NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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17374 |
2cnp   |
4430 | cing | 1-original | 2 | MR format | distance | NOE | simple |
REMARK 3 NOE DERIVED DISTANCE UPPER BOUND RESTRAINTS-- REMARK 3 THE COMPLETE SET OF DISTANCE UPPER-BOUNDS DERIVED FROM NOES REMARK 3 FOR CA2+ CALCYCLIN ARE GIVEN BELOW. REMARK 3 THESE ARE THE "RAW" CONSTRAINTS WITHOUT ANY CORRECTIONS REMARK 3 APPLIED TO BOUNDS INVOLVING NON-STEREO-SPECIFICALLY REMARK 3 ASSIGNED PROTONS. REMARK 3 THE BOUNDS ARE DERIVED DIFFERENTLY FOR *DIANA* AND *AMBER* REMARK 3 CALCULATIONS, DEPENDING ON THE TREATMENT OF NON-STEREO- REMARK 3 SPECIFICALLY ASSIGNED PROTONS. REMARK 3 REMARK 3 RESTRAINTS EXACTLY AS WOULD BE USED FOR *DIANA* AND REMARK 3 *AMBER* CALCULATIONS MAY BE OBTAINED VIA EMAIL FROM THE REMARK 3 AUTHORS: CHAZIN@SCRIPPS.EDU REMARK 3 *DIANA*- A MIXED PSEUDO-ATOM/ALL-ATOM REPRESENTATION WAS REMARK 3 USED IN WHICH ALL ALPHA, BETA, GAMMA, AND DELTA REMARK 3 METHYLENE PROTONS ARE REPRESENTED BY EITHER PROTON OR REMARK 3 PSEUDO-ATOM POINTS. REMARK 3 REMARK 3 *AMBER*- ALL-ATOM STRUCTURES WERE USED. (R**-6) DISTANCE REMARK 3 WEIGHTING WAS USED FOR ALL NON-STEREO-SPECIFICALLY REMARK 3 ASSIGNED DIASTEREOTOPIC PROTONS, INCLUDING METHYL REMARK 3 GROUPS. AMBIGUOUS NOE RESTRAINTS (CHEMICAL-SHIFT REMARK 3 DEGENERATE VAL AND LEU METHYLS, OR WHEN ONLY ONE OF REMARK 3 TWO NON-STEREO-ASSIGNED METHYLS EXHIBITS AN NOE), REMARK 3 ARE REFERRED TO COMMON CB OR CG ATOMS, RESPECTIVELY. REMARK 3 REMARK 3 PSEUDOATOM NAMES ARE USED FOR DIASTEREOTOPIC PROTONS, REMARK 3 FOR WHICH STEREOSPECIFIC ASSIGNMENTS COULD NOT BE MADE, REMARK 3 AS INDICATED BY A LEADING "Q". METHYL GROUPS ARE REMARK 3 INDICATED BY "Q". REMARK 3 REMARK 3 THE FOLLOWING LIST CONTAINS REMARK 3 2428 INTRAMOLECULAR NOES REMARK 3 386 INTERMOLECULAR NOES REMARK 3 REMARK 3 TABLE OF DISTANCE RESTRAINT UPPER BOUNDS (IN ANGSTROMS) REMARK 3 ATOM 1 ATOM 2 DISTBND REMARK 3 ----------------------------------------------- REMARK 3 2 ALA A QB 2 ALA A HN 5.7 REMARK 3 3 SER A QB 3 SER A HN 4.2 REMARK 3 4 PRO A QD 4 PRO A HB3 5.2 REMARK 3 4 PRO A QD 4 PRO A HB2 5.2 REMARK 3 4 PRO A QG 4 PRO A HA 4.0 REMARK 3 5 LEU A HA 5 LEU A QD1 5.0 REMARK 3 5 LEU A HA 5 LEU A QD2 4.5 REMARK 3 5 LEU A HB3 5 LEU A HN 4.5 REMARK 3 5 LEU A HB2 5 LEU A HN 4.5 REMARK 3 5 LEU A HB3 5 LEU A QD2 5.0 REMARK 3 5 LEU A HB2 5 LEU A QD2 5.0 REMARK 3 5 LEU A QD1 5 LEU A HN 5.7 REMARK 3 5 LEU A QD2 5 LEU A HN 5.7 REMARK 3 6 ASP A HB2 6 ASP A HN 5.2 REMARK 3 6 ASP A HB3 6 ASP A HN 5.2 REMARK 3 7 GLN A HB2 7 GLN A HN 4.5 REMARK 3 7 GLN A HB3 7 GLN A HN 4.5 REMARK 3 7 GLN A QG 7 GLN A HA 4.0 REMARK 3 7 GLN A QG 7 GLN A HN 4.5 REMARK 3 7 GLN A QG 7 GLN A QE2 5.2 REMARK 3 9 ILE A HB 9 ILE A HN 4.5 REMARK 3 9 ILE A HB 9 ILE A QD1 4.5 REMARK 3 9 ILE A QD1 9 ILE A HA 5.0 REMARK 3 9 ILE A QD1 9 ILE A HN 5.0 REMARK 3 9 ILE A QG1 9 ILE A HA 4.5 REMARK 3 9 ILE A QG1 9 ILE A HN 5.0 REMARK 3 9 ILE A QG2 9 ILE A HN 5.7 REMARK 3 11 LEU A HB2 11 LEU A HN 4.5 REMARK 3 11 LEU A HB3 11 LEU A HN 4.5 REMARK 3 11 LEU A HB3 11 LEU A QD1 4.5 REMARK 3 11 LEU A HB3 11 LEU A QD2 4.5 REMARK 3 11 LEU A HG 11 LEU A HA 4.5 REMARK 3 11 LEU A HG 11 LEU A HN 4.5 REMARK 3 11 LEU A QD1 11 LEU A HA 5.0 REMARK 3 11 LEU A QD1 11 LEU A HB2 5.0 REMARK 3 11 LEU A QD1 11 LEU A HN 5.0 REMARK 3 11 LEU A QD2 11 LEU A HA 4.5 REMARK 3 11 LEU A QD2 11 LEU A HB2 5.0 REMARK 3 11 LEU A QD2 11 LEU A HN 5.0 REMARK 3 12 LEU A HA 12 LEU A HG 4.5 REMARK 3 12 LEU A HA 12 LEU A QD1 4.5 REMARK 3 12 LEU A HA 12 LEU A QD2 5.0 REMARK 3 12 LEU A HB2 12 LEU A HN 4.5 REMARK 3 12 LEU A HB2 12 LEU A QD2 6.0 REMARK 3 12 LEU A HB3 12 LEU A HN 4.5 REMARK 3 12 LEU A HG 12 LEU A HN 4.5 REMARK 3 12 LEU A QD1 12 LEU A HB2 5.0 REMARK 3 12 LEU A QD1 12 LEU A HN 5.7 REMARK 3 13 ILE A HA 13 ILE A QG1 5.0 REMARK 3 13 ILE A HB 13 ILE A HN 4.5 REMARK 3 13 ILE A HB 13 ILE A QD1 5.0 REMARK 3 13 ILE A QD1 13 ILE A HA 5.0 REMARK 3 13 ILE A QD1 13 ILE A HN 5.7 REMARK 3 13 ILE A QG1 13 ILE A HN 5.7 REMARK 3 13 ILE A QG2 13 ILE A HA 5.0 REMARK 3 13 ILE A QG2 13 ILE A HN 5.0 REMARK 3 13 ILE A QG2 13 ILE A QG1 5.5 REMARK 3 15 ILE A HA 15 ILE A QD1 5.0 REMARK 3 15 ILE A HA 15 ILE A QG2 5.0 REMARK 3 15 ILE A HB 15 ILE A HN 4.5 REMARK 3 15 ILE A QD1 15 ILE A HB 5.0 REMARK 3 15 ILE A QD1 15 ILE A HN 5.7 REMARK 3 15 ILE A QD1 15 ILE A QG2 5.5 REMARK 3 15 ILE A QG1 15 ILE A HA 5.0 REMARK 3 15 ILE A QG1 15 ILE A HN 5.0 REMARK 3 15 ILE A QG1 15 ILE A QG2 5.5 REMARK 3 15 ILE A QG2 15 ILE A HN 5.7 REMARK 3 16 PHE A HA 16 PHE A CG 5.2 REMARK 3 16 PHE A HN 16 PHE A CG 5.5 REMARK 3 17 HIS A QB 17 HIS A HN 3.4 REMARK 3 18 LYS A QB 18 LYS A HN 4.5 REMARK 3 18 LYS A QB 18 LYS A QD 4.0 REMARK 3 18 LYS A QB 18 LYS A QE 4.5 REMARK 3 18 LYS A QD 18 LYS A HA 4.5 REMARK 3 18 LYS A QD 18 LYS A HN 5.2 REMARK 3 18 LYS A QG 18 LYS A HA 4.0 REMARK 3 18 LYS A QG 18 LYS A HN 4.5 REMARK 3 18 LYS A QG 18 LYS A QE 4.0 REMARK 3 19 TYR A CG 19 TYR A HA 4.2 REMARK 3 19 TYR A HA 19 TYR A HN 3.4 REMARK 3 19 TYR A HN 19 TYR A CG 3.4 REMARK 3 22 LYS A HA 22 LYS A QG 4.5 REMARK 3 22 LYS A QB 22 LYS A HN 4.5 REMARK 3 22 LYS A QB 22 LYS A QE 5.2 REMARK 3 22 LYS A QG 22 LYS A HN 4.5 REMARK 3 22 LYS A QG 22 LYS A QE 4.0 REMARK 3 23 GLU A QB 23 GLU A HN 5.2 REMARK 3 23 GLU A QG 23 GLU A HA 4.5 REMARK 3 23 GLU A QG 23 GLU A HN 4.5 REMARK 3 25 ASP A QB 25 ASP A HN 4.5 REMARK 3 26 LYS A HA 26 LYS A QD 4.5 REMARK 3 26 LYS A QB 26 LYS A HN 4.5 REMARK 3 26 LYS A QD 26 LYS A HN 5.2 REMARK 3 26 LYS A QG 26 LYS A HA 4.5 REMARK 3 26 LYS A QG 26 LYS A HN 5.2 REMARK 3 26 LYS A QG 26 LYS A QE 4.5 REMARK 3 27 HIS A HA 27 HIS A HN 5.2 REMARK 3 27 HIS A HD2 27 HIS A QB 4.2 REMARK 3 27 HIS A HN 27 HIS A QB 5.5 REMARK 3 28 THR A QG2 28 THR A HA 5.0 REMARK 3 28 THR A QG2 28 THR A HN 5.7 REMARK 3 29 LEU A HG 29 LEU A HA 5.2 REMARK 3 29 LEU A QD1 29 LEU A HA 5.7 REMARK 3 29 LEU A QD1 29 LEU A HN 5.7 REMARK 3 29 LEU A QD1 29 LEU A QB 5.7 REMARK 3 29 LEU A QD2 29 LEU A HN 5.7 REMARK 3 29 LEU A QD2 29 LEU A QB 5.0 REMARK 3 30 SER A QB 30 SER A HN 5.2 REMARK 3 32 LYS A HA 32 LYS A QG 4.5 REMARK 3 32 LYS A QB 32 LYS A HN 4.5 REMARK 3 32 LYS A QB 32 LYS A QE 6.0 REMARK 3 32 LYS A QD 32 LYS A HN 4.5 REMARK 3 32 LYS A QE 32 LYS A HA 5.5 REMARK 3 32 LYS A QE 32 LYS A HN 5.5 REMARK 3 32 LYS A QG 32 LYS A QE 4.5 REMARK 3 33 GLU A HA 33 GLU A QG 4.0 REMARK 3 33 GLU A HB2 33 GLU A HN 4.5 REMARK 3 33 GLU A HB3 33 GLU A HN 4.5 REMARK 3 33 GLU A QG 33 GLU A HN 4.5 REMARK 3 34 LEU A HA 34 LEU A HG 4.5 REMARK 3 34 LEU A HA 34 LEU A QD1 5.0 REMARK 3 34 LEU A HB2 34 LEU A HN 5.2 REMARK 3 34 LEU A HB3 34 LEU A HN 5.2 REMARK 3 34 LEU A HB3 34 LEU A QD1 6.0 REMARK 3 34 LEU A QD1 34 LEU A HB2 5.0 REMARK 3 34 LEU A QD1 34 LEU A HN 5.7 REMARK 3 34 LEU A QD2 34 LEU A HA 4.5 REMARK 3 34 LEU A QD2 34 LEU A HB2 5.0 REMARK 3 34 LEU A QD2 34 LEU A HB3 5.0 REMARK 3 34 LEU A QD2 34 LEU A HN 5.7 REMARK 3 35 LYS A HB2 35 LYS A HN 4.5 REMARK 3 35 LYS A HB3 35 LYS A HN 4.5 REMARK 3 35 LYS A QD 35 LYS A HA 4.5 REMARK 3 35 LYS A QD 35 LYS A HB2 4.5 REMARK 3 35 LYS A QD 35 LYS A HN 5.2 REMARK 3 35 LYS A QG 35 LYS A HA 4.0 REMARK 3 35 LYS A QG 35 LYS A HN 5.2 REMARK 3 36 GLU A HA 36 GLU A QG 4.0 REMARK 3 36 GLU A QB 36 GLU A HN 4.5 REMARK 3 36 GLU A QG 36 GLU A HN 4.5 REMARK 3 37 LEU A HA 37 LEU A HG 4.5 REMARK 3 37 LEU A HA 37 LEU A QD1 5.7 REMARK 3 37 LEU A HB2 37 LEU A HN 4.5 REMARK 3 37 LEU A HB2 37 LEU A QD2 5.0 REMARK 3 37 LEU A HB3 37 LEU A HN 4.5 REMARK 3 37 LEU A HB3 37 LEU A QD1 6.0 REMARK 3 37 LEU A HG 37 LEU A HN 5.2 REMARK 3 37 LEU A QD1 37 LEU A HB2 5.0 REMARK 3 37 LEU A QD1 37 LEU A HN 5.7 REMARK 3 37 LEU A QD2 37 LEU A HA 5.7 REMARK 3 38 ILE A HA 38 ILE A QG1 5.0 REMARK 3 38 ILE A HB 38 ILE A HN 4.5 REMARK 3 38 ILE A QD1 38 ILE A HA 5.0 REMARK 3 38 ILE A QD1 38 ILE A HB 4.5 REMARK 3 38 ILE A QD1 38 ILE A HN 5.0 REMARK 3 38 ILE A QD1 38 ILE A QG2 5.0 REMARK 3 38 ILE A QG1 38 ILE A HN 5.0 REMARK 3 38 ILE A QG2 38 ILE A HA 5.0 REMARK 3 38 ILE A QG2 38 ILE A HN 5.0 REMARK 3 38 ILE A QG2 38 ILE A QG1 5.5 REMARK 3 39 GLN A HB2 39 GLN A HN 4.5 REMARK 3 39 GLN A HB3 39 GLN A HN 4.5 REMARK 3 39 GLN A QG 39 GLN A HA 4.0 REMARK 3 39 GLN A QG 39 GLN A HN 4.5 REMARK 3 40 LYS A QB 40 LYS A HN 4.5 REMARK 3 40 LYS A QB 40 LYS A QD 4.0 REMARK 3 40 LYS A QD 40 LYS A HA 4.0 REMARK 3 40 LYS A QD 40 LYS A HN 4.5 REMARK 3 40 LYS A QE 40 LYS A HA 4.5 REMARK 3 40 LYS A QE 40 LYS A HN 5.2 REMARK 3 40 LYS A QE 40 LYS A QB 6.0 REMARK 3 40 LYS A QG 40 LYS A HA 4.0 REMARK 3 40 LYS A QG 40 LYS A HN 4.5 REMARK 3 41 GLU A QB 41 GLU A HN 5.2 REMARK 3 41 GLU A QG 41 GLU A HA 6.0 REMARK 3 42 LEU A HA 42 LEU A QD1 5.0 REMARK 3 42 LEU A HG 42 LEU A HA 4.5 REMARK 3 42 LEU A HG 42 LEU A HN 4.5 REMARK 3 42 LEU A QB 42 LEU A HN 4.5 REMARK 3 42 LEU A QB 42 LEU A QD1 4.5 REMARK 3 42 LEU A QD1 42 LEU A HN 5.7 REMARK 3 42 LEU A QD2 42 LEU A HA 5.0 REMARK 3 42 LEU A QD2 42 LEU A QB 4.5 REMARK 3 43 THR A HA 43 THR A QG2 4.5 REMARK 3 43 THR A HB 43 THR A HN 5.2 REMARK 3 43 THR A QG2 43 THR A HN 5.7 REMARK 3 44 ILE A HB 44 ILE A HN 4.5 REMARK 3 44 ILE A QD1 44 ILE A HA 5.7 REMARK 3 44 ILE A QD1 44 ILE A HB 5.0 REMARK 3 44 ILE A QD1 44 ILE A HN 5.7 REMARK 3 44 ILE A QG1 44 ILE A HA 5.0 REMARK 3 44 ILE A QG1 44 ILE A HN 5.0 REMARK 3 44 ILE A QG2 44 ILE A HA 5.0 REMARK 3 44 ILE A QG2 44 ILE A QG1 5.5 REMARK 3 47 LYS A HB2 47 LYS A HN 5.2 REMARK 3 47 LYS A HB3 47 LYS A HN 5.2 REMARK 3 47 LYS A QE 47 LYS A HA 5.5 REMARK 3 47 LYS A QG 47 LYS A HA 4.0 REMARK 3 47 LYS A QG 47 LYS A HN 4.5 REMARK 3 47 LYS A QG 47 LYS A QE 4.5 REMARK 3 48 LEU A HA 48 LEU A QD1 4.5 REMARK 3 48 LEU A HA 48 LEU A QD2 5.0 REMARK 3 48 LEU A HG 48 LEU A HA 4.0 REMARK 3 48 LEU A HG 48 LEU A HN 4.5 REMARK 3 48 LEU A QB 48 LEU A HN 4.5 REMARK 3 48 LEU A QB 48 LEU A QD1 4.5 REMARK 3 48 LEU A QD1 48 LEU A HN 5.7 REMARK 3 48 LEU A QD2 48 LEU A HN 5.7 REMARK 3 48 LEU A QD2 48 LEU A QB 4.5 REMARK 3 49 GLN A HA 49 GLN A QG 5.0 REMARK 3 49 GLN A HB2 49 GLN A HN 4.5 REMARK 3 49 GLN A HB3 49 GLN A HN 4.5 REMARK 3 50 ASP A QB 50 ASP A HN 4.5 REMARK 3 51 ALA A QB 51 ALA A HN 5.0 REMARK 3 52 GLU A QB 52 GLU A HN 4.5 REMARK 3 52 GLU A QG 52 GLU A HA 4.0 REMARK 3 52 GLU A QG 52 GLU A HN 4.5 REMARK 3 53 ILE A HA 53 ILE A QG1 4.5 REMARK 3 53 ILE A HA 53 ILE A QG2 4.5 REMARK 3 53 ILE A HB 53 ILE A HN 4.5 REMARK 3 53 ILE A QD1 53 ILE A HA 5.0 REMARK 3 53 ILE A QD1 53 ILE A HB 4.5 REMARK 3 53 ILE A QD1 53 ILE A HN 5.7 REMARK 3 53 ILE A QD1 53 ILE A QG2 7.0 REMARK 3 53 ILE A QG1 53 ILE A HN 5.0 REMARK 3 53 ILE A QG1 53 ILE A QG2 5.0 REMARK 3 53 ILE A QG2 53 ILE A HN 5.0 REMARK 3 54 VAL A HA 54 VAL A QG1 4.5 REMARK 3 54 VAL A HB 54 VAL A HN 4.5 REMARK 3 54 VAL A QG1 54 VAL A HN 5.0 REMARK 3 54 VAL A QG2 54 VAL A HA 4.5 REMARK 3 54 VAL A QG2 54 VAL A HN 5.0 REMARK 3 55 LYS A HA 55 LYS A QG 4.5 REMARK 3 55 LYS A QB 55 LYS A HN 4.5 REMARK 3 55 LYS A QB 55 LYS A QE 6.0 REMARK 3 55 LYS A QG 55 LYS A HN 4.5 REMARK 3 56 LEU A HA 56 LEU A HG 4.5 REMARK 3 56 LEU A HG 56 LEU A HN 4.5 REMARK 3 56 LEU A QB 56 LEU A HN 4.5 REMARK 3 56 LEU A QB 56 LEU A QD1 4.5 REMARK 3 56 LEU A QD1 56 LEU A HA 5.0 REMARK 3 56 LEU A QD2 56 LEU A HA 4.5 REMARK 3 56 LEU A QD2 56 LEU A QB 5.0 REMARK 3 57 MET A HB2 57 MET A HN 4.5 REMARK 3 57 MET A HB2 57 MET A QE 5.0 REMARK 3 57 MET A QE 57 MET A HA 5.0 REMARK 3 57 MET A QE 57 MET A HN 5.0 REMARK 3 57 MET A QE 57 MET A QG 4.5 REMARK 3 57 MET A QG 57 MET A HA 5.2 REMARK 3 57 MET A QG 57 MET A HN 4.5 REMARK 3 58 ASP A QB 58 ASP A HN 3.4 REMARK 3 59 ASP A QB 59 ASP A HN 4.5 REMARK 3 60 LEU A HA 60 LEU A QD1 4.5 REMARK 3 60 LEU A HA 60 LEU A QD2 5.0 REMARK 3 60 LEU A HG 60 LEU A HN 4.5 REMARK 3 60 LEU A QB 60 LEU A HN 5.2 REMARK 3 60 LEU A QB 60 LEU A QD1 5.7 REMARK 3 60 LEU A QD2 60 LEU A HN 5.7 REMARK 3 60 LEU A QD2 60 LEU A QB 5.7 REMARK 3 61 ASP A QB 61 ASP A HN 4.5 REMARK 3 62 ARG A HA 62 ARG A QD 5.2 REMARK 3 62 ARG A QB 62 ARG A HN 4.5 REMARK 3 62 ARG A QD 62 ARG A HN 5.2 REMARK 3 62 ARG A QD 62 ARG A QB 4.0 REMARK 3 62 ARG A QG 62 ARG A HA 4.0 REMARK 3 62 ARG A QG 62 ARG A HN 4.5 REMARK 3 62 ARG A QG 62 ARG A QD 4.5 REMARK 3 63 ASN A HB2 63 ASN A QD2 5.7 REMARK 3 63 ASN A HB3 63 ASN A QD2 5.7 REMARK 3 64 LYS A HA 64 LYS A QG 4.0 REMARK 3 64 LYS A QB 64 LYS A HN 5.2 REMARK 3 64 LYS A QE 64 LYS A HA 6.0 REMARK 3 64 LYS A QE 64 LYS A HN 6.0 REMARK 3 64 LYS A QG 64 LYS A HN 4.5 REMARK 3 65 ASP A HB2 65 ASP A HN 4.5 REMARK 3 65 ASP A HB3 65 ASP A HN 4.5 REMARK 3 66 GLN A HA 66 GLN A QG 4.0 REMARK 3 66 GLN A QB 66 GLN A HN 4.5 REMARK 3 66 GLN A QG 66 GLN A HN 4.5 REMARK 3 66 GLN A QG 66 GLN A QE2 4.5 REMARK 3 67 GLU A QB 67 GLU A HN 4.5 REMARK 3 67 GLU A QG 67 GLU A HA 4.0 REMARK 3 67 GLU A QG 67 GLU A HN 4.5 REMARK 3 68 VAL A HA 68 VAL A QG2 6.0 REMARK 3 68 VAL A HB 68 VAL A HN 4.5 REMARK 3 68 VAL A QG1 68 VAL A HA 5.0 REMARK 3 68 VAL A QG1 68 VAL A HN 5.7 REMARK 3 68 VAL A QG2 68 VAL A HN 5.0 REMARK 3 69 ASN A HA 69 ASN A QD2 5.7 REMARK 3 69 ASN A QB 69 ASN A HN 5.2 REMARK 3 69 ASN A QB 69 ASN A QD2 5.7 REMARK 3 70 PHE A HA 70 PHE A CG 4.2 REMARK 3 70 PHE A HN 70 PHE A CG 5.5 REMARK 3 71 GLN A HA 71 GLN A QE2 5.2 REMARK 3 71 GLN A QB 71 GLN A HN 4.5 REMARK 3 71 GLN A QG 71 GLN A HA 4.5 REMARK 3 71 GLN A QG 71 GLN A HN 4.5 REMARK 3 72 GLU A HB2 72 GLU A HN 4.5 REMARK 3 72 GLU A HB3 72 GLU A HN 4.5 REMARK 3 72 GLU A QG 72 GLU A HA 4.0 REMARK 3 72 GLU A QG 72 GLU A HN 4.5 REMARK 3 73 TYR A CG 73 TYR A HN 5.5 REMARK 3 73 TYR A HA 73 TYR A CG 4.2 REMARK 3 73 TYR A HN 73 TYR A QB 3.4 REMARK 3 74 ILE A HA 74 ILE A QD1 5.0 REMARK 3 74 ILE A