NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
25972 | 2kdh | 17243 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign ( resid 148 and name HG2# ) ( resid 149 and name HN ) 4.36 2.56 0.00 peak 16 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA2 ) ( resid 148 and name HG2# ) 5.46 3.66 0.00 peak 17 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 153 and name HB2 ) 4.32 2.52 0.00 peak 18 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 148 and name HG1# ) 4.45 2.65 0.00 peak 20 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 148 and name HD1# ) 4.45 2.65 0.00 peak 21 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 153 and name HD# ) 4.92 3.12 0.00 peak 23 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HA ) ( resid 148 and name HG2# ) 4.66 2.86 0.00 peak 24 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 152 and name HB2 ) 4.67 2.87 0.00 peak 25 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 152 and name HB1 ) 4.67 2.87 0.00 peak 26 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 148 and name HG1# ) 4.45 2.65 0.00 peak 28 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 148 and name HG2# ) 5.44 3.64 0.00 peak 29 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HD1# ) ( resid 120 and name HE# ) 5.25 3.45 0.00 peak 30 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HD# ) ( resid 119 and name HG2# ) 4.79 2.99 0.00 peak 35 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HG2 ) ( resid 119 and name HG2# ) 6.00 4.20 0.00 peak 36 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HG1 ) ( resid 119 and name HG2# ) 6.00 4.20 0.00 peak 36 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HG2# ) ( resid 119 and name HD1# ) 4.30 2.50 0.00 peak 39 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HN ) ( resid 128 and name HG2# ) 5.44 3.64 0.00 peak 41 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HA ) ( resid 128 and name HG2# ) 4.93 3.13 0.00 peak 42 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG2# ) ( resid 128 and name HG1# ) 4.96 3.16 0.00 peak 43 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG2# ) ( resid 128 and name HG1# ) 4.96 3.16 0.00 peak 44 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HD# ) ( resid 120 and name HE# ) 4.46 2.66 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 148 and name HN ) 4.85 3.05 0.00 peak 48 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 147 and name HN ) 5.63 3.83 0.00 peak 50 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HA ) ( resid 137 and name HE# ) 4.22 2.42 0.00 peak 51 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 147 and name HA ) 4.56 2.76 0.00 peak 51 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 137 and name HE# ) 4.51 2.71 0.00 peak 52 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HG2 ) ( resid 137 and name HE# ) 4.25 2.45 0.00 peak 55 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HG1 ) ( resid 137 and name HE# ) 4.25 2.45 0.00 peak 55 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HG ) ( resid 137 and name HE# ) 3.48 1.68 0.00 peak 57 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 148 and name HG1# ) 3.91 2.11 0.00 peak 58 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 148 and name HG2# ) 5.52 3.72 0.00 peak 60 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 148 and name HG1# ) 3.91 2.11 0.00 peak 61 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 148 and name HD1# ) 4.30 2.50 0.00 peak 62 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 113 and name HN ) 4.73 2.93 0.00 peak 63 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HA ) ( resid 112 and name HG2# ) 4.70 2.90 0.00 peak 64 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 117 and name HA ) 4.81 3.01 0.00 peak 65 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 116 and name HB1 ) 4.52 2.72 0.00 peak 66 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 117 and name HG ) 4.29 2.49 0.00 peak 67 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 110 and name HA2 ) 5.14 3.34 0.00 peak 103 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HB ) ( resid 133 and name HD1# ) 5.13 3.33 0.00 peak 107 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HA ) ( resid 133 and name HD1# ) 4.91 3.11 0.00 peak 115 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HB# ) ( resid 102 and name HD# ) 4.71 2.91 0.00 peak 118 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HB ) ( resid 119 and name HD1# ) 4.86 3.06 0.00 peak 137 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 112 and name HD1# ) 4.40 2.60 0.00 peak 145 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HA ) ( resid 148 and name HD1# ) 4.97 3.17 0.00 peak 148 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HB# ) ( resid 136 and name HD2# ) 4.92 3.12 0.00 peak 174 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HB2 ) ( resid 150 and name HN ) 5.26 3.46 0.00 peak 175 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HB2 ) ( resid 97 and name HD2# ) 4.96 3.16 0.00 peak 184 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HB# ) ( resid 136 and name HG ) 4.00 2.20 0.00 peak 189 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HB1 ) ( resid 117 and name HD1# ) 5.24 3.44 0.00 peak 192 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HB1 ) ( resid 114 and name HN ) 4.90 3.10 0.00 peak 197 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HN ) ( resid 136 and name HB# ) 5.08 3.28 0.00 peak 200 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HB2 ) ( resid 155 and name HN ) 5.81 4.01 0.00 peak 203 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 121 and name HB2 ) 5.04 3.24 0.00 peak 216 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HN ) ( resid 115 and name HB2 ) 4.81 3.01 0.00 peak 225 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HN ) ( resid 151 and name HB1 ) 4.85 3.05 0.00 peak 228 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HB2 ) ( resid 152 and name HN ) 5.22 3.42 0.00 peak 231 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 153 and name HB1 ) 5.95 4.15 0.00 peak 251 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 141 and name HB2 ) 6.00 4.20 0.00 peak 262 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HB2 ) ( resid 144 and name HN ) 6.00 4.20 0.00 peak 265 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HN ) ( resid 104 and name HB2 ) 5.11 3.31 0.00 peak 269 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HB2 ) ( resid 153 and name HB2 ) 5.40 3.60 0.00 peak 275 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HB2 ) ( resid 150 and name HD# ) 5.52 3.72 0.00 peak 280 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HB ) ( resid 148 and name HB ) 4.71 2.91 0.00 peak 284 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HB1 ) ( resid 153 and name HB1 ) 6.00 4.20 0.00 peak 295 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HB2 ) ( resid 153 and name HB1 ) 6.00 4.20 0.00 peak 297 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HN ) ( resid 133 and name HB ) 4.57 2.77 0.00 peak 315 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HA ) ( resid 133 and name HB ) 5.16 3.36 0.00 peak 316 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 116 and name HG1 ) 5.25 3.45 0.00 peak 325 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 135 and name HG2 ) 6.00 4.20 0.00 peak 354 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 135 and name HG1 ) 6.00 4.20 0.00 peak 354 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HA ) ( resid 136 and name HB# ) 5.11 3.31 0.00 peak 364 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HA ) ( resid 136 and name HG ) 5.04 3.24 0.00 peak 366 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HA ) ( resid 133 and name HG2# ) 4.57 2.77 0.00 peak 367 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HA ) ( resid 133 and name HD1# ) 4.83 3.03 0.00 peak 367 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 119 and name HD1# ) 5.26 3.46 0.00 peak 376 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 119 and name HG1# ) 4.99 3.19 0.00 peak 380 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 119 and name HG2# ) 4.56 2.76 0.00 peak 381 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 119 and name HG1# ) 4.99 3.19 0.00 peak 382 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HB2 ) ( resid 99 and name HN ) 5.71 3.91 0.00 peak 392 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HB1 ) ( resid 99 and name HN ) 5.71 3.91 0.00 peak 392 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HB2 ) ( resid 116 and name HB1 ) 6.00 4.20 0.00 peak 397 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HB1 ) ( resid 116 and name HB1 ) 6.00 4.20 0.00 peak 397 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HA ) ( resid 128 and name HN ) 4.57 2.77 0.00 peak 406 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HB2 ) ( resid 158 and name HD# ) 4.71 2.91 0.00 peak 413 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HB1 ) ( resid 158 and name HD# ) 4.71 2.91 0.00 peak 413 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 124 and name HA ) ( resid 124 and name HG2# ) 4.95 3.15 0.00 peak 416 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HA ) ( resid 127 and name HG2# ) 5.16 3.36 0.00 peak 416 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HA ) ( resid 161 and name HA ) 5.60 3.80 0.00 peak 420 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HA ) ( resid 101 and name HD# ) 5.05 3.25 0.00 peak 432 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HA ) ( resid 112 and name HD1# ) 5.20 3.40 0.00 peak 434 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HA ) ( resid 101 and name HB1 ) 5.13 3.33 0.00 peak 450 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HA ) ( resid 153 and name HD# ) 4.78 2.98 0.00 peak 451 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HA ) ( resid 156 and name HB1 ) 5.14 3.34 0.00 peak 455 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HA ) ( resid 156 and name HB2 ) 5.14 3.34 0.00 peak 456 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 153 and name HA ) 4.93 3.13 0.00 peak 457 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 133 and name HA ) 5.86 4.06 0.00 peak 469 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HA ) ( resid 118 and name HA ) 5.85 4.05 0.00 peak 470 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 118 and name HG1 ) 4.98 3.18 0.00 peak 473 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 133 and name HG2# ) 4.80 3.00 0.00 peak 474 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 133 and name HD1# ) 4.73 2.93 0.00 peak 474 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 118 and name HD# ) 5.66 3.86 0.00 peak 476 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 118 and name HG2 ) 4.98 3.18 0.00 peak 477 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HB2 ) ( resid 118 and name HD# ) 4.52 2.72 0.00 peak 483 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HB1 ) ( resid 118 and name HD# ) 4.52 2.72 0.00 peak 483 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HA ) ( resid 94 and name HG# ) 4.86 3.06 0.00 peak 493 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HN ) ( resid 116 and name HB1 ) 5.37 3.57 0.00 peak 497 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HA ) ( resid 95 and name HG2 ) 5.09 3.29 0.00 peak 501 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HA ) ( resid 95 and name HG1 ) 5.09 3.29 0.00 peak 501 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 134 and name HG2 ) 5.07 3.27 0.00 peak 520 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 134 and name HG1 ) 5.07 3.27 0.00 peak 521 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 137 and name HB2 ) 5.11 3.31 0.00 peak 521 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 137 and name HB1 ) 5.11 3.31 0.00 peak 522 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 134 and name HA ) 4.55 2.75 0.00 peak 523 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HA ) ( resid 104 and name HD# ) 5.61 3.81 0.00 peak 537 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HA ) ( resid 158 and name HD# ) 5.75 3.95 0.00 peak 549 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HA ) ( resid 135 and name HG2 ) 5.14 3.34 0.00 peak 552 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HA ) ( resid 135 and name HG1 ) 5.14 3.34 0.00 peak 552 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HN ) ( resid 134 and name HB# ) 5.06 3.26 0.00 peak 556 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HA ) ( resid 99 and name HN ) 5.31 3.51 0.00 peak 562 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 114 and name HD2# ) 4.55 2.75 0.00 peak 569 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HA ) ( resid 102 and name HD# ) 5.45 3.65 0.00 peak 576 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HA ) ( resid 105 and name HB2 ) 5.40 3.60 0.00 peak 577 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 117 and name HB2 ) 4.71 2.91 0.00 peak 578 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 114 and name HG ) 4.59 2.79 0.00 peak 579 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HA ) ( resid 116 and name HA ) 5.87 4.07 0.00 peak 590 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HA ) ( resid 119 and name HB ) 4.55 2.75 0.00 peak 594 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HA ) ( resid 119 and name HD1# ) 5.01 3.21 0.00 peak 601 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HA ) ( resid 138 and name HN ) 5.83 4.03 0.00 peak 602 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HB ) ( resid 120 and name HA ) 5.67 3.87 0.00 peak 608 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HA ) ( resid 158 and name HN ) 5.56 3.76 0.00 peak 615 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HA ) ( resid 105 and name HB1 ) 5.40 3.60 0.00 peak 616 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HA ) ( resid 142 and name HD2 ) 6.00 4.20 0.00 peak 621 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HA ) ( resid 142 and name HD1 ) 6.00 4.20 0.00 peak 621 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 161 and name HA ) ( resid 161 and name HG# ) 4.38 2.58 0.00 peak 625 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HB1 ) ( resid 154 and name HA ) 5.49 3.69 0.00 peak 627 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HA ) ( resid 154 and name HG ) 5.05 3.25 0.00 peak 629 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HA ) ( resid 100 and name HN ) 5.44 3.64 0.00 peak 633 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HA ) ( resid 97 and name HD2# ) 4.91 3.11 0.00 peak 638 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HA ) ( resid 137 and name HE# ) 5.32 3.52 0.00 peak 644 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD1# ) ( resid 137 and name HA ) 5.31 3.51 0.00 peak 648 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HA ) ( resid 117 and name HN ) 5.48 3.68 0.00 peak 661 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HA ) ( resid 100 and name HG ) 4.55 2.75 0.00 peak 663 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HA ) ( resid 118 and name HD# ) 5.13 3.33 0.00 peak 673 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HA ) ( resid 121 and name HG ) 5.05 3.25 0.00 peak 677 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HA ) ( resid 117 and name HG ) 5.06 3.26 0.00 peak 680 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HA ) ( resid 117 and name HD2# ) 4.38 2.58 0.00 peak 681 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HA ) ( resid 134 and name HN ) 4.92 3.12 0.00 peak 690 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HA ) ( resid 102 and name HB# ) 5.42 3.62 0.00 peak 692 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HG ) ( resid 115 and name HN ) 5.72 3.92 0.00 peak 698 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HB2 ) ( resid 117 and name HD1# ) 4.48 2.68 0.00 peak 720 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 117 and name HD1# ) 5.30 3.50 0.00 peak 724 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HB1 ) ( resid 97 and name HD2# ) 4.96 3.16 0.00 peak 727 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HA ) ( resid 126 and name HA ) 6.00 4.20 0.00 peak 738 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HB# ) ( resid 114 and name HD1# ) 4.29 2.49 0.00 peak 768 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HA ) ( resid 157 and name HA ) 5.74 3.94 0.00 peak 781 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 134 and name HG2 ) 5.40 3.60 0.00 peak 784 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 134 and name HG1 ) 5.40 3.60 0.00 peak 785 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 137 and name HE# ) 4.62 2.82 0.00 peak 786 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HB# ) ( resid 114 and name HD2# ) 4.42 2.62 0.00 peak 787 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HB# ) ( resid 136 and name HD1# ) 4.92 3.12 0.00 peak 789 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HA ) ( resid 97 and name HD1# ) 4.91 3.11 0.00 peak 798 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HB1 ) ( resid 97 and name HD1# ) 4.96 3.16 0.00 peak 800 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HB2 ) ( resid 117 and name HD2# ) 4.57 2.77 0.00 peak 804 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HB1 ) ( resid 117 and name HD2# ) 4.42 2.62 0.00 peak 805 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD2# ) ( resid 148 and name HG2# ) 4.88 3.08 0.00 peak 806 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HA ) ( resid 129 and name HG2# ) 4.38 2.58 0.00 peak 814 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 110 and name HA1 ) 5.89 4.09 0.00 peak 824 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HA ) ( resid 94 and name HA ) 5.46 3.66 0.00 peak 825 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 91 and name HA# ) ( resid 97 and name HA ) 5.23 3.43 0.00 peak 829 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 111 and name HA ) 5.28 3.48 0.00 peak 836 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HA ) ( resid 124 and name HG2# ) 5.44 3.64 0.00 peak 842 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA2 ) ( resid 156 and name HD# ) 5.78 3.98 0.00 peak 863 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA2 ) ( resid 148 and name HD1# ) 5.40 3.60 0.00 peak 864 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HA ) ( resid 152 and name HB2 ) 5.37 3.57 0.00 peak 869 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HA ) ( resid 152 and name HB1 ) 5.64 3.84 0.00 peak 870 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB1 ) ( resid 156 and name HB1 ) 6.00 4.20 0.00 peak 903 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB1 ) ( resid 156 and name HB2 ) 6.00 4.20 0.00 peak 904 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HA ) ( resid 116 and name HB1 ) 6.00 4.20 0.00 peak 919 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HB1 ) ( resid 150 and name HN ) 5.26 3.46 0.00 peak 927 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HB1 ) ( resid 148 and name HN ) 5.62 3.82 0.00 peak 935 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG2# ) ( resid 132 and name HB2 ) 5.66 3.86 0.00 peak 944 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HB2 ) ( resid 133 and name HD1# ) 6.00 4.20 0.00 peak 944 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG2# ) ( resid 132 and name HB1 ) 5.66 3.86 0.00 peak 945 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HB1 ) ( resid 133 and name HD1# ) 6.00 4.20 0.00 peak 945 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 141 and name HB1 ) 6.00 4.20 0.00 peak 958 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HA ) ( resid 139 and name HB2 ) 5.69 3.89 0.00 peak 960 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HG2 ) ( resid 119 and name HA ) 6.00 4.20 0.00 peak 978 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 121 and name HB1 ) 5.91 4.11 0.00 peak 1010 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HB ) ( resid 148 and name HD1# ) 6.00 4.20 0.00 peak 1012 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HB# ) ( resid 117 and name HB2 ) 5.72 3.92 0.00 peak 1031 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HB# ) ( resid 137 and name HE# ) 5.27 3.47 0.00 peak 1032 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA1 ) ( resid 148 and name HG2# ) 5.46 3.66 0.00 peak 1090 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HB ) ( resid 148 and name HG2# ) 5.74 3.94 0.00 peak 1091 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 106 and name HG1 ) 6.00 4.20 0.00 peak 1109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 158 and name HG1 ) 6.00 4.20 0.00 peak 1109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 137 and name HG1 ) 5.49 3.69 0.00 peak 1124 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 137 and name HG2 ) 5.49 3.69 0.00 peak 1125 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HG# ) ( resid 97 and name HG ) 5.62 3.82 0.00 peak 1147 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HG2# ) ( resid 131 and name HN ) 5.45 3.65 0.00 peak 1151 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HN ) ( resid 128 and name HG1# ) 5.80 4.00 0.00 peak 1157 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HN ) ( resid 122 and name HG1 ) 5.63 3.83 0.00 peak 1168 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HG1 ) ( resid 119 and name HA ) 6.00 4.20 0.00 peak 1181 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 106 and name HG2 ) 6.00 4.20 0.00 peak 1195 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HG2 ) ( resid 103 and name HN ) 6.00 4.20 0.00 peak 1211 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HN ) ( resid 100 and name HG ) 5.67 3.87 0.00 peak 1214 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HG ) ( resid 153 and name HZ ) 6.00 4.20 0.00 peak 1215 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HE# ) ( resid 119 and name HG2# ) 5.29 3.49 0.00 peak 1235 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HE# ) ( resid 119 and name HD1# ) 5.38 3.58 0.00 peak 1240 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HA ) ( resid 157 and name HE# ) 5.49 3.69 0.00 peak 1243 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HB2 ) ( resid 102 and name HD# ) 5.87 4.07 0.00 peak 1251 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HB1 ) ( resid 102 and name HD# ) 5.87 4.07 0.00 peak 1252 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA1 ) ( resid 148 and name HD1# ) 5.40 3.60 0.00 peak 1256 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HB ) ( resid 148 and name HD1# ) 5.02 3.22 0.00 peak 1258 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD1# ) ( resid 148 and name HD1# ) 4.08 2.28 0.00 peak 1261 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD2# ) ( resid 148 and name HD1# ) 4.30 2.50 0.00 peak 1261 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD1# ) ( resid 118 and name HN ) 6.00 4.20 0.00 peak 1262 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HB2 ) ( resid 97 and name HD1# ) 4.96 3.16 0.00 peak 1271 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HN ) ( resid 133 and name HD1# ) 5.36 3.56 0.00 peak 1272 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HB ) ( resid 112 and name HD1# ) 5.06 3.26 0.00 peak 1276 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HB1 ) ( resid 112 and name HD1# ) 5.32 3.52 0.00 peak 1277 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HB2 ) ( resid 112 and name HD1# ) 5.32 3.52 0.00 peak 1278 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HA ) ( resid 112 and name HD1# ) 5.34 3.54 0.00 peak 1280 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HD# ) ( resid 112 and name HD1# ) 5.33 3.53 0.00 peak 1283 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HD1# ) ( resid 148 and name HD1# ) 5.28 3.48 0.00 peak 1284 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HN ) ( resid 148 and name HD1# ) 5.61 3.81 0.00 peak 1285 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HA ) ( resid 148 and name HD1# ) 5.46 3.66 0.00 peak 1286 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD1# ) ( resid 