NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
612570 | 5ui7 | 30230 | cing | 1-original | 1 | DYANA/DIANA | distance | NOE | simple |
# Restraints file 1: klebsidin-final_restraints.upl 18 TYR H 18 TYR QD 2.67 #peak 2 #SUP 0.35 #QF 0.35 4 GLY HA2 18 TYR H 5.22 #peak 7 #SUP 0.74 #QF 0.41 5 PRO HD2 18 TYR H 5.50 #peak 7 #SUP 0.74 #QF 0.41 2 SER H 16 MET HB2 4.12 #peak 20 #SUP 0.24 #QF 0.24 2 SER H 3 ASP H 4.36 #peak 22 #SUP 0.77 #QF 0.77 3 ASP H 4 GLY H 4.45 #peak 24 #SUP 0.89 #QF 0.89 7 ILE HG12 17 HIS HE1 3.87 #peak 28 #SUP 0.45 #QF 0.45 7 ILE H 7 ILE QG2 4.06 #peak 30 #SUP 0.52 #QF 0.26 7 ILE H 7 ILE QD1 4.29 #peak 30 #SUP 0.52 #QF 0.26 17 HIS HA 17 HIS HE1 5.50 #peak 32 #SUP 0.60 #QF 0.25 6 ILE QD1 7 ILE H 4.72 #peak 33 #SUP 0.41 #QF 0.41 7 ILE H 18 TYR H 5.50 #peak 35 #SUP 0.50 #QF 0.50 7 ILE H 8 GLU H 5.50 #peak 36 #SUP 0.57 #QF 0.57 7 ILE H 7 ILE HB 2.55 #peak 38 #SUP 0.67 #QF 0.67 6 ILE HB 7 ILE H 2.70 #peak 39 #SUP 0.38 #QF 0.38 7 ILE H 18 TYR QE 4.61 #peak 40 #SUP 0.95 #QF 0.95 6 ILE H 7 ILE H 4.58 #peak 41 #SUP 0.88 #QF 0.88 7 ILE H 18 TYR QD 5.13 #peak 42 #SUP 0.91 #QF 0.91 6 ILE HG12 7 ILE H 4.92 #peak 44 #SUP 0.51 #QF 0.51 16 MET H 16 MET HB2 2.83 #peak 60 #SUP 0.30 #QF 0.30 15 VAL HA 16 MET H 3.19 #peak 61 #SUP 0.59 #QF 0.59 18 TYR H 19 GLY H 4.38 #peak 65 #SUP 0.43 #QF 0.43 5 PRO HD2 19 GLY H 4.42 #peak 67 #SUP 0.73 #QF 0.73 18 TYR HB2 19 GLY H 2.68 #peak 69 #SUP 0.61 #QF 0.61 6 ILE H 17 HIS HB3 3.49 #peak 76 #SUP 0.96 #QF 0.96 5 PRO HD2 6 ILE H 2.84 #peak 77 #SUP 0.66 #QF 0.66 5 PRO HG3 6 ILE H 4.21 #peak 78 #SUP 0.81 #QF 0.81 6 ILE H 18 TYR H 3.24 #peak 80 #SUP 0.98 #QF 0.98 6 ILE H 18 TYR QD 4.54 #peak 84 #SUP 0.78 #QF 0.78 5 PRO HB3 6 ILE H 4.27 #peak 85 #SUP 0.76 #QF 0.76 6 ILE H 6 ILE QG2 3.26 #peak 86 #SUP 0.67 #QF 0.67 6 ILE H 17 HIS HD2 3.90 #peak 88 #SUP 0.60 #QF 0.60 4 GLY H 18 TYR H 4.29 #peak 95 #SUP 0.56 #QF 0.56 4 GLY H 17 HIS HD2 5.29 #peak 98 #SUP 0.61 #QF 0.61 7 ILE HA 8 GLU H 2.45 #peak 112 #SUP 0.56 #QF 0.56 8 GLU H 18 TYR H 4.59 #peak 115 #SUP 0.93 #QF 0.93 8 GLU H 18 TYR QD 3.99 #peak 118 #SUP 0.70 #QF 0.70 7 ILE HB 8 GLU H 4.10 #peak 120 #SUP 0.53 #QF 0.53 9 PHE H 18 TYR QE 3.72 #peak 129 #SUP 0.97 #QF 0.97 