HB 74 ILE A HN 4.5 REMARK 3 74 ILE A HB 74 ILE A QD1 5.0 REMARK 3 74 ILE A QD1 74 ILE A HN 5.7 REMARK 3 74 ILE A QD1 74 ILE A QG2 7.0 REMARK 3 74 ILE A QG1 74 ILE A HA 5.0 REMARK 3 74 ILE A QG1 74 ILE A HN 5.0 REMARK 3 74 ILE A QG1 74 ILE A QG2 5.5 REMARK 3 74 ILE A QG2 74 ILE A HA 5.0 REMARK 3 74 ILE A QG2 74 ILE A HN 5.0 REMARK 3 75 THR A HA 75 THR A QG2 4.5 REMARK 3 75 THR A HB 75 THR A HN 3.4 REMARK 3 75 THR A QG2 75 THR A HN 4.7 REMARK 3 76 PHE A HA 76 PHE A CG 3.4 REMARK 3 77 LEU A HA 77 LEU A HG 4.5 REMARK 3 77 LEU A HA 77 LEU A QD1 5.7 REMARK 3 77 LEU A HA 77 LEU A QD2 4.5 REMARK 3 77 LEU A HB2 77 LEU A HN 4.5 REMARK 3 77 LEU A HB3 77 LEU A HN 4.5 REMARK 3 77 LEU A HG 77 LEU A HN 4.5 REMARK 3 77 LEU A QD1 77 LEU A HB2 5.0 REMARK 3 77 LEU A QD1 77 LEU A HB3 5.0 REMARK 3 77 LEU A QD1 77 LEU A HN 5.7 REMARK 3 77 LEU A QD2 77 LEU A HB2 4.5 REMARK 3 77 LEU A QD2 77 LEU A HB3 5.0 REMARK 3 77 LEU A QD2 77 LEU A HN 5.0 REMARK 3 80 LEU A HG 80 LEU A HA 4.5 REMARK 3 80 LEU A HG 80 LEU A HN 4.5 REMARK 3 80 LEU A QB 80 LEU A HN 4.5 REMARK 3 80 LEU A QB 80 LEU A QD2 4.5 REMARK 3 80 LEU A QD1 80 LEU A HA 4.5 REMARK 3 80 LEU A QD1 80 LEU A HN 5.0 REMARK 3 80 LEU A QD1 80 LEU A QB 5.0 REMARK 3 80 LEU A QD2 80 LEU A HA 5.0 REMARK 3 80 LEU A QD2 80 LEU A HN 5.0 REMARK 3 81 ALA A QB 81 ALA A HN 5.0 REMARK 3 82 MET A HA 82 MET A QE 5.0 REMARK 3 82 MET A QB 82 MET A HN 5.2 REMARK 3 82 MET A QB 82 MET A QE 6.0 REMARK 3 82 MET A QE 82 MET A HN 5.0 REMARK 3 82 MET A QE 82 MET A QG 4.5 REMARK 3 82 MET A QG 82 MET A HA 4.0 REMARK 3 82 MET A QG 82 MET A HN 4.5 REMARK 3 83 ILE A HA 83 ILE A QD1 6.0 REMARK 3 83 ILE A HA 83 ILE A QG2 5.0 REMARK 3 83 ILE A HB 83 ILE A HN 4.5 REMARK 3 83 ILE A HB 83 ILE A QD1 5.0 REMARK 3 83 ILE A QD1 83 ILE A HN 5.7 REMARK 3 83 ILE A QG1 83 ILE A HA 4.5 REMARK 3 83 ILE A QG1 83 ILE A HN 5.0 REMARK 3 83 ILE A QG2 83 ILE A HN 5.7 REMARK 3 83 ILE A QG2 83 ILE A QG1 5.0 REMARK 3 84 TYR A CG 84 TYR A HN 4.2 REMARK 3 84 TYR A HN 84 TYR A QB 4.2 REMARK 3 85 ASN A HA 85 ASN A QD2 5.7 REMARK 3 85 ASN A HB2 85 ASN A QD2 5.7 REMARK 3 85 ASN A HB3 85 ASN A HN 5.2 REMARK 3 85 ASN A HB3 85 ASN A QD2 5.7 REMARK 3 86 GLU A QB 86 GLU A HN 4.5 REMARK 3 86 GLU A QG 86 GLU A HA 4.0 REMARK 3 86 GLU A QG 86 GLU A HN 4.5 REMARK 3 87 ALA A QB 87 ALA A HN 5.0 REMARK 3 88 LEU A HA 88 LEU A HG 4.5 REMARK 3 88 LEU A HA 88 LEU A QD1 5.7 REMARK 3 88 LEU A HA 88 LEU A QD2 5.0 REMARK 3 88 LEU A HG 88 LEU A HN 4.5 REMARK 3 88 LEU A QB 88 LEU A HN 4.5 REMARK 3 88 LEU A QB 88 LEU A QD1 5.7 REMARK 3 88 LEU A QB 88 LEU A QD2 6.0 REMARK 3 88 LEU A QD1 88 LEU A HN 5.7 REMARK 3 88 LEU A QD2 88 LEU A HN 5.7 REMARK 3 89 LYS A HA 89 LYS A QE 6.0 REMARK 3 89 LYS A QB 89 LYS A HN 4.5 REMARK 3 89 LYS A QD 89 LYS A HA 6.0 REMARK 3 89 LYS A QE 89 LYS A HN 6.0 REMARK 3 89 LYS A QE 89 LYS A QB 4.5 REMARK 3 89 LYS A QG 89 LYS A HA 4.0 REMARK 3 89 LYS A QG 89 LYS A HN 4.5 REMARK 3 89 LYS A QG 89 LYS A QE 4.0 REMARK 3 2 ALA A HN 3 SER A HN 4.2 REMARK 3 2 ALA A QB 3 SER A HN 5.7 REMARK 3 3 SER A HN 2 ALA A HA 3.4 REMARK 3 5 LEU A HN 6 ASP A HN 3.4 REMARK 3 5 LEU A QD1 6 ASP A HN 5.7 REMARK 3 6 ASP A HA 7 GLN A HN 4.5 REMARK 3 6 ASP A HB2 7 GLN A HN 5.2 REMARK 3 6 ASP A HB3 7 GLN A HN 5.2 REMARK 3 6 ASP A HN 7 GLN A HN 3.4 REMARK 3 7 GLN A HB2 8 ALA A HN 4.5 REMARK 3 7 GLN A HB3 8 ALA A HN 4.5 REMARK 3 7 GLN A HN 8 ALA A HN 3.4 REMARK 3 7 GLN A QG 8 ALA A HN 4.5 REMARK 3 9 ILE A HB 10 GLY A HN 4.5 REMARK 3 9 ILE A HN 10 GLY A HN 3.4 REMARK 3 9 ILE A QD1 10 GLY A HN 5.7 REMARK 3 9 ILE A QG2 10 GLY A HN 5.0 REMARK 3 11 LEU A HN 10 GLY A QA 4.2 REMARK 3 11 LEU A HB2 12 LEU A HN 5.0 REMARK 3 11 LEU A HB3 12 LEU A HN 5.0 REMARK 3 12 LEU A HN 11 LEU A HA 4.2 REMARK 3 12 LEU A QD2 13 ILE A HN 5.7 REMARK 3 13 ILE A HN 12 LEU A HN 3.4 REMARK 3 13 ILE A HB 14 GLY A HN 4.5 REMARK 3 13 ILE A HN 14 GLY A HN 4.2 REMARK 3 13 ILE A QG2 14 GLY A HN 5.0 REMARK 3 14 GLY A HN 15 ILE A HN 4.5 REMARK 3 15 ILE A HA 16 PHE A HN 5.2 REMARK 3 15 ILE A HB 16 PHE A HN 4.5 REMARK 3 15 ILE A QD1 16 PHE A HN 5.7 REMARK 3 16 PHE A HN 15 ILE A HN 3.4 REMARK 3 16 PHE A CG 17 HIS A HN 5.5 REMARK 3 16 PHE A HA 17 HIS A HN 5.2 REMARK 3 16 PHE A HN 17 HIS A HN 3.4 REMARK 3 17 HIS A HA 18 LYS A HN 5.2 REMARK 3 18 LYS A HN 17 HIS A HN 3.4 REMARK 3 18 LYS A HN 19 TYR A HN 4.5 REMARK 3 18 LYS A HA 19 TYR A HN 4.5 REMARK 3 18 LYS A HB2 19 TYR A HN 5.2 REMARK 3 21 GLY A QA 22 LYS A HN 5.2 REMARK 3 22 LYS A QB 23 GLU A HN 4.5 REMARK 3 22 LYS A HA 26 LYS A QB 6.0 REMARK 3 22 LYS A HA 23 GLU A HN 6.0 REMARK 3 23 GLU A QG 22 LYS A QG 6.0 REMARK 3 23 GLU A QG 22 LYS A HN 6.0 REMARK 3 23 GLU A HA 22 LYS A HA 6.0 REMARK 3 23 GLU A QG 22 LYS A HA 6.0 REMARK 3 23 GLU A HN 22 LYS A HA 4.2 REMARK 3 23 GLU A HN 22 LYS A HN 5.5 REMARK 3 23 GLU A QB 24 GLY A HN 5.2 REMARK 3 23 GLU A QG 24 GLY A HN 5.2 REMARK 3 24 GLY A HN 23 GLU A HA 3.4 REMARK 3 24 GLY A HN 23 GLU A HN 5.5 REMARK 3 25 ASP A HN 24 GLY A QA 3.4 REMARK 3 25 ASP A QB 26 LYS A HN 4.5 REMARK 3 26 LYS A HN 25 ASP A HA 3.4 REMARK 3 27 HIS A HN 26 LYS A HA 4.2 REMARK 3 27 HIS A HN 28 THR A HN 4.2 REMARK 3 28 THR A HN 27 HIS A HA 3.4 REMARK 3 28 THR A HA 29 LEU A HN 3.4 REMARK 3 28 THR A HB 29 LEU A HN 3.4 REMARK 3 28 THR A QG2 29 LEU A HN 5.7 REMARK 3 29 LEU A HA 30 SER A HN 3.4 REMARK 3 30 SER A HA 31 LYS A HN 3.4 REMARK 3 31 LYS A HN 30 SER A QB 4.2 REMARK 3 32 LYS A HA 33 GLU A HN 5.2 REMARK 3 32 LYS A HN 33 GLU A HN 4.2 REMARK 3 32 LYS A QB 33 GLU A HN 4.5 REMARK 3 32 LYS A QD 33 GLU A HN 5.2 REMARK 3 33 GLU A HN 34 LEU A HN 3.4 REMARK 3 33 GLU A HB3 34 LEU A HN 5.2 REMARK 3 33 GLU A QG 34 LEU A HN 5.2 REMARK 3 34 LEU A HA 35 LYS A HN 4.5 REMARK 3 34 LEU A HN 35 LYS A HN 3.4 REMARK 3 34 LEU A QD1 35 LYS A HN 5.7 REMARK 3 35 LYS A HN 36 GLU A HN 3.4 REMARK 3 35 LYS A HA 36 GLU A HN 5.2 REMARK 3 35 LYS A HB2 36 GLU A HN 5.2 REMARK 3 35 LYS A HB3 36 GLU A HN 5.2 REMARK 3 36 GLU A HA 37 LEU A HN 4.2 REMARK 3 36 GLU A HN 37 LEU A HN 3.4 REMARK 3 36 GLU A QB 37 LEU A HN 4.5 REMARK 3 36 GLU A QG 37 LEU A HN 4.5 REMARK 3 38 ILE A HA 39 GLN A HN 5.2 REMARK 3 38 ILE A HB 39 GLN A HN 4.5 REMARK 3 38 ILE A QD1 39 GLN A HN 5.7 REMARK 3 38 ILE A QG2 39 GLN A HN 5.0 REMARK 3 38 ILE A QG2 39 GLN A HA 4.5 REMARK 3 39 GLN A HN 38 ILE A HN 3.4 REMARK 3 39 GLN A HA 40 LYS A HN 4.5 REMARK 3 39 GLN A HB2 40 LYS A HN 5.2 REMARK 3 39 GLN A HB3 40 LYS A HN 5.2 REMARK 3 39 GLN A HN 40 LYS A HN 3.4 REMARK 3 39 GLN A QG 40 LYS A HN 5.2 REMARK 3 39 GLN A HB2 40 LYS A QE 6.0 REMARK 3 40 LYS A HA 41 GLU A HN 4.5 REMARK 3 40 LYS A QB 41 GLU A HN 5.2 REMARK 3 40 LYS A QE 41 GLU A HN 5.2 REMARK 3 40 LYS A QG 41 GLU A HN 5.2 REMARK 3 41 GLU A HN 40 LYS A HN 3.4 REMARK 3 41 GLU A HN 42 LEU A HN 3.4 REMARK 3 41 GLU A QB 42 LEU A HN 5.0 REMARK 3 42 LEU A QD2 43 THR A HN 6.0 REMARK 3 43 THR A QG2 42 LEU A HA 5.0 REMARK 3 43 THR A HB 44 ILE A HN 5.2 REMARK 3 44 ILE A HA 43 THR A HA 6.0 REMARK 3 44 ILE A HA 45 GLY A HN 5.2 REMARK 3 44 ILE A HB 45 GLY A HN 5.2 REMARK 3 45 GLY A HN 44 ILE A HN 4.2 REMARK 3 46 SER A HA 47 LYS A HN 5.2 REMARK 3 47 LYS A HN 48 LEU A HN 4.2 REMARK 3 48 LEU A HN 47 LYS A HA 4.2 REMARK 3 48 LEU A HA 49 GLN A HN 4.5 REMARK 3 50 ASP A HN 49 GLN A HA 4.2 REMARK 3 50 ASP A HN 49 GLN A HN 4.2 REMARK 3 50 ASP A HA 51 ALA A HN 4.5 REMARK 3 50 ASP A QB 51 ALA A HN 5.2 REMARK 3 52 GLU A QB 53 ILE A HN 5.2 REMARK 3 52 GLU A QG 53 ILE A HN 4.5 REMARK 3 53 ILE A HN 52 GLU A HN 3.4 REMARK 3 53 ILE A HN 54 VAL A HN 3.4 REMARK 3 53 ILE A HA 54 VAL A HN 4.5 REMARK 3 53 ILE A HB 54 VAL A HN 4.5 REMARK 3 53 ILE A QD1 54 VAL A HN 5.7 REMARK 3 53 ILE A QG1 54 VAL A HN 5.7 REMARK 3 53 ILE A QG2 54 VAL A HN 5.0 REMARK 3 54 VAL A HN 55 LYS A HN 3.4 REMARK 3 54 VAL A HA 55 LYS A HN 4.2 REMARK 3 54 VAL A HB 55 LYS A HN 4.5 REMARK 3 54 VAL A QG1 55 LYS A HN 5.0 REMARK 3 55 LYS A HN 56 LEU A HN 3.4 REMARK 3 55 LYS A QB 56 LEU A HN 4.5 REMARK 3 56 LEU A QD2 55 LYS A QB 6.0 REMARK 3 56 LEU A HA 57 MET A HN 4.5 REMARK 3 56 LEU A HG 57 MET A HN 5.5 REMARK 3 56 LEU A HN 57 MET A HN 3.4 REMARK 3 56 LEU A QB 57 MET A HN 4.5 REMARK 3 56 LEU A QD2 57 MET A HN 5.7 REMARK 3 57 MET A HA 58 ASP A HN 5.2 REMARK 3 57 MET A HB2 58 ASP A HN 5.0 REMARK 3 57 MET A HB3 58 ASP A HN 5.0 REMARK 3 57 MET A HN 58 ASP A HN 3.4 REMARK 3 57 MET A QE 58 ASP A HN 5.7 REMARK 3 58 ASP A HA 59 ASP A HN 4.5 REMARK 3 58 ASP A HN 59 ASP A HN 3.4 REMARK 3 58 ASP A QB 59 ASP A HN 4.5 REMARK 3 60 LEU A HN 61 ASP A HN 3.4 REMARK 3 60 LEU A QD1 61 ASP A HN 5.0 REMARK 3 60 LEU A QD2 61 ASP A HN 5.7 REMARK 3 61 ASP A HN 60 LEU A HA 5.5 REMARK 3 61 ASP A HN 62 ARG A HN 3.4 REMARK 3 61 ASP A QB 62 ARG A HN 4.5 REMARK 3 62 ARG A HN 61 ASP A HA 5.5 REMARK 3 62 ARG A HA 63 ASN A HN 5.2 REMARK 3 62 ARG A QB 63 ASN A HN 4.5 REMARK 3 63 ASN A HN 62 ARG A HN 3.4 REMARK 3 63 ASN A HA 64 LYS A HN 5.2 REMARK 3 64 LYS A HN 63 ASN A HN 5.5 REMARK 3 65 ASP A HA 66 GLN A HN 5.2 REMARK 3 65 ASP A HB2 66 GLN A HN 5.2 REMARK 3 65 ASP A HB3 66 GLN A HN 5.2 REMARK 3 65 ASP A HN 66 GLN A HN 4.5 REMARK 3 66 GLN A HA 67 GLU A HN 4.5 REMARK 3 66 GLN A QB 67 GLU A HN 4.5 REMARK 3 66 GLN A QG 67 GLU A HN 4.5 REMARK 3 67 GLU A HA 68 VAL A HN 3.4 REMARK 3 67 GLU A QB 68 VAL A HN 4.5 REMARK 3 67 GLU A QG 68 VAL A HN 5.2 REMARK 3 68 VAL A HA 69 ASN A HN 3.4 REMARK 3 68 VAL A HB 69 ASN A HN 4.5 REMARK 3 68 VAL A QG1 69 ASN A HN 5.0 REMARK 3 68 VAL A QG2 69 ASN A HN 5.7 REMARK 3 69 ASN A HA 70 PHE A HN 3.4 REMARK 3 69 ASN A QB 70 PHE A HN 3.4 REMARK 3 70 PHE A CG 71 GLN A HN 5.5 REMARK 3 70 PHE A HA 71 GLN A HN 5.2 REMARK 3 70 PHE A HN 71 GLN A HN 3.4 REMARK 3 71 GLN A HN 72 GLU A HN 3.4 REMARK 3 71 GLN A HA 72 GLU A HN 5.2 REMARK 3 71 GLN A QB 72 GLU A HN 4.5 REMARK 3 71 GLN A QG 72 GLU A HN 4.5 REMARK 3 73 TYR A CG 74 ILE A HN 4.2 REMARK 3 73 TYR A CZ 74 ILE A HN 6.0 REMARK 3 73 TYR A HN 74 ILE A HN 3.4 REMARK 3 74 ILE A QD1 70 PHE A HZ 6.0 REMARK 3 74 ILE A QD1 73 TYR A CZ 6.0 REMARK 3 74 ILE A HA 75 THR A HN 5.2 REMARK 3 74 ILE A QD1 75 THR A HN 5.7 REMARK 3 74 ILE A QG2 75 THR A HN 5.0 REMARK 3 74 ILE A HB 75 THR A HN 4.5 REMARK 3 75 THR A HA 74 ILE A QG2 6.0 REMARK 3 75 THR A HN 74 ILE A HN 3.4 REMARK 3 75 THR A HA 76 PHE A HN 5.2 REMARK 3 75 THR A HB 76 PHE A HN 4.5 REMARK 3 75 THR A HN 76 PHE A HN 3.4 REMARK 3 77 LEU A HN 78 GLY A HN 3.4 REMARK 3 77 LEU A HA 78 GLY A HN 5.2 REMARK 3 77 LEU A HB2 78 GLY A HN 5.0 REMARK 3 77 LEU A HB3 78 GLY A HN 5.0 REMARK 3 78 GLY A HN 79 ALA A HN 3.4 REMARK 3 78 GLY A QA 79 ALA A HN 4.5 REMARK 3 79 ALA A HN 80 LEU A HN 3.4 REMARK 3 80 LEU A HA 79 ALA A QB 6.0 REMARK 3 80 LEU A HN 79 ALA A HA 4.2 REMARK 3 80 LEU A HA 81 ALA A HN 4.2 REMARK 3 80 LEU A QB 81 ALA A HN 5.0 REMARK 3 80 LEU A HG 81 ALA A HN 5.2 REMARK 3 80 LEU A HN 81 ALA A HN 3.4 REMARK 3 80 LEU A QD1 81 ALA A HN 5.7 REMARK 3 81 ALA A HN 82 MET A HN 3.4 REMARK 3 81 ALA A QB 82 MET A HN 5.7 REMARK 3 82 MET A HA 83 ILE A HN 5.2 REMARK 3 82 MET A HN 83 ILE A HN 3.4 REMARK 3 82 MET A QB 83 ILE A HN 5.0 REMARK 3 83 ILE A HA 84 TYR A HN 5.2 REMARK 3 83 ILE A HB 84 TYR A HN 4.5 REMARK 3 83 ILE A HN 84 TYR A HN 3.4 REMARK 3 83 ILE A QD1 84 TYR A HN 5.7 REMARK 3 83 ILE A QG2 84 TYR A HN 5.7 REMARK 3 84 TYR A CG 85 ASN A HN 5.5 REMARK 3 84 TYR A HN 85 ASN A HN 3.4 REMARK 3 85 ASN A HA 86 GLU A HN 3.4 REMARK 3 86 GLU A HA 87 ALA A HN 4.5 REMARK 3 86 GLU A HN 87 ALA A HN 4.2 REMARK 3 86 GLU A QB 87 ALA A HN 4.5 REMARK 3 86 GLU A QG 87 ALA A HA 6.0 REMARK 3 86 GLU A QG 87 ALA A HN 5.2 REMARK 3 87 ALA A HA 88 LEU A HN 4.5 REMARK 3 87 ALA A HN 88 LEU A HN 3.4 REMARK 3 87 ALA A QB 88 LEU A HN 5.0 REMARK 3 87 ALA A QB 88 LEU A QD2 6.0 REMARK 3 88 LEU A HA 89 LYS A HN 4.5 REMARK 3 88 LEU A HN 89 LYS A HN 3.4 REMARK 3 88 LEU A QD2 89 LYS A HN 5.7 REMARK 3 89 LYS A HA 90 GLY A HN 4.2 REMARK 3 89 LYS A HN 90 GLY A HN 4.2 REMARK 3 89 LYS A HB2 90 GLY A HN 4.5 REMARK 3 89 LYS A QG 90 GLY A HN 5.2 REMARK 3 1 MET A QE 3 SER A HN 6.0 REMARK 3 2 ALA A QB 6 ASP A HA 5.7 REMARK 3 2 ALA A QB 6 ASP A HB2 5.0 REMARK 3 2 ALA A QB 6 ASP A HB3 5.0 REMARK 3 2 ALA A QB 6 ASP A HN 5.7 REMARK 3 2 ALA A QB 7 GLN A HA 5.7 REMARK 3 2 ALA A QB 7 GLN A HB3 6.0 REMARK 3 2 ALA A QB 7 GLN A HN 5.7 REMARK 3 2 ALA A QB 7 GLN A QE2 5.7 REMARK 3 2 ALA A QB 7 GLN A QG 5.0 REMARK 3 3 SER A QB 5 LEU A HB3 4.5 REMARK 3 4 PRO A HA 7 GLN A HN 4.2 REMARK 3 5 LEU A HA 8 ALA A QB 5.0 REMARK 3 5 LEU A HA 8 ALA A HN 4.5 REMARK 3 6 ASP A HA 9 ILE A HA 6.0 REMARK 3 6 ASP A HA 9 ILE A QD1 5.0 REMARK 3 6 ASP A HA 9 ILE A HN 4.5 REMARK 3 6 ASP A HA 10 GLY A HN 4.5 REMARK 3 7 GLN A HB2 2 ALA A QB 6.0 REMARK 3 7 GLN A HB2 4 PRO A HA 4.5 REMARK 3 7 GLN A HB3 4 PRO A HA 4.5 REMARK 3 7 GLN A QG 4 PRO A HA 5.2 REMARK 3 7 GLN A HA 10 GLY A HN 4.5 REMARK 3 7 GLN A HA 11 LEU A QD1 5.7 REMARK 3 7 GLN A HB2 11 LEU A QD1 6.0 REMARK 3 7 GLN A HB3 11 LEU A QD1 5.0 REMARK 3 7 GLN A QG 11 LEU A HG 5.2 REMARK 3 7 GLN A QG 11 LEU A QD1 5.0 REMARK 3 8 ALA A QB 6 ASP A HA 5.7 REMARK 3 8 ALA A HA 11 LEU A HB3 4.0 REMARK 3 8 ALA A HA 11 LEU A HG 4.5 REMARK 3 8 ALA A HA 11 LEU A HN 4.5 REMARK 3 8 ALA A HA 11 LEU A QD1 4.5 REMARK 3 8 ALA A QB 11 LEU A HB2 4.5 REMARK 3 8 ALA A QB 11 LEU A QD1 7.0 REMARK 3 8 ALA A HA 12 LEU A QD1 5.7 REMARK 3 8 ALA A QB 12 LEU A HN 5.0 REMARK 3 9 ILE A HB 5 LEU A QD1 7.0 REMARK 3 9 ILE A HB 5 LEU A QD2 5.0 REMARK 3 9 ILE A QD1 5 LEU A HA 5.0 REMARK 3 9 ILE A HB 6 ASP A HA 4.0 REMARK 3 9 ILE A QD1 6 ASP A HB3 5.7 REMARK 3 9 ILE A QG2 6 ASP A HA 5.7 REMARK 3 9 ILE A HN 11 LEU A HN 5.0 REMARK 3 9 ILE A HA 12 LEU A HB2 6.0 REMARK 3 9 ILE A HA 12 LEU A HG 6.0 REMARK 3 9 ILE A HA 12 LEU A HN 4.2 