137 and name HE# ) 4.74 2.94 0.00 peak 1297 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HG1 ) ( resid 103 and name HN ) 6.00 4.20 0.00 peak 1326 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HD# ) ( resid 119 and name HD1# ) 5.62 3.82 0.00 peak 1331 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 116 and name HB2 ) 5.60 3.80 0.00 peak 1333 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HB2 ) ( resid 153 and name HD# ) 5.77 3.97 0.00 peak 1340 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HA ) ( resid 104 and name HD# ) 6.00 4.20 0.00 peak 1356 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HA ) ( resid 153 and name HE# ) 6.00 4.20 0.00 peak 1356 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HA ) ( resid 103 and name HN ) 6.00 4.20 0.00 peak 1357 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 141 and name HB2 ) 4.97 3.17 0.00 peak 1365 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HE# ) ( resid 120 and name HE# ) 5.37 3.57 0.00 peak 1366 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HN ) ( resid 137 and name HE# ) 4.37 2.57 0.00 peak 1368 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HZ# ) ( resid 119 and name HG2# ) 5.15 3.35 0.00 peak 1369 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HA ) ( resid 108 and name HB# ) 5.67 3.87 0.00 peak 1371 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 108 and name HB# ) ( resid 109 and name HA ) 6.00 4.20 0.00 peak 1371 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HE# ) ( resid 157 and name HE# ) 5.57 3.77 0.00 peak 1373 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA1 ) ( resid 156 and name HD# ) 5.78 3.98 0.00 peak 1382 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HN ) ( resid 110 and name HA2 ) 6.00 4.20 0.00 peak 1385 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 91 and name HA# ) ( resid 97 and name HN ) 5.80 4.00 0.00 peak 1386 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HN ) ( resid 110 and name HA1 ) 6.00 4.20 0.00 peak 1386 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HA ) ( resid 110 and name HA1 ) 5.58 3.78 0.00 peak 1388 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HD1# ) ( resid 153 and name HD# ) 6.00 4.20 0.00 peak 1398 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HB# ) ( resid 156 and name HE# ) 6.00 4.20 0.00 peak 1403 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB1 ) ( resid 156 and name HE# ) 6.00 4.20 0.00 peak 1404 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB2 ) ( resid 156 and name HE# ) 6.00 4.20 0.00 peak 1405 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HB1 ) ( resid 148 and name HD1# ) 5.95 4.15 0.00 peak 1413 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 141 and name HB1 ) 5.83 4.03 0.00 peak 1414 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 121 and name HB2 ) 5.91 4.11 0.00 peak 1421 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 122 and name HN ) 5.70 3.90 0.00 peak 1438 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 122 and name HG2 ) 6.00 4.20 0.00 peak 1439 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 120 and name HA ) 6.00 4.20 0.00 peak 1441 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 122 and name HG1 ) 6.00 4.20 0.00 peak 1445 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HB1 ) ( resid 97 and name HN ) 5.86 4.06 0.00 peak 1478 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HA ) ( resid 97 and name HN ) 5.66 3.86 0.00 peak 1487 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 138 and name HD2 ) 6.00 4.20 0.00 peak 1494 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 138 and name HD1 ) 6.00 4.20 0.00 peak 1495 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HG ) ( resid 117 and name HD1# ) 6.00 4.20 0.00 peak 1505 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HA ) ( resid 161 and name HN ) 4.55 2.75 0.00 peak 0 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HG1# ) ( resid 161 and name HN ) 5.78 3.98 0.00 peak 1 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HG2# ) ( resid 161 and name HN ) 5.78 3.98 0.00 peak 1 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 161 and name HN ) ( resid 161 and name HG# ) 5.73 3.93 0.00 peak 2 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HN ) ( resid 152 and name HN ) 5.69 3.89 0.00 peak 4 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HA ) ( resid 149 and name HN ) 4.03 2.23 0.00 peak 5 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HN ) ( resid 152 and name HB2 ) 4.59 2.79 0.00 peak 9 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HN ) ( resid 152 and name HB1 ) 5.43 3.63 0.00 peak 10 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HN ) ( resid 116 and name HN ) 5.50 3.70 0.00 peak 13 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HA ) ( resid 113 and name HN ) 4.12 2.32 0.00 peak 16 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HN ) ( resid 116 and name HB2 ) 4.49 2.69 0.00 peak 18 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 148 and name HN ) 5.00 3.20 0.00 peak 19 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HZ ) ( resid 112 and name HN ) 5.80 4.00 0.00 peak 20 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HA ) ( resid 112 and name HN ) 4.35 2.55 0.00 peak 21 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 148 and name HB ) 5.34 3.54 0.00 peak 23 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 112 and name HB ) 4.62 2.82 0.00 peak 24 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 148 and name HG2# ) 5.88 4.08 0.00 peak 25 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 112 and name HG2# ) 5.52 3.72 0.00 peak 26 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 112 and name HG1# ) 5.73 3.93 0.00 peak 26 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 112 and name HG1# ) 5.73 3.93 0.00 peak 27 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 112 and name HD1# ) 5.88 4.08 0.00 peak 28 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 112 and name HN ) 5.86 4.06 0.00 peak 29 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HD# ) ( resid 112 and name HN ) 5.83 4.03 0.00 peak 30 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 143 and name HA ) 6.00 4.20 0.00 peak 32 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HA ) ( resid 142 and name HN ) 4.14 2.34 0.00 peak 34 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HB2 ) ( resid 142 and name HN ) 5.91 4.11 0.00 peak 36 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 152 and name HB1 ) 5.31 3.51 0.00 peak 37 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HA ) ( resid 148 and name HN ) 4.29 2.49 0.00 peak 43 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HN ) ( resid 148 and name HB ) 4.50 2.70 0.00 peak 45 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HB2 ) ( resid 148 and name HN ) 5.62 3.82 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HN ) ( resid 148 and name HG1# ) 5.36 3.56 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HN ) ( resid 148 and name HG2# ) 6.00 4.20 0.00 peak 48 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HN ) ( resid 148 and name HG1# ) 5.36 3.56 0.00 peak 49 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HA ) ( resid 106 and name HN ) 4.14 2.34 0.00 peak 51 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 116 and name HB1 ) 4.91 3.11 0.00 peak 54 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 106 and name HB2 ) 4.78 2.98 0.00 peak 55 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 106 and name HB1 ) 4.78 2.98 0.00 peak 55 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HN ) ( resid 128 and name HB ) 4.85 3.05 0.00 peak 64 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HN ) ( resid 128 and name HG1# ) 5.80 4.00 0.00 peak 65 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HG2# ) ( resid 128 and name HN ) 5.59 3.79 0.00 peak 66 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HN ) ( resid 128 and name HG2# ) 5.11 3.31 0.00 peak 67 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HN ) ( resid 154 and name HN ) 5.19 3.39 0.00 peak 69 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HN ) ( resid 153 and name HB1 ) 4.44 2.64 0.00 peak 71 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HB2 ) ( resid 153 and name HN ) 5.11 3.31 0.00 peak 72 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HB1 ) ( resid 153 and name HN ) 5.37 3.57 0.00 peak 73 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 153 and name HN ) 5.00 3.20 0.00 peak 74 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 117 and name HN ) 4.70 2.90 0.00 peak 75 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HN ) ( resid 118 and name HN ) 4.89 3.09 0.00 peak 76 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HN ) ( resid 117 and name HN ) 5.57 3.77 0.00 peak 77 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 117 and name HN ) 5.20 3.40 0.00 peak 78 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HB2 ) ( resid 117 and name HN ) 5.09 3.29 0.00 peak 79 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HN ) ( resid 117 and name HB2 ) 4.72 2.92 0.00 peak 80 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HN ) ( resid 117 and name HG ) 4.61 2.81 0.00 peak 81 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 117 and name HN ) 5.07 3.27 0.00 peak 82 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HN ) ( resid 117 and name HD1# ) 5.52 3.72 0.00 peak 82 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HN ) ( resid 95 and name HN ) 4.92 3.12 0.00 peak 83 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HA ) ( resid 94 and name HN ) 4.46 2.66 0.00 peak 84 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HB2 ) ( resid 100 and name HN ) 5.15 3.35 0.00 peak 92 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HB1 ) ( resid 100 and name HN ) 5.15 3.35 0.00 peak 93 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HN ) ( resid 100 and name HD1# ) 6.00 4.20 0.00 peak 95 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HN ) ( resid 100 and name HD2# ) 6.00 4.20 0.00 peak 95 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HN ) ( resid 100 and name HN ) 4.43 2.63 0.00 peak 96 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 123 and name HN ) ( resid 124 and name HN ) 4.09 2.29 0.00 peak 97 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 123 and name HN ) ( resid 123 and name HB# ) 4.07 2.27 0.00 peak 100 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 136 and name HN ) 5.68 3.88 0.00 peak 101 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 108 and name HN ) ( resid 109 and name HN ) 4.78 2.98 0.00 peak 105 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 108 and name HN ) ( resid 108 and name HB# ) 4.65 2.85 0.00 peak 107 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HN ) ( resid 136 and name HD1# ) 6.00 4.20 0.00 peak 109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HN ) ( resid 136 and name HD2# ) 6.00 4.20 0.00 peak 109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HN ) ( resid 99 and name HB2 ) 4.81 3.01 0.00 peak 111 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HN ) ( resid 99 and name HB1 ) 4.81 3.01 0.00 peak 112 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HN ) ( resid 136 and name HG ) 4.80 3.00 0.00 peak 115 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HN ) ( resid 116 and name HN ) 4.39 2.59 0.00 peak 120 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 116 and name HB2 ) 4.38 2.58 0.00 peak 124 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 116 and name HN ) 5.56 3.76 0.00 peak 125 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 119 and name HD1# ) 6.00 4.20 0.00 peak 125 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HG2# ) ( resid 130 and name HN ) 5.60 3.80 0.00 peak 131 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HA ) ( resid 130 and name HN ) 4.07 2.27 0.00 peak 134 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HN ) ( resid 153 and name HN ) 4.75 2.95 0.00 peak 139 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HB1 ) ( resid 152 and name HN ) 5.22 3.42 0.00 peak 143 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HN ) ( resid 152 and name HB2 ) 4.85 3.05 0.00 peak 143 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HN ) ( resid 152 and name HB1 ) 4.73 2.93 0.00 peak 144 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 152 and name HN ) 5.56 3.76 0.00 peak 145 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HB2 ) ( resid 97 and name HN ) 5.86 4.06 0.00 peak 148 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 97 and name HG ) 5.05 3.25 0.00 peak 149 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 97 and name HB1 ) 5.04 3.24 0.00 peak 150 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HB2 ) ( resid 133 and name HN ) 5.40 3.60 0.00 peak 152 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HB1 ) ( resid 133 and name HN ) 5.40 3.60 0.00 peak 153 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HN ) ( resid 133 and name HG2# ) 5.30 3.50 0.00 peak 155 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HG2# ) ( resid 120 and name HN ) 5.19 3.39 0.00 peak 157 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HN ) ( resid 97 and name HN ) 4.59 2.79 0.00 peak 159 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 97 and name HB2 ) 5.04 3.24 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 116 and name HG2 ) 5.25 3.45 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HN ) ( resid 97 and name HN ) 5.10 3.30 0.00 peak 162 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HN ) ( resid 156 and name HN ) 4.72 2.92 0.00 peak 163 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 156 and name HB2 ) 4.60 2.80 0.00 peak 164 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 156 and name HB1 ) 4.60 2.80 0.00 peak 165 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 158 and name HN ) 5.81 4.01 0.00 peak 170 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HN ) ( resid 120 and name HN ) 4.56 2.76 0.00 peak 178 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HN ) ( resid 105 and name HB1 ) 4.64 2.84 0.00 peak 181 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HN ) ( resid 112 and name HD1# ) 5.54 3.74 0.00 peak 182 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 156 and name HD# ) 5.89 4.09 0.00 peak 183 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HN ) ( resid 142 and name HN ) 5.20 3.40 0.00 peak 185 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 141 and name HN ) 5.09 3.29 0.00 peak 187 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HN ) ( resid 141 and name HB2 ) 4.41 2.61 0.00 peak 188 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HN ) ( resid 141 and name HB1 ) 4.54 2.74 0.00 peak 189 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HN ) ( resid 148 and name HD1# ) 5.61 3.81 0.00 peak 190 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 141 and name HN ) 6.00 4.20 0.00 peak 191 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 126 and name HN ) ( resid 127 and name HN ) 5.73 3.93 0.00 peak 192 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HA ) ( resid 126 and name HN ) 5.68 3.88 0.00 peak 195 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HN ) ( resid 132 and name HN ) 5.87 4.07 0.00 peak 197 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HN ) ( resid 133 and name HN ) 4.13 2.33 0.00 peak 199 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HN ) ( resid 105 and name HN ) 4.26 2.46 0.00 peak 200 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HA ) ( resid 105 and name HN ) 5.09 3.29 0.00 peak 203 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HA ) ( resid 132 and name HN ) 5.61 3.81 0.00 peak 203 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HN ) ( resid 105 and name HB2 ) 4.64 2.84 0.00 peak 205 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HG2 ) ( resid 132 and name HN ) 6.00 4.20 0.00 peak 206 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HG1 ) ( resid 132 and name HN ) 6.00 4.20 0.00 peak 206 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HN ) ( resid 133 and name HB ) 6.00 4.20 0.00 peak 207 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HG2# ) ( resid 132 and name HN ) 5.74 3.94 0.00 peak 208 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HN ) ( resid 133 and name HD1# ) 6.00 4.20 0.00 peak 209 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HN ) ( resid 96 and name HN ) 4.98 3.18 0.00 peak 214 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HN ) ( resid 96 and name HN ) 5.62 3.82 0.00 peak 220 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HN ) ( resid 101 and name HN ) 4.66 2.86 0.00 peak 221 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HN ) ( resid 102 and name HN ) 4.70 2.90 0.00 peak 222 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HN ) ( resid 153 and name HE# ) 5.25 3.45 0.00 peak 223 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HN ) ( resid 101 and name HB2 ) 4.46 2.66 0.00 peak 224 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HN ) ( resid 135 and name HN ) 4.20 2.40 0.00 peak 226 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HN ) ( resid 134 and name HG2 ) 4.85 3.05 0.00 peak 229 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HN ) ( resid 134 and name HG1 ) 4.85 3.05 0.00 peak 230 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HB ) ( resid 134 and name HN ) 4.56 2.76 0.00 peak 231 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 134 and name HN ) 5.62 3.82 0.00 peak 232 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 160 and name HN ) 5.45 3.65 0.00 peak 238 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 158 and name HB2 ) 5.05 3.25 0.00 peak 241 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 158 and name HB1 ) 5.05 3.25 0.00 peak 241 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 158 and name HG2 ) 6.00 4.20 0.00 peak 242 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HN ) ( resid 95 and name HN ) 6.00 4.20 0.00 peak 245 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 96 and name HN ) 4.77 2.97 0.00 peak 247 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HB2 ) ( resid 95 and name HN ) 5.24 3.44 0.00 peak 249 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HB1 ) ( resid 95 and name HN ) 5.24 3.44 0.00 peak 250 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 95 and name HG2 ) 6.00 4.20 0.00 peak 251 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 95 and name HG1 ) 6.00 4.20 0.00 peak 251 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 95 and name HB2 ) 4.75 2.95 0.00 peak 252 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 95 and name HB1 ) 4.75 2.95 0.00 peak 252 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 97 and name HN ) 5.28 3.48 0.00 peak 253 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 136 and name HG ) 5.80 4.00 0.00 peak 256 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HN ) ( resid 160 and name HB ) 4.71 2.91 0.00 peak 261 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HA ) ( resid 150 and name HN ) 4.56 2.76 0.00 peak 265 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HN ) ( resid 150 and name HB1 ) 4.39 2.59 0.00 peak 266 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HN ) ( resid 150 and name HD# ) 6.00 4.20 0.00 peak 268 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HA ) ( resid 135 and name HN ) 5.16 3.36 0.00 peak 270 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HA ) ( resid 135 and name HN ) 5.94 4.14 0.00 peak 272 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 136 and name HB# ) 6.00 4.20 0.00 peak 275 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HG2# ) ( resid 135 and name HN ) 6.00 4.20 0.00 peak 276 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HN ) ( resid 150 and name HB2 ) 4.39 2.59 0.00 peak 280 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 122 and name HN ) 4.72 2.92 0.00 peak 281 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 120 and name HN ) ( resid 121 and name HN ) 4.67 2.87 0.00 peak 282 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 121 and name HN ) 5.53 3.73 0.00 peak 284 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 121 and name HN ) 6.00 4.20 0.00 peak 284 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 121 and name HG ) 4.99 3.19 0.00 peak 288 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 121 and name HB1 ) 5.04 3.24 0.00 peak 289 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HN ) ( resid 155 and name HN ) 5.20 3.40 0.00 peak 292 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HD# ) ( resid 154 and name HN ) 5.76 3.96 0.00 peak 293 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HA ) ( resid 154 and name HN ) 6.00 4.20 0.00 peak 294 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HB1 ) ( resid 154 and name HN ) 4.95 3.15 0.00 peak 296 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HN ) ( resid 154 and name HG ) 4.98 3.18 0.00 peak 298 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HN ) ( resid 122 and name HG2 ) 5.63 3.83 0.00 peak 302 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HA ) ( resid 114 and name HN ) 4.48 2.68 0.00 peak 305 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HB2 ) ( resid 114 and name HN ) 4.90 3.10 0.00 peak 306 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HN ) ( resid 114 and name HB# ) 4.27 2.47 0.00 peak 308 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HN ) ( resid 114 and name HG ) 4.58 2.78 0.00 peak 308 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HN ) ( resid 114 and name HD1# ) 5.31 3.51 0.00 peak 309 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HA ) ( resid 119 and name HN ) 5.43 3.63 0.00 peak 314 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HN ) ( resid 119 and name HB ) 4.18 2.38 0.00 peak 316 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HN ) ( resid 119 and name HD1# ) 5.51 3.71 0.00 peak 320 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 145 and name HN ) ( resid 146 and name HN ) 4.26 2.46 0.00 peak 321 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 144 and name HN ) ( resid 145 and name HN ) 4.66 2.86 0.00 peak 322 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HN ) ( resid 131 and name HB2 ) 5.00 3.20 0.00 peak 327 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HA ) ( resid 118 and name HN ) 6.00 4.20 0.00 peak 328 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HN ) ( resid 119 and name HN ) 4.65 2.85 0.00 peak 330 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HA ) ( resid 118 and name HN ) 5.23 3.43 0.00 peak 331 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HB2 ) ( resid 118 and name HN ) 4.37 2.57 0.00 peak 333 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HN ) ( resid 133 and name HG2# ) 4.96 3.16 0.00 peak 336 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HN ) ( resid 115 and name HN ) 4.43 2.63 0.00 peak 338 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HN ) ( resid 141 and name HN ) 4.91 3.11 0.00 peak 339 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HB2 ) ( resid 115 and name HN ) 5.57 3.77 0.00 peak 341 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HN ) ( resid 115 and name HB1 ) 4.81 3.01 0.00 peak 342 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HB# ) ( resid 115 and name HN ) 4.53 2.73 0.00 peak 343 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD1# ) ( resid 115 and name HN ) 5.78 3.98 0.00 peak 344 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 115 and name HN ) 6.00 4.20 0.00 peak 344 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HN ) ( resid 128 and name HN ) 5.29 3.49 0.00 peak 346 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HN ) ( resid 110 and name HN ) 4.30 2.50 0.00 peak 348 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HN ) ( resid 111 and name HN ) 5.00 3.20 0.00 peak 350 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HN ) ( resid 111 and name HD# ) 6.00 4.20 0.00 peak 351 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HN ) ( resid 131 and name HN ) 4.93 3.13 0.00 peak 353 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HN ) ( resid 131 and name HB1 ) 5.00 3.20 0.00 peak 358 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HB2 ) ( resid 131 and name HN ) 5.76 3.96 0.00 peak 359 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HB1 ) ( resid 131 and name HN ) 5.76 3.96 0.00 peak 359 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD1# ) ( resid 137 and name HN ) 5.11 3.31 0.00 peak 363 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 137 and name HN ) 5.16 3.36 0.00 peak 364 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HB# ) ( resid 137 and name HN ) 5.62 3.82 0.00 peak 365 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HN ) ( resid 152 and name HN ) 4.43 2.63 0.00 peak 367 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HN ) ( resid 151 and name HN ) 4.85 3.05 0.00 peak 368 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HN ) ( resid 151 and name HB2 ) 4.85 3.05 0.00 peak 371 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HN ) ( resid 138 and name HN ) 4.57 2.77 0.00 peak 373 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 138 and name HN ) 6.00 4.20 0.00 peak 375 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HN ) ( resid 93 and name HN ) 5.91 4.11 0.00 peak 382 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 126 and name HA ) ( resid 127 and name HN ) 4.32 2.52 0.00 peak 387 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HN ) ( resid 127 and name HG2# ) 5.64 3.84 0.00 peak 390 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HN ) ( resid 137 and name HB2 ) 4.51 2.71 0.00 peak 392 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HN ) ( resid 137 and name HB1 ) 4.51 2.71 0.00 peak 393 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HA ) ( resid 139 and name HN ) 5.22 3.42 0.00 peak 396 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HB2 ) ( resid 139 and name HN ) 5.73 3.93 0.00 peak 397 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HB1 ) ( resid 139 and name HN ) 5.73 3.93 0.00 peak 397 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 103 and name HN ) ( resid 104 and name HN ) 4.56 2.76 0.00 peak 398 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HA ) ( resid 103 and name HN ) 5.61 3.81 0.00 peak 399 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HN ) ( resid 139 and name HN ) 5.77 3.97 0.00 peak 402 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HN ) ( resid 129 and name HN ) 5.94 4.14 0.00 peak 406 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HB ) ( resid 129 and name HN ) 5.28 3.48 0.00 peak 409 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HN ) ( resid 129 and name HG2# ) 4.60 2.80 0.00 peak 410 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG2# ) ( resid 129 and name HN ) 5.26 3.46 0.00 peak 411 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HN ) ( resid 155 and name HG2 ) 6.00 4.20 0.00 peak 416 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HN ) ( resid 155 and name HG1 ) 6.00 4.20 0.00 peak 416 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HB1 ) ( resid 155 and name HN ) 5.81 4.01 0.00 peak 418 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 98 and name HN ) 4.54 2.74 0.00 peak 419 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HN ) ( resid 98 and name HB2 ) 4.84 3.04 0.00 peak 421 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HN ) ( resid 98 and name HB1 ) 4.84 3.04 0.00 peak 421 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HA ) ( resid 98 and name HN ) 5.61 3.81 0.00 peak 422 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD1# ) ( resid 98 and name HN ) 6.00 4.20 0.00 peak 425 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD2# ) ( resid 98 and name HN ) 6.00 4.20 0.00 peak 425 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HN ) ( resid 100 and name HN ) 5.80 4.00 0.00 peak 427 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HN ) ( resid 99 and name HN ) 4.81 3.01 0.00 peak 428 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 157 and name HN ) 4.87 3.07 0.00 peak 429 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 158 and name HN ) 4.98 3.18 0.00 peak 430 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HA ) ( resid 157 and name HN ) 5.76 3.96 0.00 peak 432 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 157 and name HB1 ) 5.06 3.26 0.00 peak 434 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 157 and name HG2 ) 5.38 3.58 0.00 peak 434 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 157 and name HB2 ) 5.06 3.26 0.00 peak 435 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 159 and name HN ) 5.81 4.01 0.00 peak 437 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HA ) ( resid 157 and name HN ) 6.00 4.20 0.00 peak 438 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 110 and name HN ) ( resid 111 and name HN ) 4.37 2.57 0.00 peak 441 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 111 and name HN ) 6.00 4.20 0.00 peak 443 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HN ) ( resid 111 and name HE# ) 6.00 4.20 0.00 peak 443 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HN ) ( resid 111 and name HD# ) 4.95 3.15 0.00 peak 444 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 146 and name HN ) ( resid 147 and name HN ) 4.42 2.62 0.00 peak 449 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HB1 ) ( resid 144 and name HN ) 5.43 3.63 0.00 peak 452 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HN ) ( resid 147 and name HG2 ) 5.91 4.11 0.00 peak 453 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HN ) ( resid 147 and name HG1 ) 5.91 4.11 0.00 peak 453 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 143 and name HN ) ( resid 144 and name HN ) 4.38 2.58 0.00 peak 462 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 143 and name ) ( resid 144 and name HN ) 4.75 2.95 0.00 peak 463 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 144 and name HN ) ( resid 144 and name HA ) 3.92 2.12 0.00 peak 465 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HD# ) ( resid 102 and name HN ) 5.48 3.68 0.00 peak 470 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HB2 ) ( resid 102 and name HN ) 5.34 3.54 0.00 peak 471 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HN ) ( resid 104 and name HN ) 5.45 3.65 0.00 peak 474 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HA ) ( resid 102 and name HN ) 5.33 3.53 0.00 peak 475 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HB1 ) ( resid 102 and name HN ) 4.67 2.87 0.00 peak 477 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HN ) ( resid 102 and name HB# ) 4.34 2.54 0.00 peak 478 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HN ) ( resid 104 and name HB1 ) 5.11 3.31 0.00 peak 484 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HN ) ( resid 120 and name HE# ) 5.44 3.64 0.00 peak 486 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HA ) ( resid 104 and name HN ) 5.76 3.96 0.00 peak 487 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 143 and name HN ) 4.40 2.60 0.00 peak 488 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 143 and name HN ) ( resid 144 and name HA ) 5.91 4.11 0.00 peak 490 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HB2 ) ( resid 143 and name HN ) 5.43 3.63 0.00 peak 491 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HB1 ) ( resid 143 and name HN ) 5.43 3.63 0.00 peak 491 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HA ) ( resid 143 and name HN ) 5.46 3.66 0.00 peak 492 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 107 and name HN ) 4.69 2.89 0.00 peak 497 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HB2 ) ( resid 107 and name HN ) 5.66 3.86 0.00 peak 499 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HB1 ) ( resid 107 and name HN ) 5.66 3.86 0.00 peak 499 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HA ) ( resid 107 and name HN ) 5.45 3.65 0.00 peak 501 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 144 and name HA ) ( resid 146 and name HN ) 5.29 3.49 0.00 peak 508 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HN ) ( resid 125 and name HN ) 5.89 4.09 0.00 peak 514 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 124 and name HN ) ( resid 125 and name HN ) 4.45 2.65 0.00 peak 515 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HA ) ( resid 125 and name HN ) 5.21 3.41 0.00 peak 517 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 124 and name HN ) ( resid 124 and name HB ) 4.96 3.16 0.00 peak 521 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 123 and name HB# ) ( resid 124 and name HN ) 5.07 3.27 0.00 peak 522 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 124 and name HN ) ( resid 124 and name HG2# ) 4.76 2.96 0.00 peak 523 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HB2 ) ( resid 159 and name HN ) 6.00 4.20 0.00 peak 525 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HB1 ) ( resid 159 and name HN ) 6.00 4.20 0.00 peak 525 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 159 and name HN ) 4.89 3.09 0.00 peak 526 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 159 and name HN ) ( resid 160 and name HN ) 5.15 3.35 0.00 peak 527 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HN ) ( resid 140 and name HN ) 4.50 2.70 0.00 peak 531 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HA ) ( resid 140 and name HN ) 4.92 3.12 0.00 peak 532 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB2 ) ( resid 140 and name HN ) 4.97 3.17 0.00 peak 534 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HA ) ( resid 160 and name HN ) 6.00 4.20 0.00 peak 536 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 157 and name HG1 ) 5.38 3.58 0.00 peak 537 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HN ) ( resid 154 and name HN ) 6.00 4.20 0.00 peak 539 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HA ) ( resid 154 and name HN ) 5.93 4.13 0.00 peak 540 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HN ) ( resid 148 and name HD1# ) 5.86 4.06 0.00 peak 541 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HN ) ( resid 141 and name HN ) 5.89 4.09 0.00 peak 547 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HA ) ( resid 124 and name HN ) 5.96 4.16 0.00 peak 548 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HN ) ( resid 139 and name HB2 ) 4.17 2.37 0.00 peak 549 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HN ) ( resid 137 and name HN ) 4.73 2.93 0.00 peak 551 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HN ) ( resid 134 and name HN ) 5.70 3.90 0.00 peak 555 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HN ) ( resid 133 and name HN ) 5.40 3.60 0.00 peak 560 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HN ) ( resid 132 and name HN ) 4.57 2.77 0.00 peak 561 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 127 and name HN ) ( resid 128 and name HB ) 6.00 4.20 0.00 peak 565 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HN ) ( resid 118 and name HD# ) 5.25 3.45 0.00 peak 572 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HB1 ) ( resid 118 and name HN ) 5.81 4.01 0.00 peak 573 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HA ) ( resid 133 and name HN ) 5.10 3.30 0.00 peak 575 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HB ) ( resid 120 and name HN ) 4.52 2.72 0.00 peak 576 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HN ) ( resid 123 and name HN ) 4.43 2.63 0.00 peak 577 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 117 and name HG ) 5.88 4.08 0.00 peak 579 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HB1 ) ( resid 115 and name HN ) 5.57 3.77 0.00 peak 580 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 108 and name HB# ) ( resid 109 and name HN ) 5.43 3.63 0.00 peak 587 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HN ) ( resid 116 and name HB1 ) 6.00 4.20 0.00 peak 588 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HN ) ( resid 101 and name HD# ) 5.61 3.81 0.00 peak 590 