9 PHE H 9 PHE QE 4.43 #peak 130 #SUP 0.90 #QF 0.90 8 GLU HB3 9 PHE H 3.88 #peak 134 #SUP 0.51 #QF 0.51 8 GLU HG3 9 PHE H 5.33 #peak 137 #SUP 0.43 #QF 0.43 1 GLY H 8 GLU HG2 4.03 #peak 150 #SUP 0.38 #QF 0.38 1 GLY H 18 TYR H 4.97 #peak 152 #SUP 0.84 #QF 0.84 1 GLY H 16 MET HB3 4.41 #peak 153 #SUP 0.32 #QF 0.32 1 GLY H 2 SER H 3.31 #peak 154 #SUP 0.71 #QF 0.71 1 GLY H 18 TYR HB3 3.33 #peak 155 #SUP 0.73 #QF 0.73 1 GLY H 8 GLU HA 5.30 #peak 157 #SUP 0.90 #QF 0.90 1 GLY H 3 ASP H 5.50 #peak 158 #SUP 0.92 #QF 0.92 8 GLU HA 10 PHE HZ 4.82 #peak 177 #SUP 0.57 #QF 0.57 9 PHE H 9 PHE QD 2.99 #peak 181 #SUP 0.96 #QF 0.96 9 PHE HZ 10 PHE QD 5.42 #peak 187 #SUP 0.65 #QF 0.65 10 PHE HA 10 PHE QD 3.91 #peak 188 #SUP 0.94 #QF 0.94 9 PHE QE 10 PHE QD 4.49 #peak 192 #SUP 0.42 #QF 0.42 9 PHE H 10 PHE QD 4.90 #peak 194 #SUP 0.41 #QF 0.41 18 TYR QD 19 GLY H 3.06 #peak 199 #SUP 0.77 #QF 0.77 6 ILE HA 18 TYR QD 5.50 #peak 203 #SUP 0.99 #QF 0.64 6 ILE HG13 18 TYR QD 3.09 #peak 208 #SUP 0.61 #QF 0.61 8 GLU HA 18 TYR QE 2.74 #peak 219 #SUP 0.44 #QF 0.44 6 ILE HG12 18 TYR QE 4.44 #peak 220 #SUP 0.53 #QF 0.53 18 TYR H 18 TYR QE 4.80 #peak 226 #SUP 0.82 #QF 0.82 10 PHE QE 18 TYR QE 4.66 #peak 227 #SUP 0.70 #QF 0.70 18 TYR QE 19 GLY H 5.18 #peak 228 #SUP 0.91 #QF 0.91 9 PHE QE 18 TYR QE 4.26 #peak 229 #SUP 0.94 #QF 0.94 6 ILE HA 18 TYR QE 5.14 #peak 230 #SUP 0.90 #QF 0.90 9 PHE HZ 18 TYR QE 5.00 #peak 231 #SUP 0.98 #QF 0.98 9 PHE QD 18 TYR QE 4.10 #peak 232 #SUP 0.85 #QF 0.85 6 ILE H 18 TYR QE 5.16 #peak 233 #SUP 0.47 #QF 0.47 7 ILE QD1 17 HIS HD2 3.97 #peak 237 #SUP 0.57 #QF 0.57 17 HIS HD2 18 TYR H 4.13 #peak 239 #SUP 0.91 #QF 0.91 6 ILE HA 17 HIS HD2 4.00 #peak 240 #SUP 0.63 #QF 0.63 7 ILE HB 17 HIS HD2 4.84 #peak 242 #SUP 0.94 #QF 0.94 7 ILE H 17 HIS HD2 3.81 #peak 245 #SUP 0.47 #QF 0.47 17 HIS HA 17 HIS HB3 2.59 #peak 258 #SUP 0.67 #QF 0.67 7 ILE H 17 HIS HA 4.82 #peak 261 #SUP 0.99 #QF 0.99 17 HIS HA 18 TYR HB3 4.25 #peak 262 #SUP 0.95 #QF 0.95 8 GLU HG3 17 HIS HA 3.20 #peak 263 #SUP 0.76 #QF 0.76 6 ILE H 17 HIS HA 5.20 #peak 264 #SUP 0.54 #QF 0.54 17 HIS HA 18 TYR QD 3.26 #peak 265 #SUP 0.72 #QF 0.72 8 GLU H 17 HIS HA 2.93 #peak 266 #SUP 0.23 #QF 0.23 1 GLY H 17 HIS HA 4.43 #peak 267 #SUP 0.71 #QF 0.71 17 HIS HA 18 TYR QE 5.09 #peak 270 #SUP 0.33 #QF 0.33 3 ASP HA 17 HIS HB3 3.70 #peak 281 #SUP 0.70 #QF 0.70 3 ASP HA 17 HIS HD2 5.50 #peak 283 #SUP 0.67 #QF 0.67 3 ASP HA 4 GLY HA2 4.90 #peak 284 #SUP 0.27 #QF 0.27 18 TYR HA 19 GLY H 2.93 #peak 306 #SUP 0.53 #QF 0.53 3 ASP H 18 TYR HA 4.92 #peak 307 #SUP 0.83 #QF 0.83 18 TYR HA 18 TYR HB2 2.78 #peak 309 #SUP 0.85 #QF 0.85 5 PRO HD2 18 TYR HA 4.76 #peak 310 #SUP 0.89 #QF 0.89 18 TYR HA 18 TYR QD 3.74 #peak 311 #SUP 0.98 #QF 0.98 4 GLY HA2 18 TYR HA 4.65 #peak 312 #SUP 0.54 #QF 0.54 18 TYR HA 18 TYR HB3 2.65 #peak 313 #SUP 0.93 #QF 0.93 1 GLY H 18 TYR HA 5.28 #peak 314 #SUP 0.94 #QF 0.94 2 SER HA 3 ASP H 3.53 #peak 335 #SUP 0.85 #QF 0.85 5 PRO HA 17 HIS HD2 4.35 #peak 354 #SUP 0.75 #QF 0.75 10 PHE HA 10 PHE HB3 2.71 #peak 360 #SUP 0.55 #QF 0.55 4 GLY HA3 17 HIS HA 5.50 #peak 362 #SUP 0.74 #QF 0.74 4 GLY HA3 18 TYR QD 5.04 #peak 364 #SUP 0.75 #QF 0.75 6 ILE HA 7 ILE H 2.40 #peak 365 #SUP 0.76 #QF 0.76 6 ILE HA 7 ILE HG13 4.03 #peak 367 #SUP 0.76 #QF 0.76 4 GLY H 4 GLY HA3 2.93 #peak 369 #SUP 0.47 #QF 0.47 9 PHE HA 9 PHE HB3 2.97 #peak 370 #SUP 0.37 #QF 0.37 4 GLY HA3 18 TYR H 3.71 #peak 371 #SUP 0.46 #QF 0.46 9 PHE HA 9 PHE HB2 2.97 #peak 372 #SUP 0.69 #QF 0.69 9 PHE HA 9 PHE QD 3.78 #peak 373 #SUP 0.78 #QF 0.78 8 GLU HA 17 HIS HA 5.24 #peak 396 #SUP 0.85 #QF 0.57 15 VAL HA 16 MET HA 5.48 #peak 396 #SUP 0.85 #QF 0.57 8 GLU HA 8 GLU HG3 3.07 #peak 397 #SUP 0.87 #QF 0.87 8 GLU HA 9 PHE QD 4.63 #peak 400 #SUP 0.96 #QF 0.91 8 GLU HA 10 PHE QE 4.78 #peak 402 #SUP 0.86 #QF 0.86 8 GLU HA 9 PHE QE 5.19 #peak 405 #SUP 0.57 #QF 0.57 8 GLU HA 18 TYR QD 3.00 #peak 406 #SUP 0.42 #QF 0.42 7 ILE HA 17 HIS HD2 3.33 #peak 422 #SUP 0.57 #QF 0.57 7 ILE HA 18 TYR H 3.93 #peak 425 #SUP 0.63 #QF 0.63 7 ILE HA 9 PHE H 5.50 #peak 427 #SUP 0.85 #QF 0.85 7 ILE HA 7 ILE HG13 3.29 #peak 428 #SUP 0.99 #QF 0.99 6 ILE HA 7 ILE HA 4.50 #peak 430 #SUP 0.90 #QF 0.90 7 ILE HA 17 HIS HB2 5.50 #peak 431 #SUP 0.59 #QF 0.59 7 ILE HA 18 TYR QE 4.69 #peak 432 #SUP 0.82 #QF 0.82 7 ILE HA 18 TYR QD 3.98 #peak 435 #SUP 0.59 #QF 0.59 4 GLY HA3 5 PRO HD3 3.29 #peak 452 #SUP 0.79 #QF 0.79 5 PRO HD3 6 ILE H 3.89 #peak 453 #SUP 