USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1028 hydrogens (0 hets) HEADER DNA-BINDING 24-NOV-94 1PES TITLE NMR SOLUTION STRUCTURE OF THE TETRAMERIC MINIMUM TITLE 2 TRANSFORMING DOMAIN OF P53 COMPND MOL_ID: 1; COMPND 2 MOLECULE: TUMOR SUPPRESSOR P53; COMPND 3 CHAIN: A, B, C, D; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: HUMAN; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: PET; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PET; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET 19B GENE: HUMAN KEYWDS DNA-BINDING EXPDTA SOLUTION NMR AUTHOR W.LEE,T.S.HARVEY,Y.YIN,P.YAU,D.LITCHFIELD,C.H.ARROWSMITH REVDAT 3 24-FEB-09 1PES 1 VERSN REVDAT 2 01-APR-03 1PES 1 JRNL REVDAT 1 07-FEB-95 1PES 0 JRNL AUTH W.LEE,T.S.HARVEY,Y.YIN,P.YAU,D.LITCHFIELD, JRNL AUTH 2 C.H.ARROWSMITH JRNL TITL SOLUTION STRUCTURE OF THE TETRAMERIC MINIMUM JRNL TITL 2 TRANSFORMING DOMAIN OF P53. JRNL REF NAT.STRUCT.BIOL. V. 1 877 1994 JRNL REFN ISSN 1072-8368 JRNL PMID 7773777 JRNL DOI 10.1038/NSB1294-877 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1PES COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : NULL REMARK 210 PH : NULL REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : NULL REMARK 210 SPECTROMETER MODEL : NULL REMARK 210 SPECTROMETER MANUFACTURER : NULL REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG A 335 -52.03 -166.83 REMARK 500 ARG B 335 -52.25 -166.82 REMARK 500 ARG C 335 -52.27 -166.82 REMARK 500 ARG D 335 -52.29 -166.77 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 333 0.28 SIDE_CHAIN REMARK 500 ARG A 335 0.32 SIDE_CHAIN REMARK 500 ARG A 337 0.30 SIDE_CHAIN REMARK 500 ARG A 342 0.32 SIDE_CHAIN REMARK 500 ARG B 333 0.28 SIDE_CHAIN REMARK 500 ARG B 335 0.32 SIDE_CHAIN REMARK 500 ARG B 337 0.30 SIDE_CHAIN REMARK 500 ARG B 342 0.32 SIDE_CHAIN REMARK 500 ARG C 333 0.28 SIDE_CHAIN REMARK 500 ARG C 335 0.32 SIDE_CHAIN REMARK 500 ARG C 337 0.30 SIDE_CHAIN REMARK 500 ARG C 342 0.32 SIDE_CHAIN REMARK 500 ARG D 333 0.28 SIDE_CHAIN REMARK 500 ARG D 335 0.32 SIDE_CHAIN REMARK 500 ARG D 337 0.30 SIDE_CHAIN REMARK 500 ARG D 342 0.32 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1PET RELATED DB: PDB DBREF 1PES A 325 355 UNP P04637 P53_HUMAN 325 355 DBREF 1PES B 325 355 UNP P04637 P53_HUMAN 325 355 DBREF 1PES C 325 355 UNP P04637 P53_HUMAN 325 355 DBREF 1PES D 325 355 UNP P04637 P53_HUMAN 325 355 SEQRES 1 A 31 GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG SEQRES 2 A 31 PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU SEQRES 3 A 31 LYS ASP ALA GLN ALA SEQRES 1 B 31 GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG SEQRES 2 B 31 PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU SEQRES 3 B 31 LYS ASP ALA GLN ALA SEQRES 1 C 31 GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG SEQRES 2 C 31 PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU SEQRES 3 C 31 LYS ASP ALA GLN ALA SEQRES 1 D 31 GLY GLU TYR PHE THR LEU GLN ILE ARG GLY ARG GLU ARG SEQRES 2 D 31 PHE GLU MET PHE ARG GLU LEU ASN GLU ALA LEU GLU LEU SEQRES 3 D 31 LYS ASP ALA GLN ALA HELIX 1 1 GLU A 336 ALA A 353 1 18 HELIX 2 2 GLU B 336 ALA B 353 1 18 HELIX 3 3 GLU C 336 ALA C 353 1 18 HELIX 4 4 GLU D 336 ALA D 353 1 18 SHEET 1 A 2 GLU A 326 PHE A 328 0 SHEET 2 A 2 ILE B 332 GLY B 334 -1 N GLY B 334 O GLU A 326 SHEET 1 B 2 ILE A 332 GLY A 334 0 SHEET 2 B 2 GLU B 326 PHE B 328 -1 N PHE B 328 O ILE A 332 SHEET 1 C 2 GLU C 326 PHE C 328 0 SHEET 2 C 2 ILE D 332 GLY D 334 -1 N GLY D 334 O GLU C 326 SHEET 1 D 2 ILE C 332 GLY C 334 0 SHEET 2 D 2 GLU D 326 PHE D 328 -1 N PHE D 328 O ILE C 332 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 327 TYR OH : rot 180:sc= -0.148 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 GLN : amide:sc= -0.174 K(o=-0.17,f=-2.8!) USER MOD Single : A 340 MET CE :methyl 159:sc= -6.78! (180deg=-9.07!) USER MOD Single : A 345 ASN : amide:sc= -6.65! C(o=-6.6!,f=-9.9!) USER MOD Single : A 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 354 GLN : amide:sc= -7.21! C(o=-7.2!,f=-6.3!) USER MOD Single : B 327 TYR OH : rot 180:sc= 0 USER MOD Single : B 329 THR OG1 : rot 180:sc= 0 USER MOD Single : B 331 GLN : amide:sc= -0.163 K(o=-0.16,f=-2.6!) USER MOD Single : B 340 MET CE :methyl 155:sc= -5.85! (180deg=-8.46!) USER MOD Single : B 345 ASN : amide:sc= -6.76! C(o=-6.8!,f=-11!) USER