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 |
|
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642077 |
6ppt   |
30627 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
# Restraints file 3: test_noe.tbl assign (resid 96 and name HG2* ) (resid 144 and name HG1 ) 3.88 2.08 2.08 !peak 2 #SUP 0.98 #QF 0.98 assign (resid 96 and name HG2* ) (resid 98 and name HB* ) 4.04 2.24 2.24 !peak 3 #SUP 0.84 #QF 0.72 assign (resid 97 and name HG12 ) (resid 138 and name HG1* ) 4.30 2.50 2.50 !peak 10 #SUP 1.00 #QF 0.69 assign (resid 97 and name HG11 ) (resid 138 and name HG1* ) 4.30 2.50 2.50 !peak 10 #SUP 1.00 #QF 0.69 assign (resid 99 and name HD1* ) (resid 121 and name HB* ) 3.06 1.26 1.26 !peak 16 #SUP 1.00 #QF 0.75 assign (resid 99 and name HB1 ) (resid 99 and name HD1* ) 2.99 1.19 1.19 !peak 17 #SUP 1.00 #QF 0.95 assign (resid 99 and name HD1* ) (resid 123 and name HG ) 3.16 1.36 1.36 !peak 21 #SUP 0.96 #QF 0.96 assign (resid 99 and name HD1* ) (resid 123 and name HD2* ) 3.19 1.39 1.39 !peak 22 #SUP 0.94 #QF 0.94 assign (resid 101 and name HG ) (resid 121 and name HB* ) 3.33 1.53 1.53 !peak 25 #SUP 1.00 assign (resid 97 and name HD1* ) (resid 99 and name HD1* ) 3.29 1.49 1.49 !peak 33 #SUP 0.98 #QF 0.98 assign (resid 97 and name HG2* ) (resid 97 and name HD1* ) 2.81 1.01 1.01 !peak 36 #SUP 0.99 #QF 0.99 assign (resid 97 and name HD1* ) (resid 136 and name HB1 ) 3.69 1.89 1.89 !peak 38 #SUP 0.97 #QF 0.60 assign (resid 97 and name HD1* ) (resid 138 and name HB ) 3.47 1.67 1.67 !peak 38 #SUP 0.97 #QF 0.60 assign (resid 125 and name HD2* ) (resid 149 and name HD1* ) 2.89 1.09 1.09 !peak 39 #SUP 1.00 #QF 0.98 assign (resid 123 and name HD2* ) (resid 149 and name HD1* ) 3.34 1.54 1.54 !peak 40 #SUP 0.96 #QF 0.96 assign (resid 125 and name HG ) (resid 149 and name HD1* ) 3.33 1.53 1.53 !peak 41 #SUP 0.98 #QF 0.97 assign (resid 149 and name HG12 ) (resid 159 and name HD1* ) 3.96 2.16 2.16 !peak 48 #SUP 1.00 #QF 0.98 assign (resid 153 and name HG2* ) (resid 159 and name HD1* ) 3.10 1.30 1.30 !peak 51 #SUP 0.85 #QF 0.85 assign (resid 149 and name HG2* ) (resid 159 and name HD1* ) 3.06 1.26 1.26 !peak 54 #SUP 0.89 #QF 0.89 assign (resid 159 and name HG2* ) (resid 159 and name HD1* ) 2.84 1.04 1.04 !peak 56 #SUP 0.88 #QF 0.88 assign (resid 159 and name HG2* ) (resid 176 and name HD1* ) 3.12 1.32 1.32 !peak 58 #SUP 1.00 assign (resid 159 and name HG2* ) (resid 161 and name HG1* ) 3.02 1.22 1.22 !peak 60 #SUP 0.90 #QF 0.90 assign (resid 97 and name HG2* ) (resid 123 and name HD1* ) 3.39 1.59 1.59 !peak 65 #SUP 0.97 #QF 0.97 assign (resid 149 and name HG2* ) (resid 153 and name HG1* ) 3.03 1.23 1.23 !peak 73 #SUP 0.95 #QF 0.95 assign (resid 161 and name HG1* ) (resid 176 and name HD1* ) 3.03 1.23 1.23 !peak 93 #SUP 0.98 #QF 0.98 assign (resid 161 and name HG1* ) (resid 174 and name HD2* ) 3.11 1.31 1.31 !peak 94 #SUP 0.97 #QF 0.97 assign (resid 97 and name HG11 ) (resid 138 and name HG2* ) 4.30 2.50 2.50 !peak 133 #SUP 0.95 #QF 0.77 assign (resid 130 and name HB* ) (resid 153 and name HG2* ) 3.36 1.56 1.56 !peak 156 #SUP 0.92 #QF 0.92 assign (resid 149 and name HG2* ) (resid 153 and name HG2* ) 3.05 1.25 1.25 !peak 157 #SUP 0.99 #QF 0.99 assign (resid 137 and name HG1* ) (resid 144 and name HB2 ) 3.61 1.81 1.81 !peak 167 #SUP 0.95 #QF 0.86 assign (resid 137 and name HG1* ) (resid 144 and name HB1 ) 3.61 1.81 1.81 !peak 167 #SUP 0.95 #QF 0.86 assign (resid 125 and name HD2* ) (resid 178 and name HG1* ) 2.99 1.19 1.19 !peak 168 #SUP 0.92 #QF 0.92 assign (resid 178 and name HG1* ) (resid 180 and name HD1* ) 3.30 1.50 1.50 !peak 170 #SUP 0.93 #QF 0.93 assign (resid 153 and name HG2* ) (resid 178 and name HG1* ) 2.22 0.42 0.42 !peak 173 #SUP 0.99 #QF 0.99 assign (resid 153 and name HG1* ) (resid 178 and name HG1* ) 3.20 1.40 1.40 !peak 174 #SUP 1.00 assign (resid 130 and name HB* ) (resid 178 and name HG1* ) 3.90 2.10 2.10 !peak 175 #SUP 0.99 #QF 0.99 assign (resid 99 and name HD2* ) (resid 176 and name HD2* ) 2.90 1.10 1.10 !peak 184 #SUP 0.99 #QF 0.80 assign (resid 174 and name HD2* ) (resid 176 and name HD2* ) 3.03 1.23 1.23 !peak 184 #SUP 0.99 #QF 0.80 assign (resid 174 and name HD1* ) (resid 176 and name HD2* ) 2.95 1.15 1.15 !peak 187 #SUP 0.89 #QF 0.89 assign (resid 100 and name HB* ) (resid 102 and name HD1* ) 2.98 1.18 1.18 !peak 207 #SUP 0.55 #QF 0.55 assign (resid 123 and name HD2* ) (resid 176 and name HD1* ) 2.73 0.93 0.93 !peak 212 #SUP 0.45 #QF 0.45 assign (resid 123 and name HD2* ) (resid 125 and name HD2* ) 3.85 2.05 2.05 !peak 217 #SUP 0.80 #QF 0.80 assign (resid 125 and name HD2* ) (resid 153 and name HG2* ) 2.93 1.13 1.13 !peak 222 #SUP 0.97 #QF 0.92 assign (resid 125 and name HD2* ) (resid 130 and name HB* ) 2.99 1.19 1.19 !peak 224 #SUP 0.98 #QF 0.98 assign (resid 123 and name HD2* ) (resid 178 and name HG2* ) 3.14 1.34 1.34 !peak 229 #SUP 0.59 #QF 0.59 assign (resid 123 and name HD2* ) (resid 159 and name HD1* ) 3.26 1.46 1.46 !peak 230 #SUP 0.70 #QF 0.70 assign (resid 99 and name HD2* ) (resid 101 and name HG ) 2.85 1.05 1.05 !peak 232 #SUP 0.41 #QF 0.41 assign (resid 123 and name HG ) (resid 178 and name HG2* ) 3.21 1.41 1.41 !peak 249 #SUP 0.75 #QF 0.75 assign (resid 153 and name HG1* ) (resid 178 and name HG2* ) 2.99 1.19 1.19 !peak 251 #SUP 0.94 #QF 0.94 assign (resid 159 and name HD1* ) (resid 178 and name HG2* ) 3.22 1.42 1.42 !peak 252 #SUP 0.93 #QF 0.93 assign (resid 161 and name HG2* ) (resid 174 and name HD2* ) 3.24 1.44 1.44 !peak 257 #SUP 0.94 #QF 0.94 assign (resid 161 and name HG2* ) (resid 176 and name HG ) 3.77 1.97 1.97 !peak 258 #SUP 0.98 #QF 0.77 assign (resid 161 and name HG2* ) (resid 176 and name HD2* ) 3.93 2.13 2.12 !peak 258 #SUP 0.98 #QF 0.77 assign (resid 101 and name HD2* ) (resid 121 and name HB* ) 2.55 0.75 0.75 !peak 280 #SUP 1.00 assign (resid 125 and name HD1* ) (resid 149 and name HD1* ) 3.07 1.27 1.27 !peak 294 #SUP 0.96 #QF 0.96 assign (resid 125 and name HD1* ) (resid 129 and name HB1 ) 3.31 1.51 1.51 !peak 295 #SUP 1.00 #QF 0.97 assign (resid 137 and name HG2* ) (resid 144 and name HG2 ) 3.42 1.62 1.62 !peak 321 #SUP 1.00 #QF 0.99 assign (resid 96 and name HG2* ) (resid 137 and name HG1* ) 2.47 0.67 0.67 !peak 367 #SUP 0.85 #QF 0.85 assign (resid 101 and name HD1* ) (resid 141 and name HB* ) 3.11 1.31 1.31 !peak 372 #SUP 0.90 #QF 0.90 assign (resid 99 and name HD1* ) (resid 123 and name HD1* ) 3.10 1.30 1.30 !peak 381 #SUP 0.79 #QF 0.79 assign (resid 97 and name HD1* ) (resid 123 and name HD1* ) 3.23 1.43 1.43 !peak 384 #SUP 0.96 #QF 0.96 assign (resid 101 and name HD2* ) (resid 141 and name HB* ) 3.34 1.54 1.54 !peak 391 #SUP 0.85 #QF 0.85 assign (resid 153 and name HG1* ) (resid 180 and name HD1* ) 2.87 1.07 1.07 !peak 397 #SUP 0.80 #QF 0.80 assign (resid 123 and name HG ) (resid 125 and name HD1* ) 3.77 1.97 1.97 !peak 400 #SUP 0.46 #QF 0.46 assign (resid 99 and name HD2* ) (resid 174 and name HD2* ) 2.22 0.42 0.42 !peak 401 #SUP 0.72 #QF 0.72 assign (resid 101 and name HD2* ) (resid 174 and name HD2* ) 3.23 1.43 1.43 !peak 403 #SUP 0.87 #QF 0.49 assign (resid 101 and name HB1 ) (resid 101 and name HD1* ) 3.02 1.22 1.22 !peak 422 #SUP 1.00 assign (resid 101 and name HB2 ) (resid 101 and name HD1* ) 3.17 1.37 1.37 !peak 422 #SUP 1.00 assign (resid 123 and name HD2* ) (resid 149 and name HG2* ) 3.47 1.67 1.67 !peak 425 #SUP 0.94 #QF 0.94 assign (resid 153 and name HG1* ) (resid 159 and name HD1* ) 3.62 1.82 1.82 !peak 427 #SUP 0.97 #QF 0.97 assign (resid 126 and name HG2* ) (resid 180 and name HD2* ) 3.80 2.00 2.00 !peak 433 #SUP 0.77 #QF 0.42 assign (resid 178 and name HG2* ) (resid 180 and name HD2* ) 3.91 2.11 2.11 !peak 433 #SUP 0.77 #QF 0.42 assign (resid 125 and name HD1* ) (resid 159 and name HD1* ) 3.64 1.84 1.84 !peak 442 #SUP 0.75 #QF 0.75 assign (resid 159 and name HG2* ) (resid 161 and name HB ) 3.58 1.78 1.78 !peak 455 #SUP 0.96 #QF 0.89 assign (resid 125 and name HD1* ) (resid 149 and name HG2* ) 3.59 1.79 1.79 !peak 457 #SUP 0.93 #QF 0.93 assign (resid 100 and name HB* ) (resid 102 and name HD2* ) 3.61 1.81 1.81 !peak 458 #SUP 0.83 #QF 0.83 assign (resid 121 and name HB* ) (resid 176 and name HD1* ) 3.73 1.93 1.93 !peak 465 #SUP 0.99 #QF 0.72 assign (resid 123 and name HD1* ) (resid 176 and name HD1* ) 3.97 2.17 2.17 !peak 465 #SUP 0.99 #QF 0.72 assign (resid 125 and name HD2* ) (resid 159 and name HD1* ) 3.63 1.83 1.83 !peak 467 #SUP 0.86 #QF 0.86 assign (resid 149 and name HG2* ) (resid 178 and name HG2* ) 3.60 1.80 1.80 !peak 469 #SUP 0.90 #QF 0.90 assign (resid 161 and name HG2* ) (resid 176 and name HD1* ) 3.57 1.77 1.77 !peak 470 #SUP 0.63 #QF 0.63 assign (resid 127 and name HD2* ) (resid 130 and name HB* ) 3.63 1.83 1.83 !peak 474 #SUP 0.55 #QF 0.55 assign (resid 153 and name HG2* ) (resid 180 and name HD1* ) 3.76 1.96 1.96 !peak 486 #SUP 0.98 #QF 0.84 assign (resid 161 and name HG2* ) (resid 164 and name HE* ) 3.21 1.41 1.41 !peak 495 #SUP 0.95 #QF 0.95 assign (resid 145 and name HG1* ) (resid 164 and name HE* ) 2.93 1.13 1.13 !peak 496 #SUP 0.96 #QF 0.96 assign (resid 145 and name HG2* ) (resid 164 and name HE* ) 2.93 1.13 1.13 !peak 497 #SUP 0.96 #QF 0.96 assign (resid 164 and name HB1 ) (resid 164 and name HE* ) 3.35 1.55 1.55 !peak 500 #SUP 0.97 #QF 0.81 assign (resid 164 and name HB2 ) (resid 164 and name HE* ) 3.62 1.82 1.82 !peak 500 #SUP 0.97 #QF 0.81 assign (resid 97 and name HA ) (resid 97 and name HD1* ) 3.22 1.42 1.42 !peak 12 #SUP 1.00 assign (resid 97 and name HD1* ) (resid 124 and name HD2 ) 3.35 1.55 1.55 !peak 13 #SUP 0.74 #QF 0.74 assign (resid 97 and name HD1* ) (resid 124 and name HD1 ) 3.49 1.69 1.69 !peak 14 #SUP 0.98 #QF 0.98 assign (resid 97 and name HD1* ) (resid 136 and name HD1 ) 3.44 1.64 1.64 !peak 15 #SUP 0.65 #QF 0.65 assign (resid 97 and name HB ) (resid 97 and name HD1* ) 2.77 0.97 0.97 !peak 17 #SUP 0.90 #QF 0.90 assign (resid 149 and name HN ) (resid 149 and name HD1* ) 3.00 1.20 1.20 !peak 21 #SUP 0.99 #QF 0.99 assign (resid 149 and name HA ) (resid 149 and name HD1* ) 3.20 1.40 1.40 !peak 23 #SUP 1.00 assign (resid 149 and name HB ) (resid 149 and name HD1* ) 2.81 1.01 1.01 !peak 25 #SUP 0.99 #QF 0.99 assign (resid 159 and name HN ) (resid 159 and name HD1* ) 3.17 1.37 1.37 !peak 30 #SUP 0.97 #QF 0.97 assign (resid 149 and name HN ) (resid 159 and name HD1* ) 3.76 1.96 1.96 !peak 31 #SUP 0.68 #QF 0.59 assign (resid 159 and name HD1* ) (resid 176 and name HN ) 4.09 2.29 2.29 !peak 31 #SUP 0.68 #QF 0.59 assign (resid 157 and name HB1 ) (resid 159 and name HD1* ) 3.39 1.59 1.59 !peak 33 #SUP 0.43 #QF 0.43 assign (resid 159 and name HD1* ) (resid 178 and name HB ) 3.34 1.54 1.54 !peak 35 #SUP 0.88 #QF 0.88 assign (resid 159 and name HD1* ) (resid 176 and name HB2 ) 2.97 1.17 1.17 !peak 36 #SUP 0.89 #QF 0.89 assign (resid 159 and name HB ) (resid 159 and name HD1* ) 2.74 0.94 0.94 !peak 37 #SUP 1.00 assign (resid 159 and name HN ) (resid 159 and name HG2* ) 3.19 1.39 1.39 !peak 41 #SUP 0.99 #QF 0.99 assign (resid 159 and name HG2* ) (resid 160 and name HA ) 3.30 1.50 1.50 !peak 43 #SUP 0.98 #QF 0.98 assign (resid 159 and name HA ) (resid 159 and name HG2* ) 2.65 0.85 0.85 !peak 45 #SUP 0.99 #QF 0.99 assign (resid 159 and name HG2* ) (resid 176 and name HB2 ) 3.14 1.34 1.34 !peak 46 #SUP 0.64 #QF 0.64 assign (resid 159 and name HG2* ) (resid 159 and name HG11 ) 2.80 1.00 1.00 !peak 48 #SUP 0.98 #QF 0.98 assign (resid 159 and name HG2* ) (resid 159 and name HG12 ) 2.80 1.00 1.00 !peak 49 #SUP 0.60 #QF 0.60 assign (resid 97 and name HA ) (resid 97 and name HG2* ) 2.78 0.98 0.98 !peak 54 #SUP 0.99 #QF 0.99 assign (resid 97 and name HG2* ) (resid 97 and name HG11 ) 2.84 1.04 1.04 !peak 56 #SUP 0.74 #QF 0.74 assign (resid 97 and name HG2* ) (resid 97 and name HG12 ) 2.84 1.04 1.04 !peak 57 #SUP 0.71 #QF 0.71 assign (resid 140 and name HA ) (resid 141 and name HB* ) 3.23 1.43 1.43 !peak 62 #SUP 0.61 #QF 0.61 assign (resid 141 and name HB* ) (resid 143 and name HB2 ) 3.13 1.33 1.33 !peak 64 #SUP 0.32 #QF 0.32 assign (resid 101 and name HG ) (resid 141 and name HB* ) 3.39 1.59 1.59 !peak 65 #SUP 0.49 #QF 0.49 assign (resid 148 and name HA ) (resid 149 and name HG2* ) 3.14 1.34 1.34 !peak 75 #SUP 0.40 #QF 0.40 assign (resid 149 and name HA ) (resid 149 and name HG2* ) 2.79 0.99 0.99 !peak 76 #SUP 0.84 #QF 0.84 assign (resid 136 and name HB2 ) (resid 149 and name HG2* ) 3.62 1.82 1.82 !peak 80 #SUP 0.21 #QF 0.21 assign (resid 149 and name HG2* ) (resid 149 and name HG12 ) 2.87 1.07 1.07 !peak 81 #SUP 0.99 #QF 0.99 assign (resid 125 and name HD2* ) (resid 149 and name HG2* ) 2.74 0.94 0.94 !peak 83 #SUP 0.99 #QF 0.99 assign (resid 130 and name HB* ) (resid 153 and name HN ) 3.54 1.74 1.74 !peak 86 #SUP 0.77 #QF 0.77 assign (resid 130 and name HB* ) (resid 180 and name HB2 ) 3.60 1.80 1.80 !peak 88 #SUP 0.56 #QF 0.56 assign (resid 125 and name HG ) (resid 130 and name HB* ) 3.20 1.40 1.40 !peak 89 #SUP 0.55 #QF 0.55 assign (resid 125 and name HB1 ) (resid 130 and name HB* ) 3.07 1.27 1.27 !peak 90 #SUP 0.62 #QF 0.62 assign (resid 130 and name HB* ) (resid 180 and name HD1* ) 2.63 0.83 0.83 !peak 92 #SUP 0.91 #QF 0.57 assign (resid 97 and name HA ) (resid 98 and name HB* ) 3.13 1.33 1.33 !peak 96 #SUP 0.76 #QF 0.76 assign (resid 100 and name HB* ) (resid 122 and name HN ) 2.90 1.10 1.10 !peak 102 #SUP 0.93 #QF 0.83 assign (resid 100 and name HB* ) (resid 102 and name HG ) 2.89 1.09 1.09 !peak 107 #SUP 0.44 #QF 0.44 assign (resid 152 and name HN ) (resid 153 and name HG1* ) 3.41 1.61 1.61 !peak 111 #SUP 0.42 #QF 0.42 assign (resid 153 and name HG1* ) (resid 154 and name HN ) 3.21 1.41 1.41 !peak 114 #SUP 0.71 #QF 0.71 assign (resid 130 and name HA ) (resid 153 and name HG1* ) 2.71 0.91 0.91 !peak 118 #SUP 0.66 #QF 0.66 assign (resid 153 and name HG1* ) (resid 154 and name HG1 ) 3.56 1.76 1.76 !peak 121 #SUP 0.70 #QF 0.70 assign (resid 130 and name HB* ) (resid 153 and name HG1* ) 2.79 0.99 0.99 !peak 122 #SUP 0.95 #QF 0.95 assign (resid 125 and name HD2* ) (resid 153 and name HG1* ) 2.65 0.85 0.85 !peak 124 #SUP 0.94 #QF 0.94 assign (resid 138 and name HG1* ) (resid 145 and name HN ) 3.26 1.46 1.47 !peak 125 #SUP 0.93 #QF 0.91 assign (resid 138 and name HG1* ) (resid 139 and name HN ) 3.28 1.48 1.48 !peak 127 #SUP 0.94 #QF 0.94 assign (resid 160 and name HA ) (resid 161 and name HG1* ) 3.22 1.42 1.42 !peak 134 #SUP 0.64 #QF 0.30 assign (resid 161 and name HG1* ) (resid 174 and name HA ) 3.25 1.45 1.45 !peak 135 #SUP 0.84 #QF 0.84 assign (resid 161 and name HA ) (resid 161 and name HG1* ) 2.79 0.99 0.99 !peak 136 #SUP 0.86 #QF 0.86 assign (resid 161 and name HG1* ) (resid 162 and name HD1 ) 3.64 1.84 1.84 !peak 137 #SUP 0.98 #QF 0.98 assign (resid 161 and name HG1* ) (resid 164 and name HB2 ) 3.05 1.25 1.25 !peak 139 #SUP 0.98 #QF 0.98 assign (resid 121 and name HB* ) (resid 161 and name HG1* ) 3.68 1.88 1.88 !peak 140 #SUP 0.65 #QF 0.65 assign (resid 145 and name HN ) (resid 145 and name HG2* ) 3.05 1.25 1.24 !peak 146 #SUP 0.96 #QF 0.96 assign (resid 145 and name HA ) (resid 145 and name HG2* ) 2.67 0.87 0.87 !peak 154 #SUP 0.94 #QF 0.94 assign (resid 147 and name HG2* ) (resid 148 and name HN ) 3.37 1.57 1.57 !peak 166 #SUP 0.81 #QF 0.81 assign (resid 138 and name HG2* ) (resid 145 and name HN ) 3.26 1.46 1.47 !peak 191 #SUP 0.72 #QF 0.72 assign (resid 145 and name HN ) (resid 145 and name HG1* ) 3.05 1.25 1.24 !peak 192 #SUP 0.99 #QF 0.99 assign (resid 138 and name HN ) (resid 138 and name HG2* ) 3.08 1.28 1.28 !peak 194 #SUP 0.57 #QF 0.57 assign (resid 137 and name HG2* ) (resid 138 and name HN ) 2.98 1.18 1.18 !peak 216 #SUP 0.96 #QF 0.96 assign (resid 137 and name HG2* ) (resid 146 and name HA ) 2.89 1.09 1.09 !peak 218 #SUP 0.29 #QF 0.29 assign (resid 137 and name HA ) (resid 137 and name HG2* ) 2.69 0.89 0.89 !peak 219 #SUP 0.83 #QF 0.83 assign (resid 137 and name HG2* ) (resid 144 and name HG1 ) 3.08 1.28 1.28 !peak 225 #SUP 0.95 #QF 0.95 assign (resid 158 and name HA ) (resid 158 and name HG2* ) 2.73 0.93 0.93 !peak 231 #SUP 1.00 assign (resid 158 and name HG2* ) (resid 177 and name HA ) 3.24 1.44 1.44 !peak 232 #SUP 0.56 #QF 0.56 assign (resid 153 and name HN ) (resid 153 and name HG2* ) 3.05 1.25 1.25 !peak 247 #SUP 0.98 #QF 0.98 assign (resid 153 and name HG2* ) (resid 157 and name HA ) 3.30 1.50 1.50 !peak 248 #SUP 0.86 #QF 0.86 assign (resid 153 and name HA ) (resid 153 and name HG2* ) 2.70 0.90 0.90 !peak 249 #SUP 0.92 #QF 0.92 assign (resid 153 and name HG2* ) (resid 157 and name HB2 ) 2.84 1.04 1.04 !peak 250 #SUP 0.81 #QF 0.64 assign (resid 153 and name HG2* ) (resid 154 and name HG1 ) 3.56 1.76 1.76 !peak 256 #SUP 0.42 #QF 0.42 assign (resid 96 and name HG2* ) (resid 137 and name HN ) 3.58 1.78 1.78 !peak 260 #SUP 0.75 #QF 0.41 assign (resid 96 and name HA ) (resid 96 and name HG2* ) 2.78 0.98 0.98 !peak 264 #SUP 0.90 #QF 0.90 assign (resid 96 and name HG2* ) (resid 137 and name HB ) 3.28 1.48 1.48 !peak 266 #SUP 0.64 #QF 0.64 assign (resid 158 and name HA ) (resid 158 and name HG1* ) 2.73 0.93 0.93 !peak 275 #SUP 0.99 #QF 0.99 assign (resid 137 and name HA ) (resid 137 and name HG1* ) 2.80 1.00 1.00 !peak 277 #SUP 0.97 #QF 0.97 assign (resid 158 and name HG1* ) (resid 177 and name HA ) 3.24 1.44 1.44 !peak 278 #SUP 0.89 #QF 0.89 assign (resid 137 and name HG1* ) (resid 144 and name HG1 ) 2.65 0.85 0.85 !peak 284 #SUP 0.56 #QF 0.56 assign (resid 137 and name HG1* ) (resid 144 and name HG2 ) 2.82 1.02 1.03 !peak 285 #SUP 0.97 #QF 0.97 assign (resid 125 and name HN ) (resid 178 and name HG1* ) 3.69 1.89 1.89 !peak 291 #SUP 0.98 #QF 0.98 assign (resid 157 and name HN ) (resid 178 and name HG1* ) 2.80 1.00 1.00 !peak 292 #SUP 0.99 #QF 0.97 assign (resid 178 and name HA ) (resid 178 and name HG1* ) 2.84 1.04 1.04 !peak 295 #SUP 1.00 assign (resid 155 and name HA ) (resid 178 and name HG1* ) 3.04 1.24 1.24 !peak 296 #SUP 0.99 #QF 0.94 assign (resid 157 and name HB2 ) (resid 178 and name HG1* ) 3.30 1.50 1.50 !peak 296 #SUP 0.99 #QF 0.94 assign (resid 180 and name HN ) (resid 180 and name HD2* ) 3.23 1.43 1.43 !peak 301 #SUP 0.78 #QF 0.78 assign (resid 155 and name HN ) (resid 180 and name HD2* ) 3.67 1.87 1.87 !peak 303 #SUP 0.95 #QF 0.95 assign (resid 180 and name HA ) (resid 180 and name HD2* ) 2.63 0.83 0.83 !peak 304 #SUP 0.94 #QF 0.94 assign (resid 126 and name HB ) (resid 180 and name HD2* ) 3.91 2.11 2.11 !peak 305 #SUP 0.36 #QF 0.36 assign (resid 154 and name HA ) (resid 180 and name HD2* ) 3.43 1.63 1.63 !peak 306 #SUP 0.97 #QF 0.97 assign (resid 127 and name HA ) (resid 180 and name HD2* ) 2.92 1.12 1.12 !peak 307 #SUP 0.81 #QF 0.81 assign (resid 180 and name HB2 ) (resid 180 and name HD2* ) 2.81 1.01 1.01 !peak 309 #SUP 0.88 #QF 0.88 assign (resid 130 and name HB* ) (resid 180 and name HD2* ) 2.45 0.65 0.65 !peak 311 #SUP 0.81 #QF 0.81 assign (resid 176 and name HA ) (resid 176 and name HD2* ) 2.74 0.94 0.94 !peak 315 #SUP 0.92 #QF 0.63 assign (resid 121 and name HA ) (resid 176 and name HD2* ) 3.65 1.85 1.85 !peak 316 #SUP 0.81 #QF 0.81 assign (resid 121 and name HB* ) (resid 176 and name HD2* ) 2.53 0.73 0.73 !peak 319 #SUP 0.86 #QF 0.86 assign (resid 175 and name HN ) (resid 175 and name HD2* ) 3.12 1.32 1.32 !peak 322 #SUP 0.93 #QF 0.86 assign (resid 175 and name HN ) (resid 175 and name HD1* ) 3.43 1.63 1.63 !peak 322 #SUP 0.93 #QF 0.86 assign (resid 121 and name HN ) (resid 175 and name HD1* ) 3.48 1.68 1.68 !peak 325 #SUP 0.43 #QF 0.43 assign (resid 120 and name HA ) (resid 175 and name HD1* ) 3.30 1.50 1.50 !peak 326 #SUP 0.64 #QF 0.64 assign (resid 118 and name HA ) (resid 175 and name HD2* ) 3.69 1.89 1.89 !peak 327 #SUP 0.44 #QF 0.44 assign (resid 160 and name HA ) (resid 175 and name HD2* ) 2.85 1.05 1.05 !peak 328 #SUP 0.35 #QF 0.35 assign (resid 175 and name HB2 ) (resid 175 and name HD1* ) 2.70 0.90 0.90 !peak 333 #SUP 0.93 #QF 0.86 assign (resid 175 and name HB1 ) (resid 175 and name HD2* ) 2.89 1.09 1.09 !peak 335 #SUP 0.94 #QF 0.87 assign (resid 127 and name HN ) (resid 127 and name HD1* ) 2.92 1.12 1.12 !peak 337 #SUP 0.54 #QF 0.54 assign (resid 119 and name HB1 ) (resid 119 and name HD1* ) 3.21 1.41 1.41 !peak 350 #SUP 0.66 #QF 0.66 assign (resid 180 and name HN ) (resid 180 and name HD1* ) 3.19 1.39 1.39 !peak 365 #SUP 0.51 #QF 0.51 assign (resid 125 and name HN ) (resid 180 and name HD1* ) 3.85 2.05 2.05 !peak 366 #SUP 0.95 #QF 0.95 assign (resid 180 and name HA ) (resid 180 and name HD1* ) 3.09 1.29 1.29 !peak 370 #SUP 0.99 #QF 0.99 assign (resid 127 and name HA ) (resid 180 and name HD1* ) 3.54 1.74 1.74 !peak 373 #SUP 0.61 #QF 0.61 assign (resid 155 and name HB1 ) (resid 180 and name HD1* ) 3.49 1.69 1.69 !peak 377 #SUP 0.99 #QF 0.99 assign (resid 180 and name HB2 ) (resid 180 and name HD1* ) 2.72 0.92 0.92 !peak 378 #SUP 0.96 #QF 0.96 assign (resid 125 and name HB1 ) (resid 180 and name HD1* ) 2.79 0.99 0.99 !peak 379 #SUP 0.54 #QF 0.54 assign (resid 101 and name HN ) (resid 101 and name HD1* ) 3.38 1.58 1.57 !peak 384 #SUP 0.73 #QF 0.73 assign (resid 101 and name HA ) (resid 101 and name HD1* ) 3.07 1.27 1.27 !peak 386 #SUP 0.75 #QF 0.75 assign (resid 100 and name HN ) (resid 121 and name HB* ) 2.86 1.06 1.06 !peak 398 #SUP 0.99 #QF 0.78 assign (resid 120 and name HA ) (resid 121 and name HB* ) 3.36 1.56 1.56 !peak 399 #SUP 0.94 #QF 0.94 assign (resid 121 and name HB* ) (resid 176 and name HA ) 3.25 1.45 1.45 !peak 400 #SUP 0.80 #QF 0.80 assign (resid 101 and name HA ) (resid 121 and name HB* ) 2.86 1.06 1.06 !peak 402 #SUP 0.88 #QF 0.88 assign (resid 176 and name HN ) (resid 176 and name HD1* ) 3.14 1.34 1.34 !peak 414 #SUP 0.48 #QF 0.48 assign (resid 176 and name HA ) (resid 176 and name HD1* ) 3.27 1.47 1.47 !peak 415 #SUP 0.99 #QF 0.99 assign (resid 176 and name HB2 ) (resid 176 and name HD1* ) 2.87 1.07 1.07 !peak 418 #SUP 0.94 #QF 0.94 assign (resid 123 and name HB1 ) (resid 176 and name HD1* ) 3.38 1.58 1.58 !peak 419 #SUP 0.65 #QF 0.65 assign (resid 176 and name HB1 ) (resid 176 and name HD1* ) 2.89 1.09 1.09 !peak 422 #SUP 1.00 assign (resid 125 and name HD2* ) (resid 126 and name HN ) 3.41 1.61 1.61 !peak 424 #SUP 0.99 #QF 0.99 assign (resid 125 and name HN ) (resid 125 and name HD2* ) 3.40 1.60 1.60 !peak 425 #SUP 0.99 #QF 0.99 assign (resid 125 and name HD2* ) (resid 152 and name HN ) 3.88 2.08 2.08 !peak 426 #SUP 0.73 #QF 0.73 assign (resid 125 and name HD2* ) (resid 130 and name HA ) 2.83 1.03 1.03 !peak 428 #SUP 0.95 #QF 0.95 assign (resid 125 and name HD2* ) (resid 178 and name HB ) 3.23 1.43 1.43 !peak 430 #SUP 0.97 #QF 0.97 assign (resid 123 and name HN ) (resid 123 and name HD2* ) 3.27 1.47 1.47 !peak 435 #SUP 0.99 #QF 0.99 assign (resid 123 and name HB1 ) (resid 123 and name HD2* ) 2.71 0.91 0.91 !peak 436 #SUP 0.82 #QF 0.82 assign (resid 164 and name HB1 ) (resid 174 and name HD2* ) 2.82 1.02 1.03 !peak 440 #SUP 0.95 #QF 0.95 assign (resid 121 and name HB* ) (resid 174 and name HD2* ) 2.69 0.89 0.89 !peak 442 #SUP 0.92 #QF 0.92 assign (resid 99 and name HD2* ) (resid 122 and name HN ) 3.77 1.97 1.97 !peak 444 #SUP 0.61 #QF 0.48 assign (resid 99 and name HN ) (resid 99 and name HD2* ) 3.41 1.61 1.61 !peak 445 #SUP 0.67 #QF 0.67 assign (resid 99 and name HD2* ) (resid 121 and name HB* ) 2.93 1.13 1.13 !peak 449 #SUP 0.85 #QF 0.85 assign (resid 102 and name HA ) (resid 102 and name HD2* ) 2.58 0.78 0.78 !peak 453 #SUP 0.82 #QF 0.82 assign (resid 99 and name HD1* ) (resid 122 and name HN ) 3.46 1.66 1.66 !peak 469 #SUP 0.95 #QF 0.83 assign (resid 99 and name HA ) (resid 99 and name HD1* ) 2.74 0.94 0.94 !peak 472 #SUP 0.93 #QF 0.93 assign (resid 99 and name HD1* ) (resid 124 and name HD1 ) 3.20 1.40 1.40 !peak 476 #SUP 0.81 #QF 0.81 assign (resid 99 and name HD1* ) (resid 176 and name HB2 ) 3.84 2.04 2.04 !peak 479 #SUP 0.82 #QF 0.52 assign (resid 99 and name HB2 ) (resid 99 and name HD1* ) 2.99 1.19 1.19 !peak 480 #SUP 0.80 #QF 0.80 assign (resid 178 and name HN ) (resid 178 and name HG2* ) 3.01 1.21 1.21 !peak 488 #SUP 0.90 #QF 0.90 assign (resid 178 and name HG2* ) (resid 179 and name HN ) 2.89 1.09 1.09 !peak 490 #SUP 0.89 #QF 0.89 assign (resid 178 and name HG2* ) (resid 179 and name HA ) 3.33 1.53 1.53 !peak 494 #SUP 0.89 #QF 0.89 assign (resid 154 and name HA ) (resid 178 and name HG2* ) 3.42 1.62 1.62 !peak 495 #SUP 0.91 #QF 0.91 assign (resid 178 and name HA ) (resid 178 and name HG2* ) 2.71 0.91 0.91 !peak 498 #SUP 0.85 #QF 0.85 assign (resid 155 and name HA ) (resid 178 and name HG2* ) 3.14 1.34 1.34 !peak 501 #SUP 0.69 #QF 0.26 assign (resid 157 and name HB1 ) (resid 178 and name HG2* ) 3.24 1.44 1.44 !peak 501 #SUP 0.69 #QF 0.26 assign (resid 125 and name HD2* ) (resid 178 and name HG2* ) 2.37 0.57 0.57 !peak 506 #SUP 0.91 #QF 0.91 assign (resid 161 and name HN ) (resid 161 and name HG2* ) 3.16 1.36 1.36 !peak 507 #SUP 0.87 #QF 0.87 assign (resid 161 and name HA ) (resid 161 and name HG2* ) 2.69 0.89 0.89 !peak 508 #SUP 0.97 #QF 0.97 assign (resid 161 and name HG2* ) (resid 162 and name HD2 ) 2.88 1.08 1.08 !peak 509 #SUP 0.85 #QF 0.85 assign (resid 161 and name HG2* ) (resid 164 and name HB2 ) 2.79 0.99 0.99 !peak 512 #SUP 0.86 #QF 0.86 assign (resid 127 and name HA ) (resid 127 and name HD2* ) 2.77 0.97 0.97 !peak 529 #SUP 0.91 #QF 0.91 assign (resid 127 and name HB2 ) (resid 127 and name HD2* ) 3.15 1.35 1.35 !peak 531 #SUP 0.87 #QF 0.87 assign (resid 127 and name HD2* ) (resid 180 and name HD2* ) 2.91 1.11 1.11 !peak 535 #SUP 0.44 #QF 0.44 assign (resid 101 and name HA ) (resid 101 and name HD2* ) 2.61 0.81 0.81 !peak 539 #SUP 0.87 #QF 0.87 assign (resid 104 and name HA ) (resid 104 and name HD1* ) 3.11 1.31 1.31 !peak 540 #SUP 0.72 #QF 0.72 assign (resid 119 and name HA ) (resid 119 and name HD2* ) 3.04 1.24 1.24 !peak 555 #SUP 0.91 #QF 0.91 assign (resid 119 and name HB1 ) (resid 119 and name HD2* ) 3.21 1.41 1.41 !peak 561 #SUP 0.95 #QF 0.95 assign (resid 125 and name HN ) (resid 125 and name HD1* ) 3.31 1.51 1.51 !peak 565 #SUP 0.64 #QF 0.64 assign (resid 125 and name HA ) (resid 125 and name HD1* ) 2.66 0.86 0.86 !peak 566 #SUP 0.94 #QF 0.94 assign (resid 125 and name HD1* ) (resid 129 and name HB2 ) 2.97 1.17 1.17 !peak 570 #SUP 0.78 #QF 0.78 assign (resid 125 and name HB2 ) (resid 125 and name HD1* ) 2.58 0.78 0.78 !peak 572 #SUP 0.87 #QF 0.87 assign (resid 121 and name HN ) (resid 174 and name HD1* ) 3.14 1.34 1.34 !peak 575 #SUP 0.75 #QF 0.75 assign (resid 164 and name HB1 ) (resid 174 and name HD1* ) 3.08 1.28 1.28 !peak 579 #SUP 0.88 #QF 0.88 assign (resid 174 and name HB2 ) (resid 174 and name HD1* ) 2.82 1.02 1.02 !peak 580 #SUP 0.97 #QF 0.97 assign (resid 121 and name HB* ) (resid 174 and name HD1* ) 2.52 0.72 0.72 !peak 582 #SUP 0.73 #QF 0.73 assign (resid 164 and name HA ) (resid 164 and name HE* ) 2.78 0.98 0.98 !peak 589 #SUP 0.58 #QF 0.58 assign (resid 145 and name HA ) (resid 164 and name HE* ) 3.19 1.39 1.39 !peak 590 #SUP 0.95 #QF 0.95 assign (resid 140 and name HA ) (resid 141 and name HA ) 3.34 1.54 1.54 !peak 602 #SUP 0.70 #QF 0.70 assign (resid 96 and name HG2* ) (resid 97 and name HA ) 3.52 1.72 1.72 !peak 606 #SUP 1.00 #QF 0.75 assign (resid 159 and name HA ) (resid 159 and name HG11 ) 3.20 1.40 1.40 !peak 611 #SUP 0.97 #QF 0.97 assign (resid 159 and name HA ) (resid 159 and name HG12 ) 3.20 1.40 1.40 !peak 612 #SUP 0.96 #QF 0.96 assign (resid 147 and name HB ) (resid 159 and name HD1* ) 2.93 1.13 1.14 !peak 615 #SUP 0.45 #QF 0.45 assign (resid 126 and name HA ) (resid 126 and name HG2* ) 3.03 1.23 1.23 !peak 642 #SUP 0.87 #QF 0.87 assign (resid 126 and name HA ) (resid 127 and name HD2* ) 3.82 2.02 2.02 !peak 643 #SUP 0.51 #QF 0.51 assign (resid 159 and name HB ) (resid 160 and name HA ) 3.73 1.93 1.93 !peak 661 #SUP 0.94 #QF 0.94 assign (resid 164 and name HB1 ) (resid 174 and name HB2 ) 3.11 1.31 1.31 !peak 672 #SUP 0.73 #QF 0.73 assign (resid 164 and name HB1 ) (resid 174 and name HB1 ) 3.16 1.36 1.36 !peak 674 #SUP 0.97 #QF 0.97 