0.80 #QF 0.80 4 GLY H 5 PRO HD3 5.31 #peak 454 #SUP 0.53 #QF 0.53 4 GLY HA2 17 HIS HB3 4.63 #peak 459 #SUP 0.39 #QF 0.39 6 ILE HA 17 HIS HB3 4.89 #peak 460 #SUP 0.66 #QF 0.66 7 ILE HA 17 HIS HB3 4.06 #peak 463 #SUP 0.70 #QF 0.70 4 GLY H 17 HIS HB3 3.16 #peak 465 #SUP 0.83 #QF 0.83 6 ILE HG13 17 HIS HB3 5.46 #peak 466 #SUP 0.40 #QF 0.40 17 HIS HB3 17 HIS HD2 2.86 #peak 467 #SUP 0.30 #QF 0.30 18 TYR H 18 TYR HB2 4.15 #peak 470 #SUP 0.78 #QF 0.78 9 PHE H 10 PHE HB3 4.47 #peak 522 #SUP 0.77 #QF 0.77 4 GLY H 17 HIS HB2 2.57 #peak 523 #SUP 0.29 #QF 0.29 9 PHE QE 10 PHE HB3 4.88 #peak 525 #SUP 0.96 #QF 0.96 4 GLY HA2 17 HIS HB2 4.47 #peak 527 #SUP 0.45 #QF 0.45 9 PHE QD 10 PHE HB3 4.06 #peak 531 #SUP 0.37 #QF 0.37 17 HIS HB2 18 TYR QD 5.36 #peak 533 #SUP 0.99 #QF 0.99 17 HIS HB2 18 TYR H 3.39 #peak 535 #SUP 0.77 #QF 0.77 8 GLU H 17 HIS HB2 5.50 #peak 536 #SUP 0.56 #QF 0.56 1 GLY H 16 MET HB2 4.34 #peak 551 #SUP 0.62 #QF 0.62 10 PHE QE 12 PRO HB2 4.96 #peak 553 #SUP 0.54 #QF 0.54 10 PHE HZ 12 PRO HB2 5.50 #peak 555 #SUP 0.52 #QF 0.52 5 PRO HB3 6 ILE HG12 5.35 #peak 558 #SUP 0.99 #QF 0.99 4 GLY HA2 5 PRO HB3 5.24 #peak 560 #SUP 0.68 #QF 0.68 8 GLU HG2 10 PHE HZ 4.48 #peak 566 #SUP 0.73 #QF 0.73 8 GLU H 8 GLU HG2 4.16 #peak 567 #SUP 0.71 #QF 0.71 8 GLU HG2 18 TYR HB2 3.74 #peak 568 #SUP 0.89 #QF 0.89 8 GLU HG2 10 PHE QD 4.84 #peak 569 #SUP 0.74 #QF 0.74 8 GLU HG2 10 PHE QE 4.91 #peak 570 #SUP 0.75 #QF 0.75 8 GLU HG2 18 TYR QD 2.82 #peak 571 #SUP 0.96 #QF 0.96 8 GLU HB3 8 GLU HG2 2.83 #peak 572 #SUP 0.93 #QF 0.93 8 GLU HG2 18 TYR QE 3.89 #peak 574 #SUP 0.94 #QF 0.94 16 MET HB2 16 MET QE 4.07 #peak 575 #SUP 0.52 #QF 0.52 8 GLU HG2 9 PHE H 4.67 #peak 578 #SUP 0.60 #QF 0.60 4 GLY HA2 5 PRO HG3 4.89 #peak 582 #SUP 0.46 #QF 0.46 16 MET HA 16 MET QE 4.37 #peak 583 #SUP 0.45 #QF 0.45 5 PRO HG2 6 ILE H 2.71 #peak 587 #SUP 0.69 #QF 0.69 10 PHE QE 12 PRO HB3 3.95 #peak 589 #SUP 0.67 #QF 0.67 10 PHE QD 12 PRO HB3 4.25 #peak 594 #SUP 0.81 #QF 0.81 10 PHE HZ 12 PRO HB3 4.31 #peak 595 #SUP 0.91 #QF 0.91 8 GLU HG3 18 TYR HB3 3.51 #peak 605 #SUP 0.42 #QF 0.42 8 GLU HG3 18 TYR H 3.94 #peak 606 #SUP 0.51 #QF 0.51 8 GLU HG3 18 TYR QE 4.19 #peak 607 #SUP 0.70 #QF 0.70 7 ILE HA 8 GLU