REMARK 3 9 ILE A QG2 12 LEU A HB2 5.7 REMARK 3 9 ILE A QG2 12 LEU A HB3 5.7 REMARK 3 9 ILE A QG2 13 ILE A HA 5.7 REMARK 3 9 ILE A QG2 13 ILE A HN 5.7 REMARK 3 9 ILE A QG2 13 ILE A QG1 6.2 REMARK 3 10 GLY A HN 12 LEU A HN 5.0 REMARK 3 11 LEU A QD1 7 GLN A QE2 5.7 REMARK 3 11 LEU A HB2 8 ALA A HA 4.0 REMARK 3 11 LEU A QD2 8 ALA A HA 5.0 REMARK 3 11 LEU A HN 13 ILE A HN 5.0 REMARK 3 11 LEU A HB3 15 ILE A QG1 5.0 REMARK 3 11 LEU A QD2 15 ILE A QG1 5.5 REMARK 3 12 LEU A QD1 8 ALA A QB 7.0 REMARK 3 12 LEU A HB3 9 ILE A HA 4.5 REMARK 3 12 LEU A QD1 9 ILE A HA 5.0 REMARK 3 12 LEU A QD2 9 ILE A HA 5.7 REMARK 3 12 LEU A HA 15 ILE A HN 4.5 REMARK 3 12 LEU A HN 14 GLY A HN 5.0 REMARK 3 12 LEU A HA 15 ILE A QD1 6.0 REMARK 3 12 LEU A HA 15 ILE A QG1 5.0 REMARK 3 12 LEU A HA 15 ILE A QG2 6.0 REMARK 3 12 LEU A HG 15 ILE A QG1 5.0 REMARK 3 12 LEU A QD2 15 ILE A HB 6.0 REMARK 3 13 ILE A HB 9 ILE A QG2 5.0 REMARK 3 13 ILE A QD1 9 ILE A HB 5.7 REMARK 3 13 ILE A QD1 9 ILE A QG2 5.5 REMARK 3 13 ILE A HB 10 GLY A QA 5.2 REMARK 3 13 ILE A QD1 10 GLY A QA 5.0 REMARK 3 13 ILE A QG2 10 GLY A QA 6.0 REMARK 3 13 ILE A HN 15 ILE A HN 5.0 REMARK 3 13 ILE A HA 16 PHE A HB2 5.2 REMARK 3 13 ILE A QG2 16 PHE A HN 5.7 REMARK 3 14 GLY A HN 11 LEU A HA 4.2 REMARK 3 14 GLY A QA 18 LYS A HA 6.0 REMARK 3 15 ILE A HB 12 LEU A HA 4.0 REMARK 3 15 ILE A HA 18 LYS A HB2 4.5 REMARK 3 15 ILE A HA 18 LYS A HN 4.5 REMARK 3 15 ILE A QD1 18 LYS A HN 5.7 REMARK 3 15 ILE A QD1 18 LYS A QB 5.0 REMARK 3 15 ILE A QG2 18 LYS A HN 5.7 REMARK 3 15 ILE A QG2 18 LYS A QD 6.0 REMARK 3 15 ILE A QG2 19 TYR A CG 5.7 REMARK 3 15 ILE A QG2 19 TYR A CZ 5.7 REMARK 3 15 ILE A QG2 19 TYR A HN 5.7 REMARK 3 16 PHE A HB3 13 ILE A HA 4.0 REMARK 3 16 PHE A HN 13 ILE A HA 4.2 REMARK 3 16 PHE A CG 19 TYR A HN 5.5 REMARK 3 16 PHE A HA 19 TYR A HN 5.2 REMARK 3 17 HIS A HE1 21 GLY A HN 6.0 REMARK 3 18 LYS A HB2 14 GLY A QA 4.5 REMARK 3 18 LYS A HB3 15 ILE A QG2 5.7 REMARK 3 18 LYS A QD 15 ILE A HA 6.0 REMARK 3 18 LYS A QD 15 ILE A QD1 5.7 REMARK 3 18 LYS A QD 15 ILE A QG1 5.0 REMARK 3 19 TYR A CG 15 ILE A HA 5.5 REMARK 3 21 GLY A HN 19 TYR A HA 5.5 REMARK 3 22 LYS A QD 19 TYR A HA 4.5 REMARK 3 22 LYS A QG 19 TYR A HA 4.0 REMARK 3 26 LYS A HA 21 GLY A QA 4.5 REMARK 3 26 LYS A QD 21 GLY A QA 5.2 REMARK 3 26 LYS A QD 22 LYS A HA 6.0 REMARK 3 26 LYS A HA 28 THR A HN 6.0 REMARK 3 28 THR A QG2 25 ASP A QB 6.0 REMARK 3 29 LEU A QB 33 GLU A HB2 6.0 REMARK 3 29 LEU A QB 33 GLU A QG 6.0 REMARK 3 29 LEU A QD1 33 GLU A HB2 5.7 REMARK 3 29 LEU A QD2 33 GLU A HA 5.7 REMARK 3 29 LEU A QD2 33 GLU A HB3 5.7 REMARK 3 29 LEU A QD1 34 LEU A HA 5.7 REMARK 3 29 LEU A QD1 34 LEU A HN 5.7 REMARK 3 29 LEU A QD1 34 LEU A QD1 6.2 REMARK 3 29 LEU A QD2 34 LEU A HA 5.7 REMARK 3 29 LEU A QD2 34 LEU A HN 5.7 REMARK 3 29 LEU A QD2 34 LEU A QD1 6.2 REMARK 3 31 LYS A HA 34 LEU A HB2 4.5 REMARK 3 31 LYS A HA 34 LEU A HB3 5.2 REMARK 3 31 LYS A HA 34 LEU A HG 5.2 REMARK 3 31 LYS A HA 34 LEU A QD1 6.0 REMARK 3 32 LYS A HA 35 LYS A HN 5.2 REMARK 3 33 GLU A HB2 29 LEU A QD2 6.0 REMARK 3 33 GLU A HA 36 GLU A HN 4.5 REMARK 3 33 GLU A HA 36 GLU A QB 4.5 REMARK 3 34 LEU A QD2 31 LYS A HA 5.7 REMARK 3 34 LEU A HA 37 LEU A HB2 4.5 REMARK 3 34 LEU A HA 37 LEU A HB3 4.0 REMARK 3 34 LEU A HA 37 LEU A HN 4.5 REMARK 3 34 LEU A QD2 37 LEU A HB2 5.7 REMARK 3 34 LEU A QD2 37 LEU A QD1 7.0 REMARK 3 35 LYS A HN 31 LYS A HA 4.2 REMARK 3 35 LYS A HA 37 LEU A HN 5.2 REMARK 3 35 LYS A HA 38 ILE A QD1 5.7 REMARK 3 35 LYS A HA 38 ILE A QG2 6.0 REMARK 3 35 LYS A HB3 38 ILE A QG2 5.7 REMARK 3 36 GLU A QG 33 GLU A HA 4.5 REMARK 3 36 GLU A HA 39 GLN A HN 4.5 REMARK 3 36 GLU A HA 39 GLN A HB2 5.0 REMARK 3 36 GLU A HA 39 GLN A HB3 5.0 REMARK 3 36 GLU A QG 40 LYS A QE 4.5 REMARK 3 36 GLU A QG 40 LYS A QG 4.5 REMARK 3 37 LEU A QD1 34 LEU A HA 5.7 REMARK 3 37 LEU A HA 40 LYS A QB 5.2 REMARK 3 37 LEU A QD2 41 GLU A HA 6.0 REMARK 3 37 LEU A QD2 41 GLU A HN 5.7 REMARK 3 37 LEU A QD2 41 GLU A QG 5.7 REMARK 3 38 ILE A HB 35 LYS A HA 5.2 REMARK 3 38 ILE A HN 35 LYS A HA 4.5 REMARK 3 38 ILE A HA 41 GLU A HN 4.5 REMARK 3 38 ILE A HA 42 LEU A QB 6.0 REMARK 3 38 ILE A HA 42 LEU A HN 4.5 REMARK 3 38 ILE A QG1 42 LEU A QD1 6.0 REMARK 3 38 ILE A QG2 42 LEU A QB 6.0 REMARK 3 39 GLN A QE2 36 GLU A HA 5.5 REMARK 3 40 LYS A QD 36 GLU A HA 4.5 REMARK 3 40 LYS A QD 36 GLU A QG 4.0 REMARK 3 40 LYS A QE 36 GLU A HA 4.5 REMARK 3 40 LYS A QE 36 GLU A QB 4.5 REMARK 3 40 LYS A QE 36 GLU A QG 4.5 REMARK 3 40 LYS A QG 36 GLU A HA 5.2 REMARK 3 41 GLU A QB 37 LEU A QD2 5.2 REMARK 3 42 LEU A QB 38 ILE A HA 6.0 REMARK 3 42 LEU A QD1 38 ILE A HA 5.7 REMARK 3 42 LEU A QD2 38 ILE A HA 6.0 REMARK 3 44 ILE A HB 42 LEU A HA 5.2 REMARK 3 44 ILE A HB 42 LEU A QB 4.5 REMARK 3 44 ILE A QD1 42 LEU A HA 5.7 REMARK 3 44 ILE A QD1 42 LEU A QB 5.0 REMARK 3 44 ILE A QD1 42 LEU A QD1 5.0 REMARK 3 44 ILE A QD1 42 LEU A QD2 6.0 REMARK 3 44 ILE A QG1 42 LEU A QB 4.5 REMARK 3 44 ILE A QG1 42 LEU A QD1 6.0 REMARK 3 44 ILE A QG2 42 LEU A QB 6.0 REMARK 3 44 ILE A QG2 42 LEU A QD2 6.0 REMARK 3 44 ILE A QG2 47 LYS A QG 6.0 REMARK 3 44 ILE A HB 48 LEU A QD1 6.0 REMARK 3 44 ILE A HB 48 LEU A QD2 6.0 REMARK 3 44 ILE A QD1 48 LEU A HG 4.5 REMARK 3 44 ILE A QD1 48 LEU A HN 5.2 REMARK 3 44 ILE A QD1 48 LEU A QB 6.0 REMARK 3 44 ILE A QG1 48 LEU A HG 5.0 REMARK 3 44 ILE A QG1 48 LEU A QB 6.0 REMARK 3 44 ILE A QG2 48 LEU A HG 6.0 REMARK 3 44 ILE A QG2 48 LEU A HN 5.7 REMARK 3 44 ILE A QG2 48 LEU A QB 6.0 REMARK 3 46 SER A HA 48 LEU A HN 5.2 REMARK 3 47 LYS A HA 44 ILE A QG2 5.7 REMARK 3 47 LYS A HB2 44 ILE A QG2 5.7 REMARK 3 47 LYS A HB3 44 ILE A QG2 5.7 REMARK 3 47 LYS A QD 44 ILE A QG2 6.0 REMARK 3 47 LYS A HA 48 LEU A HA 6.0 REMARK 3 47 LYS A HA 53 ILE A QD1 6.0 REMARK 3 48 LEU A HA 44 ILE A QD1 6.0 REMARK 3 48 LEU A HA 44 ILE A QG2 5.7 REMARK 3 48 LEU A QD1 44 ILE A QG2 6.0 REMARK 3 48 LEU A QD2 44 ILE A QD1 6.0 REMARK 3 48 LEU A QD2 44 ILE A QG2 6.0 REMARK 3 50 ASP A QB 53 ILE A HN 5.2 REMARK 3 50 ASP A QB 53 ILE A QD1 5.7 REMARK 3 50 ASP A QB 53 ILE A QG1 5.0 REMARK 3 50 ASP A HA 54 VAL A HB 6.0 REMARK 3 50 ASP A QB 54 VAL A HN 5.2 REMARK 3 51 ALA A HA 54 VAL A QG1 6.0 REMARK 3 51 ALA A QB 54 VAL A HB 5.0 REMARK 3 51 ALA A QB 54 VAL A HN 5.2 REMARK 3 52 GLU A HA 55 LYS A QB 4.5 REMARK 3 52 GLU A HA 55 LYS A QD 4.0 REMARK 3 52 GLU A HA 55 LYS A QB 5.0 REMARK 3 52 GLU A QG 55 LYS A QB 4.5 REMARK 3 52 GLU A QG 56 LEU A QD2 5.0 REMARK 3 53 ILE A HB 50 ASP A QB 5.2 REMARK 3 53 ILE A HA 56 LEU A HN 4.2 REMARK 3 53 ILE A HA 56 LEU A QB 5.2 REMARK 3 53 ILE A HA 56 LEU A QD2 6.0 REMARK 3 53 ILE A HB 56 LEU A QD1 6.0 REMARK 3 53 ILE A QG2 56 LEU A HN 5.2 REMARK 3 53 ILE A QG2 57 MET A HB3 6.0 REMARK 3 54 VAL A QG2 50 ASP A HA 5.0 REMARK 3 54 VAL A QG2 50 ASP A QB 5.7 REMARK 3 54 VAL A HB 51 ALA A HA 4.0 REMARK 3 54 VAL A HN 51 ALA A HA 4.2 REMARK 3 54 VAL A QG2 51 ALA A HA 4.5 REMARK 3 54 VAL A HN 56 LEU A HN 5.0 REMARK 3 54 VAL A HA 56 LEU A HN 5.2 REMARK 3 54 VAL A QG2 56 LEU A HN 6.0 REMARK 3 54 VAL A HA 57 MET A HB2 4.5 REMARK 3 54 VAL A QG1 57 MET A HB2 5.7 REMARK 3 54 VAL A QG2 57 MET A HB2 5.0 REMARK 3 54 VAL A HA 58 ASP A HN 5.2 REMARK 3 54 VAL A QG1 58 ASP A HN 5.7 REMARK 3 54 VAL A QG1 58 ASP A QB 5.7 REMARK 3 56 LEU A QD1 52 GLU A HA 5.7 REMARK 3 56 LEU A QD1 52 GLU A QG 6.0 REMARK 3 56 LEU A HG 53 ILE A HA 4.5 REMARK 3 56 LEU A QD1 53 ILE A HA 6.0 REMARK 3 56 LEU A QD1 53 ILE A QG1 6.0 REMARK 3 56 LEU A HA 59 ASP A QB 4.5 REMARK 3 56 LEU A HA 59 ASP A HN 4.5 REMARK 3 56 LEU A QD2 59 ASP A QB 5.7 REMARK 3 57 MET A QE 53 ILE A HA 5.0 REMARK 3 57 MET A QG 53 ILE A QG2 5.0 REMARK 3 57 MET A QE 53 ILE A QD1 6.0 REMARK 3 57 MET A HB3 54 VAL A HA 6.0 REMARK 3 57 MET A HN 54 VAL A HA 4.2 REMARK 3 57 MET A QE 54 VAL A HA 6.0 REMARK 3 57 MET A QE 54 VAL A QG2 6.0 REMARK 3 57 MET A QG 54 VAL A HA 5.2 REMARK 3 57 MET A HA 59 ASP A QB 5.0 REMARK 3 57 MET A HA 60 LEU A HN 4.5 REMARK 3 57 MET A HA 60 LEU A QD2 6.0 REMARK 3 57 MET A QE 60 LEU A QD2 6.0 REMARK 3 58 ASP A HN 55 LYS A HA 4.2 REMARK 3 58 ASP A QB 55 LYS A HA 4.0 REMARK 3 58 ASP A QB 62 ARG A QB 5.2 REMARK 3 59 ASP A HA 62 ARG A HN 4.2 REMARK 3 59 ASP A HA 63 ASN A HN 5.2 REMARK 3 60 LEU A HG 57 MET A HA 6.0 REMARK 3 60 LEU A QB 57 MET A HA 6.0 REMARK 3 60 LEU A HA 63 ASN A HB2 5.0 REMARK 3 60 LEU A HA 63 ASN A HB3 5.0 REMARK 3 61 ASP A HN 58 ASP A HA 4.2 REMARK 3 61 ASP A QB 58 ASP A HA 4.5 REMARK 3 61 ASP A HA 64 LYS A HA 6.0 REMARK 3 62 ARG A QB 59 ASP A HA 4.5 REMARK 3 62 ARG A QD 59 ASP A HA 4.5 REMARK 3 62 ARG A QG 59 ASP A HA 4.5 REMARK 3 63 ASN A HB2 60 LEU A QB 6.0 REMARK 3 63 ASN A HB3 66 GLN A QB 6.0 REMARK 3 64 LYS A QB 61 ASP A HA 5.2 REMARK 3 64 LYS A QD 61 ASP A HA 6.0 REMARK 3 64 LYS A QE 61 ASP A HA 5.2 REMARK 3 64 LYS A QG 61 ASP A HA 5.2 REMARK 3 64 LYS A QE 62 ARG A HA 6.0 REMARK 3 65 ASP A HA 66 GLN A HN 5.2 REMARK 3 65 ASP A HA 67 GLU A HN 6.0 REMARK 3 66 GLN A QB 63 ASN A HB3 5.2 REMARK 3 68 VAL A QG1 63 ASN A HB3 5.7 REMARK 3 68 VAL A QG1 63 ASN A QD2 6.2 REMARK 3 68 VAL A HA 72 GLU A HB2 6.0 REMARK 3 68 VAL A HA 72 GLU A HB3 6.0 REMARK 3 68 VAL A QG1 72 GLU A HA 5.7 REMARK 3 68 VAL A QG1 72 GLU A HB2 5.0 REMARK 3 68 VAL A QG1 72 GLU A HB3 5.0 REMARK 3 68 VAL A QG2 72 GLU A HB2 6.0 REMARK 3 68 VAL A QG2 72 GLU A HB3 4.5 REMARK 3 68 VAL A QG2 72 GLU A QG 6.0 REMARK 3 68 VAL A HB 73 TYR A HA 4.5 REMARK 3 68 VAL A QG1 73 TYR A HA 5.0 REMARK 3 68 VAL A QG2 73 TYR A HA 5.7 REMARK 3 68 VAL A QG2 73 TYR A QB 5.7 REMARK 3 70 PHE A CG 73 TYR A CG 5.5 REMARK 3 70 PHE A CG 73 TYR A CZ 5.5 REMARK 3 70 PHE A HA 73 TYR A CG 4.2 REMARK 3 70 PHE A HA 73 TYR A CZ 5.2 REMARK 3 70 PHE A HA 73 TYR A HN 4.5 REMARK 3 70 PHE A HA 73 TYR A QB 4.5 REMARK 3 71 GLN A HA 74 ILE A HN 4.5 REMARK 3 71 GLN A HA 74 ILE A QD1 6.0 REMARK 3 71 GLN A HA 74 ILE A QG1 5.7 REMARK 3 71 GLN A HA 74 ILE A QG2 5.7 REMARK 3 71 GLN A QG 74 ILE A HB 4.5 REMARK 3 71 GLN A QG 74 ILE A HN 6.0 REMARK 3 71 GLN A QG 74 ILE A QG2 5.7 REMARK 3 71 GLN A QG 75 THR A HB 5.2 REMARK 3 72 GLU A HA 68 VAL A QG2 6.0 REMARK 3 72 GLU A HA 75 THR A HB 4.0 REMARK 3 72 GLU A HA 75 THR A HN 4.5 REMARK 3 72 GLU A HA 75 THR A QG2 5.7 REMARK 3 73 TYR A HA 70 PHE A HA 6.0 REMARK 3 73 TYR A HA 76 PHE A QB 4.0 REMARK 3 73 TYR A HA 76 PHE A HN 4.5 REMARK 3 73 TYR A HA 77 LEU A HN 5.0 REMARK 3 73 TYR A HH 70 PHE A CZ 6.0 REMARK 3 74 ILE A QD1 70 PHE A HZ 5.0 REMARK 3 74 ILE A HB 71 GLN A HA 4.5 REMARK 3 74 ILE A QD1 71 GLN A HA 6.0 REMARK 3 74 ILE A QG2 71 GLN A QE2 6.0 REMARK 3 74 ILE A HA 76 PHE A HN 4.5 REMARK 3 74 ILE A HA 77 LEU A HN 4.5 REMARK 3 74 ILE A HA 77 LEU A HB2 5.0 REMARK 3 74 ILE A HA 77 LEU A HB3 5.0 REMARK 3 74 ILE A HA 77 LEU A HG 4.5 REMARK 3 74 ILE A HA 77 LEU A QD1 6.0 REMARK 3 74 ILE A HA 77 LEU A QD2 6.0 REMARK 3 74 ILE A QD1 77 LEU A HB2 5.7 REMARK 3 74 ILE A QD1 77 LEU A HB3 5.7 REMARK 3 74 ILE A QG2 77 LEU A HB2 5.7 REMARK 3 74 ILE A QD1 78 GLY A HN 5.7 REMARK 3 74 ILE A QG2 78 GLY A HN 5.0 REMARK 3 75 THR A HA 78 GLY A HN 4.2 REMARK 3 75 THR A QG2 78 GLY A HN 5.7 REMARK 3 75 THR A HA 79 ALA A HN 4.2 REMARK 3 76 PHE A HA 79 ALA A HN 4.5 REMARK 3 76 PHE A HA 79 ALA A QB 5.0 REMARK 3 77 LEU A QD1 73 TYR A CZ 5.7 REMARK 3 77 LEU A QD2 73 TYR A CZ 5.7 REMARK 3 77 LEU A HA 80 LEU A HN 4.5 REMARK 3 77 LEU A HA 80 LEU A QB 4.5 REMARK 3 77 LEU A HA 80 LEU A QD1 5.0 REMARK 3 78 GLY A QA 74 ILE A QG2 5.7 REMARK 3 78 GLY A QA 75 THR A HA 4.5 REMARK 3 78 GLY A QA 81 ALA A QB 5.0 REMARK 3 79 ALA A QB 76 PHE A CG 5.7 REMARK 3 79 ALA A HA 82 MET A HN 4.5 REMARK 3 79 ALA A HA 82 MET A QB 5.0 REMARK 3 79 ALA A HA 83 ILE A QD1 5.7 REMARK 3 79 ALA A QB 83 ILE A HN 5.7 REMARK 3 79 ALA A QB 83 ILE A QD1 5.5 REMARK 3 80 LEU A HA 83 ILE A QD1 5.0 REMARK 3 80 LEU A HA 83 ILE A HN 4.5 REMARK 3 80 LEU A QD1 83 ILE A HN 5.7 REMARK 3 80 LEU A QD1 84 TYR A CG 5.7 REMARK 3 80 LEU A QD1 84 TYR A CZ 5.7 REMARK 3 80 LEU A QD2 84 TYR A CG 5.7 REMARK 3 80 LEU A QD2 84 TYR A CZ 5.7 REMARK 3 81 ALA A HA 84 TYR A CG 4.2 REMARK 3 81 ALA A HA 84 TYR A CZ 4.2 REMARK 3 81 ALA A HA 84 TYR A HN 4.5 REMARK 3 81 ALA A QB 84 TYR A CZ 5.7 REMARK 3 81 ALA A HA 85 ASN A HB2 4.5 REMARK 3 81 ALA A HA 85 ASN A HB3 6.0 REMARK 3 81 ALA A HA 85 ASN A HN 4.5 REMARK 3 81 ALA A QB 85 ASN A HB2 5.7 REMARK 3 81 ALA A QB 85 ASN A HN 5.7 REMARK 3 81 ALA A QB 85 ASN A QD2 6.2 REMARK 3 82 MET A QE 78 GLY A QA 5.0 REMARK 3 82 MET A QE 79 ALA A HA 4.5 REMARK 3 82 MET A QG 79 ALA A HA 4.5 REMARK 3 82 MET A QB 80 LEU A HA 6.0 REMARK 3 83 ILE A HB 80 LEU A HA 4.5 REMARK 3 83 ILE A QG2 80 LEU A HA 6.0 REMARK 3 84 TYR A CG 80 LEU A HA 5.5 REMARK 3 84 TYR A HB3 81 ALA A HA 6.0 REMARK 3 85 ASN A HA 88 LEU A QD1 6.0 REMARK 3 86 GLU A HA 88 LEU A HN 5.2 REMARK 3 86 GLU A HA 89 LYS A HN 4.2 REMARK 3 86 GLU A HA 89 LYS A QB 4.5 REMARK 3 86 GLU A HA 89 LYS A QE 4.0 REMARK 3 86 GLU A HA 89 LYS A QG 6.0 REMARK 3 87 ALA A QB 85 ASN A QD2 6.2 REMARK 3 87 ALA A HA 89 LYS A HN 4.5 REMARK 3 88 LEU A HG 85 ASN A HB2 5.2 REMARK 3 88 LEU A QD1 85 ASN A HN 6.0 REMARK 3 88 LEU A QD1 85 ASN A HB2 5.0 REMARK 3 88 LEU A QD1 85 ASN A HB3 5.0 REMARK 3 88 LEU A QD1 85 ASN A QD2 6.2 REMARK 3 88 LEU A QD2 85 ASN A HB3 5.0 REMARK 3 89 LYS A HA 86 GLU A HA 6.0 REMARK 3 9 ILE A QG2 74 ILE A QD1 6.0 REMARK 3 12 LEU A QD2 70 PHE A HZ 5.7 REMARK 3 12 LEU A HB3 74 ILE A QD1 6.0 REMARK 3 12 LEU A QD1 74 ILE A QD1 6.0 REMARK 3 12 LEU A QD2 74 ILE A HA 6.0 REMARK 3 12 LEU A QD2 74 ILE A HB 6.0 REMARK 3 12 LEU A QD2 74 ILE A QD1 4.5 REMARK 3 12 LEU A QD2 77 LEU A HB3 5.0 REMARK 3 13 ILE A HA 70 PHE A CZ 3.4 REMARK 3 13 ILE A HN 70 PHE A CZ 5.5 REMARK 3 13 ILE A QD1 70 PHE A CZ 