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 |
|
|
608497 |
5kpe   |
30128 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
assign (resid 3 and name HA ) (resid 4 and name HN ) 2.72 0.92 0.92 !peak 7 #SUP 0.81 #QF 0.81 assign (resid 4 and name HB ) (resid 5 and name HN ) 3.25 1.45 1.45 !peak 12 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 5 and name HN ) 3.00 1.20 1.20 !peak 13 #SUP 1.00 assign (resid 5 and name HN ) (resid 7 and name HB* ) 3.75 1.95 1.95 !peak 14 #SUP 0.99 #QF 0.99 assign (resid 5 and name HB ) (resid 6 and name HN ) 2.92 1.12 1.12 !peak 19 #SUP 1.00 assign (resid 5 and name HG2* ) (resid 6 and name HN ) 3.09 1.29 1.28 !peak 21 #SUP 1.00 assign (resid 6 and name HN ) (resid 7 and name HN ) 2.73 0.93 0.93 !peak 22 #SUP 0.99 #QF 0.99 assign (resid 6 and name HB2 ) (resid 7 and name HN ) 2.98 1.18 1.18 !peak 24 #SUP 1.00 assign (resid 6 and name HB1 ) (resid 7 and name HN ) 2.81 1.01 1.01 !peak 25 #SUP 0.97 #QF 0.97 assign (resid 7 and name HB* ) (resid 8 and name HN ) 2.71 0.91 0.91 !peak 30 #SUP 0.99 #QF 0.99 assign (resid 8 and name HN ) (resid 9 and name HN ) 2.77 0.97 0.97 !peak 31 #SUP 1.00 assign (resid 8 and name HB* ) (resid 9 and name HN ) 2.81 1.01 1.01 !peak 33 #SUP 0.98 #QF 0.98 assign (resid 9 and name HB1 ) (resid 10 and name HN ) 2.80 1.00 1.00 !peak 36 #SUP 0.98 #QF 0.98 assign (resid 9 and name HB2 ) (resid 10 and name HN ) 3.00 1.20 1.20 !peak 37 #SUP 1.00 assign (resid 7 and name HB* ) (resid 10 and name HN ) 3.91 2.11 2.11 !peak 38 #SUP 0.99 #QF 0.88 assign (resid 9 and name HD1 ) (resid 10 and name HN ) 3.65 1.85 1.85 !peak 41 #SUP 0.95 #QF 0.95 assign (resid 10 and name HB2 ) (resid 11 and name HN ) 3.54 1.74 1.74 !peak 47 #SUP 1.00 #QF 0.95 assign (resid 10 and name HB1 ) (resid 11 and name HN ) 3.54 1.74 1.74 !peak 47 #SUP 1.00 #QF 0.95 assign (resid 11 and name HB* ) (resid 12 and name HN ) 2.74 0.94 0.94 !peak 54 #SUP 1.00 assign (resid 13 and name HN ) (resid 14 and name HN ) 2.79 0.99 0.99 !peak 58 #SUP 0.99 #QF 0.99 assign (resid 13 and name HB ) (resid 14 and name HN ) 2.78 0.98 0.98 !peak 60 #SUP 1.00 assign (resid 13 and name HG2* ) (resid 14 and name HN ) 2.91 1.11 1.11 !peak 61 #SUP 0.95 #QF 0.95 assign (resid 13 and name HG11 ) (resid 14 and name HN ) 3.44 1.64 1.64 !peak 62 #SUP 1.00 assign (resid 11 and name HB* ) (resid 14 and name HN ) 3.68 1.88 1.88 !peak 63 #SUP 1.00 assign (resid 14 and name HB* ) (resid 15 and name HN ) 2.95 1.15 1.15 !peak 67 #SUP 1.00 assign (resid 15 and name HN ) (resid 16 and name HN ) 3.06 1.26 1.26 !peak 68 #SUP 0.99 #QF 0.99 assign (resid 15 and name HB ) (resid 16 and name HN ) 3.08 1.28 1.28 !peak 70 #SUP 0.99 #QF 0.99 assign (resid 15 and name HG2* ) (resid 16 and name HN ) 3.29 1.49 1.49 !peak 71 #SUP 1.00 assign (resid 15 and name HD1* ) (resid 16 and name HN ) 3.66 1.86 1.86 !peak 74 #SUP 1.00 assign (resid 16 and name HB2 ) (resid 17 and name HN ) 3.18 1.38 1.38 !peak 78 #SUP 0.98 #QF 0.89 assign (resid 17 and name HB1 ) (resid 18 and name HN ) 3.22 1.42 1.42 !peak 84 #SUP 1.00 assign (resid 17 and name HB2 ) (resid 18 and name HN ) 3.03 1.23 1.23 !peak 85 #SUP 0.99 #QF 0.99 assign (resid 18 and name HN ) (resid 20 and name HN ) 3.69 1.89 1.89 !peak 88 #SUP 0.99 #QF 0.99 assign (resid 18 and name HB2 ) (resid 19 and name HN ) 3.15 1.35 1.35 !peak 92 #SUP 1.00 assign (resid 18 and name HB1 ) (resid 19 and name HN ) 2.99 1.19 1.19 !peak 93 #SUP 0.99 #QF 0.99 assign (resid 18 and name HG ) (resid 19 and name HN ) 3.86 2.06 2.06 !peak 94 #SUP 1.00 assign (resid 18 and name HD1* ) (resid 19 and name HN ) 3.79 1.99 1.99 !peak 95 #SUP 1.00 assign (resid 18 and name HD2* ) (resid 19 and name HN ) 3.79 1.99 1.99 !peak 96 #SUP 1.00 assign (resid 19 and name HN ) (resid 20 and name HN ) 2.87 1.07 1.07 !peak 97 #SUP 1.00 assign (resid 19 and name HB2 ) (resid 20 and name HN ) 3.30 1.50 1.50 !peak 99 #SUP 0.97 #QF 0.97 assign (resid 19 and name HB1 ) (resid 20 and name HN ) 3.30 1.50 1.50 !peak 100 #SUP 0.99 #QF 0.99 assign (resid 20 and name HN ) (resid 21 and name HN ) 2.69 0.89 0.89 !peak 107 #SUP 0.99 #QF 0.99 assign (resid 18 and name HA ) (resid 21 and name HN ) 2.95 1.15 1.15 !peak 108 #SUP 0.88 #QF 0.24 assign (resid 20 and name HB2 ) (resid 21 and name HN ) 3.45 1.65 1.65 !peak 110 #SUP 1.00 #QF 0.80 assign (resid 20 and name HB1 ) (resid 21 and name HN ) 3.62 1.82 1.82 !peak 110 #SUP 1.00 #QF 0.80 assign (resid 20 and name HG2 ) (resid 21 and name HN ) 3.52 1.72 1.72 !peak 111 #SUP 1.00 assign (resid 20 and name HG1 ) (resid 21 and name HN ) 3.52 1.72 1.72 !peak 112 #SUP 1.00 assign (resid 18 and name HB2 ) (resid 21 and name HN ) 4.35 2.55 2.55 !peak 114 #SUP 1.00 #QF 0.46 assign (resid 20 and name HD2 ) (resid 21 and name HN ) 4.35 2.55 2.55 !peak 114 #SUP 1.00 #QF 0.46 assign (resid 20 and name HD1 ) (resid 21 and name HN ) 4.35 2.55 2.55 !peak 114 #SUP 1.00 #QF 0.46 assign (resid 22 and name HG1 ) (resid 23 and name HN ) 3.60 1.80 1.80 !peak 120 #SUP 1.00 assign (resid 22 and name HG2 ) (resid 23 and name HN ) 3.25 1.45 1.45 !peak 121 #SUP 1.00 assign (resid 23 and name HN ) (resid 24 and name HN ) 2.69 0.89 0.89 !peak 124 #SUP 0.98 #QF 0.98 assign (resid 23 and name HG2* ) (resid 24 and name HN ) 3.37 1.57 1.57 !peak 127 #SUP 1.00 assign (resid 25 and name HG1 ) (resid 26 and name HN ) 3.20 1.40 1.40 !peak 132 #SUP 1.00 assign (resid 25 and name HD1 ) (resid 26 and name HN ) 3.19 1.39 1.39 !peak 133 #SUP 1.00 assign (resid 25 and name HD2 ) (resid 26 and name HN ) 2.90 1.10 1.10 !peak 134 #SUP 0.99 #QF 0.99 assign (resid 26 and name HB2 ) (resid 27 and name HN ) 3.04 1.24 1.24 !peak 137 #SUP 0.97 #QF 0.97 assign (resid 26 and name HB1 ) (resid 27 and name HN ) 3.04 1.24 1.24 !peak 138 #SUP 1.00 assign (resid 26 and name HG2 ) (resid 27 and name HN ) 3.64 1.84 1.84 !peak 139 #SUP 1.00 assign (resid 26 and name HG1 ) (resid 27 and name HN ) 3.64 1.84 1.84 !peak 140 #SUP 1.00 assign (resid 27 and name HB* ) (resid 28 and name HN ) 2.79 0.99 0.99 !peak 143 #SUP 0.99 #QF 0.99 assign (resid 28 and name HN ) (resid 29 and name HN ) 2.65 0.85 0.85 !peak 144 #SUP 0.99 #QF 0.99 assign (resid 28 and name HG1 ) (resid 29 and name HN ) 2.76 0.96 0.96 !peak 148 #SUP 0.93 #QF 0.93 assign (resid 29 and name HB1 ) (resid 30 and name HN ) 2.71 0.91 0.91 !peak 155 #SUP 0.98 #QF 0.98 assign (resid 29 and name HG1 ) (resid 30 and name HN ) 3.32 1.52 1.52 !peak 156 #SUP 1.00 assign (resid 29 and name HG2 ) (resid 30 and name HN ) 3.17 1.37 1.37 !peak 157 #SUP 1.00 assign (resid 30 and name HG ) (resid 31 and name HN ) 2.76 0.96 0.96 !peak 161 #SUP 0.65 #QF 0.65 assign (resid 30 and name HD2* ) (resid 31 and name HN ) 3.19 1.39 1.39 !peak 164 #SUP 1.00 assign (resid 31 and name HB2 ) (resid 32 and name HN ) 3.00 1.20 1.20 !peak 167 #SUP 0.98 #QF 0.98 assign (resid 31 and name HB1 ) (resid 32 and name HN ) 3.37 1.57 1.57 !peak 168 #SUP 1.00 assign (resid 31 and name HG ) (resid 32 and name HN ) 3.67 1.87 1.87 !peak 169 #SUP 1.00 assign (resid 31 and name HD1* ) (resid 32 and name HN ) 3.70 1.90 1.90 !peak 170 #SUP 1.00 assign (resid 30 and name HD1* ) (resid 32 and name HN ) 3.72 1.92 1.92 !peak 171 #SUP 0.73 #QF 0.56 assign (resid 32 and name HN ) (resid 40 and name HD2* ) 4.02 2.22 2.22 !peak 171 #SUP 0.73 #QF 0.56 assign (resid 32 and name HB2 ) (resid 33 and name HN ) 3.15 1.35 1.35 !peak 174 #SUP 0.90 #QF 0.90 assign (resid 32 and name HB1 ) (resid 33 and name HN ) 3.17 1.37 1.37 !peak 175 #SUP 0.90 #QF 0.90 assign (resid 33 and name HN ) (resid 34 and name HN ) 2.71 0.91 0.91 !peak 178 #SUP 1.00 assign (resid 33 and name HB2 ) (resid 34 and name HN ) 2.91 1.11 1.11 !peak 181 #SUP 0.85 #QF 0.85 assign (resid 34 and name HN ) (resid 35 and name HN ) 2.56 0.76 0.76 !peak 188 #SUP 0.99 #QF 0.99 assign (resid 34 and name HB ) (resid 35 and name HN ) 3.17 1.37 1.37 !peak 190 #SUP 1.00 assign (resid 34 and name HG2* ) (resid 35 and name HN ) 3.19 1.39 1.39 !peak 191 #SUP 1.00 assign (resid 34 and name HG11 ) (resid 35 and name HN ) 3.14 1.34 1.34 !peak 192 #SUP 1.00 assign (resid 34 and name HG12 ) (resid 35 and name HN ) 3.26 1.46 1.46 !peak 193 #SUP 1.00 assign (resid 34 and name HD1* ) (resid 35 and name HN ) 3.25 1.45 1.45 !peak 194 #SUP 1.00 assign (resid 35 and name HN ) (resid 36 and name HN ) 3.61 1.81 1.81 !peak 195 #SUP 1.00 assign (resid 35 and name HA ) (resid 36 and name HN ) 2.56 0.76 0.76 !peak 196 #SUP 0.93 #QF 0.93 assign (resid 35 and name HB1 ) (resid 36 and name HN ) 2.98 1.18 1.18 !peak 198 #SUP 1.00 assign (resid 35 and name HG ) (resid 36 and name HN ) 3.61 1.81 1.81 !peak 199 #SUP 0.98 #QF 0.97 assign (resid 35 and name HD1* ) (resid 36 and name HN ) 3.56 1.76 1.76 !peak 200 #SUP 1.00 assign (resid 36 and name HB2 ) (resid 38 and name HN ) 3.40 1.60 1.60 !peak 202 #SUP 1.00 #QF 0.98 assign (resid 37 and name HB2 ) (resid 38 and name HN ) 3.35 1.55 1.55 !peak 203 #SUP 1.00 assign (resid 37 and name HG2 ) (resid 38 and name HN ) 3.53 1.73 1.73 !peak 205 #SUP 1.00 assign (resid 37 and name HG1 ) (resid 38 and name HN ) 3.53 1.73 1.73 !peak 206 #SUP 1.00 assign (resid 38 and name HN ) (resid 39 and name HB ) 3.94 2.14 2.14 !peak 206 #SUP 1.00 assign (resid 37 and name HD2 ) (resid 38 and name HN ) 3.27 1.47 1.47 !peak 207 #SUP 1.00 assign (resid 37 and name HD1 ) (resid 38 and name HN ) 3.27 1.47 1.47 !peak 208 #SUP 1.00 assign (resid 38 and name HB2 ) (resid 39 and name HN ) 3.35 1.55 1.55 !peak 211 #SUP 1.00 assign (resid 38 and name HB1 ) (resid 39 and name HN ) 3.35 1.55 1.55 !peak 212 #SUP 0.99 #QF 0.99 assign (resid 39 and name HB ) (resid 40 and name HN ) 3.09 1.29 1.29 !peak 215 #SUP 0.99 #QF 0.99 assign (resid 39 and name HG1* ) (resid 40 and name HN ) 3.49 1.69 1.69 !peak 216 #SUP 1.00 assign (resid 39 and name HG2* ) (resid 40 and name HN ) 3.49 1.69 1.69 !peak 217 #SUP 0.97 #QF 0.97 assign (resid 40 and name HN ) (resid 41 and name HN ) 2.72 0.92 0.92 !peak 218 #SUP 1.00 assign (resid 40 and name HB2 ) (resid 41 and name HN ) 3.46 1.66 1.66 !peak 221 #SUP 1.00 assign (resid 40 and name HG ) (resid 41 and name HN ) 3.43 1.63 1.63 !peak 222 #SUP 1.00 assign (resid 40 and name HD1* ) (resid 41 and name HN ) 3.21 1.41 1.41 !peak 223 #SUP 0.95 #QF 0.95 assign (resid 41 and name HB1 ) (resid 42 and name HN ) 2.86 1.06 1.06 !peak 227 #SUP 0.97 #QF 0.97 assign (resid 41 and name HB2 ) (resid 42 and name HN ) 3.19 1.39 1.39 !peak 228 #SUP 0.95 #QF 0.95 assign (resid 43 and name HB ) (resid 44 and name HN ) 2.98 1.18 1.18 !peak 239 #SUP 0.95 #QF 0.95 assign (resid 43 and name HG2* ) (resid 44 and name HN ) 3.19 1.39 1.39 !peak 241 #SUP 1.00 assign (resid 44 and name HN ) (resid 45 and name HN ) 2.84 1.04 1.04 !peak 242 #SUP 1.00 assign (resid 44 and name HB2 ) (resid 45 and name HN ) 3.26 1.46 1.46 !peak 245 #SUP 1.00 assign (resid 44 and name HG1 ) (resid 45 and name HN ) 3.52 1.72 1.72 !peak 247 #SUP 1.00 assign (resid 44 and name HD2 ) (resid 45 and name HN ) 4.02 2.22 2.22 !peak 249 #SUP 0.92 #QF 0.60 assign (resid 44 and name HD1 ) (resid 45 and name HN ) 4.02 2.22 2.22 !peak 249 #SUP 0.92 #QF 0.60 assign (resid 45 and name HB2 ) (resid 46 and name HN ) 3.24 1.44 1.44 !peak 252 #SUP 0.99 #QF 0.99 assign (resid 46 and name HN ) (resid 47 and name HN ) 2.76 0.96 0.96 !peak 256 #SUP 1.00 assign (resid 46 and name HB1 ) (resid 47 and name HN ) 3.30 1.50 1.50 !peak 259 #SUP 0.87 #QF 0.87 assign (resid 47 and name HB* ) (resid 48 and name HN ) 2.84 1.04 1.04 !peak 262 #SUP 0.98 #QF 0.98 assign (resid 48 and name HG2 ) (resid 49 and name HN ) 4.05 2.25 2.25 !peak 267 #SUP 1.00 assign (resid 49 and name HB1 ) (resid 50 and name HN ) 3.10 1.30 1.30 !peak 273 #SUP 1.00 assign (resid 49 and name HB2 ) (resid 50 and name HN ) 3.09 1.29 1.29 !peak 274 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 51 and name HN ) 3.28 1.48 1.48 !peak 279 #SUP 1.00 assign (resid 50 and name HB1 ) (resid 51 and name HN ) 3.27 1.47 1.47 !peak 280 #SUP 1.00 assign (resid 50 and name HG ) (resid 51 and name HN ) 3.56 1.76 1.76 !peak 281 #SUP 1.00 assign (resid 51 and name HN ) (resid 52 and name HN ) 3.07 1.27 1.27 !peak 284 #SUP 1.00 assign (resid 51 and name HB1 ) (resid 52 and name HN ) 3.30 1.50 1.50 !peak 286 #SUP 1.00 assign (resid 52 and name HB1 ) (resid 53 and name HN ) 3.49 1.69 1.69 !peak 295 #SUP 1.00 assign (resid 55 and name HN ) (resid 56 and name HN ) 3.49 1.69 1.69 !peak 304 #SUP 1.00 assign (resid 55 and name HA ) (resid 56 and name HN ) 2.57 0.77 0.77 !peak 305 #SUP 0.94 #QF 0.94 assign (resid 55 and name HB ) (resid 56 and name HN ) 3.47 1.67 1.67 !peak 306 #SUP 1.00 assign (resid 55 and name HG2* ) (resid 56 and name HN ) 2.83 1.03 1.03 !peak 307 #SUP 0.99 #QF 0.99 assign (resid 55 and name HG11 ) (resid 56 and name HN ) 3.94 2.14 2.14 !peak 308 #SUP 1.00 assign (resid 55 and name HD1* ) (resid 56 and name HN ) 3.98 2.18 2.18 !peak 310 #SUP 1.00 assign (resid 56 and name HA ) (resid 57 and name HN ) 2.77 0.97 0.97 !peak 312 #SUP 0.87 #QF 0.87 assign (resid 57 and name HA ) (resid 58 and name HN ) 2.62 0.83 0.83 !peak 316 #SUP 0.96 #QF 0.96 assign (resid 57 and name HB2 ) (resid 58 and name HN ) 2.87 1.07 1.07 !peak 318 #SUP 0.98 #QF 0.98 assign (resid 58 and name HN ) (resid 59 and name HN ) 3.84 2.04 2.04 !peak 322 #SUP 1.00 assign (resid 58 and name HA ) (resid 59 and name HN ) 2.50 0.70 0.70 !peak 323 #SUP 0.92 #QF 0.92 assign (resid 58 and name HB2 ) (resid 59 and name HN ) 3.65 1.85 1.85 !peak 324 #SUP 1.00 assign (resid 58 and name HG2 ) (resid 59 and name HN ) 3.65 1.85 1.85 !peak 326 #SUP 0.95 #QF 0.95 assign (resid 58 and name HG1 ) (resid 59 and name HN ) 3.65 1.85 1.85 !peak 327 #SUP 0.95 #QF 0.95 assign (resid 59 and name HN ) (resid 60 and name HN ) 3.55 1.75 1.74 !peak 328 #SUP 1.00 assign (resid 59 and name HA ) (resid 60 and name HN ) 2.60 0.80 0.80 !peak 329 #SUP 0.98 #QF 0.98 assign (resid 59 and name HB ) (resid 60 and name HN ) 3.48 1.68 1.68 !peak 330 #SUP 1.00 assign (resid 59 and name HG1* ) (resid 60 and name HN ) 3.41 1.61 1.61 !peak 331 #SUP 1.00 assign (resid 59 and name HG2* ) (resid 60 and name HN ) 3.41 1.61 1.61 !peak 332 #SUP 1.00 assign (resid 60 and name HN ) (resid 61 and name HN ) 2.65 0.85 0.85 !peak 333 #SUP 1.00 assign (resid 60 and name HG1 ) (resid 61 and name HN ) 4.03 2.23 2.23 !peak 337 #SUP 1.00 assign (resid 60 and name HG2 ) (resid 61 and name HN ) 3.30 1.50 1.50 !peak 338 #SUP 1.00 assign (resid 61 and name HN ) (resid 62 and name HN ) 3.43 1.63 1.63 !peak 343 #SUP 1.00 assign (resid 61 and name HA ) (resid 62 and name HN ) 2.39 0.60 0.60 !peak 344 #SUP 0.95 #QF 0.95 assign (resid 61 and name HB2 ) (resid 62 and name HN ) 3.20 1.40 1.40 !peak 346 #SUP 1.00 assign (resid 61 and name HG2 ) (resid 62 and name HN ) 3.46 1.66 1.66 !peak 347 #SUP 1.00 assign (resid 61 and name HD2 ) (resid 62 and name HN ) 4.03 2.23 2.23 !peak 349 #SUP 1.00 assign (resid 62 and name HN ) (resid 63 and name HN ) 3.46 1.66 1.66 !peak 351 #SUP 1.00 assign (resid 62 and name HA ) (resid 63 and name HN ) 2.41 0.61 0.61 !peak 352 #SUP 0.79 #QF 0.79 assign (resid 62 and name HB ) (resid 63 and name HN ) 3.36 1.56 1.56 !peak 353 #SUP 1.00 assign (resid 63 and name HA ) (resid 64 and name HN ) 2.51 0.71 0.71 !peak 357 #SUP 0.86 #QF 0.86 assign (resid 63 and name HB1 ) (resid 64 and name HN ) 3.03 1.23 1.23 !peak 358 #SUP 1.00 assign (resid 64 and name HN ) (resid 65 and name HN ) 3.50 1.70 1.70 !peak 362 #SUP 1.00 assign (resid 64 and name HA ) (resid 65 and name HN ) 2.44 0.64 0.64 !peak 363 #SUP 0.89 #QF 0.89 assign (resid 64 and name HB ) (resid 65 and name HN ) 3.34 1.54 1.54 !peak 364 #SUP 1.00 assign (resid 65 and name HN ) (resid 73 and name HG2* ) 3.21 1.41 1.41 !peak 366 #SUP 0.67 #QF 0.57 assign (resid 65 and name HN ) (resid 66 and name HN ) 3.58 1.78 1.78 !peak 367 #SUP 1.00 assign (resid 65 and name HA ) (resid 66 and name HN ) 2.61 0.81 0.81 !peak 368 #SUP 0.82 #QF 0.82 assign (resid 65 and name HG2* ) (resid 66 and name HN ) 3.08 1.28 1.28 !peak 370 #SUP 0.89 #QF 0.89 assign (resid 66 and name HN ) (resid 67 and name HN ) 3.63 1.83 1.83 !peak 371 #SUP 1.00 assign (resid 66 and name HA ) (resid 67 and name HN ) 2.49 0.69 0.69 !peak 372 #SUP 0.94 #QF 0.94 assign (resid 66 and name HB ) (resid 67 and name HN ) 2.89 1.09 1.09 !peak 373 #SUP 0.99 #QF 0.99 assign (resid 67 and name HA ) (resid 68 and name HN ) 2.71 0.91 0.91 !peak 376 #SUP 0.84 #QF 0.84 assign (resid 68 and name HN ) (resid 69 and name HN ) 3.63 1.83 1.83 !peak 379 #SUP 1.00 assign (resid 69 and name HN ) (resid 70 and name HN ) 3.17 1.37 1.37 !peak 382 #SUP 0.94 #QF 0.94 assign (resid 69 and name HB2 ) (resid 70 and name HN ) 3.57 1.77 1.77 !peak 384 #SUP 0.99 #QF 0.99 assign (resid 69 and name HB1 ) (resid 70 and name HN ) 3.57 1.77 1.77 !peak 385 #SUP 1.00 assign (resid 70 and name HN ) (resid 71 and name HN ) 3.55 1.75 1.74 !peak 388 #SUP 1.00 assign (resid 70 and name HA ) (resid 71 and name HN ) 2.51 0.71 0.71 !peak 389 #SUP 0.89 #QF 0.89 assign (resid 70 and name HG2* ) (resid 71 and name HN ) 2.81 1.01 1.01 !peak 391 #SUP 1.00 assign (resid 71 and name HA ) (resid 72 and name HN ) 2.57 0.77 0.77 !peak 393 #SUP 0.98 #QF 0.98 assign (resid 71 and name HB ) (resid 72 and name HN ) 3.48 1.68 1.68 !peak 394 #SUP 1.00 assign (resid 71 and name HG2* ) (resid 72 and name HN ) 2.96 1.16 1.16 !peak 396 #SUP 0.93 #QF 0.93 assign (resid 72 and name HN ) (resid 73 and name HN ) 3.56 1.76 1.76 !peak 397 #SUP 1.00 assign (resid 72 and name HA ) (resid 73 and name HN ) 2.54 0.74 0.74 !peak 398 #SUP 0.95 #QF 0.95 assign (resid 72 and name HB1 ) (resid 73 and name HN ) 3.22 1.42 1.42 !peak 400 #SUP 0.99 #QF 0.99 assign (resid 73 and name HN ) (resid 94 and name HE* ) 3.53 1.73 1.73 !peak 401 #SUP 0.91 #QF 0.91 assign (resid 73 and name HA ) (resid 74 and name HN ) 2.45 0.65 0.65 !peak 404 #SUP 0.94 #QF 0.94 assign (resid 73 and name HB ) (resid 74 and name HN ) 3.37 1.57 1.57 !peak 405 #SUP 1.00 assign (resid 73 and name HG1* ) (resid 74 and name HN ) 2.73 0.93 0.93 !peak 406 #SUP 0.97 #QF 0.97 assign (resid 73 and name HG2* ) (resid 74 and name HN ) 2.99 1.19 1.19 !peak 407 #SUP 1.00 assign (resid 74 and name HA ) (resid 75 and name HN ) 2.48 0.68 0.68 !peak 409 #SUP 0.88 #QF 0.88 assign (resid 74 and name HB ) (resid 75 and name HN ) 3.53 1.73 1.73 !peak 410 #SUP 1.00 assign (resid 74 and name HG2* ) (resid 75 and name HN ) 2.78 0.98 0.98 !peak 411 #SUP 0.98 #QF 0.98 assign (resid 75 and name HN ) (resid 76 and name HN ) 3.50 1.70 1.70 !peak 412 #SUP 1.00 assign (resid 75 and name HA ) (resid 76 and name HN ) 2.46 0.66 0.66 !peak 413 #SUP 0.91 #QF 0.91 assign (resid 61 and name HB1 ) (resid 76 and name HN ) 3.38 1.58 1.58 !peak 414 #SUP 0.99 #QF 0.83 assign (resid 75 and name HB ) (resid 76 and name HN ) 3.58 1.78 1.78 !peak 414 #SUP 0.99 #QF 0.83 assign (resid 76 and name HA ) (resid 77 and name HN ) 2.55 0.75 0.75 !peak 418 #SUP 0.95 #QF 0.95 assign (resid 76 and name HB1 ) (resid 77 and name HN ) 3.61 1.81 1.81 !peak 420 #SUP 1.00 assign (resid 77 and name HN ) (resid 78 and name HN ) 3.60 1.80 1.80 !peak 423 #SUP 1.00 assign (resid 77 and name HA ) (resid 78 and name HN ) 2.61 0.81 0.81 !peak 424 #SUP 0.99 #QF 0.99 assign (resid 77 and name HB2 ) (resid 78 and name HN ) 3.12 1.32 1.32 !peak 425 #SUP 1.00 assign (resid 60 and name HG2 ) (resid 78 and name HN ) 3.01 1.21 1.21 !peak 426 #SUP 1.00 #QF 0.94 assign (resid 77 and name HB1 ) (resid 78 and name HN ) 3.19 1.39 1.39 !peak 426 #SUP 1.00 #QF 0.94 assign (resid 77 and name HD1* ) (resid 78 and name HN ) 3.92 2.12 2.12 !peak 428 #SUP 1.00 assign (resid 77 and name HD2* ) (resid 78 and name HN ) 3.92 2.12 2.12 !peak 429 #SUP 1.00 assign (resid 78 and name HN ) (resid 79 and name HN ) 3.41 1.61 1.61 !peak 430 #SUP 1.00 assign (resid 78 and name HA ) (resid 79 and name HN ) 2.55 0.75 0.75 !peak 431 #SUP 0.95 #QF 0.95 assign (resid 78 and name HG2 ) (resid 79 and name HN ) 3.71 1.91 1.91 !peak 434 #SUP 1.00 assign (resid 79 and name HA ) (resid 80 and name HN ) 2.62 0.83 0.83 !peak 437 #SUP 0.96 #QF 0.96 assign (resid 79 and name HB1 ) (resid 80 and name HN ) 3.09 1.29 1.28 !peak 439 #SUP 0.99 #QF 0.99 assign (resid 79 and name HG2 ) (resid 80 and name HN ) 3.78 1.98 1.98 !peak 440 #SUP 0.55 #QF 0.40 assign (resid 79 and name HG1 ) (resid 80 and name HN ) 3.78 1.98 1.98 !peak 441 #SUP 1.00 assign (resid 80 and name HN ) (resid 81 and name HN ) 3.32 1.52 1.51 !peak 442 #SUP 1.00 assign (resid 80 and name HA ) (resid 81 and name HN ) 2.42 0.62 0.62 !peak 443 #SUP 0.86 #QF 0.86 assign (resid 80 and name HB ) (resid 81 and name HN ) 3.45 1.65 1.65 !peak 444 #SUP 1.00 assign (resid 80 and name HG2* ) (resid 81 and name HN ) 2.71 0.91 0.91 !peak 445 #SUP 0.92 #QF 0.92 assign (resid 84 and name HN ) (resid 85 and name HN ) 3.66 1.86 1.86 !peak 448 #SUP 1.00 assign (resid 84 and name HA ) (resid 85 and name HN ) 2.56 0.76 0.76 !peak 449 #SUP 0.84 #QF 0.84 assign (resid 84 and name HB ) (resid 85 and name HN ) 3.23 1.43 1.43 !peak 450 #SUP 1.00 assign (resid 85 and name HA ) (resid 86 and name HN ) 2.45 0.65 0.65 !peak 453 #SUP 0.83 #QF 0.83 assign (resid 85 and name HG2* ) (resid 86 and name HN ) 2.69 0.89 0.89 !peak 455 #SUP 0.97 #QF 0.97 assign (resid 86 and name HA ) (resid 87 and name HN ) 2.64 0.84 0.84 !peak 457 #SUP 0.92 #QF 0.92 assign (resid 86 and name HG2* ) (resid 87 and name HN ) 2.94 1.14 1.14 !peak 459 #SUP 0.98 #QF 0.98 assign (resid 87 and name HA ) (resid 88 and name HN ) 2.51 0.71 0.71 !peak 461 #SUP 0.96 #QF 0.96 assign (resid 87 and name HB1 ) (resid 88 and name HN ) 3.11 1.31 1.31 !peak 462 #SUP 0.99 #QF 0.99 assign (resid 88 and name HA ) (resid 89 and name HN ) 2.50 0.70 0.70 !peak 467 #SUP 0.82 #QF 0.82 assign (resid 88 and name HG2* ) (resid 89 and name HN ) 2.80 1.00 1.00 !peak 469 #SUP 0.98 #QF 0.98 assign (resid 89 and name HA ) (resid 90 and name HN ) 2.63 0.83 0.83 !peak 471 #SUP 0.94 #QF 0.94 assign (resid 90 and name HN ) (resid 91 and name HN ) 3.60 1.80 1.80 !peak 474 #SUP 1.00 assign (resid 90 and name HA ) (resid 91 and name HN ) 2.56 0.76 0.76 !peak 475 #SUP 0.94 #QF 0.94 assign (resid 90 and name HB1 ) (resid 91 and name HN ) 2.90 1.10 1.10 !peak 476 #SUP 0.95 #QF 0.95 assign (resid 90 and name HD* ) (resid 91 and name HN ) 3.29 1.49 1.49 !peak 478 #SUP 1.00 assign (resid 91 and name HA ) (resid 92 and name HN ) 2.57 0.77 0.77 !peak 481 #SUP 0.98 #QF 0.98 assign (resid 91 and name HB1 ) (resid 92 and name HN ) 3.21 1.41 1.41 !peak 482 #SUP 0.99 #QF 0.99 assign (resid 91 and name HB2 ) (resid 92 and name HN ) 3.53 1.73 1.73 !peak 483 #SUP 1.00 assign (resid 91 and name HG2 ) (resid 92 and name HN ) 3.45 1.65 1.65 !peak 485 #SUP 1.00 assign (resid 92 and name HN ) (resid 93 and name HN ) 3.48 1.68 1.68 !peak 486 #SUP 1.00 assign (resid 92 and name HA ) (resid 93 and name HN ) 2.54 0.74 0.74 !peak 487 #SUP 0.93 #QF 0.93 assign (resid 93 and name HN ) (resid 105 and name HG2* ) 3.82 2.02 2.02 !peak 489 #SUP 1.00 assign (resid 92 and name HD2* ) (resid 93 and name HN ) 3.94 2.14 2.14 !peak 492 #SUP 1.00 assign (resid 93 and name HA ) (resid 94 and name HN ) 2.54 0.74 0.74 !peak 494 #SUP 0.96 #QF 0.96 assign (resid 92 and name HB1 ) (resid 94 and name HN ) 3.97 2.17 2.17 !peak 495 #SUP 1.00 #QF 0.37 assign (resid 93 and name HB1 ) (resid 94 and name HN ) 3.34 1.54 1.54 !peak 496 #SUP 1.00 assign (resid 93 and name HG1 ) (resid 94 and name HN ) 3.47 1.67 1.67 !peak 497 #SUP 1.00 assign (resid 93 and name HG2 ) (resid 94 and name HN ) 3.40 1.60 1.60 !peak 498 #SUP 0.95 #QF 0.95 assign (resid 94 and name HA ) (resid 95 and name HN ) 2.67 0.87 0.87 !peak 502 #SUP 0.94 #QF 0.94 assign (resid 94 and name HB1 ) (resid 95 and name HN ) 3.28 1.48 1.48 !peak 504 #SUP 1.00 assign (resid 95 and name HN ) (resid 96 and name HN ) 3.60 1.80 1.80 !peak 508 #SUP 1.00 assign (resid 95 and name HB1 ) (resid 96 and name HN ) 3.12 1.32 1.32 !peak 511 #SUP 0.97 #QF 0.97 assign (resid 95 and name HG2 ) (resid 96 and name HN ) 3.76 1.96 1.96 !peak 513 #SUP 0.99 #QF 0.93 assign (resid 95 and name HG1 ) (resid 96 and name HN ) 3.76 1.96 1.96 !peak 513 #SUP 0.99 #QF 0.93 assign (resid 96 and name HA ) (resid 97 and name HN ) 2.65 0.85 0.85 !peak 515 #SUP 0.96 #QF 0.96 assign (resid 96 and name HG2* ) (resid 97 and name HN ) 3.42 1.62 1.62 !peak 517 #SUP 0.78 #QF 0.78 assign (resid 96 and name HG1* ) (resid 97 and name HN ) 3.42 1.62 1.62 !peak 518 #SUP 1.00 #QF 0.55 assign (resid 97 and name HA ) (resid 98 and name HN ) 2.79 0.99 0.99 !peak 520 #SUP 0.89 #QF 0.89 assign (resid 97 and name HB1 ) (resid 98 and name HN ) 3.73 1.93 1.93 !peak 521 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 98 and name HN ) 3.67 1.87 1.87 !peak 522 #SUP 1.00 assign (resid 98 and name HA1 ) (resid 99 and name HN ) 2.85 1.05 1.05 !peak 525 #SUP 0.97 #QF 0.97 assign (resid 99 and name HA ) (resid 100 and name HN ) 2.93 1.13 1.13 !peak 527 #SUP 0.99 #QF 0.99 assign (resid 99 and name HB2 ) (resid 100 and name HN ) 3.55 1.75 1.74 !peak 528 #SUP 1.00 assign (resid 99 and name HB1 ) (resid 100 and name HN ) 3.55 1.75 1.74 !peak 529 #SUP 1.00 assign (resid 100 and name HA ) (resid 101 and name HN ) 2.51 0.71 0.71 !peak 531 #SUP 1.00 assign (resid 100 and name HB ) (resid 101 and name HN ) 3.13 1.33 1.33 !peak 532 #SUP 1.00 assign (resid 100 and name HG2* ) (resid 101 and name HN ) 2.83 1.03 1.03 !peak 533 #SUP 1.00 assign (resid 101 and name HA ) (resid 102 and name HN ) 2.73 0.93 0.93 !peak 535 #SUP 0.97 #QF 0.97 assign (resid 101 and name HB ) (resid 102 and name HN ) 3.44 1.64 1.64 !peak 536 #SUP 1.00 assign (resid 101 and name HD1* ) (resid 102 and name HN ) 3.91 2.11 2.11 !peak 540 #SUP 1.00 assign (resid 102 and name HN ) (resid 103 and name HN ) 2.67 0.87 0.87 !peak 541 #SUP 0.98 #QF 0.98 assign (resid 103 and name HN ) (resid 104 and name HN ) 3.80 2.00 2.00 !peak 549 #SUP 1.00 #QF 0.67 assign (resid 103 and name HA ) (resid 104 and name HN ) 2.56 0.76 0.76 !peak 550 #SUP 0.97 #QF 0.97 assign (resid 95 and name HN ) (resid 103 and name HB2 ) 3.16 1.36 1.36 !peak 551 #SUP 0.87 #QF 0.59 assign (resid 103 and name HB2 ) (resid 104 and name HN ) 3.48 1.68 1.68 !peak 551 #SUP 0.87 #QF 0.59 assign (resid 95 and name HN ) (resid 103 and name HB1 ) 3.16 1.36 1.36 !peak 552 #SUP 0.73 #QF 0.62 assign (resid 103 and name HB1 ) (resid 104 and name HN ) 3.48 1.68 1.68 !peak 552 #SUP 0.73 #QF 0.62 assign (resid 104 and name HA ) (resid 105 and name HN ) 2.60 0.80 0.80 !peak 558 #SUP 0.96 #QF 0.96 assign (resid 93 and name HB1 ) (resid 105 and name HN ) 3.07 1.27 1.27 !peak 559 #SUP 0.62 #QF 0.62 assign (resid 104 and name HG1* ) (resid 105 and name HN ) 3.21 1.41 1.41 !peak 560 #SUP 0.99 #QF 0.99 assign (resid 104 and name HG2* ) (resid 105 and name HN ) 3.21 1.41 1.41 !peak 561 #SUP 1.00 assign (resid 105 and name HA ) (resid 106 and name HN ) 2.65 0.85 0.85 !peak 563 #SUP 0.93 #QF 0.93 assign (resid 106 and name HA ) (resid 107 and name HN ) 2.62 0.83 0.83 !peak 567 #SUP 0.89 #QF 0.89 assign (resid 91 and name HB1 ) (resid 107 and name HN ) 3.73 1.93 1.93 !peak 568 #SUP 1.00 #QF 0.23 assign (resid 106 and name HG2* ) (resid 107 and name HN ) 3.32 1.52 1.52 !peak 570 #SUP 1.00 assign (resid 107 and name HN ) (resid 108 and name HN ) 3.47 1.67 1.67 !peak 571 #SUP 1.00 assign (resid 107 and name HA ) (resid 108 and name HN ) 2.76 0.96 0.96 !peak 572 #SUP 0.94 #QF 0.94 assign (resid 107 and name HB ) (resid 108 and name HN ) 3.41 1.61 1.61 !peak 573 #SUP 1.00 assign (resid 107 and name HG2* ) (resid 108 and name HN ) 3.02 1.22 1.22 !peak 574 #SUP 0.98 #QF 0.98 assign (resid 108 and name HA ) (resid 109 and name HN ) 2.69 0.89 0.89 !peak 576 #SUP 0.98 #QF 0.98 assign (resid 108 and name HB1 ) (resid 109 and name HN ) 3.53 1.73 1.73 !peak 577 #SUP 1.00 assign (resid 108 and name HB2 ) (resid 109 and name HN ) 3.53 1.73 1.73 !peak 578 #SUP 1.00 assign (resid 108 and name HG2 ) (resid 109 and name HN ) 3.27 1.47 1.47 !peak 579 #SUP 1.00 assign (resid 108 and name HG1 ) (resid 109 and name HN ) 3.27 1.47 1.47 !peak 580 #SUP 1.00 assign (resid 90 and name HD* ) (resid 109 and name HN ) 3.73 1.93 1.93 !peak 581 #SUP 0.93 #QF 0.93 assign (resid 112 and name HN ) (resid 113 and name HN ) 3.66 1.86 1.86 !peak 591 #SUP 1.00 assign (resid 112 and name HA ) (resid 113 and name HN ) 2.72 0.92 0.92 !peak 592 #SUP 0.89 #QF 0.89 assign (resid 112 and name HB2 ) (resid 113 and name HN ) 3.71 1.91 1.91 !peak 594 #SUP 0.96 #QF 0.77 assign (resid 112 and name HB1 ) (resid 113 and name HN ) 3.71 1.91 1.91 !peak 594 #SUP 0.96 #QF 0.77 assign (resid 113 and name HN ) (resid 114 and name HN ) 3.14 1.34 1.34 !peak 595 #SUP 1.00 assign (resid 113 and name HB2 ) (resid 114 and name HN ) 3.58 1.78 1.78 !peak 597 #SUP 1.00 assign (resid 113 and name HD1* ) (resid 114 and name HN ) 3.78 1.98 1.97 !peak 600 #SUP 1.00 assign (resid 1 and name HB2 ) (resid 2 and name HN ) 4.03 2.23 2.23 !peak 605 #SUP 1.00 #QF 0.71 assign (resid 4 and name HN ) (resid 4 and name HB ) 2.84 1.04 1.04 !peak 612 #SUP 0.99 #QF 0.99 assign (resid 4 and name HN ) (resid 4 and name HG2* ) 3.08 1.28 1.28 !peak 613 #SUP 1.00 assign (resid 4 and name HN ) (resid 4 and name HG12 ) 3.34 1.54 1.54 !peak 614 #SUP 1.00 assign (resid 4 and name HN ) (resid 4 and name HG11 ) 3.34 1.54 1.54 !peak 615 #SUP 1.00 assign (resid 4 and name HN ) (resid 4 and name HD1* ) 3.36 1.56 1.56 !peak 616 #SUP 1.00 assign (resid 5 and name HN ) (resid 5 and name HB ) 2.63 0.83 0.83 !peak 619 #SUP 0.98 #QF 0.98 assign (resid 5 and name HN ) (resid 5 and name HG2* ) 2.87 1.07 1.07 !peak 621 #SUP 0.85 #QF 0.85 assign (resid 6 and name HN ) (resid 6 and name HB2 ) 2.76 0.96 0.96 !peak 624 #SUP 0.99 #QF 0.99 assign (resid 6 and name HN ) (resid 6 and name HB1 ) 2.73 0.93 0.93 !peak 625 #SUP 0.96 #QF 0.96 assign (resid 7 and name HN ) (resid 7 and name HB* ) 2.53 0.73 0.73 !peak 630 #SUP 0.99 #QF 0.99 assign (resid 8 and name HN ) (resid 8 and name HB* ) 2.55 0.75 0.75 !peak 633 #SUP 0.99 #QF 0.99 assign (resid 9 and name HN ) (resid 9 and name HB1 ) 2.73 0.93 0.93 !peak 636 #SUP 0.99 #QF 0.99 assign (resid 9 and name HN ) (resid 9 and name HB2 ) 2.73 0.93 0.93 !peak 637 #SUP 0.99 #QF 0.99 assign (resid 9 and name HN ) (resid 9 and name HG1 ) 3.56 1.76 1.76 !peak 639 #SUP 1.00 assign (resid 9 and name HN ) (resid 9 and name HD2 ) 4.15 2.35 2.35 !peak 641 #SUP 1.00 #QF 0.70 assign (resid 11 and name HN ) (resid 11 and name HB* ) 2.73 0.93 0.93 !peak 654 #SUP 1.00 assign (resid 12 and name HN ) (resid 12 and name HB* ) 2.49 0.69 0.69 !peak 657 #SUP 0.99 #QF 0.99 assign (resid 13 and name HN ) (resid 13 and name HB ) 2.87 1.07 1.07 !peak 660 #SUP 1.00 assign (resid 13 and name HN ) (resid 13 and name HG2* ) 3.18 1.38 1.38 !peak 661 #SUP 1.00 assign (resid 14 and name HN ) (resid 14 and name HB* ) 2.50 0.70 0.70 !peak 667 #SUP 0.98 #QF 0.98 assign (resid 15 and name HN ) (resid 15 and name HB ) 2.84 1.04 1.04 !peak 670 #SUP 1.00 assign (resid 15 and name HN ) (resid 15 and name HG2* ) 3.25 1.45 1.45 !peak 671 #SUP 1.00 assign (resid 15 and name HN ) (resid 15 and name HG12 ) 3.29 1.49 1.49 !peak 672 #SUP 1.00 assign (resid 44 and name HG2 ) (resid 45 and name HN ) 3.52 1.72 1.72 !peak 672 #SUP 1.00 assign (resid 15 and name HN ) (resid 15 and name HG11 ) 3.29 1.49 1.49 !peak 674 #SUP 1.00 #QF 0.52 assign (resid 16 and name HN ) (resid 16 and name HB2 ) 2.90 1.10 1.10 !peak 678 #SUP 0.93 #QF 0.93 assign (resid 16 and name HN ) (resid 16 and name HD* ) 3.17 1.37 1.37 !peak 679 #SUP 0.99 #QF 0.99 assign (resid 16 and name HN ) (resid 16 and name HE* ) 3.78 1.98 1.97 !peak 681 #SUP 0.96 #QF 0.96 assign (resid 17 and name HN ) (resid 17 and name HB1 ) 2.99 1.19 1.19 !peak 684 #SUP 1.00 assign (resid 18 and name HN ) (resid 18 and name HB2 ) 2.73 0.93 0.93 !peak 692 #SUP 1.00 assign (resid 18 and name HN ) (resid 18 and name HB1 ) 2.92 1.12 1.12 !peak 693 #SUP 1.00 assign (resid 18 and name HN ) (resid 18 and name HG ) 3.09 1.29 1.28 !peak 694 #SUP 1.00 assign (resid 18 and name HN ) (resid 18 and name HD2* ) 3.40 1.60 1.60 !peak 696 #SUP 1.00 assign (resid 19 and name HN ) (resid 19 and name HB2 ) 3.07 1.27 1.27 !peak 699 #SUP 0.97 #QF 0.97 assign (resid 20 and name HN ) (resid 20 and name HB1 ) 2.71 0.91 0.91 !peak 710 #SUP 0.95 #QF 0.95 assign (resid 20 and name HN ) (resid 20 and name HG2 ) 3.36 1.56 1.56 !peak 711 #SUP 1.00 assign (resid 20 and name HN ) (resid 20 and name HG1 ) 3.36 1.56 1.56 !peak 712 #SUP 1.00 assign (resid 20 and name HN ) (resid 20 and name HD2 ) 4.06 2.26 2.26 !peak 714 #SUP 0.98 #QF 0.70 assign (resid 20 and name HN ) (resid 20 and name HD1 ) 4.06 2.26 2.26 !peak 714 #SUP 0.98 #QF 0.70 assign (resid 20 and name HN ) (resid 20 and name HE2 ) 4.28 2.48 2.48 !peak 716 #SUP 0.93 #QF 0.35 assign (resid 20 and name HN ) (resid 20 and name HE1 ) 4.28 2.48 2.48 !peak 716 #SUP 0.93 #QF 0.35 assign (resid 21 and name HN ) (resid 21 and name HB2 ) 2.98 1.18 1.18 !peak 719 #SUP 0.99 #QF 0.99 assign (resid 21 and name HN ) (resid 21 and name HB1 ) 2.99 1.19 1.19 !peak 720 #SUP 0.94 #QF 0.94 assign (resid 21 and name HN ) (resid 21 and name HD21 ) 3.63 1.83 1.83 !peak 722 #SUP 1.00 assign (resid 23 and name HN ) (resid 23 and name HB ) 3.32 1.52 1.51 !peak 725 #SUP 1.00 assign (resid 24 and name HN ) (resid 24 and name HB2 ) 2.71 0.91 0.91 !peak 729 #SUP 0.94 #QF 0.94 assign (resid 24 and name HN ) (resid 24 and name HB1 ) 2.71 0.91 0.91 !peak 730 #SUP 0.79 #QF 0.79 assign (resid 25 and name HG2 ) (resid 26 and name HN ) 2.57 0.77 0.77 !peak 733 #SUP 0.99 #QF 0.85 assign (resid 26 and name HN ) (resid 26 and name HB2 ) 3.07 1.27 1.27 !peak 733 #SUP 0.99 #QF 0.85 assign (resid 25 and name HB1 ) (resid 26 and name HN ) 3.38 1.58 1.58 !peak 734 #SUP 0.99 #QF 0.86 assign (resid 26 and name HN ) (resid 26 and name HG2 ) 2.97 1.17 1.17 !peak 735 #SUP 1.00 assign (resid 26 and name HN ) (resid 26 and name HG1 ) 2.97 1.17 1.17 !peak 736 #SUP 0.99 #QF 0.99 assign (resid 27 and name HN ) (resid 27 and name HB* ) 2.50 0.70 0.70 !peak 739 #SUP 0.97 #QF 0.97 assign (resid 28 and name HN ) (resid 28 and name HB1 ) 2.54 0.74 0.74 !peak 744 #SUP 0.97 #QF 0.97 assign (resid 28 and name HN ) (resid 28 and name HG2 ) 2.90 1.10 1.10 !peak 745 #SUP 1.00 assign (resid 29 and name HN ) (resid 29 and name HB2 ) 2.59 0.79 0.79 !peak 750 #SUP 0.93 #QF 0.93 assign (resid 29 and name HN ) (resid 29 and name HB1 ) 2.46 0.66 0.66 !peak 751 #SUP 0.95 #QF 0.95 assign (resid 29 and name HN ) (resid 29 and name HG1 ) 3.51 1.71 1.71 !peak 752 #SUP 1.00 assign (resid 30 and name HN ) (resid 30 and name HB1 ) 2.61 0.81 0.81 !peak 756 #SUP 0.99 #QF 0.99 assign (resid 30 and name HN ) (resid 30 and name HG ) 2.56 0.76 0.76 !peak 757 #SUP 0.64 #QF 0.64 assign (resid 30 and name HN ) (resid 30 and name HD1* ) 3.32 1.52 1.52 !peak 759 #SUP 1.00 assign (resid 30 and name HN ) (resid 30 and name HD2* ) 3.18 1.38 1.38 !peak 760 #SUP 1.00 assign (resid 31 and name HN ) (resid 31 and name HB2 ) 2.62 0.83 0.83 !peak 763 #SUP 0.98 #QF 0.98 assign (resid 31 and name HN ) (resid 31 and name HB1 ) 3.04 1.24 1.24 !peak 764 #SUP 1.00 assign (resid 31 and name HN ) (resid 31 and name HG ) 2.60 0.80 0.80 !peak 765 #SUP 0.99 #QF 0.99 assign (resid 31 and name HN ) (resid 31 and name HD1* ) 2.93 1.13 1.13 !peak 766 #SUP 1.00 assign (resid 30 and name HD1* ) (resid 31 and name HN ) 2.87 1.07 1.07 !peak 767 #SUP 0.56 #QF 0.56 assign (resid 32 and name HN ) (resid 32 and name HB2 ) 2.61 0.81 0.81 !peak 770 #SUP 0.98 #QF 0.98 assign (resid 32 and name HN ) (resid 32 and name HB1 ) 2.88 1.08 1.08 !peak 771 #SUP 0.90 #QF 0.90 assign (resid 32 and name HN ) (resid 32 and name HD21 ) 3.50 1.70 1.70 !peak 772 #SUP 1.00 assign (resid 33 and name HN ) (resid 33 and name HB2 ) 2.64 0.84 0.84 !peak 777 #SUP 0.99 #QF 0.99 assign (resid 33 and name HN ) (resid 33 and name HG1 ) 3.23 1.43 1.43 !peak 779 #SUP 1.00 assign (resid 34 and name HN ) (resid 34 and name HB ) 3.06 1.26 1.26 !peak 786 #SUP 1.00 assign (resid 34 and name HN ) (resid 34 and name HG2* ) 2.78 0.98 0.98 !peak 787 #SUP 1.00 assign (resid 34 and name HN ) (resid 34 and name HG11 ) 2.98 1.18 1.18 !peak 788 #SUP 1.00 assign (resid 34 and name HN ) (resid 34 and name HG12 ) 2.92 1.12 1.12 !peak 789 #SUP 1.00 assign (resid 34 and name HN ) (resid 34 and name HD1* ) 3.13 1.33 1.33 !peak 790 #SUP 1.00 assign (resid 35 and name HN ) (resid 35 and name HB1 ) 2.97 1.17 1.17 !peak 794 #SUP 1.00 assign (resid 35 and name HN ) (resid 35 and name HB2 ) 2.58 0.78 0.78 !peak 795 #SUP 0.91 #QF 0.91 assign (resid 35 and name HN ) (resid 35 and name HD2* ) 3.51 1.71 1.71 !peak 797 #SUP 1.00 assign (resid 36 and name HN ) (resid 36 and name HB2 ) 2.95 1.15 1.15 !peak 800 #SUP 0.99 #QF 0.99 assign (resid 36 and name HN ) (resid 36 and name HB1 ) 2.95 1.15 1.15 !peak 801 #SUP 1.00 assign (resid 38 and name HN ) (resid 38 and name HB2 ) 2.98 1.18 1.18 !peak 804 #SUP 0.98 #QF 0.98 assign (resid 38 and name HN ) (resid 38 and name HB1 ) 2.98 1.18 1.18 !peak 805 #SUP 0.98 #QF 0.98 assign (resid 39 and name HN ) (resid 39 and name HG1* ) 3.09 1.29 1.29 !peak 809 #SUP 0.98 #QF 0.98 assign (resid 39 and name HN ) (resid 39 and name HG2* ) 3.09 1.29 1.29 !peak 810 #SUP 1.00 assign (resid 40 and name HN ) (resid 40 and name HB1 ) 2.75 0.95 0.95 !peak 813 #SUP 1.00 assign (resid 40 and name HN ) (resid 40 and name HG ) 3.26 1.46 1.46 !peak 815 #SUP 1.00 assign (resid 40 and name HN ) (resid 40 and name HD1* ) 3.36 1.56 1.56 !peak 816 #SUP 1.00 assign (resid 40 and name HN ) (resid 40 and name HD2* ) 3.36 1.56 1.56 !peak 817 #SUP 1.00 assign (resid 41 and name HN ) (resid 41 and name HB1 ) 2.54 0.74 0.74 !peak 820 #SUP 0.92 #QF 0.92 assign (resid 41 and name HN ) (resid 41 and name HB2 ) 2.72 0.92 0.92 !peak 821 #SUP 0.99 #QF 0.99 assign (resid 42 and name HN ) (resid 42 and name HG2 ) 2.81 1.01 1.01 !peak 826 #SUP 0.95 #QF 0.95 assign (resid 42 and name HN ) (resid 42 and name HB1 ) 2.65 0.85 0.85 !peak 827 #SUP 1.00 #QF 0.97 assign (resid 42 and name HN ) (resid 42 and name HG1 ) 2.81 1.01 1.01 !peak 827 #SUP 1.00 #QF 0.97 assign (resid 43 and name HN ) (resid 43 and name HB ) 2.61 0.81 0.81 !peak 832 #SUP 0.98 #QF 0.98 assign (resid 43 and name HN ) (resid 43 and name HG1* ) 3.10 1.30 1.30 !peak 833 #SUP 1.00 assign (resid 43 and name HN ) (resid 43 and name HG2* ) 3.10 1.30 1.30 !peak 834 #SUP 1.00 assign (resid 44 and name HN ) (resid 44 and name HB1 ) 2.88 1.08 1.08 !peak 837 #SUP 0.99 #QF 0.99 assign (resid 44 and name HN ) (resid 44 and name HB2 ) 3.08 1.28 1.28 !peak 838 #SUP 1.00 assign (resid 44 and name HN ) (resid 44 and name HG2 ) 3.30 1.50 1.50 !peak 839 #SUP 1.00 assign (resid 45 and name HN ) (resid 45 and name HB2 ) 3.00 1.20 1.20 !peak 845 #SUP 0.98 #QF 0.98 assign (resid 45 and name HN ) (resid 45 and name HB1 ) 3.00 1.20 1.20 !peak 846 #SUP 1.00 assign (resid 46 and name HN ) (resid 46 and name HB2 ) 3.02 1.22 1.22 !peak 851 #SUP 1.00 assign (resid 46 and name HN ) (resid 46 and name HB1 ) 3.02 1.22 1.22 !peak 852 #SUP 0.93 #QF 0.93 assign (resid 47 and name HN ) (resid 47 and name HB* ) 2.57 0.77 0.77 !peak 855 #SUP 1.00 assign (resid 48 and name HN ) (resid 48 and name HB2 ) 2.94 1.14 1.14 !peak 858 #SUP 0.99 #QF 0.99 assign (resid 48 and name HN ) (resid 48 and name HG2 ) 3.29 1.49 1.49 !peak 860 #SUP 1.00 assign (resid 48 and name HN ) (resid 48 and name HG1 ) 3.29 1.49 1.49 !peak 861 #SUP 1.00 assign (resid 49 and name HN ) (resid 49 and name HB2 ) 2.75 0.95 0.95 !peak 867 #SUP 0.97 #QF 0.97 assign (resid 50 and name HN ) (resid 50 and name HB2 ) 2.72 0.92 0.92 !peak 872 #SUP 0.98 #QF 0.98 assign (resid 50 and name HN ) (resid 50 and name HB1 ) 3.06 1.26 1.26 !peak 873 #SUP 1.00 assign (resid 50 and name HN ) (resid 50 and name HG ) 2.79 0.99 0.99 !peak 874 #SUP 0.99 #QF 0.99 assign (resid 50 and name HN ) (resid 50 and name HD1* ) 3.27 1.47 1.47 !peak 875 #SUP 1.00 assign (resid 50 and name HN ) (resid 50 and name HD2* ) 3.27 1.47 1.47 !peak 876 #SUP 1.00 assign (resid 51 and name HN ) (resid 51 and name HB1 ) 2.93 1.13 1.13 !peak 879 #SUP 0.99 #QF 0.99 assign (resid 51 and name HN ) (resid 51 and name HB2 ) 2.87 1.07 1.07 !peak 880 #SUP 0.97 #QF 0.97 assign (resid 52 and name HN ) (resid 52 and name HB2 ) 3.03 1.23 1.23 !peak 887 #SUP 1.00 assign (resid 52 and name HN ) (resid 52 and name HB1 ) 3.03 1.23 1.23 !peak 888 #SUP 1.00 assign (resid 52 and name HN ) (resid 52 and name HG1 ) 3.67 1.87 1.87 !peak 890 #SUP 1.00 assign (resid 53 and name HN ) (resid 53 and name HB1 ) 3.02 1.22 1.22 !peak 897 #SUP 1.00 assign (resid 53 and name HN ) (resid 53 and name HG2 ) 3.15 1.35 1.35 !peak 899 #SUP 1.00 assign (resid 53 and name HN ) (resid 53 and name HG1 ) 3.15 1.35 1.35 !peak 900 #SUP 1.00 assign (resid 55 and name HN ) (resid 55 and name HB ) 2.76 0.96 0.96 !peak 905 #SUP 0.99 #QF 0.99 assign (resid 55 and name HN ) (resid 55 and name HG2* ) 3.11 1.31 1.31 !peak 906 #SUP 1.00 assign (resid 55 and name HN ) (resid 55 and name HG11 ) 2.90 1.10 1.10 !peak 907 #SUP 1.00 assign (resid 55 and name HN ) (resid 55 and name HG12 ) 3.13 1.33 1.33 !peak 908 #SUP 1.00 assign (resid 55 and name HN ) (resid 55 and name HD1* ) 3.13 1.33 1.33 !peak 909 #SUP 1.00 assign (resid 56 and name HN ) (resid 56 and name HB2 ) 3.11 1.31 1.31 !peak 912 #SUP 0.99 #QF 0.99 assign (resid 56 and name HN ) (resid 56 and name HB1 ) 3.11 1.31 1.31 !peak 913 #SUP 0.96 #QF 0.96 assign (resid 58 and name HN ) (resid 58 and name HB2 ) 3.04 1.24 1.24 !peak 923 #SUP 0.95 #QF 0.95 assign (resid 58 and name HN ) (resid 58 and name HB1 ) 3.04 1.24 1.24 !peak 924 #SUP 0.99 #QF 0.99 assign (resid 58 and name HN ) (resid 58 and name HG2 ) 3.92 2.12 2.12 !peak 925 #SUP 1.00 assign (resid 59 and name HN ) (resid 59 