HG3 4.64 #peak 608 #SUP 0.87 #QF 0.29 8 GLU HG3 18 TYR QD 2.82 #peak 609 #SUP 0.96 #QF 0.96 7 ILE HA 8 GLU HB2 4.68 #peak 613 #SUP 0.61 #QF 0.61 8 GLU HB2 18 TYR QD 4.37 #peak 614 #SUP 0.91 #QF 0.91 8 GLU HB2 18 TYR QE 5.24 #peak 615 #SUP 0.99 #QF 0.99 8 GLU H 8 GLU HB2 3.11 #peak 616 #SUP 0.81 #QF 0.81 8 GLU HB2 17 HIS HA 4.42 #peak 617 #SUP 0.54 #QF 0.54 1 GLY H 8 GLU HB2 3.92 #peak 619 #SUP 0.86 #QF 0.86 8 GLU HB2 18 TYR HB3 5.05 #peak 622 #SUP 0.51 #QF 0.51 6 ILE HA 7 ILE HB 4.76 #peak 625 #SUP 0.34 #QF 0.34 7 ILE HB 9 PHE H 5.50 #peak 627 #SUP 0.76 #QF 0.76 7 ILE HB 17 HIS HA 5.10 #peak 628 #SUP 0.52 #QF 0.52 7 ILE HB 9 PHE QE 5.39 #peak 632 #SUP 0.96 #QF 0.96 7 ILE HG13 17 HIS HA 5.39 #peak 633 #SUP 0.78 #QF 0.78 7 ILE H 7 ILE HG13 2.75 #peak 637 #SUP 0.90 #QF 0.90 7 ILE HB 7 ILE HG13 2.69 #peak 638 #SUP 0.65 #QF 0.65 7 ILE HG13 8 GLU H 4.88 #peak 639 #SUP 0.43 #QF 0.43 7 ILE HG13 17 HIS HD2 3.28 #peak 640 #SUP 0.44 #QF 0.44 8 GLU HB3 18 TYR QE 5.16 #peak 642 #SUP 0.93 #QF 0.93 8 GLU HB3 18 TYR QD 4.44 #peak 643 #SUP 0.98 #QF 0.98 8 GLU HB3 17 HIS HA 5.50 #peak 645 #SUP 0.52 #QF 0.52 8 GLU HB3 10 PHE HZ 4.81 #peak 647 #SUP 0.72 #QF 0.72 8 GLU H 8 GLU HB3 3.68 #peak 649 #SUP 0.54 #QF 0.54 8 GLU HB3 10 PHE QE 4.88 #peak 650 #SUP 0.52 #QF 0.52 1 GLY H 8 GLU HB3 4.43 #peak 651 #SUP 0.56 #QF 0.56 8 GLU HA 8 GLU HB3 2.67 #peak 652 #SUP 0.50 #QF 0.50 8 GLU HB3 18 TYR HB3 4.91 #peak 653 #SUP 0.41 #QF 0.41 6 ILE H 6 ILE HG12 2.64 #peak 657 #SUP 0.86 #QF 0.86 5 PRO HD3 6 ILE HG12 4.74 #peak 660 #SUP 0.97 #QF 0.97 5 PRO HG2 6 ILE HG12 2.66 #peak 661 #SUP 0.96 #QF 0.96 5 PRO HD2 6 ILE HG12 3.56 #peak 662 #SUP 0.90 #QF 0.90 6 ILE HG12 18 TYR QD 4.45 #peak 663 #SUP 0.90 #QF 0.90 6 ILE HA 6 ILE HG12 3.72 #peak 664 #SUP 0.78 #QF 0.78 6 ILE HG12 18 TYR H 4.43 #peak 667 #SUP 0.61 #QF 0.61 7 ILE HA 7 ILE HG12 2.98 #peak 669 #SUP 0.86 #QF 0.86 7 ILE HG12 17 HIS HD2 3.33 #peak 671 #SUP 0.76 #QF 0.76 6 ILE HA 6 ILE QG2 2.40 #peak 676 #SUP 0.69 #QF 0.69 5 PRO HB3 6 ILE QG2 4.99 #peak 677 #SUP 0.84 #QF 0.84 6 ILE HB 9 PHE QE 4.84 #peak 678 #SUP 0.97 #QF 0.84 6 ILE QG2 9 PHE QE 5.46 #peak 678 #SUP 0.97 #QF 0.84 6 ILE HB 18 TYR QE 3.04 #peak 680 #SUP 0.78 #QF 0.78 6 ILE HB 