assign (resid 99 and name HD1* ) (resid 123 and name HB1 ) 3.14 1.34 1.34 !peak 688 #SUP 1.00 #QF 0.57 assign (resid 119 and name HB2 ) (resid 119 and name HD2* ) 3.21 1.41 1.41 !peak 702 #SUP 1.00 #QF 0.97 assign (resid 125 and name HB2 ) (resid 125 and name HD2* ) 2.96 1.16 1.16 !peak 704 #SUP 0.57 #QF 0.57 assign (resid 123 and name HB1 ) (resid 176 and name HB1 ) 3.38 1.58 1.58 !peak 719 #SUP 0.95 #QF 0.68 assign (resid 175 and name HB1 ) (resid 175 and name HD1* ) 2.89 1.09 1.09 !peak 727 #SUP 0.48 #QF 0.48 assign (resid 180 and name HB1 ) (resid 180 and name HD1* ) 3.02 1.22 1.22 !peak 734 #SUP 0.79 #QF 0.79 assign (resid 180 and name HB1 ) (resid 180 and name HD2* ) 3.22 1.42 1.42 !peak 736 #SUP 0.83 #QF 0.83 assign (resid 127 and name HB1 ) (resid 127 and name HD2* ) 3.15 1.35 1.35 !peak 745 #SUP 0.72 #QF 0.72 assign (resid 120 and name HA ) (resid 175 and name HB2 ) 3.39 1.59 1.59 !peak 747 #SUP 0.92 #QF 0.92 assign (resid 178 and name HG2* ) (resid 180 and name HB2 ) 3.42 1.62 1.62 !peak 757 #SUP 0.96 #QF 0.96 assign (resid 178 and name HG1* ) (resid 180 and name HB2 ) 3.26 1.46 1.46 !peak 758 #SUP 0.78 #QF 0.78 assign (resid 159 and name HB ) (resid 176 and name HB2 ) 3.14 1.34 1.34 !peak 762 #SUP 0.97 #QF 0.97 assign (resid 101 and name HN ) (resid 101 and name HB2 ) 3.14 1.34 1.34 !peak 766 #SUP 0.67 #QF 0.67 assign (resid 181 and name HN ) (resid 181 and name HB1 ) 3.08 1.28 1.28 !peak 787 #SUP 0.82 #QF 0.82 assign (resid 101 and name HA ) (resid 121 and name HA ) 3.14 1.34 1.34 !peak 799 #SUP 0.97 #QF 0.97 assign (resid 102 and name HG ) (resid 121 and name HA ) 3.11 1.31 1.31 !peak 800 #SUP 0.83 #QF 0.83 assign (resid 101 and name HD2* ) (resid 121 and name HA ) 3.36 1.56 1.56 !peak 802 #SUP 0.67 #QF 0.55 assign (resid 123 and name HA ) (resid 124 and name HB1 ) 4.22 2.42 2.42 !peak 806 #SUP 0.72 #QF 0.24 assign (resid 99 and name HD1* ) (resid 123 and name HA ) 3.01 1.21 1.21 !peak 808 #SUP 0.91 #QF 0.91 assign (resid 123 and name HA ) (resid 123 and name HD1* ) 2.84 1.04 1.04 !peak 809 #SUP 0.91 #QF 0.91 assign (resid 100 and name HA ) (resid 101 and name HN ) 2.86 1.06 1.06 !peak 815 #SUP 0.98 #QF 0.98 assign (resid 123 and name HA ) (resid 124 and name HD2 ) 2.94 1.14 1.14 !peak 825 #SUP 0.90 #QF 0.90 assign (resid 99 and name HD1* ) (resid 124 and name HD2 ) 3.11 1.31 1.31 !peak 830 #SUP 0.71 #QF 0.71 assign (resid 123 and name HD1* ) (resid 124 and name HD2 ) 3.07 1.27 1.27 !peak 831 #SUP 0.82 #QF 0.82 assign (resid 123 and name HA ) (resid 124 and name HD1 ) 2.90 1.10 1.10 !peak 838 #SUP 0.90 #QF 0.90 assign (resid 181 and name HA ) (resid 182 and name HD2 ) 2.78 0.98 0.98 !peak 874 #SUP 0.82 #QF 0.82 assign (resid 181 and name HB1 ) (resid 182 and name HD2 ) 3.03 1.23 1.23 !peak 880 #SUP 0.98 #QF 0.98 assign (resid 181 and name HA ) (resid 182 and name HD1 ) 2.78 0.98 0.98 !peak 888 #SUP 0.83 #QF 0.83 assign (resid 181 and name HB1 ) (resid 182 and name HD1 ) 3.03 1.23 1.23 !peak 889 #SUP 0.97 #QF 0.97 assign (resid 161 and name HA ) (resid 162 and name HD2 ) 2.78 0.98 0.98 !peak 890 #SUP 0.97 #QF 0.97 assign (resid 161 and name HA ) (resid 162 and name HD1 ) 2.75 0.95 0.95 !peak 897 #SUP 0.98 #QF 0.98 assign (resid 161 and name HG2* ) (resid 162 and name HD1 ) 3.32 1.52 1.52 !peak 902 #SUP 0.91 #QF 0.91 assign (resid 119 and name HA ) (resid 175 and name HN ) 3.75 1.95 1.95 !peak 924 #SUP 0.66 #QF 0.66 assign (resid 119 and name HA ) (resid 119 and name HD1* ) 3.04 1.24 1.24 !peak 933 #SUP 0.93 #QF 0.76 assign (resid 125 and name HA ) (resid 129 and name HB2 ) 3.41 1.61 1.61 !peak 949 #SUP 0.30 #QF 0.30 assign (resid 180 and name HA ) (resid 181 and name HG ) 3.25 1.45 1.45 !peak 961 #SUP 0.64 #QF 0.64 assign (resid 178 and name HG2* ) (resid 180 and name HA ) 3.65 1.85 1.85 !peak 963 #SUP 0.68 #QF 0.68 assign (resid 161 and name HG1* ) (resid 164 and name HA ) 3.75 1.95 1.95 !peak 975 #SUP 0.56 #QF 0.56 assign (resid 165 and name HN ) (resid 173 and name HA ) 3.26 1.46 1.46 !peak 980 #SUP 0.92 #QF 0.92 assign (resid 164 and name HN ) (resid 173 and name HA ) 3.11 1.31 1.31 !peak 982 #SUP 0.87 #QF 0.87 assign (resid 162 and name HB1 ) (resid 173 and name HA ) 3.15 1.35 1.36 !peak 986 #SUP 0.65 #QF 0.65 assign (resid 144 and name HA ) (resid 145 and name HB ) 3.95 2.15 2.15 !peak 991 #SUP 0.78 #QF 0.38 assign (resid 135 and name HA ) (resid 135 and name HG2 ) 3.20 1.40 1.40 !peak 1000 #SUP 0.77 #QF 0.77 assign (resid 118 and name HA ) (resid 172 and name HA2 ) 3.72 1.92 1.92 !peak 1007 #SUP 0.60 #QF 0.60 assign (resid 139 and name HA ) (resid 144 and name HA ) 3.05 1.25 1.24 !peak 1012 #SUP 0.98 #QF 0.98 assign (resid 104 and name HA ) (resid 104 and name HD2* ) 3.11 1.31 1.31 !peak 1016 #SUP 0.93 #QF 0.83 assign (resid 117 and name HA ) (resid 117 and name HD2 ) 3.88 2.08 2.08 !peak 1020 #SUP 0.88 #QF 0.58 assign (resid 117 and name HA ) (resid 117 and name HD1 ) 3.88 2.08 2.08 !peak 1020 #SUP 0.88 #QF 0.58 assign (resid 135 and name HA ) (resid 148 and name HA ) 2.98 1.18 1.18 !peak 1030 #SUP 0.99 #QF 0.99 assign (resid 142 and name HN ) (resid 143 and name HA ) 3.97 2.17 2.17 !peak 1033 #SUP 0.60 #QF 0.60 assign (resid 136 and name HA ) (resid 137 and name HG2* ) 3.36 1.56 1.56 !peak 1056 #SUP 0.58 #QF 0.58 assign (resid 154 and name HA ) (resid 155 and name HN ) 2.81 1.01 1.01 !peak 1057 #SUP 0.96 #QF 0.96 assign (resid 130 and name HB* ) (resid 154 and name HA ) 3.30 1.50 1.50 !peak 1066 #SUP 0.69 #QF 0.69 assign (resid 153 and name HG1* ) (resid 154 and name HA ) 3.23 1.43 1.43 !peak 1067 #SUP 0.84 #QF 0.84 assign (resid 154 and name HA ) (resid 180 and name HD1* ) 2.89 1.09 1.09 !peak 1068 #SUP 0.77 #QF 0.77 assign (resid 154 and name HA ) (resid 178 and name HG1* ) 3.14 1.34 1.34 !peak 1070 #SUP 0.68 #QF 0.68 assign (resid 130 and name HA ) (resid 152 and name HN ) 3.34 1.54 1.54 !peak 1071 #SUP 0.38 #QF 0.38 assign (resid 127 and name HA ) (resid 127 and name HG ) 3.09 1.29 1.29 !peak 1113 #SUP 0.98 #QF 0.98 assign (resid 155 and name HA ) (resid 156 and name HA2 ) 3.41 1.61 1.61 !peak 1120 #SUP 0.96 #QF 0.96 assign (resid 155 and name HA ) (resid 180 and name HD1* ) 3.63 1.83 1.83 !peak 1125 #SUP 0.96 #QF 0.87 assign (resid 124 and name HA ) (resid 179 and name HB2 ) 2.99 1.19 1.19 !peak 1143 #SUP 0.90 #QF 0.69 assign (resid 158 and name HA ) (resid 177 and name HA ) 3.05 1.25 1.25 !peak 1159 #SUP 0.78 #QF 0.78 assign (resid 177 and name HA ) (resid 178 and name HB ) 3.33 1.53 1.53 !peak 1162 #SUP 0.88 #QF 0.88 assign (resid 131 and name HA ) (resid 131 and name HD1 ) 3.33 1.53 1.53 !peak 1174 #SUP 0.56 #QF 0.56 assign (resid 157 and name HA ) (resid 158 and name HB ) 3.61 1.81 1.81 !peak 1183 #SUP 0.81 #QF 0.81 assign (resid 145 and name HA ) (resid 145 and name HG1* ) 2.67 0.87 0.87 !peak 1189 #SUP 0.27 #QF 0.27 assign (resid 153 and name HA ) (resid 157 and name HB2 ) 3.27 1.47 1.47 !peak 1193 #SUP 0.60 #QF 0.60 assign (resid 162 and name HA ) (resid 173 and name HA ) 3.21 1.41 1.41 !peak 1205 #SUP 0.78 #QF 0.78 assign (resid 95 and name HB2 ) (resid 126 and name HB ) 3.83 2.03 2.03 !peak 1221 #SUP 0.69 #QF 0.46 assign (resid 95 and name HB1 ) (resid 126 and name HB ) 3.83 2.03 2.03 !peak 1221 #SUP 0.69 #QF 0.46 assign (resid 157 and name HB2 ) (resid 178 and name HG2* ) 3.35 1.55 1.55 !peak 1227 #SUP 0.64 #QF 0.25 assign (resid 145 and name HA ) (resid 146 and name HB2 ) 3.46 1.66 1.66 !peak 1231 #SUP 0.97 #QF 0.97 assign (resid 145 and name HA ) (resid 146 and name HB1 ) 3.46 1.66 1.66 !peak 1237 #SUP 0.72 #QF 0.72 assign (resid 166 and name HN ) (resid 172 and name HA2 ) 3.46 1.66 1.66 !peak 1251 #SUP 0.93 #QF 0.87 assign (resid 133 and name HA2 ) (resid 149 and name HG2* ) 3.82 2.02 2.02 !peak 1288 #SUP 0.94 #QF 0.94 assign (resid 155 and name HA ) (resid 156 and name HA1 ) 3.42 1.62 1.62 !peak 1317 #SUP 0.99 #QF 0.99 assign (resid 97 and name HD1* ) (resid 136 and name HD2 ) 3.44 1.64 1.64 !peak 1338 #SUP 0.70 #QF 0.51 assign (resid 128 and name HA ) (resid 131 and name HB1 ) 3.51 1.71 1.71 !peak 1398 #SUP 0.85 #QF 0.25 assign (resid 133 and name HA2 ) (resid 149 and name HB ) 3.58 1.78 1.78 !peak 1433 #SUP 0.87 #QF 0.87 assign (resid 125 and name HD2* ) (resid 149 and name HB ) 3.32 1.52 1.52 !peak 1437 #SUP 0.54 #QF 0.54 assign (resid 147 and name HN ) (resid 147 and name HB ) 3.09 1.29 1.29 !peak 1473 #SUP 0.99 #QF 0.99 assign (resid 138 and name HB ) (resid 139 and name HN ) 3.22 1.42 1.42 !peak 1480 #SUP 0.86 #QF 0.86 assign (resid 123 and name HD1* ) (resid 136 and name HB2 ) 3.64 1.84 1.84 !peak 1505 #SUP 0.95 #QF 0.95 assign (resid 123 and name HD1* ) (resid 136 and name HB1 ) 3.19 1.39 1.39 !peak 1512 #SUP 0.89 #QF 0.89 assign (resid 154 and name HB2 ) (resid 155 and name HN ) 3.14 1.34 1.34 !peak 1514 #SUP 0.92 #QF 0.92 assign (resid 164 and name HN ) (resid 164 and name HG1 ) 3.41 1.61 1.61 !peak 1551 #SUP 0.84 #QF 0.84 assign (resid 153 and name HB ) (resid 157 and name HB2 ) 3.63 1.83 1.83 !peak 1560 #SUP 0.81 #QF 0.73 assign (resid 153 and name HB ) (resid 157 and name HB1 ) 3.91 2.11 2.11 !peak 1560 #SUP 0.81 #QF 0.73 assign (resid 167 and name HG2 ) (resid 168 and name HN ) 4.03 2.23 2.23 !peak 1586 #SUP 1.00 #QF 0.99 assign (resid 167 and name HG1 ) (resid 168 and name HN ) 4.03 2.23 2.23 !peak 1586 #SUP 1.00 #QF 0.99 assign (resid 157 and name HB1 ) (resid 178 and name HB ) 3.07 1.27 1.27 !peak 1616 #SUP 0.94 #QF 0.64 assign (resid 164 and name HB2 ) (resid 174 and name HA ) 3.66 1.86 1.86 !peak 1623 #SUP 0.37 #QF 0.37 assign (resid 124 and name HA ) (resid 179 and name HB1 ) 3.40 1.60 1.60 !peak 1630 #SUP 0.81 #QF 0.81 assign (resid 177 and name HN ) (resid 177 and name HB ) 3.09 1.29 1.29 !peak 1662 #SUP 0.77 #QF 0.77 assign (resid 122 and name HB1 ) (resid 123 and name HN ) 3.32 1.52 1.52 !peak 1682 #SUP 0.58 #QF 0.58 assign (resid 124 and name HB1 ) (resid 179 and name HB2 ) 3.06 1.26 1.26 !peak 1700 #SUP 0.82 #QF 0.82 assign (resid 124 and name HB1 ) (resid 179 and name HB1 ) 3.20 1.40 1.40 !peak 1701 #SUP 0.72 #QF 0.72 assign (resid 135 and name HB2 ) (resid 136 and name HN ) 3.40 1.60 1.60 !peak 1705 #SUP 0.93 #QF 0.93 assign (resid 96 and name HA ) (resid 137 and name HB ) 3.67 1.87 1.87 !peak 1724 #SUP 0.36 #QF 0.36 assign (resid 137 and name HB ) (resid 144 and name HG1 ) 3.73 1.93 1.93 !peak 1733 #SUP 0.35 #QF 0.35 assign (resid 97 and name HG2* ) (resid 124 and name HB2 ) 3.23 1.43 1.43 !peak 1747 #SUP 0.60 #QF 0.60 assign (resid 143 and name HB1 ) (resid 144 and name HA ) 3.86 2.06 2.06 !peak 1772 #SUP 0.46 #QF 0.46 assign (resid 155 and name HB2 ) (resid 180 and name HD1* ) 3.49 1.69 1.69 !peak 1802 #SUP 0.90 #QF 0.90 assign (resid 167 and name HN ) (resid 167 and name HB1 ) 3.00 1.20 1.20 !peak 1803 #SUP 0.93 #QF 0.93 assign (resid 167 and name HB2 ) (resid 168 and name HN ) 3.34 1.54 1.54 !peak 1814 #SUP 0.66 #QF 0.66 assign (resid 97 and name HD1* ) (resid 124 and name HG2 ) 3.11 1.31 1.31 !peak 1904 #SUP 0.51 #QF 0.51 assign (resid 161 and name HA ) (resid 162 and name HG1 ) 3.33 1.53 1.53 !peak 1906 #SUP 0.87 #QF 0.87 assign (resid 161 and name HA ) (resid 162 and name HG2 ) 3.37 1.57 1.57 !peak 1912 #SUP 0.49 #QF 0.49 assign (resid 101 and name HN ) (resid 101 and name HG ) 3.17 1.37 1.37 !peak 1919 #SUP 0.89 #QF 0.89 assign (resid 104 and name HN ) (resid 104 and name HG ) 3.22 1.42 1.42 !peak 1924 #SUP 0.60 #QF 0.60 assign (resid 123 and name HD1* ) (resid 136 and name HG2 ) 3.24 1.44 1.44 !peak 1944 #SUP 0.77 #QF 0.77 assign (resid 179 and name HA ) (resid 179 and name HG1 ) 3.22 1.42 1.42 !peak 1945 #SUP 0.99 #QF 0.99 assign (resid 124 and name HB1 ) (resid 179 and name HG1 ) 3.14 1.34 1.34 !peak 1948 #SUP 0.32 #QF 0.32 assign (resid 123 and name HD1* ) (resid 136 and name HG1 ) 3.24 1.44 1.44 !peak 1952 #SUP 0.78 #QF 0.78 assign (resid 148 and name HN ) (resid 148 and name HG2 ) 3.55 1.75 1.75 !peak 1953 #SUP 1.00 assign (resid 144 and name HN ) (resid 144 and name HG2 ) 3.42 1.62 1.62 !peak 1974 #SUP 0.81 #QF 0.81 assign (resid 174 and name HA ) (resid 175 and name HG ) 3.24 1.44 1.44 !peak 1998 #SUP 0.48 #QF 0.48 assign (resid 181 and name HA ) (resid 181 and name HG ) 3.16 1.36 1.36 !peak 2001 #SUP 0.99 #QF 0.99 assign (resid 144 and name HN ) (resid 144 and name HG1 ) 3.55 1.75 1.75 !peak 2010 #SUP 0.99 #QF 0.99 assign (resid 144 and name HA ) (resid 144 and name HG1 ) 3.22 1.42 1.42 !peak 2012 #SUP 0.99 #QF 0.99 assign (resid 125 and name HD2* ) (resid 149 and name HG11 ) 2.91 1.11 1.11 !peak 2024 #SUP 0.86 #QF 0.86 assign (resid 154 and name HB2 ) (resid 157 and name HN ) 3.88 2.08 2.08 !peak 1 #SUP 0.45 #QF 0.45 assign (resid 157 and name HN ) (resid 178 and name HG2* ) 3.39 1.59 1.59 !peak 3 #SUP 0.86 #QF 0.86 assign (resid 157 and name HN ) (resid 178 and name HB ) 3.16 1.36 1.36 !peak 5 #SUP 0.98 #QF 0.98 assign (resid 154 and name HA ) (resid 157 and name HN ) 3.97 2.17 2.17 !peak 7 #SUP 0.50 #QF 0.50 assign (resid 95 and name HN ) (resid 126 and name HB ) 3.44 1.64 1.64 !peak 9 #SUP 0.24 #QF 0.24 assign (resid 128 and name HN ) (resid 129 and name HN ) 2.84 1.04 1.04 !peak 17 #SUP 0.99 #QF 0.99 assign (resid 126 and name HA ) (resid 128 and name HN ) 3.73 1.93 1.93 !peak 19 #SUP 0.58 #QF 0.58 assign (resid 127 and name HB1 ) (resid 128 and name HN ) 3.00 1.20 1.20 !peak 24 #SUP 0.75 #QF 0.75 assign (resid 127 and name HB2 ) (resid 128 and name HN ) 3.00 1.20 1.20 !peak 25 #SUP 0.83 #QF 0.83 assign (resid 126 and name HG2* ) (resid 128 and name HN ) 3.22 1.42 1.42 !peak 26 #SUP 0.83 #QF 0.83 assign (resid 141 and name HN ) (resid 142 and name HN ) 2.79 0.99 0.99 !peak 28 #SUP 0.93 #QF 0.93 assign (resid 140 and name HN ) (resid 142 and name HN ) 3.32 1.52 1.52 !peak 29 #SUP 0.43 #QF 0.43 assign (resid 140 and name HA ) (resid 142 and name HN ) 3.13 1.33 1.33 !peak 35 #SUP 0.88 #QF 0.88 assign (resid 141 and name HA ) (resid 142 and name HN ) 2.61 0.81 0.80 !peak 37 #SUP 0.83 #QF 0.83 assign (resid 142 and name HN ) (resid 