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HA ) ( resid 101 and name HN ) 5.63 3.83 0.00 peak 591 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HN ) ( resid 101 and name HB1 ) 4.53 2.73 0.00 peak 593 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HB2 ) ( resid 101 and name HN ) 5.29 3.49 0.00 peak 594 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HB1 ) ( resid 101 and name HN ) 5.29 3.49 0.00 peak 594 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HD1# ) ( resid 101 and name HN ) 6.00 4.20 0.00 peak 595 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HD2# ) ( resid 101 and name HN ) 6.00 4.20 0.00 peak 595 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HN ) ( resid 153 and name HD# ) 5.76 3.96 0.00 peak 596 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HA ) ( resid 100 and name HN ) 6.00 4.20 0.00 peak 597 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 100 and name HN ) 5.78 3.98 0.00 peak 598 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HA ) ( resid 95 and name HN ) 5.68 3.88 0.00 peak 602 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HN ) ( resid 158 and name HN ) 6.00 4.20 0.00 peak 606 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HN ) ( resid 119 and name HG2# ) 5.33 3.53 0.00 peak 3 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HZ ) ( resid 157 and name HE# ) 5.09 3.29 0.00 peak 5 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HD# ) ( resid 102 and name HA ) 5.45 3.65 0.00 peak 15 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HD# ) ( resid 153 and name HB2 ) 5.46 3.66 0.00 peak 17 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HD# ) ( resid 112 and name HD1# ) 5.05 3.25 0.00 peak 19 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HD# ) ( resid 153 and name HB1 ) 4.99 3.19 0.00 peak 21 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HD# ) ( resid 153 and name HB1 ) 5.36 3.56 0.00 peak 21 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 153 and name HB1 ) 5.34 3.54 0.00 peak 25 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 153 and name HB2 ) 5.22 3.42 0.00 peak 26 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 112 and name HD1# ) 5.39 3.59 0.00 peak 27 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 148 and name HG2# ) 5.23 3.43 0.00 peak 28 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HE# ) ( resid 149 and name HB1 ) 5.75 3.95 0.00 peak 30 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HE# ) ( resid 149 and name HB2 ) 5.75 3.95 0.00 peak 31 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HZ ) ( resid 148 and name HG2# ) 5.46 3.66 0.00 peak 37 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HZ ) ( resid 112 and name HD1# ) 5.70 3.90 0.00 peak 39 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HD1# ) ( resid 153 and name HD# ) 6.00 4.20 0.00 peak 39 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HZ ) ( resid 111 and name HA ) 4.83 3.03 0.00 peak 45 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HA ) ( resid 111 and name HE# ) 6.00 4.20 0.00 peak 46 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HE# ) ( resid 149 and name HA ) 6.00 4.20 0.00 peak 46 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HA ) ( resid 111 and name HD# ) 5.03 3.23 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HD# ) ( resid 149 and name HA ) 5.28 3.48 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 149 and name HA ) 6.00 4.20 0.00 peak 49 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HD# ) ( resid 154 and name HA ) 5.56 3.76 0.00 peak 52 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HA ) ( resid 150 and name HE# ) 4.78 2.98 0.00 peak 53 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HD# ) ( resid 153 and name HD# ) 5.24 3.44 0.00 peak 56 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HE# ) ( resid 111 and name HD# ) 3.93 2.13 0.00 peak 61 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HE# ) ( resid 111 and name HD# ) 4.15 2.35 0.00 peak 61 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HD# ) ( resid 153 and name HD# ) 5.61 3.81 0.00 peak 63 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 91 and name HA# ) ( resid 96 and name HB# ) 4.81 3.01 0.00 peak 500 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HN ) ( resid 92 and name HG# ) 5.51 3.71 0.00 peak 605 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HN ) ( resid 96 and name HB# ) 4.83 3.03 0.00 peak 167 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HA ) ( resid 92 and name HG# ) 4.67 2.87 0.00 peak 742 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HB# ) ( resid 93 and name HN ) 5.42 3.62 0.00 peak 385 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HB# ) ( resid 95 and name HB# ) 5.90 4.10 0.00 peak 1453 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HB# ) ( resid 96 and name HN ) 5.56 3.76 0.00 peak 219 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HB# ) ( resid 96 and name HB# ) 5.80 4.00 0.00 peak 1460 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HB# ) ( resid 97 and name HD## ) 5.94 4.14 0.00 peak 1347 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 92 and name HG# ) ( resid 93 and name HN ) 5.86 4.06 0.00 peak 604 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HN ) ( resid 93 and name HB# ) 4.68 2.88 0.00 peak 381 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HN ) ( resid 95 and name HB# ) 6.00 4.20 0.00 peak 384 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HN ) ( resid 96 and name HB# ) 5.13 3.33 0.00 peak 383 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HB# ) ( resid 94 and name HN ) 4.79 2.99 0.00 peak 85 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 93 and name HB# ) ( resid 96 and name HN ) 5.61 3.81 0.00 peak 212 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HN ) ( resid 94 and name HB# ) 4.32 2.52 0.00 peak 86 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HA ) ( resid 97 and name HB# ) 4.26 2.46 0.00 peak 494 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HA ) ( resid 97 and name HD## ) 5.09 3.29 0.00 peak 850 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HA ) ( resid 98 and name HB# ) 5.09 3.29 0.00 peak 417 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HG# ) ( resid 97 and name HB# ) 5.52 3.72 0.00 peak 1149 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 94 and name HG# ) ( resid 97 and name HD## ) 5.76 3.96 0.00 peak 1226 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 95 and name HB# ) 4.20 2.40 0.00 peak 252 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HN ) ( resid 95 and name HG# ) 5.61 3.81 0.00 peak 251 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HA ) ( resid 95 and name HG# ) 4.51 2.71 0.00 peak 501 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 95 and name HB# ) ( resid 96 and name HN ) 4.40 2.60 0.00 peak 218 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HN ) ( resid 96 and name HB# ) 4.26 2.46 0.00 peak 217 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HN ) ( resid 96 and name HG# ) 4.77 2.97 0.00 peak 217 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HN ) ( resid 97 and name HD## ) 5.84 4.04 0.00 peak 210 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HA ) ( resid 99 and name HB# ) 5.09 3.29 0.00 peak 563 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 96 and name HB# ) ( resid 97 and name HN ) 5.02 3.22 0.00 peak 148 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 97 and name HB# ) 4.37 2.57 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HN ) ( resid 97 and name HD## ) 5.04 3.24 0.00 peak 151 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HA ) ( resid 97 and name HD## ) 4.22 2.42 0.00 peak 798 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HA ) ( resid 100 and name HB# ) 5.01 3.21 0.00 peak 635 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HB# ) ( resid 98 and name HN ) 4.71 2.91 0.00 peak 423 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HB# ) ( resid 153 and name HE# ) 5.58 3.78 0.00 peak 1073 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD## ) ( resid 98 and name HN ) 5.82 4.02 0.00 peak 425 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD## ) ( resid 100 and name HD## ) 5.11 3.31 0.00 peak 790 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD## ) ( resid 153 and name HB1 ) 6.00 4.20 0.00 peak 1416 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD## ) ( resid 153 and name HE# ) 5.60 3.80 0.00 peak 1254 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD## ) ( resid 157 and name HG# ) 5.03 3.23 0.00 peak 1315 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 97 and name HD## ) ( resid 157 and name HE# ) 4.15 2.35 0.00 peak 80 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HN ) ( resid 98 and name HB# ) 4.36 2.56 0.00 peak 421 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HB# ) ( resid 99 and name HN ) 4.87 3.07 0.00 peak 392 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 98 and name HB# ) ( resid 150 and name HE# ) 5.04 3.24 0.00 peak 54 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HN ) ( resid 99 and name HB# ) 4.10 2.30 0.00 peak 111 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HA ) ( resid 102 and name HG# ) 5.56 3.76 0.00 peak 692 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HB# ) ( resid 100 and name HN ) 4.55 2.75 0.00 peak 92 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 99 and name HB# ) ( resid 102 and name HD# ) 5.29 3.49 0.00 peak 1252 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HN ) ( resid 100 and name HB# ) 4.25 2.45 0.00 peak 94 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HN ) ( resid 100 and name HD## ) 5.39 3.59 0.00 peak 95 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HA ) ( resid 100 and name HD## ) 4.69 2.89 0.00 peak 643 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HB# ) ( resid 101 and name HN ) 4.71 2.91 0.00 peak 594 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HB# ) ( resid 153 and name HE# ) 5.72 3.92 0.00 peak 1061 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HB# ) ( resid 153 and name HZ ) 5.74 3.94 0.00 peak 1065 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HD## ) ( resid 101 and name HN ) 6.00 4.20 0.00 peak 595 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HD## ) ( resid 153 and name HE# ) 5.47 3.67 0.00 peak 3 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HD## ) ( resid 153 and name HZ ) 4.67 2.87 0.00 peak 6 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 100 and name HD## ) ( resid 157 and name HE# ) 4.30 2.50 0.00 peak 1244 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HE# ) ( resid 112 and name HG1# ) 5.91 4.11 0.00 peak 1508 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 101 and name HZ ) ( resid 112 and name HG1# ) 6.00 4.20 0.00 peak 1512 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HN ) ( resid 102 and name HG# ) 4.50 2.70 0.00 peak 478 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HA ) ( resid 102 and name HG# ) 4.54 2.74 0.00 peak 620 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HA ) ( resid 105 and name HB# ) 4.63 2.83 0.00 peak 577 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HG# ) ( resid 103 and name HN ) 5.19 3.39 0.00 peak 1326 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 102 and name HG# ) ( resid 103 and name HA ) 6.00 4.20 0.00 peak 1209 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 103 and name HN ) ( resid 103 and name HB# ) 4.26 2.46 0.00 peak 401 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 103 and name HB# ) ( resid 104 and name HN ) 5.12 3.32 0.00 peak 485 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HN ) ( resid 104 and name HB# ) 4.46 2.66 0.00 peak 484 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HB# ) ( resid 112 and name HG2# ) 6.00 4.20 0.00 peak 1415 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HB# ) ( resid 112 and name HG1# ) 6.00 4.20 0.00 peak 1415 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HB# ) ( resid 112 and name HD1# ) 4.71 2.91 0.00 peak 1277 