MOD Single : B 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 354 GLN : amide:sc= -7.36! C(o=-7.4!,f=-6.4!) USER MOD Single : C 327 TYR OH : rot 180:sc= -0.226 USER MOD Single : C 329 THR OG1 : rot 180:sc= 0 USER MOD Single : C 331 GLN : amide:sc= -0.187 K(o=-0.19,f=-2.7!) USER MOD Single : C 340 MET CE :methyl 157:sc= -6.59! (180deg=-8.97!) USER MOD Single : C 345 ASN : amide:sc= -7.39! C(o=-7.4!,f=-11!) USER MOD Single : C 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 354 GLN : amide:sc= -7.89! C(o=-7.9!,f=-6.9!) USER MOD Single : D 327 TYR OH : rot 180:sc= -0.166 USER MOD Single : D 329 THR OG1 : rot 180:sc= 0 USER MOD Single : D 331 GLN : amide:sc= -0.189 K(o=-0.19,f=-2.7!) USER MOD Single : D 340 MET CE :methyl 160:sc= -5.9! (180deg=-7.94!) USER MOD Single : D 345 ASN : amide:sc= -7.31! C(o=-7.3!,f=-11!) USER MOD Single : D 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 354 GLN : amide:sc= -8.43! C(o=-8.4!,f=-7.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 325 13.084 2.449 -14.991 1.00 1.57 N ATOM 2 CA GLY A 325 12.097 1.485 -14.428 1.00 0.97 C ATOM 3 C GLY A 325 11.612 0.545 -15.533 1.00 0.89 C ATOM 4 O GLY A 325 11.836 0.781 -16.704 1.00 1.09 O ATOM 0 HA2 GLY A 325 12.553 0.910 -13.622 1.00 0.97 H new ATOM 0 HA3 GLY A 325 11.253 2.023 -13.997 1.00 0.97 H new ATOM 10 N GLU A 326 10.949 -0.519 -15.171 1.00 0.72 N ATOM 11 CA GLU A 326 10.451 -1.473 -16.202 1.00 0.74 C ATOM 12 C GLU A 326 8.950 -1.696 -16.007 1.00 0.67 C ATOM 13 O GLU A 326 8.307 -1.019 -15.229 1.00 0.65 O ATOM 14 CB GLU A 326 11.187 -2.807 -16.062 1.00 0.87 C ATOM 15 CG GLU A 326 12.244 -2.924 -17.162 1.00 1.16 C ATOM 16 CD GLU A 326 12.529 -4.401 -17.441 1.00 1.36 C ATOM 17 OE1 GLU A 326 12.131 -5.223 -16.633 1.00 2.13 O ATOM 18 OE2 GLU A 326 13.139 -4.684 -18.459 1.00 1.70 O ATOM 0 H GLU A 326 10.731 -0.769 -14.206 1.00 0.72 H new ATOM 0 HA GLU A 326 10.632 -1.061 -17.195 1.00 0.74 H new ATOM 0 HB2 GLU A 326 11.658 -2.873 -15.081 1.00 0.87 H new ATOM 0 HB3 GLU A 326 10.480 -3.634 -16.133 1.00 0.87 H new ATOM 0 HG2 GLU A 326 11.895 -2.432 -18.070 1.00 1.16 H new ATOM 0 HG3 GLU A 326 13.160 -2.417 -16.857 1.00 1.16 H new ATOM 25 N TYR A 327 8.386 -2.639 -16.710 1.00 0.65 N ATOM 26 CA TYR A 327 6.927 -2.904 -16.567 1.00 0.59 C ATOM 27 C TYR A 327 6.713 -4.129 -15.676 1.00 0.52 C ATOM 28 O TYR A 327 7.131 -5.224 -15.999 1.00 0.60 O ATOM 29 CB TYR A 327 6.319 -3.167 -17.946 1.00 0.67 C ATOM 30 CG TYR A 327 5.757 -1.882 -18.505 1.00 0.77 C ATOM 31 CD1 TYR A 327 6.621 -0.896 -18.997 1.00 1.30 C ATOM 32 CD2 TYR A 327 4.373 -1.677 -18.532 1.00 1.63 C ATOM 33 CE1 TYR A 327 6.100 0.295 -19.516 1.00 1.33 C ATOM 34 CE2 TYR A 327 3.851 -0.485 -19.051 1.00 1.86 C ATOM 35 CZ TYR A 327 4.715 0.501 -19.543 1.00 1.22 C ATOM 36 OH TYR A 327 4.201 1.675 -20.054 1.00 1.49 O ATOM 0 H TYR A 327 8.873 -3.238 -17.377 1.00 0.65 H new ATOM 0 HA TYR A 327 6.445 -2.037 -16.115 1.00 0.59 H new ATOM 0 HB2 TYR A 327 7.078 -3.567 -18.619 1.00 0.67 H new ATOM 0 HB3 TYR A 327 5.532 -3.917 -17.871 1.00 0.67 H new ATOM 0 HD1 TYR A 327 7.689 -1.054 -18.976 1.00 1.30 H new ATOM 0 HD2 TYR A 327 3.707 -2.438 -18.153 1.00 1.63 H new ATOM 0 HE1 TYR A 327 6.766 1.055 -19.896 1.00 1.33 H new ATOM 0 HE2 TYR A 327 2.783 -0.327 -19.072 1.00 1.86 H new ATOM 0 HH TYR A 327 3.223 1.655 -19.999 1.00 1.49 H new ATOM 46 N PHE A 328 6.059 -3.957 -14.560 1.00 0.44 N ATOM 47 CA PHE A 328 5.814 -5.113 -13.653 1.00 0.39 C ATOM 48 C PHE A 328 4.316 -5.427 -13.633 1.00 0.34 C ATOM 49 O PHE A 328 3.495 -4.570 -13.882 1.00 0.42 O ATOM 50 CB PHE A 328 6.283 -4.764 -12.240 1.00 0.42 C ATOM 51 CG PHE A 328 7.791 -4.814 -12.182 1.00 0.44 C ATOM 52 CD1 PHE A 328 8.551 -3.952 -12.982 1.00 1.44 C ATOM 53 CD2 PHE A 328 8.429 -5.722 -11.329 1.00 1.12 C ATOM 54 CE1 PHE A 328 9.949 -3.999 -12.929 1.00 1.50 C ATOM 55 CE2 PHE A 328 9.827 -5.769 -11.276 1.00 1.13 C ATOM 56 CZ PHE A 328 10.587 -4.907 -12.076 1.00 0.62 C ATOM 0 H PHE A 328 5.684 -3.065 -14.237 1.00 0.44 H new ATOM 0 HA PHE A 328 6.366 -5.982 -14.010 1.00 0.39 H new ATOM 0 HB2 PHE A 328 5.931 -3.770 -11.964 1.00 0.42 H new ATOM 0 HB3 PHE A 328 5.858 -5.464 -11.521 1.00 0.42 H new ATOM 0 HD1 PHE A 328 8.059 -3.251 -13.640 1.00 1.44 H new ATOM 0 HD2 PHE A 328 7.843 -6.386 -10.712 1.00 1.12 H new ATOM 0 HE1 PHE A 328 10.535 -3.335 -13.546 1.00 1.50 H new ATOM 0 HE2 PHE A 328 10.319 -6.470 -10.618 1.00 1.13 H new ATOM 0 HZ PHE A 328 11.666 -4.943 -12.035 1.00 0.62 H new ATOM 66 N THR A 329 3.956 -6.648 -13.345 1.00 0.42 N ATOM 67 CA THR A 329 2.509 -7.019 -13.315 1.00 0.38 C ATOM 68 C THR A 329 2.125 -7.484 -11.911 1.00 0.38 C ATOM 69 O THR A 329 2.799 -8.298 -11.311 1.00 0.47 O ATOM 70 CB THR A 329 2.264 -8.166 -14.294 1.00 0.37 C ATOM 71 OG1 THR A 329 3.323 -8.221 -15.239 1.00 0.39 O ATOM 72 CG2 THR A 329 0.937 -7.951 -15.018 1.00 0.39 C ATOM 0 H THR A 329 4.602 -7.407 -13.128 1.00 0.42 H new ATOM 0 HA THR A 329 1.910 -6.151 -13.592 1.00 0.38 H new ATOM 0 HB THR A 329 2.223 -9.106 -13.744 1.00 0.37 H new ATOM 0 HG1 THR A 329 3.165 -8.958 -15.865 1.00 0.39 H new ATOM 0 HG21 THR A 329 0.766 -8.771 -15.715 1.00 0.39 H new ATOM 0 HG22 THR A 329 0.126 -7.919 -14.290 1.00 0.39 H new ATOM 0 HG23 THR A 329 0.970 -7.010 -15.566 1.00 0.39 H new ATOM 80 N LEU A 330 1.033 -6.995 -11.392 1.00 0.32 N ATOM 81 CA LEU A 330 0.594 -7.437 -10.042 1.00 0.33 C ATOM 82 C LEU A 330 -0.704 -8.223 -10.203 1.00 0.31 C ATOM 83 O LEU A 330 -1.786 -7.670 -10.188 1.00 0.29 O ATOM 84 CB LEU A 330 0.359 -6.212 -9.155 1.00 0.34 C ATOM 85 CG LEU A 330 1.056 -6.401 -7.807 1.00 0.50 C ATOM 86 CD1 LEU A 330 2.150 -5.350 -7.650 1.00 0.43 C ATOM 87 CD2 LEU A 330 0.039 -6.225 -6.682 1.00 0.95 C ATOM 0 H LEU A 330 0.428 -6.310 -11.844 1.00 0.32 H new ATOM 0 HA LEU A 330 1.355 -8.063 -9.576 1.00 0.33 H new ATOM 0 HB2 LEU A 330 0.739 -5.317 -9.648 1.00 0.34 H new ATOM 0 HB3 LEU A 330 -0.710 -6.062 -9.003 1.00 0.34 H new ATOM 0 HG LEU A 330 1.491 -7.399 -7.762 1.00 0.50 H new ATOM 0 HD11 LEU A 330 2.648 -5.484 -6.689 1.00 0.43 H new ATOM 0 HD12 LEU A 330 2.878 -5.459 -8.454 1.00 0.43 H new ATOM 0 HD13 LEU A 330 1.708 -4.355 -7.694 1.00 0.43 H new ATOM 0 HD21 LEU A 330 0.534 -6.359 -5.720 1.00 0.95 H new ATOM 0 HD22 LEU A 330 -0.390 -5.224 -6.733 1.00 0.95 H new ATOM 0 HD23 LEU A 330 -0.754 -6.966 -6.789 1.00 0.95 H new ATOM 99 N GLN A 331 -0.603 -9.513 -10.362 1.00 0.33 N ATOM 100 CA GLN A 331 -1.827 -10.339 -10.536 1.00 0.33 C ATOM 101 C GLN A 331 -2.396 -10.692 -9.163 1.00 0.37 C ATOM 102 O GLN A 331 -1.804 -11.438 -8.407 1.00 0.42 O ATOM 103 CB GLN A 331 -1.476 -11.619 -11.298 1.00 0.36 C ATOM 104 CG GLN A 331 -1.318 -11.313 -12.788 1.00 1.07 C ATOM 105 CD GLN A 331 -1.563 -12.591 -13.594 1.00 1.25 C ATOM 106 OE1 GLN A 331 -2.101 -13.552 -13.081 1.00 2.06 O ATOM 107 NE2 GLN A 331 -1.189 -12.644 -14.843 1.00 1.37 N ATOM 0 H GLN A 331 0.276 -10.030 -10.379 1.00 0.33 H new ATOM 0 HA GLN A 331 -2.571 -9.779 -11.103 1.00 0.33 H new ATOM 0 HB2 GLN A 331 -0.552 -12.044 -10.906 1.00 0.36 H new ATOM 0 HB3 GLN A 331 -2.257 -12.365 -11.152 1.00 0.36 H new ATOM 0 HG2 GLN A 331 -2.023 -10.538 -13.089 1.00 1.07 H new ATOM 0 HG3 GLN A 331 -0.318 -10.929 -12.988 1.00 1.07 H new ATOM 0 HE21 GLN A 331 -0.737 -11.838 -15.275 1.00 1.37 H new ATOM 0 HE22 GLN A 331 -1.348 -13.492 -15.388 1.00 1.37 H new ATOM 116 N ILE A 332 -3.537 -10.156 -8.830 1.00 0.37 N ATOM 117 CA ILE A 332 -4.140 -10.454 -7.501 1.00 0.42 C ATOM 118 C ILE A 332 -5.414 -11.279 -7.688 1.00 0.43 C ATOM 119 O ILE A 332 -6.300 -10.911 -8.433 1.00 0.46 O ATOM 120 CB ILE A 332 -4.481 -9.141 -6.793 1.00 0.46 C ATOM 121 CG1 ILE A 332 -3.200 -8.332 -6.577 1.00 0.48 C ATOM 122 CG2 ILE A 332 -5.126 -9.443 -5.440 1.00 0.53 C ATOM 123 CD1 ILE A 332 -3.420 -6.891 -7.041 1.00 0.46 C ATOM 0 H ILE A 332 -4.078 -9.524 -9.421 1.00 0.37 H new ATOM 0 HA ILE A 332 -3.429 -11.020 -6.899 1.00 0.42 H new ATOM 0 HB ILE A 332 -5.176 -8.567 -7.406 1.00 0.46 H new ATOM 0 HG12 ILE A 332 -2.921 -8.347 -5.523 1.00 0.48 H new ATOM 0 HG13 ILE A 332 -2.376 -8.782 -7.131 1.00 0.48 H new ATOM 0 HG21 ILE A 332 -5.369 -8.508 -4.936 1.00 0.53 H new ATOM 0 HG22 ILE A 332 -6.038 -10.020 -5.592 1.00 0.53 H new ATOM 0 HG23 ILE A 332 -4.432 -10.017 -4.826 1.00 0.53 H new ATOM 0 HD11 ILE A 332 -2.507 -6.316 -6.887 1.00 0.46 H new ATOM 0 HD12 ILE A 332 -3.678 -6.885 -8.100 1.00 0.46 H new ATOM 0 HD13 ILE A 332 -4.232 -6.444 -6.467 1.00 0.46 H new ATOM 135 N ARG A 333 -5.513 -12.392 -7.015 1.00 0.51 N ATOM 136 CA ARG A 333 -6.732 -13.238 -7.150 1.00 0.55 C ATOM 137 C ARG A 333 -7.803 -12.737 -6.181 1.00 0.54 C ATOM 138 O ARG A 333 -7.681 -12.875 -4.980 1.00 0.82 O ATOM 139 CB ARG A 333 -6.383 -14.691 -6.821 1.00 0.66 C ATOM 140 CG ARG A 333 -6.967 -15.612 -7.894 1.00 1.46 C ATOM 141 CD ARG A 333 -6.837 -17.067 -7.443 1.00 1.66 C ATOM 142 NE ARG A 333 -7.552 -17.252 -6.149 1.00 2.45 N ATOM 143 CZ ARG A 333 -7.122 -18.132 -5.286 1.00 2.74 C ATOM 144 NH1 ARG A 333 -7.137 -19.402 -5.586 1.00 3.29 N ATOM 145 NH2 ARG A 333 -6.678 -17.741 -4.123 1.00 3.09 N ATOM 0 H ARG A 333 -4.803 -12.752 -6.378 1.00 0.51 H new ATOM 0 HA ARG A 333 -7.108 -13.179 -8.171 1.00 0.55 H new ATOM 0 HB2 ARG A 333 -5.301 -14.814 -6.771 1.00 0.66 H new ATOM 0 HB3 ARG A 333 -6.780 -14.959 -5.842 1.00 0.66 H new ATOM 0 HG2 ARG A 333 -8.015 -15.366 -8.068 1.00 1.46 H new ATOM 0 HG3 ARG A 333 -6.444 -15.465 -8.839 1.00 1.46 H new ATOM 0 HD2 ARG A 333 -7.254 -17.732 -8.199 1.00 1.66 H new ATOM 0 HD3 ARG A 333 -5.786 -17.332 -7.331 1.00 1.66 H new ATOM 0 HE ARG A 333 -8.377 -16.691 -5.937 1.00 2.45 H new ATOM 0 HH11 ARG A 333 -7.485 -19.707 -6.495 1.00 3.29 H new ATOM 0 HH12 ARG A 333 -6.801 -20.089 -4.911 1.00 3.29 H new ATOM 0 HH21 ARG A 333 -6.667 -16.748 -3.889 1.00 3.09 H new ATOM 0 HH22 ARG A 333 -6.342 -18.428 -3.448 1.00 3.09 H new ATOM 159 N GLY A 334 -8.852 -12.154 -6.692 1.00 0.53 N ATOM 160 CA GLY A 334 -9.928 -11.641 -5.797 1.00 0.49 C ATOM 161 C GLY A 334 -10.711 -10.544 -6.520 1.00 0.49 C ATOM 162 O GLY A 334 -11.045 -10.668 -7.682 1.00 0.58 O ATOM 0 H GLY A 334 -9.011 -12.011 -7.689 1.00 0.53 H new ATOM 0 HA2 GLY A 334 -10.597 -12.453 -5.512 1.00 0.49 H new ATOM 0 HA3 GLY A 334 -9.495 -11.248 -4.877 1.00 0.49 H new ATOM 166 N ARG A 335 -11.002 -9.469 -5.842 1.00 0.46 N ATOM 167 CA ARG A 335 -11.758 -8.360 -6.488 1.00 0.47 C ATOM 168 C ARG A 335 -11.679 -7.116 -5.604 1.00 0.43 C ATOM 169 O ARG A 335 -11.319 -6.046 -6.051 1.00 0.46 O ATOM 170 CB ARG A 335 -13.222 -8.770 -6.663 1.00 0.52 C ATOM 171 CG ARG A 335 -13.904 -7.815 -7.646 1.00 0.59 C ATOM 172 CD ARG A 335 -15.054 -8.541 -8.346 1.00 0.81 C ATOM 173 NE ARG A 335 -15.210 -8.008 -9.729 1.00 0.88 N ATOM 174 CZ ARG A 335 -16.398 -7.908 -10.260 1.00 1.23 C ATOM 175 NH1 ARG A 335 -16.948 -8.945 -10.829 1.00 2.04 N ATOM 176 NH2 ARG A 335 -17.036 -6.770 -10.221 1.00 1.57 N ATOM 0 H ARG A 335 -10.749 -9.310 -4.867 1.00 0.46 H new ATOM 0 HA ARG A 335 -11.326 -8.144 -7.465 1.00 0.47 H new ATOM 0 HB2 ARG A 335 -13.283 -9.794 -7.032 1.00 0.52 H new ATOM 0 HB3 ARG A 335 -13.735 -8.747 -5.701 1.00 0.52 H new ATOM 0 HG2 ARG A 335 -14.281 -6.939 -7.117 1.00 0.59 H new ATOM 0 HG3 ARG A 335 -13.184 -7.458 -8.382 1.00 0.59 H new ATOM 0 HD2 ARG A 335 -14.856 -9.612 -8.378 1.00 0.81 H new ATOM 0 HD3 ARG A 335 -15.979 -8.404 -7.786 1.00 0.81 H new ATOM 0 HE ARG A 335 -14.388 -7.721 -10.261 1.00 0.88 H new ATOM 0 HH11 ARG A 335 -16.450 -9.834 -10.859 1.00 2.04 H new ATOM 0 HH12 ARG A 335 -17.877 -8.866 -11.244 1.00 2.04 H new ATOM 0 HH21 ARG A 335 -16.606 -5.959 -9.776 1.00 1.57 H new ATOM 0 HH22 ARG A 335 -17.964 -6.691 -10.636 1.00 1.57 H new ATOM 190 N GLU A 336 -12.010 -7.249 -4.349 1.00 0.43 N ATOM 191 CA GLU A 336 -11.949 -6.075 -3.435 1.00 0.42 C ATOM 192 C GLU A 336 -10.487 -5.692 -3.204 1.00 0.37 C ATOM 193 O GLU A 336 -10.104 -4.551 -3.363 1.00 0.38 O ATOM 194 CB GLU A 336 -12.602 -6.433 -2.098 1.00 0.47 C ATOM 195 CG GLU A 336 -14.057 -5.962 -2.095 1.00 1.17 C ATOM 196 CD GLU A 336 -14.763 -6.492 -0.846 1.00 1.64 C ATOM 197 OE1 GLU A 336 -14.715 -7.691 -0.626 1.00 2.24 O ATOM 198 OE2 GLU A 336 -15.339 -5.690 -0.129 1.00 2.15 O ATOM 0 H GLU A 336 -12.320 -8.120 -3.918 1.00 0.43 H new ATOM 0 HA GLU A 336 -12.481 -5.235 -3.882 1.00 0.42 H new ATOM 0 HB2 GLU A 336 -12.558 -7.510 -1.937 1.00 0.47 H new ATOM 0 HB3 GLU A 336 -12.056 -5.965 -1.278 1.00 0.47 H new ATOM 0 HG2 GLU A 336 -14.098 -4.873 -2.114 1.00 1.17 H new ATOM 0 HG3 GLU A 336 -14.567 -6.316 -2.991 1.00 1.17 H new ATOM 205 N ARG A 337 -9.667 -6.637 -2.835 1.00 0.39 N ATOM 206 CA ARG A 337 -8.231 -6.320 -2.601 1.00 0.36 C ATOM 207 C ARG A 337 -7.652 -5.663 -3.855 1.00 0.32 C ATOM 208 O ARG A 337 -6.912 -4.702 -3.780 1.00 0.34 O ATOM 209 CB ARG A 337 -7.464 -7.608 -2.292 1.00 0.38 C ATOM 210 CG ARG A 337 -7.246 -7.720 -0.781 1.00 0.65 C ATOM 211 CD ARG A 337 -6.529 -9.033 -0.461 1.00 0.41 C ATOM 212 NE ARG A 337 -7.252 -10.165 -1.107 1.00 1.04 N ATOM 213 CZ ARG A 337 -7.645 -11.182 -0.389 1.00 1.24 C ATOM 214 NH1 ARG A 337 -8.618 -11.038 