and name HB ) 2.58 0.78 0.78 !peak 929 #SUP 0.96 #QF 0.96 assign (resid 59 and name HN ) (resid 59 and name HG1* ) 3.15 1.35 1.35 !peak 930 #SUP 1.00 assign (resid 59 and name HN ) (resid 59 and name HG2* ) 3.15 1.35 1.35 !peak 931 #SUP 0.97 #QF 0.97 assign (resid 60 and name HN ) (resid 60 and name HB2 ) 2.92 1.12 1.12 !peak 934 #SUP 1.00 assign (resid 60 and name HN ) (resid 60 and name HG1 ) 3.22 1.42 1.42 !peak 936 #SUP 1.00 assign (resid 60 and name HN ) (resid 60 and name HG2 ) 2.94 1.14 1.14 !peak 937 #SUP 1.00 assign (resid 60 and name HN ) (resid 60 and name HD2 ) 3.13 1.33 1.33 !peak 939 #SUP 0.95 #QF 0.95 assign (resid 60 and name HB2 ) (resid 61 and name HN ) 2.86 1.06 1.06 !peak 945 #SUP 0.99 #QF 0.82 assign (resid 61 and name HN ) (resid 61 and name HB1 ) 2.97 1.17 1.17 !peak 945 #SUP 0.99 #QF 0.82 assign (resid 62 and name HN ) (resid 62 and name HB ) 3.12 1.32 1.32 !peak 952 #SUP 1.00 assign (resid 62 and name HN ) (resid 62 and name HG1* ) 3.25 1.45 1.45 !peak 953 #SUP 0.99 #QF 0.99 assign (resid 62 and name HN ) (resid 62 and name HG2* ) 3.25 1.45 1.45 !peak 954 #SUP 1.00 assign (resid 63 and name HN ) (resid 63 and name HB1 ) 3.07 1.27 1.27 !peak 957 #SUP 1.00 assign (resid 63 and name HN ) (resid 63 and name HB2 ) 2.80 1.00 1.00 !peak 958 #SUP 0.99 #QF 0.99 assign (resid 63 and name HN ) (resid 63 and name HG2 ) 3.63 1.83 1.83 !peak 960 #SUP 0.96 #QF 0.30 assign (resid 63 and name HN ) (resid 63 and name HG1 ) 3.63 1.83 1.83 !peak 960 #SUP 0.96 #QF 0.30 assign (resid 64 and name HN ) (resid 64 and name HB ) 2.80 1.00 1.00 !peak 963 #SUP 0.85 #QF 0.85 assign (resid 64 and name HN ) (resid 64 and name HG2* ) 3.17 1.37 1.37 !peak 965 #SUP 0.99 #QF 0.99 assign (resid 65 and name HN ) (resid 65 and name HB ) 3.20 1.40 1.40 !peak 968 #SUP 0.99 #QF 0.99 assign (resid 65 and name HN ) (resid 65 and name HG2* ) 3.21 1.41 1.41 !peak 969 #SUP 1.00 assign (resid 66 and name HN ) (resid 66 and name HB ) 3.30 1.50 1.50 !peak 972 #SUP 1.00 assign (resid 66 and name HN ) (resid 66 and name HG2* ) 2.80 1.00 1.00 !peak 973 #SUP 0.95 #QF 0.95 assign (resid 67 and name HN ) (resid 67 and name HB2 ) 3.04 1.24 1.24 !peak 976 #SUP 0.99 #QF 0.99 assign (resid 67 and name HN ) (resid 67 and name HB1 ) 2.95 1.15 1.15 !peak 977 #SUP 0.96 #QF 0.96 assign (resid 95 and name HA ) (resid 96 and name HN ) 2.67 0.87 0.87 !peak 982 #SUP 1.00 assign (resid 70 and name HN ) (resid 70 and name HB ) 2.72 0.92 0.92 !peak 989 #SUP 0.88 #QF 0.88 assign (resid 71 and name HN ) (resid 71 and name HB ) 2.84 1.04 1.04 !peak 993 #SUP 0.94 #QF 0.94 assign (resid 72 and name HN ) (resid 72 and name HB2 ) 2.71 0.91 0.91 !peak 999 #SUP 0.98 #QF 0.98 assign (resid 72 and name HN ) (resid 72 and name HD21 ) 3.66 1.86 1.86 !peak 1000 #SUP 1.00 assign (resid 73 and name HN ) (resid 73 and name HB ) 2.86 1.06 1.06 !peak 1004 #SUP 1.00 assign (resid 73 and name HN ) (resid 73 and name HG2* ) 3.41 1.61 1.61 !peak 1006 #SUP 1.00 #QF 0.79 assign (resid 74 and name HN ) (resid 74 and name HB ) 2.67 0.87 0.87 !peak 1009 #SUP 0.97 #QF 0.97 assign (resid 74 and name HN ) (resid 74 and name HG2* ) 3.19 1.39 1.39 !peak 1010 #SUP 1.00 assign (resid 75 and name HN ) (resid 75 and name HB ) 2.84 1.04 1.04 !peak 1013 #SUP 0.89 #QF 0.89 assign (resid 75 and name HN ) (resid 75 and name HG1* ) 3.13 1.33 1.33 !peak 1014 #SUP 1.00 assign (resid 75 and name HN ) (resid 75 and name HG2* ) 3.13 1.33 1.33 !peak 1015 #SUP 1.00 assign (resid 76 and name HN ) (resid 76 and name HB2 ) 2.84 1.04 1.04 !peak 1018 #SUP 1.00 assign (resid 76 and name HN ) (resid 76 and name HB1 ) 2.93 1.13 1.13 !peak 1019 #SUP 1.00 assign (resid 77 and name HN ) (resid 77 and name HB2 ) 2.94 1.14 1.14 !peak 1024 #SUP 1.00 assign (resid 77 and name HN ) (resid 77 and name HG ) 2.90 1.10 1.10 !peak 1025 #SUP 0.58 #QF 0.58 assign (resid 77 and name HN ) (resid 77 and name HD1* ) 3.38 1.58 1.58 !peak 1027 #SUP 1.00 assign (resid 77 and name HN ) (resid 77 and name HD2* ) 3.38 1.58 1.58 !peak 1028 #SUP 1.00 assign (resid 78 and name HN ) (resid 78 and name HB2 ) 3.10 1.30 1.30 !peak 1031 #SUP 0.99 #QF 0.98 assign (resid 78 and name HN ) (resid 78 and name HG2 ) 3.61 1.81 1.81 !peak 1033 #SUP 0.95 #QF 0.95 assign (resid 78 and name HN ) (resid 78 and name HG1 ) 3.61 1.81 1.81 !peak 1034 #SUP 1.00 assign (resid 79 and name HN ) (resid 79 and name HB2 ) 2.79 0.99 0.99 !peak 1038 #SUP 0.91 #QF 0.91 assign (resid 78 and name HG1 ) (resid 79 and name HN ) 3.71 1.91 1.91 !peak 1039 #SUP 1.00 #QF 0.76 assign (resid 80 and name HN ) (resid 80 and name HB ) 2.94 1.14 1.14 !peak 1043 #SUP 0.99 #QF 0.99 assign (resid 81 and name HN ) (resid 81 and name HB ) 2.96 1.16 1.16 !peak 1047 #SUP 0.94 #QF 0.94 assign (resid 81 and name HN ) (resid 81 and name HG2* ) 2.87 1.07 1.07 !peak 1048 #SUP 0.94 #QF 0.94 assign (resid 84 and name HN ) (resid 84 and name HB ) 2.89 1.09 1.09 !peak 1051 #SUP 1.00 assign (resid 84 and name HN ) (resid 84 and name HG2* ) 3.07 1.27 1.27 !peak 1052 #SUP 0.99 #QF 0.99 assign (resid 85 and name HN ) (resid 85 and name HB ) 2.80 1.00 1.00 !peak 1055 #SUP 0.92 #QF 0.92 assign (resid 85 and name HN ) (resid 85 and name HG2* ) 3.18 1.38 1.38 !peak 1056 #SUP 0.99 #QF 0.99 assign (resid 86 and name HN ) (resid 86 and name HG2* ) 3.17 1.37 1.37 !peak 1060 #SUP 1.00 assign (resid 87 and name HN ) (resid 87 and name HB1 ) 3.06 1.26 1.26 !peak 1063 #SUP 1.00 assign (resid 87 and name HN ) (resid 87 and name HB2 ) 2.91 1.11 1.11 !peak 1064 #SUP 0.98 #QF 0.98 assign (resid 88 and name HN ) (resid 88 and name HB ) 3.07 1.27 1.27 !peak 1069 #SUP 0.99 #QF 0.99 assign (resid 89 and name HN ) (resid 89 and name HB ) 2.80 1.00 1.00 !peak 1073 #SUP 0.97 #QF 0.97 assign (resid 89 and name HN ) (resid 89 and name HG2* ) 3.22 1.42 1.42 !peak 1074 #SUP 1.00 assign (resid 90 and name HN ) (resid 90 and name HB2 ) 2.94 1.14 1.14 !peak 1077 #SUP 0.98 #QF 0.98 assign (resid 90 and name HN ) (resid 90 and name HE* ) 3.96 2.16 2.16 !peak 1080 #SUP 1.00 assign (resid 91 and name HN ) (resid 91 and name HB1 ) 3.06 1.26 1.26 !peak 1083 #SUP 1.00 assign (resid 91 and name HN ) (resid 91 and name HB2 ) 2.96 1.16 1.16 !peak 1084 #SUP 0.99 #QF 0.99 assign (resid 91 and name HN ) (resid 91 and name HG1 ) 3.32 1.52 1.52 !peak 1085 #SUP 0.99 #QF 0.99 assign (resid 91 and name HN ) (resid 91 and name HG2 ) 3.44 1.64 1.64 !peak 1086 #SUP 1.00 assign (resid 92 and name HN ) (resid 92 and name HB1 ) 3.23 1.43 1.43 !peak 1089 #SUP 0.89 #QF 0.55 assign (resid 92 and name HN ) (resid 92 and name HB2 ) 3.07 1.27 1.27 !peak 1090 #SUP 1.00 assign (resid 92 and name HN ) (resid 92 and name HG ) 2.92 1.12 1.12 !peak 1091 #SUP 1.00 assign (resid 92 and name HN ) (resid 92 and name HD2* ) 3.42 1.62 1.62 !peak 1093 #SUP 1.00 assign (resid 93 and name HN ) (resid 93 and name HB2 ) 2.78 0.98 0.98 !peak 1096 #SUP 0.97 #QF 0.97 assign (resid 93 and name HN ) (resid 93 and name HB1 ) 2.72 0.92 0.92 !peak 1097 #SUP 0.96 #QF 0.96 assign (resid 93 and name HN ) (resid 93 and name HG1 ) 3.50 1.70 1.70 !peak 1098 #SUP 1.00 assign (resid 93 and name HN ) (resid 93 and name HG2 ) 3.67 1.87 1.87 !peak 1099 #SUP 1.00 assign (resid 94 and name HN ) (resid 94 and name HB2 ) 2.87 1.07 1.07 !peak 1104 #SUP 0.99 #QF 0.99 assign (resid 94 and name HN ) (resid 94 and name HB1 ) 3.04 1.24 1.24 !peak 1105 #SUP 0.95 #QF 0.95 assign (resid 94 and name HN ) (resid 94 and name HE* ) 3.59 1.79 1.79 !peak 1107 #SUP 1.00 assign (resid 95 and name HN ) (resid 95 and name HB2 ) 2.92 1.12 1.12 !peak 1111 #SUP 0.99 #QF 0.99 assign (resid 95 and name HN ) (resid 95 and name HB1 ) 3.07 1.27 1.27 !peak 1112 #SUP 1.00 assign (resid 95 and name HN ) (resid 95 and name HG2 ) 3.87 2.07 2.07 !peak 1114 #SUP 1.00 #QF 0.55 assign (resid 95 and name HN ) (resid 95 and name HG1 ) 3.87 2.07 2.07 !peak 1114 #SUP 1.00 #QF 0.55 assign (resid 96 and name HN ) (resid 96 and name HB ) 3.07 1.27 1.27 !peak 1117 #SUP 1.00 assign (resid 99 and name HN ) (resid 99 and name HB2 ) 3.11 1.31 1.31 !peak 1129 #SUP 0.97 #QF 0.97 assign (resid 99 and name HN ) (resid 99 and name HB1 ) 3.11 1.31 1.31 !peak 1130 #SUP 0.97 #QF 0.97 assign (resid 100 and name HN ) (resid 100 and name HB ) 2.83 1.03 1.03 !peak 1133 #SUP 0.98 #QF 0.98 assign (resid 101 and name HN ) (resid 101 and name HB ) 2.70 0.90 0.90 !peak 1137 #SUP 0.97 #QF 0.97 assign (resid 101 and name HN ) (resid 101 and name HG2* ) 3.11 1.31 1.31 !peak 1138 #SUP 1.00 assign (resid 101 and name HN ) (resid 101 and name HG12 ) 3.23 1.43 1.43 !peak 1139 #SUP 0.99 #QF 0.99 assign (resid 4 and name HD1* ) (resid 101 and name HN ) 3.33 1.53 1.53 !peak 1140 #SUP 1.00 #QF 0.22 assign (resid 101 and name HN ) (resid 101 and name HD1* ) 3.22 1.42 1.42 !peak 1141 #SUP 1.00 assign (resid 102 and name HN ) (resid 102 and name HB1 ) 3.21 1.41 1.41 !peak 1144 #SUP 1.00 assign (resid 102 and name HN ) (resid 102 and name HB2 ) 3.00 1.20 1.20 !peak 1145 #SUP 1.00 assign (resid 102 and name HN ) (resid 102 and name HG2 ) 3.33 1.53 1.53 !peak 1146 #SUP 1.00 assign (resid 103 and name HN ) (resid 103 and name HB2 ) 3.13 1.33 1.33 !peak 1152 #SUP 1.00 #QF 0.61 assign (resid 103 and name HN ) (resid 103 and name HB1 ) 3.13 1.33 1.33 !peak 1153 #SUP 0.99 #QF 0.99 assign (resid 103 and name HN ) (resid 103 and name HG2 ) 3.90 2.10 2.10 !peak 1154 #SUP 0.96 #QF 0.65 assign (resid 103 and name HN ) (resid 104 and name HB ) 4.08 2.28 2.28 !peak 1154 #SUP 0.96 #QF 0.65 assign (resid 103 and name HN ) (resid 103 and name HG1 ) 3.90 2.10 2.10 !peak 1155 #SUP 1.00 assign (resid 95 and name HN ) (resid 104 and name HA ) 3.39 1.59 1.59 !peak 1159 #SUP 1.00 #QF 0.52 assign (resid 104 and name HN ) (resid 104 and name HB ) 2.80 1.00 1.00 !peak 1160 #SUP 0.95 #QF 0.95 assign (resid 104 and name HN ) (resid 104 and name HG1* ) 3.22 1.42 1.42 !peak 1161 #SUP 1.00 assign (resid 104 and name HN ) (resid 104 and name HG2* ) 3.22 1.42 1.42 !peak 1162 #SUP 0.96 #QF 0.96 assign (resid 105 and name HN ) (resid 105 and name HB ) 3.00 1.20 1.20 !peak 1165 #SUP 1.00 assign (resid 106 and name HN ) (resid 106 and name HB ) 3.08 1.28 1.28 !peak 1169 #SUP 1.00 assign (resid 106 and name HN ) (resid 106 and name HG1* ) 3.18 1.38 1.38 !peak 1170 #SUP 1.00 assign (resid 106 and name HN ) (resid 106 and name HG2* ) 3.18 1.38 1.38 !peak 1171 #SUP 0.96 #QF 0.96 assign (resid 107 and name HN ) (resid 107 and name HB ) 3.05 1.25 1.25 !peak 1174 #SUP 0.98 #QF 0.98 assign (resid 107 and name HN ) (resid 107 and name HG2* ) 3.29 1.49 1.49 !peak 1175 #SUP 1.00 assign (resid 108 and name HN ) (resid 108 and name HB1 ) 3.04 1.24 1.24 !peak 1178 #SUP 0.99 #QF 0.99 assign (resid 108 and name HN ) (resid 108 and name HB2 ) 3.09 1.29 1.29 !peak 1179 #SUP 1.00 assign (resid 108 and name HN ) (resid 108 and name HG2 ) 3.64 1.84 1.84 !peak 1180 #SUP 1.00 assign (resid 108 and name HN ) (resid 108 and name HG1 ) 3.64 1.84 1.84 !peak 1181 #SUP 1.00 assign (resid 109 and name HN ) (resid 109 and name HB2 ) 3.07 1.27 1.27 !peak 1186 #SUP 0.99 #QF 0.99 assign (resid 109 and name HN ) (resid 109 and name HB1 ) 3.07 1.27 1.27 !peak 1187 #SUP 0.98 #QF 0.98 assign (resid 113 and name HN ) (resid 113 and name HB2 ) 3.07 1.27 1.27 !peak 1197 #SUP 0.90 #QF 0.90 assign (resid 113 and name HN ) (resid 113 and name HB1 ) 3.07 1.27 1.27 !peak 1199 #SUP 0.91 #QF 0.91 assign (resid 113 and name HN ) (resid 113 and name HD1* ) 3.57 1.77 1.77 !peak 1200 #SUP 1.00 assign (resid 114 and name HN ) (resid 114 and name HB2 ) 3.11 1.31 1.31 !peak 1204 #SUP 1.00 assign (resid 114 and name HN ) (resid 114 and name HB1 ) 3.11 1.31 1.31 !peak 1205 #SUP 0.91 #QF 0.91 assign (resid 114 and name HN ) (resid 114 and name HG2 ) 3.34 1.54 1.54 !peak 1206 #SUP 0.98 #QF 0.98 assign (resid 114 and name HN ) (resid 114 and name HG1 ) 3.34 1.54 1.54 !peak 1207 #SUP 0.93 #QF 0.93 assign (resid 4 and name HN ) (resid 5 and name HN ) 2.99 1.19 1.19 !peak 1208 #SUP 1.00 assign (resid 5 and name HN ) (resid 6 and name HN ) 2.72 0.92 0.92 !peak 1209 #SUP 0.99 #QF 0.99 assign (resid 7 and name HN ) (resid 8 and name HN ) 2.74 0.94 0.94 !peak 1211 #SUP 1.00 assign (resid 9 and name HN ) (resid 10 and name HN ) 2.76 0.96 0.96 !peak 1213 #SUP 1.00 assign (resid 10 and name HN ) (resid 11 and name HN ) 2.87 1.07 1.07 !peak 1214 #SUP 1.00 assign (resid 11 and name HN ) (resid 12 and name HN ) 2.77 0.97 0.97 !peak 1215 #SUP 1.00 assign (resid 12 and name HN ) (resid 13 and name HN ) 2.89 1.09 1.09 !peak 1216 #SUP 0.99 #QF 0.99 assign (resid 14 and name HN ) (resid 15 and name HN ) 2.87 1.07 1.07 !peak 1218 #SUP 0.99 #QF 0.99 assign (resid 26 and name HN ) (resid 27 and name HN ) 2.57 0.77 0.77 !peak 1226 #SUP 1.00 assign (resid 27 and name HN ) (resid 28 and name HN ) 2.81 1.01 1.01 !peak 1227 #SUP 1.00 assign (resid 29 and name HN ) (resid 30 and name HN ) 2.61 0.81 0.81 !peak 1229 #SUP 1.00 assign (resid 30 and name HN ) (resid 31 and name HN ) 2.71 0.91 0.91 !peak 1230 #SUP 1.00 assign (resid 31 and name HN ) (resid 32 and name HN ) 2.76 0.96 0.96 !peak 1231 #SUP 1.00 assign (resid 32 and name HN ) (resid 33 and name HN ) 2.82 1.02 1.02 !peak 1232 #SUP 1.00 assign (resid 32 and name HN ) (resid 35 and name HN ) 3.67 1.87 1.87 !peak 1235 #SUP 1.00 #QF 0.89 assign (resid 38 and name HN ) (resid 39 and name HN ) 2.76 0.96 0.96 !peak 1236 #SUP 0.99 #QF 0.99 assign (resid 39 and name HN ) (resid 40 and name HN ) 2.60 0.80 0.80 !peak 1237 #SUP 0.99 #QF 0.99 assign (resid 41 and name HN ) (resid 42 and name HN ) 2.68 0.88 0.88 !peak 1239 #SUP 0.99 #QF 0.99 assign (resid 42 and name HN ) (resid 43 and name HN ) 2.75 0.95 0.95 !peak 1240 #SUP 1.00 assign (resid 43 and name HN ) (resid 44 and name HN ) 2.86 1.06 1.06 !peak 1241 #SUP 1.00 assign (resid 45 and name HN ) (resid 46 and name HN ) 2.77 0.97 0.97 !peak 1243 #SUP 1.00 assign (resid 47 and name HN ) (resid 48 and name HN ) 2.79 0.99 0.99 !peak 1246 #SUP 1.00 #QF 0.92 assign (resid 48 and name HN ) (resid 49 and name HN ) 2.79 0.99 0.99 !peak 1247 #SUP 1.00 #QF 0.96 assign (resid 49 and name HN ) (resid 50 and name HN ) 2.96 1.16 1.16 !peak 1247 #SUP 1.00 #QF 0.96 assign (resid 50 and name HN ) (resid 51 and name HN ) 2.77 0.97 0.97 !peak 1248 #SUP 0.99 #QF 0.99 assign (resid 52 and name HN ) (resid 53 and name HN ) 2.99 1.19 1.19 !peak 1250 #SUP 0.97 #QF 0.97 assign (resid 57 and name HN ) (resid 58 and name HN ) 4.03 2.23 2.23 !peak 1253 #SUP 1.00 assign (resid 63 and name HN ) (resid 64 and name HN ) 3.60 1.80 1.80 !peak 1259 #SUP 1.00 assign (resid 67 and name HN ) (resid 68 and name HN ) 3.71 1.91 1.91 !peak 1263 #SUP 1.00 assign (resid 71 and name HN ) (resid 72 and name HN ) 3.56 1.76 1.76 !peak 1267 #SUP 1.00 assign (resid 73 and name HN ) (resid 74 and name HN ) 3.53 1.73 1.73 !peak 1269 #SUP 1.00 assign (resid 76 and name HN ) (resid 77 and name HN ) 3.32 1.52 1.52 !peak 1272 #SUP 1.00 assign (resid 79 and name HN ) (resid 86 and name HN ) 3.27 1.47 1.47 !peak 1275 #SUP 0.87 #QF 0.87 assign (resid 85 and name HN ) (resid 86 and name HN ) 3.63 1.83 1.83 !peak 1278 #SUP 1.00 assign (resid 86 and name HN ) (resid 87 and name HN ) 3.62 1.82 1.82 !peak 1279 #SUP 1.00 assign (resid 87 and name HN ) (resid 88 and name HN ) 3.48 1.68 1.68 !peak 1280 #SUP 0.95 #QF 0.95 assign (resid 88 and name HN ) (resid 89 and name HN ) 3.60 1.80 1.80 !peak 1281 #SUP 1.00 assign (resid 89 and name HN ) (resid 90 and name HN ) 3.52 1.72 1.72 !peak 1282 #SUP 1.00 assign (resid 91 and name HN ) (resid 92 and name HN ) 3.42 1.62 1.62 !peak 1284 #SUP 1.00 assign (resid 93 and name HN ) (resid 94 and name HN ) 3.43 1.63 1.63 !peak 1286 #SUP 1.00 assign (resid 94 and name HN ) (resid 95 and name HN ) 3.76 1.96 1.96 !peak 1287 #SUP 1.00 assign (resid 97 and name HN ) (resid 98 and name HN ) 3.44 1.64 1.64 !peak 1290 #SUP 1.00 #QF 0.98 assign (resid 97 and name HN ) (resid 102 and name HN ) 3.57 1.77 1.77 !peak 1290 #SUP 1.00 #QF 0.98 assign (resid 98 and name HN ) (resid 99 and name HN ) 3.86 2.06 2.06 !peak 1291 #SUP 1.00 assign (resid 99 and name HN ) (resid 100 and name HN ) 2.79 0.99 0.99 !peak 1292 #SUP 0.98 #QF 0.98 assign (resid 100 and name HN ) (resid 101 and name HN ) 3.49 1.69 1.69 !peak 1293 #SUP 1.00 assign (resid 95 and name HN ) (resid 103 and name HN ) 3.05 1.25 1.25 !peak 1296 #SUP 0.79 #QF 0.79 assign (resid 104 and name HN ) (resid 105 and name HN ) 3.44 1.64 1.64 !peak 1297 #SUP 1.00 assign (resid 105 and name HN ) (resid 106 and name HN ) 3.70 1.90 1.90 !peak 1298 #SUP 1.00 assign (resid 106 and name HN ) (resid 107 and name HN ) 3.57 1.77 1.77 !peak 1299 #SUP 1.00 assign (resid 108 and name HN ) (resid 109 and name HN ) 3.57 1.77 1.77 !peak 1301 #SUP 1.00 assign (resid 109 and name HN ) (resid 110 and name HN ) 3.64 1.84 1.84 !peak 1302 #SUP 1.00 assign (resid 21 and name HN ) (resid 21 and name HD22 ) 4.35 2.55 2.55 !peak 1305 #SUP 1.00 assign (resid 21 and name HA ) (resid 21 and name HD22 ) 3.92 2.12 2.12 !peak 1306 #SUP 1.00 assign (resid 21 and name HB1 ) (resid 21 and name HD22 ) 3.16 1.36 1.36 !peak 1308 #SUP 1.00 assign (resid 21 and name HD21 ) (resid 24 and name HB1 ) 3.50 1.70 1.70 !peak 1313 #SUP 1.00 assign (resid 32 and name HB1 ) (resid 32 and name HD21 ) 2.81 1.01 1.01 !peak 1320 #SUP 0.95 #QF 0.95 assign (resid 32 and name HN ) (resid 32 and name HD22 ) 4.05 2.25 2.25 !peak 1323 #SUP 1.00 assign (resid 32 and name HA ) (resid 32 and name HD22 ) 3.72 1.92 1.92 !peak 1324 #SUP 0.90 #QF 0.90 assign (resid 32 and name HB2 ) (resid 32 and name HD22 ) 3.06 1.26 1.26 !peak 1325 #SUP 1.00 assign (resid 32 and name HB1 ) (resid 32 and name HD22 ) 3.23 1.43 1.43 !peak 1326 #SUP 1.00 assign (resid 69 and name HA ) (resid 69 and name HD21 ) 3.84 2.04 2.04 !peak 1330 #SUP 1.00 assign (resid 69 and name HA ) (resid 69 and name HD22 ) 3.84 2.04 2.04 !peak 1336 #SUP 1.00 assign (resid 72 and name HB2 ) (resid 72 and name HD21 ) 3.10 1.30 1.30 !peak 1344 #SUP 1.00 assign (resid 72 and name HN ) (resid 72 and name HD22 ) 3.66 1.86 1.86 !peak 1347 #SUP 1.00 assign (resid 72 and name HB2 ) (resid 72 and name HD22 ) 3.10 1.30 1.30 !peak 1350 #SUP 1.00 assign (resid 87 and name HA ) (resid 87 and name HD21 ) 3.67 1.87 1.87 !peak 1354 #SUP 1.00 assign (resid 87 and name HA ) (resid 87 and name HD22 ) 3.67 1.87 1.87 !peak 1360 #SUP 1.00 assign (resid 109 and name HA ) (resid 109 and name HD21 ) 3.79 1.99 1.99 !peak 1366 #SUP 1.00 assign (resid 109 and name HA ) (resid 109 and name HD22 ) 3.79 1.99 1.99 !peak 1372 #SUP 1.00 assign (resid 14 and name HA ) (resid 17 and name HE21 ) 3.79 1.99 1.99 !peak 1410 #SUP 0.93 #QF 0.93 assign (resid 17 and name HB2 ) (resid 17 and name HE21 ) 3.62 1.82 1.82 !peak 1412 #SUP 0.99 #QF 0.99 assign (resid 14 and name HA ) (resid 17 and name HE22 ) 3.79 1.99 1.99 !peak 1418 #SUP 0.93 #QF 0.93 assign (resid 17 and name HB2 ) (resid 17 and name HE22 ) 3.62 1.82 1.82 !peak 1420 #SUP 1.00 assign (resid 28 and name HN ) (resid 28 and name HE21 ) 3.74 1.94 1.94 !peak 1425 #SUP 1.00 assign (resid 28 and name HB1 ) (resid 28 and name HE21 ) 3.22 1.42 1.42 !peak 1429 #SUP 0.99 #QF 0.24 assign (resid 28 and name HG2 ) (resid 28 and name HE21 ) 3.07 1.27 1.27 !peak 1430 #SUP 1.00 assign (resid 28 and name HN ) (resid 28 and name HE22 ) 3.74 1.94 1.94 !peak 1433 #SUP 0.85 #QF 0.85 assign (resid 28 and name HB1 ) (resid 28 and name HE22 ) 3.22 1.42 1.42 !peak 1437 #SUP 1.00 #QF 0.63 assign (resid 28 and name HG2 ) (resid 28 and name HE22 ) 3.07 1.27 1.27 !peak 1438 #SUP 1.00 assign (resid 42 and name HB2 ) (resid 42 and name HE22 ) 3.96 2.16 2.16 !peak 1452 #SUP 1.00 assign (resid 53 and name HB2 ) (resid 53 and name HE21 ) 3.67 1.87 1.87 !peak 1476 #SUP 0.96 #QF 0.96 assign (resid 53 and name HB2 ) (resid 53 and name HE22 ) 3.67 1.87 1.87 !peak 1484 #SUP 1.00 assign (resid 108 and name HB1 ) (resid 108 and name HE21 ) 3.69 1.89 1.89 !peak 1491 #SUP 1.00 assign (resid 108 and name HB2 ) (resid 108 and name HE21 ) 3.70 1.90 1.90 !peak 1492 #SUP 1.00 assign (resid 108 and name HG2 ) (resid 108 and name HE21 ) 3.21 1.41 1.41 !peak 1493 #SUP 1.00 assign (resid 108 and name HG1 ) (resid 108 and name HE21 ) 3.21 1.41 1.41 !peak 1494 #SUP 1.00 assign (resid 108 and name HB1 ) (resid 108 and name HE22 ) 3.69 1.89 1.89 !peak 1499 #SUP 0.99 #QF 0.99 assign (resid 108 and name HB2 ) (resid 108 and name HE22 ) 3.70 1.90 1.90 !peak 1500 #SUP 1.00 assign (resid 108 and name HG2 ) (resid 108 and name HE22 ) 3.21 1.41 1.41 !peak 1501 #SUP 1.00 assign (resid 108 and name HG1 ) (resid 108 and name HE22 ) 3.21 1.41 1.41 !peak 1502 #SUP 1.00 assign (resid 4 and name HN ) (resid 6 and name HN ) 3.71 1.91 1.91 !peak 1515 #SUP 1.00 assign (resid 5 and name HA ) (resid 7 and name HN ) 3.78 1.98 1.98 !peak 1520 #SUP 1.00 assign (resid 5 and name HN ) (resid 7 and name HN ) 3.34 1.54 1.54 !peak 1521 #SUP 1.00 assign (resid 7 and name HN ) (resid 9 and name HN ) 3.42 1.62 1.62 !peak 1523 #SUP 1.00 assign (resid 6 and name HN ) (resid 8 and name HN ) 3.55 1.75 1.74 !peak 1525 #SUP 1.00 assign (resid 5 and name HA ) (resid 8 and name HN ) 3.23 1.43 1.43 !peak 1526 #SUP 1.00 assign (resid 4 and name HA ) (resid 8 and name HN ) 3.38 1.58 1.58 !peak 1527 #SUP 0.89 #QF 0.69 assign (resid 6 and name HA ) (resid 9 and name HN ) 3.06 1.26 1.26 !peak 1531 #SUP 1.00 assign (resid 5 and name HA ) (resid 9 and name HN ) 3.74 1.94 1.94 !peak 1532 #SUP 1.00 assign (resid 9 and name HN ) (resid 11 and name HN ) 3.64 1.84 1.84 !peak 1533 #SUP 1.00 assign (resid 8 and name HN ) (resid 10 and name HN ) 3.57 1.77 1.77 !peak 1535 #SUP 0.89 #QF 0.89 assign (resid 8 and name HA ) (resid 11 and name HN ) 3.32 1.52 1.52 !peak 1541 #SUP 1.00 assign (resid 7 and name HA ) (resid 11 and name HN ) 3.62 1.82 1.82 !peak 1542 #SUP 1.00 assign (resid 10 and name HA ) (resid 12 and name HN ) 3.53 1.73 1.73 !peak 1544 #SUP 1.00 assign (resid 10 and name HN ) (resid 12 and name HN ) 3.45 1.65 1.65 !peak 1545 #SUP 1.00 assign (resid 9 and name HA ) (resid 12 and name HN ) 3.18 1.38 1.38 !peak 1546 #SUP 1.00 assign (resid 8 and name HA ) (resid 12 and name HN ) 3.56 1.76 1.76 !peak 1547 #SUP 1.00 assign (resid 11 and name HN ) (resid 13 and name HN ) 3.92 2.12 2.12 !peak 1550 #SUP 1.00 assign (resid 10 and name HA ) (resid 13 and name HN ) 3.35 1.55 1.55 !peak 1551 #SUP 1.00 assign (resid 9 and name HA ) (resid 13 and name HN ) 3.83 2.03 2.03 !peak 1552 #SUP 1.00 assign (resid 12 and name HN ) (resid 14 and name HN ) 3.48 1.68 1.68 !peak 1555 #SUP 1.00 assign (resid 11 and name HA ) (resid 14 and name HN ) 3.03 1.23 1.23 !peak 1556 #SUP 1.00 assign (resid 13 and name HN ) (resid 15 and name HN ) 3.92 2.12 2.12 !peak 1560 #SUP 1.00 assign (resid 11 and name HA ) (resid 15 and name HN ) 3.44 1.64 1.64 !peak 1562 #SUP 1.00 assign (resid 15 and name HN ) (resid 17 and name HN ) 3.61 1.81 1.81 !peak 1563 #SUP 0.99 #QF 0.99 assign (resid 14 and name HA ) (resid 16 and name HN ) 3.72 1.92 1.92 !peak 1564 #SUP 1.00 assign (resid 14 and name HN ) (resid 16 and name HN ) 3.76 1.96 1.96 !peak 1565 #SUP 1.00 assign (resid 13 and name HA ) (resid 16 and name HN ) 3.37 1.57 1.57 !peak 1566 #SUP 0.99 #QF 0.99 assign (resid 16 and name HN ) (resid 17 and name HN ) 3.00 1.20 1.20 !peak 1568 #SUP 0.99 #QF 0.99 assign (resid 14 and name HA ) (resid 17 and name HN ) 3.00 1.20 1.20 !peak 1571 #SUP 1.00 #QF 0.97 assign (resid 13 and name HA ) (resid 17 and name HN ) 3.76 1.96 1.96 !peak 1572 #SUP 1.00 assign (resid 17 and name HN ) (resid 19 and name HN ) 3.91 2.11 2.11 !peak 1573 #SUP 1.00 #QF 0.98 assign (resid 16 and name HN ) (resid 18 and name HN ) 3.78 1.98 1.97 !peak 1575 #SUP 0.98 #QF 0.98 assign (resid 15 and name HA ) (resid 18 and name HN ) 3.19 1.39 1.39 !peak 1576 #SUP 0.99 #QF 0.99 assign (resid 17 and name HA ) (resid 19 and name HN ) 3.64 1.84 1.84 !peak 1578 #SUP 1.00 assign (resid 18 and name HN ) (resid 19 and name HN ) 2.73 0.93 0.93 !peak 1579 #SUP 1.00 assign (resid 16 and name HA ) (resid 19 and name HN ) 3.06 1.26 1.26 !peak 1580 #SUP 0.95 #QF 0.95 assign (resid 19 and name HN ) (resid 19 and name HB1 ) 3.07 1.27 1.27 !peak 1581 #SUP 0.76 #QF 0.76 assign (resid 26 and name HN ) (resid 28 and name HN ) 3.53 1.73 1.73 !peak 1582 #SUP 1.00 assign (resid 25 and name HA ) (resid 27 and name HN ) 3.83 2.03 2.03 !peak 1583 #SUP 1.00 assign (resid 27 and name HN ) (resid 29 and name HN ) 3.23 1.43 1.43 !peak 1584 #SUP 1.00 assign (resid 25 and name HA ) (resid 28 and name HN ) 3.23 1.43 1.43 !peak 1587 #SUP 1.00 assign (resid 26 and name HA ) (resid 29 and name HN ) 2.92 1.12 1.12 !peak 1591 #SUP 0.98 #QF 0.98 assign (resid 25 and name HA ) (resid 29 and name HN ) 3.41 1.61 1.61 !peak 1592 #SUP 1.00 assign (resid 29 and name HN ) (resid 31 and name HN ) 3.15 1.35 1.35 !peak 1593 #SUP 1.00 assign (resid 28 and name HA ) (resid 30 and name HN ) 3.72 1.92 1.92 !peak 1594 #SUP 0.90 #QF 0.90 assign (resid 30 and name HN ) (resid 30 and name HA ) 2.57 0.77 0.77 !peak 1596 #SUP 0.98 #QF 0.98 assign (resid 30 and name HN ) (resid 32 and name HN ) 3.41 1.61 1.61 !peak 1598 #SUP 1.00 assign (resid 29 and name HA ) (resid 31 and name HN ) 3.46 1.66 1.66 !peak 1599 #SUP 0.95 #QF 0.95 assign (resid 28 and name HA ) (resid 31 and name HN ) 3.19 1.39 1.39 !peak 1601 #SUP 1.00 assign (resid 29 and name HA ) (resid 32 and name HN ) 3.20 1.40 1.40 !peak 1606 #SUP 1.00 assign (resid 31 and name HA ) (resid 33 and name HN ) 3.56 1.76 1.76 !peak 1609 #SUP 1.00 assign (resid 31 and name HN ) (resid 33 and name HN ) 3.69 1.89 1.89 !peak 1610 #SUP 1.00 assign (resid 30 and name HA ) (resid 33 and name HN ) 3.35 1.55 1.55 !peak 1611 #SUP 1.00 assign (resid 29 and name HA ) (resid 33 and name HN ) 4.07 2.27 2.27 !peak 1612 #SUP 1.00 assign (resid 32 and name HA ) (resid 34 and name HN ) 3.78 1.98 1.98 !peak 1613 #SUP 1.00 assign (resid 32 and name HN ) (resid 34 and name HN ) 3.55 1.75 1.75 !peak 1614 #SUP 1.00 assign (resid 31 and name HA ) (resid 34 and name HN ) 3.17 1.37 1.37 !peak 1615 #SUP 1.00 assign (resid 37 and name HA ) (resid 39 and name HN ) 3.98 2.18 2.18 !peak 1618 #SUP 0.93 #QF 0.84 assign (resid 38 and name HA ) (resid 40 and name HN ) 3.91 2.11 2.11 !peak 1620 #SUP 1.00 assign (resid 40 and name HN ) (resid 41 and name HA ) 4.28 2.48 2.48 !peak 1620 #SUP 1.00 assign (resid 38 and name HN ) (resid 40 and name HN ) 3.48 1.68 1.68 !peak 1621 #SUP 1.00 assign (resid 37 and name HA ) (resid 40 and name HN ) 3.18 1.38 1.38 !peak 1622 #SUP 0.85 #QF 0.85 assign (resid 40 and name HN ) (resid 42 and name HN ) 3.42 1.62 1.62 !peak 1623 #SUP 1.00 assign (resid 39 and name HA ) (resid 41 and name HN ) 3.57 1.77 1.77 !peak 1624 #SUP 1.00 assign (resid 39 and name HN ) (resid 41 and name HN ) 3.22 1.42 1.42 !peak 1625 #SUP 1.00 assign (resid 41 and name HN ) (resid 43 and name HN ) 3.38 1.58 1.58 !peak 1628 #SUP 1.00 assign (resid 40 and name HA ) (resid 42 and name HN ) 3.49 1.69 1.69 !peak 1629 #SUP 1.00 assign (resid 39 and name HA ) (resid 42 and name HN ) 3.14 1.34 1.34 !peak 1631 #SUP 1.00 assign (resid 42 and name HN ) (resid 44 and name HN ) 3.76 1.96 1.96 !peak 1633 #SUP 1.00 assign (resid 41 and name HA ) (resid 43 and name HN ) 3.65 1.85 1.85 !peak 1634 #SUP 1.00 assign (resid 40 and name HA ) (resid 43 and name HN ) 3.07 1.27 1.27 !peak 1636 #SUP 0.98 #QF 0.73 assign (resid 39 and name HA ) (resid 43 and name HN ) 3.86 2.06 2.06 !peak 1637 #SUP 1.00 assign (resid 43 and name HN ) (resid 45 and name HN ) 3.15 1.35 1.35 !peak 1638 #SUP 1.00 assign (resid 42 and name HA ) (resid 44 and name HN ) 3.79 1.99 1.99 !peak 1639 #SUP 1.00 assign (resid 40 and name HA ) (resid 44 and name HN ) 3.62 1.82 1.82 !peak 1642 #SUP 0.95 #QF 0.39 assign (resid 43 and name HA ) (resid 45 and name HN ) 3.59 1.79 1.79 !peak 1644 #SUP 1.00 assign (resid 41 and name HA ) (resid 45 and name HN ) 3.69 1.89 1.89 !peak 1647 #SUP 1.00 assign (resid 45 and name HN ) (resid 47 and name HN ) 3.09 1.29 1.28 !peak 1648 #SUP 0.99 #QF 0.99 assign (resid 44 and name HA ) (resid 46 and name HN ) 3.67 1.87 1.87 !peak 1649 #SUP 0.90 #QF 0.90 assign (resid 43 and name HA ) (resid 46 and name HN ) 3.24 1.44 1.44 !peak 1651 #SUP 1.00 assign (resid 46 and name HN ) (resid 48 and name HN ) 3.60 1.80 1.80 !peak 1653 #SUP 1.00 assign (resid 44 and name HA ) (resid 47 and name HN ) 3.10 1.30 1.30 !peak 1656 #SUP 0.99 #QF 0.99 assign (resid 43 and name HA ) (resid 47 and name HN ) 3.76 1.96 1.96 !peak 1657 #SUP 1.00 assign (resid 47 and name HA ) (resid 49 and name HN ) 3.84 2.04 2.04 !peak 1664 #SUP 0.99 #QF 0.99 assign (resid 46 and name HA ) (resid 49 and name HN ) 3.21 1.41 1.41 !peak 1666 #SUP 0.96 #QF 0.96 assign (resid 45 and name HA ) (resid 49 and name HN ) 4.21 2.41 2.41 !peak 1667 #SUP 1.00 assign (resid 49 and name HN ) (resid 51 and name HN ) 3.17 1.37 1.37 !peak 1668 #SUP 0.97 #QF 0.97 assign (resid 48 and name HA ) (resid 50 and name HN ) 3.83 2.03 2.03 !peak 1669 #SUP 0.97 #QF 0.97 assign (resid 47 and name HA ) (resid 50 and name HN ) 3.36 1.56 1.56 !peak 1671 #SUP 0.99 #QF 0.99 assign (resid 46 and name HA ) (resid 50 and name HN ) 3.93 2.13 2.13 !peak 1672 #SUP 0.99 #QF 0.99 assign (resid 49 and name HA ) (resid 51 and name HN ) 3.48 1.68 1.68 !peak 1674 #SUP 1.00 assign (resid 51 and name HN ) (resid 53 and name HN ) 3.65 1.85 1.85 !peak 1675 #SUP 1.00 assign (resid 50 and name HN ) (resid 52 and name HN ) 4.06 2.26 2.26 !peak 1679 #SUP 0.99 #QF 0.99 assign (resid 5 and name HN ) (resid 6 and name HB2 ) 3.80 2.00 2.00 !peak 6250 #SUP 1.00 assign (resid 6 and name HN ) (resid 7 and name HB* ) 3.68 1.88 1.88 !peak 6256 #SUP 1.00 assign (resid 3 and name HB2 ) (resid 6 and name HN ) 3.89 2.09 2.09 !peak 6258 #SUP 1.00 assign (resid 7 and name HN ) (resid 34 and name HG2* ) 3.70 1.90 1.90 !peak 6274 #SUP 0.83 #QF 0.83 assign (resid 8 and name HN ) (resid 71 and name HG1* ) 4.08 2.28 2.28 !peak 6281 #SUP 0.95 #QF 0.90 assign (resid 8 and name HN ) (resid 71 and name HG2* ) 4.08 2.28 2.28 !peak 6281 #SUP 0.95 #QF 0.90 assign (resid 8 and name HN ) (resid 101 and name HD1* ) 3.56 1.76 1.76 !peak 6282 #SUP 1.00 assign (resid 9 and name HN ) (resid 10 and name HA ) 4.11 2.31 2.31 !peak 6295 #SUP 0.97 #QF 0.97 assign (resid 10 and name HN ) (resid 30 and name HD1* ) 4.20 2.40 2.40 !peak 6314 #SUP 0.96 #QF 0.79 assign (resid 10 and name HN ) (resid 34 and name HG2* ) 4.35 2.55 2.55 !peak 6314 #SUP 0.96 #QF 0.79 assign (resid 10 and name HN ) (resid 11 and name HB* ) 3.56 1.76 1.76 !peak 6329 #SUP 0.97 #QF 0.97 assign (resid 10 and name HE21 ) (resid 30 and name HD2* ) 3.67 1.87 1.87 !peak 6334 #SUP 0.84 #QF 0.33 assign (resid 10 and name HE21 ) (resid 30 and name HD1* ) 3.65 1.85 1.85 !peak 6335 #SUP 0.88 #QF 0.88 assign (resid 10 and name HE22 ) (resid 30 and name HD1* ) 3.65 1.85 1.85 !peak 6336 #SUP 0.97 #QF 0.96 assign (resid 10 and name HE22 ) (resid 30 and name HD2* ) 3.67 1.87 1.87 !peak 6337 #SUP 0.94 #QF 0.44 assign (resid 11 and name HN ) (resid 12 and name HB* ) 3.61 1.81 1.81 !peak 6338 #SUP 1.00 assign (resid 11 and name HN ) (resid 34 and name HG11 ) 3.88 2.08 2.08 !peak 6338 #SUP 1.00 assign (resid 8 and name HB* ) (resid 11 and name HN ) 3.71 1.91 1.91 !peak 6339 #SUP 0.97 #QF 0.97 assign (resid 11 and name HN ) (resid 30 and name HD1* ) 3.37 1.57 1.57 !peak 6340 #SUP 0.89 #QF 0.63 assign (resid 11 and name HN ) (resid 31 and name HD2* ) 3.67 1.87 1.87 !peak 6340 #SUP 0.89 #QF 0.63 assign (resid 11 and name HN ) (resid 34 and name HD1* ) 3.26 1.46 1.46 !peak 6341 #SUP 0.89 #QF 0.89 assign (resid 12 and name HN ) (resid 13 and name HB ) 4.14 2.34 2.34 !peak 6351 #SUP 1.00 #QF 0.99 assign (resid 12 and name HN ) (resid 13 and name HG11 ) 3.85 2.05 2.05 !peak 6352 #SUP 1.00 assign (resid 8 and name HB* ) (resid 12 and name HN ) 3.88 2.08 2.08 !peak 6353 #SUP 0.96 #QF 0.96 assign (resid 12 and name HN ) (resid 73 and name HG2* ) 3.48 1.68 1.68 !peak 6354 #SUP 0.80 #QF 0.80 assign (resid 12 and name HN ) (resid 34 and name HD1* ) 3.68 1.88 1.88 !peak 6355 #SUP 0.96 #QF 0.69 assign (resid 12 and name HN ) (resid 15 and name HD1* ) 3.40 1.60 1.60 !peak 6356 #SUP 0.99 #QF 0.99 assign (resid 14 and name HN ) (resid 15 and name HD1* ) 4.08 2.28 2.28 !peak 6397 #SUP 0.97 #QF 0.92 assign (resid 15 and name HN ) (resid 31 and name HD2* ) 3.15 1.35 1.35 !peak 6427 #SUP 1.00 assign (resid 17 and name HE21 ) (resid 27 and name HB* ) 3.80 2.00 2.00 !peak 6452 #SUP 0.87 #QF 0.87 assign (resid 13 and name HG2* ) (resid 17 and name HE21 ) 3.48 1.68 1.68 !peak 6453 #SUP 0.99 #QF 0.99 assign (resid 17 and name HE22 ) (resid 27 and name HB* ) 3.80 2.00 2.00 !peak 6455 #SUP 0.87 #QF 0.87 assign (resid 13 and name HG2* ) (resid 17 and name HE22 ) 3.48 1.68 1.68 !peak 6456 #SUP 0.88 #QF 0.88 assign (resid 18 and name HN ) (resid 31 and name HD1* ) 3.91 2.11 2.11 !peak 6457 #SUP 1.00 assign (resid 18 and name HN ) (resid 27 and name HB* ) 3.26 1.46 1.46 !peak 6460 #SUP 0.90 #QF 0.90 assign (resid 19 and name HE1 ) (resid 47 and name HB* ) 3.57 1.77 1.77 !peak 6469 #SUP 1.00 assign (resid 19 and name HE1 ) (resid 43 and name HG2* ) 3.55 1.75 1.75 !peak 6470 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 19 and name HE1 ) 3.06 1.26 1.26 !peak 6471 #SUP 0.97 #QF 0.97 assign (resid 19 and name HN ) (resid 20 and name HB1 ) 3.95 2.15 2.15 !peak 6474 #SUP 0.97 #QF 0.97 assign (resid 15 and name HG2* ) (resid 19 and name HN ) 3.60 1.80 1.80 !peak 6475 #SUP 0.96 #QF 0.96 assign (resid 19 and name HE1 ) (resid 43 and name HB ) 4.04 2.24 2.24 !peak 6476 #SUP 0.99 #QF 0.99 assign (resid 19 and name HE1 ) (resid 47 and name HN ) 3.52 1.72 1.72 !peak 6481 #SUP 1.00 assign (resid 17 and name HA ) (resid 20 and name HN ) 3.22 1.42 1.42 !peak 6483 #SUP 0.98 #QF 0.98 assign (resid 17 and name HA ) (resid 21 and name HN ) 3.65 1.85 1.85 !peak 6491 #SUP 0.73 #QF 0.73 assign (resid 21 and name HN ) (resid 22 and name HD2 ) 3.64 1.84 1.84 !peak 6492 #SUP 0.99 #QF 0.99 assign (resid 21 and name HN ) (resid 22 and name HD1 ) 3.31 1.51 1.51 !peak 6493 #SUP 1.00 assign (resid 21 and name HD21 ) (resid 24 and name HB2 ) 3.50 1.70 1.70 !peak 6497 #SUP 0.86 #QF 0.86 assign (resid 21 and name HD22 ) (resid 23 and name HB ) 3.53 1.73 1.73 !peak 6498 #SUP 0.97 #QF 0.39 assign (resid 21 and name HD22 ) (resid 24 and name HA ) 3.63 1.83 1.83 !peak 6498 #SUP 0.97 #QF 0.39 assign (resid 21 and name HD21 ) (resid 24 and name HA ) 3.47 1.67 1.67 !peak 6499 #SUP 0.98 #QF 0.98 assign (resid 21 and name HB2 ) (resid 23 and name HN ) 4.03 2.23 2.23 !peak 6511 #SUP 0.99 #QF 0.95 assign (resid 21 and name HA ) (resid 23 and name HN ) 3.55 1.75 1.75 !peak 6513 #SUP 0.97 #QF 0.97 assign (resid 22 and name HA ) (resid 24 and name HN ) 3.35 1.55 1.55 !peak 6514 #SUP 0.97 #QF 0.97 assign (resid 21 and name HA ) (resid 24 and name HN ) 3.92 2.12 2.12 !peak 6516 #SUP 1.00 assign (resid 18 and name HA ) (resid 24 and name HN ) 3.46 1.66 1.66 !peak 6517 #SUP 0.91 #QF 0.91 assign (resid 24 and name HN ) (resid 25 and name HD1 ) 3.60 1.80 1.80 !peak 6518 #SUP 0.97 #QF 0.97 assign (resid 24 and name HN ) (resid 25 and name HD2 ) 3.75 1.95 1.95 !peak 6519 #SUP 0.95 #QF 0.95 assign (resid 21 and name HB1 ) (resid 24 and name HN ) 3.49 1.69 1.69 !peak 6520 #SUP 0.86 #QF 0.86 assign (resid 24 and name HN ) (resid 27 and name HB* ) 3.60 1.80 1.80 !peak 6525 #SUP 0.56 #QF 0.56 assign (resid 26 and name HN ) (resid 27 and name HB* ) 3.56 1.76 1.76 !peak 6545 #SUP 0.99 #QF 0.99 assign (resid 25 and name HA ) (resid 28 and name HE21 ) 3.30 1.50 1.50 !peak 6568 #SUP 0.95 #QF 0.95 assign (resid 23 and name HA ) (resid 28 and name HE21 ) 3.61 1.81 1.81 !peak 6569 #SUP 0.94 #QF 0.94 assign (resid 25 and name HA ) (resid 28 and name HE22 ) 3.30 1.50 1.50 !peak 6571 #SUP 0.96 #QF 0.96 assign (resid 29 and name HN ) (resid 30 and name HB1 ) 3.72 1.92 1.92 !peak 6590 #SUP 0.98 #QF 0.98 assign (resid 29 and name HN ) (resid 30 and name HG ) 3.70 1.90 1.90 !peak 6591 #SUP 0.60 #QF 0.60 assign (resid 14 and name HB* ) (resid 30 and name HN ) 3.83 2.03 2.03 !peak 6599 #SUP 0.97 #QF 0.97 assign (resid 31 and name HN ) (resid 34 and name HN ) 3.84 2.04 2.04 !peak 6612 #SUP 0.83 #QF 0.83 assign (resid 14 and name HB* ) (resid 31 and name HN ) 3.32 1.52 1.52 !peak 6618 #SUP 1.00 assign (resid 29 and name HA ) (resid 32 and name HD21 ) 3.34 1.54 1.54 !peak 6632 #SUP 0.93 #QF 0.93 assign (resid 32 and name HN ) (resid 33 and name HB2 ) 3.58 1.78 1.78 !peak 6634 #SUP 0.95 #QF 0.95 assign (resid 30 and name HB2 ) (resid 32 and name HN ) 4.13 2.33 2.33 !peak 6635 #SUP 0.94 #QF 0.94 assign (resid 28 and name HA ) (resid 32 and name HN ) 3.71 1.91 1.91 !peak 6636 #SUP 1.00 assign (resid 30 and name HA ) (resid 32 and name HN ) 3.59 1.79 1.79 !peak 6638 #SUP 0.68 #QF 0.68 assign (resid 32 and name HN ) (resid 33 and name HA ) 3.90 2.10 2.10 !peak 6639 #SUP 0.78 #QF 0.78 assign (resid 32 and name HD21 ) (resid 40 and name HD1* ) 3.89 2.09 2.09 !peak 6646 #SUP 0.90 #QF 0.79 assign (resid 32 and name HD21 ) (resid 40 and name HD2* ) 3.89 2.09 2.09 !peak 6646 #SUP 0.90 #QF 0.79 assign (resid 33 and name HN ) (resid 34 and name HG2* ) 3.29 1.49 1.49 !peak 6655 #SUP 0.95 #QF 0.95 assign (resid 31 and name HA ) (resid 35 and name HN ) 3.19 1.39 1.39 !peak 6664 #SUP 0.97 #QF 0.97 assign (resid 33 and name HB2 ) (resid 35 and name HN ) 4.00 2.20 2.20 !peak 6669 #SUP 0.74 #QF 0.74 assign (resid 33 and name HN ) (resid 35 and name HN ) 3.29 1.49 1.49 !peak 6673 #SUP 1.00 assign (resid 36 and name HN ) (resid 101 and name HG2* ) 3.72 1.92 1.92 !peak 6679 #SUP 0.55 #QF 0.55 assign (resid 36 and name HN ) (resid 39 and name HG2* ) 3.23 1.43 1.43 !peak 6680 #SUP 0.99 #QF 0.99 assign (resid 36 and name HN ) (resid 100 and name HG2* ) 3.78 1.98 1.98 !peak 6681 #SUP 0.75 #QF 0.75 assign (resid 36 and name HN ) (resid 39 and name HN ) 3.45 1.65 1.65 !peak 6683 #SUP 1.00 assign (resid 36 and name HN ) (resid 37 and name HD1 ) 3.96 2.16 2.16 !peak 6691 #SUP 0.63 #QF 0.63 assign (resid 36 and name HA ) (resid 38 and name HN ) 3.41 1.61 1.61 !peak 6710 #SUP 0.99 #QF 0.99 assign (resid 35 and name HB1 ) (resid 39 and name HN ) 3.72 1.92 1.92 !peak 6714 #SUP 1.00 assign (resid 37 and name HB2 ) (resid 39 and name HN ) 4.35 2.55 2.55 !peak 6715 #SUP 0.92 #QF 0.63 assign (resid 39 and name HN ) (resid 42 and name HB1 ) 4.35 2.55 2.55 !peak 6715 #SUP 0.92 #QF 0.63 assign (resid 36 and name HB1 ) (resid 38 and name HN ) 3.40 1.60 1.60 !peak 6722 #SUP 1.00 assign (resid 38 and name HN ) (resid 41 and name HN ) 3.71 1.91 1.91 !peak 6739 #SUP 0.96 #QF 0.96 assign (resid 41 and name HN ) (resid 42 and name HA ) 3.88 2.08 2.08 !peak 6743 #SUP 0.90 #QF 0.90 assign (resid 41 and name HN ) (resid 42 and name HB1 ) 3.94 2.14 2.14 !peak 6760 #SUP 0.94 #QF 0.71 assign (resid 39 and name HB ) (resid 41 and name HN ) 3.96 2.16 2.16 !peak 6761 #SUP 0.97 #QF 0.97 assign (resid 46 and name HN ) (resid 47 and name HB* ) 3.45 1.65 1.65 !peak 6802 #SUP 0.99 #QF 0.99 assign (resid 45 and name HA ) (resid 48 and name HN ) 3.26 1.46 1.46 !peak 6829 #SUP 1.00 assign (resid 47 and name HB* ) (resid 49 and name HN ) 3.65 1.85 1.85 !peak 6837 #SUP 0.94 #QF 0.94 assign (resid 49 and name HN ) (resid 50 and name HB2 ) 3.90 2.10 2.10 !peak 6838 #SUP 0.95 #QF 0.95 assign (resid 53 and name HB2 ) (resid 55 and name HN ) 3.34 1.54 1.54 !peak 6847 #SUP 0.98 #QF 0.98 assign (resid 53 and name HB1 ) (resid 55 and name HN ) 3.59 1.79 1.79 !peak 6848 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 55 and name HN ) 4.22 2.42 2.42 !peak 6849 #SUP 0.86 #QF 0.86 assign (resid 53 and name HA ) (resid 55 and name HN ) 4.06 2.26 2.26 !peak 6871 #SUP 0.99 #QF 0.99 assign (resid 56 and name HN ) (resid 80 and name HB ) 3.35 1.55 1.55 !peak 6873 #SUP 0.89 #QF 0.89 assign (resid 58 and name HN ) (resid 77 and name HB1 ) 3.46 1.66 1.66 !peak 6890 #SUP 0.98 #QF 0.34 assign (resid 58 and name HN ) (resid 77 and name HD1* ) 4.06 2.26 2.26 !peak 6891 #SUP 0.86 #QF 0.86 assign (resid 58 and name HN ) (resid 77 and name HD2* ) 4.06 2.26 2.26 !peak 6892 #SUP 0.99 #QF 0.99 assign (resid 58 and name HN ) (resid 78 and name HA ) 3.94 2.14 2.14 !peak 6894 #SUP 0.96 #QF 0.54 assign (resid 58 and name HN ) (resid 79 and name HA ) 4.11 2.31 2.31 !peak 6894 #SUP 0.96 #QF 0.54 assign (resid 58 and name HN ) (resid 78 and name HN ) 2.91 1.11 1.11 !peak 6896 #SUP 0.98 #QF 0.98 assign (resid 60 and name HN ) (resid 77 and name HD2* ) 3.99 2.19 2.19 !peak 6925 #SUP 0.99 #QF 0.99 assign (resid 60 and name HN ) (resid 77 and name HA ) 2.87 1.07 1.07 !peak 6926 #SUP 0.99 #QF 0.99 assign (resid 59 and name HA ) (resid 61 and name HN ) 3.23 1.43 1.43 !peak 6937 #SUP 0.90 #QF 0.90 assign (resid 61 and name HN ) (resid 76 and name HB1 ) 2.96 1.16 1.16 !peak 6942 #SUP 0.89 #QF 0.89 assign (resid 63 and name HN ) (resid 74 and name HB ) 3.09 1.29 1.28 !peak 6949 #SUP 0.99 #QF 0.99 assign (resid 63 and name HN ) (resid 74 and name HG2* ) 3.38 1.58 1.58 !peak 6953 #SUP 0.99 #QF 0.99 assign (resid 63 and name HN ) (resid 74 and name HA ) 3.78 1.98 1.97 !peak 6962 #SUP 0.95 #QF 0.95 assign (resid 63 and name HN ) (resid 64 and name HA ) 3.80 2.00 2.00 !peak 6963 #SUP 0.98 #QF 0.98 assign (resid 65 and name HN ) (resid 73 and name HA ) 3.09 1.29 1.28 !peak 6974 #SUP 0.94 #QF 0.94 assign (resid 65 and name HN ) (resid 71 and name HA ) 4.13 2.33 2.33 !peak 6975 #SUP 1.00 assign (resid 5 and name HG2* ) (resid 66 and name HN ) 3.80 2.00 2.00 !peak 6978 #SUP 0.61 #QF 0.61 assign (resid 67 and name HN ) (resid 71 and name HA ) 3.13 1.33 1.33 !peak 6986 #SUP 0.98 #QF 0.98 assign (resid 67 and name HN ) (resid 72 and name HN ) 3.53 1.73 1.73 !peak 6994 #SUP 1.00 assign (resid 70 and name HG2* ) (resid 96 and name HN ) 3.45 1.65 1.65 !peak 7002 #SUP 0.93 #QF 0.93 assign (resid 71 and name HN ) (resid 94 