143 and name HB1 ) 3.89 2.09 2.09 !peak 40 #SUP 0.57 #QF 0.57 assign (resid 141 and name HB* ) (resid 142 and name HN ) 3.00 1.20 1.20 !peak 41 #SUP 0.91 #QF 0.91 assign (resid 134 and name HN ) (resid 135 and name HN ) 3.28 1.48 1.48 !peak 45 #SUP 0.42 #QF 0.42 assign (resid 133 and name HN ) (resid 134 and name HN ) 3.42 1.62 1.62 !peak 46 #SUP 0.82 #QF 0.82 assign (resid 134 and name HN ) (resid 149 and name HG12 ) 3.47 1.67 1.67 !peak 51 #SUP 0.68 #QF 0.68 assign (resid 134 and name HN ) (resid 149 and name HG2* ) 3.60 1.80 1.80 !peak 52 #SUP 0.60 #QF 0.60 assign (resid 172 and name HN ) (resid 173 and name HN ) 3.38 1.58 1.57 !peak 59 #SUP 0.96 #QF 0.96 assign (resid 171 and name HA ) (resid 172 and name HN ) 2.49 0.69 0.70 !peak 65 #SUP 0.76 #QF 0.76 assign (resid 171 and name HB2 ) (resid 172 and name HN ) 3.23 1.43 1.43 !peak 72 #SUP 0.91 #QF 0.91 assign (resid 171 and name HB1 ) (resid 172 and name HN ) 3.23 1.43 1.43 !peak 74 #SUP 0.83 #QF 0.83 assign (resid 163 and name HN ) (resid 165 and name HN ) 3.36 1.56 1.56 !peak 76 #SUP 0.96 #QF 0.96 assign (resid 165 and name HN ) (resid 173 and name HN ) 3.58 1.78 1.78 !peak 77 #SUP 0.94 #QF 0.94 assign (resid 165 and name HN ) (resid 166 and name HN ) 3.11 1.31 1.31 !peak 78 #SUP 0.94 #QF 0.94 assign (resid 165 and name HN ) (resid 172 and name HN ) 3.62 1.82 1.82 !peak 79 #SUP 0.36 #QF 0.36 assign (resid 165 and name HN ) (resid 174 and name HN ) 3.29 1.49 1.49 !peak 81 #SUP 1.00 assign (resid 164 and name HN ) (resid 165 and name HN ) 2.79 0.99 0.99 !peak 82 #SUP 0.99 #QF 0.99 assign (resid 165 and name HN ) (resid 172 and name HA1 ) 3.58 1.78 1.78 !peak 88 #SUP 0.60 #QF 0.60 assign (resid 164 and name HB1 ) (resid 165 and name HN ) 3.02 1.22 1.22 !peak 90 #SUP 0.47 #QF 0.47 assign (resid 165 and name HN ) (resid 174 and name HB2 ) 3.55 1.75 1.75 !peak 92 #SUP 0.83 #QF 0.83 assign (resid 164 and name HB2 ) (resid 165 and name HN ) 3.23 1.43 1.43 !peak 93 #SUP 0.88 #QF 0.88 assign (resid 165 and name HN ) (resid 174 and name HB1 ) 3.50 1.70 1.70 !peak 95 #SUP 0.87 #QF 0.87 assign (resid 161 and name HG1* ) (resid 165 and name HN ) 3.49 1.69 1.69 !peak 96 #SUP 0.95 #QF 0.95 assign (resid 165 and name HN ) (resid 174 and name HD1* ) 3.41 1.61 1.61 !peak 97 #SUP 0.97 #QF 0.74 assign (resid 165 and name HN ) (resid 174 and name HD2* ) 3.66 1.86 1.86 !peak 97 #SUP 0.97 #QF 0.74 assign (resid 168 and name HN ) (resid 169 and name HN ) 3.53 1.73 1.73 !peak 100 #SUP 0.99 #QF 0.99 assign (resid 167 and name HA ) (resid 168 and name HN ) 2.33 0.53 0.53 !peak 107 #SUP 0.70 #QF 0.70 assign (resid 167 and name HB1 ) (resid 168 and name HN ) 2.66 0.86 0.86 !peak 114 #SUP 0.69 #QF 0.69 assign (resid 132 and name HN ) (resid 133 and name HN ) 2.74 0.94 0.94 !peak 118 #SUP 0.62 #QF 0.62 assign (resid 131 and name HA ) (resid 133 and name HN ) 3.51 1.71 1.71 !peak 121 #SUP 0.36 #QF 0.36 assign (resid 132 and name HB2 ) (resid 133 and name HN ) 2.85 1.05 1.05 !peak 128 #SUP 0.54 #QF 0.54 assign (resid 131 and name HB1 ) (resid 133 and name HN ) 3.60 1.80 1.80 !peak 129 #SUP 0.64 #QF 0.64 assign (resid 133 and name HN ) (resid 149 and name HD1* ) 3.53 1.73 1.73 !peak 133 #SUP 0.35 #QF 0.35 assign (resid 115 and name HA ) (resid 116 and name HN ) 2.65 0.85 0.85 !peak 144 #SUP 0.70 #QF 0.70 assign (resid 163 and name HN ) (resid 173 and name HA ) 2.82 1.02 1.03 !peak 158 #SUP 0.94 #QF 0.94 assign (resid 162 and name HA ) (resid 163 and name HN ) 2.53 0.73 0.73 !peak 159 #SUP 0.78 #QF 0.78 assign (resid 162 and name HB1 ) (resid 163 and name HN ) 3.19 1.39 1.39 !peak 162 #SUP 0.99 #QF 0.99 assign (resid 162 and name HB2 ) (resid 163 and name HN ) 3.09 1.29 1.29 !peak 163 #SUP 0.74 #QF 0.74 assign (resid 162 and name HG2 ) (resid 163 and name HN ) 3.66 1.86 1.86 !peak 164 #SUP 0.71 #QF 0.71 assign (resid 163 and name HN ) (resid 164 and name HB2 ) 3.63 1.83 1.83 !peak 165 #SUP 0.93 #QF 0.93 assign (resid 161 and name HG2* ) (resid 163 and name HN ) 3.55 1.75 1.75 !peak 166 #SUP 0.52 #QF 0.52 assign (resid 119 and name HN ) (resid 166 and name HN ) 3.39 1.59 1.59 !peak 168 #SUP 0.80 #QF 0.72 assign (resid 118 and name HA ) (resid 166 and name HN ) 3.41 1.61 1.61 !peak 170 #SUP 0.70 #QF 0.70 assign (resid 117 and name HA ) (resid 166 and name HN ) 3.67 1.87 1.87 !peak 171 #SUP 0.86 #QF 0.86 assign (resid 165 and name HA2 ) (resid 166 and name HN ) 2.78 0.98 0.98 !peak 172 #SUP 0.91 #QF 0.91 assign (resid 166 and name HN ) (resid 172 and name HA1 ) 3.22 1.42 1.42 !peak 175 #SUP 0.67 #QF 0.67 assign (resid 165 and name HA1 ) (resid 166 and name HN ) 2.78 0.98 0.98 !peak 176 #SUP 0.94 #QF 0.94 assign (resid 117 and name HB2 ) (resid 166 and name HN ) 4.00 2.20 2.20 !peak 177 #SUP 0.99 #QF 0.99 assign (resid 117 and name HB1 ) (resid 166 and name HN ) 3.20 1.40 1.40 !peak 178 #SUP 0.43 #QF 0.43 assign (resid 152 and name HN ) (resid 153 and name HN ) 3.02 1.22 1.22 !peak 194 #SUP 0.71 #QF 0.71 assign (resid 132 and name HN ) (resid 132 and name HD2 ) 3.41 1.61 1.61 !peak 202 #SUP 0.80 #QF 0.80 assign (resid 131 and name HD1 ) (resid 132 and name HN ) 3.97 2.17 2.17 !peak 203 #SUP 0.83 #QF 0.83 assign (resid 132 and name HN ) (resid 133 and name HA1 ) 3.79 1.99 1.99 !peak 207 #SUP 0.89 #QF 0.89 assign (resid 132 and name HN ) (resid 133 and name HA2 ) 3.90 2.10 2.10 !peak 208 #SUP 0.79 #QF 0.79 assign (resid 132 and name HN ) (resid 132 and name HB2 ) 2.58 0.78 0.78 !peak 209 #SUP 0.71 #QF 0.71 assign (resid 131 and name HB1 ) (resid 132 and name HN ) 2.87 1.07 1.07 !peak 210 #SUP 0.77 #QF 0.77 assign (resid 153 and name HN ) (resid 154 and name HN ) 3.47 1.67 1.67 !peak 221 #SUP 0.88 #QF 0.88 assign (resid 151 and name HA ) (resid 153 and name HN ) 3.00 1.20 1.20 !peak 225 #SUP 0.84 #QF 0.20 assign (resid 153 and name HN ) (resid 153 and name HB ) 2.81 1.01 1.01 !peak 228 #SUP 0.96 #QF 0.96 assign (resid 153 and name HN ) (resid 153 and name HG1* ) 2.42 0.62 0.62 !peak 233 #SUP 0.90 #QF 0.90 assign (resid 125 and name HD2* ) (resid 153 and name HN ) 3.45 1.65 1.65 !peak 234 #SUP 0.80 #QF 0.80 assign (resid 163 and name HN ) (resid 164 and name HN ) 2.93 1.13 1.14 !peak 242 #SUP 0.97 #QF 0.97 assign (resid 164 and name HN ) (resid 174 and name HN ) 2.96 1.16 1.16 !peak 244 #SUP 0.99 #QF 0.99 assign (resid 162 and name HA ) (resid 164 and name HN ) 3.13 1.33 1.33 !peak 247 #SUP 0.78 #QF 0.78 assign (resid 164 and name HN ) (resid 164 and name HG2 ) 3.41 1.61 1.61 !peak 251 #SUP 1.00 assign (resid 164 and name HN ) (resid 164 and name HE* ) 3.85 2.05 2.05 !peak 253 #SUP 0.99 #QF 0.99 assign (resid 162 and name HB2 ) (resid 164 and name HN ) 4.04 2.24 2.24 !peak 254 #SUP 0.67 #QF 0.67 assign (resid 164 and name HN ) (resid 174 and name HB2 ) 3.22 1.42 1.42 !peak 255 #SUP 0.82 #QF 0.82 assign (resid 164 and name HN ) (resid 164 and name HB2 ) 2.68 0.88 0.88 !peak 256 #SUP 0.89 #QF 0.89 assign (resid 164 and name HN ) (resid 174 and name HB1 ) 3.31 1.51 1.51 !peak 257 #SUP 0.98 #QF 0.98 assign (resid 161 and name HG2* ) (resid 164 and name HN ) 3.15 1.35 1.35 !peak 258 #SUP 0.97 #QF 0.97 assign (resid 164 and name HN ) (resid 174 and name HD2* ) 3.64 1.84 1.84 !peak 259 #SUP 0.96 #QF 0.96 assign (resid 131 and name HN ) (resid 133 and name HN ) 3.57 1.77 1.77 !peak 267 #SUP 0.95 #QF 0.95 assign (resid 131 and name HN ) (resid 131 and name HD1 ) 3.51 1.71 1.71 !peak 270 #SUP 0.87 #QF 0.87 assign (resid 131 and name HN ) (resid 131 and name HB2 ) 2.63 0.83 0.83 !peak 274 #SUP 0.84 #QF 0.84 assign (resid 131 and name HN ) (resid 131 and name HB1 ) 2.67 0.87 0.87 !peak 275 #SUP 0.90 #QF 0.90 assign (resid 130 and name HB* ) (resid 131 and name HN ) 2.79 0.99 0.99 !peak 276 #SUP 0.78 #QF 0.78 assign (resid 131 and name HN ) (resid 153 and name HG1* ) 3.78 1.98 1.98 !peak 277 #SUP 0.69 #QF 0.69 assign (resid 169 and name HN ) (resid 169 and name HB2 ) 3.12 1.32 1.32 !peak 292 #SUP 0.93 #QF 0.93 assign (resid 169 and name HN ) (resid 169 and name HB1 ) 3.12 1.32 1.32 !peak 293 #SUP 0.94 #QF 0.94 assign (resid 154 and name HN ) (resid 155 and name HN ) 3.47 1.67 1.67 !peak 294 #SUP 0.86 #QF 0.86 assign (resid 154 and name HN ) (resid 157 and name HA ) 3.95 2.15 2.15 !peak 298 #SUP 0.37 #QF 0.37 assign (resid 153 and name HA ) (resid 154 and name HN ) 2.56 0.76 0.76 !peak 299 #SUP 0.91 #QF 0.91 assign (resid 154 and name HN ) (resid 157 and name HB2 ) 2.87 1.07 1.07 !peak 300 #SUP 0.51 #QF 0.51 assign (resid 153 and name HB ) (resid 154 and name HN ) 3.09 1.29 1.29 !peak 302 #SUP 0.98 #QF 0.98 assign (resid 154 and name HN ) (resid 154 and name HB1 ) 3.07 1.27 1.27 !peak 303 #SUP 0.97 #QF 0.97 assign (resid 154 and name HN ) (resid 154 and name HG1 ) 2.93 1.13 1.13 !peak 304 #SUP 0.57 #QF 0.57 assign (resid 153 and name HG2* ) (resid 154 and name HN ) 2.94 1.14 1.14 !peak 305 #SUP 0.82 #QF 0.82 assign (resid 154 and name HN ) (resid 180 and name HD1* ) 3.54 1.74 1.74 !peak 306 #SUP 0.99 #QF 0.96 assign (resid 154 and name HN ) (resid 178 and name HG1* ) 3.28 1.48 1.48 !peak 307 #SUP 0.88 #QF 0.88 assign (resid 156 and name HN ) (resid 157 and name HN ) 2.81 1.01 1.01 !peak 308 #SUP 1.00 assign (resid 157 and name HN ) (resid 178 and name HN ) 3.33 1.53 1.53 !peak 309 #SUP 0.94 #QF 0.94 assign (resid 157 and name HN ) (resid 157 and name HB2 ) 2.55 0.75 0.75 !peak 313 #SUP 0.73 #QF 0.47 assign (resid 154 and name HB1 ) (resid 157 and name HN ) 4.22 2.42 2.42 !peak 314 #SUP 0.86 #QF 0.71 assign (resid 126 and name HB ) (resid 129 and name HN ) 3.40 1.60 1.60 !peak 318 #SUP 0.56 #QF 0.56 assign (resid 129 and name HN ) (resid 129 and name HB2 ) 2.71 0.91 0.91 !peak 321 #SUP 0.65 #QF 0.55 assign (resid 129 and name HN ) (resid 129 and name HG2 ) 2.93 1.13 1.14 !peak 321 #SUP 0.65 #QF 0.55 assign (resid 129 and name HN ) (resid 129 and name HG1 ) 2.93 1.13 1.14 !peak 322 #SUP 0.73 #QF 0.73 assign (resid 129 and name HN ) (resid 129 and name HB1 ) 2.92 1.12 1.12 !peak 323 #SUP 0.95 #QF 0.95 assign (resid 126 and name HG2* ) (resid 129 and name HN ) 3.10 1.30 1.30 !peak 326 #SUP 0.67 #QF 0.67 assign (resid 161 and name HN ) (resid 174 and name HN ) 3.07 1.27 1.27 !peak 331 #SUP 0.99 #QF 0.99 assign (resid 163 and name HN ) (resid 174 and name HN ) 3.23 1.43 1.43 !peak 332 #SUP 0.77 #QF 0.77 assign (resid 173 and name HA ) (resid 174 and name HN ) 2.73 0.93 0.93 !peak 337 #SUP 0.97 #QF 0.97 assign (resid 162 and name HA ) (resid 174 and name HN ) 3.38 1.58 1.58 !peak 338 #SUP 0.80 #QF 0.80 assign (resid 174 and name HN ) (resid 174 and name HB2 ) 2.77 0.97 0.97 !peak 340 #SUP 0.85 #QF 0.85 assign (resid 164 and name HB2 ) (resid 174 and name HN ) 3.11 1.31 1.31 !peak 341 #SUP 0.79 #QF 0.79 assign (resid 174 and name HN ) (resid 175 and name HG ) 4.52 2.72 2.72 !peak 342 #SUP 0.72 #QF 0.22 assign (resid 174 and name HN ) (resid 174 and name HG ) 3.39 1.59 1.59 !peak 343 #SUP 0.89 #QF 0.89 assign (resid 174 and name HN ) (resid 174 and name HB1 ) 2.91 1.11 1.11 !peak 344 #SUP 0.98 #QF 0.98 assign (resid 161 and name HG1* ) (resid 174 and name HN ) 2.93 1.13 1.13 !peak 345 #SUP 0.90 #QF 0.90 assign (resid 141 and name HN ) (resid 143 and name HN ) 3.48 1.68 1.68 !peak 347 #SUP 0.98 #QF 0.98 assign (resid 140 and name HN ) (resid 143 and name HN ) 2.78 0.98 0.98 !peak 348 #SUP 0.99 #QF 0.99 assign (resid 142 and name HN ) (resid 143 and name HN ) 2.69 0.89 0.89 !peak 349 #SUP 0.98 #QF 0.98 assign (resid 143 and name HN ) (resid 144 and name HN ) 3.42 1.62 1.62 !peak 350 #SUP 0.96 #QF 0.96 assign (resid 139 and name HA ) (resid 143 and name HN ) 3.31 1.51 1.51 !peak 353 #SUP 0.97 #QF 0.97 assign (resid 140 and name HA ) (resid 143 and name HN ) 3.41 1.61 1.61 !peak 355 #SUP 1.00 assign (resid 141 and name HA ) (resid 143 and name HN ) 3.47 1.67 1.67 !peak 357 #SUP 0.95 #QF 0.95 assign (resid 143 and name HN ) (resid 143 and name HB2 ) 2.75 0.95 0.95 !peak 360 #SUP 0.83 #QF 0.83 assign (resid 143 and name HN ) (resid 143 and name HB1 ) 2.63 0.83 0.83 !peak 361 #SUP 0.34 #QF 0.34 assign (resid 141 and name HB* ) (resid 143 and name HN ) 3.07 1.27 1.27 !peak 362 #SUP 0.93 #QF 0.93 assign (resid 166 and name HN ) (resid 173 and name HN ) 3.54 1.74 1.74 !peak 365 #SUP 0.47 #QF 0.47 assign (resid 119 and name HN ) (resid 173 and name HN ) 3.09 1.29 1.29 !peak 366 #SUP 0.57 #QF 0.57 assign (resid 118 and name HN ) (resid 173 and name HN ) 3.66 1.86 1.86 !peak 367 #SUP 0.59 #QF 0.59 assign (resid 173 and name HN ) (resid 174 and name HN ) 3.38 1.58 1.58 !peak 368 #SUP 0.98 #QF 0.98 assign (resid 118 and name HA ) (resid 173 and name HN ) 2.76 0.96 0.96 !peak 369 #SUP 0.89 #QF 0.89 assign (resid 162 and name HA ) (resid 173 and name HN ) 3.60 1.80 1.80 !peak 371 #SUP 0.59 #QF 0.59 assign (resid 172 and name HA2 ) (resid 173 and name HN ) 2.64 0.84 0.84 !peak 372 #SUP 0.94 #QF 0.94 assign (resid 172 and name HA1 ) (resid 173 and name HN ) 2.71 0.91 0.91 !peak 374 #SUP 0.96 #QF 0.96 assign (resid 173 and name HN ) (resid 173 and name HB1 ) 3.13 1.33 1.33 !peak 377 #SUP 0.68 #QF 0.68 assign (resid 173 and name HN ) (resid 173 and name HB2 ) 3.13 1.33 1.33 !peak 378 #SUP 0.97 #QF 0.97 assign (resid 156 and name HN ) (resid 180 and name HN ) 3.55 1.75 1.75 !peak 393 #SUP 0.59 #QF 0.59 assign (resid 156 and name HN ) (resid 178 and name HN ) 3.35 1.55 1.55 !peak 394 #SUP 0.72 #QF 0.72 assign (resid 156 and name HN ) (resid 179 and name HA ) 3.52 1.72 1.72 !peak 397 #SUP 0.52 #QF 0.52 assign (resid 155 and name HA ) (resid 156 and name HN ) 2.48 0.68 0.68 !peak 399 #SUP 0.92 #QF 0.92 assign (resid 155 and name HB1 ) (resid 156 and name HN ) 3.29 1.49 1.49 !peak 403 #SUP 0.95 #QF 0.95 assign (resid 155 and name HB2 ) (resid 156 and name HN ) 3.29 1.49 1.49 !peak 404 #SUP 0.94 #QF 0.94 assign (resid 156 and name HN ) (resid 178 and name HG1* ) 2.91 1.11 1.11 !peak 407 #SUP 0.94 #QF 0.94 assign (resid 121 and name HN ) (resid 122 and name HN ) 3.41 1.61 1.61 !peak 409 #SUP 0.99 #QF 0.99 assign (resid 121 and name HA ) (resid 122 and name