0.468 1.00 1.85 N ATOM 215 NH2 ARG A 337 -7.065 -12.342 -0.529 1.00 1.95 N ATOM 0 H ARG A 337 -9.928 -7.612 -2.686 1.00 0.39 H new ATOM 0 HA ARG A 337 -8.139 -5.638 -1.755 1.00 0.36 H new ATOM 0 HB2 ARG A 337 -8.021 -8.472 -2.655 1.00 0.38 H new ATOM 0 HB3 ARG A 337 -6.505 -7.606 -2.810 1.00 0.38 H new ATOM 0 HG2 ARG A 337 -6.656 -6.876 -0.425 1.00 0.65 H new ATOM 0 HG3 ARG A 337 -8.203 -7.681 -0.262 1.00 0.65 H new ATOM 0 HD2 ARG A 337 -5.500 -8.994 -0.818 1.00 0.41 H new ATOM 0 HD3 ARG A 337 -6.487 -9.183 0.618 1.00 0.41 H new ATOM 0 HE ARG A 337 -7.440 -10.145 -2.109 1.00 1.04 H new ATOM 0 HH11 ARG A 337 -9.072 -10.131 0.577 1.00 1.85 H new ATOM 0 HH12 ARG A 337 -8.925 -11.833 1.029 1.00 1.85 H new ATOM 0 HH21 ARG A 337 -6.304 -12.454 -1.199 1.00 1.95 H new ATOM 0 HH22 ARG A 337 -7.372 -13.137 0.032 1.00 1.95 H new ATOM 229 N PHE A 338 -7.990 -6.170 -5.010 1.00 0.31 N ATOM 230 CA PHE A 338 -7.464 -5.568 -6.266 1.00 0.30 C ATOM 231 C PHE A 338 -7.879 -4.098 -6.327 1.00 0.29 C ATOM 232 O PHE A 338 -7.128 -3.248 -6.764 1.00 0.30 O ATOM 233 CB PHE A 338 -8.038 -6.311 -7.474 1.00 0.32 C ATOM 234 CG PHE A 338 -7.551 -5.657 -8.745 1.00 0.36 C ATOM 235 CD1 PHE A 338 -6.250 -5.900 -9.203 1.00 1.29 C ATOM 236 CD2 PHE A 338 -8.399 -4.806 -9.464 1.00 1.14 C ATOM 237 CE1 PHE A 338 -5.799 -5.293 -10.381 1.00 1.36 C ATOM 238 CE2 PHE A 338 -7.947 -4.199 -10.642 1.00 1.15 C ATOM 239 CZ PHE A 338 -6.647 -4.442 -11.101 1.00 0.58 C ATOM 0 H PHE A 338 -8.606 -6.973 -5.137 1.00 0.31 H new ATOM 0 HA PHE A 338 -6.377 -5.646 -6.281 1.00 0.30 H new ATOM 0 HB2 PHE A 338 -7.732 -7.357 -7.450 1.00 0.32 H new ATOM 0 HB3 PHE A 338 -9.127 -6.297 -7.439 1.00 0.32 H new ATOM 0 HD1 PHE A 338 -5.595 -6.555 -8.648 1.00 1.29 H new ATOM 0 HD2 PHE A 338 -9.402 -4.618 -9.110 1.00 1.14 H new ATOM 0 HE1 PHE A 338 -4.796 -5.481 -10.735 1.00 1.36 H new ATOM 0 HE2 PHE A 338 -8.602 -3.543 -11.197 1.00 1.15 H new ATOM 0 HZ PHE A 338 -6.298 -3.974 -12.010 1.00 0.58 H new ATOM 249 N GLU A 339 -9.069 -3.788 -5.887 1.00 0.32 N ATOM 250 CA GLU A 339 -9.525 -2.371 -5.916 1.00 0.33 C ATOM 251 C GLU A 339 -8.663 -1.548 -4.956 1.00 0.30 C ATOM 252 O GLU A 339 -8.233 -0.457 -5.271 1.00 0.30 O ATOM 253 CB GLU A 339 -10.989 -2.295 -5.482 1.00 0.40 C ATOM 254 CG GLU A 339 -11.867 -2.977 -6.532 1.00 0.54 C ATOM 255 CD GLU A 339 -13.243 -2.310 -6.560 1.00 0.94 C ATOM 256 OE1 GLU A 339 -13.615 -1.722 -5.558 1.00 1.61 O ATOM 257 OE2 GLU A 339 -13.901 -2.397 -7.583 1.00 1.47 O ATOM 0 H GLU A 339 -9.743 -4.454 -5.510 1.00 0.32 H new ATOM 0 HA GLU A 339 -9.429 -1.975 -6.927 1.00 0.33 H new ATOM 0 HB2 GLU A 339 -11.118 -2.779 -4.514 1.00 0.40 H new ATOM 0 HB3 GLU A 339 -11.290 -1.254 -5.361 1.00 0.40 H new ATOM 0 HG2 GLU A 339 -11.398 -2.908 -7.514 1.00 0.54 H new ATOM 0 HG3 GLU A 339 -11.970 -4.037 -6.302 1.00 0.54 H new ATOM 264 N MET A 340 -8.405 -2.069 -3.788 1.00 0.30 N ATOM 265 CA MET A 340 -7.567 -1.327 -2.806 1.00 0.30 C ATOM 266 C MET A 340 -6.296 -0.839 -3.487 1.00 0.26 C ATOM 267 O MET A 340 -5.999 0.339 -3.522 1.00 0.27 O ATOM 268 CB MET A 340 -7.201 -2.255 -1.651 1.00 0.33 C ATOM 269 CG MET A 340 -8.191 -2.053 -0.503 1.00 0.35 C ATOM 270 SD MET A 340 -8.106 -3.469 0.620 1.00 0.62 S ATOM 271 CE MET A 340 -6.311 -3.685 0.567 1.00 0.38 C ATOM 0 H MET A 340 -8.740 -2.979 -3.471 1.00 0.30 H new ATOM 0 HA MET A 340 -8.124 -0.471 -2.425 1.00 0.30 H new ATOM 0 HB2 MET A 340 -7.220 -3.293 -1.984 1.00 0.33 H new ATOM 0 HB3 MET A 340 -6.186 -2.048 -1.311 1.00 0.33 H new ATOM 0 HG2 MET A 340 -7.959 -1.134 0.035 1.00 0.35 H new ATOM 0 HG3 MET A 340 -9.202 -1.946 -0.895 1.00 0.35 H new ATOM 0 HE1 MET A 340 -5.985 -4.242 1.446 1.00 0.38 H new ATOM 0 HE2 MET A 340 -6.037 -4.235 -0.333 1.00 0.38 H new ATOM 0 HE3 MET A 340 -5.827 -2.708 0.557 1.00 0.38 H new ATOM 281 N PHE A 341 -5.549 -1.744 -4.031 1.00 0.27 N ATOM 282 CA PHE A 341 -4.296 -1.372 -4.720 1.00 0.28 C ATOM 283 C PHE A 341 -4.615 -0.426 -5.869 1.00 0.28 C ATOM 284 O PHE A 341 -3.875 0.486 -6.168 1.00 0.34 O ATOM 285 CB PHE A 341 -3.654 -2.637 -5.265 1.00 0.30 C ATOM 286 CG PHE A 341 -2.948 -3.377 -4.151 1.00 0.28 C ATOM 287 CD1 PHE A 341 -2.199 -2.678 -3.192 1.00 1.23 C ATOM 288 CD2 PHE A 341 -3.058 -4.769 -4.072 1.00 1.26 C ATOM 289 CE1 PHE A 341 -1.564 -3.378 -2.156 1.00 1.22 C ATOM 290 CE2 PHE A 341 -2.421 -5.466 -3.042 1.00 1.28 