58 0.78 0.78 !peak 122 assign (resid 249 and name HD* ) (resid 251 and name HN ) 3.08 1.28 1.28 !peak 204 assign (resid 249 and name HD* ) (resid 251 and name HA ) 3.13 1.33 1.33 !peak 809 assign (resid 249 and name HD* ) (resid 251 and name HB* ) 2.47 0.67 0.67 !peak 73 assign (resid 249 and name HD* ) (resid 251 and name HD* ) 2.80 1.00 1.00 !peak 573 assign (resid 249 and name HD* ) (resid 252 and name HN ) 3.96 2.16 2.16 !peak 78 assign (resid 251 and name HN ) (resid 251 and name HB* ) 2.59 0.79 0.79 !peak 206 assign (resid 251 and name HB* ) (resid 252 and name HN ) 3.07 1.27 1.27 !peak 1037 assign (resid 251 and name HD* ) (resid 252 and name HN ) 3.45 1.65 1.65 !peak 1717 assign (resid 251 and name HD* ) (resid 253 and name HN ) 3.84 2.04 2.04 !peak 1717 assign (resid 254 and name HA ) (resid 254 and name HD* ) 2.88 1.08 1.08 !peak 1061 assign (resid 254 and name HB2 ) (resid 254 and name HD* ) 2.79 0.99 0.99 !peak 1098 assign (resid 254 and name HD* ) (resid 255 and name HN ) 3.10 1.30 1.30 !peak 884 assign (resid 173 and name HN ) (resid 235 and name HD* ) 3.10 1.30 1.30 !peak 1445 assign (resid 175 and name HN ) (resid 235 and name HD* ) 4.20 2.40 2.40 !peak 664 assign (resid 176 and name HH2 ) (resid 197 and name HD* ) 3.10 1.30 1.30 !peak 3848 assign (resid 176 and name HH2 ) (resid 221 and name HG* ) 3.10 1.30 1.30 !peak 34 assign (resid 177 and name HE* ) (resid 253 and name HG* ) 3.10 1.30 1.30 ! assign (resid 176 and name HD1 ) (resid 224 and name HB* ) 3.90 2.10 2.10 !peak 99 assign (resid 176 and name HD1 ) (resid 224 and name HG* ) 3.55 1.75 1.75 !peak 23 assign (resid 176 and name HE1 ) (resid 224 and name HG* ) 3.60 1.80 1.80 !peak 38 assign (resid 176 and name HE1 ) (resid 197 and name HG ) 4.20 2.40 2.40 ! assign (resid 176 and name HD1 ) (resid 177 and name HG* ) 3.90 2.10 2.10 !peak 99 assign (resid 176 and name HH2 ) (resid 253 and name HG2* ) 3.10 1.30 1.30 ! assign (resid 176 and name HH2 ) (resid 223 and name HG1* ) 3.65 1.85 1.85 ! assign (resid 176 and name HZ3 ) (resid 253 and name HG2* ) 3.10 1.30 1.30 ! assign (resid 175 and name HN ) (resid 234 and name HD* ) 3.65 1.85 1.85 ! assign (resid 172 and name HN ) (resid 219 and name HG2* ) 3.65 1.85 1.85 !peak 1197 assign (resid 172 and name HA ) (resid 219 and name HG2* ) 3.24 1.44 1.44 !peak 516 assign (resid 172 and name HB ) (resid 219 and name HG2* ) 2.86 1.06 1.06 !peak 425 assign (resid 172 and name HB ) (resid 220 and name HB* ) 3.07 1.27 1.27 !peak 3129 assign (resid 172 and name HG2* ) (resid 219 and name HG2* ) 2.28 0.48 0.48 !peak 22 assign (resid 173 and name HB* ) (resid 197 and name HD* ) 3.65 1.85 1.85 !peak 16
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