4.7 REMARK 3 13 ILE A QG2 70 PHE A CZ 5.7 REMARK 3 13 ILE A QG1 74 ILE A QD1 5.5 REMARK 3 15 ILE A HB 37 LEU A QD2 5.0 REMARK 3 15 ILE A QG2 37 LEU A HA 5.7 REMARK 3 15 ILE A QG2 37 LEU A QD1 6.0 REMARK 3 15 ILE A QG2 37 LEU A QD2 5.5 REMARK 3 15 ILE A QD1 41 GLU A QG 5.7 REMARK 3 15 ILE A QG2 41 GLU A HA 6.0 REMARK 3 15 ILE A QG2 41 GLU A HN 5.7 REMARK 3 15 ILE A QG2 41 GLU A QB 6.0 REMARK 3 15 ILE A QG2 41 GLU A QG 5.7 REMARK 3 15 ILE A QG2 73 TYR A CZ 5.7 REMARK 3 15 ILE A QG2 77 LEU A HG 6.0 REMARK 3 15 ILE A QG2 77 LEU A QD1 6.2 REMARK 3 16 PHE A HZ 28 THR A HA 3.4 REMARK 3 16 PHE A HA 29 LEU A QD2 5.7 REMARK 3 16 PHE A HA 37 LEU A QD1 5.7 REMARK 3 16 PHE A HZ 69 ASN A HA 3.4 REMARK 3 16 PHE A CG 70 PHE A CG 4.5 REMARK 3 16 PHE A CG 70 PHE A CZ 4.5 REMARK 3 16 PHE A CZ 70 PHE A CG 4.5 REMARK 3 16 PHE A CZ 70 PHE A HA 4.2 REMARK 3 16 PHE A HZ 70 PHE A HN 4.2 REMARK 3 16 PHE A CG 73 TYR A CG 4.5 REMARK 3 16 PHE A CG 73 TYR A CZ 5.5 REMARK 3 16 PHE A CG 73 TYR A HH 6.0 REMARK 3 16 PHE A CZ 73 TYR A CG 6.0 REMARK 3 16 PHE A CZ 73 TYR A CZ 6.0 REMARK 3 16 PHE A CZ 73 TYR A QB 4.2 REMARK 3 27 HIS A HA 16 PHE A CZ 5.2 REMARK 3 27 HIS A HA 16 PHE A HZ 5.2 REMARK 3 28 THR A QG2 16 PHE A HZ 5.7 REMARK 3 28 THR A QG2 67 GLU A HA 5.7 REMARK 3 28 THR A HB 68 VAL A HN 4.5 REMARK 3 28 THR A QG2 68 VAL A HN 5.7 REMARK 3 28 THR A HA 69 ASN A HA 3.4 REMARK 3 28 THR A QG2 69 ASN A HN 5.7 REMARK 3 28 THR A QG2 69 ASN A QB 5.0 REMARK 3 28 THR A QG2 69 ASN A QD2 6.2 REMARK 3 28 THR A QG2 70 PHE A HN 5.7 REMARK 3 29 LEU A QD1 16 PHE A CG 5.7 REMARK 3 29 LEU A QD1 16 PHE A CZ 5.7 REMARK 3 29 LEU A QD2 16 PHE A CG 5.7 REMARK 3 29 LEU A QD2 16 PHE A CZ 5.7 REMARK 3 29 LEU A QD2 19 TYR A HB2 5.7 REMARK 3 29 LEU A QD2 19 TYR A HB3 5.7 REMARK 3 29 LEU A QD2 19 TYR A HN 5.7 REMARK 3 29 LEU A QD2 33 GLU A HN 6.0 REMARK 3 29 LEU A QD2 37 LEU A HB2 5.7 REMARK 3 29 LEU A QD1 68 VAL A QG2 6.2 REMARK 3 29 LEU A QD1 69 ASN A HN 5.7 REMARK 3 29 LEU A HN 68 VAL A HN 4.0 REMARK 3 30 SER A HA 67 GLU A QB 5.2 REMARK 3 30 SER A QB 67 GLU A HA 4.0 REMARK 3 30 SER A HA 68 VAL A HN 4.0 REMARK 3 30 SER A HA 68 VAL A QG1 6.0 REMARK 3 30 SER A HA 68 VAL A QG2 5.7 REMARK 3 31 LYS A HA 68 VAL A QG1 6.5 REMARK 3 31 LYS A HA 68 VAL A QG2 5.7 REMARK 3 34 LEU A QD1 63 ASN A QD2 6.2 REMARK 3 34 LEU A QD1 68 VAL A QG1 6.5 REMARK 3 34 LEU A QD1 68 VAL A QG2 6.5 REMARK 3 34 LEU A QD2 68 VAL A HB 5.7 REMARK 3 34 LEU A QD1 73 TYR A CG 5.7 REMARK 3 34 LEU A QD1 73 TYR A HA 5.7 REMARK 3 34 LEU A QD2 73 TYR A HA 5.7 REMARK 3 34 LEU A QD2 73 TYR A QB 6.0 REMARK 3 34 LEU A QD1 76 PHE A CZ 5.7 REMARK 3 34 LEU A QD2 76 PHE A CZ 5.7 REMARK 3 34 LEU A QD2 76 PHE A HZ 5.7 REMARK 3 35 LYS A HA 56 LEU A QD1 6.0 REMARK 3 35 LYS A HA 56 LEU A QD2 5.0 REMARK 3 35 LYS A HB3 56 LEU A QD2 5.7 REMARK 3 35 LYS A QD 56 LEU A QD2 5.7 REMARK 3 35 LYS A HN 76 PHE A HZ 6.0 REMARK 3 36 GLU A QG 19 TYR A CZ 5.2 REMARK 3 37 LEU A HA 19 TYR A CZ 5.2 REMARK 3 37 LEU A QD1 19 TYR A CG 5.7 REMARK 3 37 LEU A QD1 19 TYR A HA 6.0 REMARK 3 37 LEU A QD1 19 TYR A HB2 5.7 REMARK 3 37 LEU A QD1 19 TYR A HB3 5.7 REMARK 3 37 LEU A QD1 19 TYR A HN 5.7 REMARK 3 37 LEU A QD1 73 TYR A CG 5.7 REMARK 3 37 LEU A QD1 73 TYR A CZ 5.7 REMARK 3 37 LEU A QD1 73 TYR A HA 6.0 REMARK 3 38 ILE A QD1 52 GLU A HA 5.7 REMARK 3 38 ILE A QG1 55 LYS A QG 5.0 REMARK 3 38 ILE A QD1 76 PHE A CZ 5.7 REMARK 3 38 ILE A QD1 76 PHE A HZ 5.0 REMARK 3 38 ILE A QG2 76 PHE A HZ 5.7 REMARK 3 38 ILE A QG1 80 LEU A QD2 5.0 REMARK 3 40 LYS A QD 19 TYR A CG 5.2 REMARK 3 40 LYS A QD 19 TYR A CZ 5.2 REMARK 3 40 LYS A QE 19 TYR A CZ 5.2 REMARK 3 42 LEU A QD1 52 GLU A HA 5.7 REMARK 3 42 LEU A QB 80 LEU A QD2 6.0 REMARK 3 42 LEU A QD1 80 LEU A QB 5.0 REMARK 3 42 LEU A QD1 84 TYR A CZ 5.2 REMARK 3 42 LEU A QD2 84 TYR A CZ 5.7 REMARK 3 44 ILE A QD1 80 LEU A QD2 6.0 REMARK 3 44 ILE A QD1 84 TYR A QB 6.0 REMARK 3 44 ILE A QD1 80 LEU A QD2 4.0 REMARK 3 44 ILE A QD1 84 TYR A CG 5.2 REMARK 3 44 ILE A QD1 84 TYR A CZ 5.2 REMARK 3 44 ILE A QG2 84 TYR A CZ 6.5 REMARK 3 47 LYS A HB3 53 ILE A QD1 5.2 REMARK 3 49 GLN A QE2 86 GLU A HA 5.5 REMARK 3 51 ALA A HN 83 ILE A QD1 6.0 REMARK 3 52 GLU A QB 38 ILE A QD1 5.7 REMARK 3 52 GLU A HA 80 LEU A QB 4.5 REMARK 3 52 GLU A HA 80 LEU A QD2 5.2 REMARK 3 53 ILE A QD1 44 ILE A QG2 6.0 REMARK 3 53 ILE A HA 47 LYS A QD 4.0 REMARK 3 53 ILE A QD1 47 LYS A HA 5.2 REMARK 3 53 ILE A QD1 47 LYS A QG 4.5 REMARK 3 53 ILE A QG1 47 LYS A QG 4.0 REMARK 3 53 ILE A QD1 84 TYR A HB3 6.0 REMARK 3 53 ILE A QD1 84 TYR A CG 6.5 REMARK 3 53 ILE A QD1 84 TYR A CZ 6.0 REMARK 3 56 LEU A QD2 35 LYS A QE 6.0 REMARK 3 56 LEU A QD2 35 LYS A QG 5.0 REMARK 3 56 LEU A HG 76 PHE A HZ 5.2 REMARK 3 56 LEU A QD2 76 PHE A HZ 5.7 REMARK 3 57 MET A QE 35 LYS A QG 6.0 REMARK 3 67 GLU A HA 28 THR A HB 6.0 REMARK 3 67 GLU A QB 28 THR A HB 4.0 REMARK 3 67 GLU A QB 28 THR A QG2 4.5 REMARK 3 67 GLU A QG 28 THR A HB 4.5 REMARK 3 67 GLU A QG 28 THR A QG2 5.7 REMARK 3 67 GLU A HA 30 SER A HA 3.4 REMARK 3 67 GLU A QG 30 SER A HA 5.2 REMARK 3 68 VAL A QG2 16 PHE A CZ 5.7 REMARK 3 68 VAL A QG2 28 THR A HA 5.7 REMARK 3 68 VAL A HN 29 LEU A HN 4.2 REMARK 3 68 VAL A QG1 29 LEU A HN 5.7 REMARK 3 68 VAL A QG2 29 LEU A HN 5.7 REMARK 3 68 VAL A QG2 29 LEU A QB 5.7 REMARK 3 68 VAL A QG2 31 LYS A HN 6.0 REMARK 3 68 VAL A QG2 34 LEU A HB2 6.0 REMARK 3 68 VAL A QG2 34 LEU A HG 5.0 REMARK 3 68 VAL A QG2 34 LEU A QD2 5.5 REMARK 3 68 VAL A QG1 62 ARG A QG 5.7 REMARK 3 69 ASN A HA 28 THR A HB 6.0 REMARK 3 69 ASN A HA 28 THR A QG2 5.0 REMARK 3 69 ASN A HA 29 LEU A HN 4.0 REMARK 3 73 TYR A HH 12 LEU A HA 3.4 REMARK 3 74 ILE A QD1 9 ILE A QG1 6.2 REMARK 3 74 ILE A QD1 12 LEU A HA 5.7 REMARK 3 74 ILE A QD1 12 LEU A HB2 5.7 REMARK 3 74 ILE A QD1 12 LEU A HG 5.7 REMARK 3 74 ILE A QG2 12 LEU A HB3 5.7 REMARK 3 74 ILE A QD1 13 ILE A HN 5.7 REMARK 3 74 ILE A QD1 16 ILE A HN 6.0 REMARK 3 75 THR A HB 62 ARG A QD 5.2 REMARK 3 75 THR A QG2 62 ARG A QD 5.7 REMARK 3 76 PHE A QB 34 LEU A QD2 6.5 REMARK 3 76 PHE A CZ 55 LYS A HA 5.5 REMARK 3 76 PHE A HZ 59 ASP A HA 4.2 REMARK 3 76 PHE A CZ 63 ASN A QD2 6.0 REMARK 3 77 LEU A QD1 12 LEU A HA 5.2 REMARK 3 77 LEU A QD1 16 PHE A HN 6.0 REMARK 3 77 LEU A QD2 42 LEU A HG 5.2 REMARK 3 77 LEU A QD2 55 LYS A QG 5.2 REMARK 3 80 LEU A QD1 38 ILE A HB 6.0 REMARK 3 80 LEU A QD2 52 GLU A QG 5.2 REMARK 3 81 ALA A HA 88 LEU A QD1 5.2 REMARK 3 81 ALA A QB 88 LEU A QD1 6.2 REMARK 3 82 MET A QB 89 LYS A QE 5.2 REMARK 3 82 MET A QG 89 LYS A QG 5.2 REMARK 3 83 ILE A QD1 50 ASP A QB 5.2 REMARK 3 83 ILE A QG2 50 ASP A QB 5.7 REMARK 3 83 ILE A HB 51 ALA A QB 5.5 REMARK 3 83 ILE A QD1 52 GLU A HA 6.0 REMARK 3 83 ILE A QG2 52 GLU A HA 7.0 REMARK 3 83 ILE A QD1 55 LYS A HN 5.7 REMARK 3 83 ILE A QG1 89 LYS A QD 5.0 REMARK 3 88 LEU A QD2 81 ALA A QB 6.2 REMARK 3 88 LEU A HB2 82 MET A HA 6.0 REMARK 3 88 LEU A QD1 82 MET A HA 5.0 REMARK 3 88 LEU A QD1 82 MET A HN 6.0 REMARK 3 88 LEU A QD1 82 MET A QE 6.2 REMARK 3 88 LEU A QD1 82 MET A QG 5.7 REMARK 3 88 LEU A QD2 82 MET A HA 5.7 REMARK 3 88 LEU A QD2 82 MET A QE 6.2 REMARK 3 88 LEU A QD2 82 MET A QG 5.7 REMARK 3 89 LYS A HA 82 MET A QE 6.0 REMARK 3 89 LYS A HA 82 MET A QG 5.2 REMARK 3 89 LYS A QB 82 MET A QG 4.5 REMARK 3 89 LYS A QD 82 MET A QG 4.5 REMARK 3 2 ALA B QB 2 ALA B HN 5.7 REMARK 3 3 SER B QB 3 SER B HN 4.2 REMARK 3 4 PRO B QD 4 PRO B HB3 5.2 REMARK 3 4 PRO B QD 4 PRO B HB2 5.2 REMARK 3 4 PRO B QG 4 PRO B HA 4.0 REMARK 3 5 LEU B HA 5 LEU B QD1 5.0 REMARK 3 5 LEU B HA 5 LEU B QD2 4.5 REMARK 3 5 LEU B HB3 5 LEU B HN 4.5 REMARK 3 5 LEU B HB2 5 LEU B HN 4.5 REMARK 3 5 LEU B HB3 5 LEU B QD2 5.0 REMARK 3 5 LEU B HB2 5 LEU B QD2 5.0 REMARK 3 5 LEU B QD1 5 LEU B HN 5.7 REMARK 3 5 LEU B QD2 5 LEU B HN 5.7 REMARK 3 6 ASP B HB2 6 ASP B HN 5.2 REMARK 3 6 ASP B HB3 6 ASP B HN 5.2 REMARK 3 7 GLN B HB2 7 GLN B HN 4.5 REMARK 3 7 GLN B HB3 7 GLN B HN 4.5 REMARK 3 7 GLN B QG 7 GLN B HA 4.0 REMARK 3 7 GLN B QG 7 GLN B HN 4.5 REMARK 3 7 GLN B QG 7 GLN B QE2 5.2 REMARK 3 9 ILE B HB 9 ILE B HN 4.5 REMARK 3 9 ILE B HB 9 ILE B QD1 4.5 REMARK 3 9 ILE B QD1 9 ILE B HA 5.0 REMARK 3 9 ILE B QD1 9 ILE B HN 5.0 REMARK 3 9 ILE B QG1 9 ILE B HA 4.5 REMARK 3 9 ILE B QG1 9 ILE B HN 5.0 REMARK 3 9 ILE B QG2 9 ILE B HN 5.7 REMARK 3 11 LEU B HB2 11 LEU B HN 4.5 REMARK 3 11 LEU B HB3 11 LEU B HN 4.5 REMARK 3 11 LEU B HB3 11 LEU B QD1 4.5 REMARK 3 11 LEU B HB3 11 LEU B QD2 4.5 REMARK 3 11 LEU B HG 11 LEU B HA 4.5 REMARK 3 11 LEU B HG 11 LEU B HN 4.5 REMARK 3 11 LEU B QD1 11 LEU B HA 5.0 REMARK 3 11 LEU B QD1 11 LEU B HB2 5.0 REMARK 3 11 LEU B QD1 11 LEU B HN 5.0 REMARK 3 11 LEU B QD2 11 LEU B HA 4.5 REMARK 3 11 LEU B QD2 11 LEU B HB2 5.0 REMARK 3 11 LEU B QD2 11 LEU B HN 5.0 REMARK 3 12 LEU B HA 12 LEU B HG 4.5 REMARK 3 12 LEU B HA 12 LEU B QD1 4.5 REMARK 3 12 LEU B HA 12 LEU B QD2 5.0 REMARK 3 12 LEU B HB2 12 LEU B HN 4.5 REMARK 3 12 LEU B HB2 12 LEU B QD2 6.0 REMARK 3 12 LEU B HB3 12 LEU B HN 4.5 REMARK 3 12 LEU B HG 12 LEU B HN 4.5 REMARK 3 12 LEU B QD1 12 LEU B HB2 5.0 REMARK 3 12 LEU B QD1 12 LEU B HN 5.7 REMARK 3 13 ILE B HA 13 ILE B QG1 5.0 REMARK 3 13 ILE B HB 13 ILE B HN 4.5 REMARK 3 13 ILE B HB 13 ILE B QD1 5.0 REMARK 3 13 ILE B QD1 13 ILE B HA 5.0 REMARK 3 13 ILE B QD1 13 ILE B HN 5.7 REMARK 3 13 ILE B QG1 13 ILE B HN 5.7 REMARK 3 13 ILE B QG2 13 ILE B HA 5.0 REMARK 3 13 ILE B QG2 13 ILE B HN 5.0 REMARK 3 13 ILE B QG2 13 ILE B QG1 5.5 REMARK 3 15 ILE B HA 15 ILE B QD1 5.0 REMARK 3 15 ILE B HA 15 ILE B QG2 5.0 REMARK 3 15 ILE B HB 15 ILE B HN 4.5 REMARK 3 15 ILE B QD1 15 ILE B HB 5.0 REMARK 3 15 ILE B QD1 15 ILE B HN 5.7 REMARK 3 15 ILE B QD1 15 ILE B QG2 5.5 REMARK 3 15 ILE B QG1 15 ILE B HA 5.0 REMARK 3 15 ILE B QG1 15 ILE B HN 5.0 REMARK 3 15 ILE B QG1 15 ILE B QG2 5.5 REMARK 3 15 ILE B QG2 15 ILE B HN 5.7 REMARK 3 16 PHE B HA 16 PHE B CG 5.2 REMARK 3 16 PHE B HN 16 PHE B CG 5.5 REMARK 3 17 HIS B QB 17 HIS B HN 3.4 REMARK 3 18 LYS B QB 18 LYS B HN 4.5 REMARK 3 18 LYS B QB 18 LYS B QD 4.0 REMARK 3 18 LYS B QB 18 LYS B QE 4.5 REMARK 3 18 LYS B QD 18 LYS B HA 4.5 REMARK 3 18 LYS B QD 18 LYS B HN 5.2 REMARK 3 18 LYS B QG 18 LYS B HA 4.0 REMARK 3 18 LYS B QG 18 LYS B HN 4.5 REMARK 3 18 LYS B QG 18 LYS B QE 4.0 REMARK 3 19 TYR B CG 19 TYR B HA 4.2 REMARK 3 19 TYR B HA 19 TYR B HN 3.4 REMARK 3 19 TYR B HN 19 TYR B CG 3.4 REMARK 3 22 LYS B HA 22 LYS B QG 4.5 REMARK 3 22 LYS B QB 22 LYS B HN 4.5 REMARK 3 22 LYS B QB 22 LYS B QE 5.2 REMARK 3 22 LYS B QG 22 LYS B HN 4.5 REMARK 3 22 LYS B QG 22 LYS B QE 4.0 REMARK 3 23 GLU B QB 23 GLU B HN 5.2 REMARK 3 23 GLU B QG 23 GLU B HA 4.5 REMARK 3 23 GLU B QG 23 GLU B HN 4.5 REMARK 3 25 ASP B QB 25 ASP B HN 4.5 REMARK 3 26 LYS B HA 26 LYS B QD 4.5 REMARK 3 26 LYS B QB 26 LYS B HN 4.5 REMARK 3 26 LYS B QD 26 LYS B HN 5.2 REMARK 3 26 LYS B QG 26 LYS B HA 4.5 REMARK 3 26 LYS B QG 26 LYS B HN 5.2 REMARK 3 26 LYS B QG 26 LYS B QE 4.5 REMARK 3 27 HIS B HA 27 HIS B HN 5.2 REMARK 3 27 HIS B HD2 27 HIS B QB 4.2 REMARK 3 27 HIS B HN 27 HIS B QB 5.5 REMARK 3 28 THR B QG2 28 THR B HA 5.0 REMARK 3 28 THR B QG2 28 THR B HN 5.7 REMARK 3 29 LEU B HG 29 LEU B HA 5.2 REMARK 3 29 LEU B QD1 29 LEU B HA 5.7 REMARK 3 29 LEU B QD1 29 LEU B HN 5.7 REMARK 3 29 LEU B QD1 29 LEU B QB 5.7 REMARK 3 29 LEU B QD2 29 LEU B HN 5.7 REMARK 3 29 LEU B QD2 29 LEU B QB 5.0 REMARK 3 30 SER B QB 30 SER B HN 5.2 REMARK 3 32 LYS B HA 32 LYS B QG 4.5 REMARK 3 32 LYS B QB 32 LYS B HN 4.5 REMARK 3 32 LYS B QB 32 LYS B QE 6.0 REMARK 3 32 LYS B QD 32 LYS B HN 4.5 REMARK 3 32 LYS B QE 32 LYS B HA 5.5 REMARK 3 32 LYS B QE 32 LYS B HN 5.5 REMARK 3 32 LYS B QG 32 LYS B QE 4.5 REMARK 3 33 GLU B HA 33 GLU B QG 4.0 REMARK 3 33 GLU B HB2 33 GLU B HN 4.5 REMARK 3 33 GLU B HB3 33 GLU B HN 4.5 REMARK 3 33 GLU B QG 33 GLU B HN 4.5 REMARK 3 34 LEU B HA 34 LEU B HG 4.5 REMARK 3 34 LEU B HA 34 LEU B QD1 5.0 REMARK 3 34 LEU B HB2 34 LEU B HN 5.2 REMARK 3 34 LEU B HB3 34 LEU B HN 5.2 REMARK 3 34 LEU B HB3 34 LEU B QD1 6.0 REMARK 3 34 LEU B QD1 34 LEU B HB2 5.0 REMARK 3 34 LEU B QD1 34 LEU B HN 5.7 REMARK 3 34 LEU B QD2 34 LEU B HA 4.5 REMARK 3 34 LEU B QD2 34 LEU B HB2 5.0 REMARK 3 34 LEU B QD2 34 LEU B HB3 5.0 REMARK 3 34 LEU B QD2 34 LEU B HN 5.7 REMARK 3 35 LYS B HB2 35 LYS B HN 4.5 REMARK 3 35 LYS B HB3 35 LYS B HN 4.5 REMARK 3 35 LYS B QD 35 LYS B HA 4.5 REMARK 3 35 LYS B QD 35 LYS B HB2 4.5 REMARK 3 35 LYS B QD 35 LYS B HN 5.2 REMARK 3 35 LYS B QG 35 LYS B HA 4.0 REMARK 3 35 LYS B QG 35 LYS B HN 5.2 REMARK 3 36 GLU B HA 36 GLU B QG 4.0 REMARK 3 36 GLU B QB 36 GLU B HN 4.5 REMARK 3 36 GLU B QG 36 GLU B HN 4.5 REMARK 3 37 LEU B HA 37 LEU B HG 4.5 REMARK 3 37 LEU B HA 37 LEU B QD1 5.7 REMARK 3 37 LEU B HB2 37 LEU B HN 4.5 REMARK 3 37 LEU B HB2 37 LEU B QD2 5.0 REMARK 3 37 LEU B HB3 37 LEU B HN 4.5 REMARK 3 37 LEU B HB3 37 LEU B QD1 6.0 REMARK 3 37 LEU B HG 37 LEU B HN 5.2 REMARK 3 37 LEU B QD1 37 LEU B HB2 5.0 REMARK 3 37 LEU B QD1 37 LEU B HN 5.7 REMARK 3 37 LEU B QD2 37 LEU B HA 5.7 REMARK 3 38 ILE B HA 38 ILE B QG1 5.0 REMARK 3 38 ILE B HB 38 ILE B HN 4.5 REMARK 3 38 ILE B QD1 38 ILE B HA 5.0 REMARK 3 38 ILE B QD1 38 ILE B HB 4.5 REMARK 3 38 ILE B QD1 38 ILE B HN 5.0 REMARK 3 38 ILE B QD1 38 ILE B QG2 5.0 REMARK 3 38 ILE B QG1 38 ILE B HN 5.0 REMARK 3 38 ILE B QG2 38 ILE B HA 5.0 REMARK 3 38 ILE B QG2 38 ILE B HN 5.0 REMARK 3 38 ILE B QG2 38 ILE B QG1 5.5 REMARK 3 39 GLN B HB2 39 GLN B HN 4.5 REMARK 3 39 GLN B HB3 39 GLN B HN 4.5 REMARK 3 39 GLN B QG 39 GLN B HA 4.0 REMARK 3 39 GLN B QG 39 GLN B HN 4.5 REMARK 3 40 LYS B QB 40 LYS B HN 4.5 REMARK 3 40 LYS B QB 40 LYS B QD 4.0 REMARK 3 40 LYS B QD 40 LYS B HA 4.0 REMARK 3 40 LYS B QD 40 LYS B HN 4.5 