C ATOM 291 CZ PHE A 341 -1.677 -4.773 -2.084 1.00 0.35 C ATOM 0 H PHE A 341 -5.757 -2.743 -4.028 1.00 0.27 H new ATOM 0 HA PHE A 341 -3.616 -0.877 -4.027 1.00 0.28 H new ATOM 0 HB2 PHE A 341 -4.414 -3.277 -5.714 1.00 0.30 H new ATOM 0 HB3 PHE A 341 -2.944 -2.385 -6.053 1.00 0.30 H new ATOM 0 HD1 PHE A 341 -2.112 -1.603 -3.252 1.00 1.23 H new ATOM 0 HD2 PHE A 341 -3.637 -5.306 -4.809 1.00 1.26 H new ATOM 0 HE1 PHE A 341 -0.989 -2.843 -1.415 1.00 1.22 H new ATOM 0 HE2 PHE A 341 -2.504 -6.541 -2.986 1.00 1.28 H new ATOM 0 HZ PHE A 341 -1.188 -5.313 -1.287 1.00 0.35 H new ATOM 301 N ARG A 342 -5.717 -0.649 -6.508 1.00 0.28 N ATOM 302 CA ARG A 342 -6.123 0.225 -7.646 1.00 0.31 C ATOM 303 C ARG A 342 -6.185 1.675 -7.166 1.00 0.30 C ATOM 304 O ARG A 342 -5.850 2.594 -7.887 1.00 0.34 O ATOM 305 CB ARG A 342 -7.501 -0.202 -8.158 1.00 0.35 C ATOM 306 CG ARG A 342 -7.372 -0.744 -9.584 1.00 0.51 C ATOM 307 CD ARG A 342 -8.620 -0.373 -10.389 1.00 0.84 C ATOM 308 NE ARG A 342 -8.223 0.446 -11.571 1.00 1.26 N ATOM 309 CZ ARG A 342 -9.031 0.555 -12.590 1.00 1.75 C ATOM 310 NH1 ARG A 342 -9.045 -0.367 -13.514 1.00 2.37 N ATOM 311 NH2 ARG A 342 -9.824 1.587 -12.687 1.00 2.36 N ATOM 0 H ARG A 342 -6.366 -1.406 -6.294 1.00 0.28 H new ATOM 0 HA ARG A 342 -5.396 0.134 -8.453 1.00 0.31 H new ATOM 0 HB2 ARG A 342 -7.923 -0.966 -7.504 1.00 0.35 H new ATOM 0 HB3 ARG A 342 -8.186 0.646 -8.141 1.00 0.35 H new ATOM 0 HG2 ARG A 342 -6.483 -0.332 -10.061 1.00 0.51 H new ATOM 0 HG3 ARG A 342 -7.249 -1.827 -9.563 1.00 0.51 H new ATOM 0 HD2 ARG A 342 -9.137 -1.275 -10.715 1.00 0.84 H new ATOM 0 HD3 ARG A 342 -9.317 0.185 -9.764 1.00 0.84 H new ATOM 0 HE ARG A 342 -7.320 0.921 -11.583 1.00 1.26 H new ATOM 0 HH11 ARG A 342 -8.424 -1.173 -13.440 1.00 2.37 H new ATOM 0 HH12 ARG A 342 -9.677 -0.281 -14.310 1.00 2.37 H new ATOM 0 HH21 ARG A 342 -9.812 2.309 -11.966 1.00 2.36 H new ATOM 0 HH22 ARG A 342 -10.455 1.672 -13.484 1.00 2.36 H new ATOM 325 N GLU A 343 -6.607 1.889 -5.948 1.00 0.27 N ATOM 326 CA GLU A 343 -6.682 3.282 -5.423 1.00 0.28 C ATOM 327 C GLU A 343 -5.263 3.806 -5.210 1.00 0.23 C ATOM 328 O GLU A 343 -4.892 4.849 -5.712 1.00 0.26 O ATOM 329 CB GLU A 343 -7.437 3.295 -4.093 1.00 0.34 C ATOM 330 CG GLU A 343 -7.825 4.734 -3.743 1.00 0.37 C ATOM 331 CD GLU A 343 -9.276 4.988 -4.157 1.00 0.79 C ATOM 332 OE1 GLU A 343 -10.138 4.256 -3.699 1.00 1.31 O ATOM 333 OE2 GLU A 343 -9.500 5.909 -4.924 1.00 1.62 O ATOM 0 H GLU A 343 -6.902 1.162 -5.297 1.00 0.27 H new ATOM 0 HA GLU A 343 -7.209 3.915 -6.136 1.00 0.28 H new ATOM 0 HB2 GLU A 343 -8.329 2.673 -4.163 1.00 0.34 H new ATOM 0 HB3 GLU A 343 -6.814 2.872 -3.304 1.00 0.34 H new ATOM 0 HG2 GLU A 343 -7.706 4.904 -2.673 1.00 0.37 H new ATOM 0 HG3 GLU A 343 -7.163 5.434 -4.252 1.00 0.37 H new ATOM 340 N LEU A 344 -4.460 3.083 -4.478 1.00 0.24 N ATOM 341 CA LEU A 344 -3.060 3.534 -4.246 1.00 0.25 C ATOM 342 C LEU A 344 -2.372 3.715 -5.602 1.00 0.27 C ATOM 343 O LEU A 344 -1.394 4.427 -5.732 1.00 0.40 O ATOM 344 CB LEU A 344 -2.306 2.474 -3.429 1.00 0.31 C ATOM 345 CG LEU A 344 -2.871 2.383 -2.002 1.00 0.26 C ATOM 346 CD1 LEU A 344 -3.259 3.775 -1.495 1.00 0.30 C ATOM 347 CD2 LEU A 344 -4.102 1.472 -1.993 1.00 0.36 C ATOM 0 H LEU A 344 -4.713 2.201 -4.032 1.00 0.24 H new ATOM 0 HA LEU A 344 -3.060 4.476 -3.697 1.00 0.25 H new ATOM 0 HB2 LEU A 344 -2.387 1.504 -3.920 1.00 0.31 H new ATOM 0 HB3 LEU A 344 -1.246 2.724 -3.390 1.00 0.31 H new ATOM 0 HG LEU A 344 -2.106 1.969 -1.346 1.00 0.26 H new ATOM 0 HD11 LEU A 344 -3.658 3.696 -0.484 1.00 0.30 H new ATOM 0 HD12 LEU A 344 -2.379 4.418 -1.489 1.00 0.30 H new ATOM 0 HD13 LEU A 344 -4.017 4.203 -2.151 1.00 0.30 H new ATOM 0 HD21 LEU A 344 -4.501 1.409 -0.980 1.00 0.36 H new ATOM 0 HD22 LEU A 344 -4.863 1.882 -2.658 1.00 0.36 H new ATOM 0 HD23 LEU A 344 -3.820 0.476 -2.334 1.00 0.36 H new ATOM 359 N ASN A 345 -2.887 3.071 -6.614 1.00 0.40 N ATOM 360 CA ASN A 345 -2.285 3.184 -7.971 1.00 0.50 C ATOM 361 C ASN A 345 -2.820 4.436 -8.663 1.00 0.44 C ATOM 362 O ASN A 345 -2.134 5.069 -9.441 1.00 0.48 O ATOM 363 CB ASN A 345 -2.667 1.953 -8.796 1.00 0.65 C ATOM 364 CG ASN A 345 -1.403 1.212 -9.233 1.00 0.94 C ATOM 365 OD1 ASN A 345 -0.307 1.585 -8.866 1.00 1.77 O ATOM 366 ND2 ASN A 345 -1.511 0.169 -10.010 1.00 1.31 N ATOM 0 H ASN A 345 -3.706 2.466 -6.557 1.00 0.40 H new