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 104 and name HB# ) ( resid 120 and name HE# ) 4.36 2.56 0.00 peak 54 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HN ) ( resid 105 and name HB# ) 4.11 2.31 0.00 peak 205 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HN ) ( resid 112 and name HG1# ) 5.73 3.93 0.00 peak 209 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HA ) ( resid 112 and name HG1# ) 5.88 4.08 0.00 peak 1507 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HB# ) ( resid 107 and name HN ) 6.00 4.20 0.00 peak 500 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 105 and name HB# ) ( resid 112 and name HD1# ) 5.32 3.52 0.00 peak 1275 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 106 and name HB# ) 4.19 2.39 0.00 peak 55 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 106 and name HG# ) 5.64 3.84 0.00 peak 1109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 107 and name HB# ) 5.83 4.03 0.00 peak 53 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HN ) ( resid 116 and name HG# ) 6.00 4.20 0.00 peak 1428 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HB# ) ( resid 107 and name HN ) 5.07 3.27 0.00 peak 499 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HB# ) ( resid 116 and name HB1 ) 5.52 3.72 0.00 peak 397 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HG# ) ( resid 107 and name HN ) 6.00 4.20 0.00 peak 500 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 106 and name HG# ) ( resid 119 and name HG2# ) 5.72 3.92 0.00 peak 36 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HN ) ( resid 107 and name HB# ) 4.51 2.71 0.00 peak 502 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HA ) ( resid 116 and name HG# ) 6.00 4.20 0.00 peak 1426 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HB# ) ( resid 109 and name HN ) 5.45 3.65 0.00 peak 585 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HB# ) ( resid 113 and name HN ) 6.00 4.20 0.00 peak 1430 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HB# ) ( resid 116 and name HA ) 6.00 4.20 0.00 peak 1343 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HB# ) ( resid 116 and name HB2 ) 6.00 4.20 0.00 peak 1339 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HB# ) ( resid 116 and name HB1 ) 4.83 3.03 0.00 peak 1361 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 107 and name HB# ) ( resid 116 and name HG# ) 4.67 2.87 0.00 peak 326 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HN ) ( resid 109 and name HB# ) 4.68 2.88 0.00 peak 586 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 109 and name HB# ) ( resid 111 and name HD# ) 5.51 3.71 0.00 peak 1407 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HN ) ( resid 111 and name HB# ) 4.45 2.65 0.00 peak 448 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HB# ) ( resid 112 and name HN ) 4.85 3.05 0.00 peak 22 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HB# ) ( resid 147 and name HA ) 6.00 4.20 0.00 peak 127 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HB# ) ( resid 147 and name HB# ) 4.70 2.90 0.00 peak 1249 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HB# ) ( resid 147 and name HD# ) 5.82 4.02 0.00 peak 1041 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HB# ) ( resid 148 and name HN ) 5.62 3.82 0.00 peak 44 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HE# ) ( resid 149 and name HB# ) 4.95 3.15 0.00 peak 30 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HD# ) ( resid 147 and name HB# ) 5.11 3.31 0.00 peak 35 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 111 and name HD# ) ( resid 149 and name HB# ) 4.98 3.18 0.00 peak 178 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HN ) ( resid 112 and name HG1# ) 5.16 3.36 0.00 peak 27 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HB ) ( resid 148 and name HG1# ) 5.73 3.93 0.00 peak 1424 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 112 and name HG2# ) ( resid 112 and name HG1# ) 4.36 2.56 0.00 peak 46 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HN ) ( resid 115 and name HB# ) 6.00 4.20 0.00 peak 14 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HN ) ( resid 116 and name HG# ) 5.03 3.23 0.00 peak 328 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 113 and name HB# ) ( resid 114 and name HN ) 4.05 2.25 0.00 peak 306 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 134 and name HG# ) 4.85 3.05 0.00 peak 784 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 137 and name HB# ) 5.51 3.71 0.00 peak 785 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 114 and name HD2# ) ( resid 137 and name HG# ) 4.93 3.13 0.00 peak 1124 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HA ) ( resid 118 and name HB# ) 5.32 3.52 0.00 peak 672 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HA ) ( resid 118 and name HG# ) 5.33 3.53 0.00 peak 977 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HB# ) ( resid 116 and name HN ) 4.12 2.32 0.00 peak 122 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HB# ) ( resid 116 and name HA ) 4.97 3.17 0.00 peak 600 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HB# ) ( resid 116 and name HB2 ) 6.00 4.20 0.00 peak 1339 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 115 and name HB# ) ( resid 116 and name HG# ) 4.72 2.92 0.00 peak 326 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HN ) ( resid 116 and name HG# ) 4.56 2.76 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HA ) ( resid 116 and name HG# ) 4.54 2.74 0.00 peak 327 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 116 and name HG# ) ( resid 119 and name HD1# ) 6.00 4.20 0.00 peak 1139 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD1# ) ( resid 137 and name HB# ) 5.28 3.48 0.00 peak 974 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 117 and name HD2# ) ( resid 140 and name HA# ) 6.00 4.20 0.00 peak 1380 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HN ) ( resid 118 and name HB# ) 4.38 2.58 0.00 peak 333 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HN ) ( resid 118 and name HG# ) 4.39 2.59 0.00 peak 334 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HA ) ( resid 118 and name HG# ) 4.49 2.69 0.00 peak 477 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HB# ) ( resid 118 and name HD# ) 4.04 2.24 0.00 peak 483 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HB# ) ( resid 133 and name HG2# ) 5.52 3.72 0.00 peak 429 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HB# ) ( resid 133 and name HD1# ) 4.57 2.77 0.00 peak 107 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HG# ) ( resid 119 and name HN ) 5.17 3.37 0.00 peak 318 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HG# ) ( resid 119 and name HA ) 5.80 4.00 0.00 peak 1181 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 118 and name HG# ) ( resid 133 and name HD1# ) 5.35 3.55 0.00 peak 109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HN ) ( resid 119 and name HG1# ) 4.44 2.64 0.00 peak 317 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 119 and name HG1# ) 4.47 2.67 0.00 peak 382 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 122 and name HG# ) 5.34 3.54 0.00 peak 1439 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HA ) ( resid 126 and name HG# ) 5.23 3.43 0.00 peak 378 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 119 and name HG2# ) ( resid 119 and name HG1# ) 3.89 2.09 0.00 peak 38 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 120 and name HN ) ( resid 120 and name HB# ) 4.31 2.51 0.00 peak 180 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 120 and name HB# ) ( resid 121 and name HN ) 4.74 2.94 0.00 peak 287 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 120 and name HB# ) ( resid 121 and name HD## ) 5.94 4.14 0.00 peak 1464 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 121 and name HB# ) 4.52 2.72 0.00 peak 289 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 121 and name HD## ) 4.89 3.09 0.00 peak 290 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HN ) ( resid 126 and name HG# ) 6.00 4.20 0.00 peak 286 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HB# ) ( resid 122 and name HN ) 5.20 3.40 0.00 peak 572 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HB# ) ( resid 126 and name HN ) 5.24 3.44 0.00 peak 196 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HB# ) ( resid 126 and name HB# ) 3.91 2.11 0.00 peak 479 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 121 and name HB# ) ( resid 126 and name HG# ) 5.25 3.45 0.00 peak 356 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HN ) ( resid 122 and name HG# ) 4.79 2.99 0.00 peak 302 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HN ) ( resid 126 and name HG# ) 4.61 2.81 0.00 peak 303 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HA ) ( resid 126 and name HB# ) 5.88 4.08 0.00 peak 1336 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 122 and name HG# ) ( resid 126 and name HG# ) 3.94 2.14 0.00 peak 372 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 125 and name HA# ) ( resid 126 and name HA ) 6.00 4.20 0.00 peak 738 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 125 and name HA# ) ( resid 127 and name HN ) 4.87 3.07 0.00 peak 388 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 125 and name HA# ) ( resid 127 and name HG2# ) 5.09 3.29 0.00 peak 1163 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 126 and name HN ) ( resid 126 and name HB# ) 4.65 2.85 0.00 peak 568 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 126 and name HN ) ( resid 126 and name HG# ) 5.61 3.81 0.00 peak 569 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 126 and name HA ) ( resid 126 and name HG# ) 4.63 2.83 0.00 peak 741 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HN ) ( resid 128 and name HG1# ) 5.19 3.39 0.00 peak 65 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG2# ) ( resid 128 and name HG1# ) 4.32 2.52 0.00 peak 44 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG1# ) ( resid 132 and name HB# ) 5.21 3.41 0.00 peak 946 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG1# ) ( resid 133 and name HN ) 5.80 4.00 0.00 peak 154 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 128 and name HG1# ) ( resid 133 and name HD1# ) 4.85 3.05 0.00 peak 110 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 129 and name HN ) ( resid 132 and name HB# ) 4.97 3.17 0.00 peak 407 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HN ) ( resid 130 and name HB# ) 4.26 2.46 0.00 peak 137 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HN ) ( resid 130 and name HG# ) 5.12 3.32 0.00 peak 136 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HA ) ( resid 133 and name HG1# ) 4.96 3.16 0.00 peak 581 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HB# ) ( resid 131 and name HN ) 5.10 3.30 0.00 peak 359 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HB# ) ( resid 133 and name HG1# ) 5.19 3.39 0.00 peak 911 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HG# ) ( resid 131 and name HB# ) 5.59 3.79 0.00 peak 345 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HG# ) ( resid 132 and name HN ) 6.00 4.20 0.00 peak 206 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 130 and name HG# ) ( resid 133 and name HG1# ) 6.00 4.20 0.00 peak 1148 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HN ) ( resid 131 and name HB# ) 4.28 2.48 0.00 peak 358 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 131 and name HB# ) ( resid 132 and name HN ) 4.55 2.75 0.00 peak 205 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HN ) ( resid 132 and name HB# ) 4.23 2.43 0.00 peak 204 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HA ) ( resid 135 and name HB# ) 4.51 2.71 0.00 peak 855 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 132 and name HB# ) ( resid 133 and name HN ) 4.66 2.86 0.00 peak 152 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HN ) ( resid 133 and name HG1# ) 4.06 2.26 0.00 peak 156 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HB ) ( resid 134 and name HG# ) 4.16 2.36 0.00 peak 1075 