REMARK 3 40 LYS B QE 40 LYS B HA 4.5 REMARK 3 40 LYS B QE 40 LYS B HN 5.2 REMARK 3 40 LYS B QE 40 LYS B QB 6.0 REMARK 3 40 LYS B QG 40 LYS B HA 4.0 REMARK 3 40 LYS B QG 40 LYS B HN 4.5 REMARK 3 41 GLU B QB 41 GLU B HN 5.2 REMARK 3 41 GLU B QG 41 GLU B HA 6.0 REMARK 3 42 LEU B HA 42 LEU B QD1 5.0 REMARK 3 42 LEU B HG 42 LEU B HA 4.5 REMARK 3 42 LEU B HG 42 LEU B HN 4.5 REMARK 3 42 LEU B QB 42 LEU B HN 4.5 REMARK 3 42 LEU B QB 42 LEU B QD1 4.5 REMARK 3 42 LEU B QD1 42 LEU B HN 5.7 REMARK 3 42 LEU B QD2 42 LEU B HA 5.0 REMARK 3 42 LEU B QD2 42 LEU B QB 4.5 REMARK 3 43 THR B HA 43 THR B QG2 4.5 REMARK 3 43 THR B HB 43 THR B HN 5.2 REMARK 3 43 THR B QG2 43 THR B HN 5.7 REMARK 3 44 ILE B HB 44 ILE B HN 4.5 REMARK 3 44 ILE B QD1 44 ILE B HA 5.7 REMARK 3 44 ILE B QD1 44 ILE B HB 5.0 REMARK 3 44 ILE B QD1 44 ILE B HN 5.7 REMARK 3 44 ILE B QG1 44 ILE B HA 5.0 REMARK 3 44 ILE B QG1 44 ILE B HN 5.0 REMARK 3 44 ILE B QG2 44 ILE B HA 5.0 REMARK 3 44 ILE B QG2 44 ILE B QG1 5.5 REMARK 3 47 LYS B HB2 47 LYS B HN 5.2 REMARK 3 47 LYS B HB3 47 LYS B HN 5.2 REMARK 3 47 LYS B QE 47 LYS B HA 5.5 REMARK 3 47 LYS B QG 47 LYS B HA 4.0 REMARK 3 47 LYS B QG 47 LYS B HN 4.5 REMARK 3 47 LYS B QG 47 LYS B QE 4.5 REMARK 3 48 LEU B HA 48 LEU B QD1 4.5 REMARK 3 48 LEU B HA 48 LEU B QD2 5.0 REMARK 3 48 LEU B HG 48 LEU B HA 4.0 REMARK 3 48 LEU B HG 48 LEU B HN 4.5 REMARK 3 48 LEU B QB 48 LEU B HN 4.5 REMARK 3 48 LEU B QB 48 LEU B QD1 4.5 REMARK 3 48 LEU B QD1 48 LEU B HN 5.7 REMARK 3 48 LEU B QD2 48 LEU B HN 5.7 REMARK 3 48 LEU B QD2 48 LEU B QB 4.5 REMARK 3 49 GLN B HA 49 GLN B QG 5.0 REMARK 3 49 GLN B HB2 49 GLN B HN 4.5 REMARK 3 49 GLN B HB3 49 GLN B HN 4.5 REMARK 3 50 ASP B QB 50 ASP B HN 4.5 REMARK 3 51 ALA B QB 51 ALA B HN 5.0 REMARK 3 52 GLU B QB 52 GLU B HN 4.5 REMARK 3 52 GLU B QG 52 GLU B HA 4.0 REMARK 3 52 GLU B QG 52 GLU B HN 4.5 REMARK 3 53 ILE B HA 53 ILE B QG1 4.5 REMARK 3 53 ILE B HA 53 ILE B QG2 4.5 REMARK 3 53 ILE B HB 53 ILE B HN 4.5 REMARK 3 53 ILE B QD1 53 ILE B HA 5.0 REMARK 3 53 ILE B QD1 53 ILE B HB 4.5 REMARK 3 53 ILE B QD1 53 ILE B HN 5.7 REMARK 3 53 ILE B QD1 53 ILE B QG2 7.0 REMARK 3 53 ILE B QG1 53 ILE B HN 5.0 REMARK 3 53 ILE B QG1 53 ILE B QG2 5.0 REMARK 3 53 ILE B QG2 53 ILE B HN 5.0 REMARK 3 54 VAL B HA 54 VAL B QG1 4.5 REMARK 3 54 VAL B HB 54 VAL B HN 4.5 REMARK 3 54 VAL B QG1 54 VAL B HN 5.0 REMARK 3 54 VAL B QG2 54 VAL B HA 4.5 REMARK 3 54 VAL B QG2 54 VAL B HN 5.0 REMARK 3 55 LYS B HA 55 LYS B QG 4.5 REMARK 3 55 LYS B QB 55 LYS B HN 4.5 REMARK 3 55 LYS B QB 55 LYS B QE 6.0 REMARK 3 55 LYS B QG 55 LYS B HN 4.5 REMARK 3 56 LEU B HA 56 LEU B HG 4.5 REMARK 3 56 LEU B HG 56 LEU B HN 4.5 REMARK 3 56 LEU B QB 56 LEU B HN 4.5 REMARK 3 56 LEU B QB 56 LEU B QD1 4.5 REMARK 3 56 LEU B QD1 56 LEU B HA 5.0 REMARK 3 56 LEU B QD2 56 LEU B HA 4.5 REMARK 3 56 LEU B QD2 56 LEU B QB 5.0 REMARK 3 57 MET B HB2 57 MET B HN 4.5 REMARK 3 57 MET B HB2 57 MET B QE 5.0 REMARK 3 57 MET B QE 57 MET B HA 5.0 REMARK 3 57 MET B QE 57 MET B HN 5.0 REMARK 3 57 MET B QE 57 MET B QG 4.5 REMARK 3 57 MET B QG 57 MET B HA 5.2 REMARK 3 57 MET B QG 57 MET B HN 4.5 REMARK 3 58 ASP B QB 58 ASP B HN 3.4 REMARK 3 59 ASP B QB 59 ASP B HN 4.5 REMARK 3 60 LEU B HA 60 LEU B QD1 4.5 REMARK 3 60 LEU B HA 60 LEU B QD2 5.0 REMARK 3 60 LEU B HG 60 LEU B HN 4.5 REMARK 3 60 LEU B QB 60 LEU B HN 5.2 REMARK 3 60 LEU B QB 60 LEU B QD1 5.7 REMARK 3 60 LEU B QD2 60 LEU B HN 5.7 REMARK 3 60 LEU B QD2 60 LEU B QB 5.7 REMARK 3 61 ASP B QB 61 ASP B HN 4.5 REMARK 3 62 ARG B HA 62 ARG B QD 5.2 REMARK 3 62 ARG B QB 62 ARG B HN 4.5 REMARK 3 62 ARG B QD 62 ARG B HN 5.2 REMARK 3 62 ARG B QD 62 ARG B QB 4.0 REMARK 3 62 ARG B QG 62 ARG B HA 4.0 REMARK 3 62 ARG B QG 62 ARG B HN 4.5 REMARK 3 62 ARG B QG 62 ARG B QD 4.5 REMARK 3 63 ASN B HB2 63 ASN B QD2 5.7 REMARK 3 63 ASN B HB3 63 ASN B QD2 5.7 REMARK 3 64 LYS B HA 64 LYS B QG 4.0 REMARK 3 64 LYS B QB 64 LYS B HN 5.2 REMARK 3 64 LYS B QE 64 LYS B HA 6.0 REMARK 3 64 LYS B QE 64 LYS B HN 6.0 REMARK 3 64 LYS B QG 64 LYS B HN 4.5 REMARK 3 65 ASP B HB2 65 ASP B HN 4.5 REMARK 3 65 ASP B HB3 65 ASP B HN 4.5 REMARK 3 66 GLN B HA 66 GLN B QG 4.0 REMARK 3 66 GLN B QB 66 GLN B HN 4.5 REMARK 3 66 GLN B QG 66 GLN B HN 4.5 REMARK 3 66 GLN B QG 66 GLN B QE2 4.5 REMARK 3 67 GLU B QB 67 GLU B HN 4.5 REMARK 3 67 GLU B QG 67 GLU B HA 4.0 REMARK 3 67 GLU B QG 67 GLU B HN 4.5 REMARK 3 68 VAL B HA 68 VAL B QG2 6.0 REMARK 3 68 VAL B HB 68 VAL B HN 4.5 REMARK 3 68 VAL B QG1 68 VAL B HA 5.0 REMARK 3 68 VAL B QG1 68 VAL B HN 5.7 REMARK 3 68 VAL B QG2 68 VAL B HN 5.0 REMARK 3 69 ASN B HA 69 ASN B QD2 5.7 REMARK 3 69 ASN B QB 69 ASN B HN 5.2 REMARK 3 69 ASN B QB 69 ASN B QD2 5.7 REMARK 3 70 PHE B HA 70 PHE B CG 4.2 REMARK 3 70 PHE B HN 70 PHE B CG 5.5 REMARK 3 71 GLN B HA 71 GLN B QE2 5.2 REMARK 3 71 GLN B QB 71 GLN B HN 4.5 REMARK 3 71 GLN B QG 71 GLN B HA 4.5 REMARK 3 71 GLN B QG 71 GLN B HN 4.5 REMARK 3 72 GLU B HB2 72 GLU B HN 4.5 REMARK 3 72 GLU B HB3 72 GLU B HN 4.5 REMARK 3 72 GLU B QG 72 GLU B HA 4.0 REMARK 3 72 GLU B QG 72 GLU B HN 4.5 REMARK 3 73 TYR B CG 73 TYR B HN 5.5 REMARK 3 73 TYR B HA 73 TYR B CG 4.2 REMARK 3 73 TYR B HN 73 TYR B QB 3.4 REMARK 3 74 ILE B HA 74 ILE B QD1 5.0 REMARK 3 74 ILE B HB 74 ILE B HN 4.5 REMARK 3 74 ILE B HB 74 ILE B QD1 5.0 REMARK 3 74 ILE B QD1 74 ILE B HN 5.7 REMARK 3 74 ILE B QD1 74 ILE B QG2 7.0 REMARK 3 74 ILE B QG1 74 ILE B HA 5.0 REMARK 3 74 ILE B QG1 74 ILE B HN 5.0 REMARK 3 74 ILE B QG1 74 ILE B QG2 5.5 REMARK 3 74 ILE B QG2 74 ILE B HA 5.0 REMARK 3 74 ILE B QG2 74 ILE B HN 5.0 REMARK 3 75 THR B HA 75 THR B QG2 4.5 REMARK 3 75 THR B HB 75 THR B HN 3.4 REMARK 3 75 THR B QG2 75 THR B HN 4.7 REMARK 3 76 PHE B HA 76 PHE B CG 3.4 REMARK 3 77 LEU B HA 77 LEU B HG 4.5 REMARK 3 77 LEU B HA 77 LEU B QD1 5.7 REMARK 3 77 LEU B HA 77 LEU B QD2 4.5 REMARK 3 77 LEU B HB2 77 LEU B HN 4.5 REMARK 3 77 LEU B HB3 77 LEU B HN 4.5 REMARK 3 77 LEU B HG 77 LEU B HN 4.5 REMARK 3 77 LEU B QD1 77 LEU B HB2 5.0 REMARK 3 77 LEU B QD1 77 LEU B HB3 5.0 REMARK 3 77 LEU B QD1 77 LEU B HN 5.7 REMARK 3 77 LEU B QD2 77 LEU B HB2 4.5 REMARK 3 77 LEU B QD2 77 LEU B HB3 5.0 REMARK 3 77 LEU B QD2 77 LEU B HN 5.0 REMARK 3 80 LEU B HG 80 LEU B HA 4.5 REMARK 3 80 LEU B HG 80 LEU B HN 4.5 REMARK 3 80 LEU B QB 80 LEU B HN 4.5 REMARK 3 80 LEU B QB 80 LEU B QD2 4.5 REMARK 3 80 LEU B QD1 80 LEU B HA 4.5 REMARK 3 80 LEU B QD1 80 LEU B HN 5.0 REMARK 3 80 LEU B QD1 80 LEU B QB 5.0 REMARK 3 80 LEU B QD2 80 LEU B HA 5.0 REMARK 3 80 LEU B QD2 80 LEU B HN 5.0 REMARK 3 81 ALA B QB 81 ALA B HN 5.0 REMARK 3 82 MET B HA 82 MET B QE 5.0 REMARK 3 82 MET B QB 82 MET B HN 5.2 REMARK 3 82 MET B QB 82 MET B QE 6.0 REMARK 3 82 MET B QE 82 MET B HN 5.0 REMARK 3 82 MET B QE 82 MET B QG 4.5 REMARK 3 82 MET B QG 82 MET B HA 4.0 REMARK 3 82 MET B QG 82 MET B HN 4.5 REMARK 3 83 ILE B HA 83 ILE B QD1 6.0 REMARK 3 83 ILE B HA 83 ILE B QG2 5.0 REMARK 3 83 ILE B HB 83 ILE B HN 4.5 REMARK 3 83 ILE B HB 83 ILE B QD1 5.0 REMARK 3 83 ILE B QD1 83 ILE B HN 5.7 REMARK 3 83 ILE B QG1 83 ILE B HA 4.5 REMARK 3 83 ILE B QG1 83 ILE B HN 5.0 REMARK 3 83 ILE B QG2 83 ILE B HN 5.7 REMARK 3 83 ILE B QG2 83 ILE B QG1 5.0 REMARK 3 84 TYR B CG 84 TYR B HN 4.2 REMARK 3 84 TYR B HN 84 TYR B QB 4.2 REMARK 3 85 ASN B HA 85 ASN B QD2 5.7 REMARK 3 85 ASN B HB2 85 ASN B QD2 5.7 REMARK 3 85 ASN B HB3 85 ASN B HN 5.2 REMARK 3 85 ASN B HB3 85 ASN B QD2 5.7 REMARK 3 86 GLU B QB 86 GLU B HN 4.5 REMARK 3 86 GLU B QG 86 GLU B HA 4.0 REMARK 3 86 GLU B QG 86 GLU B HN 4.5 REMARK 3 87 ALA B QB 87 ALA B HN 5.0 REMARK 3 88 LEU B HA 88 LEU B HG 4.5 REMARK 3 88 LEU B HA 88 LEU B QD1 5.7 REMARK 3 88 LEU B HA 88 LEU B QD2 5.0 REMARK 3 88 LEU B HG 88 LEU B HN 4.5 REMARK 3 88 LEU B QB 88 LEU B HN 4.5 REMARK 3 88 LEU B QB 88 LEU B QD1 5.7 REMARK 3 88 LEU B QB 88 LEU B QD2 6.0 REMARK 3 88 LEU B QD1 88 LEU B HN 5.7 REMARK 3 88 LEU B QD2 88 LEU B HN 5.7 REMARK 3 89 LYS B HA 89 LYS B QE 6.0 REMARK 3 89 LYS B QB 89 LYS B HN 4.5 REMARK 3 89 LYS B QD 89 LYS B HA 6.0 REMARK 3 89 LYS B QE 89 LYS B HN 6.0 REMARK 3 89 LYS B QE 89 LYS B QB 4.5 REMARK 3 89 LYS B QG 89 LYS B HA 4.0 REMARK 3 89 LYS B QG 89 LYS B HN 4.5 REMARK 3 89 LYS B QG 89 LYS B QE 4.0 REMARK 3 2 ALA B HN 3 SER B HN 4.2 REMARK 3 2 ALA B QB 3 SER B HN 5.7 REMARK 3 3 SER B HN 2 ALA B HA 3.4 REMARK 3 5 LEU B HN 6 ASP B HN 3.4 REMARK 3 5 LEU B QD1 6 ASP B HN 5.7 REMARK 3 6 ASP B HA 7 GLN B HN 4.5 REMARK 3 6 ASP B HB2 7 GLN B HN 5.2 REMARK 3 6 ASP B HB3 7 GLN B HN 5.2 REMARK 3 6 ASP B HN 7 GLN B HN 3.4 REMARK 3 7 GLN B HB2 8 ALA B HN 4.5 REMARK 3 7 GLN B HB3 8 ALA B HN 4.5 REMARK 3 7 GLN B HN 8 ALA B HN 3.4 REMARK 3 7 GLN B QG 8 ALA B HN 4.5 REMARK 3 9 ILE B HB 10 GLY B HN 4.5 REMARK 3 9 ILE B HN 10 GLY B HN 3.4 REMARK 3 9 ILE B QD1 10 GLY B HN 5.7 REMARK 3 9 ILE B QG2 10 GLY B HN 5.0 REMARK 3 11 LEU B HN 10 GLY B QA 4.2 REMARK 3 11 LEU B HB2 12 LEU B HN 5.0 REMARK 3 11 LEU B HB3 12 LEU B HN 5.0 REMARK 3 12 LEU B HN 11 LEU B HA 4.2 REMARK 3 12 LEU B QD2 13 ILE B HN 5.7 REMARK 3 13 ILE B HN 12 LEU B HN 3.4 REMARK 3 13 ILE B HB 14 GLY B HN 4.5 REMARK 3 13 ILE B HN 14 GLY B HN 4.2 REMARK 3 13 ILE B QG2 14 GLY B HN 5.0 REMARK 3 14 GLY B HN 15 ILE B HN 4.5 REMARK 3 15 ILE B HA 16 PHE B HN 5.2 REMARK 3 15 ILE B HB 16 PHE B HN 4.5 REMARK 3 15 ILE B QD1 16 PHE B HN 5.7 REMARK 3 16 PHE B HN 15 ILE B HN 3.4 REMARK 3 16 PHE B CG 17 HIS B HN 5.5 REMARK 3 16 PHE B HA 17 HIS B HN 5.2 REMARK 3 16 PHE B HN 17 HIS B HN 3.4 REMARK 3 17 HIS B HA 18 LYS B HN 5.2 REMARK 3 18 LYS B HN 17 HIS B HN 3.4 REMARK 3 18 LYS B HN 19 TYR B HN 4.5 REMARK 3 18 LYS B HA 19 TYR B HN 4.5 REMARK 3 18 LYS B HB2 19 TYR B HN 5.2 REMARK 3 21 GLY B QA 22 LYS B HN 5.2 REMARK 3 22 LYS B QB 23 GLU B HN 4.5 REMARK 3 22 LYS B HA 26 LYS B QB 6.0 REMARK 3 22 LYS B HA 23 GLU B HN 6.0 REMARK 3 23 GLU B QG 22 LYS B QG 6.0 REMARK 3 23 GLU B QG 22 LYS B HN 6.0 REMARK 3 23 GLU B HA 22 LYS B HA 6.0 REMARK 3 23 GLU B QG 22 LYS B HA 6.0 REMARK 3 23 GLU B HN 22 LYS B HA 4.2 REMARK 3 23 GLU B HN 22 LYS B HN 5.5 REMARK 3 23 GLU B QB 24 GLY B HN 5.2 REMARK 3 23 GLU B QG 24 GLY B HN 5.2 REMARK 3 24 GLY B HN 23 GLU B HA 3.4 REMARK 3 24 GLY B HN 23 GLU B HN 5.5 REMARK 3 25 ASP B HN 24 GLY B QA 3.4 REMARK 3 25 ASP B QB 26 LYS B HN 4.5 REMARK 3 26 LYS B HN 25 ASP B HA 3.4 REMARK 3 27 HIS B HN 26 LYS B HA 4.2 REMARK 3 27 HIS B HN 28 THR B HN 4.2 REMARK 3 28 THR B HN 27 HIS B HA 3.4 REMARK 3 28 THR B HA 29 LEU B HN 3.4 REMARK 3 28 THR B HB 29 LEU B HN 3.4 REMARK 3 28 THR B QG2 29 LEU B HN 5.7 REMARK 3 29 LEU B HA 30 SER B HN 3.4 REMARK 3 30 SER B HA 31 LYS B HN 3.4 REMARK 3 31 LYS B HN 30 SER B QB 4.2 REMARK 3 32 LYS B HA 33 GLU B HN 5.2 REMARK 3 32 LYS B HN 33 GLU B HN 4.2 REMARK 3 32 LYS B QB 33 GLU B HN 4.5 REMARK 3 32 LYS B QD 33 GLU B HN 5.2 REMARK 3 33 GLU B HN 34 LEU B HN 3.4 REMARK 3 33 GLU B HB3 34 LEU B HN 5.2 REMARK 3 33 GLU B QG 34 LEU B HN 5.2 REMARK 3 34 LEU B HA 35 LYS B HN 4.5 REMARK 3 34 LEU B HN 35 LYS B HN 3.4 REMARK 3 34 LEU B QD1 35 LYS B HN 5.7 REMARK 3 35 LYS B HN 36 GLU B HN 3.4 REMARK 3 35 LYS B HA 36 GLU B HN 5.2 REMARK 3 35 LYS B HB2 36 GLU B HN 5.2 REMARK 3 35 LYS B HB3 36 GLU B HN 5.2 REMARK 3 36 GLU B HA 37 LEU B HN 4.2 REMARK 3 36 GLU B HN 37 LEU B HN 3.4 REMARK 3 36 GLU B QB 37 LEU B HN 4.5 REMARK 3 36 GLU B QG 37 LEU B HN 4.5 REMARK 3 38 ILE B HA 39 GLN B HN 5.2 REMARK 3 38 ILE B HB 39 GLN B HN 4.5 REMARK 3 38 ILE B QD1 39 GLN B HN 5.7 REMARK 3 38 ILE B QG2 39 GLN B HN 5.0 REMARK 3 38 ILE B QG2 39 GLN B HA 4.5 REMARK 3 39 GLN B HN 38 ILE B HN 3.4 REMARK 3 39 GLN B HA 40 LYS B HN 4.5 REMARK 3 39 GLN B HB2 40 LYS B HN 5.2 REMARK 3 39 GLN B HB3 40 LYS B HN 5.2 REMARK 3 39 GLN B HN 40 LYS B HN 3.4 REMARK 3 39 GLN B QG 40 LYS B HN 5.2 REMARK 3 39 GLN B HB2 40 LYS B QE 6.0 REMARK 3 40 LYS B HA 41 GLU B HN 4.5 REMARK 3 40 LYS B QB 41 GLU B HN 5.2 REMARK 3 40 LYS B QE 41 GLU B HN 5.2 REMARK 3 40 LYS B QG 41 GLU B HN 5.2 REMARK 3 41 GLU B HN 40 LYS B HN 3.4 REMARK 3 41 GLU B HN 42 LEU B HN 3.4 REMARK 3 41 GLU B QB 42 LEU B HN 5.0 REMARK 3 42 LEU B QD2 43 THR B HN 6.0 REMARK 3 43 THR B QG2 42 LEU B HA 5.0 REMARK 3 43 THR B HB 44 ILE B HN 5.2 REMARK 3 44 ILE B HA 43 THR B HA 6.0 REMARK 3 44 ILE B HA 45 GLY B HN 5.2 REMARK 3 44 ILE B HB 45 GLY B HN 5.2 REMARK 3 45 GLY B HN 44 ILE B HN 4.2 REMARK 3 46 SER B HA 47 LYS B HN 5.2 REMARK 3 47 LYS B HN 48 LEU B HN 4.2 REMARK 3 48 LEU B HN 47 LYS B HA 4.2 REMARK 3 48 LEU B HA 49 GLN B HN 4.5 REMARK 3 50 ASP B HN 49 GLN B HA 4.2 REMARK 3 50 ASP B HN 49 GLN B HN 4.2 REMARK 3 50 ASP B HA 51 ALA B HN 4.5 REMARK 3 50 ASP B QB 51 ALA B HN 5.2 REMARK 3 52 GLU B QB 53 ILE B HN 5.2 REMARK 3 52 GLU B QG 53 ILE B HN 4.5 REMARK 3 53 ILE B HN 52 GLU B HN 3.4 REMARK 3 53 ILE B HN 54 VAL B HN 3.4 REMARK 3 53 ILE B HA 54 VAL B HN 4.5 REMARK 3 53 ILE B HB 54 VAL B HN 4.5 REMARK 3 53 ILE B QD1 54 VAL B HN 5.7 REMARK 3 53 ILE B QG1 54 VAL B HN 5.7 REMARK 3 53 ILE B QG2 54 VAL B HN 5.0 REMARK 3 54 VAL B HN 55 LYS B HN 3.4 REMARK 3 54 VAL B HA 55 LYS B HN 4.2 REMARK 3 54 VAL B HB 55 LYS B HN 4.5 REMARK 3 54 VAL B QG1 55 LYS B HN 5.0 REMARK 3 55 LYS B HN 56 LEU B HN 3.4 REMARK 3 55 LYS B QB 56 LEU B HN 4.5 REMARK 3 56 LEU B QD2 55 LYS B QB 6.0 REMARK 3 56 LEU B HA 57 MET B HN 4.5 REMARK 3 56 LEU B HG 57 MET B HN 5.5 REMARK 3 56 LEU B HN 57 MET B HN 3.4 REMARK 3 56 LEU B QB 57 MET B HN 4.5 REMARK 3 56 LEU B QD2 57 MET B HN 5.7 REMARK 3 57 MET B HA 58 ASP B HN 5.2 REMARK 3 57 MET B HB2 58 ASP B HN 5.0 REMARK 3 57 MET B HB3 58 ASP B HN 5.0 REMARK 3 57 MET B HN 58 ASP B HN 3.4 REMARK 3 57 MET B QE 58 ASP B HN 5.7 REMARK 3 58 ASP B HA 59 ASP B HN 4.5 REMARK 3 58 ASP B HN 59 ASP B HN 