and name HB1 ) 3.84 2.04 2.04 !peak 7014 #SUP 1.00 assign (resid 71 and name HN ) (resid 94 and name HB2 ) 3.12 1.32 1.32 !peak 7016 #SUP 0.99 #QF 0.99 assign (resid 71 and name HN ) (resid 93 and name HA ) 3.79 1.99 1.99 !peak 7017 #SUP 0.99 #QF 0.99 assign (resid 71 and name HN ) (resid 95 and name HA ) 3.37 1.57 1.57 !peak 7018 #SUP 0.94 #QF 0.94 assign (resid 66 and name HG2* ) (resid 72 and name HN ) 3.62 1.82 1.82 !peak 7029 #SUP 1.00 assign (resid 63 and name HN ) (resid 74 and name HN ) 2.82 1.02 1.02 !peak 7043 #SUP 0.68 #QF 0.68 assign (resid 65 and name HN ) (resid 73 and name HN ) 3.90 2.10 2.10 !peak 7046 #SUP 1.00 assign (resid 73 and name HN ) (resid 94 and name HD* ) 3.68 1.88 1.88 !peak 7048 #SUP 1.00 assign (resid 73 and name HN ) (resid 93 and name HA ) 3.21 1.41 1.41 !peak 7049 #SUP 0.89 #QF 0.89 assign (resid 64 and name HA ) (resid 73 and name HN ) 4.11 2.31 2.31 !peak 7050 #SUP 0.83 #QF 0.29 assign (resid 73 and name HN ) (resid 91 and name HA ) 4.26 2.46 2.46 !peak 7050 #SUP 0.83 #QF 0.29 assign (resid 73 and name HN ) (resid 92 and name HB1 ) 3.92 2.12 2.12 !peak 7051 #SUP 1.00 assign (resid 73 and name HN ) (resid 93 and name HG1 ) 3.83 2.03 2.03 !peak 7052 #SUP 0.87 #QF 0.87 assign (resid 73 and name HN ) (resid 92 and name HB2 ) 3.38 1.58 1.58 !peak 7053 #SUP 0.98 #QF 0.98 assign (resid 63 and name HB2 ) (resid 74 and name HN ) 3.30 1.50 1.50 !peak 7060 #SUP 0.98 #QF 0.98 assign (resid 75 and name HN ) (resid 90 and name HB2 ) 3.30 1.50 1.50 !peak 7069 #SUP 0.93 #QF 0.93 assign (resid 76 and name HN ) (resid 77 and name HG ) 3.94 2.14 2.14 !peak 7073 #SUP 0.87 #QF 0.30 assign (resid 74 and name HG2* ) (resid 76 and name HN ) 3.64 1.84 1.84 !peak 7074 #SUP 0.93 #QF 0.93 assign (resid 61 and name HN ) (resid 76 and name HN ) 2.92 1.12 1.12 !peak 7078 #SUP 1.00 assign (resid 77 and name HN ) (resid 88 and name HN ) 3.26 1.46 1.46 !peak 7080 #SUP 0.91 #QF 0.91 assign (resid 59 and name HA ) (resid 78 and name HN ) 3.40 1.60 1.60 !peak 7091 #SUP 0.99 #QF 0.99 assign (resid 77 and name HN ) (resid 89 and name HG2* ) 3.52 1.72 1.72 !peak 7113 #SUP 1.00 assign (resid 57 and name HB2 ) (resid 78 and name HN ) 3.63 1.83 1.83 !peak 7114 #SUP 0.91 #QF 0.91 assign (resid 79 and name HN ) (resid 80 and name HA ) 4.24 2.44 2.43 !peak 7133 #SUP 1.00 #QF 0.96 assign (resid 79 and name HN ) (resid 85 and name HA ) 4.35 2.55 2.55 !peak 7133 #SUP 1.00 #QF 0.96 assign (resid 79 and name HN ) (resid 85 and name HG2* ) 3.61 1.81 1.81 !peak 7136 #SUP 0.98 #QF 0.98 assign (resid 57 and name HA ) (resid 80 and name HN ) 3.36 1.56 1.56 !peak 7138 #SUP 0.97 #QF 0.97 assign (resid 80 and name HA ) (resid 84 and name HN ) 3.90 2.10 2.10 !peak 7151 #SUP 0.95 #QF 0.88 assign (resid 84 and name HN ) (resid 85 and name HA ) 4.21 2.41 2.41 !peak 7151 #SUP 0.95 #QF 0.88 assign (resid 80 and name HG2* ) (resid 84 and name HN ) 3.23 1.43 1.43 !peak 7158 #SUP 0.91 #QF 0.91 assign (resid 81 and name HN ) (resid 84 and name HN ) 3.13 1.33 1.33 !peak 7160 #SUP 0.99 #QF 0.99 assign (resid 57 and name HB1 ) (resid 80 and name HN ) 3.59 1.79 1.79 !peak 7171 #SUP 0.94 #QF 0.94 assign (resid 56 and name HB1 ) (resid 80 and name HN ) 3.77 1.97 1.97 !peak 7172 #SUP 0.90 #QF 0.90 assign (resid 76 and name HG1 ) (resid 87 and name HD21 ) 3.96 2.16 2.16 !peak 7175 #SUP 0.98 #QF 0.98 assign (resid 76 and name HG2 ) (resid 87 and name HD21 ) 3.96 2.16 2.16 !peak 7176 #SUP 0.99 #QF 0.91 assign (resid 60 and name HB1 ) (resid 87 and name HD21 ) 4.35 2.55 2.55 !peak 7178 #SUP 0.84 #QF 0.61 assign (resid 60 and name HD1 ) (resid 87 and name HD21 ) 4.35 2.55 2.55 !peak 7178 #SUP 0.84 #QF 0.61 assign (resid 76 and name HG2 ) (resid 87 and name HD22 ) 3.96 2.16 2.16 !peak 7180 #SUP 0.99 #QF 0.80 assign (resid 78 and name HG1 ) (resid 87 and name HD22 ) 3.87 2.07 2.07 !peak 7180 #SUP 0.99 #QF 0.80 assign (resid 77 and name HB2 ) (resid 88 and name HN ) 3.68 1.88 1.88 !peak 7184 #SUP 1.00 assign (resid 77 and name HB1 ) (resid 88 and name HN ) 4.19 2.39 2.39 !peak 7185 #SUP 1.00 assign (resid 86 and name HG2* ) (resid 88 and name HN ) 3.91 2.11 2.11 !peak 7186 #SUP 0.97 #QF 0.97 assign (resid 79 and name HN ) (resid 88 and name HN ) 3.00 1.20 1.20 !peak 7187 #SUP 0.60 #QF 0.60 assign (resid 91 and name HN ) (resid 106 and name HA ) 3.78 1.98 1.97 !peak 7202 #SUP 0.60 #QF 0.60 assign (resid 91 and name HN ) (resid 108 and name HA ) 3.19 1.39 1.39 !peak 7203 #SUP 0.92 #QF 0.92 assign (resid 91 and name HN ) (resid 107 and name HG2* ) 3.36 1.56 1.56 !peak 7211 #SUP 0.96 #QF 0.96 assign (resid 75 and name HG2* ) (resid 90 and name HN ) 3.77 1.97 1.97 !peak 7216 #SUP 0.99 #QF 0.99 assign (resid 75 and name HG1* ) (resid 90 and name HN ) 3.77 1.97 1.97 !peak 7217 #SUP 0.80 #QF 0.80 assign (resid 73 and name HB ) (resid 92 and name HN ) 3.25 1.45 1.45 !peak 7223 #SUP 1.00 assign (resid 73 and name HG2* ) (resid 92 and name HN ) 3.72 1.92 1.92 !peak 7226 #SUP 1.00 #QF 0.49 assign (resid 73 and name HG1* ) (resid 92 and name HN ) 3.55 1.75 1.75 !peak 7227 #SUP 0.99 #QF 0.99 assign (resid 93 and name HN ) (resid 105 and name HN ) 2.90 1.10 1.10 !peak 7278 #SUP 0.99 #QF 0.99 assign (resid 70 and name HG2* ) (resid 94 and name HN ) 3.17 1.37 1.37 !peak 7285 #SUP 0.94 #QF 0.94 assign (resid 94 and name HN ) (resid 101 and name HG2* ) 3.90 2.10 2.10 !peak 7286 #SUP 0.94 #QF 0.94 assign (resid 71 and name HN ) (resid 94 and name HN ) 3.02 1.22 1.22 !peak 7310 #SUP 1.00 assign (resid 95 and name HN ) (resid 101 and name HG2* ) 3.18 1.38 1.38 !peak 7326 #SUP 1.00 assign (resid 97 and name HN ) (resid 101 and name HA ) 3.27 1.47 1.47 !peak 7331 #SUP 0.97 #QF 0.97 assign (resid 4 and name HD1* ) (resid 99 and name HN ) 4.15 2.35 2.35 !peak 7364 #SUP 0.91 #QF 0.91 assign (resid 4 and name HD1* ) (resid 100 and name HN ) 3.53 1.73 1.73 !peak 7366 #SUP 0.88 #QF 0.88 assign (resid 96 and name HB ) (resid 100 and name HN ) 4.07 2.27 2.27 !peak 7370 #SUP 0.68 #QF 0.68 assign (resid 98 and name HA2 ) (resid 100 and name HN ) 3.72 1.92 1.92 !peak 7371 #SUP 0.99 #QF 0.99 assign (resid 97 and name HN ) (resid 100 and name HN ) 3.20 1.40 1.40 !peak 7373 #SUP 0.68 #QF 0.68 assign (resid 96 and name HA ) (resid 102 and name HN ) 3.13 1.33 1.33 !peak 7392 #SUP 0.88 #QF 0.88 assign (resid 101 and name HA ) (resid 103 and name HN ) 3.10 1.30 1.30 !peak 7411 #SUP 0.97 #QF 0.97 assign (resid 94 and name HA ) (resid 103 and name HN ) 3.73 1.93 1.93 !peak 7414 #SUP 1.00 assign (resid 101 and name HG2* ) (resid 103 and name HN ) 2.73 0.93 0.93 !peak 7419 #SUP 0.85 #QF 0.85 assign (resid 101 and name HD1* ) (resid 103 and name HN ) 4.23 2.43 2.43 !peak 7421 #SUP 0.84 #QF 0.28 assign (resid 92 and name HA ) (resid 105 and name HN ) 3.45 1.65 1.65 !peak 7444 #SUP 0.91 #QF 0.91 assign (resid 94 and name HA ) (resid 105 and name HN ) 3.37 1.57 1.57 !peak 7445 #SUP 0.94 #QF 0.94 assign (resid 91 and name HB2 ) (resid 107 and name HN ) 3.54 1.74 1.74 !peak 7450 #SUP 0.90 #QF 0.90 assign (resid 92 and name HG ) (resid 107 and name HN ) 3.44 1.64 1.64 !peak 7451 #SUP 0.94 #QF 0.94 assign (resid 92 and name HA ) (resid 107 and name HN ) 3.19 1.39 1.39 !peak 7455 #SUP 0.92 #QF 0.92 assign (resid 88 and name HG2* ) (resid 108 and name HE22 ) 3.13 1.33 1.33 !peak 7467 #SUP 0.99 #QF 0.99 assign (resid 88 and name HG2* ) (resid 108 and name HE21 ) 3.13 1.33 1.33 !peak 7468 #SUP 0.94 #QF 0.94 assign (resid 91 and name HG1 ) (resid 109 and name HD22 ) 3.59 1.79 1.79 !peak 7470 #SUP 0.99 #QF 0.99 assign (resid 89 and name HG2* ) (resid 109 and name HD22 ) 3.65 1.85 1.85 !peak 7473 #SUP 0.99 #QF 0.99 assign (resid 90 and name HA ) (resid 109 and name HN ) 3.12 1.32 1.32 !peak 7480 #SUP 0.97 #QF 0.97 assign (resid 19 and name HE1 ) (resid 43 and name HA ) 3.43 1.63 1.63 !peak 7550 #SUP 0.94 #QF 0.94 assign (resid 19 and name HE1 ) (resid 46 and name HB1 ) 3.67 1.87 1.87 !peak 7551 #SUP 0.90 #QF 0.90 assign (resid 19 and name HE1 ) (resid 46 and name HB2 ) 3.67 1.87 1.87 !peak 7553 #SUP 0.93 #QF 0.93 assign (resid 3 and name HA ) (resid 5 and name HN ) 3.37 1.57 1.57 !peak 7558 #SUP 0.79 #QF 0.79 assign (resid 5 and name HN ) (resid 66 and name HG2* ) 3.61 1.81 1.81 !peak 7562 #SUP 0.96 #QF 0.96 assign (resid 3 and name HA ) (resid 6 and name HN ) 3.82 2.02 2.02 !peak 7578 #SUP 0.97 #QF 0.97 assign (resid 9 and name HN ) (resid 12 and name HB* ) 3.89 2.09 2.09 !peak 7587 #SUP 0.96 #QF 0.96 assign (resid 9 and name HB1 ) (resid 11 and name HN ) 3.86 2.06 2.06 !peak 7600 #SUP 0.99 #QF 0.99 assign (resid 16 and name HD* ) (resid 19 and name HN ) 3.95 2.15 2.15 !peak 7619 #SUP 0.94 #QF 0.91 assign (resid 19 and name HN ) (resid 19 and name HE3 ) 4.24 2.44 2.43 !peak 7619 #SUP 0.94 #QF 0.91 assign (resid 36 and name HN ) (resid 102 and name HN ) 4.35 2.55 2.55 !peak 7632 #SUP 0.89 #QF 0.22 assign (resid 36 and name HN ) (resid 102 and name HA ) 3.22 1.42 1.42 !peak 7633 #SUP 0.81 #QF 0.81 assign (resid 56 and name HN ) (resid 80 and name HG2* ) 3.97 2.17 2.17 !peak 7643 #SUP 0.80 #QF 0.80 assign (resid 56 and name HN ) (resid 81 and name HG2* ) 3.96 2.16 2.16 !peak 7644 #SUP 0.98 #QF 0.98 assign (resid 60 and name HN ) (resid 77 and name HD1* ) 3.99 2.19 2.19 !peak 7654 #SUP 0.73 #QF 0.73 assign (resid 61 and name HN ) (resid 76 and name HG1 ) 3.89 2.09 2.09 !peak 7663 #SUP 0.93 #QF 0.93 assign (resid 63 and name HN ) (resid 76 and name HN ) 4.16 2.36 2.36 !peak 7666 #SUP 0.68 #QF 0.68 assign (resid 65 and name HN ) (resid 72 and name HN ) 2.96 1.16 1.16 !peak 7669 #SUP 0.97 #QF 0.97 assign (resid 66 and name HA ) (resid 72 and name HN ) 3.00 1.20 1.20 !peak 7673 #SUP 1.00 assign (resid 70 and name HG2* ) (resid 72 and name HD21 ) 3.60 1.80 1.80 !peak 7674 #SUP 0.98 #QF 0.98 assign (resid 70 and name HG2* ) (resid 72 and name HD22 ) 3.60 1.80 1.80 !peak 7675 #SUP 0.96 #QF 0.96 assign (resid 64 and name HA ) (resid 74 and name HN ) 3.06 1.26 1.26 !peak 7686 #SUP 0.98 #QF 0.98 assign (resid 75 and name HN ) (resid 91 and name HA ) 3.21 1.41 1.41 !peak 7687 #SUP 0.97 #QF 0.97 assign (resid 75 and name HN ) (resid 89 and name HA ) 3.83 2.03 2.03 !peak 7688 #SUP 0.98 #QF 0.98 assign (resid 60 and name HN ) (resid 76 and name HN ) 3.44 1.64 1.64 !peak 7689 #SUP 0.95 #QF 0.95 assign (resid 77 and name HN ) (resid 89 and name HA ) 2.99 1.19 1.19 !peak 7700 #SUP 0.97 #QF 0.97 assign (resid 77 and name HN ) (resid 87 and name HA ) 4.22 2.42 2.42 !peak 7701 #SUP 0.99 #QF 0.99 assign (resid 78 and name HA ) (resid 87 and name HD21 ) 3.70 1.90 1.90 !peak 7731 #SUP 0.99 #QF 0.99 assign (resid 78 and name HA ) (resid 87 and name HD22 ) 3.70 1.90 1.90 !peak 7732 #SUP 1.00 assign (resid 78 and name HA ) (resid 88 and name HN ) 3.05 1.25 1.25 !peak 7738 #SUP 0.91 #QF 0.91 assign (resid 2 and name HB2 ) (resid 3 and name HN ) 4.25 2.45 2.45 !peak 7763 #SUP 1.00 #QF 0.99 assign (resid 2 and name HB1 ) (resid 3 and name HN ) 4.25 2.45 2.45 !peak 7763 #SUP 1.00 #QF 0.99 assign (resid 4 and name HN ) (resid 7 and name HN ) 3.84 2.04 2.04 !peak 7766 #SUP 0.96 #QF 0.96 assign (resid 15 and name HN ) (resid 31 and name HD1* ) 3.17 1.37 1.37 !peak 7768 #SUP 0.95 #QF 0.95 assign (resid 86 and name HN ) (resid 86 and name HB ) 3.03 1.23 1.23 !peak 7772 #SUP 0.95 #QF 0.95 assign (resid 85 and name HB ) (resid 86 and name HN ) 3.39 1.59 1.59 !peak 7773 #SUP 1.00 assign (resid 55 and name HG2* ) (resid 80 and name HN ) 3.34 1.54 1.54 !peak 7774 #SUP 0.95 #QF 0.95 assign (resid 36 and name HN ) (resid 101 and name HN ) 4.35 2.55 2.55 !peak 7781 #SUP 0.95 #QF 0.95 assign (resid 10 and name HB2 ) (resid 12 and name HN ) 4.35 2.55 2.55 !peak 7803 #SUP 1.00 #QF 0.85 assign (resid 10 and name HB1 ) (resid 12 and name HN ) 4.35 2.55 2.55 !peak 7803 #SUP 1.00 #QF 0.85 assign (resid 15 and name HG2* ) (resid 18 and name HN ) 3.86 2.06 2.06 !peak 7852 #SUP 0.93 #QF 0.93 assign (resid 24 and name HB1 ) (resid 27 and name HN ) 3.57 1.77 1.77 !peak 7886 #SUP 0.99 #QF 0.99 assign (resid 24 and name HB2 ) (resid 27 and name HN ) 3.57 1.77 1.77 !peak 7887 #SUP 1.00 assign (resid 27 and name HN ) (resid 28 and name HA ) 4.06 2.26 2.26 !peak 7888 #SUP 1.00 assign (resid 25 and name HD2 ) (resid 27 and name HN ) 3.80 2.00 2.00 !peak 7889 #SUP 0.87 #QF 0.87 assign (resid 5 and name HG2* ) (resid 67 and name HN ) 4.35 2.55 2.55 !peak 7898 #SUP 0.98 #QF 0.44 assign (resid 39 and name HN ) (resid 40 and name HB1 ) 3.70 1.90 1.90 !peak 7966 #SUP 0.99 #QF 0.99 assign (resid 22 and name HB1 ) (resid 48 and name HN ) 3.71 1.91 1.91 !peak 8032 #SUP 0.89 #QF 0.89 assign (resid 50 and name HB1 ) (resid 53 and name HN ) 4.31 2.51 2.51 !peak 8061 #SUP 0.99 #QF 0.99 assign (resid 53 and name HN ) (resid 55 and name HG11 ) 4.32 2.52 2.52 !peak 8062 #SUP 1.00 #QF 0.91 assign (resid 53 and name HN ) (resid 55 and name HD1* ) 3.97 2.17 2.17 !peak 8070 #SUP 0.97 #QF 0.97 assign (resid 54 and name HN ) (resid 55 and name HN ) 3.35 1.55 1.55 !peak 8092 #SUP 0.97 #QF 0.97 assign (resid 56 and name HN ) (resid 80 and name HN ) 3.27 1.47 1.47 !peak 8093 #SUP 0.99 #QF 0.99 assign (resid 56 and name HN ) (resid 56 and name HD2 ) 3.94 2.14 2.14 !peak 8094 #SUP 1.00 assign (resid 56 and name HN ) (resid 79 and name HB1 ) 4.01 2.21 2.21 !peak 8098 #SUP 0.97 #QF 0.97 assign (resid 57 and name HD* ) (resid 59 and name HN ) 3.70 1.90 1.90 !peak 8118 #SUP 0.98 #QF 0.98 assign (resid 71 and name HN ) (resid 94 and name HD* ) 3.73 1.93 1.93 !peak 8166 #SUP 0.93 #QF 0.93 assign (resid 4 and name HG2* ) (resid 71 and name HN ) 3.68 1.88 1.88 !peak 8178 #SUP 0.62 #QF 0.29 assign (resid 8 and name HB* ) (resid 71 and name HN ) 3.99 2.19 2.19 !peak 8178 #SUP 0.62 #QF 0.29 assign (resid 71 and name HN ) (resid 93 and name HG2 ) 3.79 1.99 1.99 !peak 8179 #SUP 0.92 #QF 0.92 assign (resid 65 and name HG2* ) (resid 72 and name HN ) 3.68 1.88 1.88 !peak 8186 #SUP 0.97 #QF 0.97 assign (resid 75 and name HN ) (resid 92 and name HN ) 3.56 1.76 1.76 !peak 8196 #SUP 0.90 #QF 0.90 assign (resid 16 and name HE* ) (resid 75 and name HN ) 4.24 2.44 2.43 !peak 8199 #SUP 1.00 #QF 0.96 assign (resid 16 and name HZ ) (resid 75 and name HN ) 4.35 2.55 2.55 !peak 8199 #SUP 1.00 #QF 0.96 assign (resid 75 and name HN ) (resid 90 and name HD* ) 4.06 2.26 2.26 !peak 8200 #SUP 1.00 assign (resid 75 and name HN ) (resid 91 and name HG2 ) 3.92 2.12 2.12 !peak 8204 #SUP 0.97 #QF 0.97 assign (resid 76 and name HN ) (resid 89 and name HA ) 3.87 2.07 2.07 !peak 8238 #SUP 1.00 assign (resid 77 and name HN ) (resid 90 and name HD* ) 3.65 1.85 1.85 !peak 8247 #SUP 1.00 assign (resid 78 and name HN ) (resid 87 and name HA ) 3.93 2.13 2.13 !peak 8261 #SUP 0.97 #QF 0.97 assign (resid 60 and name HD1 ) (resid 78 and name HN ) 3.46 1.66 1.66 !peak 8283 #SUP 0.94 #QF 0.91 assign (resid 60 and name HN ) (resid 78 and name HN ) 3.43 1.63 1.63 !peak 8295 #SUP 0.76 #QF 0.76 assign (resid 89 and name HN ) (resid 90 and name HD* ) 3.66 1.86 1.86 !peak 8318 #SUP 0.99 #QF 0.99 assign (resid 89 and name HN ) (resid 90 and name HE* ) 3.78 1.98 1.97 !peak 8319 #SUP 0.97 #QF 0.97 assign (resid 89 and name HN ) (resid 109 and name HN ) 3.54 1.74 1.74 !peak 8335 #SUP 0.98 #QF 0.98 assign (resid 10 and name HN ) (resid 12 and name HB* ) 3.75 1.95 1.95 !peak 8400 #SUP 0.99 #QF 0.99 assign (resid 10 and name HN ) (resid 13 and name HD1* ) 3.44 1.64 1.64 !peak 8403 #SUP 0.99 #QF 0.99 assign (resid 12 and name HN ) (resid 15 and name HN ) 3.83 2.03 2.03 !peak 8413 #SUP 0.80 #QF 0.80 assign (resid 13 and name HG2* ) (resid 17 and name HN ) 3.76 1.96 1.96 !peak 8444 #SUP 0.99 #QF 0.99 assign (resid 19 and name HA ) (resid 19 and name HE1 ) 3.81 2.01 2.01 !peak 8465 #SUP 0.96 #QF 0.96 assign (resid 21 and name HD22 ) (resid 23 and name HG2* ) 3.87 2.07 2.07 !peak 8473 #SUP 0.44 #QF 0.44 assign (resid 21 and name HD22 ) (resid 22 and name HD2 ) 4.17 2.37 2.37 !peak 8476 #SUP 0.96 #QF 0.72 assign (resid 21 and name HD22 ) (resid 25 and name HD2 ) 4.34 2.54 2.54 !peak 8476 #SUP 0.96 #QF 0.72 assign (resid 21 and name HD22 ) (resid 25 and name HD1 ) 3.99 2.19 2.19 !peak 8477 #SUP 0.89 #QF 0.89 assign (resid 22 and name HB2 ) (resid 24 and name HN ) 3.82 2.02 2.02 !peak 8508 #SUP 0.99 #QF 0.99 assign (resid 24 and name HN ) (resid 28 and name HB1 ) 4.35 2.55 2.55 !peak 8509 #SUP 0.81 #QF 0.81 assign (resid 24 and name HB1 ) (resid 26 and name HN ) 3.92 2.12 2.12 !peak 8516 #SUP 0.98 #QF 0.98 assign (resid 24 and name HB2 ) (resid 26 and name HN ) 3.92 2.12 2.12 !peak 8517 #SUP 0.96 #QF 0.96 assign (resid 30 and name HN ) (resid 31 and name HG ) 3.65 1.85 1.85 !peak 8528 #SUP 0.99 #QF 0.99 assign (resid 89 and name HB ) (resid 109 and name HD21 ) 3.83 2.03 2.03 !peak 8554 #SUP 0.95 #QF 0.95 assign (resid 91 and name HB1 ) (resid 109 and name HD21 ) 4.06 2.26 2.26 !peak 8556 #SUP 0.99 #QF 0.99 assign (resid 91 and name HG1 ) (resid 109 and name HD21 ) 3.59 1.79 1.79 !peak 8558 #SUP 0.81 #QF 0.81 assign (resid 32 and name HA ) (resid 32 and name HD21 ) 3.64 1.84 1.84 !peak 8564 #SUP 1.00 assign (resid 34 and name HN ) (resid 35 and name HB2 ) 3.61 1.81 1.81 !peak 8567 #SUP 0.85 #QF 0.85 assign (resid 32 and name HA ) (resid 35 and name HN ) 3.26 1.46 1.46 !peak 8568 #SUP 0.96 #QF 0.96 assign (resid 18 and name HB1 ) (resid 44 and name HN ) 3.99 2.19 2.19 !peak 8591 #SUP 0.99 #QF 0.60 assign (resid 44 and name HN ) (resid 46 and name HN ) 3.75 1.95 1.95 !peak 8623 #SUP 1.00 assign (resid 43 and name HN ) (resid 46 and name HN ) 3.86 2.06 2.06 !peak 8624 #SUP 0.76 #QF 0.76 assign (resid 51 and name HB1 ) (resid 51 and name HE22 ) 3.84 2.04 2.04 !peak 8659 #SUP 1.00 assign (resid 22 and name HG2 ) (resid 51 and name HE22 ) 3.72 1.92 1.92 !peak 8660 #SUP 0.83 #QF 0.83 assign (resid 51 and name HN ) (resid 52 and name HB2 ) 3.76 1.96 1.96 !peak 8661 #SUP 0.91 #QF 0.91 assign (resid 51 and name HB1 ) (resid 51 and name HE21 ) 3.84 2.04 2.04 !peak 8663 #SUP 1.00 assign (resid 53 and name HN ) (resid 54 and name HN ) 3.56 1.76 1.76 !peak 8675 #SUP 0.98 #QF 0.98 assign (resid 50 and name HA ) (resid 53 and name HN ) 3.56 1.76 1.76 !peak 8676 #SUP 0.99 #QF 0.98 assign (resid 53 and name HE22 ) (resid 55 and name HD1* ) 3.69 1.89 1.89 !peak 8684 #SUP 1.00 assign (resid 58 and name HN ) (resid 80 and name HN ) 4.35 2.55 2.55 !peak 8701 #SUP 0.97 #QF 0.97 assign (resid 57 and name HB2 ) (resid 59 and name HN ) 4.14 2.34 2.34 !peak 8707 #SUP 0.99 #QF 0.99 assign (resid 61 and name HN ) (resid 62 and name HA ) 4.06 2.26 2.26 !peak 8719 #SUP 1.00 assign (resid 61 and name HN ) (resid 75 and name HA ) 4.26 2.46 2.46 !peak 8719 #SUP 1.00 assign (resid 61 and name HN ) (resid 76 and name HA ) 3.73 1.93 1.93 !peak 8720 #SUP 1.00 assign (resid 61 and name HN ) (resid 77 and name HA ) 3.62 1.82 1.82 !peak 8721 #SUP 1.00 assign (resid 61 and name HN ) (resid 76 and name HG2 ) 3.89 2.09 2.09 !peak 8726 #SUP 1.00 assign (resid 61 and name HN ) (resid 76 and name HB2 ) 3.52 1.72 1.72 !peak 8727 #SUP 0.83 #QF 0.83 assign (resid 62 and name HN ) (resid 63 and name HG2 ) 4.34 2.54 2.54 !peak 8732 #SUP 0.91 #QF 0.31 assign (resid 62 and name HN ) (resid 63 and name HG1 ) 4.34 2.54 2.54 !peak 8732 #SUP 0.91 #QF 0.31 assign (resid 65 and name HN ) (resid 74 and name HN ) 3.60 1.80 1.80 !peak 8748 #SUP 0.95 #QF 0.95 assign (resid 66 and name HN ) (resid 72 and name HN ) 3.79 1.99 1.99 !peak 8749 #SUP 1.00 assign (resid 65 and name HN ) (resid 66 and name HG2* ) 3.82 2.02 2.02 !peak 8751 #SUP 0.92 #QF 0.92 assign (resid 65 and name HN ) (resid 73 and name HB ) 4.35 2.55 2.55 !peak 8752 #SUP 0.81 #QF 0.81 assign (resid 66 and name HN ) (resid 71 and name HA ) 3.96 2.16 2.16 !peak 8762 #SUP 1.00 assign (resid 67 and name HB1 ) (resid 70 and name HN ) 3.82 2.02 2.02 !peak 8776 #SUP 0.91 #QF 0.91 assign (resid 71 and name HN ) (resid 96 and name HN ) 3.80 2.00 2.00 !peak 8782 #SUP 0.76 #QF 0.76 assign (resid 74 and name HN ) (resid 92 and name HN ) 4.05 2.25 2.25 !peak 8802 #SUP 0.99 #QF 0.99 assign (resid 64 and name HN ) (resid 74 and name HN ) 3.99 2.19 2.19 !peak 8803 #SUP 0.99 #QF 0.99 assign (resid 77 and name HN ) (resid 88 and name HG2* ) 3.69 1.89 1.89 !peak 8814 #SUP 0.99 #QF 0.99 assign (resid 77 and name HN ) (resid 90 and name HB2 ) 4.06 2.26 2.26 !peak 8816 #SUP 0.99 #QF 0.99 assign (resid 79 and name HN ) (resid 88 and name HG2* ) 3.90 2.10 2.10 !peak 8827 #SUP 0.97 #QF 0.97 assign (resid 56 and name HB2 ) (resid 80 and name HN ) 3.77 1.97 1.97 !peak 8844 #SUP 0.98 #QF 0.98 assign (resid 79 and name HB2 ) (resid 88 and name HN ) 4.09 2.29 2.29 !peak 8875 #SUP 0.74 #QF 0.74 assign (resid 89 and name HN ) (resid 108 and name HG1 ) 3.89 2.09 2.09 !peak 8880 #SUP 0.88 #QF 0.88 assign (resid 89 and name HN ) (resid 108 and name HG2 ) 3.89 2.09 2.09 !peak 8881 #SUP 0.98 #QF 0.98 assign (resid 89 and name HN ) (resid 90 and name HB2 ) 4.35 2.55 2.55 !peak 8884 #SUP 0.73 #QF 0.73 assign (resid 76 and name HN ) (resid 90 and name HN ) 4.14 2.34 2.34 !peak 8893 #SUP 1.00 #QF 0.88 assign (resid 90 and name HN ) (resid 109 and name HN ) 4.34 2.54 2.54 !peak 8893 #SUP 1.00 #QF 0.88 assign (resid 16 and name HE* ) (resid 90 and name HN ) 4.35 2.55 2.55 !peak 8894 #SUP 1.00 #QF 0.49 assign (resid 16 and name HZ ) (resid 90 and name HN ) 4.35 2.55 2.55 !peak 8894 #SUP 1.00 #QF 0.49 assign (resid 91 and name HN ) (resid 92 and name HG ) 3.64 1.84 1.84 !peak 8910 #SUP 0.92 #QF 0.92 assign (resid 72 and name HA ) (resid 92 and name HN ) 4.09 2.29 2.29 !peak 8919 #SUP 0.81 #QF 0.81 assign (resid 93 and name HN ) (resid 104 and name HA ) 3.78 1.98 1.97 !peak 8924 #SUP 0.98 #QF 0.98 assign (resid 70 and name HB ) (resid 94 and name HN ) 4.35 2.55 2.55 !peak 8932 #SUP 1.00 assign (resid 94 and name HD* ) (resid 95 and name HN ) 3.57 1.77 1.77 !peak 8940 #SUP 1.00 assign (resid 94 and name HB2 ) (resid 95 and name HN ) 3.50 1.70 1.70 !peak 8942 #SUP 0.99 #QF 0.99 assign (resid 95 and name HN ) (resid 103 and name HD2 ) 4.35 2.55 2.55 !peak 8950 #SUP 0.92 #QF 0.78 assign (resid 103 and name HD2 ) (resid 104 and name HN ) 4.35 2.55 2.55 !peak 8950 #SUP 0.92 #QF 0.78 assign (resid 70 and name HG2* ) (resid 95 and name HN ) 3.93 2.13 2.13 !peak 8953 #SUP 0.98 #QF 0.98 assign (resid 70 and name HA ) (resid 96 and name HN ) 3.19 1.39 1.39 !peak 8964 #SUP 0.90 #QF 0.90 assign (resid 97 and name HN ) (resid 101 and name HG2* ) 3.99 2.19 2.19 !peak 8967 #SUP 0.96 #QF 0.96 assign (resid 97 and name HN ) (resid 100 and name HG2* ) 4.10 2.30 2.30 !peak 8968 #SUP 0.86 #QF 0.86 assign (resid 97 and name HN ) (resid 101 and name HB ) 4.35 2.55 2.55 !peak 8970 #SUP 0.91 #QF 0.85 assign (resid 97 and name HN ) (resid 102 and name HB1 ) 4.35 2.55 2.55 !peak 8970 #SUP 0.91 #QF 0.85 assign (resid 93 and name HG2 ) (resid 105 and name HN ) 4.33 2.53 2.53 !peak 9012 #SUP 0.81 #QF 0.81 assign (resid 90 and name HD* ) (resid 107 and name HN ) 3.71 1.91 1.91 !peak 9016 #SUP 0.98 #QF 0.98 assign (resid 90 and name HB1 ) (resid 107 and name HN ) 3.82 2.02 2.02 !peak 9018 #SUP 0.99 #QF 0.99 assign (resid 90 and name HD* ) (resid 108 and name HN ) 3.82 2.02 2.02 !peak 9028 #SUP 0.99 #QF 0.99 assign (resid 107 and name HG2* ) (resid 109 and name HN ) 3.74 1.94 1.94 !peak 9034 #SUP 0.96 #QF 0.96 assign (resid 89 and name HG2* ) (resid 109 and name HN ) 3.86 2.06 2.06 !peak 9035 #SUP 1.00 assign (resid 88 and name HG2* ) (resid 109 and name HN ) 3.84 2.04 2.04 !peak 9036 #SUP 0.98 #QF 0.98 assign (resid 107 and name HG2* ) (resid 109 and name HD21 ) 3.78 1.98 1.98 !peak 9037 #SUP 0.95 #QF 0.95 assign (resid 107 and name HG2* ) (resid 109 and name HD22 ) 3.78 1.98 1.98 !peak 9038 #SUP 0.85 #QF 0.85 assign (resid 89 and name HB ) (resid 109 and name HD22 ) 3.83 2.03 2.03 !peak 9039 #SUP 1.00 assign (resid 89 and name HB ) (resid 109 and name HN ) 3.80 2.00 2.00 !peak 9040 #SUP 1.00 assign (resid 91 and name HN ) (resid 109 and name HN ) 3.57 1.77 1.77 !peak 9041 #SUP 0.99 #QF 0.99 assign (resid 109 and name HB2 ) (resid 110 and name HN ) 3.96 2.16 2.16 !peak 9045 #SUP 1.00 assign (resid 21 and name HD21 ) (resid 24 and name HN ) 3.15 1.35 1.35 !peak 9062 #SUP 0.86 #QF 0.86 assign (resid 60 and name HG2 ) (resid 87 and name HD21 ) 4.01 2.21 2.20 !peak 9069 #SUP 0.96 #QF 0.96 assign (resid 85 and name HG2* ) (resid 87 and name HD21 ) 4.16 2.36 2.36 !peak 9070 #SUP 1.00 assign (resid 60 and name HB1 ) (resid 87 and name HD22 ) 4.35 2.55 2.55 !peak 9071 #SUP 0.93 #QF 0.61 assign (resid 60 and name HD1 ) (resid 87 and name HD22 ) 4.35 2.55 2.55 !peak 9071 #SUP 0.93 #QF 0.61 assign (resid 60 and name HG2 ) (resid 87 and name HD22 ) 4.01 2.21 2.20 !peak 9072 #SUP 1.00 assign (resid 85 and name HG2* ) (resid 87 and name HD22 ) 4.16 2.36 2.36 !peak 9073 #SUP 1.00 assign (resid 78 and name HG2 ) (resid 87 and name HD21 ) 3.87 2.07 2.07 !peak 9074 #SUP 0.97 #QF 0.97 assign (resid 78 and name HG2 ) (resid 87 and name HD22 ) 3.87 2.07 2.07 !peak 9075 #SUP 1.00 assign (resid 76 and name HG1 ) (resid 87 and name HD22 ) 3.96 2.16 2.16 !peak 9076 #SUP 1.00 assign (resid 22 and name HD2 ) (resid 51 and name HE22 ) 4.10 2.30 2.30 !peak 9167 #SUP 0.81 #QF 0.81 assign (resid 67 and name HB2 ) (resid 72 and name HD22 ) 3.69 1.89 1.89 !peak 9168 #SUP 0.99 #QF 0.99 assign (resid 67 and name HB2 ) (resid 72 and name HD21 ) 3.69 1.89 1.89 !peak 9169 #SUP 0.98 #QF 0.98 assign (resid 12 and name HB* ) (resid 92 and name HN ) 3.84 2.04 2.04 !peak 9230 #SUP 0.97 #QF 0.97 assign (resid 67 and name HN ) (resid 72 and name HD21 ) 4.12 2.32 2.32 !peak 9245 #SUP 0.94 #QF 0.94 assign (resid 67 and name HN ) (resid 72 and name HD22 ) 4.12 2.32 2.32 !peak 9247 #SUP 0.99 #QF 0.99 assign (resid 93 and name HN ) (resid 106 and name HA ) 3.29 1.49 1.49 !peak 9248 #SUP 0.71 #QF 0.71 assign (resid 4 and name HA ) (resid 4 and name HG2* ) 2.99 1.19 1.19 !peak 1759 #SUP 1.00 assign (resid 4 and name HA ) (resid 4 and name HD1* ) 2.86 1.06 1.06 !peak 1762 #SUP 1.00 assign (resid 4 and name HB ) (resid 4 and name HD1* ) 2.77 0.97 0.97 !peak 1769 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 4 and name HG12 ) 2.98 1.18 1.18 !peak 1774 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 4 and name HG11 ) 2.98 1.18 1.18 !peak 1775 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 4 and name HD1* ) 2.52 0.72 0.72 !peak 1794 #SUP 0.86 #QF 0.86 assign (resid 5 and name HA ) (resid 5 and name HG2* ) 2.57 0.77 0.77 !peak 1802 #SUP 0.99 #QF 0.99 assign (resid 5 and name HN ) (resid 5 and name HG1* ) 3.10 1.30 1.30 !peak 1808 #SUP 1.00 assign (resid 5 and name HA ) (resid 5 and name HG1* ) 2.65 0.85 0.85 !peak 1809 #SUP 0.99 #QF 0.99 assign (resid 9 and name HA ) (resid 9 and name HG2 ) 3.07 1.27 1.27 !peak 1864 #SUP 1.00 assign (resid 9 and name HA ) (resid 9 and name HG1 ) 3.07 1.27 1.27 !peak 1865 #SUP 1.00 assign (resid 9 and name HN ) (resid 9 and name HG2 ) 3.56 1.76 1.76 !peak 1890 #SUP 1.00 assign (resid 9 and name HG1 ) (resid 64 and name HB ) 3.63 1.83 1.83 !peak 1902 #SUP 1.00 assign (resid 9 and name HN ) (resid 9 and name HD1 ) 3.76 1.96 1.96 !peak 1920 #SUP 1.00 assign (resid 9 and name HA ) (resid 9 and name HD2 ) 3.77 1.97 1.97 !peak 1921 #SUP 1.00 #QF 0.80 assign (resid 9 and name HA ) (resid 9 and name HD1 ) 3.95 2.15 2.15 !peak 1921 #SUP 1.00 #QF 0.80 assign (resid 9 and name HB1 ) (resid 9 and name HD1 ) 2.77 0.97 0.97 !peak 1922 #SUP 1.00 #QF 0.79 assign (resid 9 and name HB2 ) (resid 9 and name HD2 ) 2.90 1.10 1.10 !peak 1923 #SUP 0.99 #QF 0.85 assign (resid 9 and name HB2 ) (resid 9 and name HD1 ) 3.06 1.26 1.26 !peak 1923 #SUP 0.99 #QF 0.85 assign (resid 9 and name HB1 ) (resid 9 and name HE2 ) 3.73 1.93 1.93 !peak 1932 #SUP 0.90 #QF 0.90 assign (resid 9 and name HB2 ) (resid 9 and name HE2 ) 3.71 1.91 1.91 !peak 1933 #SUP 1.00 assign (resid 9 and name HG2 ) (resid 9 and name HE2 ) 3.29 1.49 1.49 !peak 1934 #SUP 1.00 assign (resid 9 and name HG1 ) (resid 9 and name HE2 ) 3.29 1.49 1.49 !peak 1935 #SUP 1.00 assign (resid 9 and name HB1 ) (resid 9 and name HE1 ) 3.73 1.93 1.93 !peak 1942 #SUP 1.00 assign (resid 9 and name HB2 ) (resid 9 and name HE1 ) 3.71 1.91 1.91 !peak 1943 #SUP 1.00 assign (resid 9 and name HG2 ) (resid 9 and name HE1 ) 3.29 1.49 1.49 !peak 1944 #SUP 1.00 assign (resid 9 and name HG1 ) (resid 9 and name HE1 ) 3.29 1.49 1.49 !peak 1945 #SUP 1.00 assign (resid 10 and name HA ) (resid 10 and name HG1 ) 3.14 1.34 1.34 !peak 1955 #SUP 1.00 assign (resid 10 and name HA ) (resid 10 and name HG2 ) 3.14 1.34 1.34 !peak 1975 #SUP 1.00 assign (resid 13 and name HA ) (resid 13 and name HG2* ) 2.81 1.01 1.01 !peak 2005 #SUP 1.00 assign (resid 13 and name HA ) (resid 13 and name HD1* ) 3.11 1.31 1.31 !peak 2008 #SUP 1.00 assign (resid 13 and name HG2* ) (resid 13 and name HG12 ) 2.81 1.01 1.01 !peak 2021 #SUP 1.00 assign (resid 13 and name HN ) (resid 13 and name HG11 ) 2.98 1.18 1.18 !peak 2023 #SUP 1.00 assign (resid 13 and name HA ) (resid 13 and name HG11 ) 3.07 1.27 1.27 !peak 2024 #SUP 1.00 assign (resid 13 and name HG2* ) (resid 13 and name HG11 ) 2.80 1.00 1.00 !peak 2026 #SUP 1.00 assign (resid 13 and name HN ) (resid 13 and name HG12 ) 3.14 1.34 1.34 !peak 2030 #SUP 1.00 assign (resid 13 and name HA ) (resid 13 and name HG12 ) 3.04 1.24 1.24 !peak 2031 #SUP 1.00 assign (resid 13 and name HN ) (resid 13 and name HD1* ) 3.14 1.34 1.34 !peak 2037 #SUP 1.00 assign (resid 13 and name HB ) (resid 13 and name HD1* ) 2.76 0.96 0.96 !peak 2039 #SUP 1.00 assign (resid 13 and name HG2* ) (resid 13 and name HD1* ) 2.56 0.76 0.76 !peak 2040 #SUP 0.91 #QF 0.91 assign (resid 15 and name HA ) (resid 15 and name HG2* ) 2.94 1.14 1.14 !peak 2053 #SUP 1.00 assign (resid 15 and name HA ) (resid 15 and name HG12 ) 3.10 1.30 1.30 !peak 2054 #SUP 1.00 assign (resid 15 and name HA ) (resid 15 and name HG11 ) 3.10 1.30 1.30 !peak 2056 #SUP 0.80 #QF 0.80 assign (resid 15 and name HN ) (resid 15 and name HD1* ) 3.11 1.31 1.31 !peak 2085 #SUP 1.00 assign (resid 15 and name HA ) (resid 15 and name HD1* ) 3.20 1.40 1.40 !peak 2086 #SUP 1.00 assign (resid 15 and name HB ) (resid 15 and name HD1* ) 2.75 0.95 0.95 !peak 2087 #SUP 0.99 #QF 0.99 assign (resid 15 and name HG2* ) (resid 15 and name HD1* ) 2.61 0.81 0.81 !peak 2088 #SUP 1.00 assign (resid 18 and name HA ) (resid 18 and name HG ) 3.03 1.23 1.23 !peak 2178 #SUP 1.00 assign (resid 18 and name HN ) (resid 18 and name HD1* ) 3.40 1.60 1.60 !peak 2202 #SUP 1.00 assign (resid 18 and name HA ) (resid 18 and name HD1* ) 3.02 1.22 1.22 !peak 2203 #SUP 0.95 #QF 0.95 assign (resid 18 and name HB2 ) (resid 18 and name HD1* ) 2.96 1.16 1.16 !peak 2204 #SUP 1.00 assign (resid 18 and name HA ) (resid 18 and name HD2* ) 3.02 1.22 1.22 !peak 2210 #SUP 1.00 assign (resid 18 and name HB2 ) (resid 18 and name HD2* ) 2.96 1.16 1.16 !peak 2211 #SUP 1.00 assign (resid 18 and name HB1 ) (resid 18 and name HD2* ) 2.94 1.14 1.14 !peak 2212 #SUP 1.00 assign (resid 20 and name HA ) (resid 20 and name HD2 ) 4.25 2.45 2.45 !peak 2303 #SUP 1.00 #QF 0.75 assign (resid 20 and name HA ) (resid 20 and name HD1 ) 4.25 2.45 2.45 !peak 2303 #SUP 1.00 #QF 0.75 assign (resid 20 and name HA ) (resid 20 and name HE2 ) 4.35 2.55 2.55 !peak 2377 #SUP 0.93 #QF 0.35 assign (resid 20 and name HA ) (resid 20 and name HE1 ) 4.35 2.55 2.55 !peak 2377 #SUP 0.93 #QF 0.35 assign (resid 21 and name HA ) (resid 21 and name HD21 ) 3.49 1.69 1.69 !peak 2391 #SUP 1.00 assign (resid 23 and name HN ) (resid 23 and name HG2* ) 2.84 1.04 1.04 !peak 2461 #SUP 1.00 assign (resid 23 and name HA ) (resid 23 and name HG2* ) 2.49 0.69 0.69 !peak 2462 #SUP 0.87 #QF 0.87 assign (resid 26 and name HA ) (resid 29 and name HG2 ) 3.60 1.80 1.80 !peak 2530 #SUP 1.00 assign (resid 45 and name HA ) (resid 45 and name HG2 ) 3.13 1.33 1.33 !peak 2531 #SUP 1.00 assign (resid 26 and name HN ) (resid 26 and name HB1 ) 3.07 1.27 1.27 !peak 2538 #SUP 1.00 assign (resid 26 and name HA ) (resid 26 and name HG2 ) 3.12 1.32 1.32 !peak 2545 #SUP 1.00 assign (resid 26 and name HA ) (resid 26 and name HG1 ) 3.12 1.32 1.32 !peak 2551 #SUP 1.00 assign (resid 28 and name HN ) (resid 28 and name HG1 ) 3.03 1.23 1.23 !peak 2586 #SUP 1.00 assign (resid 28 and name HA ) (resid 28 and name HG1 ) 3.21 1.41 1.41 !peak 2587 #SUP 1.00 assign (resid 28 and name HA ) (resid 28 and name HG2 ) 3.13 1.33 1.33 !peak 2595 #SUP 1.00 assign (resid 29 and name HA ) (resid 29 and name HG2 ) 3.15 1.35 1.35 !peak 2607 #SUP 1.00 assign (resid 29 and name HA ) (resid 29 and name HG1 ) 2.91 1.11 1.11 !peak 2621 #SUP 0.95 #QF 0.95 assign (resid 29 and name HB2 ) (resid 29 and name HG1 ) 2.41 0.61 0.61 !peak 2622 #SUP 0.94 #QF 0.94 assign (resid 29 and name HN ) (resid 29 and name HG2 ) 3.44 1.64 1.64 !peak 2626 #SUP 1.00 assign (resid 30 and name HA ) (resid 30 and name HD2* ) 3.39 1.59 1.59 !peak 2638 #SUP 1.00 assign (resid 30 and name HB1 ) (resid 30 and name HD1* ) 2.93 1.13 1.13 !peak 2644 #SUP 1.00 assign (resid 30 and name HN ) (resid 30 and name HB2 ) 3.03 1.23 1.23 !peak 2646 #SUP 1.00 assign (resid 30 and name HB2 ) (resid 30 and name HD2* ) 3.09 1.29 1.28 !peak 2652 #SUP 1.00 assign (resid 27 and name HA ) (resid 30 and name HG ) 2.90 1.10 1.10 !peak 2654 #SUP 0.97 #QF 0.97 assign (resid 30 and name HB2 ) (resid 30 and name HD1* ) 2.75 0.95 0.95 !peak 2664 #SUP 1.00 #QF 0.65 assign (resid 27 and name HA ) (resid 30 and name HD2* ) 2.84 1.04 1.04 !peak 2668 #SUP 0.96 #QF 0.96 assign (resid 30 and name HB1 ) (resid 30 and name HD2* ) 2.76 0.96 0.96 !peak 2669 #SUP 1.00 assign (resid 31 and name HA ) (resid 35 and name HB2 ) 3.27 1.47 1.47 !peak 2676 #SUP 1.00 assign (resid 31 and name HA ) (resid 31 and name HG ) 3.07 1.27 1.27 !peak 2678 #SUP 1.00 assign (resid 31 and name HA ) (resid 31 and name HD1* ) 3.25 1.45 1.45 !peak 2679 #SUP 1.00 assign (resid 30 and name HD1* ) (resid 31 and name HA ) 2.69 0.89 0.89 !peak 2680 #SUP 0.99 #QF 0.50 assign (resid 31 and name HB2 ) (resid 31 and name HD2* ) 3.02 1.22 1.22 !peak 2687 #SUP 1.00 assign (resid 31 and name HD1* ) (resid 40 and name HA ) 3.29 1.49 1.49 !peak 2703 #SUP 1.00 assign (resid 31 and name HB2 ) (resid 31 and name HD1* ) 2.78 0.98 0.98 !peak 2704 #SUP 1.00 assign (resid 31 and name HB1 ) (resid 31 and name HD1* ) 2.93 1.13 1.13 !peak 2705 #SUP 1.00 assign (resid 31 and name HN ) (resid 31 and name HD2* ) 3.23 1.43 1.43 !peak 2709 #SUP 1.00 assign (resid 31 and name HA ) (resid 31 and name HD2* ) 2.64 0.84 0.84 !peak 2710 #SUP 0.96 #QF 0.96 assign (resid 31 and name HB1 ) (resid 31 and name HD2* ) 2.86 1.06 1.06 !peak 2712 #SUP 1.00 assign (resid 33 and name HA ) (resid 33 and name HG2 ) 2.94 1.14 1.14 !peak 2738 #SUP 0.85 #QF 0.85 assign (resid 33 and name HA ) (resid 33 and name HG1 ) 2.94 1.14 1.14 !peak 2739 #SUP 0.85 #QF 0.85 assign (resid 33 and name HA ) (resid 33 and name HE2 ) 4.35 2.55 2.55 !peak 2743 #SUP 0.98 #QF 0.95 assign (resid 33 and name HA ) (resid 33 and name HE1 ) 4.35 2.55 2.55 !peak 2743 #SUP 0.98 #QF 0.95 assign (resid 33 and name HN ) (resid 33 and name HG2 ) 3.23 1.43 1.43 !peak 2764 #SUP 0.90 #QF 0.90 assign (resid 34 and name HA ) (resid 34 and name HG2* ) 2.93 1.13 1.13 !peak 2827 #SUP 1.00 assign (resid 34 and name HA ) (resid 34 and name HD1* ) 3.34 1.54 1.54 !peak 2830 #SUP 1.00 assign (resid 34 and name HG2* ) (resid 34 and name HG11 ) 2.84 1.04 1.04 !peak 2842 #SUP 1.00 assign (resid 34 and name HG2* ) (resid 34 and name HG12 ) 2.68 0.88 0.88 !peak 2843 #SUP 1.00 assign (resid 34 and name HG2* ) (resid 34 and name HD1* ) 2.62 0.83 0.83 !peak 2844 #SUP 0.98 #QF 0.98 assign (resid 34 and name HA ) (resid 34 and name HG11 ) 3.29 1.49 1.49 !peak 2846 #SUP 1.00 assign (resid 34 and name HA ) (resid 34 and name HG12 ) 3.26 1.46 1.46 !peak 2853 #SUP 1.00 assign (resid 30 and name HD1* ) (resid 34 and name HG12 ) 3.08 1.28 1.28 !peak 2855 #SUP 1.00 #QF 0.65 assign (resid 34 and name HB ) (resid 34 and name HD1* ) 2.75 0.95 0.95 !peak 2861 #SUP 1.00 assign (resid 30 and name HD1* ) (resid 34 and name HD1* ) 2.55 0.75 0.75 !peak 2862 #SUP 0.99 #QF 0.61 assign (resid 35 and name HB2 ) (resid 35 and name HD1* ) 3.14 1.34 1.34 !peak 2878 #SUP 1.00 #QF 0.50 assign (resid 35 and name HN ) (resid 35 and name HG ) 3.73 1.93 1.93 !peak 2887 #SUP 1.00 assign (resid 35 and name HN ) (resid 35 and name HD1* ) 3.51 1.71 1.71 !peak 2894 #SUP 1.00 assign (resid 35 and name HA ) (resid 35 and name HD1* ) 3.30 1.50 1.50 !peak 2895 #SUP 0.98 #QF 0.98 assign (resid 35 and name HB1 ) (resid 35 and name HD1* ) 2.99 1.19 1.19 !peak 2897 #SUP 1.00 assign (resid 35 and name HD1* ) (resid 101 and name HB ) 3.38 1.58 1.58 !peak 2898 #SUP 1.00 assign (resid 35 and name HA ) (resid 35 and name HD2* ) 3.30 1.50 1.50 !peak 2902 #SUP 1.00 assign (resid 35 and name HB1 ) (resid 35 and name HD2* ) 2.99 1.19 1.19 !peak 2904 #SUP 1.00 assign (resid 35 and name HB2 ) (resid 35 and name HD2* ) 3.14 1.34 1.34 !peak 2905 #SUP 1.00 #QF 0.85 assign (resid 39 and name HA ) (resid 39 and name HG1* ) 2.75 0.95 0.95 !peak 2984 #SUP 0.96 #QF 0.96 assign (resid 39 and name HA ) (resid 39 and name HG2* ) 2.75 0.95 0.95 !peak 2985 #SUP 1.00 assign (resid 39 and name HN ) (resid 39 and name HB ) 2.98 1.18 1.18 !peak 2986 #SUP 1.00 assign (resid 40 and name HA ) (resid 40 and name HD1* ) 3.32 1.52 1.52 !peak 3006 #SUP 1.00 assign (resid 40 and name HB1 ) (resid 40 and name HD2* ) 2.94 1.14 1.14 !peak 3014 #SUP 1.00 assign (resid 40 and name HN ) (resid 40 and name HB2 ) 3.02 1.22 1.22 !peak 3015 #SUP 1.00 assign (resid 40 and name HB2 ) (resid 40 and name HD2* ) 2.91 1.11 1.11 !peak 3021 #SUP 1.00 assign (resid 31 and name HA ) (resid 34 and name HG11 ) 3.13 1.33 1.33 !peak 3023 #SUP 0.80 #QF 0.57 assign (resid 60 and name HG2 ) (resid 60 and name HD1 ) 2.59 0.79 0.79 !peak 3025 #SUP 1.00 #QF 0.40 assign (resid 32 and name HN ) (resid 40 and name HD1* ) 4.02 2.22 2.22 !peak 3029 #SUP 1.00 #QF 0.41 assign (resid 40 and name HB1 ) (resid 40 and name HD1* ) 2.94 1.14 1.14 !peak 3031 #SUP 1.00 assign (resid 40 and name HB2 ) (resid 40 and name HD1* ) 2.91 1.11 1.11 !peak 3032 #SUP 1.00 assign (resid 40 and name HA ) (resid 40 and name HD2* ) 3.32 1.52 1.52 !peak 3037 #SUP 1.00 assign (resid 42 and name HN ) (resid 42 and name HB2 ) 3.00 1.20 1.20 !peak 3071 #SUP 1.00 assign (resid 42 and name HB2 ) (resid 42 and name HE21 ) 3.96 2.16 2.16 !peak 3077 #SUP 1.00 assign (resid 43 and name HA ) (resid 43 and name HG1* ) 2.85 1.05 1.05 !peak 3098 #SUP 1.00 assign (resid 40 and name HA ) (resid 43 and name HG1* ) 3.57 1.77 1.77 !peak 3106 #SUP 0.99 #QF 0.85 assign (resid 43 and name HA ) (resid 43 and name HG2* ) 2.85 1.05 1.05 !peak 3111 #SUP 1.00 assign (resid 44 and name HA ) (resid 44 and name HD2 ) 4.35 2.55 2.55 !peak 3122 #SUP 1.00 assign (resid 44 and name HA ) (resid 44 and name HD1 ) 4.35 2.55 2.55 !peak 3122 #SUP 1.00 assign (resid 44 and name HN ) (resid 44 and name HG1 ) 3.30 1.50 1.50 !peak 3147 #SUP 1.00 assign (resid 44 and name HN ) (resid 44 and name HD2 ) 4.10 2.30 2.30 !peak 3163 #SUP 1.00 assign (resid 44 and name HN ) (resid 44 and name HD1 ) 4.10 2.30 2.30 !peak 3163 #SUP 1.00 assign (resid 48 and name HA ) (resid 48 and name HG2 ) 3.07 1.27 1.27 !peak 3223 #SUP 1.00 assign (resid 48 and name HA ) (resid 48 and name HD2 ) 3.92 2.12 2.12 !peak 3226 #SUP 1.00 assign (resid 48 and name HN ) (resid 48 and name HB1 ) 2.94 1.14 1.14 !peak 3235 #SUP 1.00 assign (resid 44 and name HB2 ) (resid 44 and name HD2 ) 3.25 1.45 1.45 !peak 3242 #SUP 0.99 #QF 0.64 assign (resid 48 and name HA ) (resid 48 and name HG1 ) 3.07 1.27 1.27 !peak 3252 #SUP 1.00 assign (resid 48 and name HN ) (resid 48 and name HD2 ) 4.00 2.20 2.20 !peak 3267 #SUP 0.96 #QF 0.80 assign (resid 48 and name HN ) (resid 48 and name HD1 ) 4.00 2.20 2.20 !peak 3267 #SUP 0.96 #QF 0.80 assign (resid 48 and name HA ) (resid 48 and name HD1 ) 3.92 2.12 2.12 !peak 3268 #SUP 1.00 #QF 0.41 assign (resid 44 and name HB2 ) (resid 44 and name HD1 ) 3.25 1.45 1.45 !peak 3269 #SUP 0.98 #QF 0.35 assign (resid 53 and name HN ) (resid 53 and name HB2 ) 2.76 0.96 0.96 !peak 3281 #SUP 0.97 #QF 0.97 assign (resid 49 and name HA ) (resid 49 and name HG2 ) 3.14 1.34 1.34 !peak 3300 #SUP 1.00 assign (resid 49 and name HA ) (resid 49 and name HG1 ) 3.14 1.34 1.34 !peak 3300 #SUP 1.00 assign (resid 29 and name HB1 ) (resid 29 and name HG2 ) 2.53 0.73 0.73 !peak 3302 #SUP 0.98 #QF 0.53 assign (resid 50 and name HA ) (resid 50 and name HG ) 3.09 1.29 1.28 !peak 3309 #SUP 1.00 assign (resid 50 and name HA ) (resid 50 and name HD1* ) 3.46 1.66 1.66 !peak 3310 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 50 and name HD1* ) 3.13 1.33 1.33 !peak 3317 #SUP 1.00 assign (resid 50 and name HB1 ) (resid 50 and name HD1* ) 3.21 1.41 1.41 !peak 3324 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 50 and name HG ) 2.56 0.76 0.76 !peak 3328 #SUP 0.97 #QF 0.97 assign (resid 50 and name HA ) (resid 50 and name HD2* ) 3.46 1.66 1.66 !peak 3341 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 50 and name HD2* ) 3.13 1.33 1.33 !peak 3342 #SUP 1.00 assign (resid 50 and name HB1 ) (resid 50 and name HD2* ) 3.21 1.41 1.41 !peak 3343 #SUP 1.00 assign (resid 52 and name HA ) (resid 52 and name HG1 ) 3.26 1.46 1.46 !peak 3392 #SUP 1.00 assign (resid 52 and name HA ) (resid 52 and name HD2 ) 3.44 1.64 1.64 !peak 3393 #SUP 0.95 #QF 0.95 assign (resid 52 and name HA ) (resid 52 and name HD1 ) 3.44 1.64 1.64 !peak 3394 #SUP 1.00 assign (resid 52 and name HA ) (resid 52 and name HE2 ) 4.35 2.55 2.55 !peak 3396 #SUP 1.00 #QF 0.95 assign (resid 52 and name HA ) (resid 52 and name HE1 ) 4.35 2.55 2.55 !peak 3396 #SUP 1.00 #QF 0.95 assign (resid 52 and name HB2 ) (resid 52 and name HD1 ) 3.07 1.27 1.27 !peak 3404 #SUP 1.00 assign (resid 52 and name HB1 ) (resid 52 and name HE2 ) 4.35 2.55 2.55 !peak 3416 #SUP 1.00 assign (resid 52 and name HB1 ) (resid 52 and name HE1 ) 4.35 2.55 2.55 !peak 3416 #SUP 1.00 assign (resid 52 and name HN ) (resid 52 and name HG2 ) 3.67 1.87 1.87 !peak 3417 #SUP 1.00 assign (resid 52 and name HA ) (resid 52 and name HG2 ) 3.26 1.46 1.46 !peak 3418 #SUP 0.99 #QF 0.99 assign (resid 52 and name HB2 ) (resid 52 and name HD2 ) 3.07 1.27 1.27 !peak 3439 #SUP 1.00 assign (resid 53 and name HA ) (resid 53 and name HG2 ) 3.11 1.31 1.31 !peak 3481 #SUP 1.00 assign (resid 53 and name HA ) (resid 53 and name HG1 ) 3.11 1.31 1.31 !peak 3510 #SUP 1.00 assign (resid 55 and name HA ) (resid 55 and name HG2* ) 2.88 1.08 1.08 !peak 3536 #SUP 1.00 assign (resid 55 and name HG2* ) (resid 55 and name HG12 ) 2.91 1.11 1.11 !peak 3540 #SUP 1.00 assign (resid 55 and name HA ) (resid 55 and name HG11 ) 3.09 1.29 1.28 !peak 3543 #SUP 1.00 assign (resid 55 and name HG2* ) (resid 55 and name HG11 ) 3.06 1.26 1.26 !peak 3545 #SUP 1.00 assign (resid 55 and name HA ) (resid 55 and name HG12 ) 3.11 1.31 1.31 !peak 3550 #SUP 1.00 assign (resid 55 and name HA ) (resid 55 and name HD1* ) 3.17 1.37 1.37 !peak 3557 #SUP 1.00 assign (resid 55 and name HB ) (resid 55 and name HD1* ) 2.80 1.00 1.00 !peak 3558 #SUP 1.00 assign (resid 55 and name HG2* ) (resid 55 and name HD1* ) 2.53 0.73 0.73 !peak 3559 #SUP 0.97 #QF 0.97 assign (resid 58 and name HA ) (resid 58 and name HG2 ) 3.18 1.38 1.38 !peak 3621 #SUP 1.00 assign (resid 58 and name HN ) (resid 58 and name HG1 ) 3.92 2.12 2.12 !peak 3641 #SUP 1.00 assign (resid 58 and name HA ) (resid 58 and name HG1 ) 3.18 1.38 1.38 !peak 3642 #SUP 1.00 assign (resid 59 and name HA ) (resid 59 and name HG1* ) 2.81 1.01 1.01 !peak 3658 #SUP 1.00 assign (resid 59 and name HA ) (resid 59 and name HG2* ) 2.81 1.01 1.01 !peak 3663 #SUP 1.00 assign (resid 60 and name HA ) (resid 60 and name HG2 ) 3.07 1.27 1.27 !peak 3672 #SUP 1.00 assign (resid 60 and name HA ) (resid 60 and name HD2 ) 2.62 0.82 0.82 !peak 3674 #SUP 0.94 #QF 0.94 assign (resid 60 and name HA ) (resid 60 and name HE1 ) 3.23 1.43 1.43 !peak 3676 #SUP 1.00 assign (resid 60 and name HB2 ) (resid 60 and name HE2 ) 3.56 1.76 1.76 !peak 3685 #SUP 1.00 assign (resid 60 and name HN ) (resid 60 and name HB1 ) 3.11 1.31 1.31 !peak 3687 #SUP 1.00 assign (resid 60 and name HB1 ) (resid 60 and name HD2 ) 2.58 0.78 0.78 !peak 3694 #SUP 1.00 assign (resid 60 and name HA ) (resid 60 and name HG1 ) 3.18 1.38 1.38 !peak 3698 #SUP 1.00 assign (resid 60 and name HG1 ) (resid 60 and name HD1 ) 2.63 0.83 0.83 !peak 3704 #SUP 1.00 assign (resid 60 and name HA ) (resid 60 and name HE2 ) 3.23 1.43 1.43 !peak 3738 #SUP 1.00 assign (resid 60 and name HB1 ) (resid 60 and name HE2 ) 2.95 1.15 1.15 !peak 3740 #SUP 1.00 assign (resid 60 and name HB2 ) (resid 60 and name HE1 ) 3.56 1.76 1.76 !peak 3749 #SUP 1.00 assign (resid 60 and name HB1 ) (resid 60 and name HE1 ) 2.95 1.15 1.15 !peak 3750 #SUP 0.95 #QF 0.95 assign (resid 103 and name HA ) (resid 103 and name HG1 ) 3.06 1.26 1.26 !peak 3761 #SUP 1.00 assign (resid 103 and name HB2 ) (resid 103 and name HD1 ) 3.21 1.41 1.41 !peak 3800 #SUP 1.00 assign (resid 61 and name HA ) (resid 61 and name HD1 ) 3.64 1.84 1.84 !peak 3806 #SUP 1.00 assign (resid 61 and name HB2 ) (resid 61 and name HD1 ) 3.26 1.46 1.46 !peak 3808 #SUP 0.95 #QF 0.79 assign (resid 62 and name HA ) (resid 62 and name HG1* ) 2.87 1.07 1.07 !peak 3824 #SUP 1.00 assign (resid 62 and name HA ) (resid 62 and name HG2* ) 2.87 1.07 1.07 !peak 3829 #SUP 0.99 #QF 0.99 assign (resid 64 and name HA ) (resid 64 and name HG1* ) 2.86 1.06 1.06 !peak 3866 #SUP 1.00 assign (resid 64 and name HA ) (resid 64 and name HG2* ) 2.86 1.06 1.06 !peak 3867 #SUP 0.98 #QF 0.90 assign (resid 64 and name HA ) (resid 73 and name HG2* ) 2.96 1.16 1.16 !peak 3867 #SUP 0.98 #QF 0.90 assign (resid 64 and name HN ) (resid 64 and name HG1* ) 3.17 1.37 1.37 !peak 3873 #SUP 1.00 assign (resid 65 and name HA ) (resid 65 and name HG2* ) 2.79 0.99 0.99 !peak 3892 #SUP 1.00 assign (resid 66 and name HA ) (resid 66 and name HG2* ) 2.74 0.94 0.94 !peak 3904 #SUP 1.00 assign (resid 70 and name HN ) (resid 70 and name HG2* ) 3.23 1.43 1.43 !peak 3951 #SUP 1.00 assign (resid 70 and name HA ) (resid 70 and name HG2* ) 2.72 0.92 0.92 !peak 3952 #SUP 1.00 assign (resid 71 and name HA ) (resid 71 and name HG2* ) 2.83 1.03 1.03 !peak 3959 #SUP 1.00 #QF 0.52 assign (resid 71 and name HA ) (resid 71 and name HG1* ) 2.83 1.03 1.03 !peak 3966 #SUP 1.00 assign (resid 73 and name HA ) (resid 73 and name HG1* ) 2.68 0.88 0.88 !peak 3996 #SUP 0.99 #QF 0.99 assign (resid 73 and name HN ) (resid 73 and name HG1* ) 3.02 1.22 1.22 !peak 4003 #SUP 1.00 assign (resid 73 and name HA ) (resid 73 and name HG2* ) 2.59 0.79 0.79 !peak 4009 #SUP 0.98 #QF 0.98 assign (resid 74 and name HA ) (resid 74 and name HG2* ) 2.76 0.96 0.96 !peak 4022 #SUP 1.00 assign (resid 75 and name HA ) (resid 75 and name HG2* ) 2.86 1.06 1.06 !peak 4029 #SUP 1.00 assign (resid 75 and name HA ) (resid 75 and name HG1* ) 2.86 1.06 1.06 !peak 4036 #SUP 1.00 #QF 0.23 assign (resid 76 and name HN ) (resid 76 and name HG2 ) 3.72 1.92 1.92 !peak 4063 #SUP 1.00 assign (resid 76 and name HA ) (resid 76 and name HG2 ) 3.28 1.48 1.48 !peak 4064 #SUP 1.00 assign (resid 76 and name HN ) (resid 76 and name HG1 ) 3.72 1.92 1.92 !peak 4069 #SUP 1.00 assign (resid 76 and name HA ) (resid 76 and name HG1 ) 3.28 1.48 1.48 !peak 4070 #SUP 1.00 assign (resid 77 and name HB2 ) (resid 77 and name HD1* ) 3.23 1.43 1.43 !peak 4087 #SUP 1.00 assign (resid 77 and name HB1 ) (resid 77 and name HD1* ) 3.09 1.29 1.29 !peak 4094 #SUP 1.00 assign (resid 77 and name HA ) (resid 77 and name HD1* ) 3.36 1.56 1.56 !peak 4104 #SUP 1.00 assign (resid 77 and name HA ) (resid 77 and name HD2* ) 3.36 1.56 1.56 !peak 4111 #SUP 1.00 assign (resid 77 and name HB2 ) (resid 77 and name HD2* ) 3.23 1.43 1.43 !peak 4112 #SUP 1.00 assign (resid 77 and name HB1 ) (resid 77 and name HD2* ) 3.09 1.29 1.29 !peak 4113 #SUP 1.00 assign (resid 78 and name HN ) (resid 78 and name HB1 ) 3.10 1.30 1.30 !peak 4129 #SUP 1.00 assign (resid 78 and name HA ) (resid 78 and name HG2 ) 3.20 1.40 1.40 !peak 4136 #SUP 1.00 assign (resid 78 and name HA ) (resid 78 and name HG1 ) 3.20 1.40 1.40 !peak 4142 #SUP 1.00 assign (resid 79 and name HA ) (resid 79 and name HG2 ) 3.25 1.45 1.45 !peak 4166 #SUP 1.00 assign (resid 79 and name HA ) (resid 79 and name HG1 ) 3.25 1.45 1.45 !peak 4172 #SUP 1.00 assign (resid 80 and name HN ) (resid 80 and name HG2* ) 3.27 1.47 1.47 !peak 4185 #SUP 1.00 assign (resid 80 and name HA ) (resid 80 and name HG2* ) 2.72 0.92 0.92 !peak 4186 #SUP 0.99 #QF 0.99 assign (resid 81 and name HA ) (resid 81 and name HG2* ) 2.81 1.01 1.01 !peak 4198 #SUP 1.00 assign (resid 84 and name HA ) (resid 84 and name HG2* ) 2.62 0.83 0.83 !peak 4214 #SUP 0.86 #QF 0.77 assign (resid 85 and name HA ) (resid 85 and name HG2* ) 2.80 1.00 1.00 !peak 4226 #SUP 1.00 assign (resid 80 and name HN ) (resid 81 and name HG2* ) 3.56 1.76 1.76 !peak 4237 #SUP 1.00 #QF 0.27 assign (resid 88 and name HN ) (resid 88 and name HG2* ) 3.21 1.41 1.41 !peak 4267 #SUP 1.00 assign (resid 88 and name HA ) (resid 88 and name HG2* ) 2.90 1.10 1.10 !peak 4268 #SUP 1.00 assign (resid 89 and name HA ) (resid 89 and name HG2* ) 2.83 1.03 1.03 !peak 4280 #SUP 1.00 assign (resid 90 and name HA ) (resid 90 and name HE* ) 4.25 2.45 2.45 !peak 4302 #SUP 0.98 #QF 0.98 assign (resid 91 and name HA ) (resid 91 and name HG1 ) 3.25 1.45 1.45 !peak 4317 #SUP 1.00 assign (resid 91 and name HA ) (resid 91 and name HG2 ) 3.29 1.49 1.49 !peak 4318 #SUP 1.00 assign (resid 91 and name HB1 ) (resid 91 and name HG2 ) 2.53 0.73 0.73 !peak 4339 #SUP 0.96 #QF 0.96 assign (resid 92 and name HB1 ) (resid 92 and name HD1* ) 3.22 1.42 1.42 !peak 4355 #SUP 1.00 assign (resid 92 and name HA ) (resid 92 and name HG ) 2.95 1.15 1.15 !peak 4365 #SUP 1.00 assign (resid 92 and name HN ) (resid 92 and name HD1* ) 3.42 1.62 1.62 !peak 4371 #SUP 1.00 assign (resid 92 and name HA ) (resid 92 and name HD1* ) 3.26 1.46 1.46 !peak 4372 #SUP 1.00 assign (resid 92 and name HB2 ) (resid 92 and name HD1* ) 2.85 1.05 1.05 !peak 4374 #SUP 0.94 #QF 0.94 assign (resid 92 and name HA ) (resid 92 and name HD2* ) 3.26 1.46 1.46 !peak 4379 #SUP 1.00 assign (resid 92 and name HB2 ) (resid 92 and name HD2* ) 2.85 1.05 1.05 !peak 4381 #SUP 1.00 assign (resid 92 and name HB1 ) (resid 92 and name HD2* ) 3.22 1.42 1.42 !peak 4382 #SUP 1.00 #QF 0.76 assign (resid 58 and name HN ) (resid 60 and name HD1 ) 4.10 2.30 2.30 !peak 4409 #SUP 1.00 #QF 0.33 assign (resid 93 and name HA ) (resid 93 and name HG1 ) 3.29 1.49 1.49 !peak 4410 #SUP 1.00 assign (resid 93 and name HA ) (resid 93 and name HG2 ) 3.26 1.46 1.46 !peak 4418 #SUP 1.00 assign (resid 93 and name HA ) (resid 93 and name HD2 ) 3.94 2.14 2.14 !peak 4434 #SUP 1.00 assign (resid 93 and name HA ) (resid 93 and name HD1 ) 3.94 2.14 2.14 !peak 4434 #SUP 1.00 assign (resid 93 and name HB1 ) (resid 93 and name HD2 ) 3.06 1.26 1.26 !peak 4436 #SUP 0.92 #QF 0.87 assign (resid 93 and name HB1 ) (resid 93 and name HD1 ) 3.06 1.26 1.26 !peak 4436 #SUP 0.92 #QF 0.87 assign (resid 94 and name HA ) (resid 94 and name HE* ) 4.14 2.34 2.34 !peak 4446 #SUP 1.00 assign (resid 96 and name HA ) (resid 96 and name HG1* ) 2.91 1.11 1.11 !peak 4516 #SUP 1.00 assign (resid 96 and name HA ) (resid 96 and name HG2* ) 2.91 1.11 1.11 !peak 4529 #SUP 1.00 assign (resid 97 and name HN ) (resid 97 and name HB1 ) 3.07 1.27 1.27 !peak 4537 #SUP 1.00 assign (resid 97 and name HN ) (resid 97 and name HB2 ) 3.10 1.30 1.30 !peak 4541 #SUP 1.00 assign (resid 100 and name HN ) (resid 100 and name HG2* ) 3.08 1.28 1.28 !peak 4571 #SUP 1.00 assign (resid 107 and name HA ) (resid 107 and name HG2* ) 2.42 0.62 0.62 !peak 4572 #SUP 0.52 #QF 0.52 assign (resid 101 and name HA ) (resid 101 and name HG2* ) 2.97 1.17 1.17 !peak 4578 #SUP 1.00 assign (resid 101 and name HA ) (resid 101 and name HG12 ) 3.19 1.39 1.39 !peak 4579 #SUP 1.00 assign (resid 101 and name HA ) (resid 101 and name HG11 ) 3.19 1.39 1.39 !peak 4580 #SUP 1.00 assign (resid 101 and name HA ) (resid 101 and name HD1* ) 3.56 1.76 1.76 !peak 4581 #SUP 1.00 assign (resid 35 and name HD2* ) (resid 101 and name HB ) 3.38 1.58 1.58 !peak 4587 #SUP 1.00 #QF 0.74 assign (resid 101 and name HG2* ) (resid 101 and name HG12 ) 3.18 1.38 1.38 !peak 4593 #SUP 1.00 assign (resid 101 and name HG2* ) (resid 101 and name HG11 ) 3.18 1.38 1.38 !peak 4606 #SUP 1.00 #QF 0.56 assign (resid 101 and name HB ) (resid 101 and name HD1* ) 3.00 1.20 1.20 !peak 4612 #SUP 1.00 #QF 0.33 assign (resid 101 and name HG2* ) (resid 101 and name HD1* ) 2.62 0.82 0.82 !peak 4613 #SUP 0.95 #QF 0.95 assign (resid 102 and name HA ) (resid 102 and name HG2 ) 3.15 1.35 1.35 !peak 4621 #SUP 1.00 assign (resid 102 and name HN ) (resid 102 and name HG1 ) 3.33 1.53 1.53 !peak 4649 #SUP 1.00 assign (resid 102 and name HA ) (resid 102 and name HG1 ) 3.15 1.35 1.35 !peak 4650 #SUP 1.00 assign (resid 30 and name HG ) (resid 31 and name HG ) 2.95 1.15 1.15 !peak 4651 #SUP 1.00 #QF 0.53 assign (resid 102 and name HA ) (resid 102 and name HD2 ) 3.05 1.25 1.25 !peak 4658 #SUP 0.90 #QF 0.90 assign (resid 102 and name HB1 ) (resid 102 and name HD2 ) 3.13 1.33 1.33 !peak 4659 #SUP 1.00 assign (resid 102 and name HA ) (resid 102 and name HD1 ) 3.05 1.25 1.25 !peak 4666 #SUP 1.00 assign (resid 102 and name HB1 ) (resid 102 and name HD1 ) 3.13 1.33 1.33 !peak 4667 #SUP 1.00 assign (resid 103 and name HA ) (resid 103 and name HG2 ) 3.06 1.26 1.26 !peak 4677 #SUP 1.00 assign (resid 103 and name HB1 ) (resid 103 and name HD1 ) 3.21 1.41 1.41 !peak 4696 #SUP 1.00 assign (resid 34 and name HB ) (resid 34 and name HG11 ) 2.61 0.81 0.81 !peak 4707 #SUP 0.89 #QF 0.62 assign (resid 103 and name HA ) (resid 103 and name HD2 ) 3.80 2.00 2.00 !peak 4714 #SUP 0.95 #QF 0.95 assign (resid 103 and name HB2 ) (resid 103 and name HD2 ) 3.21 1.41 1.41 !peak 4715 #SUP 0.95 #QF 0.95 assign (resid 103 and name HB1 ) (resid 103 and name HD2 ) 3.21 1.41 1.41 !peak 4716 #SUP 1.00 assign (resid 61 and name HA ) (resid 61 and name HD2 ) 3.64 1.84 1.84 !peak 4722 #SUP 0.97 #QF 0.36 assign (resid 103 and name HA ) (resid 103 and name HD1 ) 3.80 2.00 2.00 !peak 4722 #SUP 0.97 #QF 0.36 assign (resid 61 and name HB2 ) (resid 61 and name HD2 ) 3.26 1.46 1.46 !peak 4724 #SUP 0.98 #QF 0.46 assign (resid 104 and name HA ) (resid 104 and name HG1* ) 3.05 1.25 1.25 !peak 4732 #SUP 1.00 assign (resid 104 and name HA ) (resid 104 and name HG2* ) 3.05 1.25 1.25 !peak 4733 #SUP 1.00 assign (resid 105 and name HN ) (resid 105 and name HG2* ) 3.21 1.41 1.41 !peak 4757 #SUP 1.00 assign (resid 105 and name HA ) (resid 105 and name HG2* ) 2.58 0.78 0.78 !peak 4758 #SUP 0.90 #QF 0.90 assign (resid 106 and name HA ) (resid 106 and name HG1* ) 3.00 1.20 1.20 !peak 4772 #SUP 1.00 assign (resid 106 and name HA ) (resid 106 and name HG2* ) 3.00 1.20 1.20 !peak 4777 #SUP 1.00 assign (resid 91 and name HN ) (resid 107 and name HB ) 3.23 1.43 1.43 !peak 4785 #SUP 1.00 #QF 0.82 assign (resid 86 and name HA ) (resid 86 and name HG2* ) 2.60 0.80 0.80 !peak 4790 #SUP 0.91 #QF 0.51 assign (resid 108 and name HA ) (resid 108 and name HG2 ) 3.24 1.44 1.44 !peak 4797 #SUP 1.00 assign (resid 108 and name HA ) (resid 108 and name HG1 ) 3.24 1.44 1.44 !peak 4798 #SUP 1.00 assign (resid 113 and name HA ) (resid 113 and name HD2* ) 2.88 1.08 1.08 !peak 4873 #SUP 0.95 #QF 0.95 assign (resid 113 and name HB1 ) (resid 113 and name HD1* ) 2.87 1.07 1.07 !peak 4886 #SUP 1.00 assign (resid 113 and name HN ) (resid 113 and name HG ) 3.46 1.66 1.66 !peak 4888 #SUP 0.90 #QF 0.90 assign (resid 113 and name HA ) (resid 113 and name HG ) 3.28 1.48 1.48 !peak 4889 #SUP 0.80 #QF 0.80 assign (resid 113 and name HA ) (resid 113 and name HD1* ) 2.88 1.08 1.08 !peak 4896 #SUP 0.95 #QF 0.95 assign (resid 113 and name HB2 ) (resid 113 and name HD1* ) 2.87 1.07 1.07 !peak 4897 #SUP 0.99 #QF 0.62 assign (resid 18 and name HB1 ) (resid 18 and name HD1* ) 2.94 1.14 1.14 !peak 4899 #SUP 1.00 #QF 0.75 assign (resid 113 and name HN ) (resid 113 and name HD2* ) 3.57 1.77 1.77 !peak 4902 #SUP 1.00 assign (resid 113 and name HB2 ) (resid 113 and name HD2* ) 2.87 1.07 1.07 !peak 4904 #SUP 1.00 assign (resid 113 and name HB1 ) (resid 113 and name HD2* ) 2.87 1.07 1.07 !peak 4906 #SUP 1.00 #QF 0.94 assign (resid 114 and name HA ) (resid 114 and name HG2 ) 3.29 1.49 1.49 !peak 4913 #SUP 1.00 assign (resid 114 and name HA ) (resid 114 and name HG1 ) 3.29 1.49 1.49 !peak 4914 #SUP 1.00 assign (resid 4 and name HD1* ) (resid 5 and name HN ) 3.65 1.85 1.85 !peak 4952 #SUP 1.00 assign (resid 5 and name HG1* ) (resid 6 and name HN ) 3.21 1.41 1.41 !peak 4955 #SUP 1.00 assign (resid 6 and name HG2 ) (resid 7 and name HN ) 4.06 2.26 2.26 !peak 4961 #SUP 1.00 #QF 0.95 assign (resid 6 and name HG1 ) (resid 7 and name HN ) 4.06 2.26 2.26 !peak 4961 #SUP 1.00 #QF 0.95 assign (resid 9 and name HG2 ) (resid 10 and name HN ) 3.89 2.09 2.09 !peak 4969 #SUP 1.00 assign (resid 9 and name HG1 ) (resid 10 and name HN ) 3.89 2.09 2.09 !peak 4970 #SUP 1.00 assign (resid 10 and name HG2 ) (resid 11 and name HN ) 3.90 2.10 2.10 !peak 4978 #SUP 1.00 assign (resid 10 and name HG1 ) (resid 11 and name HN ) 3.90 2.10 2.10 !peak 4979 #SUP 1.00 assign (resid 12 and name HB* ) (resid 13 and name HN ) 2.93 1.13 1.13 !peak 4983 #SUP 1.00 assign (resid 13 and name HG12 ) (resid 14 and name HN ) 3.88 2.08 2.08 !peak 4988 #SUP 1.00 assign (resid 13 and name HD1* ) (resid 14 and name HN ) 3.35 1.55 1.55 !peak 4989 #SUP 1.00 assign (resid 17 and name HN ) (resid 17 and name HB2 ) 2.88 1.08 1.08 !peak 5006 #SUP 1.00 #QF 0.99 assign (resid 30 and name HD1* ) (resid 35 and name HN ) 4.35 2.55 2.55 !peak 5013 #SUP 1.00 assign (resid 22 and name HD1 ) (resid 23 and name HN ) 3.69 1.89 1.89 !peak 5032 #SUP 1.00 assign (resid 22 and name HD2 ) (resid 23 and name HN ) 3.44 1.64 1.64 !peak 5033 #SUP 1.00 assign (resid 25 and name HB2 ) (resid 26 and name HN ) 3.38 1.58 1.58 !peak 5045 #SUP 1.00 assign (resid 28 and name HB2 ) (resid 29 and name HN ) 3.52 1.72 1.72 !peak 5058 #SUP 1.00 assign (resid 28 and name HB1 ) (resid 29 and name HN ) 3.75 1.95 1.95 !peak 5058 #SUP 1.00 assign (resid 28 and name HG2 ) (resid 29 and name HN ) 3.49 1.69 1.69 !peak 5060 #SUP 1.00 assign (resid 29 and name HB2 ) (resid 30 and name HN ) 3.23 1.43 1.43 !peak 5062 #SUP 1.00 assign (resid 30 and name HB1 ) (resid 31 and name HN ) 3.16 1.36 1.36 !peak 5067 #SUP 1.00 assign (resid 30 and name HB2 ) (resid 31 and name HN ) 3.41 1.61 1.61 !peak 5068 #SUP 1.00 assign (resid 31 and name HB1 ) (resid 40 and name HN ) 4.09 2.29 2.29 !peak 5074 #SUP 1.00 assign (resid 31 and name HD1* ) (resid 40 and name HN ) 4.16 2.36 2.36 !peak 5076 #SUP 1.00 assign (resid 12 and name HN ) (resid 31 and name HD2* ) 3.91 2.11 2.11 !peak 5077 #SUP 0.55 #QF 0.35 assign (resid 35 and name HB2 ) (resid 36 and name HN ) 3.29 1.49 1.49 !peak 5097 #SUP 1.00 assign (resid 35 and name HD2* ) (resid 36 and name HN ) 3.56 1.76 1.76 !peak 5101 #SUP 1.00 assign (resid 37 and name HB1 ) (resid 38 and name HN ) 3.52 1.72 1.72 !peak 5106 #SUP 1.00 assign (resid 36 and name HN ) (resid 39 and name HB ) 3.37 1.57 1.57 !peak 5113 #SUP 1.00 #QF 0.55 assign (resid 36 and name HN ) (resid 39 and name HG1* ) 3.23 1.43 1.43 !peak 5114 #SUP 0.99 #QF 0.99 assign (resid 40 and name HB1 ) (resid 41 and name HN ) 3.18 1.38 1.38 !peak 5117 #SUP 1.00 assign (resid 40 and name HD2* ) (resid 41 and name HN ) 3.21 1.41 1.41 !peak 5121 #SUP 1.00 assign (resid 42 and name HB1 ) (resid 43 and name HN ) 3.31 1.51 1.51 !peak 5126 #SUP 1.00 assign (resid 42 and name HB2 ) (resid 43 and name HN ) 3.25 1.45 1.45 !peak 5127 #SUP 1.00 assign (resid 43 and name HG1* ) (resid 44 and name HN ) 3.19 1.39 1.39 !peak 5132 #SUP 1.00 assign (resid 44 and name HB1 ) (resid 45 and name HN ) 3.32 1.52 1.51 !peak 5135 #SUP 1.00 assign (resid 45 and name HB1 ) (resid 46 and name HN ) 3.24 1.44 1.44 !peak 5143 #SUP 1.00 assign (resid 45 and name HG2 ) (resid 46 and name HN ) 4.15 2.35 2.35 !peak 5145 #SUP 1.00 #QF 0.70 assign (resid 45 and name HG1 ) (resid 46 and name HN ) 4.15 2.35 2.35 !peak 5145 #SUP 1.00 #QF 0.70 assign (resid 46 and name HB2 ) (resid 47 and name HN ) 3.30 1.50 1.50 !peak 5147 #SUP 1.00 assign (resid 48 and name HG1 ) (resid 49 and name HN ) 4.05 2.25 2.25 !peak 5155 #SUP 1.00 assign (resid 48 and name HD2 ) (resid 49 and name HN ) 4.35 2.55 2.55 !peak 5157 #SUP 0.99 #QF 0.24 assign (resid 48 and name HD1 ) (resid 49 and name HN ) 4.35 2.55 2.55 !peak 5157 #SUP 0.99 #QF 0.24 assign (resid 50 and name HB1 ) (resid 55 and name HN ) 3.93 2.13 2.13 !peak 5165 #SUP 1.00 assign (resid 50 and name HD1* ) (resid 51 and name HN ) 4.35 2.55 2.55 !peak 5167 #SUP 1.00 #QF 0.40 assign (resid 50 and name HD1* ) (resid 55 and name HN ) 4.35 2.55 2.55 !peak 5167 #SUP 1.00 #QF 0.40 assign (resid 50 and name HD2* ) (resid 51 and name HN ) 4.35 2.55 2.55 !peak 5168 #SUP 1.00 assign (resid 50 and name HD2* ) (resid 55 and name HN ) 4.35 2.55 2.55 !peak 5168 #SUP 1.00 assign (resid 52 and name HB2 ) (resid 53 and name HN ) 3.29 1.49 1.49 !peak 5175 #SUP 1.00 assign (resid 55 and name HG12 ) (resid 56 and name HN ) 3.65 1.85 1.85 !peak 5189 #SUP 1.00 assign (resid 58 and name HB1 ) (resid 59 and name HN ) 3.65 1.85 1.85 !peak 5202 #SUP 1.00 assign (resid 60 and name HB1 ) (resid 61 and name HN ) 3.31 1.51 1.51 !peak 5211 #SUP 1.00 assign (resid 61 and name HB1 ) (resid 62 and name HN ) 3.70 1.90 1.90 !peak 5220 #SUP 1.00 assign (resid 61 and name HG1 ) (resid 62 and name HN ) 3.46 1.66 1.66 !peak 5222 #SUP 1.00 assign (resid 61 and name HD1 ) (resid 62 and name HN ) 4.03 2.23 2.23 !peak 5224 #SUP 1.00 assign (resid 63 and name HB2 ) (resid 64 and name HN ) 3.43 1.63 1.63 !peak 5231 #SUP 1.00 assign (resid 65 and name HB ) (resid 66 and name HN ) 3.03 1.23 1.23 !peak 5239 #SUP 1.00 assign (resid 66 and name HG2* ) (resid 67 and name HN ) 3.17 1.37 1.37 !peak 5243 #SUP 1.00 assign (resid 70 and name HB ) (resid 71 and name HN ) 3.17 1.37 1.37 !peak 5253 #SUP 1.00 assign (resid 71 and name HG1* ) (resid 72 and name HN ) 2.96 1.16 1.16 !peak 5257 #SUP 0.99 #QF 0.99 assign (resid 76 and name HB2 ) (resid 77 and name HN ) 3.50 1.70 1.70 !peak 5274 #SUP 1.00 assign (resid 77 and name HG ) (resid 78 and name HN ) 3.78 1.98 1.98 !peak 5281 #SUP 1.00 assign (resid 84 and name HG2* ) (resid 85 and name HN ) 3.02 1.22 1.22 !peak 5301 #SUP 1.00 assign (resid 86 and name HB ) (resid 87 and name HN ) 3.25 1.45 1.45 !peak 5306 #SUP 1.00 assign (resid 87 and name HB2 ) (resid 88 and name HN ) 3.48 1.68 1.68 !peak 5310 #SUP 1.00 assign (resid 88 and name HB ) (resid 89 and name HN ) 3.03 1.23 1.23 !peak 5312 #SUP 1.00 assign (resid 89 and name HB ) (resid 90 and name HN ) 3.25 1.45 1.45 !peak 5315 #SUP 1.00 assign (resid 89 and name HG2* ) (resid 90 and name HN ) 2.84 1.04 1.04 !peak 5316 #SUP 1.00 assign (resid 91 and name HG1 ) (resid 92 and name HN ) 4.00 2.20 2.20 !peak 5325 #SUP 1.00 assign (resid 92 and name HB1 ) (resid 93 and name HN ) 3.86 2.06 2.06 !peak 5328 #SUP 1.00 assign (resid 92 and name HB2 ) (resid 93 and name HN ) 3.56 1.76 1.76 !peak 5329 #SUP 1.00 assign (resid 92 and name HD1* ) (resid 93 and name HN ) 3.94 2.14 2.14 !peak 5331 #SUP 1.00 assign (resid 93 and name HB2 ) (resid 94 and name HN ) 3.58 1.78 1.78 !peak 5334 #SUP 1.00 assign (resid 95 and name HB2 ) (resid 96 and name HN ) 3.53 1.73 1.73 !peak 5347 #SUP 1.00 assign (resid 96 and name HB ) (resid 97 and name HN ) 2.76 0.96 0.96 !peak 5352 #SUP 0.86 #QF 0.86 assign (resid 96 and name HN ) (resid 96 and name HG1* ) 2.73 0.93 0.93 !peak 5353 #SUP 0.89 #QF 0.89 assign (resid 96 and name HN ) (resid 96 and name HG2* ) 2.73 0.93 0.93 !peak 5354 #SUP 0.78 #QF 0.78 assign (resid 97 and name HB1 ) (resid 102 and name HN ) 4.18 2.38 2.38 !peak 5356 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 102 and name HN ) 3.60 1.80 1.80 !peak 5357 #SUP 1.00 assign (resid 101 and name HG2* ) (resid 102 and name HN ) 2.96 1.16 1.16 !peak 5368 #SUP 1.00 assign (resid 101 and name HN ) (resid 101 and name HG11 ) 3.23 1.43 1.43 !peak 5370 #SUP 1.00 assign (resid 102 and name HB1 ) (resid 103 and name HN ) 3.85 2.05 2.05 !peak 5373 #SUP 1.00 #QF 0.39 assign (resid 102 and name HB2 ) (resid 103 and name HN ) 3.37 1.57 1.57 !peak 5374 #SUP 1.00 assign (resid 104 and name HB ) (resid 105 and name HN ) 3.52 1.72 1.72 !peak 5387 #SUP 1.00 assign (resid 105 and name HB ) (resid 106 and name HN ) 3.26 1.46 1.46 !peak 5391 #SUP 1.00 assign (resid 105 and name HG2* ) (resid 106 and name HN ) 2.90 1.10 1.10 !peak 5392 #SUP 0.98 #QF 0.98 assign (resid 106 and name HB ) (resid 107 and name HN ) 3.53 1.73 1.73 !peak 5394 #SUP 1.00 assign (resid 106 and name HG1* ) (resid 107 and name HN ) 3.32 1.52 1.52 !peak 5395 #SUP 1.00 assign (resid 113 and name HA ) (resid 114 and name HN ) 2.94 1.14 1.14 !peak 5413 #SUP 1.00 assign (resid 113 and name HB1 ) (resid 114 and name HN ) 3.58 1.78 1.78 !peak 5415 #SUP 1.00 assign (resid 113 and name HG ) (resid 114 and name HN ) 4.29 2.49 2.49 !peak 5416 #SUP 1.00 assign (resid 113 and name HD2* ) (resid 114 and name HN ) 3.78 1.98 1.97 !peak 5418 #SUP 1.00 assign (resid 4 and name HA ) (resid 6 and name HN ) 4.09 2.29 2.29 !peak 5419 #SUP 1.00 assign (resid 4 and name HA ) (resid 7 and name HN ) 3.61 1.81 1.81 !peak 5420 #SUP 0.99 #QF 0.99 assign (resid 4 and name HA ) (resid 7 and name HB* ) 3.37 1.57 1.57 !peak 5421 #SUP 1.00 assign (resid 5 and name HA ) (resid 8 and name HB* ) 2.98 1.18 1.18 !peak 5426 #SUP 1.00 assign (resid 6 and name HA ) (resid 8 and name HN ) 3.84 2.04 2.04 !peak 5429 #SUP 1.00 assign (resid 6 and name HA ) (resid 9 and name HB1 ) 3.11 1.31 1.31 !peak 5432 #SUP 0.99 #QF 0.99 assign (resid 6 and name HA ) (resid 9 and name HB2 ) 3.11 1.31 1.31 !peak 5433 #SUP 1.00 assign (resid 6 and name HA ) (resid 10 and name HN ) 3.72 1.92 1.92 !peak 5435 #SUP 1.00 assign (resid 7 and name HA ) (resid 9 and name HN ) 3.95 2.15 2.15 !peak 5436 #SUP 1.00 assign (resid 7 and name HA ) (resid 10 and name HN ) 3.06 1.26 1.26 !peak 5437 #SUP 0.90 #QF 0.90 assign (resid 8 and name HA ) (resid 10 and name HN ) 3.80 2.00 2.00 !peak 5443 #SUP 1.00 assign (resid 8 and name HA ) (resid 11 and name HB* ) 2.95 1.15 1.15 !peak 5446 #SUP 0.99 #QF 0.99 assign (resid 9 and name HA ) (resid 11 and name HN ) 4.20 2.40 2.40 !peak 5448 #SUP 1.00 assign (resid 9 and name HA ) (resid 12 and name HB* ) 2.86 1.06 1.06 !peak 5451 #SUP 1.00 assign (resid 9 and name HB1 ) (resid 10 and name HA ) 3.37 1.57 1.57 !peak 5455 #SUP 1.00 #QF 0.42 assign (resid 10 and name HA ) (resid 14 and name HN ) 3.49 1.69 1.69 !peak 5457 #SUP 0.95 #QF 0.95 assign (resid 11 and name HA ) (resid 13 and name HN ) 3.87 2.07 2.07 !peak 5458 #SUP 1.00 assign (resid 11 and name HA ) (resid 14 and name HB* ) 2.86 1.06 1.06 !peak 5460 #SUP 1.00 assign (resid 12 and name HA ) (resid 14 and name HN ) 3.90 2.10 2.10 !peak 5463 #SUP 1.00 assign (resid 12 and name HA ) (resid 15 and name HN ) 3.41 1.61 1.61 !peak 5464 #SUP 1.00 assign (resid 12 and name HA ) (resid 15 and name HB ) 3.14 1.34 1.34 !peak 5466 #SUP 0.99 #QF 0.99 assign (resid 13 and name HA ) (resid 15 and name HN ) 3.94 2.14 2.14 !peak 5468 #SUP 1.00 assign (resid 13 and name HA ) (resid 16 and name HB2 ) 3.36 1.56 1.56 !peak 5472 #SUP 0.98 #QF 0.98 assign (resid 14 and name HA ) (resid 17 and name HB1 ) 3.43 1.63 1.63 !peak 5477 #SUP 1.00 assign (resid 14 and name HA ) (resid 17 and name HB2 ) 2.83 1.03 1.03 !peak 5480 #SUP 1.00 #QF 0.99 assign (resid 15 and name HA ) (resid 17 and name HN ) 3.70 1.90 1.90 !peak 5483 #SUP 1.00 #QF 0.24 assign (resid 15 and name HA ) (resid 18 and name HB2 ) 3.44 1.64 1.64 !peak 5484 #SUP 1.00 assign (resid 15 and name HA ) (resid 18 and name HB1 ) 3.92 2.12 2.12 !peak 5487 #SUP 1.00 assign (resid 16 and name HA ) (resid 18 and name HN ) 4.22 2.42 2.42 !peak 5489 #SUP 1.00 assign (resid 16 and name HA ) (resid 19 and name HB2 ) 3.60 1.80 1.80 !peak 5492 #SUP 1.00 assign (resid 15 and name HA ) (resid 16 and name HA ) 3.84 2.04 2.04 !peak 5493 #SUP 1.00 #QF 0.73 assign (resid 16 and name HA ) (resid 19 and name HB1 ) 3.60 1.80 1.80 !peak 5494 #SUP 0.99 #QF 0.99 assign (resid 25 and name HA ) (resid 28 and name HG1 ) 2.65 0.85 0.85 !peak 5500 #SUP 0.88 #QF 0.88 assign (resid 26 and name HA ) (resid 28 and name HN ) 3.88 2.08 2.08 !peak 5503 #SUP 1.00 assign (resid 26 and name HA ) (resid 29 and name HB1 ) 2.87 1.07 1.07 !peak 5507 #SUP 1.00 #QF 0.98 assign (resid 26 and name HA ) (resid 30 and name HN ) 3.40 1.60 1.60 !peak 5509 #SUP 0.94 #QF 0.94 assign (resid 27 and name HA ) (resid 29 and name HN ) 3.73 1.93 1.93 !peak 5510 #SUP 1.00 assign (resid 27 and name HA ) (resid 30 and name HN ) 3.26 1.46 1.46 !peak 5511 #SUP 1.00 assign (resid 27 and name HA ) (resid 30 and name HB1 ) 3.37 1.57 1.57 !peak 5512 #SUP 0.95 #QF 0.95 assign (resid 27 and name HA ) (resid 31 and name HN ) 3.52 1.72 1.72 !peak 5516 #SUP 1.00 assign (resid 28 and name HA ) (resid 31 and name HB2 ) 3.14 1.34 1.34 !peak 5519 #SUP 0.99 #QF 0.99 assign (resid 28 and name HA ) (resid 31 and name HB1 ) 3.52 1.72 1.72 !peak 5521 #SUP 1.00 assign (resid 29 and name HA ) (resid 32 and name HB2 ) 3.04 1.24 1.24 !peak 5527 #SUP 0.90 #QF 0.90 assign (resid 29 and name HA ) (resid 32 and name HB1 ) 3.46 1.66 1.66 !peak 5528 #SUP 0.90 #QF 0.90 assign (resid 30 and name HA ) (resid 33 and name HB2 ) 3.21 1.41 1.41 !peak 5536 #SUP 1.00 assign (resid 30 and name HA ) (resid 34 and name HN ) 4.01 2.21 2.21 !peak 5537 #SUP 1.00 assign (resid 31 and name HA ) (resid 34 and name HB ) 3.97 2.17 2.17 !peak 5541 #SUP 1.00 assign (resid 32 and name HD21 ) (resid 37 and name HA ) 4.33 2.53 2.53 !peak 5543 #SUP 1.00 #QF 0.39 assign (resid 37 and name HA ) (resid 40 and name HB1 ) 3.46 1.66 1.66 !peak 5545 #SUP 1.00 assign (resid 37 and name HA ) (resid 41 and name HN ) 3.53 1.73 1.73 !peak 5549 #SUP 1.00 assign (resid 38 and name HA ) (resid 41 and name HN ) 3.25 1.45 1.45 !peak 5551 #SUP 0.99 #QF 0.99 assign (resid 38 and name HA ) (resid 41 and name HB1 ) 2.83 1.03 1.03 !peak 5553 #SUP 1.00 #QF 0.96 assign (resid 38 and name HA ) (resid 41 and name HB2 ) 2.95 1.15 1.15 !peak 5554 #SUP 0.94 #QF 0.94 assign (resid 38 and name HA ) (resid 42 and name HN ) 3.67 1.87 1.87 !peak 5556 #SUP 0.99 #QF 0.99 assign (resid 39 and name HA ) (resid 42 and name HG1 ) 3.40 1.60 1.60 !peak 5559 #SUP 1.00 assign (resid 39 and name HA ) (resid 42 and name HB1 ) 3.45 1.65 1.65 !peak 5560 #SUP 1.00 assign (resid 41 and name HA ) (resid 44 and name HN ) 3.33 1.53 1.53 !peak 5570 #SUP 1.00 assign (resid 41 and name HA ) (resid 44 and name HB1 ) 3.54 1.74 1.74 !peak 5571 #SUP 1.00 assign (resid 42 and name HA ) (resid 45 and name HN ) 3.14 1.34 1.34 !peak 5577 #SUP 0.99 #QF 0.99 assign (resid 42 and name HA ) (resid 46 and name HN ) 3.53 1.73 1.73 !peak 5582 #SUP 0.90 #QF 0.90 assign (resid 43 and name HA ) (resid 46 and name HB2 ) 3.69 1.89 1.89 !peak 5586 #SUP 0.90 #QF 0.90 assign (resid 43 and name HA ) (resid 46 and name HB1 ) 3.69 1.89 1.89 !peak 5587 #SUP 0.90 #QF 0.90 assign (resid 44 and name HA ) (resid 47 and name HB* ) 2.95 1.15 1.15 !peak 5592 #SUP 0.93 #QF 0.93 assign (resid 44 and name HA ) (resid 48 and name HN ) 4.35 2.55 2.55 !peak 5594 #SUP 1.00 assign (resid 44 and name HB2 ) (resid 45 and name HA ) 3.62 1.82 1.82 !peak 5600 #SUP 0.80 #QF 0.80 assign (resid 45 and name HA ) (resid 47 and name HN ) 3.37 1.57 1.57 !peak 5601 #SUP 0.96 #QF 0.96 assign (resid 46 and name HA ) (resid 49 and name HB2 ) 3.04 1.24 1.24 !peak 5607 #SUP 0.99 #QF 0.99 assign (resid 46 and name HA ) (resid 48 and name HN ) 3.46 1.66 1.66 !peak 5608 #SUP 0.94 #QF 0.94 assign (resid 47 and name HA ) (resid 50 and name HB2 ) 3.46 1.66 1.66 !peak 5611 #SUP 1.00 assign (resid 47 and name HA ) (resid 50 and name HB1 ) 4.21 2.41 2.41 !peak 5614 #SUP 1.00 assign (resid 47 and name HA ) (resid 51 and name HN ) 4.09 2.29 2.29 !peak 5615 #SUP 1.00 #QF 0.28 assign (resid 48 and name HA ) (resid 51 and name HN ) 3.34 1.54 1.54 !peak 5617 #SUP 1.00 assign (resid 48 and name HA ) (resid 51 and name HB1 ) 3.16 1.36 1.36 !peak 5618 #SUP 1.00 assign (resid 48 and name HA ) (resid 51 and name HB2 ) 3.07 1.27 1.27 !peak 5620 #SUP 0.99 #QF 0.99 assign (resid 48 and name HA ) (resid 52 and name HN ) 4.06 2.26 2.26 !peak 5622 #SUP 1.00 assign (resid 49 and name HA ) (resid 52 and name HN ) 3.44 1.64 1.64 !peak 5624 #SUP 0.99 #QF 0.99 assign (resid 49 and name HA ) (resid 52 and name HB2 ) 3.24 1.44 1.44 !peak 5626 #SUP 0.92 #QF 0.92 assign (resid 49 and name HA ) (resid 52 and name HB1 ) 3.95 2.15 2.15 !peak 5628 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 96 and name HA ) 3.41 1.61 1.61 !peak 6244 #SUP 0.65 #QF 0.65 assign (resid 4 and name HD1* ) (resid 100 and name HA ) 3.44 1.64 1.64 !peak 6245 #SUP 0.97 #QF 0.83 assign (resid 5 and name HA ) (resid 71 and name HB ) 3.59 1.79 1.79 !peak 6249 #SUP 0.95 #QF 0.95 assign (resid 6 and name HB1 ) (resid 7 and name HB* ) 3.22 1.42 1.42 !peak 6265 #SUP 0.86 #QF 0.86 assign (resid 7 and name HB* ) (resid 8 and name HA ) 3.67 1.87 1.87 !peak 6280 #SUP 1.00 assign (resid 8 and name HA ) (resid 94 and name HE* ) 3.70 1.90 1.90 !peak 6286 #SUP 0.97 #QF 0.97 assign (resid 9 and name HA ) (resid 73 and name HG2* ) 3.17 1.37 1.37 !peak 6291 #SUP 0.73 #QF 0.46 assign (resid 9 and name HA ) (resid 13 and name HD1* ) 3.35 1.55 1.55 !peak 6292 #SUP 0.99 #QF 0.99 assign (resid 6 and name HA ) (resid 9 and name HG2 ) 4.24 2.44 2.44 !peak 6298 #SUP 1.00 assign (resid 9 and name HB1 ) (resid 64 and name HG1* ) 4.08 2.28 2.28 !peak 6299 #SUP 0.99 #QF 0.97 assign (resid 9 and name HB1 ) (resid 64 and name HG2* ) 4.08 2.28 2.28 !peak 6299 #SUP 0.99 #QF 0.97 assign (resid 9 and name HD2 ) (resid 64 and name HG2* ) 3.40 1.60 1.60 !peak 6306 #SUP 0.87 #QF 0.48 assign (resid 9 and name HD1 ) (resid 13 and name HD1* ) 3.54 1.74 1.74 !peak 6307 #SUP 0.86 #QF 0.46 assign (resid 21 and name HA ) (resid 22 and name HG1 ) 3.68 1.88 1.88 !peak 6308 #SUP 1.00 assign (resid 7 and name HA ) (resid 10 and name HG2 ) 3.43 1.63 1.63 !peak 6310 #SUP 0.97 #QF 0.97 assign (resid 10 and name HA ) (resid 13 and name HB ) 3.06 1.26 1.26 !peak 6316 #SUP 0.90 #QF 0.90 assign (resid 10 and name HA ) (resid 13 and name HG11 ) 3.72 1.92 1.92 !peak 6317 #SUP 1.00 assign (resid 9 and name HG1 ) (resid 10 and name HA ) 4.35 2.55 2.55 !peak 6318 #SUP 0.98 #QF 0.33 assign (resid 10 and name HA ) (resid 11 and name HB* ) 4.35 2.55 2.55 !peak 6318 #SUP 0.98 #QF 0.33 assign (resid 10 and name HA ) (resid 30 and name HD1* ) 4.11 2.31 2.31 !peak 6319 #SUP 0.81 #QF 0.58 assign (resid 10 and name HA ) (resid 13 and name HD1* ) 2.92 1.12 1.12 !peak 6320 #SUP 0.91 #QF 0.91 assign (resid 11 and name HA ) (resid 31 and name HD2* ) 2.79 0.99 0.99 !peak 6343 #SUP 0.97 #QF 0.79 assign (resid 11 and name HA ) (resid 30 and name HD2* ) 3.36 1.56 1.56 !peak 6344 #SUP 0.97 #QF 0.97 assign (resid 11 and name HB* ) (resid 15 and name HD1* ) 3.07 1.27 1.27 !peak 6347 #SUP 1.00 assign (resid 11 and name HB* ) (resid 101 and name HD1* ) 3.37 1.57 1.57 !peak 6348 #SUP 0.96 #QF 0.55 assign (resid 11 and name HB* ) (resid 31 and name HD2* ) 2.63 0.83 0.83 !peak 6349 #SUP 0.98 #QF 0.98 assign (resid 11 and name HB* ) (resid 12 and name HA ) 3.64 1.84 1.84 !peak 6357 #SUP 1.00 assign (resid 12 and name HA ) (resid 73 and name HG2* ) 3.86 2.06 2.06 !peak 6359 #SUP 0.96 #QF 0.85 assign (resid 11 and name HB* ) (resid 12 and name HB* ) 3.18 1.38 1.38 !peak 6363 #SUP 1.00 assign (resid 12 and name HB* ) (resid 92 and name HD2* ) 2.74 0.94 0.94 !peak 6366 #SUP 1.00 assign (resid 12 and name HB* ) (resid 15 and name HD1* ) 3.18 1.38 1.38 !peak 6367 #SUP 0.97 #QF 0.97 assign (resid 10 and name HA ) (resid 13 and name HG2* ) 3.82 2.02 2.02 !peak 6388 #SUP 0.99 #QF 0.99 assign (resid 10 and name HA ) (resid 13 and name HG12 ) 4.08 2.28 2.28 !peak 6390 #SUP 0.95 #QF 0.95 assign (resid 12 and name HB* ) (resid 13 and name HA ) 3.54 1.74 1.74 !peak 6395 #SUP 0.78 #QF 0.78 assign (resid 13 and name HA ) (resid 59 and name HG1* ) 4.09 2.29 2.29 !peak 6396 #SUP 0.98 #QF 0.98 assign (resid 14 and name HB* ) (resid 17 and name HN ) 3.61 1.81 1.81 !peak 6400 #SUP 0.96 #QF 0.39 assign (resid 15 and name HB ) (resid 16 and name HD* ) 3.97 2.17 2.17 !peak 6408 #SUP 0.97 #QF 0.97 assign (resid 12 and name HA ) (resid 15 and name HG2* ) 3.62 1.82 1.82 !peak 6410 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 18 and name HB2 ) 3.75 1.95 1.95 !peak 6417 #SUP 1.00 #QF 0.99 assign (resid 14 and name HB* ) (resid 17 and name HB1 ) 3.95 2.15 2.15 !peak 6421 #SUP 0.85 #QF 0.85 assign (resid 14 and name HB* ) (resid 17 and name HB2 ) 3.56 1.76 1.76 !peak 6422 #SUP 0.98 #QF 0.38 assign (resid 14 and name HB* ) (resid 30 and name HD1* ) 2.64 0.84 0.84 !peak 6424 #SUP 0.99 #QF 0.99 assign (resid 14 and name HB* ) (resid 31 and name HD1* ) 2.82 1.02 1.02 !peak 6426 #SUP 0.99 #QF 0.99 assign (resid 15 and name HA ) (resid 31 and name HD2* ) 3.13 1.33 1.33 !peak 6429 #SUP 0.98 #QF 0.98 assign (resid 15 and name HA ) (resid 43 and name HG2* ) 3.48 1.68 1.68 !peak 6430 #SUP 1.00 assign (resid 15 and name HB ) (resid 31 and name HD2* ) 3.68 1.88 1.88 !peak 6432 #SUP 0.97 #QF 0.97 assign (resid 15 and name HB ) (resid 43 and name HG2* ) 3.68 1.88 1.88 !peak 6433 #SUP 0.96 #QF 0.96 assign (resid 15 and name HG2* ) (resid 106 and name HG2* ) 3.56 1.76 1.76 !peak 6435 #SUP 0.84 #QF 0.34 assign (resid 15 and name HG12 ) (resid 31 and name HD2* ) 3.30 1.50 1.50 !peak 6438 #SUP 1.00 assign (resid 16 and name HB2 ) (resid 59 and name HG2* ) 4.35 2.55 2.55 !peak 6440 #SUP 0.99 #QF 0.96 assign (resid 15 and name HG2* ) (resid 16 and name HA ) 3.69 1.89 1.89 !peak 6446 #SUP 0.99 #QF 0.99 assign (resid 17 and name HA ) (resid 20 and name HD2 ) 3.92 2.12 2.12 !peak 6450 #SUP 0.99 #QF 0.88 assign (resid 17 and name HA ) (resid 20 and name HD1 ) 3.92 2.12 2.12 !peak 6450 #SUP 0.99 #QF 0.88 assign (resid 18 and name HD1* ) (resid 28 and name HB1 ) 3.37 1.57 1.57 !peak 6461 #SUP 0.87 #QF 0.26 assign (resid 18 and name HD2* ) (resid 28 and name HB1 ) 3.37 1.57 1.57 !peak 6462 #SUP 0.98 #QF 0.89 assign (resid 20 and name HB2 ) (resid 21 and name HB2 ) 3.96 2.16 2.16 !peak 6488 #SUP 0.96 #QF 0.87 assign (resid 21 and name HB2 ) (resid 24 and name HN ) 4.26 2.46 2.46 !peak 6501 #SUP 0.95 #QF 0.95 assign (resid 21 and name HA ) (resid 22 and name HD1 ) 2.76 0.96 0.96 !peak 6504 #SUP 0.99 #QF 0.99 assign (resid 21 and name HA ) (resid 22 and name HD2 ) 2.73 0.93 0.93 !peak 6505 #SUP 0.98 #QF 0.98 assign (resid 22 and name HB1 ) (resid 47 and name HB* ) 3.22 1.42 1.42 !peak 6507 #SUP 1.00 assign (resid 79 and name HB1 ) (resid 81 and name HG2* ) 3.14 1.34 1.34 !peak 6508 #SUP 0.76 #QF 0.53 assign (resid 22 and name HG1 ) (resid 23 and name HG2* ) 3.52 1.72 1.72 !peak 6509 #SUP 0.99 #QF 0.99 assign (resid 22 and name HD2 ) (resid 23 and name HG2* ) 3.80 2.00 2.00 !peak 6510 #SUP 1.00 assign (resid 24 and name HA ) (resid 25 and name HD2 ) 2.76 0.96 0.96 !peak 6522 #SUP 0.99 #QF 0.99 assign (resid 24 and name HA ) (resid 25 and name HG1 ) 3.41 1.61 1.61 !peak 6528 #SUP 0.92 #QF 0.92 assign (resid 24 and name HB1 ) (resid 25 and name HD1 ) 4.07 2.27 2.27 !peak 6536 #SUP 1.00 assign (resid 24 and name HB2 ) (resid 25 and name HD1 ) 4.07 2.27 2.27 !peak 6537 #SUP 0.71 #QF 0.71 assign (resid 24 and name HB1 ) (resid 25 and name HD2 ) 3.78 1.98 1.97 !peak 6538 #SUP 0.97 #QF 0.97 assign (resid 24 and name HB2 ) (resid 25 and name HD2 ) 3.78 1.98 1.97 !peak 6539 #SUP 0.97 #QF 0.97 assign (resid 24 and name HA ) (resid 25 and name HD1 ) 2.67 0.87 0.87 !peak 6544 #SUP 0.93 #QF 0.93 assign (resid 28 and name HA ) (resid 40 and name HB2 ) 3.98 2.18 2.18 !peak 6548 #SUP 0.98 #QF 0.96 assign (resid 28 and name HA ) (resid 31 and name HD1* ) 3.25 1.45 1.45 !peak 6551 #SUP 0.96 #QF 0.96 assign (resid 17 and name HB2 ) (resid 27 and name HA ) 3.72 1.92 1.92 !peak 6554 #SUP 0.96 #QF 0.70 assign (resid 27 and name HA ) (resid 30 and name HD1* ) 3.55 1.75 1.75 !peak 6555 #SUP 1.00 assign (resid 25 and name HA ) (resid 28 and name HG2 ) 3.45 1.65 1.65 !peak 6563 #SUP 0.97 #QF 0.97 assign (resid 27 and name HB* ) (resid 28 and name HG2 ) 3.56 1.76 1.76 !peak 6579 #SUP 0.96 #QF 0.96 assign (resid 27 and name HB* ) (resid 28 and name HB1 ) 3.46 1.66 1.66 !peak 6583 #SUP 0.99 #QF 0.99 assign (resid 28 and name HB2 ) (resid 40 and name HB2 ) 3.74 1.94 1.94 !peak 6583 #SUP 0.99 #QF 0.99 assign (resid 28 and name HA ) (resid 29 and name HA ) 3.67 1.87 1.87 !peak 6596 #SUP 0.97 #QF 0.97 assign (resid 30 and name HA ) (resid 33 and name HG1 ) 3.80 2.00 2.00 !peak 6600 #SUP 0.94 #QF 0.94 assign (resid 29 and name HN ) (resid 30 and name HB2 ) 4.35 2.55 2.55 !peak 6604 #SUP 0.76 #QF 0.76 assign (resid 27 and name HA ) (resid 31 and name HD1* ) 3.76 1.96 1.96 !peak 6624 #SUP 0.96 #QF 0.96 assign (resid 31 and name HN ) (resid 32 and name HB2 ) 3.60 1.80 1.80 !peak 6627 #SUP 0.95 #QF 0.95 assign (resid 32 and name HB2 ) (resid 33 and name HA ) 4.19 2.39 2.39 !peak 6640 #SUP 0.96 #QF 0.96 assign (resid 32 and name HB1 ) (resid 33 and name HA ) 3.76 1.96 1.96 !peak 6641 #SUP 0.98 #QF 0.98 assign (resid 15 and name HG2* ) (resid 31 and name HD1* ) 3.61 1.81 1.81 !peak 6649 #SUP 1.00 assign (resid 30 and name HA ) (resid 33 and name HG2 ) 3.80 2.00 2.00 !peak 6652 #SUP 0.95 #QF 0.95 assign (resid 33 and name HA ) (resid 34 and name HG2* ) 3.71 1.91 1.91 !peak 6656 #SUP 0.99 #QF 0.99 assign (resid 31 and name HA ) (resid 34 and name HG2* ) 3.54 1.74 1.74 !peak 6659 #SUP 1.00 assign (resid 7 and name HA ) (resid 34 and name HD1* ) 3.22 1.42 1.42 !peak 6662 #SUP 0.99 #QF 0.99 assign (resid 11 and name HA ) (resid 34 and name HD1* ) 3.07 1.27 1.27 !peak 6663 #SUP 0.99 #QF 0.99 assign (resid 33 and name HB2 ) (resid 34 and name HA ) 3.83 2.03 2.03 !peak 6665 #SUP 0.95 #QF 0.70 assign (resid 33 and name HB1 ) (resid 34 and name HA ) 4.04 2.24 2.24 !peak 6665 #SUP 0.95 #QF 0.70 assign (resid 33 and name HB2 ) (resid 34 and name HB ) 4.34 2.54 2.54 !peak 6666 #SUP 0.85 #QF 0.85 assign (resid 33 and name HB2 ) (resid 34 and name HG12 ) 3.46 1.66 1.66 !peak 6667 #SUP 0.79 #QF 0.79 assign (resid 10 and name HB2 ) (resid 34 and name HD1* ) 3.38 1.58 1.58 !peak 6668 #SUP 0.90 #QF 0.24 assign (resid 10 and name HB1 ) (resid 34 and name HD1* ) 3.38 1.58 1.58 !peak 6668 #SUP 0.90 #QF 0.24 assign (resid 35 and name HB2 ) (resid 39 and name HB ) 3.90 2.10 2.10 !peak 6678 #SUP 1.00 assign (resid 36 and name HB2 ) (resid 39 and name HN ) 3.69 1.89 1.89 !peak 6685 #SUP 1.00 assign (resid 36 and name HB1 ) (resid 39 and name HN ) 3.69 1.89 1.89 !peak 6687 #SUP 0.98 #QF 0.98 assign (resid 32 and name HA ) (resid 37 and name HA ) 3.41 1.61 1.61 !peak 6694 #SUP 0.64 #QF 0.64 assign (resid 37 and name HB2 ) (resid 38 and name HA ) 3.61 1.81 1.81 !peak 6695 #SUP 1.00 assign (resid 37 and name HA ) (resid 40 and name HG ) 3.69 1.89 1.89 !peak 6700 #SUP 0.99 #QF 0.99 assign (resid 35 and name HB1 ) (resid 39 and name HB ) 3.19 1.39 1.39 !peak 6719 #SUP 1.00 assign (resid 40 and name HA ) (resid 43 and name HG2* ) 3.57 1.77 1.77 !peak 6723 #SUP 0.93 #QF 0.89 assign (resid 40 and name HA ) (resid 43 and name HB ) 2.90 1.10 1.10 !peak 6725 #SUP 0.91 #QF 0.91 assign (resid 31 and name HB2 ) (resid 40 and name HD1* ) 3.32 1.52 1.51 !peak 6727 #SUP 0.95 #QF 0.95 assign (resid 31 and name HB2 ) (resid 40 and name HD2* ) 3.32 1.52 1.51 !peak 6728 #SUP 0.93 #QF 0.93 assign (resid 40 and name HD1* ) (resid 41 and name HA ) 3.49 1.69 1.69 !peak 6729 #SUP 0.97 #QF 0.96 assign (resid 40 and name HD2* ) (resid 41 and name HA ) 3.49 1.69 1.69 !peak 6730 #SUP 0.92 #QF 0.92 assign (resid 40 and name HB1 ) (resid 41 and name HA ) 4.26 2.46 2.46 !peak 6735 #SUP 1.00 assign (resid 32 and name HD21 ) (resid 40 and name HB2 ) 4.35 2.55 2.55 !peak 6737 #SUP 0.78 #QF 0.50 assign (resid 39 and name HN ) (resid 40 and name HB2 ) 4.35 2.55 2.55 !peak 6737 #SUP 0.78 #QF 0.50 assign (resid 41 and name HA ) (resid 44 and name HD2 ) 3.53 1.73 1.73 !peak 6745 #SUP 0.89 #QF 0.76 assign (resid 41 and name HA ) (resid 44 and name HD1 ) 3.53 1.73 1.73 !peak 6745 #SUP 0.89 #QF 0.76 assign (resid 42 and name HB1 ) (resid 43 and name HA ) 4.25 2.45 2.45 !peak 6748 #SUP 1.00 assign (resid 42 and name HB2 ) (resid 43 and name HA ) 3.78 1.98 1.97 !peak 6750 #SUP 0.92 #QF 0.92 assign (resid 40 and name HB1 ) (resid 41 and name HB2 ) 4.35 2.55 2.55 !peak 6755 #SUP 1.00 assign (resid 40 and name HD1* ) (resid 41 and name HB2 ) 3.50 1.70 1.70 !peak 6756 #SUP 0.91 #QF 0.91 assign (resid 39 and name HA ) (resid 42 and name HG2 ) 3.40 1.60 1.60 !peak 6763 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 43 and name HG1* ) 3.14 1.34 1.34 !peak 6772 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 43 and name HG2* ) 3.14 1.34 1.34 !peak 6773 #SUP 1.00 assign (resid 19 and name HZ2 ) (resid 43 and name HA ) 4.17 2.37 2.37 !peak 6787 #SUP 1.00 assign (resid 31 and name HD1* ) (resid 43 and name HB ) 4.29 2.49 2.49 !peak 6797 #SUP 0.90 #QF 0.60 assign (resid 46 and name HA ) (resid 47 and name HB* ) 3.87 2.07 2.07 !peak 6807 #SUP 0.90 #QF 0.90 assign (resid 46 and name HA ) (resid 50 and name HG ) 4.33 2.53 2.53 !peak 6808 #SUP 0.80 #QF 0.80 assign (resid 19 and name HZ2 ) (resid 46 and name HB1 ) 4.00 2.20 2.20 !peak 6810 #SUP 0.95 #QF 0.95 assign (resid 47 and name HA ) (resid 50 and name HD2* ) 4.00 2.20 2.20 !peak 6825 #SUP 1.00 assign (resid 47 and name HA ) (resid 50 and name HD1* ) 4.00 2.20 2.20 !peak 6826 #SUP 0.71 #QF 0.71 assign (resid 19 and name HA ) (resid 47 and name HA ) 3.57 1.77 1.77 !peak 6827 #SUP 1.00 assign (resid 19 and name HA ) (resid 47 and name HB* ) 3.12 1.32 1.32 !peak 6828 #SUP 0.98 #QF 0.98 assign (resid 45 and name HA ) (resid 48 and name HD2 ) 4.25 2.45 2.45 !peak 6832 #SUP 0.99 #QF 0.51 assign (resid 45 and name HA ) (resid 48 and name HD1 ) 4.25 2.45 2.45 !peak 6832 #SUP 0.99 #QF 0.51 assign (resid 55 and name HA ) (resid 81 and name HG2* ) 3.78 1.98 1.97 !peak 6850 #SUP 0.99 #QF 0.99 assign (resid 50 and name HB2 ) (resid 55 and name HB ) 3.75 1.95 1.95 !peak 6851 #SUP 0.99 #QF 0.99 assign (resid 55 and name HG2* ) (resid 81 and name HG2* ) 3.15 1.35 1.35 !peak 6852 #SUP 0.97 #QF 0.97 assign (resid 55 and name HG2* ) (resid 79 and name HB1 ) 2.94 1.14 1.14 !peak 6853 #SUP 0.75 #QF 0.75 assign (resid 53 and name HB2 ) (resid 55 and name HB ) 3.57 1.77 1.77 !peak 6859 #SUP 1.00 assign (resid 53 and name HB1 ) (resid 55 and name HG11 ) 3.35 1.55 1.55 !peak 6861 #SUP 0.97 #QF 0.97 assign (resid 53 and name HB2 ) (resid 55 and name HG12 ) 3.45 1.65 1.65 !peak 6862 #SUP 1.00 assign (resid 53 and name HB1 ) (resid 55 and name HG12 ) 3.73 1.93 1.93 !peak 6863 #SUP 0.96 #QF 0.96 assign (resid 55 and name HG2* ) (resid 79 and name HA ) 3.56 1.76 1.76 !peak 6864 #SUP 0.99 #QF 0.99 assign (resid 72 and name HA ) (resid 93 and name HG2 ) 3.73 1.93 1.93 !peak 6866 #SUP 0.96 #QF 0.96 assign (resid 57 and name HA ) (resid 58 and name HB2 ) 4.28 2.48 2.48 !peak 6875 #SUP 0.98 #QF 0.86 assign (resid 57 and name HA ) (resid 79 and name HA ) 3.09 1.29 1.29 !peak 6876 #SUP 0.93 #QF 0.93 assign (resid 56 and name HA ) (resid 57 and name HA ) 3.60 1.80 1.80 !peak 6877 #SUP 0.99 #QF 0.99 assign (resid 57 and name HB1 ) (resid 79 and name HA ) 3.44 1.64 1.64 !peak 6879 #SUP 0.99 #QF 0.57 assign (resid 57 and name HA ) (resid 78 and name HN ) 3.73 1.93 1.93 !peak 6882 #SUP 1.00 assign (resid 59 and name HA ) (resid 77 and name HA ) 3.09 1.29 1.29 !peak 6886 #SUP 1.00 assign (resid 59 and name HA ) (resid 77 and name HB2 ) 3.58 1.78 1.78 !peak 6902 #SUP 0.78 #QF 0.78 assign (resid 59 and name HA ) (resid 77 and name HG ) 3.42 1.62 1.62 !peak 6904 #SUP 1.00 #QF 0.99 assign (resid 59 and name HA ) (resid 75 and name HG1* ) 4.35 2.55 2.55 !peak 6906 #SUP 0.60 #QF 0.60 assign (resid 60 and name HB1 ) (resid 77 and name HA ) 4.33 2.53 2.53 !peak 6929 #SUP 1.00 assign (resid 60 and name HG1 ) (resid 77 and name HA ) 3.55 1.75 1.75 !peak 6930 #SUP 0.99 #QF 0.99 assign (resid 60 and name HG2 ) (resid 77 and name HA ) 3.60 1.80 1.80 !peak 6931 #SUP 1.00 assign (resid 60 and name HD1 ) (resid 77 and name HA ) 3.95 2.15 2.15 !peak 6932 #SUP 0.95 #QF 0.78 assign (resid 60 and name HD2 ) (resid 77 and name HA ) 4.25 2.45 2.45 !peak 6932 #SUP 0.95 #QF 0.78 assign (resid 61 and name HA ) (resid 62 and name HB ) 3.94 2.14 2.14 !peak 6950 #SUP 0.99 #QF 0.99 assign (resid 63 and name HB1 ) (resid 74 and name HN ) 3.44 1.64 1.64 !peak 6952 #SUP 1.00 assign (resid 63 and name HB1 ) (resid 74 and name HB ) 2.99 1.19 1.19 !peak 6961 #SUP 0.88 #QF 0.88 assign (resid 63 and name HG2 ) (resid 74 and name HB ) 4.32 2.52 2.52 !peak 6965 #SUP 0.92 #QF 0.41 assign (resid 63 and name HG1 ) (resid 74 and name HB ) 4.32 2.52 2.52 !peak 6965 #SUP 0.92 #QF 0.41 assign (resid 65 and name HB ) (resid 72 and name HB2 ) 3.83 2.03 2.03 !peak 6970 #SUP 1.00 #QF 0.99 assign (resid 9 and name HA ) (resid 73 and name HG1* ) 3.50 1.70 1.70 !peak 6972 #SUP 0.91 #QF 0.77 assign (resid 64 and name HA ) (resid 73 and name HA ) 2.95 1.15 1.15 !peak 6976 #SUP 0.90 #QF 0.90 assign (resid 70 and name HA ) (resid 95 and name HA ) 3.06 1.26 1.26 !peak 6977 #SUP 0.77 #QF 0.77 assign (resid 5 and name HG2* ) (resid 66 and name HB ) 3.40 1.60 1.60 !peak 6981 #SUP 1.00 #QF 0.64 assign (resid 66 and name HB ) (resid 67 and name HA ) 3.36 1.56 1.56 !peak 6983 #SUP 0.93 #QF 0.93 assign (resid 67 and name HA ) (resid 68 and name HA2 ) 3.55 1.75 1.75 !peak 6989 #SUP 0.83 #QF 0.83 assign (resid 67 and name HA ) (resid 68 and name HA1 ) 3.55 1.75 1.75 !peak 6990 #SUP 0.96 #QF 0.96 assign (resid 68 and name HA2 ) (resid 70 and name HN ) 3.76 1.96 1.96 !peak 6992 #SUP 0.98 #QF 0.98 assign (resid 68 and name HA1 ) (resid 70 and name HN ) 3.76 1.96 1.96 !peak 6993 #SUP 0.90 #QF 0.90 assign (resid 67 and name HB1 ) (resid 70 and name HG2* ) 3.99 2.19 2.19 !peak 6995 #SUP 1.00 assign (resid 67 and name HB1 ) (resid 70 and name HB ) 3.41 1.61 1.61 !peak 7011 #SUP 0.86 #QF 0.86 assign (resid 67 and name HB2 ) (resid 70 and name HB ) 4.10 2.30 2.30 !peak 7012 #SUP 0.97 #QF 0.97 assign (resid 71 and name HB ) (resid 94 and name HN ) 3.60 1.80 1.80 !peak 7021 #SUP 1.00 assign (resid 71 and name HB ) (resid 94 and name HB1 ) 3.90 2.10 2.10 !peak 7022 #SUP 0.93 #QF 0.93 assign (resid 71 and name HB ) (resid 94 and name HB2 ) 3.10 1.30 1.30 !peak 7023 #SUP 0.94 #QF 0.94 assign (resid 66 and name HG2* ) (resid 71 and name HA ) 3.11 1.31 1.31 !peak 7024 #SUP 0.96 #QF 0.96 assign (resid 72 and name HA ) (resid 73 and name HB ) 3.69 1.89 1.89 !peak 7030 #SUP 1.00 assign (resid 72 and name HA ) (resid 93 and name HB2 ) 4.18 2.38 2.38 !peak 7031 #SUP 1.00 assign (resid 72 and name HA ) (resid 93 and name HG1 ) 3.79 1.99 1.99 !peak 7032 #SUP 0.99 #QF 0.99 assign (resid 70 and name HG2* ) (resid 72 and name HA ) 3.75 1.95 1.95 !peak 7034 #SUP 0.94 #QF 0.94 assign (resid 86 and name HG2* ) (resid 87 and name HB2 ) 3.47 1.67 1.67 !peak 7037 #SUP 0.50 #QF 0.50 assign (resid 72 and name HB1 ) (resid 93 and name HG1 ) 4.05 2.25 2.25 !peak 7039 #SUP 0.85 #QF 0.85 assign (resid 72 and name HA ) (resid 93 and name HA ) 2.98 1.18 1.18 !peak 7040 #SUP 0.98 #QF 0.98 assign (resid 66 and name HA ) (resid 72 and name HB2 ) 3.75 1.95 1.95 !peak 7041 #SUP 0.95 #QF 0.95 assign (resid 74 and name HA ) (resid 92 and name HN ) 3.41 1.61 1.61 !peak 7044 #SUP 0.97 #QF 0.97 assign (resid 73 and name HB ) (resid 92 and name HB1 ) 3.14 1.34 1.34 !peak 7058 #SUP 0.94 #QF 0.94 assign (resid 63 and name HB2 ) (resid 74 and name HB ) 2.98 1.18 1.18 !peak 7062 #SUP 1.00 assign (resid 62 and name HA ) (resid 74 and name HB ) 3.91 2.11 2.11 !peak 7067 #SUP 0.88 #QF 0.32 assign (resid 73 and name HA ) (resid 74 and name HB ) 4.05 2.25 2.25 !peak 7067 #SUP 0.88 #QF 0.32 assign (resid 75 and name HG1* ) (resid 90 and name HB2 ) 3.56 1.76 1.76 !peak 7070 #SUP 0.99 #QF 0.98 assign (resid 75 and name HB ) (resid 90 and name HB2 ) 3.80 2.00 2.00 !peak 7071 #SUP 1.00 assign (resid 74 and name HA ) (resid 75 and name HB ) 3.86 2.06 2.06 !peak 7075 #SUP 0.89 #QF 0.89 assign (resid 16 and name HE* ) (resid 75 and name HG1* ) 3.18 1.38 1.38 !peak 7077 #SUP 1.00 assign (resid 76 and name HA ) (resid 77 and name HB2 ) 3.95 2.15 2.15 !peak 7081 #SUP 0.99 #QF 0.89 assign (resid 77 and name HB2 ) (resid 78 and name HA ) 4.13 2.33 2.33 !peak 7081 #SUP 0.99 #QF 0.89 assign (resid 77 and name HB1 ) (resid 78 and name HA ) 3.88 2.08 2.08 !peak 7082 #SUP 1.00 assign (resid 76 and name HA ) (resid 77 and name HG ) 3.90 2.10 2.10 !peak 7083 #SUP 0.87 #QF 0.87 assign (resid 76 and name HA ) (resid 77 and name HD1* ) 4.11 2.31 2.31 !peak 7084 #SUP 0.98 #QF 0.94 assign (resid 76 and name HA ) (resid 77 and name HD2* ) 4.11 2.31 2.31 !peak 7085 #SUP 0.97 #QF 0.97 assign (resid 59 and name HA ) (resid 77 and name HB1 ) 3.69 1.89 1.89 !peak 7086 #SUP 0.96 #QF 0.96 assign (resid 59 and name HA ) (resid 77 and name HD2* ) 3.71 1.91 1.91 !peak 7089 #SUP 1.00 assign (resid 59 and name HA ) (resid 77 and name HD1* ) 3.71 1.91 1.91 !peak 7090 #SUP 1.00 assign (resid 59 and name HB ) (resid 77 and name HB1 ) 4.30 2.50 2.50 !peak 7094 #SUP 0.89 #QF 0.89 assign (resid 57 and name HB2 ) (resid 77 and name HB2 ) 3.76 1.96 1.96 !peak 7098 #SUP 1.00 #QF 0.98 assign (resid 57 and name HB2 ) (resid 77 and name HB1 ) 3.51 1.71 1.71 !peak 7099 #SUP 0.99 #QF 0.92 assign (resid 59 and name HB ) (resid 77 and name HD1* ) 4.26 2.46 2.46 !peak 7100 #SUP 0.89 #QF 0.71 assign (resid 77 and name HD1* ) (resid 90 and name HB2 ) 4.03 2.23 2.23 !peak 7101 #SUP 1.00 assign (resid 57 and name HB2 ) (resid 77 and name HD1* ) 3.31 1.51 1.51 !peak 7102 #SUP 0.94 #QF 0.94 assign (resid 59 and name HB ) (resid 77 and name HD2* ) 4.26 2.46 2.46 !peak 7103 #SUP 0.83 #QF 0.83 assign (resid 57 and name HB2 ) (resid 77 and name HD2* ) 3.31 1.51 1.51 !peak 7105 #SUP 0.92 #QF 0.92 assign (resid 59 and name HG2* ) (resid 77 and name HD2* ) 3.61 1.81 1.81 !peak 7108 #SUP 0.78 #QF 0.78 assign (resid 77 and name HB2 ) (resid 88 and name HG2* ) 3.64 1.84 1.84 !peak 7109 #SUP 0.99 #QF 0.99 assign (resid 77 and name HB1 ) (resid 88 and name HG2* ) 4.35 2.55 2.55 !peak 7110 #SUP 0.73 #QF 0.73 assign (resid 77 and name HG ) (resid 90 and name HD* ) 3.57 1.77 1.77 !peak 7115 #SUP 1.00 assign (resid 77 and name HG ) (resid 90 and name HE* ) 4.07 2.27 2.27 !peak 7116 #SUP 1.00 assign (resid 57 and name HE* ) (resid 77 and name HD1* ) 3.78 1.98 1.98 !peak 7120 #SUP 0.98 #QF 0.98 assign (resid 57 and name HD* ) (resid 77 and name HD1* ) 3.26 1.46 1.46 !peak 7121 #SUP 0.95 #QF 0.95 assign (resid 16 and name HD* ) (resid 77 and name HD1* ) 3.45 1.65 1.65 !peak 7124 #SUP 1.00 assign (resid 57 and name HE* ) (resid 77 and name HD2* ) 3.78 1.98 1.98 !peak 7126 #SUP 0.73 #QF 0.73 assign (resid 77 and name HD2* ) (resid 90 and name HD* ) 3.44 1.64 1.64 !peak 7128 #SUP 0.99 #QF 0.99 assign (resid 16 and name HD* ) (resid 77 and name HD2* ) 3.45 1.65 1.65 !peak 7130 #SUP 0.92 #QF 0.92 assign (resid 16 and name HE* ) (resid 77 and name HD2* ) 3.28 1.48 1.48 !peak 7131 #SUP 0.98 #QF 0.95 assign (resid 78 and name HA ) (resid 87 and name HA ) 2.94 1.14 1.14 !peak 7132 #SUP 0.96 #QF 0.96 assign (resid 57 and name HA ) (resid 79 and name HB2 ) 4.35 2.55 2.55 !peak 7139 #SUP 1.00 #QF 0.85 assign (resid 57 and name HA ) (resid 79 and name HB1 ) 4.35 2.55 2.55 !peak 7139 #SUP 1.00 #QF 0.85 assign (resid 84 and name HA ) (resid 85 and name HA ) 3.68 1.88 1.88 !peak 7140 #SUP 0.98 #QF 0.91 assign (resid 85 and name HA ) (resid 86 and name HA ) 3.88 2.08 2.08 !peak 7140 #SUP 0.98 #QF 0.91 assign (resid 89 and name HB ) (resid 109 and name HB1 ) 3.44 1.64 1.64 !peak 7142 #SUP 1.00 assign (resid 89 and name HB ) (resid 109 and name HB2 ) 3.44 1.64 1.64 !peak 7143 #SUP 1.00 assign (resid 85 and name HB ) (resid 86 and name HA ) 4.10 2.30 2.30 !peak 7147 #SUP 1.00 #QF 0.62 assign (resid 55 and name HG11 ) (resid 81 and name HB ) 4.10 2.30 2.30 !peak 7154 #SUP 1.00 assign (resid 55 and name HG12 ) (resid 81 and name HB ) 3.43 1.63 1.63 !peak 7155 #SUP 0.99 #QF 0.99 assign (resid 55 and name HD1* ) (resid 81 and name HB ) 3.90 2.10 2.10 !peak 7156 #SUP 0.90 #QF 0.90 assign (resid 55 and name HG2* ) (resid 81 and name HB ) 3.27 1.47 1.47 !peak 7157 #SUP 0.97 #QF 0.97 assign (resid 79 and name HN ) (resid 87 and name HA ) 3.31 1.51 1.51 !peak 7162 #SUP 0.98 #QF 0.98 assign (resid 86 and name HA ) (resid 87 and name HA ) 3.96 2.16 2.16 !peak 7165 #SUP 0.98 #QF 0.87 assign (resid 87 and name HA ) (resid 88 and name HA ) 4.20 2.40 2.40 !peak 7165 #SUP 0.98 #QF 0.87 assign (resid 87 and name HB1 ) (resid 88 and name HA ) 3.64 1.84 1.84 !peak 7166 #SUP 0.97 #QF 0.97 assign (resid 91 and name HB2 ) (resid 107 and name HB ) 3.20 1.40 1.40 !peak 7167 #SUP 0.98 #QF 0.98 assign (resid 91 and name HB1 ) (resid 107 and name HB ) 3.06 1.26 1.26 !peak 7169 #SUP 0.95 #QF 0.95 assign (resid 78 and name HG1 ) (resid 87 and name HA ) 3.65 1.85 1.85 !peak 7173 #SUP 1.00 #QF 0.94 assign (resid 86 and name HG2* ) (resid 87 and name HA ) 3.82 2.02 2.02 !peak 7174 #SUP 0.97 #QF 0.97 assign (resid 93 and name HB2 ) (resid 105 and name HB ) 3.15 1.35 1.35 !peak 7193 #SUP 0.99 #QF 0.97 assign (resid 76 and name HA ) (resid 89 and name HA ) 2.95 1.15 1.15 !peak 7194 #SUP 0.97 #QF 0.97 assign (resid 89 and name HB ) (resid 90 and name HA ) 3.53 1.73 1.73 !peak 7195 #SUP 0.67 #QF 0.67 assign (resid 93 and name HN ) (resid 105 and name HB ) 3.41 1.61 1.61 !peak 7196 #SUP 0.98 #QF 0.98 assign (resid 74 and name HA ) (resid 91 and name HG2 ) 3.54 1.74 1.74 !peak 7224 #SUP 0.99 #QF 0.99 assign (resid 74 and name HA ) (resid 91 and name HA ) 2.88 1.08 1.08 !peak 7225 #SUP 0.85 #QF 0.85 assign (resid 74 and name HG2* ) (resid 91 and name HA ) 3.88 2.08 2.08 !peak 7228 #SUP 1.00 #QF 0.98 assign (resid 91 and name HA ) (resid 92 and name HB2 ) 4.14 2.34 2.34 !peak 7228 #SUP 1.00 #QF 0.98 assign (resid 91 and name HA ) (resid 92 and name HG ) 3.69 1.89 1.89 !peak 7230 #SUP 0.94 #QF 0.94 assign (resid 16 and name HE* ) (resid 92 and name HD2* ) 3.16 1.36 1.36 !peak 7236 #SUP 0.99 #QF 0.90 assign (resid 12 and name HA ) (resid 92 and name HD1* ) 3.17 1.37 1.37 !peak 7241 #SUP 1.00 assign (resid 90 and name HB1 ) (resid 92 and name HD1* ) 3.72 1.92 1.92 !peak 7242 #SUP 1.00 #QF 0.97 assign (resid 12 and name HA ) (resid 92 and name HD2* ) 3.17 1.37 1.37 !peak 7243 #SUP 1.00 assign (resid 73 and name HB ) (resid 92 and name HB2 ) 3.34 1.54 1.54 !peak 7247 #SUP 0.99 #QF 0.99 assign (resid 73 and name HB ) (resid 92 and name HG ) 3.73 1.93 1.93 !peak 7248 #SUP 0.88 #QF 0.88 assign (resid 73 and name HB ) (resid 92 and name HD1* ) 3.65 1.85 1.85 !peak 7249 #SUP 0.99 #QF 0.99 assign (resid 73 and name HB ) (resid 92 and name HD2* ) 3.65 1.85 1.85 !peak 7250 #SUP 1.00 assign (resid 12 and name HB* ) (resid 92 and name HD1* ) 2.74 0.94 0.94 !peak 7252 #SUP 0.97 #QF 0.97 assign (resid 15 and name HG2* ) (resid 92 and name HD2* ) 3.71 1.91 1.91 !peak 7259 #SUP 0.95 #QF 0.95 assign (resid 93 and name HB1 ) (resid 105 and name HB ) 3.20 1.40 1.40 !peak 7260 #SUP 0.97 #QF 0.97 assign (resid 91 and name HN ) (resid 92 and name HD1* ) 4.35 2.55 2.55 !peak 7269 #SUP 0.97 #QF 0.97 assign (resid 93 and name HB2 ) (resid 105 and name HN ) 3.66 1.86 1.86 !peak 7279 #SUP 0.99 #QF 0.99 assign (resid 70 and name HG2* ) (resid 93 and name HB2 ) 3.61 1.81 1.81 !peak 7281 #SUP 0.95 #QF 0.88 assign (resid 93 and name HB2 ) (resid 105 and name HG2* ) 3.82 2.02 2.02 !peak 7281 #SUP 0.95 #QF 0.88 assign (resid 71 and name HG1* ) (resid 94 and name HB2 ) 3.53 1.73 1.73 !peak 7290 #SUP 0.99 #QF 0.97 assign (resid 94 and name HB2 ) (resid 101 and name HG2* ) 3.34 1.54 1.54 !peak 7291 #SUP 1.00 assign (resid 94 and name HA ) (resid 104 and name HG1* ) 3.89 2.09 2.09 !peak 7299 #SUP 0.78 #QF 0.78 assign (resid 94 and name HB2 ) (resid 101 and name HD1* ) 3.87 2.07 2.07 !peak 7300 #SUP 1.00 #QF 0.96 assign (resid 95 and name HB1 ) (resid 103 and name HN ) 3.40 1.60 1.60 !peak 7329 #SUP 1.00 assign (resid 97 and name HB1 ) (resid 102 and name HB1 ) 3.65 1.85 1.85 !peak 7334 #SUP 1.00 assign (resid 96 and name HA ) (resid 97 and name HB1 ) 4.08 2.28 2.28 !peak 7339 #SUP 1.00 assign (resid 97 and name HB1 ) (resid 98 and name HA1 ) 3.77 1.97 1.97 !peak 7340 #SUP 0.54 #QF 0.54 assign (resid 98 and name HA1 ) (resid 100 and name HN ) 3.50 1.70 1.70 !peak 7345 #SUP 0.99 #QF 0.99 assign (resid 96 and name HA ) (resid 97 and name HB2 ) 3.87 2.07 2.07 !peak 7346 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 98 and name HA1 ) 4.27 2.47 2.47 !peak 7347 #SUP 0.62 #QF 0.62 assign (resid 98 and name HA2 ) (resid 99 and name HA ) 3.75 1.95 1.95 !peak 7348 #SUP 1.00 assign (resid 98 and name HA1 ) (resid 99 and name HA ) 3.50 1.70 1.70 !peak 7350 #SUP 0.99 #QF 0.99 assign (resid 97 and name HB2 ) (resid 102 and name HB1 ) 3.84 2.04 2.04 !peak 7353 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 102 and name HG2 ) 3.41 1.61 1.61 !peak 7354 #SUP 0.78 #QF 0.78 assign (resid 97 and name HB2 ) (resid 100 and name HG2* ) 3.94 2.14 2.14 !peak 7356 #SUP 0.99 #QF 0.99 assign (resid 4 and name HD1* ) (resid 100 and name HB ) 4.00 2.20 2.20 !peak 7367 #SUP 0.90 #QF 0.90 assign (resid 9 and name HE1 ) (resid 13 and name HD1* ) 3.44 1.64 1.64 !peak 7369 #SUP 0.79 #QF 0.51 assign (resid 94 and name HB1 ) (resid 101 and name HG2* ) 3.18 1.38 1.38 !peak 7378 #SUP 1.00 assign (resid 1 and name HE* ) (resid 101 and name HD1* ) 4.35 2.55 2.55 !peak 7379 #SUP 0.97 #QF 0.37 assign (resid 96 and name HB ) (resid 101 and name HD1* ) 4.35 2.55 2.55 !peak 7379 #SUP 0.97 #QF 0.37 assign (resid 94 and name HB1 ) (resid 101 and name HD1* ) 3.57 1.77 1.77 !peak 7380 #SUP 0.99 #QF 0.99 assign (resid 8 and name HA ) (resid 101 and name HD1* ) 3.21 1.41 1.41 !peak 7381 #SUP 1.00 assign (resid 96 and name HB ) (resid 101 and name HA ) 3.59 1.79 1.79 !peak 7382 #SUP 1.00 assign (resid 7 and name HB* ) (resid 101 and name HD1* ) 3.14 1.34 1.34 !peak 7383 #SUP 0.98 #QF 0.98 assign (resid 96 and name HA ) (resid 101 and name HA ) 2.94 1.14 1.14 !peak 7390 #SUP 0.92 #QF 0.92 assign (resid 96 and name HA ) (resid 101 and name HB ) 4.09 2.29 2.29 !peak 7391 #SUP 1.00 #QF 0.92 assign (resid 100 and name HA ) (resid 101 and name HB ) 4.33 2.53 2.53 !peak 7391 #SUP 1.00 #QF 0.92 assign (resid 94 and name HD* ) (resid 101 and name HD1* ) 3.22 1.42 1.42 !peak 7394 #SUP 0.97 #QF 0.97 assign (resid 94 and name HE* ) (resid 101 and name HD1* ) 3.88 2.08 2.08 !peak 7395 #SUP 1.00 assign (resid 94 and name HE* ) (resid 101 and name HG2* ) 3.64 1.84 1.84 !peak 7397 #SUP 1.00 assign (resid 97 and name HB1 ) (resid 102 and name HG2 ) 3.38 1.58 1.58 !peak 7398 #SUP 1.00 assign (resid 97 and name HB1 ) (resid 102 and name HG1 ) 3.38 1.58 1.58 !peak 7400 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 102 and name HG1 ) 3.41 1.61 1.61 !peak 7401 #SUP 1.00 assign (resid 97 and name HB1 ) (resid 102 and name HD2 ) 3.90 2.10 2.10 !peak 7402 #SUP 0.99 #QF 0.99 assign (resid 97 and name HB2 ) (resid 102 and name HD2 ) 3.89 2.09 2.09 !peak 7403 #SUP 0.99 #QF 0.99 assign (resid 97 and name HB1 ) (resid 102 and name HD1 ) 3.90 2.10 2.10 !peak 7404 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 102 and name HD1 ) 3.89 2.09 2.09 !peak 7405 #SUP 1.00 assign (resid 97 and name HB1 ) (resid 102 and name HB2 ) 3.90 2.10 2.10 !peak 7408 #SUP 1.00 assign (resid 97 and name HB2 ) (resid 102 and name HB2 ) 3.74 1.94 1.94 !peak 7409 #SUP 0.99 #QF 0.99 assign (resid 97 and name HN ) (resid 102 and name HG1 ) 3.61 1.81 1.81 !peak 7412 #SUP 0.93 #QF 0.93 assign (resid 97 and name HN ) (resid 102 and name HG2 ) 3.61 1.81 1.81 !peak 7413 #SUP 0.96 #QF 0.96 assign (resid 100 and name HG2* ) (resid 102 and name HD1 ) 3.33 1.53 1.53 !peak 7417 #SUP 0.98 #QF 0.98 assign (resid 100 and name HG2* ) (resid 102 and name HD2 ) 3.33 1.53 1.53 !peak 7418 #SUP 0.99 #QF 0.99 assign (resid 101 and name HD1* ) (resid 102 and name HA ) 4.35 2.55 2.55 !peak 7428 #SUP 0.85 #QF 0.76 assign (resid 95 and name HB1 ) (resid 103 and name HB2 ) 3.27 1.47 1.47 !peak 7430 #SUP 0.99 #QF 0.26 assign (resid 94 and name HE* ) (resid 104 and name HB ) 3.65 1.85 1.85 !peak 7432 #SUP 0.99 #QF 0.99 assign (resid 94 and name HE* ) (resid 104 and name HG2* ) 3.52 1.72 1.72 !peak 7438 #SUP 0.99 #QF 0.99 assign (resid 103 and name HA ) (resid 104 and name HB ) 3.67 1.87 1.87 !peak 7440 #SUP 0.95 #QF 0.95 assign (resid 94 and name HA ) (resid 104 and name HB ) 3.83 2.03 2.03 !peak 7441 #SUP 1.00 assign (resid 104 and name HG1* ) (resid 105 and name HA ) 4.31 2.51 2.51 !peak 7442 #SUP 0.78 #QF 0.78 assign (resid 104 and name HG2* ) (resid 105 and name HA ) 4.31 2.51 2.51 !peak 7443 #SUP 0.99 #QF 0.96 assign (resid 39 and name HG1* ) (resid 104 and name HB ) 3.29 1.49 1.49 !peak 7447 #SUP 0.86 #QF 0.67 assign (resid 92 and name HG ) (resid 106 and name HG1* ) 3.08 1.28 1.28 !peak 7453 #SUP 0.46 #QF 0.46 assign (resid 90 and name HE* ) (resid 108 and name HB1 ) 3.54 1.74 1.74 !peak 7462 #SUP 1.00 assign (resid 90 and name HE* ) (resid 108 and name HG1 ) 3.73 1.93 1.93 !peak 7465 #SUP 1.00 assign (resid 90 and name HA ) (resid 108 and name HA ) 2.95 1.15 1.15 !peak 7466 #SUP 0.99 #QF 0.99 assign (resid 90 and name HN ) (resid 108 and name HA ) 3.92 2.12 2.12 !peak 7491 #SUP 1.00 assign (resid 76 and name HN ) (resid 89 and name HG2* ) 3.46 1.66 1.66 !peak 7495 #SUP 0.94 #QF 0.94 assign (resid 73 and name HG1* ) (resid 94 and name HZ ) 3.86 2.06 2.06 !peak 7528 #SUP 0.88 #QF 0.88 assign (resid 35 and name HD2* ) (resid 94 and name HD* ) 3.57 1.77 1.77 !peak 7534 #SUP 0.98 #QF 0.79 assign (resid 3 and name HB1 ) (resid 6 and name HB1 ) 3.91 2.11 2.11 !peak 7555 #SUP 0.94 #QF 0.79 assign (resid 3 and name HB2 ) (resid 6 and name HB1 ) 3.91 2.11 2.11 !peak 7556 #SUP 0.98 #QF 0.96 assign (resid 5 and name HA ) (resid 7 and name HB* ) 4.06 2.26 2.26 !peak 7559 #SUP 0.99 #QF 0.99 assign (resid 5 and name HA ) (resid 66 and name HG2* ) 3.58 1.78 1.78 !peak 7560 #SUP 0.99 #QF 0.99 assign (resid 4 and name HA ) (resid 5 and name HA ) 3.98 2.18 2.18 !peak 7563 #SUP 1.00 #QF 0.97 assign (resid 5 and name HA ) (resid 6 and name HA ) 4.22 2.42 2.42 !peak 7563 #SUP 1.00 #QF 0.97 assign (resid 35 and name HA ) (resid 39 and name HB ) 4.16 2.36 2.36 !peak 7565 #SUP 1.00 assign (resid 5 and name HB ) (resid 6 and name HA ) 3.70 1.90 1.90 !peak 7566 #SUP 1.00 assign (resid 5 and name HB ) (resid 8 and name HN ) 4.23 2.43 2.43 !peak 7572 #SUP 0.96 #QF 0.96 assign (resid 29 and name HG2 ) (resid 30 and name HD2* ) 4.35 2.55 2.55 !peak 7574 #SUP 0.56 #QF 0.43 assign (resid 6 and name HG2 ) (resid 7 and name HB* ) 4.35 2.55 2.55 !peak 7575 #SUP 0.98 #QF 0.94 assign (resid 6 and name HG1 ) (resid 7 and name HB* ) 4.35 2.55 2.55 !peak 7575 #SUP 0.98 #QF 0.94 assign (resid 6 and name HB1 ) (resid 7 and name HA ) 3.58 1.78 1.78 !peak 7585 #SUP 0.85 #QF 0.85 assign (resid 9 and name HE2 ) (resid 13 and name HD1* ) 3.44 1.64 1.64 !peak 7593 #SUP 0.56 #QF 0.56 assign (resid 6 and name HA ) (resid 9 and name HG1 ) 4.24 2.44 2.44 !peak 7594 #SUP 1.00 assign (resid 6 and name HA ) (resid 9 and name HD2 ) 3.80 2.00 2.00 !peak 7597 #SUP 0.95 #QF 0.70 assign (resid 6 and name HA ) (resid 9 and name HD1 ) 3.99 2.19 2.19 !peak 7597 #SUP 0.95 #QF 0.70 assign (resid 11 and name HA ) (resid 31 and name HG ) 4.22 2.42 2.42 !peak 7601 #SUP 0.98 #QF 0.80 assign (resid 10 and name HB2 ) (resid 11 and name HA ) 4.35 2.55 2.55 !peak 7602 #SUP 0.98 #QF 0.68 assign (resid 10 and name HB1 ) (resid 11 and name HA ) 4.35 2.55 2.55 !peak 7602 #SUP 0.98 #QF 0.68 assign (resid 10 and name HB2 ) (resid 11 and name HB* ) 4.32 2.52 2.52 !peak 7603 #SUP 0.99 #QF 0.78 assign (resid 10 and name HB1 ) (resid 11 and name HB* ) 4.32 2.52 2.52 !peak 7603 #SUP 0.99 #QF 0.78 assign (resid 12 and name HA ) (resid 13 and name HA ) 3.76 1.96 1.96 !peak 7606 #SUP 0.95 #QF 0.95 assign (resid 16 and name HD* ) (resid 75 and name HG2* ) 3.86 2.06 2.06 !peak 7616 #SUP 0.75 #QF 0.75 assign (resid 29 and name HA ) (resid 32 and name HD22 ) 3.83 2.03 2.03 !peak 7621 #SUP 1.00 assign (resid 14 and name HN ) (resid 31 and name HD1* ) 4.29 2.49 2.49 !peak 7622 #SUP 0.98 #QF 0.97 assign (resid 29 and name HN ) (resid 31 and name HD1* ) 4.35 2.55 2.55 !peak 7622 #SUP 0.98 #QF 0.97 assign (resid 10 and name HN ) (resid 34 and name HD1* ) 3.66 1.86 1.86 !peak 7630 #SUP 0.92 #QF 0.70 assign (resid 31 and name HN ) (resid 34 and name HD1* ) 4.01 2.21 2.21 !peak 7630 #SUP 0.92 #QF 0.70 assign (resid 104 and name HG1* ) (resid 106 and name HB ) 4.35 2.55 2.55 !peak 7639 #SUP 0.93 #QF 0.93 assign (resid 13 and name HA ) (resid 59 and name HG2* ) 4.09 2.29 2.29 !peak 7649 #SUP 0.98 #QF 0.91 assign (resid 59 and name HA ) (resid 60 and name HB1 ) 4.30 2.50 2.50 !peak 7655 #SUP 0.98 #QF 0.98 assign (resid 59 and name HA ) (resid 60 and name HG1 ) 4.03 2.23 2.23 !peak 7656 #SUP 1.00 assign (resid 60 and name HG1 ) (resid 78 and name HN ) 3.61 1.81 1.81 !peak 7657 #SUP 1.00 assign (resid 61 and name HG1 ) (resid 76 and name HB1 ) 3.48 1.68 1.68 !peak 7664 #SUP 0.78 #QF 0.78 assign (resid 66 and name HB ) (resid 72 and name HN ) 4.21 2.41 2.41 !peak 7667 #SUP 1.00 assign (resid 65 and name HB ) (resid 72 and name HN ) 4.22 2.42 2.42 !peak 7668 #SUP 0.99 #QF 0.99 assign (resid 66 and name HA ) (resid 67 and name HB2 ) 3.93 2.13 2.13 !peak 7672 #SUP 0.89 #QF 0.89 assign (resid 65 and name HN ) (resid 72 and name HB2 ) 3.33 1.53 1.53 !peak 7679 #SUP 1.00 assign (resid 74 and name HG2* ) (resid 75 and name HB ) 4.14 2.34 2.34 !peak 7682 #SUP 1.00 assign (resid 16 and name HD* ) (resid 75 and name HG1* ) 3.86 2.06 2.06 !peak 7694 #SUP 1.00 assign (resid 75 and name HG1* ) (resid 90 and name HD* ) 3.65 1.85 1.85 !peak 7695 #SUP 0.95 #QF 0.95 assign (resid 77 and name HB1 ) (resid 90 and name HD* ) 4.14 2.34 2.34 !peak 7706 #SUP 1.00 assign (resid 77 and name HB1 ) (resid 90 and name HE* ) 3.90 2.10 2.10 !peak 7707 #SUP 0.99 #QF 0.99 assign (resid 80 and name HA ) (resid 81 and name HB ) 4.21 2.41 2.41 !peak 7725 #SUP 0.99 #QF 0.96 assign (resid 84 and name HB ) (resid 85 and name HA ) 4.35 2.55 2.55 !peak 7725 #SUP 0.99 #QF 0.96 assign (resid 87 and name HA ) (resid 88 and name HG2* ) 4.19 2.39 2.39 !peak 7728 #SUP 1.00 assign (resid 78 and name HA ) (resid 87 and name HB1 ) 4.04 2.24 2.24 !peak 7730 #SUP 0.99 #QF 0.99 assign (resid 85 and name HA ) (resid 86 and name HB ) 3.76 1.96 1.96 !peak 7737 #SUP 0.91 #QF 0.91 assign (resid 4 and name HD1* ) (resid 101 and name HD1* ) 3.17 1.37 1.37 !peak 7776 #SUP 0.97 #QF 0.53 assign (resid 8 and name HB* ) (resid 101 and name HD1* ) 3.05 1.25 1.25 !peak 7777 #SUP 0.97 #QF 0.97 assign (resid 94 and name HA ) (resid 104 and name HG2* ) 3.89 2.09 2.09 !peak 7784 #SUP 0.83 #QF 0.83 assign (resid 104 and name HG2* ) (resid 106 and name HB ) 4.35 2.55 2.55 !peak 7793 #SUP 0.94 #QF 0.88 assign (resid 104 and name HG1* ) (resid 106 and name HG2* ) 4.35 2.55 2.55 !peak 7794 #SUP 0.37 #QF 0.37 assign (resid 104 and name HG1* ) (resid 106 and name HG1* ) 4.35 2.55 2.55 !peak 7795 #SUP 1.00 #QF 0.63 assign (resid 104 and name HG2* ) (resid 106 and name HG1* ) 4.35 2.55 2.55 !peak 7795 #SUP 1.00 #QF 0.63 assign (resid 15 and name HG2* ) (resid 106 and name HG1* ) 3.56 1.76 1.76 !peak 7797 #SUP 0.95 #QF 0.95 assign (resid 105 and name HG2* ) (resid 106 and name HB ) 4.08 2.28 2.28 !peak 7800 #SUP 0.68 #QF 0.48 assign (resid 12 and name HB* ) (resid 13 and name HG11 ) 2.93 1.13 1.13 !peak 7804 #SUP 0.89 #QF 0.89 assign (resid 12 and name HB* ) (resid 73 and name HB ) 3.36 1.56 1.56 !peak 7807 #SUP 0.92 #QF 0.92 assign (resid 12 and name HA ) (resid 92 and name HG ) 3.69 1.89 1.89 !peak 7808 #SUP 0.74 #QF 0.74 assign (resid 12 and name HB* ) (resid 13 and name HD1* ) 3.16 1.36 1.36 !peak 7810 #SUP 0.99 #QF 0.99 assign (resid 12 and name HB* ) (resid 13 and name HB ) 3.70 1.90 1.90 !peak 7813 #SUP 0.83 #QF 0.83 assign (resid 13 and name HB ) (resid 14 and name HA ) 3.90 2.10 2.10 !peak 7817 #SUP 0.93 #QF 0.93 assign (resid 13 and name HG2* ) (resid 14 and name HA ) 3.24 1.44 1.44 !peak 7818 #SUP 1.00 assign (resid 14 and name HB* ) (resid 27 and name HA ) 2.75 0.95 0.95 !peak 7821 #SUP 1.00 assign (resid 14 and name HB* ) (resid 31 and name HA ) 3.63 1.83 1.83 !peak 7822 #SUP 1.00 assign (resid 14 and name HB* ) (resid 31 and name HG ) 2.96 1.16 1.16 !peak 7823 #SUP 0.96 #QF 0.63 assign (resid 15 and name HA ) (resid 31 and name HD1* ) 2.90 1.10 1.10 !peak 7825 #SUP 0.86 #QF 0.86 assign (resid 15 and name HG11 ) (resid 31 and name HD2* ) 3.30 1.50 1.50 !peak 7827 #SUP 1.00 assign (resid 15 and name HD1* ) (resid 92 and name HD2* ) 3.34 1.54 1.54 !peak 7830 #SUP 0.99 #QF 0.99 assign (resid 15 and name HD1* ) (resid 31 and name HD2* ) 2.76 0.96 0.96 !peak 7831 #SUP 0.95 #QF 0.95 assign (resid 15 and name HD1* ) (resid 92 and name HB1 ) 3.42 1.62 1.62 !peak 7834 #SUP 0.98 #QF 0.95 assign (resid 15 and name HD1* ) (resid 104 and name HB ) 3.80 2.00 2.00 !peak 7834 #SUP 0.98 #QF 0.95 assign (resid 12 and name HA ) (resid 15 and name HD1* ) 2.87 1.07 1.07 !peak 7836 #SUP 0.98 #QF 0.98 assign (resid 15 and name HD1* ) (resid 92 and name HD1* ) 3.34 1.54 1.54 !peak 7840 #SUP 0.84 #QF 0.80 assign (resid 14 and name HN ) (resid 15 and name HB ) 3.83 2.03 2.03 !peak 7848 #SUP 0.99 #QF 0.99 assign (resid 18 and name HB2 ) (resid 31 and name HD1* ) 3.56 1.76 1.76 !peak 7854 #SUP 1.00 assign (resid 18 and name HB1 ) (resid 31 and name HD1* ) 4.08 2.28 2.28 !peak 7855 #SUP 1.00 assign (resid 18 and name HG ) (resid 31 and name HD1* ) 3.59 1.79 1.79 !peak 7856 #SUP 0.99 #QF 0.99 assign (resid 18 and name HD2* ) (resid 31 and name HD1* ) 3.20 1.40 1.40 !peak 7857 #SUP 0.94 #QF 0.94 assign (resid 18 and name HD1* ) (resid 31 and name HD1* ) 3.20 1.40 1.40 !peak 7858 #SUP 0.98 #QF 0.98 assign (resid 30 and name HD1* ) (resid 31 and name HD1* ) 3.43 1.63 1.63 !peak 7858 #SUP 0.98 #QF 0.98 assign (resid 18 and name HB2 ) (resid 27 and name HB* ) 3.57 1.77 1.77 !peak 7860 #SUP 0.99 #QF 0.99 assign (resid 18 and name HG ) (resid 27 and name HB* ) 3.14 1.34 1.34 !peak 7861 #SUP 0.99 #QF 0.99 assign (resid 18 and name HD2* ) (resid 27 and name HB* ) 2.98 1.18 1.18 !peak 7862 #SUP 0.80 #QF 0.80 assign (resid 18 and name HA ) (resid 22 and name HA ) 3.13 1.33 1.33 !peak 7864 #SUP 0.91 #QF 0.91 assign (resid 18 and name HB2 ) (resid 22 and name HA ) 4.10 2.30 2.30 !peak 7865 #SUP 0.95 #QF 0.95 assign (resid 18 and name HB1 ) (resid 22 and name HA ) 3.71 1.91 1.91 !peak 7866 #SUP 0.99 #QF 0.99 assign (resid 18 and name HG ) (resid 22 and name HA ) 3.63 1.83 1.83 !peak 7867 #SUP 0.99 #QF 0.99 assign (resid 15 and name HA ) (resid 18 and name HG ) 3.88 2.08 2.08 !peak 7870 #SUP 0.90 #QF 0.90 assign (resid 11 and name HA ) (resid 30 and name HD1* ) 3.14 1.34 1.34 !peak 7874 #SUP 0.29 #QF 0.29 assign (resid 23 and name HB ) (resid 24 and name HN ) 3.64 1.84 1.84 !peak 7881 #SUP 0.76 #QF 0.76 assign (resid 23 and name HA ) (resid 28 and name HE22 ) 3.61 1.81 1.81 !peak 7883 #SUP 1.00 assign (resid 17 and name HN ) (resid 27 and name HB* ) 3.57 1.77 1.77 !peak 7885 #SUP 0.98 #QF 0.34 assign (resid 17 and name HB2 ) (resid 27 and name HB* ) 2.80 1.00 1.00 !peak 7890 #SUP 0.99 #QF 0.99 assign (resid 17 and name HB1 ) (resid 27 and name HB* ) 3.01 1.21 1.21 !peak 7891 #SUP 1.00 assign (resid 24 and name HB1 ) (resid 27 and name HB* ) 3.13 1.33 1.33 !peak 7893 #SUP 0.98 #QF 0.98 assign (resid 24 and name HB2 ) (resid 27 and name HB* ) 3.13 1.33 1.33 !peak 7894 #SUP 0.83 #QF 0.83 assign (resid 27 and name HB* ) (resid 28 and name HA ) 3.65 1.85 1.85 !peak 7895 #SUP 0.99 #QF 0.99 assign (resid 18 and name HD1* ) (resid 27 and name HB* ) 2.98 1.18 1.18 !peak 7901 #SUP 0.78 #QF 0.78 assign (resid 27 and name HB* ) (resid 31 and name HD1* ) 3.26 1.46 1.46 !peak 7902 #SUP 0.93 #QF 0.93 assign (resid 14 and name HB* ) (resid 30 and name HB1 ) 3.53 1.73 1.73 !peak 7903 #SUP 1.00 assign (resid 14 and name HB* ) (resid 30 and name HD2* ) 2.53 0.73 0.73 !peak 7904 #SUP 0.99 #QF 0.99 assign (resid 34 and name HB ) (resid 101 and name HD1* ) 4.00 2.20 2.20 !peak 7907 #SUP 0.94 #QF 0.94 assign (resid 34 and name HG2* ) (resid 101 and name HD1* ) 3.75 1.95 1.95 !peak 7909 #SUP 0.94 #QF 0.94 assign (resid 34 and name HG11 ) (resid 101 and name HD1* ) 3.78 1.98 1.97 !peak 7910 #SUP 0.76 #QF 0.67 assign (resid 11 and name HB* ) (resid 34 and name HB ) 3.34 1.54 1.54 !peak 7911 #SUP 0.98 #QF 0.98 assign (resid 11 and name HB* ) (resid 34 and name HD1* ) 2.75 0.95 0.95 !peak 7913 #SUP 0.99 #QF 0.99 assign (resid 7 and name HB* ) (resid 34 and name HD1* ) 2.85 1.05 1.05 !peak 7914 #SUP 0.94 #QF 0.94 assign (resid 7 and name HB* ) (resid 34 and name HG12 ) 3.57 1.77 1.77 !peak 7915 #SUP 1.00 assign (resid 30 and name HB2 ) (resid 34 and name HG12 ) 3.71 1.91 1.91 !peak 7916 #SUP 0.80 #QF 0.80 assign (resid 30 and name HB2 ) (resid 34 and name HD1* ) 3.48 1.68 1.68 !peak 7917 #SUP 0.95 #QF 0.89 assign (resid 34 and name HG12 ) (resid 35 and name HB2 ) 3.69 1.89 1.89 !peak 7918 #SUP 0.85 #QF 0.64 assign (resid 33 and name HB2 ) (resid 34 and name HD1* ) 3.92 2.12 2.12 !peak 7919 #SUP 0.64 #QF 0.64 assign (resid 31 and name HG ) (resid 34 and name HD1* ) 3.32 1.52 1.52 !peak 7920 #SUP 0.99 #QF 0.99 assign (resid 1 and name HE* ) (resid 34 and name HG2* ) 3.15 1.35 1.35 !peak 7923 #SUP 0.44 #QF 0.44 assign (resid 7 and name HB* ) (resid 34 and name HG2* ) 2.89 1.09 1.09 !peak 7924 #SUP 0.99 #QF 0.99 assign (resid 33 and name HN ) (resid 34 and name HG12 ) 3.88 2.08 2.08 !peak 7925 #SUP 0.89 #QF 0.89 assign (resid 33 and name HN ) (resid 34 and name HG11 ) 4.07 2.27 2.27 !peak 7926 #SUP 0.99 #QF 0.99 assign (resid 31 and name HA ) (resid 35 and name HB1 ) 3.88 2.08 2.08 !peak 7933 #SUP 1.00 assign (resid 35 and name HB1 ) (resid 40 and name HA ) 4.26 2.46 2.46 !peak 7933 #SUP 1.00 assign (resid 31 and name HA ) (resid 35 and name HG ) 3.80 2.00 2.00 !peak 7934 #SUP 0.90 #QF 0.90 assign (resid 31 and name HB1 ) (resid 35 and name HD2* ) 4.33 2.53 2.53 !peak 7938 #SUP 0.82 #QF 0.82 assign (resid 34 and name HG11 ) (resid 35 and name HB1 ) 3.59 1.79 1.79 !peak 7940 #SUP 0.71 #QF 0.71 assign (resid 35 and name HG ) (resid 39 and name HG1* ) 3.47 1.67 1.67 !peak 7943 #SUP 0.75 #QF 0.75 assign (resid 15 and name HD1* ) (resid 35 and name HD2* ) 3.61 1.81 1.81 !peak 7946 #SUP 0.63 #QF 0.63 assign (resid 37 and name HB2 ) (resid 40 and name HN ) 4.35 2.55 2.55 !peak 7950 #SUP 1.00 assign (resid 37 and name HB2 ) (resid 41 and name HN ) 4.31 2.51 2.51 !peak 7951 #SUP 0.98 #QF 0.98 assign (resid 37 and name HB1 ) (resid 40 and name HN ) 4.35 2.55 2.55 !peak 7952 #SUP 0.88 #QF 0.84 assign (resid 36 and name HN ) (resid 37 and name HD2 ) 3.96 2.16 2.16 !peak 7955 #SUP 1.00 assign (resid 36 and name HA ) (resid 37 and name HD1 ) 2.82 1.02 1.02 !peak 7957 #SUP 1.00 assign (resid 36 and name HA ) (resid 37 and name HD2 ) 2.82 1.02 1.02 !peak 7958 #SUP 0.99 #QF 0.99 assign (resid 36 and name HA ) (resid 37 and name HG2 ) 3.70 1.90 1.90 !peak 7959 #SUP 1.00 assign (resid 36 and name HA ) (resid 37 and name HG1 ) 3.70 1.90 1.90 !peak 7960 #SUP 1.00 assign (resid 22 and name HD2 ) (resid 51 and name HE21 ) 4.10 2.30 2.30 !peak 7961 #SUP 1.00 #QF 0.21 assign (resid 39 and name HG2* ) (resid 104 and name HB ) 3.29 1.49 1.49 !peak 7969 #SUP 0.88 #QF 0.88 assign (resid 35 and name HG ) (resid 39 and name HG2* ) 3.47 1.67 1.67 !peak 7970 #SUP 1.00 #QF 0.99 assign (resid 4 and name HG2* ) (resid 96 and name HB ) 3.29 1.49 1.49 !peak 7974 #SUP 0.92 #QF 0.92 assign (resid 4 and name HG2* ) (resid 5 and name HB ) 4.01 2.21 2.21 !peak 7975 #SUP 1.00 assign (resid 53 and name HB2 ) (resid 55 and name HD1* ) 2.84 1.04 1.04 !peak 7976 #SUP 0.83 #QF 0.83 assign (resid 53 and name HB1 ) (resid 55 and name HD1* ) 3.23 1.43 1.43 !peak 7977 #SUP 0.94 #QF 0.94 assign (resid 32 and name HA ) (resid 40 and name HB2 ) 4.19 2.39 2.39 !peak 7986 #SUP 0.99 #QF 0.54 assign (resid 40 and name HB2 ) (resid 41 and name HA ) 4.35 2.55 2.55 !peak 7986 #SUP 0.99 #QF 0.54 assign (resid 40 and name HD2* ) (resid 41 and name HB2 ) 3.50 1.70 1.70 !peak 7989 #SUP 0.94 #QF 0.94 assign (resid 39 and name HB ) (resid 40 and name HB1 ) 3.80 2.00 2.00 !peak 7991 #SUP 0.99 #QF 0.99 assign (resid 31 and name HB2 ) (resid 40 and name HB2 ) 3.33 1.53 1.53 !peak 7992 #SUP 0.96 #QF 0.96 assign (resid 39 and name HB ) (resid 40 and name HB2 ) 4.35 2.55 2.55 !peak 7993 #SUP 0.98 #QF 0.98 assign (resid 41 and name HB1 ) (resid 42 and name HA ) 3.95 2.15 2.15 !peak 7994 #SUP 0.70 #QF 0.70 assign (resid 15 and name HB ) (resid 43 and name HG1* ) 3.68 1.88 1.88 !peak 8000 #SUP 0.95 #QF 0.95 assign (resid 15 and name HA ) (resid 43 and name HG1* ) 3.48 1.68 1.68 !peak 8005 #SUP 0.89 #QF 0.89 assign (resid 40 and name HN ) (resid 43 and name HB ) 4.21 2.41 2.41 !peak 8007 #SUP 0.74 #QF 0.74 assign (resid 43 and name HB ) (resid 45 and name HN ) 3.96 2.16 2.16 !peak 8008 #SUP 0.82 #QF 0.82 assign (resid 43 and name HB ) (resid 46 and name HN ) 4.29 2.49 2.49 !peak 8009 #SUP 1.00 assign (resid 19 and name HE1 ) (resid 43 and name HG1* ) 3.55 1.75 1.75 !peak 8011 #SUP 0.95 #QF 0.95 assign (resid 42 and name HN ) (resid 43 and name HB ) 3.83 2.03 2.03 !peak 8015 #SUP 0.99 #QF 0.99 assign (resid 19 and name HZ2 ) (resid 46 and name HB2 ) 4.00 2.20 2.20 !peak 8027 #SUP 0.99 #QF 0.99 assign (resid 49 and name HB1 ) (resid 50 and name HD2* ) 4.35 2.55 2.55 !peak 8040 #SUP 1.00 #QF 0.92 assign (resid 50 and name HD2* ) (resid 53 and name HB2 ) 4.35 2.55 2.55 !peak 8040 #SUP 1.00 #QF 0.92 assign (resid 49 and name HB1 ) (resid 50 and name HD1* ) 4.35 2.55 2.55 !peak 8043 #SUP 0.93 #QF 0.73 assign (resid 50 and name HD1* ) (resid 53 and name HB2 ) 4.35 2.55 2.55 !peak 8043 #SUP 0.93 #QF 0.73 assign (resid 50 and name HB1 ) (resid 53 and name HB2 ) 4.09 2.29 2.29 !peak 8046 #SUP 0.90 #QF 0.90 assign (resid 50 and name HD1* ) (resid 57 and name HE* ) 3.83 2.03 2.03 !peak 8049 #SUP 0.97 #QF 0.97 assign (resid 50 and name HD2* ) (resid 90 and name HE* ) 4.28 2.48 2.48 !peak 8054 #SUP 0.96 #QF 0.96 assign (resid 57 and name HB1 ) (resid 79 and name HB1 ) 3.71 1.91 1.91 !peak 8055 #SUP 0.97 #QF 0.68 assign (resid 53 and name HB1 ) (resid 55 and name HB ) 4.05 2.25 2.25 !peak 8059 #SUP 1.00 assign (resid 53 and name HB2 ) (resid 55 and name HG11 ) 3.21 1.41 1.41 !peak 8060 #SUP 0.98 #QF 0.98 assign (resid 55 and name HG2* ) (resid 57 and name HB1 ) 3.60 1.80 1.80 !peak 8071 #SUP 1.00 #QF 0.73 assign (resid 55 and name HG2* ) (resid 80 and name HB ) 4.35 2.55 2.55 !peak 8072 #SUP 0.97 #QF 0.97 assign (resid 50 and name HA ) (resid 55 and name HG12 ) 4.35 2.55 2.55 !peak 8076 #SUP 0.93 #QF 0.48 assign (resid 50 and name HA ) (resid 55 and name HD1* ) 3.44 1.64 1.64 !peak 8077 #SUP 0.98 #QF 0.98 assign (resid 50 and name HB1 ) (resid 55 and name HG12 ) 4.22 2.42 2.42 !peak 8078 #SUP 0.98 #QF 0.98 assign (resid 50 and name HB1 ) (resid 55 and name HD1* ) 3.06 1.26 1.26 !peak 8081 #SUP 0.99 #QF 0.99 assign (resid 70 and name HG2* ) (resid 93 and name HG2 ) 2.95 1.15 1.15 !peak 8082 #SUP 0.68 #QF 0.68 assign (resid 55 and name HG12 ) (resid 81 and name HG2* ) 3.41 1.61 1.61 !peak 8083 #SUP 0.94 #QF 0.94 assign (resid 55 and name HD1* ) (resid 57 and name HD* ) 3.74 1.94 1.94 !peak 8088 #SUP 0.96 #QF 0.96 assign (resid 55 and name HG2* ) (resid 57 and name HZ ) 4.35 2.55 2.55 !peak 8091 #SUP 0.97 #QF 0.71 assign (resid 57 and name HA ) (resid 58 and name HB1 ) 4.28 2.48 2.48 !peak 8100 #SUP 0.95 #QF 0.95 assign (resid 57 and name HA ) (resid 77 and name HB1 ) 4.24 2.44 2.43 !peak 8101 #SUP 0.96 #QF 0.96 assign (resid 55 and name HG2* ) (resid 57 and name HA ) 4.13 2.33 2.33 !peak 8102 #SUP 0.96 #QF 0.96 assign (resid 57 and name HA ) (resid 77 and name HD2* ) 4.35 2.55 2.55 !peak 8104 #SUP 0.68 #QF 0.68 assign (resid 57 and name HB1 ) (resid 79 and name HB2 ) 4.32 2.52 2.52 !peak 8108 #SUP 0.96 #QF 0.78 assign (resid 55 and name HG12 ) (resid 57 and name HD* ) 4.35 2.55 2.55 !peak 8112 #SUP 0.97 #QF 0.91 assign (resid 57 and name HD* ) (resid 88 and name HG2* ) 4.35 2.55 2.55 !peak 8112 #SUP 0.97 #QF 0.91 assign (resid 57 and name HD* ) (resid 59 and name HA ) 4.14 2.34 2.34 !peak 8115 #SUP 0.92 #QF 0.92 assign (resid 58 and name HA ) (resid 59 and name HB ) 3.84 2.04 2.04 !peak 8119 #SUP 0.96 #QF 0.96 assign (resid 91 and name HB1 ) (resid 107 and name HG2* ) 3.63 1.83 1.83 !peak 8122 #SUP 0.69 #QF 0.69 assign (resid 59 and name HA ) (resid 60 and name HD2 ) 3.65 1.85 1.85 !peak 8126 #SUP 0.54 #QF 0.54 assign (resid 16 and name HB2 ) (resid 59 and name HG1* ) 4.35 2.55 2.55 !peak 8133 #SUP 0.90 #QF 0.90 assign (resid 32 and name HA ) (resid 37 and name HB1 ) 4.08 2.28 2.28 !peak 8134 #SUP 0.70 #QF 0.32 assign (resid 60 and name HG1 ) (resid 76 and name HB1 ) 4.34 2.54 2.54 !peak 8137 #SUP 0.92 #QF 0.87 assign (resid 60 and name HG2 ) (resid 76 and name HB1 ) 4.14 2.34 2.34 !peak 8140 #SUP 0.99 #QF 0.93 assign (resid 12 and name HB* ) (resid 75 and name HG2* ) 3.60 1.80 1.80 !peak 8147 #SUP 0.58 #QF 0.58 assign (resid 14 and name HB* ) (resid 31 and name HD2* ) 2.65 0.85 0.85 !peak 8151 #SUP 0.86 #QF 0.86 assign (resid 9 and