HN ) 2.69 0.89 0.89 !peak 412 #SUP 0.94 #QF 0.94 assign (resid 99 and name HA ) (resid 122 and name HN ) 3.17 1.37 1.37 !peak 414 #SUP 0.29 #QF 0.29 assign (resid 102 and name HG ) (resid 122 and name HN ) 3.02 1.22 1.22 !peak 417 #SUP 0.89 #QF 0.89 assign (resid 121 and name HB* ) (resid 122 and name HN ) 2.62 0.82 0.82 !peak 419 #SUP 0.92 #QF 0.92 assign (resid 102 and name HD1* ) (resid 122 and name HN ) 3.26 1.46 1.46 !peak 420 #SUP 0.87 #QF 0.87 assign (resid 155 and name HN ) (resid 156 and name HN ) 3.44 1.64 1.64 !peak 434 #SUP 0.98 #QF 0.98 assign (resid 155 and name HN ) (resid 155 and name HB1 ) 2.72 0.92 0.92 !peak 440 #SUP 0.76 #QF 0.76 assign (resid 154 and name HB1 ) (resid 155 and name HN ) 2.57 0.77 0.77 !peak 441 #SUP 0.94 #QF 0.78 assign (resid 155 and name HN ) (resid 155 and name HB2 ) 2.72 0.92 0.92 !peak 441 #SUP 0.94 #QF 0.78 assign (resid 155 and name HN ) (resid 180 and name HD1* ) 2.65 0.85 0.85 !peak 443 #SUP 0.89 #QF 0.89 assign (resid 166 and name HN ) (resid 167 and name HN ) 3.42 1.62 1.62 !peak 444 #SUP 0.96 #QF 0.96 assign (resid 167 and name HN ) (resid 168 and name HN ) 3.41 1.61 1.61 !peak 448 #SUP 1.00 assign (resid 167 and name HN ) (resid 167 and name HB2 ) 2.45 0.65 0.65 !peak 454 #SUP 0.55 #QF 0.55 assign (resid 119 and name HN ) (resid 175 and name HN ) 3.22 1.42 1.42 !peak 456 #SUP 0.98 #QF 0.98 assign (resid 118 and name HA ) (resid 119 and name HN ) 2.61 0.81 0.80 !peak 460 #SUP 0.87 #QF 0.87 assign (resid 119 and name HN ) (resid 174 and name HA ) 3.08 1.28 1.28 !peak 463 #SUP 0.28 #QF 0.28 assign (resid 119 and name HN ) (resid 165 and name HA2 ) 3.29 1.49 1.49 !peak 466 #SUP 0.82 #QF 0.82 assign (resid 119 and name HN ) (resid 172 and name HA1 ) 3.89 2.09 2.09 !peak 468 #SUP 0.66 #QF 0.66 assign (resid 119 and name HN ) (resid 165 and name HA1 ) 3.29 1.49 1.49 !peak 469 #SUP 0.80 #QF 0.80 assign (resid 135 and name HN ) (resid 135 and name HB2 ) 2.66 0.86 0.86 !peak 471 #SUP 0.58 #QF 0.58 assign (resid 119 and name HN ) (resid 119 and name HG ) 3.70 1.90 1.90 !peak 472 #SUP 0.47 #QF 0.47 assign (resid 119 and name HN ) (resid 119 and name HD1* ) 3.61 1.81 1.81 !peak 477 #SUP 0.92 #QF 0.67 assign (resid 119 and name HN ) (resid 119 and name HD2* ) 3.61 1.81 1.81 !peak 477 #SUP 0.92 #QF 0.67 assign (resid 119 and name HN ) (resid 174 and name HD1* ) 3.22 1.42 1.42 !peak 478 #SUP 0.77 #QF 0.77 assign (resid 100 and name HN ) (resid 101 and name HN ) 3.41 1.61 1.61 !peak 479 #SUP 0.98 #QF 0.95 assign (resid 100 and name HB* ) (resid 101 and name HN ) 2.69 0.89 0.89 !peak 484 #SUP 0.79 #QF 0.79 assign (resid 158 and name HN ) (resid 159 and name HN ) 3.49 1.69 1.69 !peak 485 #SUP 0.98 #QF 0.98 assign (resid 157 and name HN ) (resid 158 and name HN ) 3.49 1.69 1.69 !peak 487 #SUP 0.96 #QF 0.96 assign (resid 157 and name HA ) (resid 158 and name HN ) 2.36 0.56 0.56 !peak 489 #SUP 0.70 #QF 0.70 assign (resid 158 and name HN ) (resid 178 and name HB ) 4.08 2.28 2.28 !peak 493 #SUP 0.71 #QF 0.71 assign (resid 158 and name HN ) (resid 158 and name HB ) 2.59 0.79 0.79 !peak 494 #SUP 0.87 #QF 0.87 assign (resid 158 and name HN ) (resid 158 and name HG2* ) 3.07 1.27 1.27 !peak 495 #SUP 0.96 #QF 0.96 assign (resid 158 and name HN ) (resid 158 and name HG1* ) 3.07 1.27 1.27 !peak 496 #SUP 0.93 #QF 0.93 assign (resid 98 and name HB* ) (resid 99 and name HN ) 2.84 1.04 1.04 !peak 503 #SUP 0.83 #QF 0.83 assign (resid 145 and name HN ) (resid 146 and name HN ) 3.61 1.81 1.81 !peak 505 #SUP 1.00 #QF 0.84 assign (resid 138 and name HN ) (resid 146 and name HN ) 3.79 1.99 1.99 !peak 506 #SUP 0.62 #QF 0.62 assign (resid 145 and name HA ) (resid 146 and name HN ) 2.34 0.54 0.54 !peak 511 #SUP 0.85 #QF 0.85 assign (resid 146 and name HN ) (resid 146 and name HB2 ) 2.58 0.78 0.78 !peak 512 #SUP 0.88 #QF 0.88 assign (resid 146 and name HN ) (resid 146 and name HB1 ) 2.58 0.78 0.78 !peak 513 #SUP 0.91 #QF 0.91 assign (resid 146 and name HN ) (resid 164 and name HE* ) 3.74 1.94 1.94 !peak 514 #SUP 0.80 #QF 0.80 assign (resid 145 and name HB ) (resid 146 and name HN ) 3.15 1.35 1.36 !peak 515 #SUP 0.95 #QF 0.95 assign (resid 138 and name HN ) (resid 145 and name HN ) 2.90 1.10 1.10 !peak 518 #SUP 0.78 #QF 0.78 assign (resid 138 and name HN ) (resid 139 and name HN ) 3.31 1.51 1.51 !peak 520 #SUP 0.82 #QF 0.82 assign (resid 138 and name HN ) (resid 146 and name HA ) 3.09 1.29 1.29 !peak 522 #SUP 0.49 #QF 0.49 assign (resid 137 and name HA ) (resid 138 and name HN ) 2.72 0.92 0.92 !peak 523 #SUP 0.95 #QF 0.95 assign (resid 138 and name HN ) (resid 138 and name HB ) 3.11 1.31 1.31 !peak 524 #SUP 0.77 #QF 0.77 assign (resid 138 and name HN ) (resid 144 and name HG1 ) 3.55 1.75 1.75 !peak 527 #SUP 0.96 #QF 0.96 assign (resid 137 and name HG1* ) (resid 138 and name HN ) 2.52 0.72 0.72 !peak 529 #SUP 0.94 #QF 0.84 assign (resid 138 and name HN ) (resid 138 and name HG1* ) 3.08 1.28 1.28 !peak 529 #SUP 0.94 #QF 0.84 assign (resid 120 and name HN ) (resid 121 and name HN ) 3.47 1.67 1.67 !peak 530 #SUP 0.48 #QF 0.48 assign (resid 119 and name HN ) (resid 120 and name HN ) 3.48 1.68 1.68 !peak 532 #SUP 0.66 #QF 0.66 assign (resid 118 and name HA ) (resid 120 and name HN ) 4.30 2.50 2.50 !peak 534 #SUP 0.48 #QF 0.48 assign (resid 120 and name HN ) (resid 121 and name HA ) 3.95 2.15 2.15 !peak 535 #SUP 0.57 #QF 0.57 assign (resid 119 and name HA ) (resid 120 and name HN ) 2.66 0.86 0.86 !peak 536 #SUP 0.84 #QF 0.84 assign (resid 120 and name HN ) (resid 174 and name HD1* ) 3.41 1.61 1.61 !peak 542 #SUP 0.85 #QF 0.85 assign (resid 99 and name HN ) (resid 139 and name HN ) 3.41 1.61 1.61 !peak 545 #SUP 0.79 #QF 0.79 assign (resid 138 and name HA ) (resid 139 and name HN ) 2.63 0.83 0.83 !peak 548 #SUP 0.85 #QF 0.85 assign (resid 97 and name HG11 ) (resid 139 and name HN ) 3.67 1.87 1.87 !peak 558 #SUP 0.50 #QF 0.50 assign (resid 98 and name HB* ) (resid 139 and name HN ) 3.48 1.68 1.68 !peak 561 #SUP 0.66 #QF 0.66 assign (resid 96 and name HG2* ) (resid 139 and name HN ) 3.38 1.58 1.58 !peak 562 #SUP 0.82 #QF 0.69 assign (resid 97 and name HG12 ) (resid 139 and name HN ) 3.67 1.87 1.87 !peak 562 #SUP 0.82 #QF 0.69 assign (resid 138 and name HG2* ) (resid 139 and name HN ) 3.28 1.48 1.48 !peak 563 #SUP 0.74 #QF 0.74 assign (resid 158 and name HA ) (resid 176 and name HN ) 3.76 1.96 1.96 !peak 567 #SUP 0.71 #QF 0.71 assign (resid 176 and name HN ) (resid 176 and name HB2 ) 2.82 1.02 1.03 !peak 569 #SUP 0.58 #QF 0.58 assign (resid 175 and name HB1 ) (resid 176 and name HN ) 2.86 1.06 1.06 !peak 572 #SUP 0.51 #QF 0.51 assign (resid 136 and name HN ) (resid 137 and name HN ) 3.47 1.67 1.67 !peak 577 #SUP 0.78 #QF 0.78 assign (resid 135 and name HA ) (resid 136 and name HN ) 2.49 0.69 0.70 !peak 578 #SUP 0.90 #QF 0.90 assign (resid 136 and name HN ) (resid 148 and name HA ) 3.04 1.24 1.24 !peak 580 #SUP 0.70 #QF 0.70 assign (resid 136 and name HN ) (resid 147 and name HA ) 3.63 1.83 1.83 !peak 581 #SUP 0.84 #QF 0.84 assign (resid 135 and name HB1 ) (resid 136 and name HN ) 2.90 1.10 1.10 !peak 583 #SUP 0.82 #QF 0.82 assign (resid 140 and name HN ) (resid 141 and name HN ) 3.34 1.54 1.54 !peak 584 #SUP 0.80 #QF 0.80 assign (resid 139 and name HN ) (resid 140 and name HN ) 3.46 1.66 1.66 !peak 587 #SUP 0.92 #QF 0.92 assign (resid 140 and name HN ) (resid 144 and name HN ) 3.78 1.98 1.98 !peak 588 #SUP 0.98 #QF 0.98 assign (resid 139 and name HA ) (resid 140 and name HN ) 2.46 0.66 0.66 !peak 590 #SUP 0.85 #QF 0.85 assign (resid 176 and name HA ) (resid 177 and name HN ) 2.53 0.73 0.73 !peak 591 #SUP 0.71 #QF 0.71 assign (resid 140 and name HN ) (resid 144 and name HA ) 2.98 1.18 1.18 !peak 592 #SUP 0.88 #QF 0.88 assign (resid 140 and name HN ) (resid 143 and name HB1 ) 3.23 1.43 1.43 !peak 599 #SUP 0.76 #QF 0.76 assign (resid 140 and name HN ) (resid 141 and name HB* ) 3.48 1.68 1.68 !peak 600 #SUP 0.97 #QF 0.97 assign (resid 176 and name HB1 ) (resid 177 and name HN ) 3.11 1.31 1.31 !peak 602 #SUP 0.91 #QF 0.91 assign (resid 125 and name HN ) (resid 126 and name HN ) 3.45 1.65 1.65 !peak 605 #SUP 0.85 #QF 0.85 assign (resid 124 and name HA ) (resid 125 and name HN ) 2.58 0.78 0.78 !peak 608 #SUP 0.82 #QF 0.82 assign (resid 125 and name HN ) (resid 180 and name HA ) 3.03 1.23 1.23 !peak 609 #SUP 0.54 #QF 0.54 assign (resid 125 and name HN ) (resid 178 and name HA ) 3.63 1.83 1.83 !peak 611 #SUP 0.85 #QF 0.85 assign (resid 124 and name HB2 ) (resid 125 and name HN ) 3.17 1.37 1.37 !peak 612 #SUP 0.94 #QF 0.94 assign (resid 125 and name HN ) (resid 125 and name HB1 ) 2.86 1.06 1.06 !peak 613 #SUP 0.68 #QF 0.56 assign (resid 125 and name HN ) (resid 180 and name HG ) 3.07 1.27 1.27 !peak 614 #SUP 0.58 #QF 0.58 assign (resid 137 and name HN ) (resid 138 and name HN ) 3.88 2.08 2.08 !peak 616 #SUP 0.98 #QF 0.70 assign (resid 136 and name HA ) (resid 137 and name HN ) 2.57 0.77 0.77 !peak 620 #SUP 0.69 #QF 0.69 assign (resid 137 and name HN ) (resid 137 and name HB ) 2.62 0.82 0.82 !peak 624 #SUP 0.74 #QF 0.74 assign (resid 136 and name HB1 ) (resid 137 and name HN ) 3.39 1.59 1.59 !peak 626 #SUP 0.88 #QF 0.88 assign (resid 137 and name HN ) (resid 137 and name HG2* ) 2.64 0.84 0.84 !peak 629 #SUP 0.96 #QF 0.96 assign (resid 137 and name HN ) (resid 137 and name HG1* ) 2.94 1.14 1.14 !peak 630 #SUP 0.75 #QF 0.75 assign (resid 102 and name HN ) (resid 121 and name HA ) 3.23 1.43 1.43 !peak 632 #SUP 0.74 #QF 0.74 assign (resid 101 and name HA ) (resid 102 and name HN ) 2.61 0.81 0.80 !peak 633 #SUP 0.75 #QF 0.75 assign (resid 102 and name HN ) (resid 121 and name HB* ) 3.19 1.39 1.39 !peak 637 #SUP 0.61 #QF 0.61 assign (resid 102 and name HN ) (resid 102 and name HD1* ) 2.79 0.99 0.99 !peak 638 #SUP 0.39 #QF 0.39 assign (resid 139 and name HA ) (resid 144 and name HN ) 3.67 1.87 1.87 !peak 644 #SUP 0.83 #QF 0.83 assign (resid 143 and name HA ) (resid 144 and name HN ) 2.41 0.61 0.61 !peak 646 #SUP 0.59 #QF 0.59 assign (resid 103 and name HA ) (resid 104 and name HN ) 2.44 0.64 0.64 !peak 655 #SUP 0.77 #QF 0.77 assign (resid 103 and name HB2 ) (resid 104 and name HN ) 3.06 1.26 1.26 !peak 657 #SUP 0.98 #QF 0.98 assign (resid 117 and name HA ) (resid 118 and name HN ) 2.46 0.66 0.66 !peak 664 #SUP 0.70 #QF 0.70 assign (resid 118 and name HN ) (resid 172 and name HA1 ) 4.11 2.31 2.31 !peak 666 #SUP 0.90 #QF 0.90 assign (resid 117 and name HD2 ) (resid 118 and name HN ) 3.67 1.87 1.87 !peak 667 #SUP 0.92 #QF 0.59 assign (resid 117 and name HD1 ) (resid 118 and name HN ) 3.67 1.87 1.87 !peak 667 #SUP 0.92 #QF 0.59 assign (resid 117 and name HB2 ) (resid 118 and name HN ) 3.20 1.40 1.40 !peak 669 #SUP 0.88 #QF 0.88 assign (resid 181 and name HB1 ) (resid 183 and name HN ) 3.12 1.32 1.32 !peak 683 #SUP 0.48 #QF 0.35 assign (resid 179 and name HN ) (resid 180 and name HN ) 3.46 1.66 1.66 !peak 695 #SUP 0.98 #QF 0.98 assign (resid 179 and name HA ) (resid 180 and name HN ) 2.60 0.80 0.80 !peak 697 #SUP 0.74 #QF 0.74 assign (resid 155 and name HA ) (resid 180 and name HN ) 3.17 1.37 1.37 !peak 698 #SUP 0.86 #QF 0.86 assign (resid 180 and name HN ) (resid 180 and name HB2 ) 2.65 0.85 0.85 !peak 702 #SUP 0.93 #QF 0.93 assign (resid 179 and name HB1 ) (resid 180 and name HN ) 3.08 1.28 1.28 !peak 703 #SUP 0.96 #QF 0.96 assign (resid 180 and name HN ) (resid 180 and name HB1 ) 2.93 1.13 1.13 !peak 704 #SUP 0.81 #QF 0.81 assign (resid 178 and name HG2* ) (resid 180 and name HN ) 3.49 1.69 1.69 !peak 705 #SUP 0.99 #QF 0.48 assign (resid 178 and name HG1* ) (resid 180 and name HN ) 2.98 1.18 1.18 !peak 706 #SUP 0.84 #QF 0.84 assign (resid 136 and name HN ) (resid 147 and name HN ) 2.73 0.93 0.93 !peak 708 #SUP 0.83 #QF 0.83 assign (resid 146 and name HN ) (resid 147 and name HN ) 3.60 1.80 1.80 !peak 709 #SUP 0.95 #QF 0.82 assign (resid 135 and name HA ) (resid 147 and name HN ) 3.29 1.49 1.49 !peak 710 #SUP 0.81 #QF 0.81 assign (resid 146 and name HA ) (resid 147 and name HN ) 2.56 0.76 0.76 !peak 711 #SUP 0.79 #QF 0.79 assign (resid 146 and name HB2 ) (resid 147 and name HN ) 3.20 1.40 1.40 !peak 715 #SUP 0.83 #QF 0.83 assign (resid 146 and name HB1 ) (resid 147 and name HN ) 3.20 1.40 1.40 !peak 716 #SUP 0.83 #QF 0.83 assign (resid 135 and name HG1 ) (resid 147 and name HN ) 3.84 2.04 2.04 !peak 718 #SUP 0.31 #QF 0.31 assign (resid 145 and name HN ) (resid 145 and name HB ) 2.75 0.95 0.95 !peak 719 #SUP 0.62 #QF 0.62 assign (resid 144 and name HG2 ) (resid 145 and name HN ) 3.11 1.31 1.31 !peak 721 #SUP 0.65 #QF 0.65 assign (resid 140 and name HN ) (resid 145 and name HN ) 3.48 1.68 1.68 !peak 724 #SUP 0.90 #QF 0.90 assign (resid 139 and name HA ) (resid 145 and name HN ) 3.16 1.36 1.36 !peak 725 #SUP 0.90 #QF 0.90 assign (resid 144 and name HA ) (resid 145 and name HN ) 2.49 0.69 0.70 !peak 726 #SUP 0.85 #QF 0.85 assign (resid 144 and name HG1 ) (resid 145 and name HN ) 3.08 1.28 1.28 !peak 727 #SUP 0.83 #QF 0.83 assign (resid 180 and name HN ) (resid 181 and name HN ) 3.44 1.64 1.64 !peak 728 #SUP 0.84 #QF 0.84 assign (resid 180 and name HA ) (resid 181 and name HN ) 2.48 0.68 0.68 !peak 732 #SUP 0.89 #QF 0.89 assign (resid 181 and name HN ) (resid 182 and name HD1 ) 3.83 2.03 2.03 !peak 734 #SUP 0.93 #QF 0.93 assign (resid 181 and name HN ) (resid 182 and name HD2 ) 3.83 2.03 2.03 !peak 735 #SUP 0.94 #QF 0.94 assign (resid 180 and name HB2 ) (resid 181 and name HN ) 3.22 1.42 1.42 !peak 737 #SUP 0.99 #QF 0.99 assign (resid 181 and name HN ) (resid 181 and name HG ) 2.45 0.65 0.65 !peak 738 #SUP 0.49 #QF 0.49 assign (resid 180 and name HB1 ) (resid 181 and name HN ) 2.85 1.05 1.05 !peak 739 #SUP 0.67 #QF 0.67 assign (resid 180 and name HD2* ) (resid 181 and name HN ) 2.83 1.03 1.03 !peak 741 #SUP 0.91 #QF 0.91 assign (resid 122 and name HN ) (resid 123 and name HN ) 3.45 1.65 1.65 !peak 743 #SUP 0.88 #QF 0.88 assign (resid 123 and name HN ) (resid 179 and name HN ) 3.47 1.67 1.67 !peak 744 #SUP 1.00 assign (resid 123 and name HN ) (resid 178 and