3.4 REMARK 3 58 ASP B QB 59 ASP B HN 4.5 REMARK 3 60 LEU B HN 61 ASP B HN 3.4 REMARK 3 60 LEU B QD1 61 ASP B HN 5.0 REMARK 3 60 LEU B QD2 61 ASP B HN 5.7 REMARK 3 61 ASP B HN 60 LEU B HA 5.5 REMARK 3 61 ASP B HN 62 ARG B HN 3.4 REMARK 3 61 ASP B QB 62 ARG B HN 4.5 REMARK 3 62 ARG B HN 61 ASP B HA 5.5 REMARK 3 62 ARG B HA 63 ASN B HN 5.2 REMARK 3 62 ARG B QB 63 ASN B HN 4.5 REMARK 3 63 ASN B HN 62 ARG B HN 3.4 REMARK 3 63 ASN B HA 64 LYS B HN 5.2 REMARK 3 64 LYS B HN 63 ASN B HN 5.5 REMARK 3 65 ASP B HA 66 GLN B HN 5.2 REMARK 3 65 ASP B HB2 66 GLN B HN 5.2 REMARK 3 65 ASP B HB3 66 GLN B HN 5.2 REMARK 3 65 ASP B HN 66 GLN B HN 4.5 REMARK 3 66 GLN B HA 67 GLU B HN 4.5 REMARK 3 66 GLN B QB 67 GLU B HN 4.5 REMARK 3 66 GLN B QG 67 GLU B HN 4.5 REMARK 3 67 GLU B HA 68 VAL B HN 3.4 REMARK 3 67 GLU B QB 68 VAL B HN 4.5 REMARK 3 67 GLU B QG 68 VAL B HN 5.2 REMARK 3 68 VAL B HA 69 ASN B HN 3.4 REMARK 3 68 VAL B HB 69 ASN B HN 4.5 REMARK 3 68 VAL B QG1 69 ASN B HN 5.0 REMARK 3 68 VAL B QG2 69 ASN B HN 5.7 REMARK 3 69 ASN B HA 70 PHE B HN 3.4 REMARK 3 69 ASN B QB 70 PHE B HN 3.4 REMARK 3 70 PHE B CG 71 GLN B HN 5.5 REMARK 3 70 PHE B HA 71 GLN B HN 5.2 REMARK 3 70 PHE B HN 71 GLN B HN 3.4 REMARK 3 71 GLN B HN 72 GLU B HN 3.4 REMARK 3 71 GLN B HA 72 GLU B HN 5.2 REMARK 3 71 GLN B QB 72 GLU B HN 4.5 REMARK 3 71 GLN B QG 72 GLU B HN 4.5 REMARK 3 73 TYR B CG 74 ILE B HN 4.2 REMARK 3 73 TYR B CZ 74 ILE B HN 6.0 REMARK 3 73 TYR B HN 74 ILE B HN 3.4 REMARK 3 74 ILE B QD1 70 PHE B HZ 6.0 REMARK 3 74 ILE B QD1 73 TYR B CZ 6.0 REMARK 3 74 ILE B HA 75 THR B HN 5.2 REMARK 3 74 ILE B QD1 75 THR B HN 5.7 REMARK 3 74 ILE B QG2 75 THR B HN 5.0 REMARK 3 74 ILE B HB 75 THR B HN 4.5 REMARK 3 75 THR B HA 74 ILE B QG2 6.0 REMARK 3 75 THR B HN 74 ILE B HN 3.4 REMARK 3 75 THR B HA 76 PHE B HN 5.2 REMARK 3 75 THR B HB 76 PHE B HN 4.5 REMARK 3 75 THR B HN 76 PHE B HN 3.4 REMARK 3 77 LEU B HN 78 GLY B HN 3.4 REMARK 3 77 LEU B HA 78 GLY B HN 5.2 REMARK 3 77 LEU B HB2 78 GLY B HN 5.0 REMARK 3 77 LEU B HB3 78 GLY B HN 5.0 REMARK 3 78 GLY B HN 79 ALA B HN 3.4 REMARK 3 78 GLY B QA 79 ALA B HN 4.5 REMARK 3 79 ALA B HN 80 LEU B HN 3.4 REMARK 3 80 LEU B HA 79 ALA B QB 6.0 REMARK 3 80 LEU B HN 79 ALA B HA 4.2 REMARK 3 80 LEU B HA 81 ALA B HN 4.2 REMARK 3 80 LEU B QB 81 ALA B HN 5.0 REMARK 3 80 LEU B HG 81 ALA B HN 5.2 REMARK 3 80 LEU B HN 81 ALA B HN 3.4 REMARK 3 80 LEU B QD1 81 ALA B HN 5.7 REMARK 3 81 ALA B HN 82 MET B HN 3.4 REMARK 3 81 ALA B QB 82 MET B HN 5.7 REMARK 3 82 MET B HA 83 ILE B HN 5.2 REMARK 3 82 MET B HN 83 ILE B HN 3.4 REMARK 3 82 MET B QB 83 ILE B HN 5.0 REMARK 3 83 ILE B HA 84 TYR B HN 5.2 REMARK 3 83 ILE B HB 84 TYR B HN 4.5 REMARK 3 83 ILE B HN 84 TYR B HN 3.4 REMARK 3 83 ILE B QD1 84 TYR B HN 5.7 REMARK 3 83 ILE B QG2 84 TYR B HN 5.7 REMARK 3 84 TYR B CG 85 ASN B HN 5.5 REMARK 3 84 TYR B HN 85 ASN B HN 3.4 REMARK 3 85 ASN B HA 86 GLU B HN 3.4 REMARK 3 86 GLU B HA 87 ALA B HN 4.5 REMARK 3 86 GLU B HN 87 ALA B HN 4.2 REMARK 3 86 GLU B QB 87 ALA B HN 4.5 REMARK 3 86 GLU B QG 87 ALA B HA 6.0 REMARK 3 86 GLU B QG 87 ALA B HN 5.2 REMARK 3 87 ALA B HA 88 LEU B HN 4.5 REMARK 3 87 ALA B HN 88 LEU B HN 3.4 REMARK 3 87 ALA B QB 88 LEU B HN 5.0 REMARK 3 87 ALA B QB 88 LEU B QD2 6.0 REMARK 3 88 LEU B HA 89 LYS B HN 4.5 REMARK 3 88 LEU B HN 89 LYS B HN 3.4 REMARK 3 88 LEU B QD2 89 LYS B HN 5.7 REMARK 3 89 LYS B HA 90 GLY B HN 4.2 REMARK 3 89 LYS B HN 90 GLY B HN 4.2 REMARK 3 89 LYS B HB2 90 GLY B HN 4.5 REMARK 3 89 LYS B QG 90 GLY B HN 5.2 REMARK 3 1 MET B QE 3 SER B HN 6.0 REMARK 3 2 ALA B QB 6 ASP B HA 5.7 REMARK 3 2 ALA B QB 6 ASP B HB2 5.0 REMARK 3 2 ALA B QB 6 ASP B HB3 5.0 REMARK 3 2 ALA B QB 6 ASP B HN 5.7 REMARK 3 2 ALA B QB 7 GLN B HA 5.7 REMARK 3 2 ALA B QB 7 GLN B HB3 6.0 REMARK 3 2 ALA B QB 7 GLN B HN 5.7 REMARK 3 2 ALA B QB 7 GLN B QE2 5.7 REMARK 3 2 ALA B QB 7 GLN B QG 5.0 REMARK 3 3 SER B QB 5 LEU B HB3 4.5 REMARK 3 4 PRO B HA 7 GLN B HN 4.2 REMARK 3 5 LEU B HA 8 ALA B QB 5.0 REMARK 3 5 LEU B HA 8 ALA B HN 4.5 REMARK 3 6 ASP B HA 9 ILE B HA 6.0 REMARK 3 6 ASP B HA 9 ILE B QD1 5.0 REMARK 3 6 ASP B HA 9 ILE B HN 4.5 REMARK 3 6 ASP B HA 10 GLY B HN 4.5 REMARK 3 7 GLN B HB2 2 ALA B QB 6.0 REMARK 3 7 GLN B HB2 4 PRO B HA 4.5 REMARK 3 7 GLN B HB3 4 PRO B HA 4.5 REMARK 3 7 GLN B QG 4 PRO B HA 5.2 REMARK 3 7 GLN B HA 10 GLY B HN 4.5 REMARK 3 7 GLN B HA 11 LEU B QD1 5.7 REMARK 3 7 GLN B HB2 11 LEU B QD1 6.0 REMARK 3 7 GLN B HB3 11 LEU B QD1 5.0 REMARK 3 7 GLN B QG 11 LEU B HG 5.2 REMARK 3 7 GLN B QG 11 LEU B QD1 5.0 REMARK 3 8 ALA B QB 6 ASP B HA 5.7 REMARK 3 8 ALA B HA 11 LEU B HB3 4.0 REMARK 3 8 ALA B HA 11 LEU B HG 4.5 REMARK 3 8 ALA B HA 11 LEU B HN 4.5 REMARK 3 8 ALA B HA 11 LEU B QD1 4.5 REMARK 3 8 ALA B QB 11 LEU B HB2 4.5 REMARK 3 8 ALA B QB 11 LEU B QD1 7.0 REMARK 3 8 ALA B HA 12 LEU B QD1 5.7 REMARK 3 8 ALA B QB 12 LEU B HN 5.0 REMARK 3 9 ILE B HB 5 LEU B QD1 7.0 REMARK 3 9 ILE B HB 5 LEU B QD2 5.0 REMARK 3 9 ILE B QD1 5 LEU B HA 5.0 REMARK 3 9 ILE B HB 6 ASP B HA 4.0 REMARK 3 9 ILE B QD1 6 ASP B HB3 5.7 REMARK 3 9 ILE B QG2 6 ASP B HA 5.7 REMARK 3 9 ILE B HN 11 LEU B HN 5.0 REMARK 3 9 ILE B HA 12 LEU B HB2 6.0 REMARK 3 9 ILE B HA 12 LEU B HG 6.0 REMARK 3 9 ILE B HA 12 LEU B HN 4.2 REMARK 3 9 ILE B QG2 12 LEU B HB2 5.7 REMARK 3 9 ILE B QG2 12 LEU B HB3 5.7 REMARK 3 9 ILE B QG2 13 ILE B HA 5.7 REMARK 3 9 ILE B QG2 13 ILE B HN 5.7 REMARK 3 9 ILE B QG2 13 ILE B QG1 6.2 REMARK 3 10 GLY B HN 12 LEU B HN 5.0 REMARK 3 11 LEU B QD1 7 GLN B QE2 5.7 REMARK 3 11 LEU B HB2 8 ALA B HA 4.0 REMARK 3 11 LEU B QD2 8 ALA B HA 5.0 REMARK 3 11 LEU B HN 13 ILE B HN 5.0 REMARK 3 11 LEU B HB3 15 ILE B QG1 5.0 REMARK 3 11 LEU B QD2 15 ILE B QG1 5.5 REMARK 3 12 LEU B QD1 8 ALA B QB 7.0 REMARK 3 12 LEU B HB3 9 ILE B HA 4.5 REMARK 3 12 LEU B QD1 9 ILE B HA 5.0 REMARK 3 12 LEU B QD2 9 ILE B HA 5.7 REMARK 3 12 LEU B HA 15 ILE B HN 4.5 REMARK 3 12 LEU B HN 14 GLY B HN 5.0 REMARK 3 12 LEU B HA 15 ILE B QD1 6.0 REMARK 3 12 LEU B HA 15 ILE B QG1 5.0 REMARK 3 12 LEU B HA 15 ILE B QG2 6.0 REMARK 3 12 LEU B HG 15 ILE B QG1 5.0 REMARK 3 12 LEU B QD2 15 ILE B HB 6.0 REMARK 3 13 ILE B HB 9 ILE B QG2 5.0 REMARK 3 13 ILE B QD1 9 ILE B HB 5.7 REMARK 3 13 ILE B QD1 9 ILE B QG2 5.5 REMARK 3 13 ILE B HB 10 GLY B QA 5.2 REMARK 3 13 ILE B QD1 10 GLY B QA 5.0 REMARK 3 13 ILE B QG2 10 GLY B QA 6.0 REMARK 3 13 ILE B HN 15 ILE B HN 5.0 REMARK 3 13 ILE B HA 16 PHE B HB2 5.2 REMARK 3 13 ILE B QG2 16 PHE B HN 5.7 REMARK 3 14 GLY B HN 11 LEU B HA 4.2 REMARK 3 14 GLY B QA 18 LYS B HA 6.0 REMARK 3 15 ILE B HB 12 LEU B HA 4.0 REMARK 3 15 ILE B HA 18 LYS B HB2 4.5 REMARK 3 15 ILE B HA 18 LYS B HN 4.5 REMARK 3 15 ILE B QD1 18 LYS B HN 5.7 REMARK 3 15 ILE B QD1 18 LYS B QB 5.0 REMARK 3 15 ILE B QG2 18 LYS B HN 5.7 REMARK 3 15 ILE B QG2 18 LYS B QD 6.0 REMARK 3 15 ILE B QG2 19 TYR B CG 5.7 REMARK 3 15 ILE B QG2 19 TYR B CZ 5.7 REMARK 3 15 ILE B QG2 19 TYR B HN 5.7 REMARK 3 16 PHE B HB3 13 ILE B HA 4.0 REMARK 3 16 PHE B HN 13 ILE B HA 4.2 REMARK 3 16 PHE B CG 19 TYR B HN 5.5 REMARK 3 16 PHE B HA 19 TYR B HN 5.2 REMARK 3 17 HIS B HE1 21 GLY B HN 6.0 REMARK 3 18 LYS B HB2 14 GLY B QA 4.5 REMARK 3 18 LYS B HB3 15 ILE B QG2 5.7 REMARK 3 18 LYS B QD 15 ILE B HA 6.0 REMARK 3 18 LYS B QD 15 ILE B QD1 5.7 REMARK 3 18 LYS B QD 15 ILE B QG1 5.0 REMARK 3 19 TYR B CG 15 ILE B HA 5.5 REMARK 3 21 GLY B HN 19 TYR B HA 5.5 REMARK 3 22 LYS B QD 19 TYR B HA 4.5 REMARK 3 22 LYS B QG 19 TYR B HA 4.0 REMARK 3 26 LYS B HA 21 GLY B QA 4.5 REMARK 3 26 LYS B QD 21 GLY B QA 5.2 REMARK 3 26 LYS B QD 22 LYS B HA 6.0 REMARK 3 26 LYS B HA 28 THR B HN 6.0 REMARK 3 28 THR B QG2 25 ASP B QB 6.0 REMARK 3 29 LEU B QB 33 GLU B HB2 6.0 REMARK 3 29 LEU B QB 33 GLU B QG 6.0 REMARK 3 29 LEU B QD1 33 GLU B HB2 5.7 REMARK 3 29 LEU B QD2 33 GLU B HA 5.7 REMARK 3 29 LEU B QD2 33 GLU B HB3 5.7 REMARK 3 29 LEU B QD1 34 LEU B HA 5.7 REMARK 3 29 LEU B QD1 34 LEU B HN 5.7 REMARK 3 29 LEU B QD1 34 LEU B QD1 6.2 REMARK 3 29 LEU B QD2 34 LEU B HA 5.7 REMARK 3 29 LEU B QD2 34 LEU B HN 5.7 REMARK 3 29 LEU B QD2 34 LEU B QD1 6.2 REMARK 3 31 LYS B HA 34 LEU B HB2 4.5 REMARK 3 31 LYS B HA 34 LEU B HB3 5.2 REMARK 3 31 LYS B HA 34 LEU B HG 5.2 REMARK 3 31 LYS B HA 34 LEU B QD1 6.0 REMARK 3 32 LYS B HA 35 LYS B HN 5.2 REMARK 3 33 GLU B HB2 29 LEU B QD2 6.0 REMARK 3 33 GLU B HA 36 GLU B HN 4.5 REMARK 3 33 GLU B HA 36 GLU B QB 4.5 REMARK 3 34 LEU B QD2 31 LYS B HA 5.7 REMARK 3 34 LEU B HA 37 LEU B HB2 4.5 REMARK 3 34 LEU B HA 37 LEU B HB3 4.0 REMARK 3 34 LEU B HA 37 LEU B HN 4.5 REMARK 3 34 LEU B QD2 37 LEU B HB2 5.7 REMARK 3 34 LEU B QD2 37 LEU B QD1 7.0 REMARK 3 35 LYS B HN 31 LYS B HA 4.2 REMARK 3 35 LYS B HA 37 LEU B HN 5.2 REMARK 3 35 LYS B HA 38 ILE B QD1 5.7 REMARK 3 35 LYS B HA 38 ILE B QG2 6.0 REMARK 3 35 LYS B HB3 38 ILE B QG2 5.7 REMARK 3 36 GLU B QG 33 GLU B HA 4.5 REMARK 3 36 GLU B HA 39 GLN B HN 4.5 REMARK 3 36 GLU B HA 39 GLN B HB2 5.0 REMARK 3 36 GLU B HA 39 GLN B HB3 5.0 REMARK 3 36 GLU B QG 40 LYS B QE 4.5 REMARK 3 36 GLU B QG 40 LYS B QG 4.5 REMARK 3 37 LEU B QD1 34 LEU B HA 5.7 REMARK 3 37 LEU B HA 40 LYS B QB 5.2 REMARK 3 37 LEU B QD2 41 GLU B HA 6.0 REMARK 3 37 LEU B QD2 41 GLU B HN 5.7 REMARK 3 37 LEU B QD2 41 GLU B QG 5.7 REMARK 3 38 ILE B HB 35 LYS B HA 5.2 REMARK 3 38 ILE B HN 35 LYS B HA 4.5 REMARK 3 38 ILE B HA 41 GLU B HN 4.5 REMARK 3 38 ILE B HA 42 LEU B QB 6.0 REMARK 3 38 ILE B HA 42 LEU B HN 4.5 REMARK 3 38 ILE B QG1 42 LEU B QD1 6.0 REMARK 3 38 ILE B QG2 42 LEU B QB 6.0 REMARK 3 39 GLN B QE2 36 GLU B HA 5.5 REMARK 3 40 LYS B QD 36 GLU B HA 4.5 REMARK 3 40 LYS B QD 36 GLU B QG 4.0 REMARK 3 40 LYS B QE 36 GLU B HA 4.5 REMARK 3 40 LYS B QE 36 GLU B QB 4.5 REMARK 3 40 LYS B QE 36 GLU B QG 4.5 REMARK 3 40 LYS B QG 36 GLU B HA 5.2 REMARK 3 41 GLU B QB 37 LEU B QD2 5.2 REMARK 3 42 LEU B QB 38 ILE B HA 6.0 REMARK 3 42 LEU B QD1 38 ILE B HA 5.7 REMARK 3 42 LEU B QD2 38 ILE B HA 6.0 REMARK 3 44 ILE B HB 42 LEU B HA 5.2 REMARK 3 44 ILE B HB 42 LEU B QB 4.5 REMARK 3 44 ILE B QD1 42 LEU B HA 5.7 REMARK 3 44 ILE B QD1 42 LEU B QB 5.0 REMARK 3 44 ILE B QD1 42 LEU B QD1 5.0 REMARK 3 44 ILE B QD1 42 LEU B QD2 6.0 REMARK 3 44 ILE B QG1 42 LEU B QB 4.5 REMARK 3 44 ILE B QG1 42 LEU B QD1 6.0 REMARK 3 44 ILE B QG2 42 LEU B QB 6.0 REMARK 3 44 ILE B QG2 42 LEU B QD2 6.0 REMARK 3 44 ILE B QG2 47 LYS B QG 6.0 REMARK 3 44 ILE B HB 48 LEU B QD1 6.0 REMARK 3 44 ILE B HB 48 LEU B QD2 6.0 REMARK 3 44 ILE B QD1 48 LEU B HG 4.5 REMARK 3 44 ILE B QD1 48 LEU B HN 5.2 REMARK 3 44 ILE B QD1 48 LEU B QB 6.0 REMARK 3 44 ILE B QG1 48 LEU B HG 5.0 REMARK 3 44 ILE B QG1 48 LEU B QB 6.0 REMARK 3 44 ILE B QG2 48 LEU B HG 6.0 REMARK 3 44 ILE B QG2 48 LEU B HN 5.7 REMARK 3 44 ILE B QG2 48 LEU B QB 6.0 REMARK 3 46 SER B HA 48 LEU B HN 5.2 REMARK 3 47 LYS B HA 44 ILE B QG2 5.7 REMARK 3 47 LYS B HB2 44 ILE B QG2 5.7 REMARK 3 47 LYS B HB3 44 ILE B QG2 5.7 REMARK 3 47 LYS B QD 44 ILE B QG2 6.0 REMARK 3 47 LYS B HA 48 LEU B HA 6.0 REMARK 3 47 LYS B HA 53 ILE B QD1 6.0 REMARK 3 48 LEU B HA 44 ILE B QD1 6.0 REMARK 3 48 LEU B HA 44 ILE B QG2 5.7 REMARK 3 48 LEU B QD1 44 ILE B QG2 6.0 REMARK 3 48 LEU B QD2 44 ILE B QD1 6.0 REMARK 3 48 LEU B QD2 44 ILE B QG2 6.0 REMARK 3 50 ASP B QB 53 ILE B HN 5.2 REMARK 3 50 ASP B QB 53 ILE B QD1 5.7 REMARK 3 50 ASP B QB 53 ILE B QG1 5.0 REMARK 3 50 ASP B HA 54 VAL B HB 6.0 REMARK 3 50 ASP B QB 54 VAL B HN 5.2 REMARK 3 51 ALA B HA 54 VAL B QG1 6.0 REMARK 3 51 ALA B QB 54 VAL B HB 5.0 REMARK 3 51 ALA B QB 54 VAL B HN 5.2 REMARK 3 52 GLU B HA 55 LYS B QB 4.5 REMARK 3 52 GLU B HA 55 LYS B QD 4.0 REMARK 3 52 GLU B HA 55 LYS B QB 5.0 REMARK 3 52 GLU B QG 55 LYS B QB 4.5 REMARK 3 52 GLU B QG 56 LEU B QD2 5.0 REMARK 3 53 ILE B HB 50 ASP B QB 5.2 REMARK 3 53 ILE B HA 56 LEU B HN 4.2 REMARK 3 53 ILE B HA 56 LEU B QB 5.2 REMARK 3 53 ILE B HA 56 LEU B QD2 6.0 REMARK 3 53 ILE B HB 56 LEU B QD1 6.0 REMARK 3 53 ILE B QG2 56 LEU B HN 5.2 REMARK 3 53 ILE B QG2 57 MET B HB3 6.0 REMARK 3 54 VAL B QG2 50 ASP B HA 5.0 REMARK 3 54 VAL B QG2 50 ASP B QB 5.7 REMARK 3 54 VAL B HB 51 ALA B HA 4.0 REMARK 3 54 VAL B HN 51 ALA B HA 4.2 REMARK 3 54 VAL B QG2 51 ALA B HA 4.5 REMARK 3 54 VAL B HN 56 LEU B HN 5.0 REMARK 3 54 VAL B HA 56 LEU B HN 5.2 REMARK 3 54 VAL B QG2 56 LEU B HN 6.0 REMARK 3 54 VAL B HA 57 MET B HB2 4.5 REMARK 3 54 VAL B QG1 57 MET B HB2 5.7 REMARK 3 54 VAL B QG2 57 MET B HB2 5.0 REMARK 3 54 VAL B HA 58 ASP B HN 5.2 REMARK 3 54 VAL B QG1 58 ASP B HN 5.7 REMARK 3 54 VAL B QG1 58 ASP B QB 5.7 REMARK 3 56 LEU B QD1 52 GLU B HA 5.7 REMARK 3 56 LEU B QD1 52 GLU B QG 6.0 REMARK 3 56 LEU B HG 53 ILE B HA 4.5 REMARK 3 56 LEU B QD1 53 ILE B HA 6.0 REMARK 3 56 LEU B QD1 53 ILE B QG1 6.0 REMARK 3 56 LEU B HA 59 ASP B QB 4.5 REMARK 3 56 LEU B HA 59 ASP B HN 4.5 REMARK 3 56 LEU B QD2 59 ASP B QB 5.7 REMARK 3 57 MET B QE 53 ILE B HA 5.0 REMARK 3 57 MET B QG 53 ILE B QG2 5.0 REMARK 3 57 MET B QE 53 ILE B QD1 6.0 REMARK 3 57 MET B HB3 54 VAL B HA 6.0 REMARK 3 57 MET B HN 54 VAL B HA 4.2 REMARK 3 57 MET B QE 54 VAL B HA 6.0 REMARK 3 57 MET B QE 54 VAL B QG2 6.0 REMARK 3 57 MET B QG 54 VAL B HA 5.2 REMARK 3 57 MET B HA 59 ASP B QB 5.0 REMARK 3 57 MET B HA 60 LEU B HN 4.5 REMARK 3 57 MET B HA 60 LEU B QD2 6.0 REMARK 3 57 MET B QE 60 LEU B QD2 6.0 REMARK 3 58 ASP B HN 55 LYS B HA 4.2 REMARK 3 58 ASP B QB 55 LYS B HA 4.0 REMARK 3 58 ASP B QB 62 ARG B QB 5.2 REMARK 3 59 ASP B HA 62 ARG B HN 4.2 REMARK 3 59 ASP B HA 63 ASN B HN 5.2 REMARK 3 60 LEU B HG 57 MET B HA 6.0 REMARK 3 60 LEU B QB 57 MET B HA 6.0 REMARK 3 60 LEU B HA 63 ASN B HB2 5.0 REMARK 3 60 LEU B HA 63 ASN B HB3 5.0 REMARK 3 61 ASP B HN 58 ASP B HA 4.2 REMARK 3 61 ASP B QB 58 ASP B HA 