name HD2 ) (resid 64 and name HB ) 3.23 1.43 1.43 !peak 8153 #SUP 0.28 #QF 0.28 assign (resid 9 and name HB2 ) (resid 64 and name HG1* ) 2.95 1.15 1.15 !peak 8154 #SUP 0.95 #QF 0.95 assign (resid 70 and name HB ) (resid 93 and name HG1 ) 3.85 2.05 2.05 !peak 8158 #SUP 1.00 assign (resid 70 and name HG2* ) (resid 71 and name HA ) 3.58 1.78 1.78 !peak 8160 #SUP 1.00 assign (resid 70 and name HG2* ) (resid 95 and name HA ) 3.04 1.24 1.24 !peak 8161 #SUP 0.97 #QF 0.97 assign (resid 66 and name HA ) (resid 71 and name HB ) 3.82 2.02 2.02 !peak 8162 #SUP 1.00 assign (resid 71 and name HB ) (resid 94 and name HD* ) 3.53 1.73 1.73 !peak 8168 #SUP 1.00 assign (resid 9 and name HB2 ) (resid 64 and name HG2* ) 2.95 1.15 1.15 !peak 8174 #SUP 0.98 #QF 0.49 assign (resid 31 and name HD2* ) (resid 35 and name HB2 ) 3.21 1.41 1.41 !peak 8174 #SUP 0.98 #QF 0.49 assign (resid 4 and name HG2* ) (resid 71 and name HA ) 3.77 1.97 1.97 !peak 8177 #SUP 0.74 #QF 0.74 assign (resid 70 and name HG2* ) (resid 71 and name HB ) 4.17 2.37 2.37 !peak 8180 #SUP 1.00 #QF 0.99 assign (resid 8 and name HB* ) (resid 71 and name HG1* ) 2.83 1.03 1.03 !peak 8181 #SUP 0.72 #QF 0.72 assign (resid 8 and name HB* ) (resid 71 and name HG2* ) 2.83 1.03 1.03 !peak 8182 #SUP 0.89 #QF 0.45 assign (resid 12 and name HB* ) (resid 73 and name HG1* ) 2.75 0.95 0.95 !peak 8190 #SUP 0.99 #QF 0.99 assign (resid 9 and name HD2 ) (resid 64 and name HG1* ) 3.40 1.60 1.60 !peak 8191 #SUP 0.96 #QF 0.39 assign (resid 73 and name HG1* ) (resid 92 and name HB1 ) 3.60 1.80 1.80 !peak 8191 #SUP 0.96 #QF 0.39 assign (resid 12 and name HB* ) (resid 73 and name HG2* ) 2.48 0.68 0.68 !peak 8192 #SUP 0.92 #QF 0.92 assign (resid 73 and name HG1* ) (resid 94 and name HD* ) 3.65 1.85 1.85 !peak 8193 #SUP 0.99 #QF 0.99 assign (resid 75 and name HB ) (resid 90 and name HN ) 4.03 2.23 2.23 !peak 8197 #SUP 1.00 assign (resid 75 and name HB ) (resid 90 and name HD* ) 4.35 2.55 2.55 !peak 8201 #SUP 0.70 #QF 0.70 assign (resid 12 and name HB* ) (resid 75 and name HB ) 3.28 1.48 1.48 !peak 8206 #SUP 0.74 #QF 0.74 assign (resid 75 and name HB ) (resid 77 and name HG ) 3.80 2.00 2.00 !peak 8207 #SUP 0.61 #QF 0.61 assign (resid 12 and name HB* ) (resid 75 and name HG1* ) 3.60 1.80 1.80 !peak 8208 #SUP 0.94 #QF 0.94 assign (resid 13 and name HA ) (resid 75 and name HG1* ) 4.35 2.55 2.55 !peak 8210 #SUP 0.61 #QF 0.61 assign (resid 61 and name HG2 ) (resid 76 and name HB1 ) 3.48 1.68 1.68 !peak 8225 #SUP 0.85 #QF 0.85 assign (resid 76 and name HB1 ) (resid 89 and name HG2* ) 3.94 2.14 2.14 !peak 8227 #SUP 1.00 assign (resid 76 and name HG2 ) (resid 89 and name HG2* ) 3.66 1.86 1.86 !peak 8231 #SUP 1.00 assign (resid 76 and name HG1 ) (resid 89 and name HG2* ) 3.66 1.86 1.86 !peak 8235 #SUP 1.00 assign (resid 61 and name HB1 ) (resid 76 and name HA ) 4.10 2.30 2.30 !peak 8236 #SUP 0.93 #QF 0.77 assign (resid 75 and name HA ) (resid 76 and name HB2 ) 3.67 1.87 1.87 !peak 8237 #SUP 0.99 #QF 0.99 assign (resid 76 and name HB2 ) (resid 89 and name HA ) 3.82 2.02 2.02 !peak 8239 #SUP 1.00 assign (resid 76 and name HB1 ) (resid 89 and name HA ) 4.24 2.44 2.44 !peak 8240 #SUP 0.96 #QF 0.96 assign (resid 58 and name HN ) (resid 77 and name HB2 ) 4.16 2.36 2.36 !peak 8249 #SUP 1.00 assign (resid 60 and name HN ) (resid 77 and name HB1 ) 4.04 2.24 2.24 !peak 8252 #SUP 0.95 #QF 0.95 assign (resid 57 and name HA ) (resid 77 and name HD1* ) 4.35 2.55 2.55 !peak 8259 #SUP 0.84 #QF 0.84 assign (resid 77 and name HB1 ) (resid 88 and name HB ) 3.95 2.15 2.15 !peak 8264 #SUP 0.92 #QF 0.92 assign (resid 59 and name HG2* ) (resid 77 and name HD1* ) 3.61 1.81 1.81 !peak 8269 #SUP 0.98 #QF 0.98 assign (resid 59 and name HG1* ) (resid 77 and name HD1* ) 3.61 1.81 1.81 !peak 8270 #SUP 0.99 #QF 0.99 assign (resid 59 and name HG1* ) (resid 77 and name HD2* ) 3.61 1.81 1.81 !peak 8271 #SUP 1.00 assign (resid 78 and name HG2 ) (resid 87 and name HA ) 3.65 1.85 1.85 !peak 8289 #SUP 1.00 assign (resid 78 and name HG1 ) (resid 87 and name HD21 ) 3.87 2.07 2.07 !peak 8291 #SUP 0.97 #QF 0.97 assign (resid 8 and name HB* ) (resid 94 and name HZ ) 3.83 2.03 2.03 !peak 8298 #SUP 0.97 #QF 0.97 assign (resid 8 and name HA ) (resid 94 and name HD* ) 3.97 2.17 2.17 !peak 8299 #SUP 0.99 #QF 0.99 assign (resid 8 and name HB* ) (resid 71 and name HB ) 3.21 1.41 1.41 !peak 8300 #SUP 1.00 assign (resid 7 and name HB* ) (resid 8 and name HB* ) 3.28 1.48 1.48 !peak 8301 #SUP 0.99 #QF 0.99 assign (resid 8 and name HB* ) (resid 12 and name HB* ) 3.59 1.79 1.79 !peak 8302 #SUP 1.00 assign (resid 56 and name HN ) (resid 81 and name HB ) 3.80 2.00 2.00 !peak 8312 #SUP 0.86 #QF 0.86 assign (resid 89 and name HG2* ) (resid 91 and name HG1 ) 3.87 2.07 2.07 !peak 8323 #SUP 0.79 #QF 0.40 assign (resid 76 and name HB2 ) (resid 89 and name HG2* ) 3.29 1.49 1.49 !peak 8324 #SUP 0.94 #QF 0.94 assign (resid 76 and name HA ) (resid 89 and name HG2* ) 2.98 1.18 1.18 !peak 8327 #SUP 0.99 #QF 0.99 assign (resid 89 and name HG2* ) (resid 109 and name HD21 ) 3.65 1.85 1.85 !peak 8332 #SUP 0.99 #QF 0.99 assign (resid 89 and name HG2* ) (resid 90 and name HD* ) 3.88 2.08 2.08 !peak 8334 #SUP 0.99 #QF 0.99 assign (resid 91 and name HB1 ) (resid 109 and name HD22 ) 4.06 2.26 2.26 !peak 8337 #SUP 0.71 #QF 0.71 assign (resid 92 and name HB1 ) (resid 94 and name HD* ) 4.23 2.43 2.43 !peak 8342 #SUP 0.97 #QF 0.97 assign (resid 73 and name HG2* ) (resid 92 and name HB1 ) 3.62 1.82 1.82 !peak 8345 #SUP 1.00 assign (resid 73 and name HG1* ) (resid 92 and name HB2 ) 3.73 1.93 1.93 !peak 8348 #SUP 0.99 #QF 0.99 assign (resid 1 and name HE* ) (resid 7 and name HB* ) 3.10 1.30 1.30 !peak 8357 #SUP 0.56 #QF 0.56 assign (resid 3 and name HB1 ) (resid 6 and name HN ) 3.89 2.09 2.09 !peak 8360 #SUP 0.99 #QF 0.99 assign (resid 4 and name HG2* ) (resid 66 and name HG2* ) 3.18 1.38 1.38 !peak 8363 #SUP 0.84 #QF 0.84 assign (resid 4 and name HB ) (resid 66 and name HG2* ) 3.82 2.02 2.02 !peak 8364 #SUP 0.92 #QF 0.92 assign (resid 4 and name HG2* ) (resid 5 and name HA ) 3.48 1.68 1.68 !peak 8366 #SUP 0.98 #QF 0.98 assign (resid 4 and name HA ) (resid 96 and name HB ) 4.35 2.55 2.55 !peak 8369 #SUP 0.72 #QF 0.72 assign (resid 5 and name HG1* ) (resid 66 and name HG2* ) 2.51 0.71 0.71 !peak 8372 #SUP 0.92 #QF 0.92 assign (resid 4 and name HA ) (resid 5 and name HG2* ) 3.76 1.96 1.96 !peak 8373 #SUP 0.70 #QF 0.70 assign (resid 5 and name HB ) (resid 6 and name HB2 ) 3.23 1.43 1.43 !peak 8374 #SUP 0.97 #QF 0.97 assign (resid 5 and name HG1* ) (resid 6 and name HB2 ) 3.64 1.84 1.84 !peak 8375 #SUP 0.99 #QF 0.99 assign (resid 6 and name HA ) (resid 7 and name HB* ) 4.09 2.29 2.29 !peak 8379 #SUP 1.00 assign (resid 5 and name HG2* ) (resid 6 and name HB2 ) 3.96 2.16 2.16 !peak 8382 #SUP 0.96 #QF 0.96 assign (resid 7 and name HB* ) (resid 34 and name HG11 ) 3.34 1.54 1.54 !peak 8385 #SUP 0.99 #QF 0.99 assign (resid 7 and name HB* ) (resid 9 and name HN ) 3.63 1.83 1.83 !peak 8388 #SUP 0.97 #QF 0.97 assign (resid 8 and name HA ) (resid 94 and name HZ ) 4.14 2.34 2.34 !peak 8390 #SUP 1.00 assign (resid 7 and name HN ) (resid 8 and name HB* ) 3.49 1.69 1.69 !peak 8391 #SUP 0.99 #QF 0.99 assign (resid 9 and name HB1 ) (resid 12 and name HB* ) 3.81 2.01 2.01 !peak 8394 #SUP 1.00 assign (resid 10 and name HA ) (resid 14 and name HB* ) 3.87 2.07 2.07 !peak 8401 #SUP 0.96 #QF 0.96 assign (resid 9 and name HG2 ) (resid 10 and name HA ) 4.35 2.55 2.55 !peak 8402 #SUP 1.00 assign (resid 11 and name HB* ) (resid 15 and name HN ) 3.72 1.92 1.92 !peak 8407 #SUP 1.00 assign (resid 11 and name HB* ) (resid 35 and name HN ) 4.09 2.29 2.29 !peak 8407 #SUP 1.00 assign (resid 12 and name HB* ) (resid 14 and name HN ) 3.72 1.92 1.92 !peak 8411 #SUP 1.00 assign (resid 11 and name HB* ) (resid 14 and name HB* ) 3.10 1.30 1.30 !peak 8415 #SUP 0.73 #QF 0.73 assign (resid 11 and name HB* ) (resid 34 and name HG11 ) 3.03 1.23 1.23 !peak 8416 #SUP 0.97 #QF 0.97 assign (resid 12 and name HB* ) (resid 15 and name HG2* ) 4.09 2.29 2.29 !peak 8419 #SUP 1.00 assign (resid 13 and name HG2* ) (resid 14 and name HB* ) 3.43 1.63 1.63 !peak 8424 #SUP 0.92 #QF 0.92 assign (resid 14 and name HA ) (resid 30 and name HD2* ) 4.09 2.29 2.29 !peak 8425 #SUP 1.00 #QF 0.96 assign (resid 13 and name HA ) (resid 14 and name HA ) 3.77 1.97 1.97 !peak 8426 #SUP 1.00 assign (resid 14 and name HN ) (resid 15 and name HA ) 4.16 2.36 2.36 !peak 8427 #SUP 1.00 assign (resid 15 and name HB ) (resid 17 and name HN ) 4.21 2.41 2.41 !peak 8428 #SUP 0.99 #QF 0.99 assign (resid 15 and name HB ) (resid 18 and name HN ) 4.35 2.55 2.55 !peak 8428 #SUP 0.99 #QF 0.99 assign (resid 15 and name HG2* ) (resid 17 and name HN ) 4.35 2.55 2.55 !peak 8429 #SUP 1.00 assign (resid 17 and name HA ) (resid 20 and name HB2 ) 4.08 2.28 2.28 !peak 8440 #SUP 0.99 #QF 0.29 assign (resid 17 and name HA ) (resid 20 and name HB1 ) 4.19 2.39 2.39 !peak 8440 #SUP 0.99 #QF 0.29 assign (resid 13 and name HG2* ) (resid 17 and name HB1 ) 3.94 2.14 2.14 !peak 8448 #SUP 0.64 #QF 0.64 assign (resid 13 and name HG2* ) (resid 17 and name HB2 ) 3.77 1.97 1.97 !peak 8450 #SUP 0.62 #QF 0.62 assign (resid 18 and name HB1 ) (resid 19 and name HD1 ) 3.87 2.07 2.07 !peak 8459 #SUP 1.00 assign (resid 18 and name HA ) (resid 20 and name HN ) 3.74 1.94 1.94 !peak 8460 #SUP 0.95 #QF 0.95 assign (resid 19 and name HB2 ) (resid 21 and name HN ) 4.35 2.55 2.55 !peak 8461 #SUP 1.00 #QF 0.89 assign (resid 19 and name HB1 ) (resid 21 and name HN ) 4.35 2.55 2.55 !peak 8462 #SUP 0.52 #QF 0.52 assign (resid 19 and name HA ) (resid 20 and name HB1 ) 4.26 2.46 2.46 !peak 8463 #SUP 0.92 #QF 0.92 assign (resid 21 and name HB2 ) (resid 22 and name HD1 ) 3.90 2.10 2.10 !peak 8474 #SUP 0.96 #QF 0.96 assign (resid 20 and name HN ) (resid 22 and name HD1 ) 4.35 2.55 2.55 !peak 8478 #SUP 0.97 #QF 0.70 assign (resid 22 and name HG2 ) (resid 51 and name HE21 ) 3.72 1.92 1.92 !peak 8481 #SUP 1.00 assign (resid 21 and name HD21 ) (resid 22 and name HG2 ) 4.35 2.55 2.55 !peak 8482 #SUP 0.73 #QF 0.73 assign (resid 21 and name HN ) (resid 22 and name HG1 ) 4.15 2.35 2.35 !peak 8483 #SUP 0.95 #QF 0.95 assign (resid 21 and name HN ) (resid 22 and name HG2 ) 4.29 2.49 2.49 !peak 8484 #SUP 0.95 #QF 0.95 assign (resid 21 and name HA ) (resid 22 and name HB1 ) 3.99 2.19 2.19 !peak 8485 #SUP 0.95 #QF 0.95 assign (resid 22 and name HD1 ) (resid 23 and name HG2* ) 4.10 2.30 2.30 !peak 8488 #SUP 1.00 assign (resid 21 and name HB2 ) (resid 22 and name HD2 ) 3.81 2.01 2.01 !peak 8489 #SUP 0.99 #QF 0.99 assign (resid 22 and name HB1 ) (resid 23 and name HG2* ) 3.89 2.09 2.09 !peak 8490 #SUP 1.00 assign (resid 22 and name HG2 ) (resid 47 and name HB* ) 3.52 1.72 1.72 !peak 8492 #SUP 0.90 #QF 0.90 assign (resid 22 and name HG2 ) (resid 48 and name HA ) 4.05 2.25 2.25 !peak 8498 #SUP 1.00 assign (resid 22 and name HG1 ) (resid 48 and name HA ) 3.49 1.69 1.69 !peak 8499 #SUP 0.94 #QF 0.94 assign (resid 18 and name HD1* ) (resid 22 and name HB1 ) 4.10 2.30 2.30 !peak 8500 #SUP 0.98 #QF 0.98 assign (resid 22 and name HG2 ) (resid 23 and name HG2* ) 2.88 1.08 1.08 !peak 8503 #SUP 0.91 #QF 0.82 assign (resid 25 and name HA ) (resid 26 and name HA ) 3.71 1.91 1.91 !peak 8510 #SUP 0.97 #QF 0.97 assign (resid 24 and name HA ) (resid 25 and name HG2 ) 3.40 1.60 1.60 !peak 8512 #SUP 0.99 #QF 0.99 assign (resid 25 and name HG2 ) (resid 27 and name HN ) 4.03 2.23 2.23 !peak 8515 #SUP 0.99 #QF 0.99 assign (resid 18 and name HA ) (resid 27 and name HB* ) 3.28 1.48 1.48 !peak 8518 #SUP 0.92 #QF 0.92 assign (resid 27 and name HB* ) (resid 29 and name HN ) 3.44 1.64 1.64 !peak 8519 #SUP 1.00 assign (resid 15 and name HN ) (resid 27 and name HB* ) 3.96 2.16 2.16 !peak 8521 #SUP 0.78 #QF 0.78 assign (resid 27 and name HN ) (resid 28 and name HG2 ) 3.92 2.12 2.12 !peak 8522 #SUP 0.65 #QF 0.65 assign (resid 28 and name HB2 ) (resid 31 and name HD1* ) 4.24 2.44 2.44 !peak 8523 #SUP 1.00 #QF 0.99 assign (resid 28 and name HB1 ) (resid 31 and name HD1* ) 4.35 2.55 2.55 !peak 8523 #SUP 1.00 #QF 0.99 assign (resid 45 and name HA ) (resid 45 and name HG1 ) 3.13 1.33 1.33 !peak 8525 #SUP 0.49 #QF 0.49 assign (resid 30 and name HD1* ) (resid 31 and name HG ) 2.95 1.15 1.15 !peak 8529 #SUP 0.98 #QF 0.98 assign (resid 30 and name HD2* ) (resid 31 and name HG ) 3.09 1.29 1.28 !peak 8532 #SUP 0.99 #QF 0.99 assign (resid 14 and name HN ) (resid 30 and name HD1* ) 3.28 1.48 1.48 !peak 8534 #SUP 0.99 #QF 0.99 assign (resid 14 and name HN ) (resid 30 and name HD2* ) 3.26 1.46 1.46 !peak 8535 #SUP 1.00 assign (resid 28 and name HA ) (resid 31 and name HG ) 4.02 2.22 2.22 !peak 8536 #SUP 1.00 assign (resid 27 and name HA ) (resid 31 and name HG ) 3.98 2.18 2.18 !peak 8537 #SUP 1.00 #QF 0.99 assign (resid 31 and name HA ) (resid 34 and name HG12 ) 3.27 1.47 1.47 !peak 8538 #SUP 0.95 #QF 0.95 assign (resid 30 and name HG ) (resid 31 and name HD1* ) 3.24 1.44 1.44 !peak 8543 #SUP 0.95 #QF 0.95 assign (resid 9 and name HN ) (resid 73 and name HG2* ) 4.29 2.49 2.49 !peak 8548 #SUP 0.87 #QF 0.68 assign (resid 28 and name HB2 ) (resid 32 and name HB2 ) 4.24 2.44 2.43 !peak 8550 #SUP 0.21 #QF 0.21 assign (resid 32 and name HB1 ) (resid 33 and name HB2 ) 4.35 2.55 2.55 !peak 8552 #SUP 0.98 #QF 0.95 assign (resid 32 and name HB1 ) (resid 33 and name HB1 ) 4.35 2.55 2.55 !peak 8552 #SUP 0.98 #QF 0.95 assign (resid 31 and name HB2 ) (resid 32 and name HB1 ) 4.35 2.55 2.55 !peak 8559 #SUP 1.00 #QF 0.99 assign (resid 15 and name HD1* ) (resid 35 and name HD1* ) 3.61 1.81 1.81 !peak 8569 #SUP 0.77 #QF 0.77 assign (resid 48 and name HG2 ) (resid 51 and name HB1 ) 3.78 1.98 1.98 !peak 8577 #SUP 0.47 #QF 0.47 assign (resid 48 and name HG1 ) (resid 51 and name HB1 ) 3.78 1.98 1.98 !peak 8578 #SUP 0.62 #QF 0.62 assign (resid 39 and name HG2* ) (resid 103 and name HA ) 3.69 1.89 1.89 !peak 8580 #SUP 0.98 #QF 0.98 assign (resid 15 and name HG2* ) (resid 43 and name HB ) 3.88 2.08 2.08 !peak 8589 #SUP 1.00 assign (resid 22 and name HB1 ) (resid 44 and name HA ) 3.84 2.04 2.04 !peak 8592 #SUP 0.50 #QF 0.50 assign (resid 45 and name HA ) (resid 47 and name HB* ) 4.00 2.20 2.20 !peak 8614 #SUP 0.85 #QF 0.85 assign (resid 26 and name HA ) (resid 30 and name HD2* ) 4.35 2.55 2.55 !peak 8616 #SUP 0.32 #QF 0.32 assign (resid 44 and name HN ) (resid 47 and name HB* ) 3.79 1.99 1.99 !peak 8626 #SUP 0.90 #QF 0.90 assign (resid 22 and name HB2 ) (resid 47 and name HB* ) 3.37 1.57 1.57 !peak 8628 #SUP 1.00 assign (resid 22 and name HG1 ) (resid 47 and name HB* ) 3.26 1.46 1.46 !peak 8629 #SUP 1.00 assign (resid 18 and name HB2 ) (resid 47 and name HB* ) 3.14 1.34 1.34 !peak 8630 #SUP 0.59 #QF 0.59 assign (resid 49 and name HB2 ) (resid 50 and name HA ) 3.41 1.61 1.61 !peak 8633 #SUP 0.99 #QF 0.99 assign (resid 49 and name HB2 ) (resid 50 and name HB2 ) 3.74 1.94 1.94 !peak 8635 #SUP 1.00 assign (resid 49 and name HB1 ) (resid 50 and name HG ) 3.52 1.72 1.72 !peak 8636 #SUP 0.83 #QF 0.83 assign (resid 50 and name HA ) (resid 55 and name HG11 ) 3.88 2.08 2.08 !peak 8641 #SUP 0.97 #QF 0.97 assign (resid 50 and name HA ) (resid 55 and name HB ) 3.72 1.92 1.92 !peak 8642 #SUP 0.99 #QF 0.99 assign (resid 50 and name HA ) (resid 53 and name HB1 ) 3.84 2.04 2.04 !peak 8644 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 55 and name HG11 ) 4.34 2.54 2.54 !peak 8645 #SUP 0.89 #QF 0.89 assign (resid 50 and name HD2* ) (resid 55 and name HD1* ) 3.48 1.68 1.68 !peak 8647 #SUP 1.00 assign (resid 50 and name HD1* ) (resid 55 and name HD1* ) 3.48 1.68 1.68 !peak 8648 #SUP 1.00 assign (resid 47 and name HA ) (resid 50 and name HG ) 4.13 2.33 2.33 !peak 8651 #SUP 1.00 assign (resid 51 and name HA ) (resid 53 and name HN ) 3.65 1.85 1.85 !peak 8656 #SUP 0.94 #QF 0.94 assign (resid 7 and name HA ) (resid 10 and name HG1 ) 3.43 1.63 1.63 !peak 8658 #SUP 1.00 assign (resid 50 and name HB2 ) (resid 51 and name HA ) 3.90 2.10 2.10 !peak 8666 #SUP 0.95 #QF 0.95 assign (resid 79 and name HB2 ) (resid 88 and name HG2* ) 3.60 1.80 1.80 !peak 8667 #SUP 0.73 #QF 0.73 assign (resid 51 and name HB1 ) (resid 52 and name HA ) 3.71 1.91 1.91 !peak 8669 #SUP 0.97 #QF 0.97 assign (resid 50 and name HA ) (resid 53 and name HB2 ) 3.44 1.64 1.64 !peak 8681 #SUP 1.00 #QF 0.78 assign (resid 50 and name HD2* ) (resid 55 and name HG2* ) 3.79 1.99 1.99 !peak 8692 #SUP 0.81 #QF 0.81 assign (resid 50 and name HB1 ) (resid 55 and name HG2* ) 3.59 1.79 1.79 !peak 8694 #SUP 0.92 #QF 0.92 assign (resid 20 and name HB1 ) (resid 57 and name HD* ) 4.18 2.38 2.38 !peak 8699 #SUP 1.00 #QF 0.98 assign (resid 58 and name HB2 ) (resid 78 and name HN ) 3.68 1.88 1.88 !peak 8702 #SUP 0.64 #QF 0.64 assign (resid 58 and name HB1 ) (resid 78 and name HN ) 3.68 1.88 1.88 !peak 8703 #SUP 0.98 #QF 0.98 assign (resid 60 and name HB2 ) (resid 77 and name HA ) 4.03 2.23 2.23 !peak 8715 #SUP 1.00 assign (resid 61 and name HB1 ) (resid 62 and name HA ) 4.19 2.39 2.39 !peak 8722 #SUP 0.96 #QF 0.85 assign (resid 61 and name HB1 ) (resid 75 and name HA ) 4.35 2.55 2.55 !peak 8722 #SUP 0.96 #QF 0.85 assign (resid 59 and name HA ) (resid 75 and name HG2* ) 4.35 2.55 2.55 !peak 8733 #SUP 0.99 #QF 0.97 assign (resid 13 and name HA ) (resid 75 and name HG2* ) 4.35 2.55 2.55 !peak 8734 #SUP 0.69 #QF 0.38 assign (resid 9 and name HE1 ) (resid 62 and name HB ) 4.15 2.35 2.35 !peak 8736 #SUP 0.79 #QF 0.79 assign (resid 9 and name HE2 ) (resid 62 and name HB ) 4.15 2.35 2.35 !peak 8737 #SUP 1.00 assign (resid 62 and name HA ) (resid 63 and name HB2 ) 3.53 1.73 1.73 !peak 8738 #SUP 0.93 #QF 0.93 assign (resid 63 and name HB1 ) (resid 64 and name HA ) 3.51 1.71 1.71 !peak 8739 #SUP 1.00 assign (resid 63 and name HB2 ) (resid 73 and name HG1* ) 4.35 2.55 2.55 !peak 8742 #SUP 0.80 #QF 0.62 assign (resid 9 and name HG2 ) (resid 64 and name HB ) 3.63 1.83 1.83 !peak 8745 #SUP 0.99 #QF 0.99 assign (resid 65 and name HG2* ) (resid 72 and name HB2 ) 3.20 1.40 1.40 !peak 8750 #SUP 0.94 #QF 0.92 assign (resid 5 and name HG2* ) (resid 66 and name HG2* ) 2.46 0.66 0.66 !peak 8754 #SUP 0.95 #QF 0.76 assign (resid 97 and name HB1 ) (resid 100 and name HG2* ) 3.59 1.79 1.79 !peak 8756 #SUP 0.48 #QF 0.48 assign (resid 5 and name HB ) (resid 66 and name HG2* ) 3.35 1.55 1.55 !peak 8758 #SUP 0.73 #QF 0.73 assign (resid 66 and name HG2* ) (resid 71 and name HB ) 3.34 1.54 1.54 !peak 8759 #SUP 0.87 #QF 0.87 assign (resid 66 and name HB ) (resid 71 and name HA ) 3.69 1.89 1.89 !peak 8760 #SUP 0.98 #QF 0.98 assign (resid 66 and name HA ) (resid 71 and name HA ) 3.00 1.20 1.20 !peak 8761 #SUP 1.00 assign (resid 66 and name HG2* ) (resid 67 and name HB2 ) 4.35 2.55 2.55 !peak 8764 #SUP 0.94 #QF 0.90 assign (resid 67 and name HB2 ) (resid 70 and name HG2* ) 4.35 2.55 2.55 !peak 8764 #SUP 0.94 #QF 0.90 assign (resid 66 and name HA ) (resid 67 and name HB1 ) 3.86 2.06 2.06 !peak 8768 #SUP 0.80 #QF 0.80 assign (resid 70 and name HA ) (resid 95 and name HG2 ) 3.94 2.14 2.14 !peak 8775 #SUP 0.93 #QF 0.63 assign (resid 70 and name HA ) (resid 95 and name HG1 ) 3.94 2.14 2.14 !peak 8775 #SUP 0.93 #QF 0.63 assign (resid 70 and name HG2* ) (resid 93 and name HB1 ) 3.02 1.22 1.22 !peak 8778 #SUP 0.68 #QF 0.68 assign (resid 70 and name HG2* ) (resid 93 and name HG1 ) 3.46 1.66 1.66 !peak 8779 #SUP 1.00 assign (resid 71 and name HA ) (resid 72 and name HB2 ) 3.49 1.69 1.69 !peak 8787 #SUP 1.00 assign (resid 65 and name HN ) (resid 72 and name HA ) 4.14 2.34 2.34 !peak 8791 #SUP 1.00 assign (resid 71 and name HN ) (resid 72 and name HA ) 4.35 2.55 2.55 !peak 8791 #SUP 1.00 assign (resid 72 and name HA ) (resid 74 and name HN ) 4.35 2.55 2.55 !peak 8799 #SUP 0.95 #QF 0.95 assign (resid 72 and name HB1 ) (resid 74 and name HN ) 4.32 2.52 2.52 !peak 8800 #SUP 0.93 #QF 0.93 assign (resid 63 and name HB1 ) (resid 74 and name HG2* ) 3.48 1.68 1.68 !peak 8804 #SUP 0.79 #QF 0.25 assign (resid 63 and name HB2 ) (resid 74 and name HG2* ) 3.14 1.34 1.34 !peak 8805 #SUP 0.92 #QF 0.89 assign (resid 91 and name HB2 ) (resid 107 and name HG2* ) 3.30 1.50 1.50 !peak 8805 #SUP 0.92 #QF 0.89 assign (resid 74 and name HA ) (resid 91 and name HB1 ) 4.09 2.29 2.29 !peak 8807 #SUP 0.89 #QF 0.89 assign (resid 75 and name HG2* ) (resid 90 and name HB2 ) 3.56 1.76 1.76 !peak 8810 #SUP 1.00 #QF 0.26 assign (resid 62 and name HA ) (resid 76 and name HB1 ) 4.35 2.55 2.55 !peak 8811 #SUP 1.00 #QF 0.59 assign (resid 75 and name HA ) (resid 76 and name HB1 ) 4.35 2.55 2.55 !peak 8811 #SUP 1.00 #QF 0.59 assign (resid 77 and name HD2* ) (resid 90 and name HB2 ) 4.03 2.23 2.23 !peak 8815 #SUP 1.00 assign (resid 77 and name HA ) (resid 90 and name HD* ) 4.28 2.48 2.48 !peak 8818 #SUP 0.99 #QF 0.99 assign (resid 58 and name HN ) (resid 77 and name HA ) 3.60 1.80 1.80 !peak 8819 #SUP 0.97 #QF 0.97 assign (resid 57 and name HD* ) (resid 77 and name HG ) 4.03 2.23 2.23 !peak 8820 #SUP 1.00 assign (resid 57 and name HA ) (resid 79 and name HG1 ) 4.11 2.31 2.31 !peak 8830 #SUP 1.00 assign (resid 57 and name HA ) (resid 79 and name HG2 ) 4.11 2.31 2.31 !peak 8831 #SUP 1.00 assign (resid 57 and name HD* ) (resid 79 and name HB1 ) 4.05 2.25 2.25 !peak 8832 #SUP 1.00 assign (resid 79 and name HA ) (resid 80 and name HB ) 3.74 1.94 1.94 !peak 8840 #SUP 0.94 #QF 0.94 assign (resid 80 and name HA ) (resid 81 and name HG2* ) 3.10 1.30 1.30 !peak 8845 #SUP 0.57 #QF 0.57 assign (resid 83 and name HA2 ) (resid 84 and name HG2* ) 4.04 2.24 2.24 !peak 8851 #SUP 0.87 #QF 0.87 assign (resid 83 and name HA1 ) (resid 84 and name HG2* ) 4.04 2.24 2.24 !peak 8852 #SUP 0.74 #QF 0.74 assign (resid 81 and name HN ) (resid 84 and name HB ) 4.10 2.30 2.30 !peak 8854 #SUP 0.89 #QF 0.89 assign (resid 78 and name HG2 ) (resid 85 and name HG2* ) 2.97 1.17 1.17 !peak 8856 #SUP 1.00 assign (resid 78 and name HG1 ) (resid 85 and name HG2* ) 2.97 1.17 1.17 !peak 8857 #SUP 0.98 #QF 0.98 assign (resid 89 and name HB ) (resid 91 and name HG1 ) 4.24 2.44 2.44 !peak 8859 #SUP 0.96 #QF 0.94 assign (resid 79 and name HB2 ) (resid 80 and name HA ) 4.06 2.26 2.26 !peak 8862 #SUP 0.99 #QF 0.78 assign (resid 79 and name HB1 ) (resid 80 and name HA ) 4.23 2.43 2.43 !peak 8862 #SUP 0.99 #QF 0.78 assign (resid 85 and name HG2* ) (resid 86 and name HA ) 3.60 1.80 1.80 !peak 8864 #SUP 0.96 #QF 0.96 assign (resid 76 and name HG2 ) (resid 87 and name HB1 ) 3.81 2.01 2.01 !peak 8866 #SUP 0.98 #QF 0.98 assign (resid 70 and name HG2* ) (resid 94 and name HB1 ) 4.26 2.46 2.46 !peak 8867 #SUP 1.00 #QF 0.33 assign (resid 86 and name HG2* ) (resid 87 and name HB1 ) 4.35 2.55 2.55 !peak 8867 #SUP 1.00 #QF 0.33 assign (resid 86 and name HA ) (resid 87 and name HB2 ) 3.50 1.70 1.70 !peak 8869 #SUP 0.93 #QF 0.93 assign (resid 77 and name HB2 ) (resid 88 and name HB ) 3.45 1.65 1.65 !peak 8873 #SUP 0.99 #QF 0.99 assign (resid 88 and name HG2* ) (resid 108 and name HG1 ) 3.28 1.48 1.48 !peak 8874 #SUP 1.00 assign (resid 89 and name HA ) (resid 90 and name HB2 ) 3.89 2.09 2.09 !peak 8883 #SUP 0.96 #QF 0.96 assign (resid 75 and name HN ) (resid 89 and name HG2* ) 3.14 1.34 1.34 !peak 8891 #SUP 0.84 #QF 0.84 assign (resid 91 and name HG1 ) (resid 107 and name HB ) 3.98 2.18 2.18 !peak 8902 #SUP 0.99 #QF 0.99 assign (resid 90 and name HA ) (resid 91 and name HB1 ) 4.35 2.55 2.55 !peak 8904 #SUP 1.00 #QF 0.93 assign (resid 90 and name HA ) (resid 91 and name HB2 ) 3.46 1.66 1.66 !peak 8905 #SUP 0.85 #QF 0.85 assign (resid 75 and name HN ) (resid 76 and name HB2 ) 4.34 2.54 2.54 !peak 8907 #SUP 0.55 #QF 0.55 assign (resid 91 and name HN ) (resid 92 and name HD2* ) 4.35 2.55 2.55 !peak 8908 #SUP 1.00 #QF 0.98 assign (resid 92 and name HG ) (resid 93 and name HN ) 3.60 1.80 1.80 !peak 8909 #SUP 0.95 #QF 0.95 assign (resid 74 and name HG2* ) (resid 76 and name HB2 ) 3.56 1.76 1.76 !peak 8911 #SUP 0.87 #QF 0.23 assign (resid 74 and name HG2* ) (resid 91 and name HG2 ) 3.46 1.66 1.66 !peak 8912 #SUP 0.95 #QF 0.95 assign (resid 16 and name HD* ) (resid 92 and name HD2* ) 3.76 1.96 1.96 !peak 8914 #SUP 1.00 assign (resid 16 and name HD* ) (resid 92 and name HD1* ) 3.76 1.96 1.96 !peak 8916 #SUP 0.87 #QF 0.87 assign (resid 92 and name HG ) (resid 94 and name HE* ) 3.60 1.80 1.80 !peak 8917 #SUP 0.95 #QF 0.95 assign (resid 16 and name HE* ) (resid 92 and name HG ) 4.01 2.21 2.21 !peak 8918 #SUP 1.00 #QF 0.95 assign (resid 16 and name HZ ) (resid 92 and name HG ) 4.13 2.33 2.33 !peak 8918 #SUP 1.00 #QF 0.95 assign (resid 90 and name HB1 ) (resid 92 and name HD2* ) 3.72 1.92 1.92 !peak 8920 #SUP 0.93 #QF 0.93 assign (resid 15 and name HG2* ) (resid 92 and name HD1* ) 3.71 1.91 1.91 !peak 8921 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 92 and name HG ) 4.35 2.55 2.55 !peak 8922 #SUP 0.60 #QF 0.60 assign (resid 94 and name HA ) (resid 104 and name HA ) 3.29 1.49 1.49 !peak 8931 #SUP 0.97 #QF 0.97 assign (resid 94 and name HA ) (resid 95 and name HB1 ) 3.99 2.19 2.19 !peak 8933 #SUP 0.96 #QF 0.96 assign (resid 94 and name HA ) (resid 95 and name HB2 ) 3.88 2.08 2.08 !peak 8934 #SUP 0.84 #QF 0.84 assign (resid 95 and name HB2 ) (resid 103 and name HN ) 3.78 1.98 1.98 !peak 8938 #SUP 1.00 assign (resid 95 and name HB1 ) (resid 102 and name HN ) 3.87 2.07 2.07 !peak 8941 #SUP 0.91 #QF 0.91 assign (resid 95 and name HB1 ) (resid 103 and name HB1 ) 3.27 1.47 1.47 !peak 8946 #SUP 0.99 #QF 0.99 assign (resid 70 and name HG2* ) (resid 95 and name HB2 ) 3.68 1.88 1.88 !peak 8954 #SUP 1.00 assign (resid 95 and name HB2 ) (resid 101 and name HG2* ) 3.76 1.96 1.96 !peak 8955 #SUP 0.98 #QF 0.98 assign (resid 70 and name HG2* ) (resid 95 and name HB1 ) 3.67 1.87 1.87 !peak 8956 #SUP 0.99 #QF 0.99 assign (resid 95 and name HB1 ) (resid 101 and name HG2* ) 3.70 1.90 1.90 !peak 8957 #SUP 0.91 #QF 0.91 assign (resid 95 and name HB1 ) (resid 96 and name HG1* ) 4.32 2.52 2.52 !peak 8958 #SUP 0.96 #QF 0.85 assign (resid 95 and name HB1 ) (resid 96 and name HG2* ) 4.32 2.52 2.52 !peak 8958 #SUP 0.96 #QF 0.85 assign (resid 96 and name HA ) (resid 101 and name HG2* ) 3.52 1.72 1.72 !peak 8987 #SUP 0.95 #QF 0.95 assign (resid 101 and name HA ) (resid 102 and name HB2 ) 3.74 1.94 1.94 !peak 8990 #SUP 0.94 #QF 0.94 assign (resid 70 and name HG2* ) (resid 103 and name HB2 ) 4.35 2.55 2.55 !peak 8996 #SUP 0.86 #QF 0.86 assign (resid 70 and name HG2* ) (resid 103 and name HB1 ) 4.35 2.55 2.55 !peak 8997 #SUP 0.97 #QF 0.97 assign (resid 39 and name HG1* ) (resid 103 and name HA ) 3.69 1.89 1.89 !peak 9000 #SUP 0.94 #QF 0.94 assign (resid 95 and name HN ) (resid 103 and name HD1 ) 4.35 2.55 2.55 !peak 9003 #SUP 0.99 #QF 0.28 assign (resid 103 and name HD1 ) (resid 104 and name HN ) 4.35 2.55 2.55 !peak 9003 #SUP 0.99 #QF 0.28 assign (resid 104 and name HG2* ) (resid 106 and name HG2* ) 4.35 2.55 2.55 !peak 9007 #SUP 0.89 #QF 0.84 assign (resid 93 and name HG2 ) (resid 105 and name HB ) 4.15 2.35 2.35 !peak 9010 #SUP 1.00 assign (resid 93 and name HG1 ) (resid 105 and name HB ) 4.13 2.33 2.33 !peak 9013 #SUP 0.86 #QF 0.86 assign (resid 88 and name HG2* ) (resid 108 and name HB1 ) 3.73 1.93 1.93 !peak 9021 #SUP 0.87 #QF 0.87 assign (resid 90 and name HA ) (resid 108 and name HG2 ) 4.03 2.23 2.23 !peak 9022 #SUP 0.96 #QF 0.96 assign (resid 90 and name HA ) (resid 108 and name HG1 ) 4.03 2.23 2.23 !peak 9023 #SUP 1.00 assign (resid 90 and name HA ) (resid 108 and name HB1 ) 4.26 2.46 2.46 !peak 9024 #SUP 1.00 assign (resid 90 and name HE* ) (resid 108 and name HG2 ) 3.73 1.93 1.93 !peak 9025 #SUP 0.97 #QF 0.29 assign (resid 90 and name HD* ) (resid 108 and name HB1 ) 3.87 2.07 2.07 !peak 9026 #SUP 0.97 #QF 0.75 assign (resid 90 and name HD* ) (resid 108 and name HB2 ) 3.41 1.61 1.61 !peak 9029 #SUP 1.00 assign (resid 31 and name HN ) (resid 32 and name HB1 ) 4.35 2.55 2.55 !peak 9043 #SUP 0.99 #QF 0.99 assign (resid 109 and name HB1 ) (resid 110 and name HN ) 3.96 2.16 2.16 !peak 9044 #SUP 0.99 #QF 0.99 assign (resid 112 and name HB2 ) (resid 114 and name HN ) 4.35 2.55 2.55 !peak 9047 #SUP 0.98 #QF 0.76 assign (resid 112 and name HB1 ) (resid 114 and name HN ) 4.35 2.55 2.55 !peak 9047 #SUP 0.98 #QF 0.76 assign (resid 112 and name HA ) (resid 114 and name HN ) 3.51 1.71 1.71 !peak 9048 #SUP 0.56 #QF 0.56 assign (resid 1 and name HE* ) (resid 7 and name HA ) 3.59 1.79 1.79 !peak 9080 #SUP 0.87 #QF 0.87 assign (resid 35 and name HA ) (resid 101 and name HB ) 3.40 1.60 1.60 !peak 9081 #SUP 0.94 #QF 0.94 assign (resid 35 and name HA ) (resid 101 and name HG2* ) 3.41 1.61 1.61 !peak 9082 #SUP 0.96 #QF 0.96 assign (resid 94 and name HA ) (resid 101 and name HG2* ) 3.39 1.59 1.59 !peak 9083 #SUP 1.00 assign (resid 94 and name HA ) (resid 101 and name HD1* ) 4.31 2.51 2.51 !peak 9084 #SUP 0.99 #QF 0.99 assign (resid 11 and name HB* ) (resid 35 and name HB2 ) 3.60 1.80 1.80 !peak 9085 #SUP 0.85 #QF 0.67 assign (resid 11 and name HB* ) (resid 35 and name HG ) 3.71 1.91 1.91 !peak 9085 #SUP 0.85 #QF 0.67 assign (resid 11 and name HA ) (resid 31 and name HD1* ) 3.60 1.80 1.80 !peak 9086 #SUP 1.00 assign (resid 14 and name HA ) (resid 27 and name HB* ) 2.83 1.03 1.03 !peak 9087 #SUP 0.99 #QF 0.99 assign (resid 30 and name HA ) (resid 30 and name HD1* ) 2.91 1.11 1.11 !peak 9094 #SUP 0.34 #QF 0.34 assign (resid 19 and name HB2 ) (resid 47 and name HA ) 4.07 2.27 2.27 !peak 9099 #SUP 0.99 #QF 0.99 assign (resid 19 and name HB1 ) (resid 47 and name HA ) 4.07 2.27 2.27 !peak 9100 #SUP 0.97 #QF 0.97 assign (resid 14 and name HB* ) (resid 27 and name HB* ) 2.46 0.66 0.66 !peak 9111 #SUP 0.88 #QF 0.88 assign (resid 31 and name HB1 ) (resid 34 and name HD1* ) 3.98 2.18 2.18 !peak 9116 #SUP 0.99 #QF 0.97 assign (resid 31 and name HB1 ) (resid 35 and name HD1* ) 4.33 2.53 2.53 !peak 9116 #SUP 0.99 #QF 0.97 assign (resid 31 and name HD2* ) (resid 34 and name HD1* ) 2.67 0.87 0.87 !peak 9117 #SUP 0.86 #QF 0.86 assign (resid 33 and name HG2 ) (resid 34 and name HG2* ) 4.07 2.27 2.27 !peak 9120 #SUP 1.00 assign (resid 33 and name HG1 ) (resid 34 and name HG2* ) 4.07 2.27 2.27 !peak 9121 #SUP 0.90 #QF 0.90 assign (resid 33 and name HB2 ) (resid 34 and name HG2* ) 3.16 1.36 1.36 !peak 9122 #SUP 0.98 #QF 0.84 assign (resid 33 and name HB1 ) (resid 34 and name HG2* ) 3.48 1.68 1.68 !peak 9122 #SUP 0.98 #QF 0.84 assign (resid 31 and name HA ) (resid 34 and name HD1* ) 3.25 1.45 1.45 !peak 9123 #SUP 1.00 assign (resid 34 and name HG12 ) (resid 35 and name HG ) 4.19 2.39 2.39 !peak 9127 #SUP 0.98 #QF 0.98 assign (resid 4 and name HG2* ) (resid 101 and name HD1* ) 3.21 1.41 1.41 !peak 9131 #SUP 0.85 #QF 0.85 assign (resid 42 and name HA ) (resid 45 and name HG2 ) 3.80 2.00 2.00 !peak 9133 #SUP 0.90 #QF 0.24 assign (resid 42 and name HA ) (resid 45 and name HG1 ) 3.80 2.00 2.00 !peak 9133 #SUP 0.90 #QF 0.24 assign (resid 19 and name HE3 ) (resid 50 and name HD2* ) 4.06 2.26 2.26 !peak 9134 #SUP 0.89 #QF 0.89 assign (resid 19 and name HZ3 ) (resid 50 and name HD1* ) 4.18 2.38 2.38 !peak 9135 #SUP 0.85 #QF 0.85 assign (resid 53 and name HE21 ) (resid 55 and name HD1* ) 3.69 1.89 1.89 !peak 9139 #SUP 0.98 #QF 0.98 assign (resid 55 and name HD1* ) (resid 90 and name HE* ) 4.35 2.55 2.55 !peak 9140 #SUP 0.61 #QF 0.61 assign (resid 64 and name HA ) (resid 73 and name HB ) 4.33 2.53 2.53 !peak 9145 #SUP 1.00 #QF 0.90 assign (resid 73 and name HB ) (resid 91 and name HA ) 4.35 2.55 2.55 !peak 9145 #SUP 1.00 #QF 0.90 assign (resid 73 and name HG2* ) (resid 92 and name HB2 ) 3.05 1.25 1.25 !peak 9150 #SUP 0.60 #QF 0.60 assign (resid 79 and name HG1 ) (resid 88 and name HB ) 3.99 2.19 2.19 !peak 9153 #SUP 0.71 #QF 0.71 assign (resid 79 and name HG2 ) (resid 88 and name HB ) 3.99 2.19 2.19 !peak 9154 #SUP 1.00 assign (resid 92 and name HG ) (resid 106 and name HG2* ) 3.08 1.28 1.28 !peak 9160 #SUP 0.94 #QF 0.94 assign (resid 92 and name HG ) (resid 106 and name HA ) 3.30 1.50 1.50 !peak 9161 #SUP 0.92 #QF 0.92 assign (resid 92 and name HA ) (resid 106 and name HA ) 3.22 1.42 1.42 !peak 9162 #SUP 0.92 #QF 0.92 assign (resid 8 and name HB* ) (resid 94 and name HB2 ) 3.45 1.65 1.65 !peak 9163 #SUP 0.96 #QF 0.96 assign (resid 8 and name HB* ) (resid 94 and name HB1 ) 3.78 1.98 1.98 !peak 9164 #SUP 1.00 assign (resid 4 and name HA ) (resid 101 and name HD1* ) 3.96 2.16 2.16 !peak 9171 #SUP 0.99 #QF 0.82 assign (resid 92 and name HA ) (resid 104 and name HG1* ) 4.35 2.55 2.55 !peak 9173 #SUP 0.73 #QF 0.73 assign (resid 17 and name HB2 ) (resid 18 and name HA ) 3.45 1.65 1.65 !peak 9177 #SUP 0.92 #QF 0.92 assign (resid 29 and name HG2 ) (resid 30 and name HA ) 3.48 1.68 1.68 !peak 9188 #SUP 0.98 #QF 0.98 assign (resid 11 and name HB* ) (resid 31 and name HD1* ) 3.56 1.76 1.76 !peak 9189 #SUP 1.00 assign (resid 35 and name HD1* ) (resid 39 and name HB ) 3.82 2.02 2.02 !peak 9190 #SUP 0.93 #QF 0.93 assign (resid 35 and name HD2* ) (resid 39 and name HB ) 3.82 2.02 2.02 !peak 9191 #SUP 1.00 assign (resid 50 and name HB1 ) (resid 55 and name HB ) 3.53 1.73 1.73 !peak 9195 #SUP 0.98 #QF 0.98 assign (resid 50 and name HB1 ) (resid 55 and name HG11 ) 3.57 1.77 1.77 !peak 9197 #SUP 0.92 #QF 0.92 assign (resid 53 and name HB1 ) (resid 54 and name HN ) 3.47 1.67 1.67 !peak 9199 #SUP 0.97 #QF 0.97 assign (resid 60 and name HB1 ) (resid 76 and name HB1 ) 4.07 2.27 2.27 !peak 9200 #SUP 0.99 #QF 0.99 assign (resid 60 and name HB2 ) (resid 76 and name HB1 ) 3.02 1.22 1.22 !peak 9201 #SUP 0.79 #QF 0.79 assign (resid 71 and name HG2* ) (resid 94 and name HB2 ) 3.53 1.73 1.73 !peak 9207 #SUP 1.00 assign (resid 55 and name HG2* ) (resid 79 and name HG2 ) 3.61 1.81 1.81 !peak 9213 #SUP 0.94 #QF 0.94 assign (resid 55 and name HG2* ) (resid 79 and name HG1 ) 3.61 1.81 1.81 !peak 9214 #SUP 0.99 #QF 0.99 assign (resid 88 and name HG2* ) (resid 108 and name HG2 ) 3.28 1.48 1.48 !peak 9222 #SUP 0.67 #QF 0.67 assign (resid 92 and name HA ) (resid 104 and name HG2* ) 4.35 2.55 2.55 !peak 9225 #SUP 0.95 #QF 0.95 assign (resid 73 and name HG2* ) (resid 92 and name HA ) 4.35 2.55 2.55 !peak 9226 #SUP 1.00 #QF 0.98 assign (resid 12 and name HB* ) (resid 92 and name HB1 ) 3.68 1.88 1.88 !peak 9228 #SUP 1.00 assign (resid 12 and name HB* ) (resid 92 and name HB2 ) 3.74 1.94 1.94 !peak 9229 #SUP 0.99 #QF 0.99 assign (resid 12 and name HB* ) (resid 92 and name HG ) 3.67 1.87 1.87 !peak 9231 #SUP 1.00 assign (resid 70 and name HB ) (resid 93 and name HG2 ) 3.46 1.66 1.66 !peak 9233 #SUP 0.94 #QF 0.94 assign (resid 69 and name HA ) (resid 96 and name HG2* ) 3.36 1.56 1.56 !peak 9238 #SUP 0.93 #QF 0.84 assign (resid 69 and name HA ) (resid 96 and name HG1* ) 3.36 1.56 1.56 !peak 9239 #SUP 0.99 #QF 0.96 assign (resid 1 and name HB1 ) (resid 2 and name HN ) 4.03 2.23 2.23 !peak 9250 #SUP 1.00 assign (resid 18 and name HD2* ) (resid 22 and name HB1 ) 4.10 2.30 2.30 !peak 9257 #SUP 0.98 #QF 0.59 assign (resid 30 and name HG ) (resid 34 and name HD1* ) 3.60 1.80 1.80 !peak 9260 #SUP 0.85 #QF 0.85 assign (resid 32 and name HB2 ) (resid 33 and name HD2 ) 4.35 2.55 2.55 !peak 9261 #SUP 0.99 #QF 0.85 assign (resid 32 and name HB2 ) (resid 33 and name HD1 ) 4.35 2.55 2.55 !peak 9261 #SUP 0.99 #QF 0.85 assign (resid 32 and name HB2 ) (resid 33 and name HB2 ) 4.33 2.53 2.53 !peak 9262 #SUP 0.83 #QF 0.83 assign (resid 7 and name HA ) (resid 34 and name HG2* ) 3.49 1.69 1.69 !peak 9263 #SUP 1.00 assign (resid 22 and name HD1 ) (resid 47 and name HB* ) 3.27 1.47 1.47 !peak 9266 #SUP 0.95 #QF 0.95 assign (resid 22 and name HD2 ) (resid 47 and name HB* ) 3.59 1.79 1.79 !peak 9267 #SUP 0.84 #QF 0.84 assign (resid 50 and name HD1* ) (resid 55 and name HG2* ) 3.79 1.99 1.99 !peak 9271 #SUP 0.99 #QF 0.99 assign (resid 16 and name HD* ) (resid 59 and name HG2* ) 4.35 2.55 2.55 !peak 9274 #SUP 0.99 #QF 0.99 assign (resid 16 and name HD* ) (resid 59 and name HG1* ) 4.35 2.55 2.55 !peak 9275 #SUP 1.00 assign (resid 76 and name HG1 ) (resid 87 and name HB1 ) 3.81 2.01 2.01 !peak 9281 #SUP 0.99 #QF 0.99 assign (resid 90 and name HB1 ) (resid 92 and name HG ) 3.89 2.09 2.09 !peak 9285 #SUP 0.99 #QF 0.81 assign (resid 77 and name HN ) (resid 90 and name HE* ) 3.46 1.66 1.66 !peak 4333 #SUP 0.90 #QF 0.90 assign (resid 19 and name HN ) (resid 19 and name HD1 ) 2.92 1.12 1.12 !peak 2254 #SUP 1.00 assign (resid 19 and name HA ) (resid 19 and name HD1 ) 2.63 0.83 0.83 !peak 2255 #SUP 0.91 #QF 0.91 assign (resid 19 and name HD1 ) (resid 20 and name HN ) 3.70 1.90 1.90 !peak 5080 #SUP 1.00 assign (resid 16 and name HD* ) (resid 16 and name HZ ) 3.11 1.31 1.31 !peak 2125 #SUP 0.99 #QF 0.99 assign (resid 57 and name HD* ) (resid 57 and name HZ ) 3.10 1.30 1.30 !peak 3632 #SUP 1.00 assign (resid 16 and name HA ) (resid 16 and name HE* ) 3.49 1.69 1.69 !peak 2129 #SUP 0.96 #QF 0.96 assign (resid 16 and name HA ) (resid 16 and name HD* ) 3.16 1.36 1.36 !peak 2136 #SUP 0.86 #QF 0.86 assign (resid 94 and name HN ) (resid 94 and name HD* ) 2.78 0.98 0.98 !peak 4508 #SUP 1.00 assign (resid 94 and name HA ) (resid 94 and name HD* ) 2.94 1.14 1.14 !peak 4509 #SUP 1.00 assign (resid 94 and name HD* ) (resid 94 and name HZ ) 3.16 1.36 1.36 !peak 4514 #SUP 1.00 assign (resid 57 and name HN ) (resid 57 and name HD* ) 3.25 1.45 1.45 !peak 3642 #SUP 0.97 #QF 0.97 assign (resid 57 and name HA ) (resid 57 and name HD* ) 3.04 1.24 1.24 !peak 3643 #SUP 1.00 assign (resid 57 and name HD* ) (resid 58 and name HN ) 3.13 1.33 1.33 !peak 5263 #SUP 1.00 assign (resid 90 and name HN ) (resid 90 and name HD* ) 2.79 0.99 0.99 !peak 4339 #SUP 1.00 #QF 0.30 assign (resid 90 and name HA ) (resid 90 and name HD* ) 2.72 0.92 0.92 !peak 4340 #SUP 0.96 #QF 0.96 assign (resid 16 and name HZ ) (resid 90 and name HB2 ) 2.82 1.02 1.02 !peak 5410 #SUP 0.99 #QF 0.91 assign (resid 16 and name HZ ) (resid 90 and name HB1 ) 3.10 1.30 1.30 !peak 5410 #SUP 0.99 #QF 0.91 assign (resid 16 and name HZ ) (resid 75 and name HB ) 3.48 1.68 1.68 !peak 5411 #SUP 0.97 #QF 0.97 assign (resid 12 and name HB* ) (resid 16 and name HZ ) 3.64 1.84 1.84 !peak 5412 #SUP 0.86 #QF 0.86 assign (resid 16 and name HZ ) (resid 92 and name HD1* ) 3.02 1.22 1.22 !peak 5413 #SUP 0.97 #QF 0.97 assign (resid 16 and name HZ ) (resid 75 and name HG2* ) 3.09 1.29 1.29 !peak 5414 #SUP 0.77 #QF 0.77 assign (resid 16 and name HZ ) (resid 77 and name HD1* ) 3.41 1.61 1.61 !peak 5416 #SUP 0.98 #QF 0.98 assign (resid 16 and name HZ ) (resid 77 and name HD2* ) 3.41 1.61 1.61 !peak 5417 #SUP 0.94 #QF 0.94 assign (resid 16 and name HE* ) (resid 90 and name HB2 ) 3.44 1.64 1.64 !peak 5418 #SUP 1.00 #QF 0.96 assign (resid 16 and name HE* ) (resid 90 and name HB1 ) 3.63 1.83 1.83 !peak 5418 #SUP 1.00 #QF 0.96 assign (resid 16 and name HE* ) (resid 75 and name HB ) 3.32 1.52 1.52 !peak 5419 #SUP 0.96 #QF 0.96 assign (resid 12 and name HB* ) (resid 16 and name HE* ) 3.29 1.49 1.49 !peak 5420 #SUP 0.90 #QF 0.90 assign (resid 16 and name HE* ) (resid 92 and name HD1* ) 3.16 1.36 1.36 !peak 5421 #SUP 0.85 #QF 0.85 assign (resid 16 and name HE* ) (resid 75 and name HG2* ) 3.18 1.38 1.38 !peak 5422 #SUP 0.92 #QF 0.92 assign (resid 16 and name HE* ) (resid 77 and name HD1* ) 3.28 1.48 1.48 !peak 5424 #SUP 0.76 #QF 0.76 assign (resid 15 and name HG2* ) (resid 16 and name HE* ) 3.37 1.57 1.57 !peak 5426 #SUP 0.84 #QF 0.84 assign (resid 16 and name HZ ) (resid 90 and name HD* ) 3.32 1.52 1.51 !peak 5427 #SUP 0.86 #QF 0.86 assign (resid 12 and name HB* ) (resid 16 and name HD* ) 4.25 2.45 2.45 !peak 5429 #SUP 0.98 #QF 0.84 assign (resid 15 and name HG2* ) (resid 16 and name HD* ) 3.57 1.77 1.77 !peak 5432 #SUP 0.72 #QF 0.72 assign (resid 19 and name HD1 ) (resid 47 and name HA ) 3.11 1.31 1.31 !peak 5433 #SUP 0.99 #QF 0.99 assign (resid 18 and name HB2 ) (resid 19 and name HD1 ) 3.34 1.54 1.54 !peak 5434 #SUP 0.91 #QF 0.91 assign (resid 19 and name HD1 ) (resid 47 and name HB* ) 2.62 0.83 0.83 !peak 5435 #SUP 0.83 #QF 0.83 assign (resid 15 and name HG2* ) (resid 19 and name HD1 ) 3.48 1.68 1.68 !peak 5439 #SUP 0.94 #QF 0.94 assign (resid 18 and name HN ) (resid 19 and name HD1 ) 3.63 1.83 1.83 !peak 5440 #SUP 0.99 #QF 0.99 assign (resid 19 and name HD1 ) (resid 47 and name HN ) 3.31 1.51 1.51 !peak 5441 #SUP 0.84 #QF 0.84 assign (resid 19 and name HZ2 ) (resid 106 and name HG1* ) 3.02 1.22 1.22 !peak 5443 #SUP 0.98 #QF 0.98 assign (resid 19 and name HZ2 ) (resid 106 and name HG2* ) 3.02 1.22 1.22 !peak 5444 #SUP 0.84 #QF 0.84 assign (resid 15 and name HG2* ) (resid 19 and name HZ2 ) 3.29 1.49 1.49 !peak 5445 #SUP 0.78 #QF 0.78 assign (resid 19 and name HH2 ) (resid 106 and name HG1* ) 3.11 1.31 1.31 !peak 5447 #SUP 0.98 #QF 0.98 assign (resid 19 and name HH2 ) (resid 106 and name HG2* ) 3.11 1.31 1.31 !peak 5448 #SUP 0.62 #QF 0.62 assign (resid 15 and name HG2* ) (resid 19 and name HH2 ) 3.72 1.92 1.92 !peak 5449 #SUP 0.87 #QF 0.87 assign (resid 20 and name HB1 ) (resid 57 and name HE* ) 3.32 1.52 1.51 !peak 5450 #SUP 0.88 #QF 0.88 assign (resid 16 and name HB1 ) (resid 57 and name HD* ) 3.41 1.61 1.61 !peak 5452 #SUP 0.92 #QF 0.92 assign (resid 57 and name HD* ) (resid 77 and name HB2 ) 3.33 1.53 1.53 !peak 5455 #SUP 0.99 #QF 0.99 assign (resid 55 and name HB ) (resid 57 and name HD* ) 3.39 1.59 1.59 !peak 5456 #SUP 0.98 #QF 0.98 assign (resid 16 and name HB1 ) (resid 57 and name HE* ) 3.45 1.65 1.65 !peak 5457 #SUP 1.00 #QF 0.96 assign (resid 57 and name HD* ) (resid 77 and name HB1 ) 2.92 1.12 1.12 !peak 5458 #SUP 0.97 #QF 0.97 assign (resid 55 and name HG2* ) (resid 57 and name HD* ) 2.88 1.08 1.08 !peak 5461 #SUP 0.90 #QF 0.90 assign (resid 57 and name HD* ) (resid 77 and name HD2* ) 3.26 1.46 1.46 !peak 5463 #SUP 0.92 #QF 0.92 assign (resid 56 and name HA ) (resid 57 and name HD* ) 3.47 1.67 1.67 !peak 5468 #SUP 0.72 #QF 0.72 assign (resid 19 and name HE3 ) (resid 57 and name HD* ) 3.57 1.77 1.77 !peak 5470 #SUP 0.87 #QF 0.87 assign (resid 79 and name HG1 ) (resid 90 