9 PHE HZ 5.50 #peak 681 #SUP 0.93 #QF 0.74 6 ILE QG2 9 PHE HZ 5.50 #peak 681 #SUP 0.93 #QF 0.74 5 PRO HG2 6 ILE QG2 3.10 #peak 685 #SUP 0.45 #QF 0.45 6 ILE HG13 18 TYR H 3.44 #peak 687 #SUP 0.75 #QF 0.75 6 ILE H 6 ILE HG13 2.85 #peak 688 #SUP 0.54 #QF 0.54 7 ILE QG2 18 TYR H 5.50 #peak 697 #SUP 0.82 #QF 0.82 7 ILE QG2 18 TYR QE 4.97 #peak 699 #SUP 0.96 #QF 0.96 7 ILE QG2 9 PHE QE 5.28 #peak 700 #SUP 0.95 #QF 0.95 7 ILE QG2 9 PHE H 3.99 #peak 702 #SUP 0.90 #QF 0.90 7 ILE QG2 8 GLU HA 3.99 #peak 704 #SUP 0.80 #QF 0.80 7 ILE QG2 8 GLU H 3.20 #peak 706 #SUP 0.71 #QF 0.71 7 ILE QG2 9 PHE HA 4.00 #peak 707 #SUP 0.61 #QF 0.61 7 ILE QG2 18 TYR QD 4.75 #peak 709 #SUP 0.65 #QF 0.65 7 ILE HA 7 ILE QG2 2.62 #peak 710 #SUP 0.60 #QF 0.60 7 ILE QG2 17 HIS HA 3.80 #peak 711 #SUP 0.24 #QF 0.24 7 ILE QG2 9 PHE QD 4.42 #peak 713 #SUP 0.36 #QF 0.36 5 PRO HG2 6 ILE QD1 3.41 #peak 718 #SUP 0.59 #QF 0.59 6 ILE QD1 18 TYR QD 3.78 #peak 719 #SUP 0.59 #QF 0.59 6 ILE QD1 18 TYR QE 3.04 #peak 720 #SUP 0.62 #QF 0.62 6 ILE QD1 18 TYR HB3 5.50 #peak 721 #SUP 0.64 #QF 0.64 6 ILE QD1 9 PHE HZ 5.50 #peak 722 #SUP 0.68 #QF 0.68 6 ILE QD1 9 PHE QE 5.50 #peak 723 #SUP 0.71 #QF 0.71 5 PRO HD2 6 ILE QD1 4.24 #peak 725 #SUP 0.84 #QF 0.84 6 ILE QD1 18 TYR HB2 5.27 #peak 726 #SUP 0.84 #QF 0.84 6 ILE H 6 ILE QD1 3.67 #peak 727 #SUP 0.86 #QF 0.86 6 ILE QG2 6 ILE QD1 2.46 #peak 728 #SUP 0.89 #QF 0.67 6 ILE QD1 18 TYR H 4.78 #peak 729 #SUP 0.93 #QF 0.93 6 ILE QD1 19 GLY H 5.22 #peak 730 #SUP 0.93 #QF 0.93 5 PRO HD3 6 ILE QD1 5.50 #peak 731 #SUP 0.99 #QF 0.99 1 GLY H 1 GLY QA 2.40 #peak 439 1 GLY H 2 SER QB 4.80 #peak 148 1 GLY QA 8 GLU HG3 4.14 #peak 608 2 SER H 2 SER QB 3.20 #peak 19 2 SER QB 3 ASP H 2.66 #peak 25 2 SER QB 3 ASP QB 4.45 #peak 515 2 SER QB 18 TYR HA 3.75 #peak 305 7 ILE QG2 9 PHE QB 4.84 #peak 484 9 PHE H 9 PHE QB 3.16 #peak 135 9 PHE HA 9 PHE QB 2.46 #peak 370 10 PHE QE 12 PRO QD 5.21 #peak 445 15 VAL HA 16 MET QG 4.97 #peak 390 15 VAL QQG 16 MET QG 4.66 #peak 549 16 MET H 16 MET QG 3.96 #peak 62 16 MET QG 16 MET QE 3.51 #peak 580 18 TYR H 19 GLY QA 4.83 #peak 8 18 TYR QD 19 GLY QA 4.11 #peak 212 19 GLY H 19 GLY QA 2.34 #peak 418
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