4.5 REMARK 3 61 ASP B HA 64 LYS B HA 6.0 REMARK 3 62 ARG B QB 59 ASP B HA 4.5 REMARK 3 62 ARG B QD 59 ASP B HA 4.5 REMARK 3 62 ARG B QG 59 ASP B HA 4.5 REMARK 3 63 ASN B HB2 60 LEU B QB 6.0 REMARK 3 63 ASN B HB3 66 GLN B QB 6.0 REMARK 3 64 LYS B QB 61 ASP B HA 5.2 REMARK 3 64 LYS B QD 61 ASP B HA 6.0 REMARK 3 64 LYS B QE 61 ASP B HA 5.2 REMARK 3 64 LYS B QG 61 ASP B HA 5.2 REMARK 3 64 LYS B QE 62 ARG B HA 6.0 REMARK 3 65 ASP B HA 66 GLN B HN 5.2 REMARK 3 65 ASP B HA 67 GLU B HN 6.0 REMARK 3 66 GLN B QB 63 ASN B HB3 5.2 REMARK 3 68 VAL B QG1 63 ASN B HB3 5.7 REMARK 3 68 VAL B QG1 63 ASN B QD2 6.2 REMARK 3 68 VAL B HA 72 GLU B HB2 6.0 REMARK 3 68 VAL B HA 72 GLU B HB3 6.0 REMARK 3 68 VAL B QG1 72 GLU B HA 5.7 REMARK 3 68 VAL B QG1 72 GLU B HB2 5.0 REMARK 3 68 VAL B QG1 72 GLU B HB3 5.0 REMARK 3 68 VAL B QG2 72 GLU B HB2 6.0 REMARK 3 68 VAL B QG2 72 GLU B HB3 4.5 REMARK 3 68 VAL B QG2 72 GLU B QG 6.0 REMARK 3 68 VAL B HB 73 TYR B HA 4.5 REMARK 3 68 VAL B QG1 73 TYR B HA 5.0 REMARK 3 68 VAL B QG2 73 TYR B HA 5.7 REMARK 3 68 VAL B QG2 73 TYR B QB 5.7 REMARK 3 70 PHE B CG 73 TYR B CG 5.5 REMARK 3 70 PHE B CG 73 TYR B CZ 5.5 REMARK 3 70 PHE B HA 73 TYR B CG 4.2 REMARK 3 70 PHE B HA 73 TYR B CZ 5.2 REMARK 3 70 PHE B HA 73 TYR B HN 4.5 REMARK 3 70 PHE B HA 73 TYR B QB 4.5 REMARK 3 71 GLN B HA 74 ILE B HN 4.5 REMARK 3 71 GLN B HA 74 ILE B QD1 6.0 REMARK 3 71 GLN B HA 74 ILE B QG1 5.7 REMARK 3 71 GLN B HA 74 ILE B QG2 5.7 REMARK 3 71 GLN B QG 74 ILE B HB 4.5 REMARK 3 71 GLN B QG 74 ILE B HN 6.0 REMARK 3 71 GLN B QG 74 ILE B QG2 5.7 REMARK 3 71 GLN B QG 75 THR B HB 5.2 REMARK 3 72 GLU B HA 68 VAL B QG2 6.0 REMARK 3 72 GLU B HA 75 THR B HB 4.0 REMARK 3 72 GLU B HA 75 THR B HN 4.5 REMARK 3 72 GLU B HA 75 THR B QG2 5.7 REMARK 3 73 TYR B HA 70 PHE B HA 6.0 REMARK 3 73 TYR B HA 76 PHE B QB 4.0 REMARK 3 73 TYR B HA 76 PHE B HN 4.5 REMARK 3 73 TYR B HA 77 LEU B HN 5.0 REMARK 3 73 TYR B HH 70 PHE B CZ 6.0 REMARK 3 74 ILE B QD1 70 PHE B HZ 5.0 REMARK 3 74 ILE B HB 71 GLN B HA 4.5 REMARK 3 74 ILE B QD1 71 GLN B HA 6.0 REMARK 3 74 ILE B QG2 71 GLN B QE2 6.0 REMARK 3 74 ILE B HA 76 PHE B HN 4.5 REMARK 3 74 ILE B HA 77 LEU B HN 4.5 REMARK 3 74 ILE B HA 77 LEU B HB2 5.0 REMARK 3 74 ILE B HA 77 LEU B HB3 5.0 REMARK 3 74 ILE B HA 77 LEU B HG 4.5 REMARK 3 74 ILE B HA 77 LEU B QD1 6.0 REMARK 3 74 ILE B HA 77 LEU B QD2 6.0 REMARK 3 74 ILE B QD1 77 LEU B HB2 5.7 REMARK 3 74 ILE B QD1 77 LEU B HB3 5.7 REMARK 3 74 ILE B QG2 77 LEU B HB2 5.7 REMARK 3 74 ILE B QD1 78 GLY B HN 5.7 REMARK 3 74 ILE B QG2 78 GLY B HN 5.0 REMARK 3 75 THR B HA 78 GLY B HN 4.2 REMARK 3 75 THR B QG2 78 GLY B HN 5.7 REMARK 3 75 THR B HA 79 ALA B HN 4.2 REMARK 3 76 PHE B HA 79 ALA B HN 4.5 REMARK 3 76 PHE B HA 79 ALA B QB 5.0 REMARK 3 77 LEU B QD1 73 TYR B CZ 5.7 REMARK 3 77 LEU B QD2 73 TYR B CZ 5.7 REMARK 3 77 LEU B HA 80 LEU B HN 4.5 REMARK 3 77 LEU B HA 80 LEU B QB 4.5 REMARK 3 77 LEU B HA 80 LEU B QD1 5.0 REMARK 3 78 GLY B QA 74 ILE B QG2 5.7 REMARK 3 78 GLY B QA 75 THR B HA 4.5 REMARK 3 78 GLY B QA 81 ALA B QB 5.0 REMARK 3 79 ALA B QB 76 PHE B CG 5.7 REMARK 3 79 ALA B HA 82 MET B HN 4.5 REMARK 3 79 ALA B HA 82 MET B QB 5.0 REMARK 3 79 ALA B HA 83 ILE B QD1 5.7 REMARK 3 79 ALA B QB 83 ILE B HN 5.7 REMARK 3 79 ALA B QB 83 ILE B QD1 5.5 REMARK 3 80 LEU B HA 83 ILE B QD1 5.0 REMARK 3 80 LEU B HA 83 ILE B HN 4.5 REMARK 3 80 LEU B QD1 83 ILE B HN 5.7 REMARK 3 80 LEU B QD1 84 TYR B CG 5.7 REMARK 3 80 LEU B QD1 84 TYR B CZ 5.7 REMARK 3 80 LEU B QD2 84 TYR B CG 5.7 REMARK 3 80 LEU B QD2 84 TYR B CZ 5.7 REMARK 3 81 ALA B HA 84 TYR B CG 4.2 REMARK 3 81 ALA B HA 84 TYR B CZ 4.2 REMARK 3 81 ALA B HA 84 TYR B HN 4.5 REMARK 3 81 ALA B QB 84 TYR B CZ 5.7 REMARK 3 81 ALA B HA 85 ASN B HB2 4.5 REMARK 3 81 ALA B HA 85 ASN B HB3 6.0 REMARK 3 81 ALA B HA 85 ASN B HN 4.5 REMARK 3 81 ALA B QB 85 ASN B HB2 5.7 REMARK 3 81 ALA B QB 85 ASN B HN 5.7 REMARK 3 81 ALA B QB 85 ASN B QD2 6.2 REMARK 3 82 MET B QE 78 GLY B QA 5.0 REMARK 3 82 MET B QE 79 ALA B HA 4.5 REMARK 3 82 MET B QG 79 ALA B HA 4.5 REMARK 3 82 MET B QB 80 LEU B HA 6.0 REMARK 3 83 ILE B HB 80 LEU B HA 4.5 REMARK 3 83 ILE B QG2 80 LEU B HA 6.0 REMARK 3 84 TYR B CG 80 LEU B HA 5.5 REMARK 3 84 TYR B HB3 81 ALA B HA 6.0 REMARK 3 85 ASN B HA 88 LEU B QD1 6.0 REMARK 3 86 GLU B HA 88 LEU B HN 5.2 REMARK 3 86 GLU B HA 89 LYS B HN 4.2 REMARK 3 86 GLU B HA 89 LYS B QB 4.5 REMARK 3 86 GLU B HA 89 LYS B QE 4.0 REMARK 3 86 GLU B HA 89 LYS B QG 6.0 REMARK 3 87 ALA B QB 85 ASN B QD2 6.2 REMARK 3 87 ALA B HA 89 LYS B HN 4.5 REMARK 3 88 LEU B HG 85 ASN B HB2 5.2 REMARK 3 88 LEU B QD1 85 ASN B HN 6.0 REMARK 3 88 LEU B QD1 85 ASN B HB2 5.0 REMARK 3 88 LEU B QD1 85 ASN B HB3 5.0 REMARK 3 88 LEU B QD1 85 ASN B QD2 6.2 REMARK 3 88 LEU B QD2 85 ASN B HB3 5.0 REMARK 3 89 LYS B HA 86 GLU B HA 6.0 REMARK 3 9 ILE B QG2 74 ILE B QD1 6.0 REMARK 3 12 LEU B QD2 70 PHE B HZ 5.7 REMARK 3 12 LEU B HB3 74 ILE B QD1 6.0 REMARK 3 12 LEU B QD1 74 ILE B QD1 6.0 REMARK 3 12 LEU B QD2 74 ILE B HA 6.0 REMARK 3 12 LEU B QD2 74 ILE B HB 6.0 REMARK 3 12 LEU B QD2 74 ILE B QD1 4.5 REMARK 3 12 LEU B QD2 77 LEU B HB3 5.0 REMARK 3 13 ILE B HA 70 PHE B CZ 3.4 REMARK 3 13 ILE B HN 70 PHE B CZ 5.5 REMARK 3 13 ILE B QD1 70 PHE B CZ 4.7 REMARK 3 13 ILE B QG2 70 PHE B CZ 5.7 REMARK 3 13 ILE B QG1 74 ILE B QD1 5.5 REMARK 3 15 ILE B HB 37 LEU B QD2 5.0 REMARK 3 15 ILE B QG2 37 LEU B HA 5.7 REMARK 3 15 ILE B QG2 37 LEU B QD1 6.0 REMARK 3 15 ILE B QG2 37 LEU B QD2 5.5 REMARK 3 15 ILE B QD1 41 GLU B QG 5.7 REMARK 3 15 ILE B QG2 41 GLU B HA 6.0 REMARK 3 15 ILE B QG2 41 GLU B HN 5.7 REMARK 3 15 ILE B QG2 41 GLU B QB 6.0 REMARK 3 15 ILE B QG2 41 GLU B QG 5.7 REMARK 3 15 ILE B QG2 73 TYR B CZ 5.7 REMARK 3 15 ILE B QG2 77 LEU B HG 6.0 REMARK 3 15 ILE B QG2 77 LEU B QD1 6.2 REMARK 3 16 PHE B HZ 28 THR B HA 3.4 REMARK 3 16 PHE B HA 29 LEU B QD2 5.7 REMARK 3 16 PHE B HA 37 LEU B QD1 5.7 REMARK 3 16 PHE B HZ 69 ASN B HA 3.4 REMARK 3 16 PHE B CG 70 PHE B CG 4.5 REMARK 3 16 PHE B CG 70 PHE B CZ 4.5 REMARK 3 16 PHE B CZ 70 PHE B CG 4.5 REMARK 3 16 PHE B CZ 70 PHE B HA 4.2 REMARK 3 16 PHE B HZ 70 PHE B HN 4.2 REMARK 3 16 PHE B CG 73 TYR B CG 4.5 REMARK 3 16 PHE B CG 73 TYR B CZ 5.5 REMARK 3 16 PHE B CG 73 TYR B HH 6.0 REMARK 3 16 PHE B CZ 73 TYR B CG 6.0 REMARK 3 16 PHE B CZ 73 TYR B CZ 6.0 REMARK 3 16 PHE B CZ 73 TYR B QB 4.2 REMARK 3 27 HIS B HA 16 PHE B CZ 5.2 REMARK 3 27 HIS B HA 16 PHE B HZ 5.2 REMARK 3 28 THR B QG2 16 PHE B HZ 5.7 REMARK 3 28 THR B QG2 67 GLU B HA 5.7 REMARK 3 28 THR B HB 68 VAL B HN 4.5 REMARK 3 28 THR B QG2 68 VAL B HN 5.7 REMARK 3 28 THR B HA 69 ASN B HA 3.4 REMARK 3 28 THR B QG2 69 ASN B HN 5.7 REMARK 3 28 THR B QG2 69 ASN B QB 5.0 REMARK 3 28 THR B QG2 69 ASN B QD2 6.2 REMARK 3 28 THR B QG2 70 PHE B HN 5.7 REMARK 3 29 LEU B QD1 16 PHE B CG 5.7 REMARK 3 29 LEU B QD1 16 PHE B CZ 5.7 REMARK 3 29 LEU B QD2 16 PHE B CG 5.7 REMARK 3 29 LEU B QD2 16 PHE B CZ 5.7 REMARK 3 29 LEU B QD2 19 TYR B HB2 5.7 REMARK 3 29 LEU B QD2 19 TYR B HB3 5.7 REMARK 3 29 LEU B QD2 19 TYR B HN 5.7 REMARK 3 29 LEU B QD2 33 GLU B HN 6.0 REMARK 3 29 LEU B QD2 37 LEU B HB2 5.7 REMARK 3 29 LEU B QD1 68 VAL B QG2 6.2 REMARK 3 29 LEU B QD1 69 ASN B HN 5.7 REMARK 3 29 LEU B HN 68 VAL B HN 4.0 REMARK 3 30 SER B HA 67 GLU B QB 5.2 REMARK 3 30 SER B QB 67 GLU B HA 4.0 REMARK 3 30 SER B HA 68 VAL B HN 4.0 REMARK 3 30 SER B HA 68 VAL B QG1 6.0 REMARK 3 30 SER B HA 68 VAL B QG2 5.7 REMARK 3 31 LYS B HA 68 VAL B QG1 6.5 REMARK 3 31 LYS B HA 68 VAL B QG2 5.7 REMARK 3 34 LEU B QD1 63 ASN B QD2 6.2 REMARK 3 34 LEU B QD1 68 VAL B QG1 6.5 REMARK 3 34 LEU B QD1 68 VAL B QG2 6.5 REMARK 3 34 LEU B QD2 68 VAL B HB 5.7 REMARK 3 34 LEU B QD1 73 TYR B CG 5.7 REMARK 3 34 LEU B QD1 73 TYR B HA 5.7 REMARK 3 34 LEU B QD2 73 TYR B HA 5.7 REMARK 3 34 LEU B QD2 73 TYR B QB 6.0 REMARK 3 34 LEU B QD1 76 PHE B CZ 5.7 REMARK 3 34 LEU B QD2 76 PHE B CZ 5.7 REMARK 3 34 LEU B QD2 76 PHE B HZ 5.7 REMARK 3 35 LYS B HA 56 LEU B QD1 6.0 REMARK 3 35 LYS B HA 56 LEU B QD2 5.0 REMARK 3 35 LYS B HB3 56 LEU B QD2 5.7 REMARK 3 35 LYS B QD 56 LEU B QD2 5.7 REMARK 3 35 LYS B HN 76 PHE B HZ 6.0 REMARK 3 36 GLU B QG 19 TYR B CZ 5.2 REMARK 3 37 LEU B HA 19 TYR B CZ 5.2 REMARK 3 37 LEU B QD1 19 TYR B CG 5.7 REMARK 3 37 LEU B QD1 19 TYR B HA 6.0 REMARK 3 37 LEU B QD1 19 TYR B HB2 5.7 REMARK 3 37 LEU B QD1 19 TYR B HB3 5.7 REMARK 3 37 LEU B QD1 19 TYR B HN 5.7 REMARK 3 37 LEU B QD1 73 TYR B CG 5.7 REMARK 3 37 LEU B QD1 73 TYR B CZ 5.7 REMARK 3 37 LEU B QD1 73 TYR B HA 6.0 REMARK 3 38 ILE B QD1 52 GLU B HA 5.7 REMARK 3 38 ILE B QG1 55 LYS B QG 5.0 REMARK 3 38 ILE B QD1 76 PHE B CZ 5.7 REMARK 3 38 ILE B QD1 76 PHE B HZ 5.0 REMARK 3 38 ILE B QG2 76 PHE B HZ 5.7 REMARK 3 38 ILE B QG1 80 LEU B QD2 5.0 REMARK 3 40 LYS B QD 19 TYR B CG 5.2 REMARK 3 40 LYS B QD 19 TYR B CZ 5.2 REMARK 3 40 LYS B QE 19 TYR B CZ 5.2 REMARK 3 42 LEU B QD1 52 GLU B HA 5.7 REMARK 3 42 LEU B QB 80 LEU B QD2 6.0 REMARK 3 42 LEU B QD1 80 LEU B QB 5.0 REMARK 3 42 LEU B QD1 84 TYR B CZ 5.2 REMARK 3 42 LEU B QD2 84 TYR B CZ 5.7 REMARK 3 44 ILE B QD1 80 LEU B QD2 6.0 REMARK 3 44 ILE B QD1 84 TYR B QB 6.0 REMARK 3 44 ILE B QD1 80 LEU B QD2 4.0 REMARK 3 44 ILE B QD1 84 TYR B CG 5.2 REMARK 3 44 ILE B QD1 84 TYR B CZ 5.2 REMARK 3 44 ILE B QG2 84 TYR B CZ 6.5 REMARK 3 47 LYS B HB3 53 ILE B QD1 5.2 REMARK 3 49 GLN B QE2 86 GLU B HA 5.5 REMARK 3 51 ALA B HN 83 ILE B QD1 6.0 REMARK 3 52 GLU B QB 38 ILE B QD1 5.7 REMARK 3 52 GLU B HA 80 LEU B QB 4.5 REMARK 3 52 GLU B HA 80 LEU B QD2 5.2 REMARK 3 53 ILE B QD1 44 ILE B QG2 6.0 REMARK 3 53 ILE B HA 47 LYS B QD 4.0 REMARK 3 53 ILE B QD1 47 LYS B HA 5.2 REMARK 3 53 ILE B QD1 47 LYS B QG 4.5 REMARK 3 53 ILE B QG1 47 LYS B QG 4.0 REMARK 3 53 ILE B QD1 84 TYR B HB3 6.0 REMARK 3 53 ILE B QD1 84 TYR B CG 6.5 REMARK 3 53 ILE B QD1 84 TYR B CZ 6.0 REMARK 3 56 LEU B QD2 35 LYS B QE 6.0 REMARK 3 56 LEU B QD2 35 LYS B QG 5.0 REMARK 3 56 LEU B HG 76 PHE B HZ 5.2 REMARK 3 56 LEU B QD2 76 PHE B HZ 5.7 REMARK 3 57 MET B QE 35 LYS B QG 6.0 REMARK 3 67 GLU B HA 28 THR B HB 6.0 REMARK 3 67 GLU B QB 28 THR B HB 4.0 REMARK 3 67 GLU B QB 28 THR B QG2 4.5 REMARK 3 67 GLU B QG 28 THR B HB 4.5 REMARK 3 67 GLU B QG 28 THR B QG2 5.7 REMARK 3 67 GLU B HA 30 SER B HA 3.4 REMARK 3 67 GLU B QG 30 SER B HA 5.2 REMARK 3 68 VAL B QG2 16 PHE B CZ 5.7 REMARK 3 68 VAL B QG2 28 THR B HA 5.7 REMARK 3 68 VAL B HN 29 LEU B HN 4.2 REMARK 3 68 VAL B QG1 29 LEU B HN 5.7 REMARK 3 68 VAL B QG2 29 LEU B HN 5.7 REMARK 3 68 VAL B QG2 29 LEU B QB 5.7 REMARK 3 68 VAL B QG2 31 LYS B HN 6.0 REMARK 3 68 VAL B QG2 34 LEU B HB2 6.0 REMARK 3 68 VAL B QG2 34 LEU B HG 5.0 REMARK 3 68 VAL B QG2 34 LEU B QD2 5.5 REMARK 3 68 VAL B QG1 62 ARG B QG 5.7 REMARK 3 69 ASN B HA 28 THR B HB 6.0 REMARK 3 69 ASN B HA 28 THR B QG2 5.0 REMARK 3 69 ASN B HA 29 LEU B HN 4.0 REMARK 3 73 TYR B HH 12 LEU B HA 3.4 REMARK 3 74 ILE B QD1 9 ILE B QG1 6.2 REMARK 3 74 ILE B QD1 12 LEU B HA 5.7 REMARK 3 74 ILE B QD1 12 LEU B HB2 5.7 REMARK 3 74 ILE B QD1 12 LEU B HG 5.7 REMARK 3 74 ILE B QG2 12 LEU B HB3 5.7 REMARK 3 74 ILE B QD1 13 ILE B HN 5.7 REMARK 3 74 ILE B QD1 16 ILE B HN 6.0 REMARK 3 75 THR B HB 62 ARG B QD 5.2 REMARK 3 75 THR B QG2 62 ARG B QD 5.7 REMARK 3 76 PHE B QB 34 LEU B QD2 6.5 REMARK 3 76 PHE B CZ 55 LYS B HA 5.5 REMARK 3 76 PHE B HZ 59 ASP B HA 4.2 REMARK 3 76 PHE B CZ 63 ASN B QD2 6.0 REMARK 3 77 LEU B QD1 12 LEU B HA 5.2 REMARK 3 77 LEU B QD1 16 PHE B HN 6.0 REMARK 3 77 LEU B QD2 42 LEU B HG 5.2 REMARK 3 77 LEU B QD2 55 LYS B QG 5.2 REMARK 3 80 LEU B QD1 38 ILE B HB 6.0 REMARK 3 80 LEU B QD2 52 GLU B QG 5.2 REMARK 3 81 ALA B HA 88 LEU B QD1 5.2 REMARK 3 81 ALA B QB 88 LEU B QD1 6.2 REMARK 3 82 MET B QB 89 LYS B QE 5.2 REMARK 3 82 MET B QG 89 LYS B QG 5.2 REMARK 3 83 ILE B QD1 50 ASP B QB 5.2 REMARK 3 83 ILE B QG2 50 ASP B QB 5.7 REMARK 3 83 ILE B HB 51 ALA B QB 5.5 REMARK 3 83 ILE B QD1 52 GLU B HA 6.0 REMARK 3 83 ILE B QG2 52 GLU B HA 7.0 REMARK 3 83 ILE B QD1 55 LYS B HN 5.7 REMARK 3 83 ILE B QG1 89 LYS B QD 5.0 REMARK 3 88 LEU B QD2 81 ALA B QB 6.2 REMARK 3 88 LEU B HB2 82 MET B HA 6.0 REMARK 3 88 LEU B QD1 82 MET B HA 5.0 REMARK 3 88 LEU B QD1 82 MET B HN 6.0 REMARK 3 88 LEU B QD1 82 MET B QE 6.2 REMARK 3 88 LEU B QD1 82 MET B QG 5.7 REMARK 3 88 LEU B QD2 82 MET B HA 5.7 REMARK 3 88 LEU B QD2 82 MET B QE 6.2 REMARK 3 88 LEU B QD2 82 MET B QG 5.7 REMARK 3 89 LYS B HA 82 MET B QE 6.0 REMARK 3 89 LYS B HA 82 MET B QG 5.2 REMARK 3 89 LYS B QB 82 MET B QG 4.5 REMARK 3 89 LYS B QD 82 MET B QG 4.5 REMARK 3 1 MET A QE 43 THR B HN 6.5 REMARK 3 1 MET A QB 44 ILE B QD1 6.5 REMARK 3 8 ALA A QB 8 ALA B HA 6.0 REMARK 3 11 LEU A HB2 11 LEU B QD1 6.0 REMARK 3 12 LEU A HB2 12 LEU B QD1 6.0 REMARK 3 12 LEU A HB2 12 LEU B QD2 6.0 REMARK 3 12 LEU A HG 12 LEU B QD2 6.0 REMARK 3 71 GLN A HA 71 GLN B QE2 6.0 REMARK 3 71 GLN A QG 71 GLN B QE2 6.0 REMARK 3 74 ILE A HA 74 ILE B QG2 6.0 REMARK 3 74 ILE A HB 74 ILE B QG2 6.0 REMARK 3 74 ILE A QD1 74 ILE B QG1 6.0 REMARK 3 74 ILE A QG1 74 ILE B QG2 6.0 REMARK 3 74 ILE A QG2 74 ILE B HN 6.0 REMARK 3 74 ILE A QG2 74 ILE B QD1 6.0 REMARK 3 8 ALA A QB 9 ILE B HA 6.0 REMARK 3 12 LEU A QD2 13 ILE B HN 6.0 REMARK 3 7 GLN A HB3 11 LEU B QD2 6.0 REMARK 3 7 GLN A QG 11 LEU B QD1 6.0 REMARK 3 8 ALA A HA 11 LEU B QD1 6.0 REMARK 3 8 ALA A QB 11 LEU B HB2 4.0 REMARK 3 8 ALA A QB 11 LEU B HB3 4.0 REMARK 3 8 ALA A QB 11 LEU B HN 4.5 REMARK 3 8 ALA A QB 11 LEU B QD1 4.5 REMARK 3 8 ALA A QB 11 LEU B QD2 6.0 REMARK 3 8 ALA A QB 12 LEU B HB2 5.2 REMARK 3 8 ALA A QB 12 LEU B HN 4.5 REMARK 3 8 ALA A QB 12 LEU B QD2 4.5 REMARK 3 9 ILE A HA 12 LEU B HG 6.0 REMARK 3 9 ILE A HA 12 LEU B QD1 4.5 