and name HE* ) 3.66 1.86 1.86 !peak 5472 #SUP 0.87 #QF 0.87 assign (resid 79 and name HG2 ) (resid 90 and name HE* ) 3.66 1.86 1.86 !peak 5473 #SUP 0.96 #QF 0.96 assign (resid 77 and name HB2 ) (resid 90 and name HE* ) 2.86 1.06 1.06 !peak 5475 #SUP 0.86 #QF 0.86 assign (resid 90 and name HE* ) (resid 108 and name HB2 ) 2.79 0.99 0.99 !peak 5476 #SUP 0.96 #QF 0.96 assign (resid 88 and name HG2* ) (resid 90 and name HE* ) 2.53 0.73 0.73 !peak 5479 #SUP 0.72 #QF 0.72 assign (resid 50 and name HD1* ) (resid 90 and name HE* ) 4.28 2.48 2.48 !peak 5483 #SUP 0.81 #QF 0.81 assign (resid 88 and name HG2* ) (resid 90 and name HD* ) 3.02 1.22 1.22 !peak 5487 #SUP 0.87 #QF 0.62 assign (resid 77 and name HD1* ) (resid 90 and name HD* ) 3.44 1.64 1.64 !peak 5489 #SUP 0.95 #QF 0.95 assign (resid 88 and name HB ) (resid 90 and name HE* ) 2.77 0.97 0.97 !peak 5491 #SUP 0.95 #QF 0.95 assign (resid 90 and name HE* ) (resid 108 and name HA ) 3.21 1.41 1.41 !peak 5492 #SUP 0.64 #QF 0.64 assign (resid 89 and name HA ) (resid 90 and name HD* ) 3.04 1.24 1.24 !peak 5494 #SUP 0.91 #QF 0.91 assign (resid 90 and name HD* ) (resid 108 and name HA ) 2.92 1.12 1.12 !peak 5495 #SUP 0.90 #QF 0.90 assign (resid 16 and name HE* ) (resid 90 and name HD* ) 3.07 1.27 1.27 !peak 5496 #SUP 0.79 #QF 0.79 assign (resid 19 and name HH2 ) (resid 90 and name HD* ) 3.19 1.39 1.39 !peak 5497 #SUP 0.97 #QF 0.97 assign (resid 19 and name HZ3 ) (resid 90 and name HE* ) 3.23 1.43 1.43 !peak 5498 #SUP 0.99 #QF 0.99 assign (resid 16 and name HE* ) (resid 90 and name HE* ) 3.59 1.79 1.79 !peak 5499 #SUP 0.99 #QF 0.99 assign (resid 19 and name HH2 ) (resid 90 and name HE* ) 3.07 1.27 1.27 !peak 5501 #SUP 0.72 #QF 0.72 assign (resid 12 and name HA ) (resid 94 and name HZ ) 2.65 0.85 0.85 !peak 5502 #SUP 0.99 #QF 0.99 assign (resid 73 and name HB ) (resid 94 and name HZ ) 3.82 2.02 2.02 !peak 5503 #SUP 0.95 #QF 0.95 assign (resid 73 and name HB ) (resid 94 and name HE* ) 3.01 1.21 1.21 !peak 5504 #SUP 0.91 #QF 0.91 assign (resid 92 and name HB1 ) (resid 94 and name HE* ) 2.85 1.05 1.05 !peak 5505 #SUP 0.94 #QF 0.94 assign (resid 92 and name HB1 ) (resid 94 and name HZ ) 3.00 1.20 1.20 !peak 5507 #SUP 0.91 #QF 0.91 assign (resid 12 and name HB* ) (resid 94 and name HZ ) 2.68 0.88 0.88 !peak 5508 #SUP 0.93 #QF 0.93 assign (resid 11 and name HB* ) (resid 94 and name HZ ) 2.71 0.91 0.91 !peak 5509 #SUP 0.68 #QF 0.68 assign (resid 92 and name HB2 ) (resid 94 and name HZ ) 3.22 1.42 1.42 !peak 5510 #SUP 0.95 #QF 0.95 assign (resid 73 and name HG2* ) (resid 94 and name HZ ) 3.38 1.58 1.58 !peak 5512 #SUP 0.76 #QF 0.76 assign (resid 15 and name HD1* ) (resid 94 and name HZ ) 2.64 0.84 0.84 !peak 5514 #SUP 0.97 #QF 0.97 assign (resid 12 and name HB* ) (resid 94 and name HE* ) 2.85 1.05 1.05 !peak 5516 #SUP 0.98 #QF 0.98 assign (resid 11 and name HB* ) (resid 94 and name HE* ) 2.86 1.06 1.06 !peak 5517 #SUP 0.98 #QF 0.98 assign (resid 92 and name HB2 ) (resid 94 and name HE* ) 3.14 1.34 1.34 !peak 5518 #SUP 0.97 #QF 0.97 assign (resid 8 and name HB* ) (resid 94 and name HE* ) 3.19 1.39 1.39 !peak 5519 #SUP 0.75 #QF 0.36 assign (resid 92 and name HD1* ) (resid 94 and name HE* ) 3.31 1.51 1.51 !peak 5519 #SUP 0.75 #QF 0.36 assign (resid 73 and name HG1* ) (resid 94 and name HE* ) 2.76 0.96 0.96 !peak 5520 #SUP 0.79 #QF 0.79 assign (resid 92 and name HD2* ) (resid 94 and name HE* ) 3.31 1.51 1.51 !peak 5521 #SUP 0.95 #QF 0.95 assign (resid 15 and name HD1* ) (resid 94 and name HE* ) 2.94 1.14 1.14 !peak 5522 #SUP 1.00 assign (resid 94 and name HE* ) (resid 104 and name HG1* ) 3.52 1.72 1.72 !peak 5523 #SUP 0.98 #QF 0.98 assign (resid 73 and name HB ) (resid 94 and name HD* ) 3.56 1.76 1.76 !peak 5524 #SUP 1.00 assign (resid 94 and name HD* ) (resid 104 and name HB ) 2.82 1.02 1.02 !peak 5526 #SUP 0.91 #QF 0.91 assign (resid 12 and name HB* ) (resid 94 and name HD* ) 3.72 1.92 1.92 !peak 5527 #SUP 0.94 #QF 0.94 assign (resid 11 and name HB* ) (resid 94 and name HD* ) 3.14 1.34 1.34 !peak 5528 #SUP 0.88 #QF 0.88 assign (resid 92 and name HB2 ) (resid 94 and name HD* ) 3.28 1.48 1.48 !peak 5529 #SUP 0.95 #QF 0.95 assign (resid 8 and name HB* ) (resid 94 and name HD* ) 3.00 1.20 1.20 !peak 5530 #SUP 0.82 #QF 0.82 assign (resid 94 and name HD* ) (resid 101 and name HG2* ) 2.44 0.64 0.64 !peak 5531 #SUP 0.94 #QF 0.94 assign (resid 35 and name HD1* ) (resid 94 and name HD* ) 3.57 1.77 1.77 !peak 5532 #SUP 0.52 #QF 0.52 assign (resid 93 and name HA ) (resid 94 and name HD* ) 3.15 1.35 1.35 !peak 5534 #SUP 0.94 #QF 0.94 assign (resid 94 and name HD* ) (resid 104 and name HA ) 3.30 1.50 1.50 !peak 5535 #SUP 0.85 #QF 0.85 assign (resid 12 and name HA ) (resid 94 and name HE* ) 3.23 1.43 1.43 !peak 5536 #SUP 0.99 #QF 0.99 assign (resid 12 and name HN ) (resid 94 and name HZ ) 2.91 1.11 1.11 !peak 5537 #SUP 0.99 #QF 0.99 assign (resid 16 and name HZ ) (resid 92 and name HD2* ) 3.02 1.22 1.22 !peak 5538 #SUP 0.69 #QF 0.69 assign (resid 16 and name HZ ) (resid 75 and name HG1* ) 3.09 1.29 1.29 !peak 5539 #SUP 0.99 #QF 0.99 assign (resid 55 and name HG2* ) (resid 57 and name HE* ) 3.42 1.62 1.62 !peak 5541 #SUP 1.00 assign (resid 50 and name HD2* ) (resid 57 and name HE* ) 3.83 2.03 2.03 !peak 5542 #SUP 0.80 #QF 0.37 assign (resid 19 and name HB1 ) (resid 57 and name HE* ) 3.71 1.91 1.91 !peak 5546 #SUP 0.76 #QF 0.76 assign (resid 19 and name HB2 ) (resid 57 and name HE* ) 3.71 1.91 1.91 !peak 5547 #SUP 0.84 #QF 0.84 assign (resid 19 and name HZ2 ) (resid 106 and name HB ) 3.61 1.81 1.81 !peak 5552 #SUP 1.00 assign (resid 19 and name HH2 ) (resid 106 and name HB ) 3.67 1.87 1.87 !peak 5555 #SUP 0.97 #QF 0.97 assign (resid 19 and name HZ3 ) (resid 50 and name HD2* ) 4.18 2.38 2.38 !peak 5559 #SUP 0.97 #QF 0.72 assign (resid 56 and name HA ) (resid 56 and name HD2 ) 3.03 1.23 1.23 !peak 5564 #SUP 0.83 #QF 0.83 assign (resid 56 and name HD2 ) (resid 80 and name HB ) 3.90 2.10 2.10 !peak 5566 #SUP 0.99 #QF 0.99 assign (resid 16 and name HB1 ) (resid 57 and name HZ ) 3.62 1.82 1.82 !peak 5570 #SUP 0.98 #QF 0.55 assign (resid 20 and name HB1 ) (resid 57 and name HZ ) 3.46 1.66 1.66 !peak 5571 #SUP 0.94 #QF 0.94 assign (resid 55 and name HB ) (resid 57 and name HE* ) 4.03 2.23 2.23 !peak 5575 #SUP 0.92 #QF 0.53 assign (resid 57 and name HE* ) (resid 77 and name HB1 ) 3.91 2.11 2.11 !peak 5576 #SUP 0.63 #QF 0.63 assign (resid 90 and name HD* ) (resid 107 and name HA ) 3.83 2.03 2.03 !peak 5583 #SUP 0.92 #QF 0.92 assign (resid 88 and name HB ) (resid 90 and name HD* ) 3.23 1.43 1.43 !peak 5584 #SUP 0.95 #QF 0.95 assign (resid 77 and name HB2 ) (resid 90 and name HD* ) 3.18 1.38 1.38 !peak 5585 #SUP 0.87 #QF 0.87 assign (resid 75 and name HG2* ) (resid 90 and name HD* ) 3.65 1.85 1.85 !peak 5588 #SUP 0.78 #QF 0.78 assign (resid 12 and name HN ) (resid 94 and name HE* ) 3.32 1.52 1.51 !peak 5590 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 94 and name HZ ) 3.99 2.19 2.19 !peak 5596 #SUP 0.94 #QF 0.94 assign (resid 15 and name HD1* ) (resid 94 and name HD* ) 3.46 1.66 1.66 !peak 5597 #SUP 0.94 #QF 0.94 assign (resid 72 and name HA ) (resid 94 and name HD* ) 3.78 1.98 1.97 !peak 5598 #SUP 0.74 #QF 0.74 assign (resid 94 and name HD* ) (resid 105 and name HN ) 3.90 2.10 2.10 !peak 5599 #SUP 0.90 #QF 0.90 assign (resid 13 and name HA ) (resid 16 and name HD* ) 3.29 1.49 1.49 !peak 5600 #SUP 0.85 #QF 0.85 assign (resid 19 and name HA ) (resid 19 and name HE3 ) 3.88 2.08 2.08 !peak 5603 #SUP 0.75 #QF 0.75 assign (resid 19 and name HE3 ) (resid 50 and name HD1* ) 4.06 2.26 2.26 !peak 5610 #SUP 0.98 #QF 0.98 assign (resid 46 and name HA ) (resid 46 and name HD2 ) 3.96 2.16 2.16 !peak 5612 #SUP 1.00 assign (resid 19 and name HD1 ) (resid 22 and name HB1 ) 4.21 2.41 2.41 !peak 5617 #SUP 0.95 #QF 0.93 assign (resid 19 and name HD1 ) (resid 43 and name HB ) 4.35 2.55 2.55 !peak 5617 #SUP 0.95 #QF 0.93 assign (resid 50 and name HB2 ) (resid 57 and name HE* ) 4.16 2.36 2.36 !peak 5623 #SUP 0.99 #QF 0.98 assign (resid 50 and name HG ) (resid 57 and name HE* ) 4.35 2.55 2.55 !peak 5623 #SUP 0.99 #QF 0.98 assign (resid 50 and name HB1 ) (resid 57 and name HE* ) 4.18 2.38 2.38 !peak 5624 #SUP 0.94 #QF 0.94 assign (resid 16 and name HA ) (resid 57 and name HD* ) 4.29 2.49 2.49 !peak 5630 #SUP 0.83 #QF 0.83 assign (resid 19 and name HE3 ) (resid 57 and name HE* ) 3.58 1.78 1.78 !peak 5631 #SUP 1.00 #QF 0.99 assign (resid 16 and name HD* ) (resid 57 and name HZ ) 3.65 1.85 1.85 !peak 5632 #SUP 1.00 #QF 0.96 assign (resid 19 and name HE3 ) (resid 57 and name HZ ) 3.76 1.96 1.96 !peak 5632 #SUP 1.00 #QF 0.96 assign (resid 15 and name HA ) (resid 16 and name HD* ) 4.35 2.55 2.55 !peak 5633 #SUP 0.83 #QF 0.24 assign (resid 16 and name HA ) (resid 57 and name HZ ) 4.19 2.39 2.39 !peak 5636 #SUP 0.72 #QF 0.72 assign (resid 19 and name HZ3 ) (resid 90 and name HD* ) 3.62 1.82 1.82 !peak 5637 #SUP 0.88 #QF 0.88 assign (resid 1 and name HG* ) (resid 7 and name HB* ) 3.55 1.75 1.75 !peak 6268 assign (resid 1 and name HE* ) (resid 3 and name HB* ) 4.21 2.41 2.41 !peak 9277 assign (resid 3 and name HN ) (resid 4 and name HG1* ) 4.14 2.34 2.34 !peak 7571 assign (resid 3 and name HB* ) (resid 4 and name HN ) 3.30 1.50 1.50 !peak 9 assign (resid 3 and name HB* ) (resid 4 and name HA ) 4.24 2.44 2.44 !peak 8980 assign (resid 3 and name HB* ) (resid 4 and name HD1* ) 4.24 2.44 2.44 !peak 7557 assign (resid 3 and name HB* ) (resid 5 and name HN ) 4.05 2.25 2.25 !peak 8359 assign (resid 3 and name HB* ) (resid 6 and name HN ) 3.46 1.66 1.66 !peak 6258 assign (resid 3 and name HB* ) (resid 6 and name HB2 ) 3.23 1.43 1.43 !peak 6260 assign (resid 3 and name HB* ) (resid 6 and name HB1 ) 3.53 1.73 1.73 !peak 7556 assign (resid 4 and name HN ) (resid 4 and name HG1* ) 3.04 1.24 1.24 !peak 615 assign (resid 4 and name HA ) (resid 4 and name HG1* ) 3.04 1.24 1.24 !peak 5421 assign (resid 4 and name HA ) (resid 101 and name HG1* ) 3.53 1.73 1.73 !peak 3148 assign (resid 4 and name HG2* ) (resid 4 and name HG1* ) 2.64 0.84 0.84 !peak 1775 assign (resid 4 and name HG2* ) (resid 96 and name HG* ) 2.88 1.08 1.08 !peak 1776 assign (resid 4 and name HG2* ) (resid 101 and name HG1* ) 3.09 1.29 1.28 !peak 4599 assign (resid 4 and name HG1* ) (resid 5 and name HN ) 3.45 1.65 1.65 !peak 15 assign (resid 4 and name HG1* ) (resid 96 and name HB ) 3.70 1.90 1.90 !peak 8367 assign (resid 4 and name HG1* ) (resid 96 and name HG* ) 2.94 1.14 1.14 !peak 8128 assign (resid 4 and name HD1* ) (resid 99 and name HB* ) 4.24 2.44 2.44 !peak 7557 assign (resid 4 and name HD1* ) (resid 101 and name HG1* ) 3.08 1.28 1.28 !peak 8080 assign (resid 5 and name HN ) (resid 71 and name HG* ) 4.16 2.36 2.36 !peak 16 assign (resid 5 and name HA ) (resid 71 and name HG* ) 3.40 1.60 1.60 !peak 8546 assign (resid 5 and name HG1* ) (resid 71 and name HG* ) 2.69 0.89 0.89 !peak 8182 assign (resid 6 and name HN ) (resid 6 and name HG* ) 3.35 1.55 1.55 !peak 1842 assign (resid 6 and name HA ) (resid 6 and name HG* ) 2.80 1.00 1.00 !peak 1843 assign (resid 6 and name HG* ) (resid 7 and name HN ) 3.56 1.76 1.76 !peak 4961 assign (resid 6 and name HG* ) (resid 7 and name HA ) 3.78 1.98 1.98 !peak 8387 assign (resid 6 and name HG* ) (resid 9 and name HD1 ) 3.68 1.88 1.88 !peak 8397 assign (resid 7 and name HA ) (resid 10 and name HB* ) 3.33 1.53 1.53 !peak 5441 assign (resid 7 and name HA ) (resid 10 and name HG* ) 3.09 1.29 1.28 !peak 6310 assign (resid 7 and name HB* ) (resid 10 and name HB* ) 4.14 2.34 2.34 !peak 8405 assign (resid 7 and name HB* ) (resid 10 and name HG* ) 4.03 2.23 2.23 !peak 6267 assign (resid 8 and name HN ) (resid 71 and name HG* ) 3.60 1.80 1.80 !peak 6281 assign (resid 8 and name HA ) (resid 35 and name HD* ) 3.94 2.14 2.14 !peak 8308 assign (resid 8 and name HA ) (resid 71 and name HG* ) 3.32 1.52 1.51 !peak 8307 assign (resid 8 and name HB* ) (resid 71 and name HG* ) 2.26 0.46 0.46 !peak 8181 assign (resid 8 and name HB* ) (resid 101 and name HG1* ) 3.62 1.82 1.82 !peak 8604 assign (resid 9 and name HN ) (resid 10 and name HB* ) 3.87 2.07 2.07 !peak 7588 assign (resid 9 and name HN ) (resid 64 and name HG* ) 3.12 1.32 1.32 !peak 6283 assign (resid 9 and name HA ) (resid 62 and name HG* ) 3.63 1.83 1.83 !peak 8309 assign (resid 9 and name HA ) (resid 64 and name HG* ) 3.07 1.27 1.27 !peak 6291 assign (resid 9 and name HA ) (resid 92 and name HD* ) 4.17 2.37 2.37 !peak 8310 assign (resid 9 and name HB2 ) (resid 9 and name HE* ) 3.37 1.57 1.57 !peak 1933 assign (resid 9 and name HB2 ) (resid 62 and name HG* ) 4.01 2.21 2.21 !peak 8392 assign (resid 9 and name HB2 ) (resid 64 and name HG* ) 2.67 0.87 0.87 !peak 8154 assign (resid 9 and name HB1 ) (resid 9 and name HE* ) 3.29 1.49 1.49 !peak 1932 assign (resid 9 and name HB1 ) (resid 62 and name HG* ) 3.87 2.07 2.07 !peak 8393 assign (resid 9 and name HB1 ) (resid 64 and name HG* ) 3.63 1.83 1.83 !peak 6299 assign (resid 9 and name HG* ) (resid 9 and name HE* ) 2.75 0.95 0.95 !peak 1935 assign (resid 9 and name HG* ) (resid 10 and name HA ) 3.88 2.08 2.08 !peak 6318 assign (resid 9 and name HG* ) (resid 12 and name HB* ) 3.18 1.38 1.38 !peak 6362 assign (resid 9 and name HG* ) (resid 13 and name HD1* ) 3.14 1.34 1.34 !peak 7809 assign (resid 9 and name HG* ) (resid 62 and name HB ) 4.24 2.44 2.44 !peak 8145 assign (resid 9 and name HG* ) (resid 62 and name HG* ) 2.77 0.97 0.97 !peak 8129 assign (resid 9 and name HG* ) (resid 64 and name HB ) 3.20 1.40 1.40 !peak 1902 assign (resid 9 and name HG* ) (resid 64 and name HG* ) 2.91 1.11 1.11 !peak 6304 assign (resid 9 and name HD2 ) (resid 62 and name HG* ) 3.81 2.01 2.01 !peak 6307 assign (resid 9 and name HD2 ) (resid 64 and name HG* ) 2.92 1.12 1.12 !peak 6306 assign (resid 9 and name HE* ) (resid 13 and name HD1* ) 3.03 1.23 1.23 !peak 7593 assign (resid 9 and name HE* ) (resid 62 and name HB ) 3.71 1.91 1.91 !peak 8736 assign (resid 9 and name HE* ) (resid 62 and name HG* ) 2.92 1.12 1.12 !peak 8132 assign (resid 9 and name HE* ) (resid 64 and name HB ) 3.96 2.16 2.16 !peak 1942 assign (resid 9 and name HE* ) (resid 64 and name HG* ) 3.02 1.22 1.22 !peak 7368 assign (resid 10 and name HN ) (resid 10 and name HB* ) 2.59 0.79 0.79 !peak 647 assign (resid 10 and name HN ) (resid 10 and name HG* ) 2.67 0.87 0.87 !peak 1974 assign (resid 10 and name HN ) (resid 64 and name HG* ) 4.30 2.50 2.50 !peak 6314 assign (resid 10 and name HA ) (resid 10 and name HG* ) 2.83 1.03 1.03 !peak 1955 assign (resid 10 and name HA ) (resid 10 and name HE* ) 3.79 1.99 1.99 !peak 1402 assign (resid 10 and name HB* ) (resid 10 and name HE* ) 3.44 1.64 1.64 !peak 1404 assign (resid 10 and name HB* ) (resid 11 and name HN ) 3.11 1.31 1.31 !peak 47 assign (resid 10 and name HB* ) (resid 11 and name HA ) 3.93 2.13 2.13 !peak 7602 assign (resid 10 and name HB* ) (resid 11 and name HB* ) 3.82 2.02 2.02 !peak 7603 assign (resid 10 and name HB* ) (resid 14 and name HB* ) 3.37 1.57 1.57 !peak 6422 assign (resid 10 and name HB* ) (resid 30 and name HD1* ) 2.81 1.01 1.01 !peak 6461 assign (resid 10 and name HB* ) (resid 30 and name HD2* ) 2.91 1.11 1.11 !peak 8533 assign (resid 10 and name HG* ) (resid 10 and name HE* ) 2.65 0.85 0.85 !peak 1989 assign (resid 10 and name HG* ) (resid 11 and name HN ) 3.53 1.73 1.73 !peak 4979 assign (resid 10 and name HG* ) (resid 13 and name HD1* ) 3.95 2.15 2.15 !peak 8453 assign (resid 10 and name HG* ) (resid 30 and name HD1* ) 3.53 1.73 1.73 !peak 9256 assign (resid 10 and name HG* ) (resid 30 and name HD2* ) 3.51 1.71 1.71 !peak 6328 assign (resid 10 and name HG* ) (resid 34 and name HG2* ) 3.91 2.11 2.11 !peak 6330 assign (resid 10 and name HE* ) (resid 14 and name HB* ) 3.88 2.08 2.08 !peak 9255 assign (resid 10 and name HE* ) (resid 30 and name HD1* ) 3.29 1.49 1.49 !peak 6335 assign (resid 10 and name HE* ) (resid 30 and name HD2* ) 3.21 1.41 1.41 !peak 6334 assign (resid 11 and name HA ) (resid 15 and name HG1* ) 3.77 1.97 1.97 !peak 7601 assign (resid 11 and name HB* ) (resid 15 and name HG1* ) 3.46 1.66 1.66 !peak 8417 assign (resid 11 and name HB* ) (resid 104 and name HG* ) 3.49 1.69 1.69 !peak 6348 assign (resid 12 and name HN ) (resid 15 and name HG1* ) 4.24 2.44 2.44 !peak 6351 assign (resid 12 and name HN ) (resid 92 and name HD* ) 3.80 2.00 2.00 !peak 6355 assign (resid 12 and name HA ) (resid 15 and name HG1* ) 3.50 1.70 1.70 !peak 7605 assign (resid 12 and name HA ) (resid 75 and name HG* ) 4.08 2.28 2.28 !peak 6359 assign (resid 12 and name HA ) (resid 92 and name HD* ) 2.77 0.97 0.97 !peak 7243 assign (resid 12 and name HB* ) (resid 62 and name HG* ) 3.09 1.29 1.29 !peak 8127 assign (resid 12 and name HB* ) (resid 75 and name HG* ) 2.92 1.12 1.12 !peak 8147 assign (resid 13 and name HA ) (resid 59 and name HG* ) 3.65 1.85 1.85 !peak 6396 assign (resid 13 and name HA ) (resid 62 and name HG* ) 4.30 2.50 2.50 !peak 8734 assign (resid 13 and name HA ) (resid 75 and name HG* ) 3.70 1.90 1.90 !peak 8210 assign (resid 13 and name HB ) (resid 17 and name HG* ) 3.88 2.08 2.08 !peak 7815 assign (resid 13 and name HG2* ) (resid 17 and name HG* ) 3.11 1.31 1.31 !peak 8452 assign (resid 13 and name HG2* ) (resid 17 and name HE* ) 3.15 1.35 1.35 !peak 6453 assign (resid 13 and name HG2* ) (resid 59 and name HG* ) 3.63 1.83 1.83 !peak 8421 assign (resid 13 and name HG12 ) (resid 59 and name HG* ) 3.38 1.58 1.58 !peak 8711 assign (resid 13 and name HG11 ) (resid 17 and name HE* ) 4.24 2.44 2.44 !peak 8441 assign (resid 13 and name HG11 ) (resid 59 and name HG* ) 3.64 1.84 1.84 !peak 8422 assign (resid 13 and name HD1* ) (resid 17 and name HE* ) 4.21 2.41 2.41 !peak 8446 assign (resid 14 and name HA ) (resid 17 and name HG* ) 2.96 1.16 1.16 !peak 2167 assign (resid 14 and name HA ) (resid 18 and name HD* ) 3.94 2.14 2.14 !peak 8425 assign (resid 14 and name HB* ) (resid 17 and name HG* ) 3.48 1.68 1.68 !peak 6420 assign (resid 14 and name HB* ) (resid 17 and name HE* ) 3.85 2.05 2.05 !peak 9255 assign (resid 15 and name HN ) (resid 15 and name HG1* ) 2.94 1.14 1.14 !peak 672 assign (resid 15 and name HN ) (resid 43 and name HG* ) 3.75 1.95 1.95 !peak 6428 assign (resid 15 and name HA ) (resid 15 and name HG1* ) 2.72 0.92 0.92 !peak 2056 assign (resid 15 and name HA ) (resid 18 and name HD* ) 3.38 1.58 1.58 !peak 7872 assign (resid 15 and name HA ) (resid 43 and name HG* ) 3.11 1.31 1.31 !peak 6430 assign (resid 15 and name HB ) (resid 43 and name HG* ) 3.34 1.54 1.54 !peak 8000 assign (resid 15 and name HB ) (resid 92 and name HD* ) 3.02 1.22 1.22 !peak 7251 assign (resid 15 and name HG2* ) (resid 15 and name HG1* ) 2.65 0.85 0.85 !peak 2070 assign (resid 15 and name HG2* ) (resid 43 and name HG* ) 2.75 0.95 0.95 !peak 6773 assign (resid 15 and name HG2* ) (resid 92 and name HD* ) 2.89 1.09 1.09 !peak 7259 assign (resid 15 and name HG2* ) (resid 106 and name HG* ) 3.12 1.32 1.32 !peak 6435 assign (resid 15 and name HG1* ) (resid 16 and name HN ) 4.20 2.40 2.40 !peak 73 assign (resid 15 and name HG1* ) (resid 31 and name HD2* ) 2.92 1.12 1.12 !peak 6438 assign (resid 15 and name HG1* ) (resid 43 and name HB ) 4.09 2.29 2.29 !peak 6797 assign (resid 15 and name HG1* ) (resid 43 and name HG* ) 2.75 0.95 0.95 !peak 6793 assign (resid 15 and name HG1* ) (resid 92 and name HD* ) 3.27 1.47 1.47 !peak 6437 assign (resid 15 and name HG1* ) (resid 94 and name HE* ) 3.55 1.75 1.75 !peak 5592 assign (resid 15 and name HG1* ) (resid 94 and name HZ ) 3.86 2.06 2.06 !peak 5506 assign (resid 15 and name HD1* ) (resid 35 and name HD* ) 3.03 1.23 1.23 !peak 7946 assign (resid 15 and name HD1* ) (resid 43 and name HG* ) 3.07 1.27 1.27 !peak 7840 assign (resid 15 and name HD1* ) (resid 92 and name HD* ) 2.57 0.77 0.77 !peak 7830 assign (resid 15 and name HD1* ) (resid 104 and name HG* ) 2.97 1.17 1.17 !peak 9006 assign (resid 16 and name HN ) (resid 92 and name HD* ) 3.86 2.06 2.06 !peak 8431 assign (resid 16 and name HA ) (resid 19 and name HB* ) 3.15 1.35 1.35 !peak 5492 assign (resid 16 and name HB2 ) (resid 59 and name HG* ) 3.64 1.84 1.84 !peak 6440 assign (resid 16 and name HB2 ) (resid 77 and name HD* ) 3.94 2.14 2.14 !peak 7104 assign (resid 16 and name HB1 ) (resid 59 and name HG* ) 3.98 2.18 2.18 !peak 6440 assign (resid 16 and name HB1 ) (resid 77 and name HD* ) 4.03 2.23 2.23 !peak 7104 assign (resid 16 and name HD* ) (resid 19 and name HB* ) 3.80 2.00 2.00 !peak 5634 assign (resid 16 and name HD* ) (resid 59 and name HG* ) 3.53 1.73 1.73 !peak 9274 assign (resid 16 and name HD* ) (resid 75 and name HG* ) 3.43 1.63 1.63 !peak 7694 assign (resid 16 and name HD* ) (resid 77 and name HD* ) 3.11 1.31 1.31 !peak 7130 assign (resid 16 and name HD* ) (resid 92 and name HD* ) 3.35 1.55 1.55 !peak 8914 assign (resid 16 and name HE* ) (resid 59 and name HG* ) 3.88 2.08 2.08 !peak 7503 assign (resid 16 and name HE* ) (resid 75 and name HG* ) 2.83 1.03 1.03 !peak 5422 assign (resid 16 and name HE* ) (resid 92 and name HD* ) 2.84 1.04 1.04 !peak 5421 assign (resid 16 and name HZ ) (resid 75 and name HG* ) 2.71 0.91 0.91 !peak 5414 assign (resid 16 and name HZ ) (resid 77 and name HD* ) 3.03 1.23 1.23 !peak 5416 assign (resid 16 and name HZ ) (resid 92 and name HD* ) 2.60 0.80 0.80 !peak 5413 assign (resid 17 and name HN ) (resid 17 and name HG* ) 2.88 1.08 1.08 !peak 5008 assign (resid 17 and name HN ) (resid 18 and name HD* ) 3.91 2.11 2.11 !peak 8445 assign (resid 17 and name HA ) (resid 17 and name HG* ) 2.96 1.16 1.16 !peak 2139 assign (resid 17 and name HA ) (resid 20 and name HG* ) 3.53 1.73 1.73 !peak 6451 assign (resid 17 and name HA ) (resid 20 and name HD* ) 3.51 1.71 1.71 !peak 6450 assign (resid 17 and name HA ) (resid 20 and name HE* ) 3.40 1.60 1.60 !peak 3468 assign (resid 17 and name HB2 ) (resid 17 and name HE* ) 3.28 1.48 1.48 !peak 1412 assign (resid 17 and name HB2 ) (resid 18 and name HD* ) 3.11 1.31 1.31 !peak 6462 assign (resid 17 and name HB1 ) (resid 18 and name HD* ) 4.09 2.29 2.29 !peak 8449 assign (resid 17 and name HG* ) (resid 17 and name HE* ) 2.64 0.84 0.84 !peak 1981 assign (resid 17 and name HG* ) (resid 18 and name HN ) 3.49 1.69 1.69 !peak 87 assign (resid 17 and name HG* ) (resid 18 and name HD* ) 4.19 2.39 2.39 !peak 8453 assign (resid 17 and name HG* ) (resid 20 and name HD* ) 3.88 2.08 2.08 !peak 8442 assign (resid 17 and name HG* ) (resid 27 and name HA ) 4.08 2.28 2.28 !peak 7897 assign (resid 17 and name HG* ) (resid 27 and name HB* ) 3.16 1.36 1.36 !peak 7892 assign (resid 17 and name HE* ) (resid 27 and name HB* ) 3.41 1.61 1.61 !peak 6452 assign (resid 17 and name HE* ) (resid 30 and name HD2* ) 3.72 1.92 1.92 !peak 8447 assign (resid 18 and name HN ) (resid 18 and name HD* ) 2.98 1.18 1.18 !peak 696 assign (resid 18 and name HN ) (resid 19 and name HB* ) 4.18 2.38 2.38 !peak 8461 assign (resid 18 and name HA ) (resid 18 and name HD* ) 2.61 0.81 0.81 !peak 2203 assign (resid 18 and name HB2 ) (resid 18 and name HD* ) 2.69 0.89 0.89 !peak 2204 assign (resid 18 and name HB2 ) (resid 43 and name HG* ) 3.41 1.61 1.61 !peak 8001 assign (resid 18 and name HB1 ) (resid 18 and name HD* ) 2.49 0.69 0.69 !peak 4899 assign (resid 18 and name HB1 ) (resid 43 and name HG* ) 3.17 1.37 1.37 !peak 8002 assign (resid 18 and name HG ) (resid 43 and name HG* ) 3.68 1.88 1.88 !peak 9180 assign (resid 18 and name HD* ) (resid 19 and name HN ) 3.38 1.58 1.58 !peak 96 assign (resid 18 and name HD* ) (resid 19 and name HD1 ) 3.73 1.93 1.93 !peak 5437 assign (resid 18 and name HD* ) (resid 19 and name HE1 ) 4.30 2.50 2.50 !peak 7552 assign (resid 18 and name HD* ) (resid 21 and name HN ) 4.13 2.33 2.33 !peak 6487 assign (resid 18 and name HD* ) (resid 22 and name HA ) 3.42 1.62 1.62 !peak 7869 assign (resid 18 and name HD* ) (resid 22 and name HB2 ) 3.07 1.27 1.27 !peak 8530 assign (resid 18 and name HD* ) (resid 22 and name HB1 ) 3.44 1.64 1.64 !peak 8500 assign (resid 18 and name HD* ) (resid 22 and name HG2 ) 4.07 2.27 2.27 !peak 8502 assign (resid 18 and name HD* ) (resid 22 and name HG1 ) 3.95 2.15 2.15 !peak 8501 assign (resid 18 and name HD* ) (resid 23 and name HN ) 3.86 2.06 2.06 !peak 6523 assign (resid 18 and name HD* ) (resid 24 and name HN ) 3.44 1.64 1.64 !peak 6524 assign (resid 18 and name HD* ) (resid 24 and name HB* ) 3.32 1.52 1.52 !peak 9184 assign (resid 18 and name HD* ) (resid 27 and name HN ) 4.30 2.50 2.50 !peak 7898 assign (resid 18 and name HD* ) (resid 28 and name HN ) 3.30 1.50 1.50 !peak 6546 assign (resid 18 and name HD* ) (resid 28 and name HA ) 3.42 1.62 1.62 !peak 9093 assign (resid 18 and name HD* ) (resid 28 and name HB1 ) 2.92 1.12 1.12 !peak 6461 assign (resid 18 and name HD* ) (resid 28 and name HE* ) 2.98 1.18 1.18 !peak 6576 assign (resid 18 and name HD* ) (resid 31 and name HD1* ) 2.75 0.95 0.95 !peak 7857 assign (resid 18 and name HD* ) (resid 43 and name HB ) 3.28 1.48 1.48 !peak 6771 assign (resid 18 and name HD* ) (resid 43 and name HG* ) 2.56 0.76 0.76 !peak 9182 assign (resid 18 and name HD* ) (resid 44 and name HN ) 3.42 1.62 1.62 !peak 6789 assign (resid 18 and name HD* ) (resid 44 and name HA ) 3.20 1.40 1.40 !peak 6792 assign (resid 18 and name HD* ) (resid 44 and name HB2 ) 3.67 1.87 1.87 !peak 8603 assign (resid 18 and name HD* ) (resid 44 and name HB1 ) 3.60 1.80 1.80 !peak 8601 assign (resid 18 and name HD* ) (resid 44 and name HG* ) 3.57 1.77 1.77 !peak 8607 assign (resid 18 and name HD* ) (resid 45 and name HN ) 4.30 2.50 2.50 !peak 5013 assign (resid 18 and name HD* ) (resid 45 and name HA ) 4.30 2.50 2.50 !peak 8615 assign (resid 18 and name HD* ) (resid 47 and name HN ) 3.87 2.07 2.07 !peak 8621 assign (resid 19 and name HN ) (resid 19 and name HB* ) 2.71 0.91 0.91 !peak 699 assign (resid 19 and name HA ) (resid 50 and name HD* ) 4.11 2.31 2.31 !peak 6482 assign (resid 19 and name HB* ) (resid 20 and name HN ) 2.96 1.16 1.16 !peak 99 assign (resid 19 and name HB* ) (resid 21 and name HN ) 3.87 2.07 2.07 !peak 8462 assign (resid 19 and name HB* ) (resid 43 and name HG* ) 3.99 2.19 2.19 !peak 8004 assign (resid 19 and name HB* ) (resid 47 and name HA ) 3.65 1.85 1.85 !peak 9100 assign (resid 19 and name HB* ) (resid 50 and name HD* ) 3.21 1.41 1.41 !peak 6472 assign (resid 19 and name HB* ) (resid 55 and name HG2* ) 4.24 2.44 2.44 !peak 6855 assign (resid 19 and name HB* ) (resid 57 and name HE* ) 3.29 1.49 1.49 !peak 5547 assign (resid 19 and name HB* ) (resid 57 and name HZ ) 3.19 1.39 1.39 !peak 5569 assign (resid 19 and name HD1 ) (resid 43 and name HG* ) 3.05 1.25 1.25 !peak 5436 assign (resid 19 and name HD1 ) (resid 50 and name HD* ) 3.55 1.75 1.74 !peak 5438 assign (resid 19 and name HE3 ) (resid 50 and name HD* ) 3.45 1.65 1.65 !peak 5610 assign (resid 19 and name HE1 ) (resid 43 and name HG* ) 2.93 1.13 1.13 !peak 6470 assign (resid 19 and name HZ3 ) (resid 50 and name HD* ) 3.67 1.87 1.87 !peak 9135 assign (resid 19 and name HZ3 ) (resid 77 and name HD* ) 4.03 2.23 2.23 !peak 8817 assign (resid 19 and name HZ3 ) (resid 106 and name HG* ) 3.62 1.82 1.82 !peak 9174 assign (resid 19 and name HZ2 ) (resid 43 and name HG* ) 3.88 2.08 2.08 !peak 8014 assign (resid 19 and name HZ2 ) (resid 46 and name HB* ) 3.55 1.75 1.74 !peak 8027 assign (resid 19 and name HZ2 ) (resid 50 and name HD* ) 3.69 1.89 1.89 !peak 5560 assign (resid 19 and name HZ2 ) (resid 106 and name HG* ) 2.68 0.88 0.88 !peak 5443 assign (resid 19 and name HH2 ) (resid 106 and name HG* ) 2.71 0.91 0.91 !peak 5447 assign (resid 20 and name HN ) (resid 20 and name HG* ) 3.03 1.23 1.23 !peak 711 assign (resid 20 and name HN ) (resid 20 and name HD* ) 3.64 1.84 1.84 !peak 714 assign (resid 20 and name HN ) (resid 20 and name HE* ) 3.86 2.06 2.06 !peak 716 assign (resid 20 and name HN ) (resid 50 and name HD* ) 4.19 2.39 2.39 !peak 5167 assign (resid 20 and name HA ) (resid 20 and name HD* ) 3.78 1.98 1.98 !peak 2303 assign (resid 20 and name HB2 ) (resid 20 and name HD* ) 3.04 1.24 1.24 !peak 2359 assign (resid 20 and name HB1 ) (resid 20 and name HE* ) 3.87 2.07 2.07 !peak 8704 assign (resid 20 and name HG* ) (resid 20 and name HE* ) 2.68 0.88 0.88 !peak 2380 assign (resid 20 and name HG* ) (resid 21 and name HN ) 3.18 1.38 1.38 !peak 112 assign (resid 20 and name HG* ) (resid 21 and name HB2 ) 3.73 1.93 1.93 !peak 6489 assign (resid 20 and name HG* ) (resid 21 and name HB1 ) 3.76 1.96 1.96 !peak 6490 assign (resid 20 and name HG* ) (resid 57 and name HZ ) 3.78 1.98 1.98 !peak 5572 assign (resid 20 and name HD* ) (resid 57 and name HD* ) 3.94 2.14 2.14 !peak 8472 assign (resid 20 and name HD* ) (resid 57 and name HE* ) 3.73 1.93 1.93 !peak 5575 assign (resid 20 and name HE* ) (resid 21 and name HN ) 3.59 1.79 1.79 !peak 116 assign (resid 21 and name HD21 ) (resid 24 and name HB* ) 3.15 1.35 1.35 !peak 1313 assign (resid 21 and name HD22 ) (resid 24 and name HB* ) 3.22 1.42 1.42 !peak 9108 assign (resid 22 and name HG2 ) (resid 48 and name HG* ) 3.57 1.77 1.77 !peak 8494 assign (resid 22 and name HG1 ) (resid 48 and name HG* ) 3.25 1.45 1.45 !peak 8495 assign (resid 22 and name HG1 ) (resid 51 and name HE* ) 3.86 2.06 2.06 !peak 8480 assign (resid 22 and name HD2 ) (resid 51 and name HE* ) 3.72 1.92 1.92 !peak 7961 assign (resid 22 and name HD1 ) (resid 51 and name HE* ) 3.83 2.03 2.03 !peak 8479 assign (resid 23 and name HN ) (resid 24 and name HB* ) 3.56 1.76 1.76 !peak 6512 assign (resid 23 and name HA ) (resid 28 and name HE* ) 3.25 1.45 1.45 !peak 6569 assign (resid 24 and name HB* ) (resid 25 and name HD2 ) 3.41 1.61 1.61 !peak 6539 assign (resid 24 and name HB* ) (resid 26 and name HN ) 3.54 1.74 1.74 !peak 8516 assign (resid 24 and name HB* ) (resid 27 and name HN ) 3.13 1.33 1.33 !peak 7886 assign (resid 24 and name HB* ) (resid 27 and name HB* ) 2.79 0.99 0.99 !peak 7893 assign (resid 25 and name HB* ) (resid 26 and name HN ) 2.90 1.10 1.10 !peak 734 assign (resid 25 and name HB* ) (resid 27 and name HN ) 4.24 2.44 2.44 !peak 7952 assign (resid 25 and name HG2 ) (resid 26 and name HG* ) 2.67 0.87 0.87 !peak 2552 assign (resid 25 and name HD2 ) (resid 26 and name HG* ) 3.51 1.71 1.71 !peak 2485 assign (resid 26 and name HN ) (resid 26 and name HB* ) 2.67 0.87 0.87 !peak 733 assign (resid 26 and name HN ) (resid 26 and name HG* ) 2.64 0.84 0.84 !peak 736 assign (resid 26 and name HA ) (resid 26 and name HG* ) 2.77 0.97 0.97 !peak 2551 assign (resid 26 and name HB* ) (resid 26 and name HG* ) 2.26 0.46 0.46 !peak 2537 assign (resid 26 and name HB* ) (resid 27 and name HN ) 2.67 0.87 0.87 !peak 137 assign (resid 26 and name HB* ) (resid 27 and name HA ) 3.84 2.04 2.04 !peak 6554 assign (resid 26 and name HG* ) (resid 27 and name HN ) 3.17 1.37 1.37 !peak 140 assign (resid 27 and name HB* ) (resid 28 and name HE* ) 4.17 2.37 2.37 !peak 9258 assign (resid 28 and name HN ) (resid 28 and name HE* ) 3.37 1.57 1.57 !peak 1433 assign (resid 28 and name HA ) (resid 40 and name HD* ) 3.04 1.24 1.24 !peak 6550 assign (resid 28 and name HB2 ) (resid 40 and name HD* ) 3.18 1.38 1.38 !peak 6582 assign (resid 28 and name HB1 ) (resid 28 and name HE* ) 2.91 1.11 1.11 !peak 1437 assign (resid 28 and name HG1 ) (resid 40 and name HD* ) 3.40 1.60 1.60 !peak 6581 assign (resid 29 and name HN ) (resid 40 and name HD* ) 3.89 2.09 2.09 !peak 6593 assign (resid 30 and name HA ) (resid 33 and name HG* ) 3.32 1.52 1.51 !peak 6600 assign (resid 30 and name HA ) (resid 33 and name HD* ) 3.21 1.41 1.41 !peak 9187 assign (resid 31 and name HA ) (resid 35 and name HD* ) 3.06 1.26 1.26 !peak 7936 assign (resid 31 and name HB2 ) (resid 40 and name HD* ) 2.97 1.17 1.17 !peak 6728 assign (resid 31 and name HB1 ) (resid 35 and name HD* ) 3.45 1.65 1.65 !peak 7938 assign (resid 31 and name HD1* ) (resid 40 and name HD* ) 2.95 1.15 1.15 !peak 8582 assign (resid 31 and name HD1* ) (resid 43 and name HG* ) 2.91 1.11 1.11 !peak 6794 assign (resid 32 and name HN ) (resid 40 and name HD* ) 3.34 1.54 1.54 !peak 3029 assign (resid 32 and name HA ) (resid 40 and name HD* ) 3.07 1.27 1.27 !peak 8561 assign (resid 32 and name HB2 ) (resid 33 and name HG* ) 4.24 2.44 2.44 !peak 9261 assign (resid 32 and name HB2 ) (resid 40 and name HD* ) 3.59 1.79 1.79 !peak 7982 assign (resid 32 and name HB1 ) (resid 33 and name HG* ) 3.73 1.93 1.93 !peak 8560 assign (resid 32 and name HB1 ) (resid 40 and name HD* ) 3.78 1.98 1.97 !peak 6645 assign (resid 32 and name HD21 ) (resid 40 and name HD* ) 3.39 1.59 1.59 !peak 6646 assign (resid 32 and name HD22 ) (resid 40 and name HD* ) 3.32 1.52 1.51 !peak 8563 assign (resid 33 and name HN ) (resid 33 and name HG* ) 2.94 1.14 1.14 !peak 779 assign (resid 33 and name HN ) (resid 33 and name HD* ) 3.33 1.53 1.53 !peak 781 assign (resid 33 and name HN ) (resid 33 and name HE* ) 3.91 2.11 2.11 !peak 2814 assign (resid 33 and name HA ) (resid 33 and name HD* ) 3.53 1.73 1.73 !peak 2795 assign (resid 33 and name HA ) (resid 33 and name HE* ) 3.85 2.05 2.05 !peak 2743 assign (resid 33 and name HB2 ) (resid 33 and name HD* ) 2.62 0.82 0.82 !peak 2797 assign (resid 33 and name HB1 ) (resid 33 and name HE* ) 3.26 1.46 1.46 !peak 2817 assign (resid 33 and name HG* ) (resid 33 and name HD* ) 2.16 0.37 0.37 !peak 2798 assign (resid 33 and name HG* ) (resid 33 and name HE* ) 2.49 0.69 0.69 !peak 2818 assign (resid 33 and name HG* ) (resid 34 and name HN ) 3.36 1.56 1.56 !peak 183 assign (resid 33 and name HG* ) (resid 34 and name HG2* ) 3.65 1.85 1.85 !peak 9121 assign (resid 33 and name HD* ) (resid 34 and name HN ) 3.59 1.79 1.79 !peak 185 assign (resid 33 and name HE* ) (resid 34 and name HG2* ) 3.45 1.65 1.65 !peak 7625 assign (resid 34 and name HG11 ) (resid 35 and name HD* ) 3.45 1.65 1.65 !peak 7937 assign (resid 35 and name HN ) (resid 35 and name HD* ) 2.98 1.18 1.18 !peak 797 assign (resid 35 and name HA ) (resid 35 and name HD* ) 2.69 0.89 0.89 !peak 2895 assign (resid 35 and name HB2 ) (resid 35 and name HD* ) 2.57 0.77 0.77 !peak 2905 assign (resid 35 and name HB2 ) (resid 39 and name HG* ) 3.30 1.50 1.50 !peak 6675 assign (resid 35 and name HB1 ) (resid 35 and name HD* ) 2.69 0.89 0.89 !peak 2904 assign (resid 35 and name HB1 ) (resid 39 and name HG* ) 3.24 1.44 1.44 !peak 6676 assign (resid 35 and name HG ) (resid 39 and name HG* ) 3.11 1.31 1.31 !peak 7943 assign (resid 35 and name HD* ) (resid 36 and name HN ) 2.88 1.08 1.08 !peak 200 assign (resid 35 and name HD* ) (resid 39 and name HN ) 3.65 1.85 1.85 !peak 7964 assign (resid 35 and name HD* ) (resid 39 and name HB ) 3.31 1.51 1.51 !peak 9190 assign (resid 35 and name HD* ) (resid 39 and name HG* ) 2.71 0.91 0.91 !peak 7945 assign (resid 35 and name HD* ) (resid 94 and name HA ) 4.30 2.50 2.50 !peak 8936 assign (resid 35 and name HD* ) (resid 94 and name HD* ) 2.72 0.92 0.92 !peak 5532 assign (resid 35 and name HD* ) (resid 94 and name HE* ) 3.48 1.68 1.68 !peak 7929 assign (resid 35 and name HD* ) (resid 94 and name HZ ) 4.26 2.46 2.46 !peak 7516 assign (resid 35 and name HD* ) (resid 101 and name HN ) 3.75 1.95 1.95 !peak 8984 assign (resid 35 and name HD* ) (resid 101 and name HA ) 3.49 1.69 1.69 !peak 8983 assign (resid 35 and name HD* ) (resid 101 and name HB ) 2.81 1.01 1.01 !peak 2898 assign (resid 35 and name HD* ) (resid 101 and name HG2* ) 2.57 0.77 0.77 !peak 7944 assign (resid 35 and name HD* ) (resid 101 and name HD1* ) 3.17 1.37 1.37 !peak 7629 assign (resid 35 and name HD* ) (resid 102 and name HN ) 3.41 1.61 1.61 !peak 8985 assign (resid 35 and name HD* ) (resid 103 and name HN ) 3.45 1.65 1.65 !peak 7420 assign (resid 35 and name HD* ) (resid 104 and name HA ) 3.58 1.78 1.78 !peak 7931 assign (resid 35 and name HD* ) (resid 104 and name HB ) 3.34 1.54 1.54 !peak 7446 assign (resid 35 and name HD* ) (resid 104 and name HG* ) 2.87 1.07 1.07 !peak 9007 assign (resid 36 and name HN ) (resid 36 and name HB* ) 2.67 0.87 0.87 !peak 801 assign (resid 36 and name HN ) (resid 37 and name HD* ) 3.49 1.69 1.69 !peak 6691 assign (resid 36 and name HN ) (resid 39 and name HG* ) 2.83 1.03 1.03 !peak 5114 assign (resid 36 and name HB* ) (resid 37 and name HG* ) 3.29 1.49 1.49 !peak 2955 assign (resid 36 and name HB* ) (resid 37 and name HD* ) 2.80 1.00 1.00 !peak 2927 assign (resid 36 and name HB* ) (resid 38 and name HN ) 2.98 1.18 1.18 !peak 202 assign (resid 36 and name HB* ) (resid 39 and name HN ) 3.30 1.50 1.50 !peak 6687 assign (resid 36 and name HB* ) (resid 39 and name HB ) 3.69 1.89 1.89 !peak 8572 assign (resid 36 and name HB* ) (resid 39 and name HG* ) 2.97 1.17 1.17 !peak 9244 assign (resid 36 and name HB* ) (resid 100 and name HG2* ) 3.83 2.03 2.03 !peak 8573 assign (resid 36 and name HB* ) (resid 102 and name HA ) 3.04 1.24 1.24 !peak 8370 assign (resid 36 and name HB* ) (resid 102 and name HD* ) 3.50 1.70 1.70 !peak 8991 assign (resid 37 and name HA ) (resid 40 and name HD* ) 3.19 1.39 1.39 !peak 6702 assign (resid 37 and name HB2 ) (resid 40 and name HD* ) 4.30 2.50 2.50 !peak 8575 assign (resid 37 and name HG* ) (resid 38 and name HN ) 3.10 1.30 1.30 !peak 205 assign (resid 37 and name HG* ) (resid 40 and name HD* ) 4.00 2.20 2.20 !peak 8579 assign (resid 37 and name HD* ) (resid 38 and name HN ) 2.98 1.18 1.18 !peak 207 assign (resid 38 and name HN ) (resid 39 and name HG* ) 3.45 1.65 1.65 !peak 6711 assign (resid 38 and name HB* ) (resid 39 and name HN ) 2.99 1.19 1.19 !peak 212 assign (resid 38 and name HB* ) (resid 39 and name HG* ) 3.17 1.37 1.37 !peak 6712 assign (resid 39 and name HN ) (resid 39 and name HG* ) 2.46 0.66 0.66 !peak 809 assign (resid 39 and name HN ) (resid 42 and name HG* ) 4.24 2.44 2.44 !peak 6715 assign (resid 39 and name HA ) (resid 39 and name HG* ) 2.45 0.65 0.65 !peak 2984 assign (resid 39 and name HA ) (resid 42 and name HG* ) 2.96 1.16 1.16 !peak 5559 assign (resid 39 and name HA ) (resid 42 and name HE* ) 3.19 1.39 1.39 !peak 2981 assign (resid 39 and name HB ) (resid 104 and name HG* ) 3.95 2.15 2.15 !peak 9130 assign (resid 39 and name HG* ) (resid 40 and name HN ) 2.86 1.06 1.06 !peak 217 assign (resid 39 and name HG* ) (resid 40 and name HA ) 3.23 1.43 1.43 !peak 6723 assign (resid 39 and name HG* ) (resid 40 and name HB1 ) 3.34 1.54 1.54 !peak 7971 assign (resid 39 and name HG* ) (resid 41 and name HN ) 3.91 2.11 2.11 !peak 6762 assign (resid 39 and name HG* ) (resid 42 and name HG* ) 3.80 2.00 2.00 !peak 6765 assign (resid 39 and name HG* ) (resid 42 and name HE* ) 3.30 1.50 1.50 !peak 2996 assign (resid 39 and name HG* ) (resid 43 and name HN ) 4.09 2.29 2.29 !peak 7963 assign (resid 39 and name HG* ) (resid 102 and name HA ) 3.00 1.20 1.20 !peak 7415 assign (resid 39 and name HG* ) (resid 103 and name HN ) 3.13 1.33 1.33 !peak 9002 assign (resid 39 and name HG* ) (resid 103 and name HA ) 2.85 1.05 1.05 !peak 9000 assign (resid 39 and name HG* ) (resid 103 and name HB* ) 3.66 1.86 1.86 !peak 8998 assign (resid 39 and name HG* ) (resid 104 and name HN ) 2.94 1.14 1.14 !peak 7328 assign (resid 39 and name HG* ) (resid 104 and name HB ) 2.98 1.18 1.18 !peak 7447 assign (resid 39 and name HG* ) (resid 104 and name HG* ) 2.54 0.74 0.74 !peak 7785 assign (resid 40 and name HN ) (resid 40 and name HD* ) 2.90 1.10 1.10 !peak 816 assign (resid 40 and name HN ) (resid 43 and name HG* ) 3.75 1.95 1.95 !peak 216 assign (resid 40 and name HA ) (resid 40 and name HD* ) 2.77 0.97 0.97 !peak 3037 assign (resid 40 and name HA ) (resid 42 and name HG* ) 4.02 2.22 2.22 !peak 6764 assign (resid 40 and name HA ) (resid 43 and name HG* ) 2.72 0.92 0.92 !peak 3106 assign (resid 40 and name HB2 ) (resid 40 and name HD* ) 2.61 0.81 0.81 !peak 3032 assign (resid 40 and name HB1 ) (resid 40 and name HD* ) 2.60 0.80 0.80 !peak 3031 assign (resid 40 and name HD* ) (resid 41 and name HA ) 2.91 1.11 1.11 !peak 6730 assign (resid 40 and name HD* ) (resid 41 and name HB2 ) 3.14 1.34 1.34 !peak 7989 assign (resid 40 and name HD* ) (resid 42 and name HN ) 3.80 2.00 2.00 !peak 8586 assign (resid 40 and name HD* ) (resid 43 and name HN ) 3.60 1.80 1.80 !peak 6770 assign (resid 40 and name HD* ) (resid 43 and name HB ) 3.38 1.58 1.58 !peak 7987 assign (resid 40 and name HD* ) (resid 44 and name HG* ) 3.33 1.53 1.53 !peak 3038 assign (resid 40 and name HD* ) (resid 44 and name HD* ) 3.86 2.06 2.06 !peak 8609 assign (resid 41 and name HN ) (resid 42 and name HG* ) 4.05 2.25 2.25 !peak 6760 assign (resid 41 and name HN ) (resid 43 and name HG* ) 4.17 2.37 2.37 !peak 6762 assign (resid 41 and name HA ) (resid 44 and name HG* ) 3.25 1.45 1.45 !peak 8583 assign (resid 41 and name HA ) (resid 44 and name HD* ) 3.14 1.34 1.34 !peak 6745 assign (resid 41 and name HB2 ) (resid 44 and name HG* ) 4.24 2.44 2.44 !peak 6755 assign (resid 42 and name HN ) (resid 43 and name HG* ) 3.21 1.41 1.41 !peak 6752 assign (resid 42 and name HA ) (resid 42 and name HG* ) 3.00 1.20 1.20 !peak 3080 assign (resid 42 and name HA ) (resid 43 and name HG* ) 3.91 2.11 2.11 !peak 8587 assign (resid 42 and name HA ) (resid 45 and name HB* ) 2.82 1.02 1.02 !peak 5578 assign (resid 42 and name HA ) (resid 45 and name HG* ) 3.43 1.63 1.63 !peak 9133 assign (resid 42 and name HB2 ) (resid 42 and name HE* ) 3.52 1.72 1.72 !peak 3077 assign (resid 42 and name HB2 ) (resid 43 and name HG* ) 3.60 1.80 1.80 !peak 6754 assign (resid 42 and name HB1 ) (resid 42 and name HE* ) 3.46 1.66 1.66 !peak 3069 assign (resid 42 and name HB1 ) (resid 43 and name HG* ) 3.80 2.00 2.00 !peak 6753 assign (resid 42 and name HG* ) (resid 42 and name HE* ) 2.64 0.84 0.84 !peak 1445 assign (resid 42 and name HG* ) (resid 43 and name HN ) 2.61 0.81 0.81 !peak 234 assign (resid 42 and name HG* ) (resid 43 and name HA ) 3.17 1.37 1.37 !peak 7996 assign (resid 42 and name HG* ) (resid 43 and name HG* ) 3.27 1.47 