name HA ) 3.11 1.31 1.31 !peak 747 #SUP 0.44 #QF 0.44 assign (resid 123 and name HN ) (resid 124 and name HD2 ) 3.53 1.73 1.73 !peak 748 #SUP 0.95 #QF 0.95 assign (resid 122 and name HB2 ) (resid 123 and name HN ) 3.32 1.52 1.52 !peak 750 #SUP 0.90 #QF 0.90 assign (resid 123 and name HN ) (resid 123 and name HB1 ) 2.87 1.07 1.07 !peak 752 #SUP 0.92 #QF 0.92 assign (resid 123 and name HN ) (resid 123 and name HG ) 3.23 1.43 1.43 !peak 753 #SUP 0.93 #QF 0.93 assign (resid 99 and name HD1* ) (resid 123 and name HN ) 2.95 1.15 1.15 !peak 754 #SUP 1.00 #QF 0.94 assign (resid 123 and name HN ) (resid 123 and name HD1* ) 3.19 1.39 1.39 !peak 755 #SUP 0.98 #QF 0.98 assign (resid 147 and name HN ) (resid 148 and name HN ) 3.43 1.63 1.63 !peak 756 #SUP 0.94 #QF 0.94 assign (resid 136 and name HN ) (resid 148 and name HN ) 3.70 1.90 1.90 !peak 757 #SUP 1.00 #QF 0.25 assign (resid 148 and name HN ) (resid 149 and name HN ) 3.83 2.03 2.03 !peak 757 #SUP 1.00 #QF 0.25 assign (resid 135 and name HA ) (resid 148 and name HN ) 3.50 1.70 1.70 !peak 759 #SUP 0.90 #QF 0.90 assign (resid 147 and name HA ) (resid 148 and name HN ) 2.42 0.62 0.62 !peak 761 #SUP 0.82 #QF 0.82 assign (resid 147 and name HB ) (resid 148 and name HN ) 3.18 1.38 1.38 !peak 763 #SUP 0.86 #QF 0.86 assign (resid 148 and name HN ) (resid 148 and name HB2 ) 2.81 1.01 1.01 !peak 764 #SUP 0.83 #QF 0.57 assign (resid 148 and name HN ) (resid 148 and name HB1 ) 2.81 1.01 1.01 !peak 764 #SUP 0.83 #QF 0.57 assign (resid 148 and name HN ) (resid 148 and name HG1 ) 3.55 1.75 1.75 !peak 765 #SUP 0.94 #QF 0.94 assign (resid 147 and name HG1* ) (resid 148 and name HN ) 3.37 1.57 1.57 !peak 767 #SUP 0.92 #QF 0.92 assign (resid 99 and name HN ) (resid 100 and name HN ) 3.50 1.70 1.70 !peak 769 #SUP 0.62 #QF 0.62 assign (resid 99 and name HA ) (resid 100 and name HN ) 2.59 0.79 0.79 !peak 771 #SUP 0.83 #QF 0.83 assign (resid 100 and name HN ) (resid 100 and name HB* ) 2.62 0.82 0.82 !peak 773 #SUP 0.91 #QF 0.91 assign (resid 99 and name HD1* ) (resid 100 and name HN ) 3.08 1.28 1.28 !peak 775 #SUP 0.93 #QF 0.93 assign (resid 121 and name HN ) (resid 175 and name HN ) 3.33 1.53 1.53 !peak 776 #SUP 0.81 #QF 0.81 assign (resid 120 and name HA ) (resid 121 and name HN ) 2.51 0.71 0.71 !peak 779 #SUP 0.87 #QF 0.87 assign (resid 121 and name HN ) (resid 176 and name HA ) 3.07 1.27 1.27 !peak 780 #SUP 0.52 #QF 0.52 assign (resid 121 and name HN ) (resid 121 and name HB* ) 2.69 0.89 0.89 !peak 786 #SUP 0.95 #QF 0.95 assign (resid 102 and name HD1* ) (resid 121 and name HN ) 3.23 1.43 1.43 !peak 787 #SUP 0.63 #QF 0.63 assign (resid 121 and name HN ) (resid 176 and name HD2* ) 3.62 1.82 1.82 !peak 788 #SUP 0.97 #QF 0.95 assign (resid 177 and name HN ) (resid 178 and name HN ) 3.45 1.65 1.65 !peak 793 #SUP 0.69 #QF 0.69 assign (resid 158 and name HA ) (resid 178 and name HN ) 3.15 1.35 1.35 !peak 795 #SUP 0.94 #QF 0.94 assign (resid 177 and name HA ) (resid 178 and name HN ) 2.52 0.72 0.72 !peak 796 #SUP 0.90 #QF 0.90 assign (resid 157 and name HA ) (resid 178 and name HN ) 3.53 1.73 1.73 !peak 797 #SUP 0.76 #QF 0.76 assign (resid 157 and name HB1 ) (resid 178 and name HN ) 3.12 1.32 1.32 !peak 799 #SUP 0.72 #QF 0.72 assign (resid 178 and name HN ) (resid 178 and name HB ) 2.62 0.82 0.82 !peak 800 #SUP 0.95 #QF 0.95 assign (resid 177 and name HB ) (resid 178 and name HN ) 3.28 1.48 1.48 !peak 801 #SUP 0.93 #QF 0.21 assign (resid 178 and name HN ) (resid 178 and name HG1* ) 2.79 0.99 0.99 !peak 804 #SUP 0.95 #QF 0.95 assign (resid 175 and name HN ) (resid 176 and name HN ) 3.35 1.55 1.55 !peak 806 #SUP 0.55 #QF 0.55 assign (resid 120 and name HA ) (resid 175 and name HN ) 2.95 1.15 1.15 !peak 809 #SUP 0.75 #QF 0.75 assign (resid 175 and name HN ) (resid 175 and name HB2 ) 2.76 0.96 0.96 !peak 812 #SUP 0.96 #QF 0.96 assign (resid 175 and name HN ) (resid 175 and name HG ) 2.73 0.93 0.93 !peak 814 #SUP 0.89 #QF 0.89 assign (resid 175 and name HN ) (resid 175 and name HB1 ) 2.97 1.17 1.17 !peak 815 #SUP 0.96 #QF 0.96 assign (resid 174 and name HD1* ) (resid 175 and name HN ) 2.63 0.83 0.83 !peak 816 #SUP 0.72 #QF 0.72 assign (resid 134 and name HN ) (resid 149 and name HN ) 3.07 1.27 1.27 !peak 818 #SUP 0.66 #QF 0.66 assign (resid 135 and name HA ) (resid 149 and name HN ) 3.14 1.34 1.34 !peak 819 #SUP 0.72 #QF 0.72 assign (resid 148 and name HA ) (resid 149 and name HN ) 2.58 0.78 0.78 !peak 820 #SUP 0.75 #QF 0.75 assign (resid 133 and name HA2 ) (resid 149 and name HN ) 3.63 1.83 1.83 !peak 823 #SUP 0.83 #QF 0.83 assign (resid 135 and name HG1 ) (resid 149 and name HN ) 4.07 2.27 2.27 !peak 825 #SUP 0.55 #QF 0.55 assign (resid 149 and name HN ) (resid 149 and name HB ) 3.00 1.20 1.20 !peak 827 #SUP 0.98 #QF 0.98 assign (resid 148 and name HB2 ) (resid 149 and name HN ) 3.78 1.98 1.98 !peak 828 #SUP 1.00 #QF 0.94 assign (resid 148 and name HB1 ) (resid 149 and name HN ) 3.78 1.98 1.98 !peak 828 #SUP 1.00 #QF 0.94 assign (resid 149 and name HN ) (resid 149 and name HG12 ) 2.90 1.10 1.10 !peak 829 #SUP 0.92 #QF 0.92 assign (resid 149 and name HN ) (resid 149 and name HG2* ) 2.96 1.16 1.16 !peak 830 #SUP 0.93 #QF 0.72 assign (resid 149 and name HN ) (resid 149 and name HG11 ) 3.28 1.48 1.48 !peak 830 #SUP 0.93 #QF 0.72 assign (resid 159 and name HA ) (resid 160 and name HN ) 2.47 0.67 0.67 !peak 838 #SUP 0.82 #QF 0.82 assign (resid 160 and name HN ) (resid 160 and name HD2 ) 3.86 2.06 2.06 !peak 839 #SUP 0.92 #QF 0.92 assign (resid 160 and name HN ) (resid 160 and name HD1 ) 3.86 2.06 2.06 !peak 840 #SUP 0.92 #QF 0.92 assign (resid 160 and name HN ) (resid 160 and name HB2 ) 2.69 0.89 0.89 !peak 841 #SUP 0.88 #QF 0.88 assign (resid 160 and name HN ) (resid 160 and name HB1 ) 2.69 0.89 0.89 !peak 842 #SUP 0.93 #QF 0.93 assign (resid 160 and name HN ) (resid 160 and name HG1 ) 3.49 1.69 1.69 !peak 844 #SUP 0.83 #QF 0.83 assign (resid 160 and name HN ) (resid 160 and name HG2 ) 3.49 1.69 1.69 !peak 845 #SUP 0.90 #QF 0.90 assign (resid 159 and name HG2* ) (resid 160 and name HN ) 2.74 0.94 0.94 !peak 846 #SUP 0.88 #QF 0.88 assign (resid 178 and name HN ) (resid 179 and name HN ) 3.52 1.72 1.72 !peak 847 #SUP 0.57 #QF 0.57 assign (resid 125 and name HN ) (resid 179 and name HN ) 3.26 1.46 1.47 !peak 849 #SUP 1.00 assign (resid 124 and name HA ) (resid 179 and name HN ) 3.04 1.24 1.24 !peak 851 #SUP 0.97 #QF 0.97 assign (resid 178 and name HA ) (resid 179 and name HN ) 2.53 0.73 0.73 !peak 853 #SUP 0.91 #QF 0.91 assign (resid 178 and name HB ) (resid 179 and name HN ) 3.44 1.64 1.64 !peak 855 #SUP 0.93 #QF 0.93 assign (resid 124 and name HB2 ) (resid 179 and name HN ) 3.89 2.09 2.09 !peak 856 #SUP 0.62 #QF 0.62 assign (resid 124 and name HB1 ) (resid 179 and name HN ) 3.52 1.72 1.72 !peak 858 #SUP 0.88 #QF 0.88 assign (resid 179 and name HN ) (resid 179 and name HB2 ) 2.79 0.99 0.99 !peak 859 #SUP 0.93 #QF 0.93 assign (resid 123 and name HG ) (resid 179 and name HN ) 3.33 1.53 1.53 !peak 860 #SUP 0.85 #QF 0.51 assign (resid 125 and name HB2 ) (resid 179 and name HN ) 3.51 1.71 1.71 !peak 860 #SUP 0.85 #QF 0.51 assign (resid 178 and name HG1* ) (resid 179 and name HN ) 3.00 1.20 1.20 !peak 862 #SUP 0.99 #QF 0.99 assign (resid 98 and name HN ) (resid 99 and name HA ) 3.44 1.64 1.64 !peak 867 #SUP 0.33 #QF 0.33 assign (resid 97 and name HA ) (resid 98 and name HN ) 2.43 0.63 0.63 !peak 868 #SUP 0.84 #QF 0.84 assign (resid 97 and name HB ) (resid 98 and name HN ) 2.86 1.06 1.06 !peak 869 #SUP 0.87 #QF 0.87 assign (resid 97 and name HG11 ) (resid 98 and name HN ) 3.35 1.55 1.55 !peak 871 #SUP 0.87 #QF 0.87 assign (resid 98 and name HN ) (resid 98 and name HB* ) 2.45 0.65 0.65 !peak 872 #SUP 0.79 #QF 0.79 assign (resid 97 and name HG12 ) (resid 98 and name HN ) 3.35 1.55 1.55 !peak 873 #SUP 0.98 #QF 0.98 assign (resid 97 and name HG2* ) (resid 98 and name HN ) 3.00 1.20 1.20 !peak 874 #SUP 0.90 #QF 0.90 assign (resid 161 and name HN ) (resid 176 and name HN ) 3.45 1.65 1.65 !peak 876 #SUP 0.69 #QF 0.69 assign (resid 160 and name HN ) (resid 161 and name HN ) 3.37 1.57 1.57 !peak 877 #SUP 0.98 #QF 0.98 assign (resid 160 and name HA ) (resid 161 and name HN ) 2.64 0.84 0.84 !peak 879 #SUP 0.83 #QF 0.83 assign (resid 161 and name HN ) (resid 162 and name HD1 ) 3.46 1.66 1.66 !peak 881 #SUP 0.84 #QF 0.84 assign (resid 161 and name HN ) (resid 162 and name HD2 ) 3.63 1.83 1.83 !peak 882 #SUP 0.98 #QF 0.98 assign (resid 161 and name HN ) (resid 161 and name HB ) 2.73 0.93 0.93 !peak 883 #SUP 0.92 #QF 0.92 assign (resid 160 and name HB2 ) (resid 161 and name HN ) 3.39 1.59 1.59 !peak 884 #SUP 0.96 #QF 0.96 assign (resid 160 and name HB1 ) (resid 161 and name HN ) 3.39 1.59 1.59 !peak 885 #SUP 0.99 #QF 0.99 assign (resid 161 and name HN ) (resid 175 and name HG ) 4.19 2.39 2.39 !peak 886 #SUP 0.42 #QF 0.42 assign (resid 161 and name HN ) (resid 174 and name HB1 ) 3.31 1.51 1.51 !peak 888 #SUP 0.55 #QF 0.55 assign (resid 161 and name HN ) (resid 161 and name HG1* ) 2.54 0.74 0.74 !peak 889 #SUP 0.92 #QF 0.92 assign (resid 161 and name HN ) (resid 176 and name HD1* ) 3.16 1.36 1.36 !peak 890 #SUP 0.69 #QF 0.69 assign (resid 140 and name HA ) (resid 141 and name HN ) 2.54 0.74 0.74 !peak 895 #SUP 0.97 #QF 0.97 assign (resid 140 and name HB ) (resid 141 and name HN ) 3.21 1.41 1.41 !peak 897 #SUP 0.98 #QF 0.98 assign (resid 141 and name HN ) (resid 141 and name HB* ) 2.74 0.94 0.94 !peak 898 #SUP 0.94 #QF 0.94 assign (resid 101 and name HD1* ) (resid 141 and name HN ) 3.41 1.61 1.61 !peak 899 #SUP 0.82 #QF 0.82 assign (resid 159 and name HN ) (resid 178 and name HN ) 3.56 1.76 1.76 !peak 902 #SUP 0.93 #QF 0.93 assign (resid 159 and name HN ) (resid 176 and name HN ) 2.96 1.16 1.16 !peak 903 #SUP 0.97 #QF 0.97 assign (resid 159 and name HN ) (resid 160 and name HN ) 3.28 1.48 1.48 !peak 904 #SUP 0.69 #QF 0.69 assign (resid 158 and name HA ) (resid 159 and name HN ) 2.51 0.71 0.71 !peak 906 #SUP 0.94 #QF 0.94 assign (resid 159 and name HN ) (resid 177 and name HA ) 3.13 1.33 1.33 !peak 908 #SUP 0.93 #QF 0.93 assign (resid 159 and name HN ) (resid 176 and name HB2 ) 3.06 1.26 1.26 !peak 910 #SUP 0.91 #QF 0.91 assign (resid 158 and name HB ) (resid 159 and name HN ) 3.23 1.43 1.43 !peak 911 #SUP 0.82 #QF 0.82 assign (resid 159 and name HN ) (resid 159 and name HB ) 2.74 0.94 0.94 !peak 912 #SUP 0.93 #QF 0.93 assign (resid 158 and name HG2* ) (resid 159 and name HN ) 3.12 1.32 1.32 !peak 915 #SUP 0.95 #QF 0.95 assign (resid 158 and name HG1* ) (resid 159 and name HN ) 3.12 1.32 1.32 !peak 916 #SUP 0.76 #QF 0.76 assign (resid 116 and name HN ) (resid 117 and name HN ) 3.24 1.44 1.44 !peak 917 #SUP 0.98 #QF 0.98 assign (resid 117 and name HN ) (resid 172 and name HN ) 3.61 1.81 1.81 !peak 919 #SUP 0.29 #QF 0.29 assign (resid 116 and name HA2 ) (resid 117 and name HN ) 2.79 0.99 0.99 !peak 925 #SUP 0.76 #QF 0.76 assign (resid 116 and name HA1 ) (resid 117 and name HN ) 2.79 0.99 0.99 !peak 926 #SUP 0.91 #QF 0.91 assign (resid 117 and name HN ) (resid 172 and name HA1 ) 3.46 1.66 1.66 !peak 928 #SUP 0.23 #QF 0.23 assign (resid 117 and name HN ) (resid 117 and name HB2 ) 2.97 1.17 1.17 !peak 930 #SUP 0.84 #QF 0.84 assign (resid 117 and name HN ) (resid 117 and name HB1 ) 2.51 0.71 0.71 !peak 931 #SUP 0.68 #QF 0.68 assign (resid 135 and name HN ) (resid 136 and name HN ) 3.41 1.61 1.61 !peak 933 #SUP 0.91 #QF 0.91 assign (resid 96 and name HN ) (resid 96 and name HB ) 3.19 1.39 1.39 !peak 941 #SUP 0.98 #QF 0.98 assign (resid 96 and name HN ) (resid 96 and name HG2* ) 3.51 1.71 1.71 !peak 943 #SUP 0.97 #QF 0.97 assign (resid 97 and name HN ) (resid 139 and name HN ) 3.38 1.58 1.58 !peak 944 #SUP 0.98 #QF 0.98 assign (resid 97 and name HN ) (resid 98 and name HN ) 3.36 1.56 1.56 !peak 945 #SUP 0.76 #QF 0.76 assign (resid 97 and name HN ) (resid 138 and name HA ) 3.18 1.38 1.38 !peak 948 #SUP 0.58 #QF 0.58 assign (resid 97 and name HN ) (resid 98 and name HA ) 3.62 1.82 1.82 !peak 949 #SUP 0.91 #QF 0.91 assign (resid 96 and name HA ) (resid 97 and name HN ) 2.52 0.72 0.72 !peak 951 #SUP 0.79 #QF 0.79 assign (resid 96 and name HB ) (resid 97 and name HN ) 3.05 1.25 1.24 !peak 953 #SUP 0.97 #QF 0.97 assign (resid 97 and name HN ) (resid 97 and name HB ) 3.12 1.32 1.32 !peak 955 #SUP 0.98 #QF 0.98 assign (resid 97 and name HN ) (resid 98 and name HB* ) 3.74 1.94 1.94 !peak 957 #SUP 0.69 #QF 0.69 assign (resid 96 and name HG2* ) (resid 97 and name HN ) 2.73 0.93 0.93 !peak 958 #SUP 0.99 #QF 0.92 assign (resid 97 and name HN ) (resid 97 and name HG2* ) 2.83 1.03 1.03 !peak 959 #SUP 0.95 #QF 0.95 assign (resid 97 and name HN ) (resid 97 and name HD1* ) 3.38 1.58 1.58 !peak 960 #SUP 0.80 #QF 0.67 assign (resid 126 and name HN ) (resid 130 and name HN ) 3.53 1.73 1.73 !peak 963 #SUP 0.46 #QF 0.46 assign (resid 126 and name HN ) (resid 129 and name HN ) 3.32 1.52 1.52 !peak 964 #SUP 0.88 #QF 0.88 assign (resid 125 and name HA ) (resid 126 and name HN ) 2.67 0.87 0.87 !peak 965 #SUP 0.82 #QF 0.82 assign (resid 126 and name HN ) (resid 129 and name HA ) 3.93 2.13 2.13 !peak 967 #SUP 0.65 #QF 0.65 assign (resid 126 and name HN ) (resid 129 and name HB2 ) 2.80 1.00 1.00 !peak 968 #SUP 0.75 #QF 0.75 assign (resid 126 and name HN ) (resid 129 and name HB1 ) 3.13 1.33 1.33 !peak 970 #SUP 0.89 #QF 0.89 assign (resid 125 and name HB2 ) (resid 126 and name HN ) 3.30 1.50 1.50 !peak 972 #SUP 0.86 #QF 0.86 assign (resid 126 and name HN ) (resid 126 and name HG2* ) 2.57 0.77 0.77 !peak 973 #SUP 0.57 #QF 0.57 assign (resid 125 and name HD1* ) (resid 126 and name HN ) 2.85 1.05 1.05 !peak 974 #SUP 0.83 #QF 0.83 assign (resid 127 and name HN ) (resid 128 and name HN ) 2.91 1.11 1.11 !peak 977 #SUP 0.98 #QF 0.98 assign (resid 126 and name HB ) (resid 127 and name HN ) 3.15 1.35 1.35 !peak 978 #SUP 0.57 #QF 0.57 assign (resid 126 and name HA ) (resid 127 and name HN ) 2.73 0.93 0.93 !peak 979 #SUP 0.92 #QF 0.92 assign (resid 127 and name HN ) (resid 127 and name