REMARK 3 9 ILE A HA 12 LEU B QD2 6.0 REMARK 3 9 ILE A HB 12 LEU B QD1 6.0 REMARK 3 11 LEU A QD1 7 GLN B HB3 6.0 REMARK 3 11 LEU A HA 8 ALA B QB 6.0 REMARK 3 11 LEU A HB3 8 ALA B HA 4.5 REMARK 3 11 LEU A HG 8 ALA B QB 6.0 REMARK 3 11 LEU A QD1 8 ALA B HN 6.0 REMARK 3 11 LEU A QD2 8 ALA B HA 4.5 REMARK 3 11 LEU A QD2 8 ALA B HN 4.5 REMARK 3 12 LEU A HG 8 ALA B QB 6.0 REMARK 3 12 LEU A QD1 8 ALA B HA 6.0 REMARK 3 12 LEU A QD1 8 ALA B QB 3.5 REMARK 3 12 LEU A HG 9 ILE B QG1 4.5 REMARK 3 12 LEU A QD1 9 ILE B HN 5.2 REMARK 3 12 LEU A QD1 9 ILE B QG1 6.0 REMARK 3 12 LEU A QD2 9 ILE B HB 6.0 REMARK 3 12 LEU A QD2 9 ILE B HN 6.0 REMARK 3 12 LEU A QD2 9 ILE B QG1 4.5 REMARK 3 71 GLN A QG 74 ILE B HB 6.0 REMARK 3 71 GLN A QG 74 ILE B QG2 6.0 REMARK 3 71 GLN A HA 75 THR B QG2 6.0 REMARK 3 71 GLN A QG 75 THR B HA 4.5 REMARK 3 71 GLN A QG 75 THR B HB 6.0 REMARK 3 71 GLN A QG 78 GLY B QA 6.0 REMARK 3 74 ILE A HB 71 GLN B QE2 4.5 REMARK 3 74 ILE A QG2 71 GLN B HA 6.0 REMARK 3 74 ILE A QG2 71 GLN B QB 6.0 REMARK 3 74 ILE A QG2 71 GLN B QE2 5.2 REMARK 3 75 THR A QG2 71 GLN B QE2 5.2 REMARK 3 75 THR A QG2 71 GLN B QG 5.2 REMARK 3 3 SER A QB 41 GLU B HA 4.5 REMARK 3 4 PRO A HA 11 LEU B QD2 5.2 REMARK 3 4 PRO A HB3 11 LEU B QD1 5.2 REMARK 3 4 PRO A HB2 11 LEU B QD1 5.2 REMARK 3 4 PRO A HB3 15 ILE B QG1 6.0 REMARK 3 4 PRO A QG 11 LEU B QD2 5.2 REMARK 3 4 PRO A QG 15 ILE B QD1 6.0 REMARK 3 5 LEU A HA 11 LEU B QD2 4.0 REMARK 3 5 LEU A HA 12 LEU B QD1 6.0 REMARK 3 5 LEU A HB3 12 LEU B QD1 6.0 REMARK 3 5 LEU A HB2 12 LEU B QD1 6.0 REMARK 3 5 LEU A QD2 12 LEU B HA 4.5 REMARK 3 5 LEU A QD2 12 LEU B QD1 6.0 REMARK 3 5 LEU A HA 15 ILE B QG1 6.0 REMARK 3 5 LEU A HB2 15 ILE B QD1 6.0 REMARK 3 5 LEU A HB3 15 ILE B QD1 6.0 REMARK 3 5 LEU A HG 15 ILE B QG2 6.0 REMARK 3 5 LEU A QD1 15 ILE B HB 6.0 REMARK 3 5 LEU A QD2 15 ILE B HB 5.2 REMARK 3 5 LEU A QD2 15 ILE B QG1 6.0 REMARK 3 5 LEU A QD2 15 ILE B QG2 5.2 REMARK 3 5 LEU A QD1 41 GLU B HA 6.0 REMARK 3 5 LEU A HB3 42 LEU B QD2 6.0 REMARK 3 5 LEU A QD1 42 LEU B HA 5.2 REMARK 3 5 LEU A QD2 42 LEU B HG 4.5 REMARK 3 5 LEU A QD1 77 LEU B QD1 4.5 REMARK 3 5 LEU A QD2 77 LEU B QD1 6.0 REMARK 3 6 ASP A HA 42 LEU B QD1 4.0 REMARK 3 9 ILE A QG1 42 LEU B QD2 4.0 REMARK 3 9 ILE A HB 77 LEU B QD1 5.2 REMARK 3 9 ILE A QD1 77 LEU B HA 5.2 REMARK 3 9 ILE A QD1 77 LEU B HN 6.0 REMARK 3 9 ILE A QD1 77 LEU B QD1 4.5 REMARK 3 9 ILE A HB 81 ALA B QB 6.0 REMARK 3 9 ILE A QD1 81 ALA B HN 5.2 REMARK 3 9 ILE A QG1 81 ALA B QB 6.0 REMARK 3 9 ILE A QG2 81 ALA B HA 6.0 REMARK 3 9 ILE A QG2 81 ALA B HN 5.2 REMARK 3 9 ILE A QG2 81 ALA B QB 4.5 REMARK 3 9 ILE A QG2 84 TYR B CZ 5.2 REMARK 3 9 ILE A HB 85 ASN B QD2 5.2 REMARK 3 9 ILE A QG2 85 ASN B QD2 5.2 REMARK 3 9 ILE A QG2 88 LEU B QD1 5.2 REMARK 3 11 LEU A QD1 4 PRO B HA 4.5 REMARK 3 11 LEU A QD2 4 PRO B HB3 4.5 REMARK 3 12 LEU A HA 5 LEU B QD1 5.2 REMARK 3 12 LEU A QD2 70 PHE B HZ 6.0 REMARK 3 12 LEU A QD2 74 ILE B QD1 6.0 REMARK 3 12 LEU A QD2 74 ILE B QG2 6.0 REMARK 3 13 ILE A QD1 81 ALA B QB 4.5 REMARK 3 13 ILE A QD1 85 ASN B HB2 5.2 REMARK 3 13 ILE A QD1 85 ASN B HB3 6.0 REMARK 3 13 ILE A QD1 85 ASN B QD2 4.5 REMARK 3 13 ILE A QG2 85 ASN B QD2 5.2 REMARK 3 13 ILE A QG2 87 ALA B QB 6.0 REMARK 3 13 ILE A QG2 88 LEU B HA 6.0 REMARK 3 13 ILE A QD1 88 LEU B HG 6.0 REMARK 3 13 ILE A QD1 88 LEU B QD1 4.5 REMARK 3 13 ILE A QG2 88 LEU B HG 6.0 REMARK 3 13 ILE A QG2 88 LEU B HN 5.2 REMARK 3 13 ILE A QG2 88 LEU B QD1 5.2 REMARK 3 13 ILE A QG2 88 LEU B QD2 6.0 REMARK 3 15 ILE A QD1 4 PRO B HB3 5.2 REMARK 3 15 ILE A QD1 4 PRO B HB2 4.5 REMARK 3 15 ILE A QD1 4 PRO B QD 5.2 REMARK 3 15 ILE A HB 5 LEU B HA 6.0 REMARK 3 15 ILE A QD1 5 LEU B HA 4.5 REMARK 3 15 ILE A QD1 5 LEU B HN 5.2 REMARK 3 15 ILE A QD1 5 LEU B HB3 4.5 REMARK 3 15 ILE A QG2 5 LEU B HA 6.0 REMARK 3 15 ILE A QG2 5 LEU B HB3 4.5 REMARK 3 15 ILE A QG2 5 LEU B QD1 6.0 REMARK 3 15 ILE A QD1 8 ALA B QB 6.0 REMARK 3 37 LEU A HG 5 LEU B QD1 6.0 REMARK 3 38 ILE A HA 5 LEU B QD1 6.0 REMARK 3 41 GLU A QB 5 LEU B QD1 6.0 REMARK 3 41 GLU A QB 5 LEU B QD2 5.2 REMARK 3 42 LEU A HG 5 LEU B QD1 6.0 REMARK 3 42 LEU A QB 5 LEU B QD1 6.0 REMARK 3 42 LEU A QD1 5 LEU B HG 6.0 REMARK 3 42 LEU A QD1 5 LEU B HB2 5.2 REMARK 3 42 LEU A QD2 6 ASP B HA 4.0 REMARK 3 42 LEU A HG 9 ILE B QD1 6.0 REMARK 3 69 ASN A QB 82 MET B QE 6.0 REMARK 3 70 PHE A CZ 78 GLY B QA 6.0 REMARK 3 70 PHE A CZ 81 ALA B QB 6.0 REMARK 3 70 PHE A HZ 81 ALA B QB 6.0 REMARK 3 70 PHE A CZ 88 LEU B QD2 6.0 REMARK 3 70 PHE A HB2 88 LEU B QD1 6.0 REMARK 3 70 PHE A HZ 88 LEU B QD1 6.0 REMARK 3 73 TYR A CZ 5 LEU B QD2 6.0 REMARK 3 74 ILE A QG2 12 LEU B HB3 6.0 REMARK 3 77 LEU A HB2 9 ILE B QD1 6.0 REMARK 3 77 LEU A HB3 9 ILE B QD1 6.0 REMARK 3 77 LEU A QD1 9 ILE B QG1 5.2 REMARK 3 77 LEU A QD2 9 ILE B QG1 6.0 REMARK 3 78 GLY A QA 9 ILE B QG2 6.0 REMARK 3 78 GLY A QA 13 ILE B QD1 6.0 REMARK 3 78 GLY A QA 71 GLN B HA 4.5 REMARK 3 79 ALA A HA 71 GLN B QB 6.0 REMARK 3 79 ALA A QB 71 GLN B QE2 5.0 REMARK 3 81 ALA A HA 9 ILE B QD1 5.2 REMARK 3 81 ALA A QB 9 ILE B QD1 5.2 REMARK 3 81 ALA A HA 13 ILE B QD1 6.0 REMARK 3 81 ALA A QB 13 ILE B QG1 6.0 REMARK 3 81 ALA A QB 70 PHE B CG 5.2 REMARK 3 81 ALA A QB 74 ILE B QD1 6.5 REMARK 3 82 MET A QE 69 ASN B QD2 4.5 REMARK 3 82 MET A QE 70 PHE B HN 4.5 REMARK 3 82 MET A QE 71 GLN B HN 4.5 REMARK 3 84 TYR A CZ 9 ILE B QD1 6.0 REMARK 3 85 ASN A HB2 13 ILE B QG2 6.0 REMARK 3 88 LEU A HG 13 ILE B QG1 4.5 REMARK 3 88 LEU A QD1 13 ILE B HA 5.2 REMARK 3 88 LEU A QD1 13 ILE B QG1 4.5 REMARK 3 88 LEU A QD2 13 ILE B HA 5.2 REMARK 3 88 LEU A QD2 13 ILE B QD1 6.0 REMARK 3 88 LEU A QD2 13 ILE B QG1 5.2 REMARK 3 88 LEU A QD2 16 PHE B CG 5.2 REMARK 3 88 LEU A QD2 16 PHE B CZ 5.2 REMARK 3 88 LEU A QD2 16 PHE B HB2 6.0 REMARK 3 88 LEU A QD2 17 HIS B QB 5.2 REMARK 3 88 LEU A QD2 26 LYS B QB 6.0 REMARK 3 88 LEU A QD2 27 HIS B QB 6.0 REMARK 3 88 LEU A QD1 27 HIS B HD2 6.0 REMARK 3 88 LEU A QD1 70 PHE B CG 5.2 REMARK 3 88 LEU A QD1 70 PHE B CZ 5.2 REMARK 3 88 LEU A QD2 70 PHE B CG 5.2 REMARK 3 88 LEU A QD2 70 PHE B HA 5.2 REMARK 3 88 LEU A QD2 70 PHE B HB2 5.2 REMARK 3 88 LEU A QD2 70 PHE B HB3 5.2 REMARK 3 88 LEU A QD2 70 PHE B HN 5.2 REMARK 3 90 GLY A QA 27 HIS B HD2 6.0 REMARK 3 1 MET B QE 43 THR A HN 6.5 REMARK 3 1 MET B QB 44 ILE A QD1 6.5 REMARK 3 8 ALA B QB 8 ALA A HA 6.0 REMARK 3 11 LEU B HB2 11 LEU A QD1 6.0 REMARK 3 12 LEU B HB2 12 LEU A QD1 6.0 REMARK 3 12 LEU B HB2 12 LEU A QD2 6.0 REMARK 3 12 LEU B HG 12 LEU A QD2 6.0 REMARK 3 71 GLN B HA 71 GLN A QE2 6.0 REMARK 3 71 GLN B QG 71 GLN A QE2 6.0 REMARK 3 74 ILE B HA 74 ILE A QG2 6.0 REMARK 3 74 ILE B HB 74 ILE A QG2 6.0 REMARK 3 74 ILE B QD1 74 ILE A QG1 6.0 REMARK 3 74 ILE B QG1 74 ILE A QG2 6.0 REMARK 3 74 ILE B QG2 74 ILE A HN 6.0 REMARK 3 74 ILE B QG2 74 ILE A QD1 6.0 REMARK 3 8 ALA B QB 9 ILE A HA 6.0 REMARK 3 12 LEU B QD2 13 ILE A HN 6.0 REMARK 3 7 GLN B HB3 11 LEU A QD2 6.0 REMARK 3 7 GLN B QG 11 LEU A QD1 6.0 REMARK 3 8 ALA B HA 11 LEU A QD1 6.0 REMARK 3 8 ALA B QB 11 LEU A HB2 4.0 REMARK 3 8 ALA B QB 11 LEU A HB3 4.0 REMARK 3 8 ALA B QB 11 LEU A HN 4.5 REMARK 3 8 ALA B QB 11 LEU A QD1 4.5 REMARK 3 8 ALA B QB 11 LEU A QD2 6.0 REMARK 3 8 ALA B QB 12 LEU A HB2 5.2 REMARK 3 8 ALA B QB 12 LEU A HN 4.5 REMARK 3 8 ALA B QB 12 LEU A QD2 4.5 REMARK 3 9 ILE B HA 12 LEU A HG 6.0 REMARK 3 9 ILE B HA 12 LEU A QD1 4.5 REMARK 3 9 ILE B HA 12 LEU A QD2 6.0 REMARK 3 9 ILE B HB 12 LEU A QD1 6.0 REMARK 3 11 LEU B QD1 7 GLN A HB3 6.0 REMARK 3 11 LEU B HA 8 ALA A QB 6.0 REMARK 3 11 LEU B HB3 8 ALA A HA 4.5 REMARK 3 11 LEU B HG 8 ALA A QB 6.0 REMARK 3 11 LEU B QD1 8 ALA A HN 6.0 REMARK 3 11 LEU B QD2 8 ALA A HA 4.5 REMARK 3 11 LEU B QD2 8 ALA A HN 4.5 REMARK 3 12 LEU B HG 8 ALA A QB 6.0 REMARK 3 12 LEU B QD1 8 ALA A HA 6.0 REMARK 3 12 LEU B QD1 8 ALA A QB 3.5 REMARK 3 12 LEU B HG 9 ILE A QG1 4.5 REMARK 3 12 LEU B QD1 9 ILE A HN 5.2 REMARK 3 12 LEU B QD1 9 ILE A QG1 6.0 REMARK 3 12 LEU B QD2 9 ILE A HB 6.0 REMARK 3 12 LEU B QD2 9 ILE A HN 6.0 REMARK 3 12 LEU B QD2 9 ILE A QG1 4.5 REMARK 3 71 GLN B QG 74 ILE A HB 6.0 REMARK 3 71 GLN B QG 74 ILE A QG2 6.0 REMARK 3 71 GLN B HA 75 THR A QG2 6.0 REMARK 3 71 GLN B QG 75 THR A HA 4.5 REMARK 3 71 GLN B QG 75 THR A HB 6.0 REMARK 3 71 GLN B QG 78 GLY A QA 6.0 REMARK 3 74 ILE B HB 71 GLN A QE2 4.5 REMARK 3 74 ILE B QG2 71 GLN A HA 6.0 REMARK 3 74 ILE B QG2 71 GLN A QB 6.0 REMARK 3 74 ILE B QG2 71 GLN A QE2 5.2 REMARK 3 75 THR B QG2 71 GLN A QE2 5.2 REMARK 3 75 THR B QG2 71 GLN A QG 5.2 REMARK 3 3 SER B QB 41 GLU A HA 4.5 REMARK 3 4 PRO B HA 11 LEU A QD2 5.2 REMARK 3 4 PRO B HB3 11 LEU A QD1 5.2 REMARK 3 4 PRO B HB2 11 LEU A QD1 5.2 REMARK 3 4 PRO B HB3 15 ILE A QG1 6.0 REMARK 3 4 PRO B QG 11 LEU A QD2 5.2 REMARK 3 4 PRO B QG 15 ILE A QD1 6.0 REMARK 3 5 LEU B HA 11 LEU A QD2 4.0 REMARK 3 5 LEU B HA 12 LEU A QD1 6.0 REMARK 3 5 LEU B HB3 12 LEU A QD1 6.0 REMARK 3 5 LEU B HB2 12 LEU A QD1 6.0 REMARK 3 5 LEU B QD2 12 LEU A HA 4.5 REMARK 3 5 LEU B QD2 12 LEU A QD1 6.0 REMARK 3 5 LEU B HA 15 ILE A QG1 6.0 REMARK 3 5 LEU B HB2 15 ILE A QD1 6.0 REMARK 3 5 LEU B HB3 15 ILE A QD1 6.0 REMARK 3 5 LEU B HG 15 ILE A QG2 6.0 REMARK 3 5 LEU B QD1 15 ILE A HB 6.0 REMARK 3 5 LEU B QD2 15 ILE A HB 5.2 REMARK 3 5 LEU B QD2 15 ILE A QG1 6.0 REMARK 3 5 LEU B QD2 15 ILE A QG2 5.2 REMARK 3 5 LEU B QD1 41 GLU A HA 6.0 REMARK 3 5 LEU B HB3 42 LEU A QD2 6.0 REMARK 3 5 LEU B QD1 42 LEU A HA 5.2 REMARK 3 5 LEU B QD2 42 LEU A HG 4.5 REMARK 3 5 LEU B QD1 77 LEU A QD1 4.5 REMARK 3 5 LEU B QD2 77 LEU A QD1 6.0 REMARK 3 6 ASP B HA 42 LEU A QD1 4.0 REMARK 3 9 ILE B QG1 42 LEU A QD2 4.0 REMARK 3 9 ILE B HB 77 LEU A QD1 5.2 REMARK 3 9 ILE B QD1 77 LEU A HA 5.2 REMARK 3 9 ILE B QD1 77 LEU A HN 6.0 REMARK 3 9 ILE B QD1 77 LEU A QD1 4.5 REMARK 3 9 ILE B HB 81 ALA A QB 6.0 REMARK 3 9 ILE B QD1 81 ALA A HN 5.2 REMARK 3 9 ILE B QG1 81 ALA A QB 6.0 REMARK 3 9 ILE B QG2 81 ALA A HA 6.0 REMARK 3 9 ILE B QG2 81 ALA A HN 5.2 REMARK 3 9 ILE B QG2 81 ALA A QB 4.5 REMARK 3 9 ILE B QG2 84 TYR A CZ 5.2 REMARK 3 9 ILE B HB 85 ASN A QD2 5.2 REMARK 3 9 ILE B QG2 85 ASN A QD2 5.2 REMARK 3 9 ILE B QG2 88 LEU A QD1 5.2 REMARK 3 11 LEU B QD1 4 PRO A HA 4.5 REMARK 3 11 LEU B QD2 4 PRO A HB3 4.5 REMARK 3 12 LEU B HA 5 LEU A QD1 5.2 REMARK 3 12 LEU B QD2 70 PHE A HZ 6.0 REMARK 3 12 LEU B QD2 74 ILE A QD1 6.0 REMARK 3 12 LEU B QD2 74 ILE A QG2 6.0 REMARK 3 13 ILE B QD1 81 ALA A QB 4.5 REMARK 3 13 ILE B QD1 85 ASN A HB2 5.2 REMARK 3 13 ILE B QD1 85 ASN A HB3 6.0 REMARK 3 13 ILE B QD1 85 ASN A QD2 4.5 REMARK 3 13 ILE B QG2 85 ASN A QD2 5.2 REMARK 3 13 ILE B QG2 87 ALA A QB 6.0 REMARK 3 13 ILE B QG2 88 LEU A HA 6.0 REMARK 3 13 ILE B QD1 88 LEU A HG 6.0 REMARK 3 13 ILE B QD1 88 LEU A QD1 4.5 REMARK 3 13 ILE B QG2 88 LEU A HG 6.0 REMARK 3 13 ILE B QG2 88 LEU A HN 5.2 REMARK 3 13 ILE B QG2 88 LEU A QD1 5.2 REMARK 3 13 ILE B QG2 88 LEU A QD2 6.0 REMARK 3 15 ILE B QD1 4 PRO A HB3 5.2 REMARK 3 15 ILE B QD1 4 PRO A HB2 4.5 REMARK 3 15 ILE B QD1 4 PRO A QD 5.2 REMARK 3 15 ILE B HB 5 LEU A HA 6.0 REMARK 3 15 ILE B QD1 5 LEU A HA 4.5 REMARK 3 15 ILE B QD1 5 LEU A HN 5.2 REMARK 3 15 ILE B QD1 5 LEU A HB3 4.5 REMARK 3 15 ILE B QG2 5 LEU A HA 6.0 REMARK 3 15 ILE B QG2 5 LEU A HB3 4.5 REMARK 3 15 ILE B QG2 5 LEU A QD1 6.0 REMARK 3 15 ILE B QD1 8 ALA A QB 6.0 REMARK 3 37 LEU B HG 5 LEU A QD1 6.0 REMARK 3 38 ILE B HA 5 LEU A QD1 6.0 REMARK 3 41 GLU B QB 5 LEU A QD1 6.0 REMARK 3 41 GLU B QB 5 LEU A QD2 5.2 REMARK 3 42 LEU B HG 5 LEU A QD1 6.0 REMARK 3 42 LEU B QB 5 LEU A QD1 6.0 REMARK 3 42 LEU B QD1 5 LEU A HG 6.0 REMARK 3 42 LEU B QD1 5 LEU A HB2 5.2 REMARK 3 42 LEU B QD2 6 ASP A HA 4.0 REMARK 3 42 LEU B HG 9 ILE A QD1 6.0 REMARK 3 69 ASN B QB 82 MET A QE 6.0 REMARK 3 70 PHE B CZ 78 GLY A QA 6.0 REMARK 3 70 PHE B CZ 81 ALA A QB 6.0 REMARK 3 70 PHE B HZ 81 ALA A QB 6.0 REMARK 3 70 PHE B CZ 88 LEU A QD2 6.0 REMARK 3 70 PHE B HB2 88 LEU A QD1 6.0 REMARK 3 70 PHE B HZ 88 LEU A QD1 6.0 REMARK 3 73 TYR B CZ 5 LEU A QD2 6.0 REMARK 3 74 ILE B QG2 12 LEU A HB3 6.0 REMARK 3 77 LEU B HB2 9 ILE A QD1 6.0 REMARK 3 77 LEU B HB3 9 ILE A QD1 6.0 REMARK 3 77 LEU B QD1 9 ILE A QG1 5.2 REMARK 3 77 LEU B QD2 9 ILE A QG1 6.0 REMARK 3 78 GLY B QA 9 ILE A QG2 6.0 REMARK 3 78 GLY B QA 13 ILE A QD1 6.0 REMARK 3 78 GLY B QA 71 GLN A HA 4.5 REMARK 3 79 ALA B HA 71 GLN A QB 6.0 REMARK 3 79 ALA B QB 71 GLN A QE2 5.0 REMARK 3 81 ALA B HA 9 ILE A QD1 5.2 REMARK 3 81 ALA B QB 9 ILE A QD1 5.2 REMARK 3 81 ALA B HA 13 ILE A QD1 6.0 REMARK 3 81 ALA B QB 13 ILE A QG1 6.0 REMARK 3 81 ALA B QB 70 PHE A CG 5.2 REMARK 3 81 ALA B QB 74 ILE A QD1 6.5 REMARK 3 82 MET B QE 69 ASN A QD2 4.5 REMARK 3 82 MET B QE 70 PHE A HN 4.5 REMARK 3 82 MET B QE 71 GLN A HN 4.5 REMARK 3 84 TYR B CZ 9 ILE A QD1 6.0 REMARK 3 85 ASN B HB2 13 ILE A QG2 6.0 REMARK 3 88 LEU B HG 13 ILE A QG1 4.5 REMARK 3 88 LEU B QD1 13 ILE A HA 5.2 REMARK 3 88 LEU B QD1 13 ILE A QG1 4.5 REMARK 3 88 LEU B QD2 13 ILE A HA 5.2 REMARK 3 88 LEU B QD2 13 ILE A QD1 6.0 REMARK 3 88 LEU B QD2 13 ILE A QG1 5.2 REMARK 3 88 LEU B QD2 16 PHE A CG 5.2 REMARK 3 88 LEU B QD2 16 PHE A CZ 5.2 REMARK 3 88 LEU B QD2 16 PHE A HB2 6.0 REMARK 3 88 LEU B QD2 17 HIS A QB 5.2 REMARK 3 88 LEU B QD2 26 LYS A QB 6.0 REMARK 3 88 LEU B QD2 27 HIS A QB 6.0 REMARK 3 88 LEU B QD1 27 HIS A HD2 6.0 REMARK 3 88 LEU B QD1 70 PHE A CG 5.2 REMARK 3 88 LEU B QD1 70 PHE A CZ 5.2 REMARK 3 88 LEU B QD2 70 PHE A CG 5.2 REMARK 3 88 LEU B QD2 70 PHE A HA 5.2 REMARK 3 88 LEU B QD2 70 PHE A HB2 5.2 REMARK 3 88 LEU B QD2 70 PHE A HB3 5.2 REMARK 3 88 LEU B QD2 70 PHE A HN 5.2 REMARK 3 90 GLY B QA 27 HIS A HD2 6.0
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