1.47 !peak 8069 assign (resid 42 and name HE* ) (resid 43 and name HA ) 4.24 2.44 2.44 !peak 6787 assign (resid 42 and name HE* ) (resid 43 and name HG* ) 3.43 1.63 1.63 !peak 8013 assign (resid 42 and name HE* ) (resid 104 and name HG* ) 3.34 1.54 1.54 !peak 6768 assign (resid 43 and name HN ) (resid 43 and name HG* ) 2.54 0.74 0.74 !peak 833 assign (resid 43 and name HN ) (resid 45 and name HB* ) 3.69 1.89 1.89 !peak 8590 assign (resid 43 and name HA ) (resid 46 and name HB* ) 3.25 1.45 1.45 !peak 5587 assign (resid 43 and name HB ) (resid 44 and name HG* ) 3.96 2.16 2.16 !peak 8596 assign (resid 43 and name HG* ) (resid 44 and name HN ) 2.91 1.11 1.11 !peak 241 assign (resid 43 and name HG* ) (resid 44 and name HA ) 3.28 1.48 1.48 !peak 6791 assign (resid 43 and name HG* ) (resid 44 and name HB2 ) 3.94 2.14 2.14 !peak 8602 assign (resid 43 and name HG* ) (resid 44 and name HB1 ) 3.90 2.10 2.10 !peak 8600 assign (resid 43 and name HG* ) (resid 44 and name HG* ) 3.84 2.04 2.04 !peak 8606 assign (resid 43 and name HG* ) (resid 45 and name HN ) 3.96 2.16 2.16 !peak 6428 assign (resid 43 and name HG* ) (resid 46 and name HN ) 3.99 2.19 2.19 !peak 6803 assign (resid 43 and name HG* ) (resid 46 and name HB* ) 3.57 1.77 1.77 !peak 8618 assign (resid 43 and name HG* ) (resid 47 and name HN ) 3.57 1.77 1.77 !peak 6823 assign (resid 43 and name HG* ) (resid 104 and name HG* ) 2.97 1.17 1.17 !peak 6774 assign (resid 44 and name HN ) (resid 44 and name HG* ) 2.89 1.09 1.09 !peak 839 assign (resid 44 and name HN ) (resid 44 and name HD* ) 3.65 1.85 1.85 !peak 3163 assign (resid 44 and name HA ) (resid 44 and name HG* ) 2.98 1.18 1.18 !peak 3140 assign (resid 44 and name HB2 ) (resid 44 and name HD* ) 2.83 1.03 1.03 !peak 3269 assign (resid 44 and name HG* ) (resid 45 and name HN ) 3.15 1.35 1.35 !peak 672 assign (resid 44 and name HG* ) (resid 45 and name HA ) 4.24 2.44 2.44 !peak 8021 assign (resid 44 and name HG* ) (resid 45 and name HB* ) 3.50 1.70 1.70 !peak 8595 assign (resid 44 and name HG* ) (resid 45 and name HG* ) 4.06 2.26 2.26 !peak 8596 assign (resid 44 and name HD* ) (resid 45 and name HN ) 3.60 1.80 1.80 !peak 249 assign (resid 44 and name HD* ) (resid 45 and name HG* ) 3.88 2.08 2.08 !peak 8035 assign (resid 45 and name HN ) (resid 45 and name HB* ) 2.55 0.75 0.75 !peak 845 assign (resid 45 and name HN ) (resid 45 and name HG* ) 2.93 1.13 1.13 !peak 848 assign (resid 45 and name HA ) (resid 45 and name HB* ) 2.42 0.62 0.62 !peak 5505 assign (resid 45 and name HA ) (resid 48 and name HB* ) 3.10 1.30 1.30 !peak 5598 assign (resid 45 and name HA ) (resid 48 and name HG* ) 3.57 1.77 1.77 !peak 8020 assign (resid 45 and name HA ) (resid 48 and name HD* ) 3.80 2.00 2.00 !peak 6832 assign (resid 45 and name HB* ) (resid 45 and name HG* ) 2.20 0.40 0.40 !peak 3192 assign (resid 45 and name HB* ) (resid 46 and name HN ) 2.87 1.07 1.07 !peak 252 assign (resid 45 and name HB* ) (resid 46 and name HA ) 3.76 1.96 1.96 !peak 6805 assign (resid 45 and name HG* ) (resid 46 and name HN ) 3.74 1.94 1.94 !peak 5145 assign (resid 46 and name HN ) (resid 46 and name HB* ) 2.62 0.82 0.82 !peak 852 assign (resid 46 and name HN ) (resid 48 and name HB* ) 4.07 2.27 2.27 !peak 8617 assign (resid 46 and name HA ) (resid 49 and name HG* ) 3.23 1.43 1.43 !peak 6804 assign (resid 46 and name HB* ) (resid 47 and name HN ) 2.90 1.10 1.10 !peak 259 assign (resid 46 and name HB* ) (resid 106 and name HG* ) 4.19 2.39 2.39 !peak 8620 assign (resid 47 and name HN ) (resid 48 and name HB* ) 3.52 1.72 1.72 !peak 6822 assign (resid 47 and name HA ) (resid 50 and name HD* ) 3.32 1.52 1.51 !peak 6826 assign (resid 47 and name HB* ) (resid 50 and name HD* ) 3.80 2.00 2.00 !peak 8029 assign (resid 48 and name HN ) (resid 48 and name HB* ) 2.56 0.76 0.76 !peak 858 assign (resid 48 and name HN ) (resid 48 and name HG* ) 2.80 1.00 1.00 !peak 860 assign (resid 48 and name HN ) (resid 48 and name HD* ) 3.53 1.73 1.73 !peak 3267 assign (resid 48 and name HN ) (resid 49 and name HG* ) 3.66 1.86 1.86 !peak 5162 assign (resid 48 and name HA ) (resid 48 and name HG* ) 2.79 0.99 0.99 !peak 3252 assign (resid 48 and name HA ) (resid 48 and name HD* ) 3.53 1.73 1.73 !peak 3226 assign (resid 48 and name HA ) (resid 51 and name HG* ) 3.65 1.85 1.85 !peak 8657 assign (resid 48 and name HB* ) (resid 48 and name HD* ) 2.72 0.92 0.92 !peak 3269 assign (resid 48 and name HB* ) (resid 49 and name HN ) 2.63 0.83 0.83 !peak 265 assign (resid 48 and name HB* ) (resid 49 and name HG* ) 3.19 1.39 1.39 !peak 8593 assign (resid 48 and name HB* ) (resid 51 and name HB1 ) 3.44 1.64 1.64 !peak 8576 assign (resid 48 and name HG* ) (resid 49 and name HN ) 3.55 1.75 1.75 !peak 267 assign (resid 48 and name HG* ) (resid 51 and name HB1 ) 3.42 1.62 1.62 !peak 8578 assign (resid 49 and name HN ) (resid 49 and name HG* ) 2.82 1.02 1.02 !peak 869 assign (resid 49 and name HA ) (resid 49 and name HG* ) 2.80 1.00 1.00 !peak 3300 assign (resid 49 and name HA ) (resid 52 and name HD* ) 3.65 1.85 1.85 !peak 8672 assign (resid 49 and name HB2 ) (resid 50 and name HD* ) 3.96 2.16 2.16 !peak 8637 assign (resid 49 and name HB1 ) (resid 50 and name HD* ) 3.75 1.95 1.95 !peak 8040 assign (resid 49 and name HG* ) (resid 50 and name HN ) 3.38 1.58 1.58 !peak 276 assign (resid 49 and name HG* ) (resid 50 and name HD* ) 3.94 2.14 2.14 !peak 8639 assign (resid 50 and name HN ) (resid 50 and name HD* ) 2.94 1.14 1.14 !peak 876 assign (resid 50 and name HA ) (resid 50 and name HD* ) 2.71 0.91 0.91 !peak 3341 assign (resid 50 and name HA ) (resid 53 and name HG* ) 3.61 1.81 1.81 !peak 8679 assign (resid 50 and name HB2 ) (resid 50 and name HD* ) 2.67 0.87 0.87 !peak 3342 assign (resid 50 and name HD* ) (resid 51 and name HN ) 3.67 1.87 1.87 !peak 5168 assign (resid 50 and name HD* ) (resid 53 and name HB2 ) 3.88 2.08 2.08 !peak 8040 assign (resid 50 and name HD* ) (resid 53 and name HE* ) 3.39 1.59 1.59 !peak 8685 assign (resid 50 and name HD* ) (resid 55 and name HN ) 3.83 2.03 2.03 !peak 5168 assign (resid 50 and name HD* ) (resid 55 and name HB ) 3.37 1.57 1.57 !peak 6858 assign (resid 50 and name HD* ) (resid 55 and name HG2* ) 3.11 1.31 1.31 !peak 8692 assign (resid 50 and name HD* ) (resid 55 and name HG12 ) 3.94 2.14 2.14 !peak 8690 assign (resid 50 and name HD* ) (resid 55 and name HG11 ) 3.88 2.08 2.08 !peak 8689 assign (resid 50 and name HD* ) (resid 55 and name HD1* ) 2.89 1.09 1.09 !peak 8647 assign (resid 50 and name HD* ) (resid 57 and name HB1 ) 4.30 2.50 2.50 !peak 8048 assign (resid 50 and name HD* ) (resid 57 and name HD* ) 3.73 1.93 1.93 !peak 5540 assign (resid 50 and name HD* ) (resid 57 and name HE* ) 3.45 1.65 1.65 !peak 8049 assign (resid 50 and name HD* ) (resid 57 and name HZ ) 3.65 1.85 1.85 !peak 5581 assign (resid 50 and name HD* ) (resid 90 and name HE* ) 3.59 1.79 1.79 !peak 5483 assign (resid 51 and name HA ) (resid 51 and name HG* ) 2.73 0.93 0.93 !peak 3088 assign (resid 51 and name HB1 ) (resid 51 and name HG* ) 2.41 0.61 0.61 !peak 3503 assign (resid 51 and name HB1 ) (resid 51 and name HE* ) 3.48 1.68 1.68 !peak 8659 assign (resid 51 and name HG* ) (resid 51 and name HE* ) 2.74 0.94 0.94 !peak 3385 assign (resid 51 and name HG* ) (resid 52 and name HN ) 3.36 1.56 1.56 !peak 289 assign (resid 51 and name HG* ) (resid 52 and name HA ) 3.64 1.84 1.84 !peak 8670 assign (resid 52 and name HN ) (resid 52 and name HG* ) 3.23 1.43 1.43 !peak 890 assign (resid 52 and name HN ) (resid 52 and name HD* ) 3.42 1.62 1.62 !peak 891 assign (resid 52 and name HA ) (resid 52 and name HG* ) 2.94 1.14 1.14 !peak 3392 assign (resid 52 and name HA ) (resid 52 and name HD* ) 3.10 1.30 1.30 !peak 3394 assign (resid 52 and name HB1 ) (resid 52 and name HD* ) 2.53 0.73 0.73 !peak 3440 assign (resid 52 and name HB1 ) (resid 53 and name HG* ) 3.46 1.66 1.66 !peak 6331 assign (resid 52 and name HG* ) (resid 52 and name HE* ) 2.78 0.98 0.98 !peak 3471 assign (resid 52 and name HG* ) (resid 53 and name HN ) 4.00 2.20 2.20 !peak 8062 assign (resid 53 and name HN ) (resid 53 and name HG* ) 2.88 1.08 1.08 !peak 900 assign (resid 53 and name HA ) (resid 53 and name HG* ) 2.83 1.03 1.03 !peak 3481 assign (resid 53 and name HB2 ) (resid 53 and name HE* ) 3.23 1.43 1.43 !peak 1476 assign (resid 53 and name HB1 ) (resid 53 and name HE* ) 3.49 1.69 1.69 !peak 1475 assign (resid 53 and name HB1 ) (resid 54 and name HA* ) 4.22 2.42 2.42 !peak 8680 assign (resid 53 and name HG* ) (resid 53 and name HE* ) 2.68 0.88 0.88 !peak 1478 assign (resid 53 and name HG* ) (resid 55 and name HD1* ) 3.83 2.03 2.03 !peak 6328 assign (resid 53 and name HE* ) (resid 55 and name HB ) 4.17 2.37 2.37 !peak 8089 assign (resid 53 and name HE* ) (resid 55 and name HG2* ) 4.24 2.44 2.44 !peak 8091 assign (resid 53 and name HE* ) (resid 55 and name HD1* ) 3.33 1.53 1.53 !peak 9139 assign (resid 54 and name HA* ) (resid 55 and name HA ) 3.55 1.75 1.74 !peak 8073 assign (resid 54 and name HA* ) (resid 55 and name HG12 ) 4.24 2.44 2.44 !peak 8076 assign (resid 55 and name HA ) (resid 56 and name HB* ) 3.85 2.05 2.05 !peak 8074 assign (resid 55 and name HG2* ) (resid 56 and name HB* ) 4.24 2.44 2.44 !peak 6855 assign (resid 55 and name HG2* ) (resid 79 and name HG* ) 3.21 1.41 1.41 !peak 9214 assign (resid 55 and name HD1* ) (resid 79 and name HG* ) 4.24 2.44 2.44 !peak 9218 assign (resid 56 and name HN ) (resid 56 and name HB* ) 2.77 0.97 0.97 !peak 913 assign (resid 56 and name HB* ) (resid 56 and name HD2 ) 2.86 1.06 1.06 !peak 5568 assign (resid 56 and name HB* ) (resid 80 and name HN ) 3.34 1.54 1.54 !peak 7172 assign (resid 56 and name HB* ) (resid 80 and name HB ) 2.99 1.19 1.19 !peak 7718 assign (resid 56 and name HB* ) (resid 80 and name HG2* ) 4.02 2.22 2.22 !peak 7645 assign (resid 57 and name HA ) (resid 58 and name HB* ) 3.82 2.02 2.02 !peak 8100 assign (resid 57 and name HA ) (resid 78 and name HB* ) 3.94 2.14 2.14 !peak 8288 assign (resid 57 and name HA ) (resid 79 and name HG* ) 3.66 1.86 1.86 !peak 8830 assign (resid 57 and name HB2 ) (resid 58 and name HB* ) 4.04 2.24 2.24 !peak 8705 assign (resid 57 and name HB2 ) (resid 75 and name HG* ) 4.30 2.50 2.50 !peak 8209 assign (resid 57 and name HB2 ) (resid 77 and name HD* ) 2.97 1.17 1.17 !peak 7105 assign (resid 57 and name HB2 ) (resid 78 and name HB* ) 4.24 2.44 2.44 !peak 8284 assign (resid 57 and name HB1 ) (resid 79 and name HG* ) 3.64 1.84 1.84 !peak 8903 assign (resid 57 and name HD* ) (resid 58 and name HB* ) 4.24 2.44 2.44 !peak 8470 assign (resid 57 and name HD* ) (resid 59 and name HG* ) 3.27 1.47 1.47 !peak 5460 assign (resid 57 and name HD* ) (resid 77 and name HD* ) 2.69 0.89 0.89 !peak 5463 assign (resid 57 and name HD* ) (resid 79 and name HG* ) 2.95 1.15 1.15 !peak 5453 assign (resid 57 and name HE* ) (resid 59 and name HG* ) 3.46 1.66 1.66 !peak 5465 assign (resid 57 and name HE* ) (resid 77 and name HD* ) 3.33 1.53 1.53 !peak 7126 assign (resid 57 and name HZ ) (resid 77 and name HD* ) 3.61 1.81 1.81 !peak 5580 assign (resid 58 and name HN ) (resid 58 and name HB* ) 2.73 0.93 0.93 !peak 924 assign (resid 58 and name HN ) (resid 58 and name HG* ) 3.48 1.68 1.68 !peak 925 assign (resid 58 and name HN ) (resid 77 and name HD* ) 3.50 1.70 1.70 !peak 6892 assign (resid 58 and name HN ) (resid 78 and name HB* ) 3.57 1.77 1.77 !peak 8293 assign (resid 58 and name HN ) (resid 79 and name HG* ) 4.24 2.44 2.44 !peak 926 assign (resid 58 and name HB* ) (resid 59 and name HN ) 3.15 1.35 1.35 !peak 324 assign (resid 58 and name HB* ) (resid 59 and name HA ) 4.24 2.44 2.44 !peak 8713 assign (resid 58 and name HB* ) (resid 60 and name HA ) 4.24 2.44 2.44 !peak 8134 assign (resid 58 and name HB* ) (resid 60 and name HG2 ) 3.69 1.89 1.89 !peak 8140 assign (resid 58 and name HB* ) (resid 60 and name HG1 ) 3.96 2.16 2.16 !peak 8137 assign (resid 58 and name HB* ) (resid 60 and name HD1 ) 3.36 1.56 1.56 !peak 9272 assign (resid 58 and name HB* ) (resid 60 and name HE* ) 3.67 1.87 1.87 !peak 9276 assign (resid 58 and name HB* ) (resid 78 and name HN ) 3.32 1.52 1.52 !peak 8702 assign (resid 58 and name HG* ) (resid 59 and name HN ) 3.21 1.41 1.41 !peak 326 assign (resid 58 and name HG* ) (resid 59 and name HG* ) 4.19 2.39 2.39 !peak 7574 assign (resid 58 and name HG* ) (resid 60 and name HD2 ) 3.93 2.13 2.13 !peak 9273 assign (resid 58 and name HG* ) (resid 60 and name HD1 ) 3.76 1.96 1.96 !peak 9273 assign (resid 58 and name HG* ) (resid 60 and name HE* ) 4.13 2.33 2.33 !peak 8706 assign (resid 59 and name HN ) (resid 59 and name HG* ) 2.60 0.80 0.80 !peak 931 assign (resid 59 and name HN ) (resid 75 and name HG* ) 3.78 1.98 1.98 !peak 7691 assign (resid 59 and name HN ) (resid 77 and name HD* ) 3.57 1.77 1.77 !peak 6905 assign (resid 59 and name HA ) (resid 62 and name HG* ) 4.30 2.50 2.50 !peak 8733 assign (resid 59 and name HA ) (resid 75 and name HG* ) 3.52 1.72 1.72 !peak 6906 assign (resid 59 and name HA ) (resid 77 and name HD* ) 2.85 1.05 1.05 !peak 7089 assign (resid 59 and name HB ) (resid 75 and name HG* ) 3.84 2.04 2.04 !peak 8120 assign (resid 59 and name HB ) (resid 77 and name HD* ) 3.47 1.67 1.67 !peak 7103 assign (resid 59 and name HG* ) (resid 60 and name HN ) 2.76 0.96 0.96 !peak 331 assign (resid 59 and name HG* ) (resid 60 and name HA ) 3.49 1.69 1.69 !peak 8717 assign (resid 59 and name HG* ) (resid 60 and name HG2 ) 3.82 2.02 2.02 !peak 8718 assign (resid 59 and name HG* ) (resid 60 and name HD2 ) 4.30 2.50 2.50 !peak 8124 assign (resid 59 and name HG* ) (resid 61 and name HN ) 2.77 0.97 0.97 !peak 6945 assign (resid 59 and name HG* ) (resid 61 and name HA ) 3.78 1.98 1.98 !peak 6887 assign (resid 59 and name HG* ) (resid 61 and name HG* ) 4.19 2.39 2.39 !peak 8124 assign (resid 59 and name HG* ) (resid 62 and name HN ) 3.71 1.91 1.91 !peak 6954 assign (resid 59 and name HG* ) (resid 62 and name HA ) 3.47 1.67 1.67 !peak 6888 assign (resid 59 and name HG* ) (resid 62 and name HB ) 3.37 1.57 1.57 !peak 8714 assign (resid 59 and name HG* ) (resid 62 and name HG* ) 2.42 0.62 0.62 !peak 8709 assign (resid 59 and name HG* ) (resid 75 and name HA ) 3.65 1.85 1.85 !peak 6888 assign (resid 59 and name HG* ) (resid 75 and name HB ) 3.44 1.64 1.64 !peak 8123 assign (resid 59 and name HG* ) (resid 75 and name HG* ) 2.57 0.77 0.77 !peak 7650 assign (resid 59 and name HG* ) (resid 76 and name HN ) 3.24 1.44 1.44 !peak 7698 assign (resid 59 and name HG* ) (resid 77 and name HA ) 3.37 1.57 1.57 !peak 6889 assign (resid 59 and name HG* ) (resid 77 and name HB1 ) 3.41 1.61 1.61 !peak 8962 assign (resid 59 and name HG* ) (resid 77 and name HG ) 3.70 1.90 1.90 !peak 8125 assign (resid 59 and name HG* ) (resid 77 and name HD* ) 2.61 0.81 0.81 !peak 7108 assign (resid 60 and name HN ) (resid 75 and name HG* ) 3.40 1.60 1.60 !peak 7690 assign (resid 60 and name HN ) (resid 77 and name HD* ) 3.45 1.65 1.65 !peak 6925 assign (resid 60 and name HA ) (resid 60 and name HE* ) 2.94 1.14 1.14 !peak 3676 assign (resid 60 and name HB2 ) (resid 60 and name HE* ) 3.18 1.38 1.38 !peak 3749 assign (resid 60 and name HB1 ) (resid 76 and name HG* ) 3.55 1.75 1.75 !peak 8135 assign (resid 60 and name HG2 ) (resid 76 and name HG* ) 3.94 2.14 2.14 !peak 8229 assign (resid 60 and name HG2 ) (resid 78 and name HB* ) 3.36 1.56 1.56 !peak 8139 assign (resid 60 and name HG2 ) (resid 78 and name HG* ) 3.65 1.85 1.85 !peak 8141 assign (resid 60 and name HG2 ) (resid 87 and name HD2* ) 3.58 1.78 1.78 !peak 9069 assign (resid 60 and name HG1 ) (resid 60 and name HE* ) 2.99 1.19 1.19 !peak 3741 assign (resid 60 and name HG1 ) (resid 76 and name HG* ) 3.64 1.84 1.84 !peak 8229 assign (resid 60 and name HG1 ) (resid 78 and name HB* ) 3.48 1.68 1.68 !peak 8825 assign (resid 60 and name HG1 ) (resid 78 and name HG* ) 3.51 1.71 1.71 !peak 8138 assign (resid 60 and name HG1 ) (resid 87 and name HD2* ) 3.73 1.93 1.93 !peak 5212 assign (resid 60 and name HD1 ) (resid 78 and name HB* ) 3.40 1.60 1.60 !peak 8282 assign (resid 60 and name HD1 ) (resid 78 and name HG* ) 3.67 1.87 1.87 !peak 8278 assign (resid 60 and name HE* ) (resid 61 and name HN ) 4.24 2.44 2.44 !peak 5217 assign (resid 60 and name HE* ) (resid 78 and name HB* ) 4.13 2.33 2.33 !peak 8284 assign (resid 60 and name HE* ) (resid 87 and name HD2* ) 4.13 2.33 2.33 !peak 5217 assign (resid 61 and name HN ) (resid 61 and name HG* ) 3.26 1.46 1.46 !peak 3781 assign (resid 61 and name HN ) (resid 61 and name HD* ) 4.24 2.44 2.44 !peak 4721 assign (resid 61 and name HN ) (resid 62 and name HG* ) 3.25 1.45 1.45 !peak 6944 assign (resid 61 and name HN ) (resid 75 and name HG* ) 3.36 1.56 1.56 !peak 6946 assign (resid 61 and name HN ) (resid 76 and name HG* ) 3.52 1.72 1.72 !peak 8726 assign (resid 61 and name HN ) (resid 77 and name HD* ) 4.30 2.50 2.50 !peak 8731 assign (resid 61 and name HA ) (resid 61 and name HG* ) 3.02 1.22 1.22 !peak 3762 assign (resid 61 and name HA ) (resid 62 and name HG* ) 3.37 1.57 1.57 !peak 8729 assign (resid 61 and name HB2 ) (resid 61 and name HD* ) 2.83 1.03 1.03 !peak 3808 assign (resid 61 and name HB1 ) (resid 61 and name HG* ) 2.41 0.61 0.61 !peak 3784 assign (resid 61 and name HB1 ) (resid 61 and name HD* ) 3.03 1.23 1.23 !peak 3808 assign (resid 61 and name HG* ) (resid 62 and name HN ) 2.96 1.16 1.16 !peak 347 assign (resid 61 and name HG* ) (resid 62 and name HA ) 4.00 2.20 2.20 !peak 8723 assign (resid 61 and name HG* ) (resid 63 and name HG* ) 3.18 1.38 1.38 !peak 8948 assign (resid 61 and name HG* ) (resid 75 and name HA ) 4.24 2.44 2.44 !peak 8723 assign (resid 61 and name HG* ) (resid 76 and name HN ) 3.21 1.41 1.41 !peak 7072 assign (resid 61 and name HG* ) (resid 76 and name HB2 ) 3.22 1.42 1.42 !peak 8221 assign (resid 61 and name HG* ) (resid 76 and name HB1 ) 3.06 1.26 1.26 !peak 8225 assign (resid 61 and name HG* ) (resid 76 and name HG* ) 4.13 2.33 2.33 !peak 8234 assign (resid 61 and name HD* ) (resid 62 and name HN ) 3.60 1.80 1.80 !peak 349 assign (resid 61 and name HD* ) (resid 63 and name HG* ) 3.37 1.57 1.57 !peak 8725 assign (resid 62 and name HN ) (resid 62 and name HG* ) 2.72 0.92 0.92 !peak 953 assign (resid 62 and name HN ) (resid 63 and name HG* ) 3.91 2.11 2.11 !peak 8732 assign (resid 62 and name HA ) (resid 62 and name HG* ) 2.57 0.77 0.77 !peak 3829 assign (resid 62 and name HG* ) (resid 63 and name HN ) 2.76 0.96 0.96 !peak 355 assign (resid 62 and name HG* ) (resid 75 and name HG* ) 3.44 1.64 1.64 !peak 8809 assign (resid 62 and name HG* ) (resid 76 and name HN ) 3.56 1.76 1.76 !peak 5272 assign (resid 63 and name HN ) (resid 63 and name HG* ) 3.27 1.47 1.47 !peak 960 assign (resid 63 and name HA ) (resid 63 and name HG* ) 2.94 1.14 1.14 !peak 3858 assign (resid 63 and name HB2 ) (resid 64 and name HG* ) 4.29 2.49 2.49 !peak 8742 assign (resid 63 and name HB1 ) (resid 64 and name HG* ) 3.75 1.95 1.95 !peak 8744 assign (resid 63 and name HG* ) (resid 64 and name HN ) 3.07 1.27 1.27 !peak 361 assign (resid 63 and name HG* ) (resid 74 and name HB ) 3.88 2.08 2.08 !peak 6965 assign (resid 64 and name HN ) (resid 64 and name HG* ) 2.74 0.94 0.94 !peak 965 assign (resid 64 and name HA ) (resid 64 and name HG* ) 2.54 0.74 0.74 !peak 3866 assign (resid 64 and name HG* ) (resid 65 and name HN ) 2.69 0.89 0.89 !peak 365 assign (resid 64 and name HG* ) (resid 73 and name HG2* ) 2.63 0.83 0.83 !peak 3877 assign (resid 65 and name HN ) (resid 71 and name HG* ) 2.88 1.08 1.08 !peak 3970 assign (resid 65 and name HG2* ) (resid 72 and name HD2* ) 3.71 1.91 1.91 !peak 7677 assign (resid 66 and name HA ) (resid 71 and name HG* ) 3.04 1.24 1.24 !peak 6979 assign (resid 66 and name HA ) (resid 72 and name HD2* ) 4.24 2.44 2.44 !peak 8790 assign (resid 66 and name HB ) (resid 71 and name HG* ) 3.37 1.57 1.57 !peak 8165 assign (resid 66 and name HG2* ) (resid 71 and name HG* ) 2.58 0.78 0.78 !peak 8981 assign (resid 67 and name HN ) (resid 71 and name HG* ) 3.30 1.50 1.50 !peak 6985 assign (resid 67 and name HN ) (resid 72 and name HD2* ) 3.73 1.93 1.93 !peak 9247 assign (resid 67 and name HB1 ) (resid 68 and name HA* ) 3.90 2.10 2.10 !peak 6988 assign (resid 67 and name HB1 ) (resid 72 and name HD2* ) 3.35 1.55 1.55 !peak 9170 assign (resid 68 and name HA* ) (resid 69 and name HB* ) 4.11 2.31 2.31 !peak 8772 assign (resid 69 and name HN ) (resid 69 and name HD2* ) 3.78 1.98 1.97 !peak 8770 assign (resid 69 and name HA ) (resid 69 and name HD2* ) 3.35 1.55 1.55 !peak 1330 assign (resid 69 and name HA ) (resid 96 and name HG* ) 2.94 1.14 1.14 !peak 9238 assign (resid 69 and name HB* ) (resid 69 and name HD2* ) 2.64 0.84 0.84 !peak 1332 assign (resid 69 and name HB* ) (resid 70 and name HN ) 3.21 1.41 1.41 !peak 384 assign (resid 69 and name HB* ) (resid 70 and name HA ) 3.95 2.15 2.15 !peak 8771 assign (resid 69 and name HB* ) (resid 70 and name HG2* ) 3.76 1.96 1.96 !peak 6997 assign (resid 69 and name HB* ) (resid 96 and name HN ) 3.73 1.93 1.93 !peak 3937 assign (resid 69 and name HB* ) (resid 96 and name HB ) 3.61 1.81 1.81 !peak 6999 assign (resid 69 and name HB* ) (resid 96 and name HG* ) 3.03 1.23 1.23 !peak 6998 assign (resid 69 and name HD2* ) (resid 70 and name HN ) 3.98 2.18 2.18 !peak 8769 assign (resid 69 and name HD2* ) (resid 96 and name HG* ) 3.56 1.76 1.76 !peak 7009 assign (resid 70 and name HA ) (resid 95 and name HG* ) 3.52 1.72 1.72 !peak 8775 assign (resid 70 and name HB ) (resid 71 and name HG* ) 4.15 2.35 2.35 !peak 8156 assign (resid 70 and name HB ) (resid 93 and name HD* ) 3.63 1.83 1.83 !peak 7305 assign (resid 70 and name HG2* ) (resid 71 and name HG* ) 3.12 1.32 1.32 !peak 8774 assign (resid 70 and name HG2* ) (resid 72 and name HD2* ) 3.21 1.41 1.41 !peak 7675 assign (resid 70 and name HG2* ) (resid 93 and name HD* ) 2.80 1.00 1.00 !peak 7283 assign (resid 70 and name HG2* ) (resid 95 and name HG* ) 3.07 1.27 1.27 !peak 6966 assign (resid 71 and name HN ) (resid 71 and name HG* ) 2.66 0.86 0.86 !peak 995 assign (resid 71 and name HA ) (resid 71 and name HG* ) 2.55 0.75 0.75 !peak 3959 assign (resid 71 and name HG* ) (resid 72 and name HN ) 2.56 0.76 0.76 !peak 396 assign (resid 71 and name HG* ) (resid 72 and name HA ) 3.24 1.44 1.44 !peak 7035 assign (resid 71 and name HG* ) (resid 72 and name HB2 ) 3.56 1.76 1.76 !peak 7038 assign (resid 71 and name HG* ) (resid 72 and name HD2* ) 3.87 2.07 2.07 !peak 9067 assign (resid 71 and name HG* ) (resid 73 and name HN ) 3.31 1.51 1.51 !peak 1006 assign (resid 71 and name HG* ) (resid 93 and name HA ) 3.38 1.58 1.58 !peak 8163 assign (resid 71 and name HG* ) (resid 94 and name HN ) 3.15 1.35 1.35 !peak 7287 assign (resid 71 and name HG* ) (resid 94 and name HB2 ) 3.04 1.24 1.24 !peak 7290 assign (resid 71 and name HG* ) (resid 94 and name HB1 ) 3.49 1.69 1.69 !peak 7294 assign (resid 71 and name HG* ) (resid 94 and name HD* ) 3.20 1.40 1.40 !peak 8170 assign (resid 72 and name HB2 ) (resid 72 and name HD2* ) 2.82 1.02 1.02 !peak 1344 assign (resid 72 and name HD2* ) (resid 93 and name HA ) 4.24 2.44 2.44 !peak 8790 assign (resid 72 and name HD2* ) (resid 93 and name HG2 ) 3.87 2.07 2.07 !peak 8086 assign (resid 72 and name HD2* ) (resid 93 and name HG1 ) 3.76 1.96 1.96 !peak 8785 assign (resid 73 and name HN ) (resid 92 and name HD* ) 3.76 1.96 1.96 !peak 7054 assign (resid 73 and name HB ) (resid 92 and name HD* ) 3.00 1.20 1.20 !peak 7249 assign (resid 73 and name HG1* ) (resid 75 and name HG* ) 3.42 1.62 1.62 !peak 9278 assign (resid 73 and name HG1* ) (resid 92 and name HD* ) 2.60 0.80 0.80 !peak 9149 assign (resid 74 and name HA ) (resid 75 and name HG* ) 3.46 1.66 1.66 !peak 8808 assign (resid 75 and name HN ) (resid 75 and name HG* ) 2.67 0.87 0.87 !peak 1015 assign (resid 75 and name HN ) (resid 92 and name HD* ) 3.18 1.38 1.38 !peak 7680 assign (resid 75 and name HB ) (resid 77 and name HD* ) 3.86 2.06 2.06 !peak 7683 assign (resid 75 and name HB ) (resid 92 and name HD* ) 3.15 1.35 1.35 !peak 9158 assign (resid 75 and name HG* ) (resid 76 and name HN ) 2.80 1.00 1.00 !peak 415 assign (resid 75 and name HG* ) (resid 76 and name HA ) 3.62 1.82 1.82 !peak 8202 assign (resid 75 and name HG* ) (resid 76 and name HB2 ) 4.30 2.50 2.50 !peak 8224 assign (resid 75 and name HG* ) (resid 77 and name HN ) 3.55 1.75 1.75 !peak 8273 assign (resid 75 and name HG* ) (resid 77 and name HB2 ) 3.80 2.00 2.00 !peak 8276 assign (resid 75 and name HG* ) (resid 77 and name HB1 ) 3.77 1.97 1.97 !peak 8275 assign (resid 75 and name HG* ) (resid 77 and name HG ) 3.17 1.37 1.37 !peak 7696 assign (resid 75 and name HG* ) (resid 77 and name HD* ) 2.71 0.91 0.91 !peak 8213 assign (resid 75 and name HG* ) (resid 89 and name HG2* ) 3.71 1.91 1.91 !peak 8215 assign (resid 75 and name HG* ) (resid 90 and name HN ) 3.38 1.58 1.58 !peak 7216 assign (resid 75 and name HG* ) (resid 90 and name HA ) 3.89 2.09 2.09 !peak 8203 assign (resid 75 and name HG* ) (resid 90 and name HB2 ) 3.15 1.35 1.35 !peak 8810 assign (resid 75 and name HG* ) (resid 90 and name HD* ) 2.97 1.17 1.17 !peak 5588 assign (resid 75 and name HG* ) (resid 90 and name HE* ) 4.30 2.50 2.50 !peak 8897 assign (resid 75 and name HG* ) (resid 91 and name HB2 ) 4.30 2.50 2.50 !peak 8224 assign (resid 75 and name HG* ) (resid 91 and name HG1 ) 4.30 2.50 2.50 !peak 9218 assign (resid 75 and name HG* ) (resid 92 and name HN ) 3.81 2.01 2.01 !peak 7226 assign (resid 75 and name HG* ) (resid 92 and name HA ) 4.30 2.50 2.50 !peak 9226 assign (resid 75 and name HG* ) (resid 92 and name HG ) 3.30 1.50 1.50 !peak 8349 assign (resid 75 and name HG* ) (resid 92 and name HD* ) 2.51 0.71 0.71 !peak 8216 assign (resid 76 and name HN ) (resid 76 and name HG* ) 3.33 1.53 1.53 !peak 4063 assign (resid 76 and name HN ) (resid 77 and name HD* ) 4.06 2.26 2.26 !peak 8813 assign (resid 76 and name HA ) (resid 77 and name HD* ) 3.58 1.78 1.78 !peak 7084 assign (resid 76 and name HG* ) (resid 77 and name HN ) 3.12 1.32 1.32 !peak 421 assign (resid 76 and name HG* ) (resid 77 and name HB2 ) 4.24 2.44 2.44 !peak 7095 assign (resid 76 and name HG* ) (resid 77 and name HD* ) 4.13 2.33 2.33 !peak 8265 assign (resid 76 and name HG* ) (resid 87 and name HD2* ) 3.07 1.27 1.27 !peak 7176 assign (resid 76 and name HG* ) (resid 88 and name HN ) 3.56 1.76 1.76 !peak 7183 assign (resid 76 and name HG* ) (resid 89 and name HA ) 3.85 2.05 2.05 !peak 8241 assign (resid 76 and name HG* ) (resid 89 and name HG2* ) 3.25 1.45 1.45 !peak 8235 assign (resid 77 and name HA ) (resid 77 and name HD* ) 2.89 1.09 1.09 !peak 4111 assign (resid 77 and name HB2 ) (resid 79 and name HG* ) 3.71 1.91 1.91 !peak 7096 assign (resid 77 and name HB1 ) (resid 79 and name HG* ) 3.48 1.68 1.68 !peak 7093 assign (resid 77 and name HD* ) (resid 78 and name HN ) 3.43 1.63 1.63 !peak 429 assign (resid 77 and name HD* ) (resid 79 and name HG* ) 3.67 1.87 1.87 !peak 9215 assign (resid 77 and name HD* ) (resid 88 and name HN ) 4.01 2.21 2.20 !peak 8876 assign (resid 77 and name HD* ) (resid 88 and name HB ) 3.66 1.86 1.86 !peak 8877 assign (resid 77 and name HD* ) (resid 88 and name HG2* ) 3.19 1.39 1.39 !peak 8268 assign (resid 77 and name HD* ) (resid 89 and name HG2* ) 3.68 1.88 1.88 !peak 7107 assign (resid 77 and name HD* ) (resid 90 and name HB2 ) 3.59 1.79 1.79 !peak 7101 assign (resid 77 and name HD* ) (resid 90 and name HD* ) 2.69 0.89 0.89 !peak 5489 assign (resid 77 and name HD* ) (resid 90 and name HE* ) 2.56 0.76 0.76 !peak 5481 assign (resid 77 and name HD* ) (resid 108 and name HG* ) 4.19 2.39 2.39 !peak 7100 assign (resid 78 and name HN ) (resid 78 and name HB* ) 2.73 0.93 0.93 !peak 1031 assign (resid 78 and name HN ) (resid 78 and name HG* ) 3.19 1.39 1.39 !peak 1033 assign (resid 78 and name HA ) (resid 78 and name HG* ) 2.90 1.10 1.10 !peak 4142 assign (resid 78 and name HA ) (resid 87 and name HD2* ) 3.36 1.56 1.56 !peak 7731 assign (resid 78 and name HB* ) (resid 79 and name HN ) 3.13 1.33 1.33 !peak 433 assign (resid 78 and name HB* ) (resid 85 and name HB ) 4.10 2.30 2.30 !peak 8861 assign (resid 78 and name HB* ) (resid 85 and name HG2* ) 2.68 0.88 0.88 !peak 8858 assign (resid 78 and name HB* ) (resid 87 and name HA ) 3.71 1.91 1.91 !peak 7727 assign (resid 78 and name HB* ) (resid 87 and name HD2* ) 3.13 1.33 1.33 !peak 7181 assign (resid 78 and name HG* ) (resid 79 and name HN ) 3.32 1.52 1.51 !peak 434 assign (resid 78 and name HG* ) (resid 85 and name HA ) 3.69 1.89 1.89 !peak 8841 assign (resid 78 and name HG* ) (resid 85 and name HB ) 3.71 1.91 1.91 !peak 8859 assign (resid 78 and name HG* ) (resid 85 and name HG2* ) 2.65 0.85 0.85 !peak 8857 assign (resid 78 and name HG* ) (resid 86 and name HN ) 3.42 1.62 1.62 !peak 8842 assign (resid 78 and name HG* ) (resid 87 and name HD2* ) 3.09 1.29 1.28 !peak 9075 assign (resid 78 and name HG* ) (resid 88 and name HN ) 3.95 2.15 2.15 !peak 7183 assign (resid 79 and name HN ) (resid 79 and name HG* ) 3.09 1.29 1.29 !peak 1040 assign (resid 79 and name HA ) (resid 79 and name HG* ) 2.90 1.10 1.10 !peak 4166 assign (resid 79 and name HG* ) (resid 80 and name HN ) 3.34 1.54 1.54 !peak 441 assign (resid 79 and name HG* ) (resid 88 and name HN ) 4.24 2.44 2.44 !peak 7182 assign (resid 79 and name HG* ) (resid 88 and name HG2* ) 3.67 1.87 1.87 !peak 9216 assign (resid 80 and name HG2* ) (resid 83 and name HA* ) 3.16 1.36 1.36 !peak 9282 assign (resid 83 and name HA* ) (resid 84 and name HA ) 4.00 2.20 2.20 !peak 8853 assign (resid 85 and name HG2* ) (resid 87 and name HD2* ) 3.76 1.96 1.96 !peak 9070 assign (resid 87 and name HA ) (resid 87 and name HD2* ) 3.29 1.49 1.49 !peak 1360 assign (resid 87 and name HB1 ) (resid 87 and name HD2* ) 2.96 1.16 1.16 !peak 1361 assign (resid 88 and name HB ) (resid 108 and name HE* ) 3.57 1.77 1.77 !peak 7476 assign (resid 88 and name HG2* ) (resid 108 and name HG* ) 2.95 1.15 1.15 !peak 9222 assign (resid 89 and name HN ) (resid 108 and name HG* ) 3.50 1.70 1.70 !peak 8880 assign (resid 89 and name HN ) (resid 109 and name HB* ) 3.72 1.92 1.92 !peak 8885 assign (resid 89 and name HB ) (resid 109 and name HB* ) 3.11 1.31 1.31 !peak 7142 assign (resid 89 and name HB ) (resid 109 and name HD2* ) 3.42 1.62 1.62 !peak 8554 assign (resid 89 and name HG2* ) (resid 109 and name HB* ) 3.29 1.49 1.49 !peak 7474 assign (resid 89 and name HG2* ) (resid 109 and name HD2* ) 3.20 1.40 1.40 !peak 7473 assign (resid 90 and name HA ) (resid 108 and name HG* ) 3.60 1.80 1.80 !peak 9022 assign (resid 90 and name HB2 ) (resid 92 and name HD* ) 3.13 1.33 1.33 !peak 7242 assign (resid 90 and name HB1 ) (resid 92 and name HD* ) 3.16 1.36 1.36 !peak 7242 assign (resid 90 and name HB1 ) (resid 106 and name HG* ) 3.10 1.30 1.30 !peak 7801 assign (resid 90 and name HD* ) (resid 106 and name HG* ) 3.13 1.33 1.33 !peak 5487 assign (resid 90 and name HD* ) (resid 108 and name HG* ) 3.03 1.23 1.23 !peak 5484 assign (resid 90 and name HE* ) (resid 106 and name HG* ) 3.26 1.46 1.46 !peak 7458 assign (resid 90 and name HE* ) (resid 108 and name HG* ) 3.38 1.58 1.58 !peak 7465 assign (resid 91 and name HN ) (resid 92 and name HD* ) 3.46 1.66 1.66 !peak 7269 assign (resid 91 and name HN ) (resid 109 and name HD2* ) 3.85 2.05 2.05 !peak 9042 assign (resid 91 and name HA ) (resid 92 and name HD* ) 3.19 1.39 1.39 !peak 9232 assign (resid 91 and name HB2 ) (resid 109 and name HD2* ) 3.54 1.74 1.74 !peak 7472 assign (resid 91 and name HB1 ) (resid 109 and name HD2* ) 3.58 1.78 1.78 !peak 8556 assign (resid 91 and name HG2 ) (resid 109 and name HD2* ) 3.50 1.70 1.70 !peak 7471 assign (resid 91 and name HG1 ) (resid 109 and name HD2* ) 3.14 1.34 1.34 !peak 8558 assign (resid 92 and name HN ) (resid 92 and name HD* ) 2.77 0.97 0.97 !peak 4371 assign (resid 92 and name HA ) (resid 92 and name HD* ) 2.87 1.07 1.07 !peak 4372 assign (resid 92 and name HA ) (resid 106 and name HG* ) 3.13 1.33 1.33 !peak 7456 assign (resid 92 and name HB2 ) (resid 92 and name HD* ) 2.46 0.66 0.66 !peak 4374 assign (resid 92 and name HB2 ) (resid 104 and name HG* ) 3.56 1.76 1.76 !peak 7254 assign (resid 92 and name HB1 ) (resid 92 and name HD* ) 2.69 0.89 0.89 !peak 4382 assign (resid 92 and name HB1 ) (resid 104 and name HG* ) 4.21 2.41 2.41 !peak 7255 assign (resid 92 and name HB1 ) (resid 106 and name HG* ) 3.29 1.49 1.49 !peak 7452 assign (resid 92 and name HG ) (resid 104 and name HG* ) 3.86 2.06 2.06 !peak 7253 assign (resid 92 and name HG ) (resid 106 and name HG* ) 2.77 0.97 0.97 !peak 7453 assign (resid 92 and name HD* ) (resid 93 and name HN ) 3.48 1.68 1.68 !peak 492 assign (resid 92 and name HD* ) (resid 94 and name HE* ) 2.73 0.93 0.93 !peak 5521 assign (resid 92 and name HD* ) (resid 94 and name HZ ) 2.63 0.83 0.83 !peak 5513 assign (resid 92 and name HD* ) (resid 104 and name HG* ) 2.87 1.07 1.07 !peak 7257 assign (resid 92 and name HD* ) (resid 107 and name HN ) 4.30 2.50 2.50 !peak 8908 assign (resid 93 and name HN ) (resid 93 and name HD* ) 3.72 1.92 1.92 !peak 4433 assign (resid 93 and name HN ) (resid 104 and name HG* ) 3.15 1.35 1.35 !peak 7258 assign (resid 93 and name HA ) (resid 93 and name HD* ) 3.48 1.68 1.68 !peak 4434 assign (resid 93 and name HB2 ) (resid 93 and name HD* ) 2.71 0.91 0.91 !peak 4435 assign (resid 93 and name HB1 ) (resid 93 and name HD* ) 2.68 0.88 0.88 !peak 4436 assign (resid 93 and name HD* ) (resid 105 and name HB ) 3.43 1.63 1.63 !peak 7306 assign (resid 94 and name HN ) (resid 104 and name HG* ) 3.64 1.84 1.84 !peak 7303 assign (resid 94 and name HA ) (resid 101 and name HG1* ) 4.24 2.44 2.44 !peak 8936 assign (resid 94 and name HA ) (resid 104 and name HG* ) 3.26 1.46 1.46 !peak 7299 assign (resid 94 and name HB2 ) (resid 96 and name HG* ) 4.04 2.24 2.24 !peak 9241 assign (resid 94 and name HB2 ) (resid 104 and name HG* ) 4.24 2.44 2.44 !peak 7300 assign (resid 94 and name HB1 ) (resid 101 and name HG1* ) 3.24 1.44 1.44 !peak 7294 assign (resid 94 and name HD* ) (resid 101 and name HG1* ) 3.91 2.11 2.11 !peak 8989 assign (resid 94 and name HD* ) (resid 104 and name HG* ) 2.57 0.77 0.77 !peak 5533 assign (resid 94 and name HE* ) (resid 104 and name HG* ) 2.71 0.91 0.91 !peak 5523 assign (resid 94 and name HZ ) (resid 104 and name HG* ) 2.90 1.10 1.10 !peak 5515 assign (resid 95 and name HN ) (resid 95 and name HG* ) 3.47 1.67 1.67 !peak 1114 assign (resid 95 and name HN ) (resid 96 and name HG* ) 3.88 2.08 2.08 !peak 7327 assign (resid 95 and name HN ) (resid 103 and name HG* ) 4.13 2.33 2.33 !peak 5382 assign (resid 95 and name HN ) (resid 104 and name HG* ) 3.95 2.15 2.15 !peak 4739 assign (resid 95 and name HA ) (resid 95 and name HG* ) 3.03 1.23 1.23 !peak 4508 assign (resid 95 and name HA ) (resid 96 and name HG* ) 3.56 1.76 1.76 !peak 9239 assign (resid 95 and name HB2 ) (resid 103 and name HB* ) 3.05 1.25 1.25 !peak 8944 assign (resid 95 and name HB2 ) (resid 103 and name HG* ) 3.73 1.93 1.93 !peak 8945 assign (resid 95 and name HB2 ) (resid 103 and name HD* ) 3.40 1.60 1.60 !peak 8728 assign (resid 95 and name HB1 ) (resid 96 and name HG* ) 3.85 2.05 2.05 !peak 8958 assign (resid 95 and name HB1 ) (resid 103 and name HB* ) 2.92 1.12 1.12 !peak 8946 assign (resid 95 and name HB1 ) (resid 103 and name HG* ) 3.64 1.84 1.84 !peak 8947 assign (resid 95 and name HB1 ) (resid 103 and name HD* ) 4.02 2.22 2.22 !peak 8951 assign (resid 95 and name HG* ) (resid 96 and name HN ) 3.28 1.48 1.48 !peak 513 assign (resid 96 and name HA ) (resid 96 and name HG* ) 2.62 0.83 0.83 !peak 4516 assign (resid 96 and name HA ) (resid 101 and name HG1* ) 3.77 1.97 1.97 !peak 8986 assign (resid 96 and name HG* ) (resid 97 and name HN ) 2.98 1.18 1.18 !peak 517 assign (resid 96 and name HG* ) (resid 97 and name HB2 ) 3.92 2.12 2.12 !peak 8966 assign (resid 96 and name HG* ) (resid 97 and name HB1 ) 4.25 2.45 2.45 !peak 7338 assign (resid 96 and name HG* ) (resid 98 and name HN ) 3.36 1.56 1.56 !peak 7361 assign (resid 96 and name HG* ) (resid 98 and name HA2 ) 4.16 2.36 2.36 !peak 7362 assign (resid 96 and name HG* ) (resid 98 and name HA1 ) 4.30 2.50 2.50 !peak 7363 assign (resid 96 and name HG* ) (resid 101 and name HA ) 3.31 1.51 1.51 !peak 8353 assign (resid 96 and name HG* ) (resid 101 and name HG1* ) 3.27 1.47 1.47 !peak 9166 assign (resid 97 and name HN ) (resid 101 and name HG1* ) 3.80 2.00 2.00 !peak 7333 assign (resid 97 and name HB2 ) (resid 102 and name HG* ) 3.10 1.30 1.30 !peak 7354 assign (resid 97 and name HB2 ) (resid 102 and name HD* ) 3.50 1.70 1.70 !peak 7403 assign (resid 97 and name HB1 ) (resid 102 and name HG* ) 3.07 1.27 1.27 !peak 7398 assign (resid 98 and name HA2 ) (resid 99 and name HB* ) 3.80 2.00 2.00 !peak 7358 assign (resid 98 and name HA1 ) (resid 99 and name HB* ) 3.55 1.75 1.75 !peak 8399 assign (resid 99 and name HB* ) (resid 100 and name HN ) 3.21 1.41 1.41 !peak 529 assign (resid 100 and name HG2* ) (resid 102 and name HG* ) 2.70 0.90 0.90 !peak 9019 assign (resid 101 and name HN ) (resid 101 and name HG1* ) 2.82 1.02 1.02 !peak 1139 assign (resid 101 and name HN ) (resid 102 and name HD* ) 4.06 2.26 2.26 !peak 4665 assign (resid 101 and name HA ) (resid 101 and name HG1* ) 2.84 1.04 1.04 !peak 4580 assign (resid 101 and name HG2* ) (resid 101 and name HG1* ) 2.80 1.00 1.00 !peak 4606 assign (resid 101 and name HG2* ) (resid 102 and name HG* ) 3.44 1.64 1.64 !peak 7426 assign (resid 101 and name HG1* ) (resid 102 and name HN ) 3.72 1.92 1.92 !peak 539 assign (resid 102 and name HN ) (resid 102 and name HG* ) 3.03 1.23 1.23 !peak 1146 assign (resid 102 and name HN ) (resid 102 and name HD* ) 3.71 1.91 1.91 !peak 4657 assign (resid 102 and name HA ) (resid 102 and name HG* ) 2.86 1.06 1.06 !peak 4621 assign (resid 102 and name HA ) (resid 104 and name HG* ) 4.30 2.50 2.50 !peak 7428 assign (resid 102 and name HB2 ) (resid 102 and name HD* ) 3.02 1.22 1.22 !peak 4660 assign (resid 102 and name HG* ) (resid 103 and name HN ) 3.58 1.78 1.78 !peak 5375 assign (resid 103 and name HN ) (resid 103 and name HB* ) 2.79 0.99 0.99 !peak 1153 assign (resid 103 and name HN ) (resid 103 and name HG* ) 3.48 1.68 1.68 !peak 1155 assign (resid 103 and name HN ) (resid 103 and name HD* ) 3.80 2.00 2.00 !peak 4713 assign (resid 103 and name HN ) (resid 104 and name HG* ) 4.30 2.50 2.50 !peak 7421 assign (resid 103 and name HA ) (resid 103 and name HD* ) 3.35 1.55 1.55 !peak 4714 assign (resid 103 and name HA ) (resid 104 and name HG* ) 3.46 1.66 1.66 !peak 8730 assign (resid 103 and name HB* ) (resid 103 and name HD* ) 2.61 0.81 0.81 !peak 4715 assign (resid 103 and name HG* ) (resid 104 and name HN ) 3.32 1.52 1.52 !peak 5383 assign (resid 104 and name HN ) (resid 104 and name HG* ) 2.73 0.93 0.93 !peak 1162 assign (resid 104 and name HG* ) (resid 105 and name HN ) 2.79 0.99 0.99 !peak 560 assign (resid 104 and name HG* ) (resid 105 and name HA ) 3.65 1.85 1.85 !peak 7442 assign (resid 104 and name HG* ) (resid 105 and name HG2* ) 3.88 2.08 2.08 !peak 7790 assign (resid 104 and name HG* ) (resid 106 and name HN ) 3.74 1.94 1.94 !peak 7461 assign (resid 104 and name HG* ) (resid 106 and name HB ) 3.87 2.07 2.07 !peak 7639 assign (resid 104 and name HG* ) (resid 106 and name HG* ) 2.64 0.84 0.84 !peak 7794 assign (resid 105 and name HN ) (resid 106 and name HG* ) 3.72 1.92 1.92 !peak 601 assign (resid 106 and name HN ) (resid 106 and name HG* ) 2.81 1.01 1.01 !peak 1171 assign (resid 106 and name HG* ) (resid 107 and name HN ) 2.83 1.03 1.03 !peak 5395 assign (resid 106 and name HG* ) (resid 107 and name HB ) 4.08 2.28 2.28 !peak 7729 assign (resid 107 and name HG2* ) (resid 109 and name HD2* ) 3.29 1.49 1.49 !peak 9038 assign (resid 108 and name HN ) (resid 108 and name HG* ) 3.32 1.52 1.51 !peak 1181 assign (resid 108 and name HA ) (resid 108 and name HG* ) 2.92 1.12 1.12 !peak 4798 assign (resid 108 and name HB2 ) (resid 108 and name HE* ) 3.33 1.53 1.53 !peak 1500 assign (resid 108 and name HB1 ) (resid 108 and name HE* ) 3.27 1.47 1.47 !peak 1499 assign (resid 108 and name HG* ) (resid 108 and name HE* ) 2.68 0.88 0.88 !peak 1501 assign (resid 108 and name HG* ) (resid 109 and name HB* ) 4.13 2.33 2.33 !peak 8559 assign (resid 109 and name HN ) (resid 109 and name HB* ) 2.80 1.00 1.00 !peak 1187 assign (resid 109 and name HN ) (resid 109 and name HD2* ) 3.68 1.88 1.88 !peak 1365 assign (resid 109 and name HA ) (resid 109 and name HD2* ) 3.34 1.54 1.54 !peak 1372 assign (resid 109 and name HB* ) (resid 109 and name HD2* ) 2.65 0.85 0.85 !peak 1368 assign (resid 112 and name HN ) (resid 112 and name HB* ) 3.03 1.23 1.23 !peak 1194 assign (resid 112 and name HA ) (resid 113 and name HB* ) 3.54 1.74 1.74 !peak 7487 assign (resid 112 and name HB* ) (resid 113 and name HN ) 3.34 1.54 1.54 !peak 594 assign (resid 112 and name HB* ) (resid 113 and name HB* ) 3.88 2.08 2.08 !peak 9051 assign (resid 112 and name HB* ) (resid 113 and name HD* ) 3.49 1.69 1.69 !peak 9054 assign (resid 112 and name HB* ) (resid 114 and name HN ) 3.90 2.10 2.10 !peak 9047 assign (resid 113 and name HN ) (resid 113 and name HB* ) 2.64 0.84 0.84 !peak 1199 assign (resid 113 and name HB* ) (resid 113 and name HG ) 2.35 0.55 0.55 !peak 4890 assign (resid 113 and name HB* ) (resid 113 and name HD* ) 2.41 0.61 0.61 !peak 4904 assign (resid 113 and name HB* ) (resid 114 and name HN ) 3.15 1.35 1.35 !peak 597 assign (resid 113 and name HD* ) (resid 114 and name HN ) 3.42 1.62 1.62 !peak 600 assign (resid 114 and name HN ) (resid 114 and name HB* ) 2.71 0.91 0.91 !peak 1205 assign (resid 114 and name HN ) (resid 114 and name HG* ) 3.04 1.24 1.24 !peak 1206 assign (resid 114 and name HA ) (resid 114 and name HG* ) 2.98 1.18 1.18 !peak 4914
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