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HG2# ) ( resid 133 and name HG1# ) 4.28 2.48 0.00 peak 573 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 133 and name HG1# ) ( resid 134 and name HN ) 5.61 3.81 0.00 peak 556 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HN ) ( resid 134 and name HG# ) 4.10 2.30 0.00 peak 230 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HN ) ( resid 135 and name HB# ) 5.51 3.71 0.00 peak 981 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 134 and name HG# ) 4.29 2.49 0.00 peak 521 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HA ) ( resid 137 and name HB# ) 4.49 2.69 0.00 peak 521 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 134 and name HB# ) ( resid 137 and name HB# ) 6.00 4.20 0.00 peak 910 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 135 and name HB# ) 3.95 2.15 0.00 peak 273 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 135 and name HG# ) 5.40 3.60 0.00 peak 354 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HN ) ( resid 136 and name HD## ) 6.00 4.20 0.00 peak 276 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HA ) ( resid 135 and name HG# ) 4.57 2.77 0.00 peak 552 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HB# ) ( resid 136 and name HN ) 4.32 2.52 0.00 peak 99 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HB# ) ( resid 136 and name HG ) 6.00 4.20 0.00 peak 910 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 135 and name HG# ) ( resid 136 and name HN ) 6.00 4.20 0.00 peak 103 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HN ) ( resid 136 and name HD## ) 5.64 3.84 0.00 peak 109 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 136 and name HA ) ( resid 136 and name HD## ) 4.74 2.94 0.00 peak 788 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HN ) ( resid 137 and name HB# ) 4.08 2.28 0.00 peak 393 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HN ) ( resid 137 and name HG# ) 5.25 3.45 0.00 peak 362 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HB# ) ( resid 138 and name HN ) 4.49 2.69 0.00 peak 376 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HB# ) ( resid 139 and name HN ) 6.00 4.20 0.00 peak 550 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HG# ) ( resid 137 and name HE# ) 3.68 1.88 0.00 peak 55 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HG# ) ( resid 148 and name HD1# ) 5.88 4.08 0.00 peak 1255 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 137 and name HE# ) ( resid 148 and name HG1# ) 3.43 1.63 0.00 peak 61 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HN ) ( resid 138 and name HB# ) 4.00 2.20 0.00 peak 377 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HN ) ( resid 138 and name HG# ) 4.77 2.97 0.00 peak 378 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 138 and name HD# ) 5.62 3.82 0.00 peak 1494 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HA ) ( resid 142 and name HG# ) 5.53 3.73 0.00 peak 550 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HB# ) ( resid 138 and name HD# ) 4.21 2.41 0.00 peak 544 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HB# ) ( resid 139 and name HN ) 5.15 3.35 0.00 peak 397 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HB# ) ( resid 141 and name HN ) 6.00 4.20 0.00 peak 191 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 138 and name HB# ) ( resid 142 and name HG# ) 4.97 3.17 0.00 peak 438 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HN ) ( resid 140 and name HA# ) 5.82 4.02 0.00 peak 1381 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB2 ) ( resid 140 and name HA# ) 5.95 4.15 0.00 peak 1378 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB2 ) ( resid 156 and name HB# ) 6.00 4.20 0.00 peak 904 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB1 ) ( resid 140 and name HA# ) 6.00 4.20 0.00 peak 1378 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 139 and name HB1 ) ( resid 156 and name HB# ) 6.00 4.20 0.00 peak 903 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA# ) ( resid 141 and name HB2 ) 6.00 4.20 0.00 peak 262 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA# ) ( resid 148 and name HG2# ) 4.62 2.82 0.00 peak 17 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA# ) ( resid 148 and name HG1# ) 6.00 4.20 0.00 peak 1380 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA# ) ( resid 148 and name HD1# ) 4.79 2.99 0.00 peak 1256 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA# ) ( resid 156 and name HB# ) 4.72 2.92 0.00 peak 917 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 140 and name HA# ) ( resid 156 and name HD# ) 5.06 3.26 0.00 peak 863 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 141 and name HB1 ) ( resid 144 and name HB# ) 5.55 3.75 0.00 peak 311 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 142 and name HB# ) 4.21 2.41 0.00 peak 38 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 142 and name HG# ) 4.67 2.87 0.00 peak 40 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 142 and name HD# ) 6.00 4.20 0.00 peak 39 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HN ) ( resid 142 and name HE# ) 6.00 4.20 0.00 peak 36 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HA ) ( resid 142 and name HG# ) 4.35 2.55 0.00 peak 666 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HA ) ( resid 142 and name HD# ) 5.55 3.75 0.00 peak 621 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HB# ) ( resid 143 and name HN ) 4.72 2.92 0.00 peak 491 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 142 and name HB# ) ( resid 144 and name HN ) 6.00 4.20 0.00 peak 544 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 143 and name HN ) ( resid 143 and name HB# ) 4.61 2.81 0.00 peak 495 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 143 and name HB# ) ( resid 145 and name HN ) 5.45 3.65 0.00 peak 953 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 144 and name HN ) ( resid 144 and name HB# ) 4.68 2.88 0.00 peak 459 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 145 and name HN ) ( resid 145 and name HB# ) 4.67 2.87 0.00 peak 324 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 145 and name HB# ) ( resid 147 and name HN ) 5.72 3.92 0.00 peak 466 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 146 and name HA# ) ( resid 147 and name HA ) 5.59 3.79 0.00 peak 1383 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HN ) ( resid 147 and name HB# ) 4.66 2.86 0.00 peak 455 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HN ) ( resid 147 and name HG# ) 5.22 3.42 0.00 peak 453 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HA ) ( resid 147 and name HD# ) 5.09 3.29 0.00 peak 129 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HB# ) ( resid 148 and name HN ) 4.81 3.01 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 147 and name HG# ) ( resid 148 and name HN ) 5.83 4.03 0.00 peak 48 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HA ) ( resid 148 and name HG1# ) 4.71 2.91 0.00 peak 867 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 148 and name HG2# ) ( resid 156 and name HB# ) 6.00 4.20 0.00 peak 251 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HN ) ( resid 152 and name HG# ) 5.62 3.82 0.00 peak 7 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HB# ) ( resid 150 and name HN ) 4.56 2.76 0.00 peak 175 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 149 and name HB# ) ( resid 151 and name HN ) 4.93 3.13 0.00 peak 403 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HB# ) ( resid 151 and name HN ) 4.63 2.83 0.00 peak 372 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HB# ) ( resid 153 and name HB1 ) 5.37 3.57 0.00 peak 295 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HD# ) ( resid 154 and name HD## ) 5.24 3.44 0.00 peak 24 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 150 and name HE# ) ( resid 154 and name HD## ) 4.98 3.18 0.00 peak 82 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HN ) ( resid 151 and name HB# ) 4.16 2.36 0.00 peak 371 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HA ) ( resid 154 and name HB# ) 5.71 3.91 0.00 peak 915 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HA ) ( resid 154 and name HD## ) 4.99 3.19 0.00 peak 656 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 151 and name HB# ) ( resid 152 and name HN ) 4.46 2.66 0.00 peak 143 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HN ) ( resid 152 and name HG# ) 4.43 2.63 0.00 peak 142 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HA ) ( resid 152 and name HG# ) 4.53 2.73 0.00 peak 592 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 152 and name HG# ) ( resid 153 and name HN ) 6.00 4.20 0.00 peak 1087 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HA ) ( resid 156 and name HB# ) 4.50 2.70 0.00 peak 455 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HB2 ) ( resid 156 and name HB# ) 5.89 4.09 0.00 peak 274 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 153 and name HD# ) ( resid 154 and name HD## ) 5.25 3.45 0.00 peak 41 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HN ) ( resid 154 and name HB# ) 4.44 2.64 0.00 peak 297 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HN ) ( resid 154 and name HD## ) 5.53 3.73 0.00 peak 299 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HA ) ( resid 154 and name HD## ) 4.21 2.41 0.00 peak 1268 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HA ) ( resid 157 and name HG# ) 5.23 3.43 0.00 peak 628 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HB# ) ( resid 154 and name HD## ) 3.85 2.05 0.00 peak 799 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HB# ) ( resid 155 and name HN ) 4.98 3.18 0.00 peak 203 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HD## ) ( resid 157 and name HN ) 6.00 4.20 0.00 peak 583 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 154 and name HD## ) ( resid 157 and name HG# ) 5.89 4.09 0.00 peak 1082 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HN ) ( resid 155 and name HB# ) 4.47 2.67 0.00 peak 532 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HN ) ( resid 155 and name HG# ) 5.59 3.79 0.00 peak 416 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 155 and name HA ) ( resid 158 and name HB# ) 5.11 3.31 0.00 peak 430 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 156 and name HB# ) 4.15 2.35 0.00 peak 165 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HN ) ( resid 157 and name HG# ) 5.69 3.89 0.00 peak 175 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HB# ) ( resid 157 and name HN ) 4.89 3.09 0.00 peak 433 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HD# ) ( resid 157 and name HB# ) 6.00 4.20 0.00 peak 1472 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 156 and name HD# ) ( resid 157 and name HG# ) 6.00 4.20 0.00 peak 1472 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 157 and name HB# ) 4.53 2.73 0.00 peak 435 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HN ) ( resid 160 and name HG## ) 6.00 4.20 0.00 peak 583 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HA ) ( resid 160 and name HG## ) 5.30 3.50 0.00 peak 879 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HB# ) ( resid 157 and name HE# ) 4.35 2.55 0.00 peak 467 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HB# ) ( resid 160 and name HG## ) 5.49 3.69 0.00 peak 895 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 157 and name HG# ) ( resid 157 and name HE# ) 4.01 2.21 0.00 peak 77 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 158 and name HB# ) 4.42 2.62 0.00 peak 241 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HN ) ( resid 158 and name HG# ) 6.00 4.20 0.00 peak 242 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 158 and name HA ) ( resid 159 and name HA# ) 5.68 3.88 0.00 peak 605 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HN ) ( resid 160 and name HG## ) 4.59 2.79 0.00 peak 262 volume 0.00 ppm1 0.000 ppm2 0.000 assign ( resid 160 and name HG## ) ( resid 161 and name HN ) 5.16 3.36 0.00 peak 1 volume 0.00 ppm1 0.000 ppm2 0.000
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