HG ) 2.62 0.82 0.82 !peak 981 #SUP 0.87 #QF 0.87 assign (resid 126 and name HG2* ) (resid 127 and name HN ) 2.92 1.12 1.12 !peak 983 #SUP 0.96 #QF 0.96 assign (resid 127 and name HN ) (resid 127 and name HD2* ) 3.28 1.48 1.48 !peak 984 #SUP 1.00 #QF 0.94 assign (resid 99 and name HD2* ) (resid 100 and name HN ) 3.22 1.42 1.42 !peak 992 #SUP 0.98 #QF 0.98 assign (resid 100 and name HN ) (resid 101 and name HB2 ) 3.53 1.73 1.73 !peak 993 #SUP 0.40 #QF 0.40 assign (resid 101 and name HA ) (resid 121 and name HN ) 3.78 1.98 1.98 !peak 996 #SUP 0.91 #QF 0.91 assign (resid 99 and name HN ) (resid 121 and name HB* ) 4.10 2.30 2.30 !peak 997 #SUP 0.96 #QF 0.96 assign (resid 99 and name HN ) (resid 99 and name HD1* ) 2.90 1.10 1.10 !peak 998 #SUP 0.55 #QF 0.55 assign (resid 174 and name HN ) (resid 175 and name HN ) 3.61 1.81 1.81 !peak 1001 #SUP 0.99 #QF 0.99 assign (resid 102 and name HN ) (resid 102 and name HG ) 2.83 1.03 1.03 !peak 1003 #SUP 0.35 #QF 0.35 assign (resid 120 and name HN ) (resid 121 and name HB* ) 3.65 1.85 1.85 !peak 1004 #SUP 0.68 #QF 0.68 assign (resid 137 and name HB ) (resid 138 and name HN ) 3.25 1.45 1.45 !peak 1006 #SUP 0.62 #QF 0.62 assign (resid 94 and name HB* ) (resid 94 and name HG* ) 2.16 0.37 0.37 !peak 1527 assign (resid 94 and name HB* ) (resid 136 and name HA ) 3.77 1.97 1.97 !peak 1052 assign (resid 94 and name HB* ) (resid 136 and name HB2 ) 3.80 2.00 2.00 !peak 1503 assign (resid 94 and name HB* ) (resid 136 and name HD* ) 3.48 1.68 1.68 !peak 1344 assign (resid 95 and name HB* ) (resid 126 and name HB ) 3.42 1.62 1.62 !peak 1221 assign (resid 96 and name HG2* ) (resid 138 and name HG* ) 4.28 2.48 2.48 !peak 3 assign (resid 97 and name HN ) (resid 97 and name HG1* ) 2.96 1.16 1.16 !peak 956 assign (resid 97 and name HN ) (resid 138 and name HG* ) 3.64 1.84 1.84 !peak 960 assign (resid 97 and name HG2* ) (resid 97 and name HG1* ) 2.59 0.79 0.79 !peak 57 assign (resid 97 and name HG2* ) (resid 136 and name HG* ) 3.62 1.82 1.82 !peak 456 assign (resid 97 and name HG2* ) (resid 138 and name HG* ) 3.38 1.58 1.58 !peak 67 assign (resid 97 and name HG1* ) (resid 98 and name HN ) 2.95 1.15 1.15 !peak 871 assign (resid 97 and name HG1* ) (resid 138 and name HG* ) 3.08 1.28 1.28 !peak 133 assign (resid 97 and name HG12 ) (resid 138 and name HG2* ) 4.30 2.50 2.50 !peak 133 assign (resid 97 and name HG1* ) (resid 139 and name HN ) 3.27 1.47 1.47 !peak 558 assign (resid 97 and name HD1* ) (resid 136 and name HD* ) 3.11 1.31 1.31 !peak 1338 assign (resid 97 and name HD1* ) (resid 138 and name HG* ) 3.36 1.56 1.56 !peak 34 assign (resid 97 and name HD1* ) (resid 147 and name HG* ) 3.40 1.60 1.60 !peak 117 assign (resid 98 and name HB* ) (resid 138 and name HG* ) 3.33 1.53 1.53 !peak 101 assign (resid 99 and name HN ) (resid 99 and name HB* ) 2.65 0.85 0.85 !peak 502 assign (resid 99 and name HN ) (resid 138 and name HG* ) 2.87 1.07 1.07 !peak 504 assign (resid 99 and name HA ) (resid 138 and name HG* ) 3.20 1.40 1.40 !peak 202 assign (resid 99 and name HA ) (resid 140 and name HG* ) 3.60 1.80 1.80 !peak 143 assign (resid 99 and name HB* ) (resid 99 and name HD1* ) 2.59 0.79 0.79 !peak 480 assign (resid 99 and name HB* ) (resid 99 and name HD2* ) 2.62 0.82 0.82 !peak 448 assign (resid 99 and name HB* ) (resid 100 and name HN ) 3.12 1.32 1.32 !peak 772 assign (resid 99 and name HB* ) (resid 121 and name HB* ) 2.55 0.75 0.75 !peak 404 assign (resid 99 and name HB* ) (resid 140 and name HG* ) 2.59 0.79 0.79 !peak 157 assign (resid 99 and name HD1* ) (resid 122 and name HB* ) 3.60 1.80 1.80 !peak 479 assign (resid 99 and name HD2* ) (resid 138 and name HG* ) 3.19 1.39 1.39 !peak 239 assign (resid 99 and name HD2* ) (resid 140 and name HG* ) 2.79 0.99 0.99 !peak 134 assign (resid 101 and name HN ) (resid 140 and name HG* ) 3.62 1.82 1.82 !peak 167 assign (resid 101 and name HA ) (resid 119 and name HD* ) 3.12 1.32 1.32 !peak 1046 assign (resid 101 and name HG ) (resid 140 and name HG* ) 3.39 1.59 1.59 !peak 102 assign (resid 101 and name HD1* ) (resid 119 and name HD* ) 3.22 1.42 1.42 !peak 503 assign (resid 101 and name HD1* ) (resid 140 and name HG* ) 3.33 1.53 1.53 !peak 421 assign (resid 101 and name HD2* ) (resid 140 and name HG* ) 3.15 1.35 1.36 !peak 390 assign (resid 102 and name HN ) (resid 102 and name HB* ) 2.71 0.91 0.91 !peak 636 assign (resid 102 and name HA ) (resid 103 and name HG* ) 3.30 1.50 1.50 !peak 1871 assign (resid 102 and name HA ) (resid 103 and name HD* ) 2.71 0.91 0.91 !peak 845 assign (resid 102 and name HB* ) (resid 102 and name HD2* ) 2.77 0.97 0.97 !peak 244 assign (resid 102 and name HB* ) (resid 103 and name HD* ) 2.95 1.15 1.15 !peak 850 assign (resid 102 and name HD1* ) (resid 120 and name HB* ) 3.15 1.35 1.35 !peak 1500 assign (resid 102 and name HD1* ) (resid 122 and name HB* ) 3.31 1.51 1.51 !peak 386 assign (resid 102 and name HD1* ) (resid 122 and name HG* ) 3.27 1.47 1.47 !peak 348 assign (resid 102 and name HD2* ) (resid 103 and name HD* ) 2.70 0.90 0.90 !peak 454 assign (resid 102 and name HD2* ) (resid 122 and name HG* ) 2.97 1.17 1.17 !peak 458 assign (resid 103 and name HA ) (resid 104 and name HB* ) 3.48 1.68 1.68 !peak 1149 assign (resid 103 and name HA ) (resid 104 and name HD* ) 3.40 1.60 1.60 !peak 354 assign (resid 103 and name HB2 ) (resid 104 and name HB* ) 3.30 1.50 1.50 !peak 1605 assign (resid 103 and name HB2 ) (resid 104 and name HD* ) 3.15 1.35 1.36 !peak 360 assign (resid 103 and name HG* ) (resid 104 and name HN ) 3.39 1.59 1.59 !peak 658 assign (resid 104 and name HN ) (resid 104 and name HB* ) 2.90 1.10 1.10 !peak 769 assign (resid 104 and name HA ) (resid 104 and name HD* ) 2.70 0.90 0.90 !peak 540 assign (resid 104 and name HB* ) (resid 105 and name HN ) 3.10 1.30 1.30 !peak 775 assign (resid 104 and name HD* ) (resid 105 and name HA* ) 2.93 1.13 1.13 !peak 542 assign (resid 114 and name HA* ) (resid 115 and name HN ) 2.61 0.81 0.81 !peak 282 assign (resid 115 and name HN ) (resid 115 and name HB* ) 2.78 0.98 0.98 !peak 283 assign (resid 116 and name HA* ) (resid 117 and name HN ) 2.51 0.71 0.71 !peak 925 assign (resid 116 and name HA* ) (resid 172 and name HN ) 3.03 1.23 1.23 !peak 68 assign (resid 116 and name HA* ) (resid 173 and name HN ) 3.54 1.74 1.74 !peak 373 assign (resid 117 and name HN ) (resid 117 and name HD* ) 3.47 1.67 1.67 !peak 929 assign (resid 117 and name HA ) (resid 117 and name HD* ) 3.44 1.64 1.64 !peak 1020 assign (resid 117 and name HD* ) (resid 118 and name HN ) 3.29 1.49 1.49 !peak 667 assign (resid 117 and name HD* ) (resid 119 and name HG ) 3.72 1.92 1.92 !peak 1926 assign (resid 117 and name HD* ) (resid 119 and name HD* ) 2.89 1.09 1.09 !peak 347 assign (resid 117 and name HD* ) (resid 165 and name HA* ) 3.61 1.81 1.81 !peak 1358 assign (resid 118 and name HN ) (resid 118 and name HB* ) 2.61 0.81 0.81 !peak 668 assign (resid 118 and name HN ) (resid 119 and name HB* ) 4.11 2.31 2.31 !peak 671 assign (resid 118 and name HA ) (resid 165 and name HA* ) 3.99 2.19 2.19 !peak 1255 assign (resid 118 and name HB* ) (resid 119 and name HN ) 2.92 1.12 1.12 !peak 470 assign (resid 118 and name HB* ) (resid 173 and name HN ) 3.50 1.70 1.70 !peak 376 assign (resid 118 and name HB* ) (resid 175 and name HN ) 3.94 2.14 2.14 !peak 999 assign (resid 118 and name HB* ) (resid 175 and name HG ) 3.31 1.51 1.51 !peak 2005 assign (resid 118 and name HB* ) (resid 175 and name HD1* ) 3.54 1.74 1.74 !peak 1414 assign (resid 118 and name HB* ) (resid 175 and name HD2* ) 3.42 1.62 1.62 !peak 1414 assign (resid 119 and name HN ) (resid 119 and name HB* ) 2.60 0.80 0.80 !peak 476 assign (resid 119 and name HN ) (resid 119 and name HD* ) 3.22 1.42 1.42 !peak 477 assign (resid 119 and name HN ) (resid 165 and name HA* ) 2.96 1.16 1.16 !peak 469 assign (resid 119 and name HA ) (resid 119 and name HD* ) 2.60 0.80 0.80 !peak 555 assign (resid 119 and name HB2 ) (resid 119 and name HD1* ) 3.21 1.41 1.41 !peak 350 assign (resid 119 and name HB* ) (resid 165 and name HN ) 3.67 1.87 1.87 !peak 94 assign (resid 119 and name HB* ) (resid 165 and name HA* ) 3.06 1.26 1.26 !peak 1259 assign (resid 119 and name HB* ) (resid 166 and name HN ) 3.09 1.29 1.29 !peak 179 assign (resid 119 and name HB* ) (resid 174 and name HN ) 4.24 2.44 2.44 !peak 342 assign (resid 119 and name HB* ) (resid 174 and name HD1* ) 2.77 0.97 0.97 !peak 581 assign (resid 119 and name HD* ) (resid 120 and name HN ) 2.68 0.88 0.88 !peak 541 assign (resid 119 and name HD* ) (resid 121 and name HA ) 3.45 1.65 1.65 !peak 802 assign (resid 119 and name HD* ) (resid 165 and name HA* ) 2.99 1.19 1.19 !peak 343 assign (resid 119 and name HD* ) (resid 166 and name HA2 ) 3.41 1.61 1.61 !peak 1300 assign (resid 119 and name HD* ) (resid 174 and name HD1* ) 3.01 1.21 1.21 !peak 298 assign (resid 120 and name HN ) (resid 120 and name HB* ) 2.62 0.82 0.82 !peak 539 assign (resid 120 and name HB* ) (resid 175 and name HD1* ) 3.18 1.38 1.38 !peak 1495 assign (resid 120 and name HG* ) (resid 121 and name HN ) 2.85 1.05 1.05 !peak 785 assign (resid 120 and name HG* ) (resid 175 and name HD1* ) 3.34 1.54 1.54 !peak 2016 assign (resid 121 and name HB* ) (resid 140 and name HG* ) 3.31 1.51 1.51 !peak 28 assign (resid 122 and name HN ) (resid 122 and name HB* ) 2.86 1.06 1.06 !peak 1672 assign (resid 122 and name HN ) (resid 122 and name HG* ) 2.82 1.02 1.03 !peak 415 assign (resid 122 and name HB* ) (resid 123 and name HN ) 2.89 1.09 1.09 !peak 750 assign (resid 122 and name HB* ) (resid 123 and name HA ) 3.99 2.19 2.19 !peak 806 assign (resid 122 and name HB* ) (resid 124 and name HD1 ) 3.50 1.70 1.70 !peak 1677 assign (resid 122 and name HB* ) (resid 179 and name HN ) 3.77 1.97 1.97 !peak 857 assign (resid 122 and name HG* ) (resid 123 and name HN ) 3.70 1.90 1.90 !peak 749 assign (resid 123 and name HA ) (resid 138 and name HG* ) 3.02 1.22 1.22 !peak 199 assign (resid 123 and name HB2 ) (resid 138 and name HG* ) 2.80 1.00 1.00 !peak 213 assign (resid 123 and name HB1 ) (resid 138 and name HG* ) 3.15 1.35 1.36 !peak 689 assign (resid 123 and name HG ) (resid 138 and name HG* ) 4.02 2.22 2.22 !peak 489 assign (resid 123 and name HD1* ) (resid 136 and name HG* ) 2.95 1.15 1.15 !peak 1944 assign (resid 123 and name HD1* ) (resid 138 and name HG* ) 3.53 1.73 1.73 !peak 485 assign (resid 123 and name HD1* ) (resid 147 and name HG* ) 2.86 1.06 1.06 !peak 382 assign (resid 124 and name HG2 ) (resid 138 and name HG* ) 3.80 2.00 2.00 !peak 208 assign (resid 125 and name HD1* ) (resid 136 and name HD* ) 3.51 1.71 1.71 !peak 569 assign (resid 126 and name HN ) (resid 129 and name HG* ) 3.15 1.35 1.35 !peak 969 assign (resid 127 and name HN ) (resid 127 and name HB* ) 2.75 0.95 0.95 !peak 982 assign (resid 127 and name HB* ) (resid 127 and name HD2* ) 2.75 0.95 0.95 !peak 531 assign (resid 127 and name HB* ) (resid 128 and name HN ) 2.72 0.92 0.92 !peak 24 assign (resid 127 and name HB* ) (resid 129 and name HN ) 3.79 1.99 1.99 !peak 325 assign (resid 128 and name HN ) (resid 128 and name HB* ) 2.79 0.99 0.99 !peak 23 assign (resid 128 and name HN ) (resid 128 and name HG* ) 2.93 1.13 1.13 !peak 22 assign (resid 128 and name HB* ) (resid 129 and name HB2 ) 3.55 1.75 1.75 !peak 1844 assign (resid 129 and name HN ) (resid 129 and name HG* ) 2.66 0.86 0.86 !peak 322 assign (resid 131 and name HA ) (resid 152 and name HA* ) 3.20 1.40 1.40 !peak 1176 assign (resid 134 and name HA* ) (resid 135 and name HN ) 2.50 0.70 0.70 !peak 465 assign (resid 134 and name HA* ) (resid 149 and name HN ) 3.31 1.51 1.51 !peak 822 assign (resid 136 and name HN ) (resid 136 and name HD* ) 3.51 1.71 1.71 !peak 582 assign (resid 136 and name HA ) (resid 136 and name HD* ) 3.20 1.40 1.40 !peak 1050 assign (resid 136 and name HG* ) (resid 137 and name HN ) 2.95 1.15 1.15 !peak 628 assign (resid 136 and name HG* ) (resid 138 and name HG* ) 3.42 1.62 1.62 !peak 11 assign (resid 136 and name HG* ) (resid 147 and name HG* ) 2.90 1.10 1.10 !peak 158 assign (resid 136 and name HG* ) (resid 149 and name HD1* ) 3.61 1.81 1.81 !peak 41 assign (resid 136 and name HD* ) (resid 137 and name HN ) 3.00 1.20 1.20 !peak 622 assign (resid 136 and name HD* ) (resid 137 and name HA ) 3.57 1.77 1.77 !peak 1341 assign (resid 136 and name HD* ) (resid 137 and name HB ) 3.22 1.42 1.42 !peak 1343 assign (resid 137 and name HA ) (resid 138 and name HG* ) 3.26 1.46 1.47 !peak 129 assign (resid 137 and name HG1* ) (resid 144 and name HB* ) 3.18 1.38 1.38 !peak 167 assign (resid 138 and name HN ) (resid 138 and name HG* ) 2.58 0.78 0.78 !peak 529 assign (resid 138 and name HN ) (resid 144 and name HB* ) 4.10 2.30 2.30 !peak 526 assign (resid 138 and name HG* ) (resid 139 and name HN ) 2.63 0.83 0.83 !peak 563 assign (resid 138 and name HG* ) (resid 139 and name HA ) 3.35 1.55 1.55 !peak 1011 assign (resid 138 and name HG* ) (resid 145 and name HB ) 3.64 1.84 1.84 !peak 7 assign (resid 138 and name HG* ) (resid 145 and name HG* ) 2.82 1.02 1.02 !peak 139 assign (resid 138 and name HG* ) (resid 147 and name HN ) 3.48 1.68 1.68 !peak 125 assign (resid 138 and name HG* ) (resid 147 and name HG* ) 3.44 1.64 1.64 !peak 128 assign (resid 138 and name HG* ) (resid 161 and name HG1* ) 4.12 2.32 2.32 !peak 428 assign (resid 138 and name HG* ) (resid 174 and name HD2* ) 3.82 2.02 2.02 !peak 454 assign (resid 138 and name HG* ) (resid 176 and name HD1* ) 3.45 1.65 1.65 !peak 434 assign (resid 138 and name HG* ) (resid 176 and name HD2* ) 3.28 1.48 1.48 !peak 189 assign (resid 139 and name HA ) (resid 140 and name HG* ) 3.21 1.41 1.41 !peak 148 assign (resid 139 and name HB* ) (resid 144 and name HA ) 3.57 1.77 1.77 !peak 991 assign (resid 140 and name HN ) (resid 140 and name HG* ) 2.40 0.60 0.60 !peak 604 assign (resid 140 and name HN ) (resid 143 and name HD* ) 4.13 2.33 2.33 !peak 596 assign (resid 140 and name HG* ) (resid 141 and name HN ) 3.13 1.33 1.33 !peak 900 assign (resid 140 and name HG* ) (resid 141 and name HA ) 3.75 1.95 1.95 !peak 908 assign (resid 140 and name HG* ) (resid 141 and name HB* ) 3.33 1.53 1.53 !peak 376 assign (resid 140 and name HG* ) (resid 142 and name HN ) 3.70 1.90 1.90 !peak 42 assign (resid 140 and name HG* ) (resid 143 and name HN ) 3.06 1.26 1.26 !peak 363 assign (resid 140 and name HG* ) (resid 143 and name HD* ) 3.68 1.88 1.88 !peak 1372 assign (resid 140 and name HG* ) (resid 174 and name HD1* ) 3.54 1.74 1.74 !peak 300 assign (resid 140 and name HG* ) (resid 174 and name HD2* ) 3.29 1.49 1.49 !peak 405 assign (resid 142 and name HA* ) (resid 143 and name HB1 ) 3.91 2.11 2.11 !peak 1646 assign (resid 143 and name HN ) (resid 143 and name HG* ) 3.36 1.56 1.56 !peak 1932 assign (resid 143 and name HA ) (resid 143 and name HG* ) 2.82 1.02 1.02 !peak 1934 assign (resid 143 and name HA ) (resid 143 and name HD* ) 3.43 1.63 1.63 !peak 1368 assign (resid 143 and name HB2 ) (resid 143 and name HD* ) 2.68 0.88 0.88 !peak 1370 assign (resid 143 and name HG* ) (resid 144 and name HN ) 3.02 1.22 1.22 !peak 1931 assign (resid 143 and name HD* ) (resid 145 and name HG* ) 3.40 1.60 1.60 !peak 155 assign (resid 143 and name HD* ) (resid 164 and name HE* ) 3.43 1.63 1.63 !peak 591 assign (resid 144 and name HN ) (resid 144 and name HB* ) 2.36 0.56 0.56 !peak 650 assign (resid 144 and name HA ) (resid 145 and name HG* ) 2.99 1.19 1.19 !peak 149 assign (resid 144 and name HB* ) (resid 144 and name HD* ) 2.68 0.88 0.88 !peak 1349 assign (resid 145 and name HN ) (resid 145 and name HG* ) 2.70 0.90 0.90 !peak 146 assign (resid 145 and name HA ) (resid 145 and name HG* ) 2.43 0.63 0.63 !peak 1189 assign (resid 145 and name HG* ) (resid 146 and name HN ) 2.50 0.70 0.70 !peak 517 assign (resid 145 and name HG* ) (resid 146 and name HA ) 3.02 1.22 1.22 !peak 151 assign (resid 145 and name HG* ) (resid 161 and name HG1* ) 2.94 1.14 1.14 !peak 96 assign (resid 145 and name HG* ) (resid 161 and name HG2* ) 3.01 1.21 1.21 !peak 136 assign (resid 145 and name HG* ) (resid 164 and name HG* ) 2.89 1.09 1.09 !peak 206 assign (resid 145 and name HG* ) (resid 164 and name HE* ) 2.67 0.87 0.87 !peak 496 assign (resid 145 and name HG* ) (resid 174 and name HD2* ) 3.39 1.59 1.59 !peak 405 assign (resid 145 and name HG* ) (resid 176 and name HG ) 3.85 2.05 2.05 !peak 135 assign (resid 145 and name HG* ) (resid 176 and name HD1* ) 2.85 1.05 1.05 !peak 214 assign (resid 145 and name HG* ) (resid 176 and name HD2* ) 2.90 1.10 1.10 !peak 188 assign (resid 146 and name HB* ) (resid 147 and name HN ) 2.92 1.12 1.12 !peak 715 assign (resid 147 and name HN ) (resid 147 and name HG* ) 3.13 1.33 1.33 !peak 181 assign (resid 147 and name HG* ) (resid 148 and name HN ) 2.59 0.79 0.79 !peak 767 assign (resid 147 and name HG* ) (resid 149 and name HN ) 3.50 1.70 1.70 !peak 831 assign (resid 147 and name HG* ) (resid 149 and name HG12 ) 3.67 1.87 1.87 !peak 319 assign (resid 147 and name HG* ) (resid 149 and name HD1* ) 3.23 1.43 1.43 !peak 43 assign (resid 147 and name HG* ) (resid 159 and name HG2* ) 2.82 1.02 1.03 !peak 59 assign (resid 147 and name HG* ) (resid 159 and name HG1* ) 3.18 1.38 1.38 !peak 187 assign (resid 147 and name HG* ) (resid 159 and name HD1* ) 3.21 1.41 1.41 !peak 52 assign (resid 147 and name HG* ) (resid 176 and name HB1 ) 3.25 1.45 1.45 !peak 721 assign (resid 147 and name HG* ) (resid 176 and name HG ) 3.92 2.12 2.12 !peak 459 assign (resid 147 and name HG* ) (resid 176 and name HD1* ) 2.96 1.16 1.16 !peak 214 assign (resid 147 and name HG* ) (resid 176 and name HD2* ) 3.23 1.43 1.43 !peak 105 assign (resid 148 and name HN ) (resid 148 and name HB* ) 2.58 0.78 0.78 !peak 764 assign (resid 148 and name HN ) (resid 148 and name HG* ) 3.16 1.36 1.36 !peak 765 assign (resid 148 and name HN ) (resid 148 and name HD* ) 3.75 1.95 1.95 !peak 1327 assign (resid 148 and name HA ) (resid 148 and name HG* ) 2.95 1.15 1.15 !peak 2000 assign (resid 148 and name HB* ) (resid 148 and name HD* ) 2.71 0.91 0.91 !peak 1784 assign (resid 148 and name HB* ) (resid 149 and name HN ) 3.36 1.56 1.56 !peak 828 assign (resid 148 and name HG* ) (resid 149 and name HN ) 3.30 1.50 1.50 !peak 1991 assign (resid 148 and name HD* ) (resid 149 and name HN ) 3.79 1.99 1.99 !peak 824 assign (resid 151 and name HB* ) (resid 153 and name HN ) 3.73 1.93 1.93 !peak 229 assign (resid 154 and name HN ) (resid 154 and name HD* ) 3.63 1.83 1.83 !peak 301 assign (resid 154 and name HA ) (resid 154 and name HD* ) 3.38 1.58 1.57 !peak 1329 assign (resid 154 and name HD* ) (resid 155 and name HN ) 3.64 1.84 1.84 !peak 439 assign (resid 155 and name HN ) (resid 155 and name HB* ) 2.45 0.65 0.65 !peak 440 assign (resid 155 and name HN ) (resid 155 and name HG* ) 3.35 1.55 1.55 !peak 1468 assign (resid 155 and name HB* ) (resid 157 and name HN ) 4.35 2.55 2.55 !peak 314 assign (resid 155 and name HB* ) (resid 180 and name HN ) 3.08 1.28 1.28 !peak 701 assign (resid 155 and name HB* ) (resid 180 and name HD1* ) 3.13 1.33 1.33 !peak 377 assign (resid 155 and name HG* ) (resid 156 and name HN ) 3.19 1.39 1.39 !peak 402 assign (resid 155 and name HG* ) (resid 180 and name HN ) 3.44 1.64 1.64 !peak 700 assign (resid 156 and name HN ) (resid 177 and name HG* ) 2.91 1.11 1.11 !peak 406 assign (resid 156 and name HN ) (resid 179 and name HD* ) 3.64 1.84 1.84 !peak 401 assign (resid 156 and name HA2 ) (resid 177 and name HG* ) 2.84 1.04 1.04 !peak 174 assign (resid 156 and name HA1 ) (resid 177 and name HG* ) 3.42 1.62 1.62 !peak 1319 assign (resid 157 and name HA ) (resid 158 and name HG* ) 3.12 1.32 1.32 !peak 1184 assign (resid 158 and name HN ) (resid 158 and name HG* ) 2.50 0.70 0.70 !peak 495 assign (resid 158 and name HA ) (resid 177 and name HG* ) 3.06 1.26 1.26 !peak 169 assign (resid 158 and name HG* ) (resid 159 and name HN ) 2.45 0.65 0.65 !peak 916 assign (resid 158 and name HG* ) (resid 160 and name HA ) 3.17 1.37 1.37 !peak 662 assign (resid 158 and name HG* ) (resid 160 and name HD* ) 3.92 2.12 2.12 !peak 1326 assign (resid 158 and name HG* ) (resid 175 and name HD1* ) 3.31 1.51 1.51 !peak 196 assign (resid 158 and name HG* ) (resid 175 and name HD2* ) 3.01 1.21 1.21 !peak 195 assign (resid 158 and name HG* ) (resid 177 and name HG* ) 2.84 1.04 1.04 !peak 150 assign (resid 159 and name HN ) (resid 159 and name HG1* ) 3.20 1.40 1.40 !peak 914 assign (resid 159 and name HA ) (resid 159 and name HG1* ) 2.89 1.09 1.09 !peak 612 assign (resid 159 and name HG2* ) (resid 159 and name HG1* ) 2.53 0.73 0.73 !peak 49 assign (resid 159 and name HG1* ) (resid 160 and name HN ) 3.55 1.75 1.75 !peak 843 assign (resid 160 and name HN ) (resid 160 and name HB* ) 2.46 0.66 0.66 !peak 841 assign (resid 160 and name HN ) (resid 160 and name HG* ) 3.16 1.36 1.36 !peak 844 assign (resid 160 and name HN ) (resid 160 and name HD* ) 3.49 1.69 1.69 !peak 840 assign (resid 160 and name HA ) (resid 160 and name HG* ) 2.93 1.13 1.14 !peak 1960 assign (resid 160 and name HB* ) (resid 161 and name HN ) 3.06 1.26 1.26 !peak 885 assign (resid 160 and name HB* ) (resid 175 and name HD2* ) 3.25 1.45 1.45 !peak 1661 assign (resid 160 and name HG* ) (resid 161 and name HN ) 2.93 1.13 1.14 !peak 887 assign (resid 161 and name HG2* ) (resid 164 and name HG* ) 2.68 0.88 0.88 !peak 510 assign (resid 162 and name HB2 ) (resid 163 and name HA* ) 3.55 1.75 1.75 !peak 1729 assign (resid 163 and name HA* ) (resid 165 and name HN ) 3.38 1.58 1.58 !peak 87 assign (resid 164 and name HN ) (resid 164 and name HG* ) 3.07 1.27 1.27 !peak 1551 assign (resid 164 and name HN ) (resid 165 and name HA* ) 3.44 1.64 1.64 !peak 250 assign (resid 164 and name HG* ) (resid 164 and name HE* ) 2.81 1.01 1.01 !peak 592 assign (resid 165 and name HA* ) (resid 173 and name HN ) 3.30 1.50 1.50 !peak 375 assign (resid 165 and name HA* ) (resid 175 and name HN ) 3.88 2.08 2.08 !peak 811 assign (resid 167 and name HN ) (resid 167 and name HG* ) 2.62 0.82 0.82 !peak 453 assign (resid 167 and name HA ) (resid 167 and name HG* ) 2.90 1.10 1.10 !peak 1587 assign (resid 167 and name HG* ) (resid 168 and name HN ) 3.58 1.78 1.78 !peak 1586 assign (resid 171 and name HB* ) (resid 172 and name HN ) 2.84 1.04 1.04 !peak 74 assign (resid 171 and name HG* ) (resid 172 and name HN ) 3.59 1.79 1.79 !peak 73 assign (resid 173 and name HN ) (resid 173 and name HB* ) 2.67 0.87 0.87 !peak 377 assign (resid 173 and name HB* ) (resid 174 and name HN ) 2.84 1.04 1.04 !peak 339 assign (resid 173 and name HB* ) (resid 175 and name HN ) 3.91 2.11 2.11 !peak 1000 assign (resid 177 and name HN ) (resid 177 and name HG* ) 3.04 1.24 1.24 !peak 165 assign (resid 177 and name HG* ) (resid 178 and name HN ) 2.84 1.04 1.04 !peak 164 assign (resid 177 and name HG* ) (resid 178 and name HB ) 3.45 1.65 1.65 !peak 429 assign (resid 177 and name HG* ) (resid 179 and name HN ) 3.80 2.00 2.00 !peak 168 assign (resid 177 and name HG* ) (resid 179 and name HD* ) 3.20 1.40 1.40 !peak 176 assign (resid 179 and name HN ) (resid 179 and name HD* ) 3.69 1.89 1.89 !peak 854 assign (resid 179 and name HD* ) (resid 180 and name HN ) 3.26 1.46 1.47 !peak 699 assign (resid 181 and name HN ) (resid 182 and name HD* ) 3.38 1.58 1.58 !peak 735 assign (resid 181 and name HA ) (resid 182 and name HG* ) 3.40 1.60 1.60 !peak 913 assign (resid 181 and name HB2 ) (resid 182 and name HD* ) 3.30 1.50 1.50 !peak 792 assign (resid 181 and name HB1 ) (resid 182 and name HD* ) 2.65 0.85 0.85 !peak 880 assign (resid 182 and name HB* ) (resid 183 and name HN ) 3.03 1.23 1.23 !peak 680 assign (resid 182 and name HG* ) (resid 183 and name HN ) 3.00 1.20 1.20 !peak 681 assign (resid 182 and name HD* ) (resid 183 and name HN ) 3.29 1.49 1.49 !peak 678 assign (resid 183 and name HN ) (resid 183 and name HB* ) 2.73 0.93 0.93 !peak 679 assign (resid 96 and name HN ) (resid 126 and name HB ) 4.20 2.40 2.40 ! assign (resid 96 and name HG2* ) (resid 126 and name HG2* ) 4.20 2.40 2.40 !peak 358 assign (resid 96 and name HG2* ) (resid 126 and name HB ) 4.20 2.40 2.40 ! assign (resid 96 and name HG2* ) (resid 136 and name HD* ) 3.65 1.85 1.85 ! assign (resid 97 and name HG2* ) (resid 123 and name HD2* ) 3.28 1.48 1.48 !peak 65 assign (resid 97 and name HG2* ) (resid 136 and name HD* ) 3.65 1.85 1.85 !peak 63 assign (resid 97 and name HN ) (resid 138 and name HG1* ) 3.65 1.85 1.85 !peak 960 assign (resid 97 and name HG2* ) (resid 138 and name HG1* ) 3.65 1.85 1.85 !peak 67 assign (resid 97 and name HD1* ) (resid 124 and name HG* ) 3.65 1.85 1.85 !peak 1904 assign (resid 97 and name HD1* ) (resid 138 and name HG1* ) 3.65 1.85 1.85 !peak 34 assign (resid 98 and name HB* ) (resid 138 and name HG2* ) 3.65 1.85 1.85 !peak 118 assign (resid 98 and name HB* ) (resid 139 and name HG2 ) 3.65 1.85 1.85 !peak 119 assign (resid 98 and name HB* ) (resid 139 and name HB* ) 3.65 1.85 1.85 ! assign (resid 99 and name HN ) (resid 140 and name HG* ) 2.97 1.17 1.17 !peak 504 assign (resid 99 and name HB* ) (resid 121 and name HA ) 3.50 1.70 1.70 !peak 1248 assign (resid 99 and name HB* ) (resid 122 and name HN ) 3.22 1.42 1.42 !peak 417 assign (resid 99 and name HB* ) (resid 138 and name HG2* ) 3.17 1.37 1.37 !peak 155 assign (resid 99 and name HB* ) (resid 140 and name HB ) 3.41 1.61 1.61 !peak 1060 assign (resid 99 and name HD* ) (resid 100 and name HN ) 3.19 1.39 1.39 !peak 992 assign (resid 99 and name HD* ) (resid 121 and name HB* ) 2.62 0.82 0.82 !peak 582 assign (resid 99 and name HD* ) (resid 122 and name HN ) 3.79 1.99 1.99 !peak 704 assign (resid 99 and name HD* ) (resid 123 and name HA ) 2.95 1.15 1.15 !peak 711 assign (resid 99 and name HD* ) (resid 123 and name HG ) 3.25 1.45 1.45 !peak 21 assign (resid 99 and name HD* ) (resid 123 and name HD* ) 2.75 0.95 0.95 !peak 400 assign (resid 99 and name HD* ) (resid 124 and name HG* ) 3.51 1.71 1.71 !peak 721 assign (resid 99 and name HD* ) (resid 124 and name HD2 ) 2.96 1.16 1.16 !peak 718 assign (resid 99 and name HD* ) (resid 124 and name HD1 ) 3.09 1.29 1.29 !peak 720 assign (resid 99 and name HD* ) (resid 138 and name HB ) 3.06 1.26 1.26 !peak 628 assign (resid 99 and name HD* ) (resid 138 and name HG1* ) 2.72 0.92 0.92 !peak 247 assign (resid 99 and name HD* ) (resid 138 and name HG2* ) 2.69 0.89 0.89 !peak 157 assign (resid 99 and name HD* ) (resid 145 and name HG* ) 2.90 1.10 1.10 !peak 247 assign (resid 99 and name HD* ) (resid 147 and name HG* ) 3.00 1.20 1.20 !peak 127 assign (resid 99 and name HD* ) (resid 174 and name HD* ) 3.01 1.21 1.21 !peak 423 assign (resid 99 and name HD* ) (resid 176 and name HG ) 3.18 1.38 1.38 !peak 243 assign (resid 99 and name HD* ) (resid 176 and name HD1* ) 2.82 1.02 1.03 !peak 189 assign (resid 99 and name HD* ) (resid 176 and name HD2* ) 2.78 0.98 0.98 !peak 241 assign (resid 100 and name HB* ) (resid 119 and name HD2* ) 3.65 1.85 1.85 !peak 215 assign (resid 100 and name HB* ) (resid 140 and name HG* ) 3.61 1.81 1.81 !peak 129 assign (resid 101 and name HN ) (resid 140 and name HG1* ) 3.51 1.71 1.71 !peak 196 assign (resid 101 and name HD1* ) (resid 140 and name HG1* ) 3.23 1.43 1.43 !peak 444 assign (resid 101 and name HD1* ) (resid 141 and name HA ) 3.29 1.49 1.49 !peak 556 assign (resid 101 and name HD1* ) (resid 119 and name HD1* ) 3.11 1.31 1.31 ! assign (resid 101 and name HD1* ) (resid 119 and name HD2* ) 3.11 1.31 1.31 ! assign (resid 101 and name HD2* ) (resid 119 and name HB* ) 3.15 1.35 1.36 !peak 392 assign (resid 101 and name HD1* ) (resid 174 and name HD1* ) 3.10 1.30 1.30 !peak 403 assign (resid 101 and name HD1* ) (resid 176 and name HD2* ) 3.91 2.11 2.11 !peak 465 assign (resid 102 and name HD1* ) (resid 121 and name HB* ) 3.45 1.65 1.65 !peak 351 assign (resid 102 and name HD1* ) (resid 122 and name HB2 ) 3.77 1.97 1.97 !peak 386 assign (resid 102 and name HD1* ) (resid 122 and name HG1 ) 3.42 1.62 1.62 !peak 348
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