ATOM 0 HA ASN A 345 -1.200 3.249 -7.884 1.00 0.50 H new ATOM 0 HB2 ASN A 345 -3.302 1.292 -8.207 1.00 0.65 H new ATOM 0 HB3 ASN A 345 -3.244 2.254 -9.670 1.00 0.65 H new ATOM 0 HD21 ASN A 345 -0.675 -0.333 -10.309 1.00 1.31 H new ATOM 0 HD22 ASN A 345 -2.431 -0.144 -10.318 1.00 1.31 H new ATOM 373 N GLU A 346 -4.042 4.796 -8.390 1.00 0.38 N ATOM 374 CA GLU A 346 -4.621 6.004 -9.037 1.00 0.38 C ATOM 375 C GLU A 346 -3.888 7.249 -8.539 1.00 0.33 C ATOM 376 O GLU A 346 -3.633 8.170 -9.288 1.00 0.38 O ATOM 377 CB GLU A 346 -6.106 6.110 -8.685 1.00 0.40 C ATOM 378 CG GLU A 346 -6.864 6.743 -9.855 1.00 0.87 C ATOM 379 CD GLU A 346 -8.281 6.170 -9.916 1.00 1.11 C ATOM 380 OE1 GLU A 346 -9.120 6.636 -9.163 1.00 1.59 O ATOM 381 OE2 GLU A 346 -8.504 5.276 -10.716 1.00 1.89 O ATOM 0 H GLU A 346 -4.664 4.306 -7.747 1.00 0.38 H new ATOM 0 HA GLU A 346 -4.510 5.925 -10.118 1.00 0.38 H new ATOM 0 HB2 GLU A 346 -6.511 5.121 -8.468 1.00 0.40 H new ATOM 0 HB3 GLU A 346 -6.235 6.712 -7.786 1.00 0.40 H new ATOM 0 HG2 GLU A 346 -6.903 7.825 -9.733 1.00 0.87 H new ATOM 0 HG3 GLU A 346 -6.340 6.546 -10.790 1.00 0.87 H new ATOM 388 N ALA A 347 -3.549 7.289 -7.279 1.00 0.27 N ATOM 389 CA ALA A 347 -2.839 8.481 -6.738 1.00 0.25 C ATOM 390 C ALA A 347 -1.383 8.481 -7.196 1.00 0.27 C ATOM 391 O ALA A 347 -0.898 9.453 -7.737 1.00 0.29 O ATOM 392 CB ALA A 347 -2.877 8.451 -5.218 1.00 0.27 C ATOM 0 H ALA A 347 -3.733 6.548 -6.602 1.00 0.27 H new ATOM 0 HA ALA A 347 -3.334 9.379 -7.106 1.00 0.25 H new ATOM 0 HB1 ALA A 347 -2.357 9.324 -4.824 1.00 0.27 H new ATOM 0 HB2 ALA A 347 -3.913 8.462 -4.880 1.00 0.27 H new ATOM 0 HB3 ALA A 347 -2.388 7.545 -4.860 1.00 0.27 H new ATOM 398 N LEU A 348 -0.675 7.406 -6.979 1.00 0.31 N ATOM 399 CA LEU A 348 0.750 7.369 -7.410 1.00 0.38 C ATOM 400 C LEU A 348 0.827 7.778 -8.882 1.00 0.42 C ATOM 401 O LEU A 348 1.561 8.677 -9.263 1.00 0.47 O ATOM 402 CB LEU A 348 1.297 5.950 -7.235 1.00 0.43 C ATOM 403 CG LEU A 348 1.186 5.538 -5.766 1.00 0.42 C ATOM 404 CD1 LEU A 348 1.455 4.037 -5.632 1.00 0.49 C ATOM 405 CD2 LEU A 348 2.215 6.313 -4.940 1.00 0.48 C ATOM 0 H LEU A 348 -1.018 6.559 -6.526 1.00 0.31 H new ATOM 0 HA LEU A 348 1.344 8.055 -6.806 1.00 0.38 H new ATOM 0 HB2 LEU A 348 0.740 5.254 -7.862 1.00 0.43 H new ATOM 0 HB3 LEU A 348 2.337 5.907 -7.558 1.00 0.43 H new ATOM 0 HG LEU A 348 0.183 5.761 -5.403 1.00 0.42 H new ATOM 0 HD11 LEU A 348 1.376 3.745 -4.585 1.00 0.49 H new ATOM 0 HD12 LEU A 348 0.724 3.482 -6.220 1.00 0.49 H new ATOM 0 HD13 LEU A 348 2.458 3.813 -5.996 1.00 0.49 H new ATOM 0 HD21 LEU A 348 2.136 6.020 -3.893 1.00 0.48 H new ATOM 0 HD22 LEU A 348 3.217 6.090 -5.305 1.00 0.48 H new ATOM 0 HD23 LEU A 348 2.025 7.382 -5.033 1.00 0.48 H new ATOM 417 N GLU A 349 0.060 7.134 -9.714 1.00 0.44 N ATOM 418 CA GLU A 349 0.071 7.491 -11.153 1.00 0.52 C ATOM 419 C GLU A 349 -0.340 8.956 -11.300 1.00 0.49 C ATOM 420 O GLU A 349 0.067 9.635 -12.224 1.00 0.56 O ATOM 421 CB GLU A 349 -0.916 6.601 -11.912 1.00 0.57 C ATOM 422 CG GLU A 349 -0.430 6.412 -13.350 1.00 0.98 C ATOM 423 CD GLU A 349 -1.058 5.148 -13.939 1.00 0.91 C ATOM 424 OE1 GLU A 349 -0.489 4.085 -13.752 1.00 1.48 O ATOM 425 OE2 GLU A 349 -2.097 5.264 -14.569 1.00 1.42 O ATOM 0 H GLU A 349 -0.573 6.376 -9.458 1.00 0.44 H new ATOM 0 HA GLU A 349 1.070 7.343 -11.563 1.00 0.52 H new ATOM 0 HB2 GLU A 349 -1.005 5.634 -11.417 1.00 0.57 H new ATOM 0 HB3 GLU A 349 -1.908 7.054 -11.908 1.00 0.57 H new ATOM 0 HG2 GLU A 349 -0.699 7.279 -13.953 1.00 0.98 H new ATOM 0 HG3 GLU A 349 0.657 6.334 -13.370 1.00 0.98 H new ATOM 432 N LEU A 350 -1.140 9.459 -10.393 1.00 0.40 N ATOM 433 CA LEU A 350 -1.560 10.873 -10.493 1.00 0.39 C ATOM 434 C LEU A 350 -0.355 11.774 -10.214 1.00 0.38 C ATOM 435 O LEU A 350 -0.244 12.866 -10.734 1.00 0.41 O ATOM 436 CB LEU A 350 -2.708 11.115 -9.501 1.00 0.34 C ATOM 437 CG LEU A 350 -2.237 11.948 -8.318 1.00 0.28 C ATOM 438 CD1 LEU A 350 -2.286 13.413 -8.713 1.00 0.31 C ATOM 439 CD2 LEU A 350 -3.156 11.701 -7.128 1.00 0.36 C ATOM 0 H LEU A 350 -1.514 8.947 -9.594 1.00 0.40 H new ATOM 0 HA LEU A 350 -1.922 11.108 -11.494 1.00 0.39 H new ATOM 0 HB2 LEU A 350 -3.529 11.624 -10.006 1.00 0.34 H new ATOM 0 HB3 LEU A 350 -3.095 10.160 -9.147 1.00 0.34 H new ATOM 0 HG LEU A 350 -1.219 11.673 -8.042 1.00 0.28 H new ATOM 0 HD11 LEU A 350 -1.951 14.027 -7.877 1.00 0.31 H new ATOM 0 HD12 LEU A 350 -1.634 13.581 -9.570 1.00 0.31 H new ATOM 0 HD13 LEU A 350 -3.308 13.685 -8.976 1.00 0.31 H new ATOM 0 HD21 LEU A 350 -2.820 12.297 -6.279 1.00 0.36 H new ATOM 0 HD22 LEU A 350 -4.175 11.985 -7.390 1.00 0.36 H new ATOM 0 HD23 LEU A 350 -3.131 10.644 -6.862 1.00 0.36 H new ATOM 451 N LYS A 351 0.552 11.311 -9.406 1.00 0.38 N ATOM 452 CA LYS A 351 1.758 12.126 -9.097 1.00 0.43 C ATOM 453 C LYS A 351 2.593 12.262 -10.360 1.00 0.54 C ATOM 454 O LYS A 351 3.158 13.299 -10.644 1.00 0.59 O ATOM 455 CB LYS A 351 2.584 11.444 -8.004 1.00 0.46 C ATOM 456 CG LYS A 351 3.512 12.472 -7.352 1.00 0.57 C ATOM 457 CD LYS A 351 4.501 11.758 -6.428 1.00 0.75 C ATOM 458 CE LYS A 351 4.617 12.528 -5.111 1.00 1.39 C ATOM 459 NZ LYS A 351 5.880 12.144 -4.420 1.00 1.73 N ATOM 0 H LYS A 351 0.512 10.402 -8.945 1.00 0.38 H new ATOM 0 HA LYS A 351 1.454 13.111 -8.743 1.00 0.43 H new ATOM 0 HB2 LYS A 351 1.925 11.006 -7.255 1.00 0.46 H new ATOM 0 HB3 LYS A 351 3.169 10.629 -8.430 1.00 0.46 H new ATOM 0 HG2 LYS A 351 4.052 13.028 -8.119 1.00 0.57 H new ATOM 0 HG3 LYS A 351 2.927 13.197 -6.785 1.00 0.57 H new ATOM 0 HD2 LYS A 351 4.166 10.739 -6.237 1.00 0.75 H new ATOM 0 HD3 LYS A 351 5.477 11.688 -6.908 1.00 0.75 H new ATOM 0 HE2 LYS A 351 4.607 13.601 -5.303 1.00 1.39 H new ATOM 0 HE3 LYS A 351 3.760 12.310 -4.473 1.00 1.39 H new ATOM 0 HZ1 LYS A 351 5.959 12.667 -3.525 1.00 1.73 H new ATOM 0 HZ2 LYS A 351 5.872 11.123 -4.224 1.00 1.73 H new ATOM 0 HZ3 LYS A 351 6.692 12.374 -5.028 1.00 1.73 H new ATOM 473 N ASP A 352 2.662 11.218 -11.125 1.00 0.60 N ATOM 474 CA ASP A 352 3.451 11.277 -12.389 1.00 0.72 C ATOM 475 C ASP A 352 2.757 12.226 -13.370 1.00 0.77 C ATOM 476 O ASP A 352 3.394 12.875 -14.176 1.00 0.92 O ATOM 477 CB ASP A 352 3.545 9.880 -13.006 1.00 0.74 C ATOM 478 CG ASP A 352 4.923 9.697 -13.646 1.00 1.05 C ATOM 479 OD1 ASP A 352 5.667 10.664 -13.692 1.00 1.58 O ATOM 480 OD2 ASP A 352 5.212 8.594 -14.079 1.00 1.65 O ATOM 0 H ASP A 352 2.209 10.324 -10.935 1.00 0.60 H new ATOM 0 HA ASP A 352 4.456 11.640 -12.175 1.00 0.72 H new ATOM 0 HB2 ASP A 352 3.384 9.121 -12.240 1.00 0.74 H new ATOM 0 HB3 ASP A 352 2.764 9.748 -13.755 1.00 0.74 H new ATOM 485 N ALA A 353 1.454 12.311 -13.309 1.00 0.69 N ATOM 486 CA ALA A 353 0.720 13.219 -14.240 1.00 0.78 C ATOM 487 C ALA A 353 0.714 14.642 -13.679 1.00 0.80 C ATOM 488 O ALA A 353 0.496 15.603 -14.390 1.00 1.30 O ATOM 489 CB ALA A 353 -0.719 12.731 -14.398 1.00 0.77 C ATOM 0 H ALA A 353 0.867 11.792 -12.656 1.00 0.69 H new ATOM 0 HA ALA A 353 1.217 13.216 -15.210 1.00 0.78 H new ATOM 0 HB1 ALA A 353 -1.255 13.393 -15.077 1.00 0.77 H new ATOM 0 HB2 ALA A 353 -0.718 11.719 -14.803 1.00 0.77 H new ATOM 0 HB3 ALA A 353 -1.212 12.732 -13.426 1.00 0.77 H new ATOM 495 N GLN A 354 0.955 14.779 -12.410 1.00 0.68 N ATOM 496 CA GLN A 354 0.972 16.134 -11.786 1.00 0.65 C ATOM 497 C GLN A 354 1.810 17.083 -12.646 1.00 1.12 C ATOM 498 O GLN A 354 2.845 16.713 -13.164 1.00 1.51 O ATOM 499 CB GLN A 354 1.583 16.032 -10.396 1.00 0.53 C ATOM 500 CG GLN A 354 0.454 15.881 -9.384 1.00 0.46 C ATOM 501 CD GLN A 354 0.850 16.563 -8.080 1.00 0.66 C ATOM 502 OE1 GLN A 354 1.921 16.327 -7.556 1.00 1.64 O ATOM 503 NE2 GLN A 354 0.027 17.408 -7.532 1.00 0.69 N ATOM 0 H GLN A 354 1.143 14.007 -11.770 1.00 0.68 H new ATOM 0 HA GLN A 354 -0.045 16.519 -11.714 1.00 0.65 H new ATOM 0 HB2 GLN A 354 2.259 15.178 -10.340 1.00 0.53 H new ATOM 0 HB3 GLN A 354 2.174 16.921 -10.175 1.00 0.53 H new ATOM 0 HG2 GLN A 354 -0.462 16.324 -9.775 1.00 0.46 H new ATOM 0 HG3 GLN A 354 0.248 14.825 -9.207 1.00 0.46 H new ATOM 0 HE21 GLN A 354 -0.871 17.605 -7.974 1.00 0.69 H new ATOM 0 HE22 GLN A 354 0.280 17.874 -6.661 1.00 0.69 H new ATOM 512 N ALA A 355 1.375 18.304 -12.804 1.00 1.70 N ATOM 513 CA ALA A 355 2.154 19.269 -13.631 1.00 2.14 C ATOM 514 C ALA A 355 1.397 20.596 -13.716 1.00 2.68 C ATOM 515 O ALA A 355 2.047 21.628 -13.699 1.00 3.11 O ATOM 516 CB ALA A 355 2.345 18.700 -15.038 1.00 2.63 C ATOM 517 OXT ALA A 355 0.181 20.557 -13.798 1.00 3.15 O ATOM 0 H ALA A 355 0.516 18.674 -12.397 1.00 1.70 H new ATOM 0 HA ALA A 355 3.128 19.435 -13.172 1.00 2.14 H new ATOM 0 HB1 ALA A 355 2.915 19.406 -15.642 1.00 2.63 H new ATOM 0 HB2 ALA A 355 2.885 17.755 -14.978 1.00 2.63 H new ATOM 0 HB3 ALA A 355 1.371 18.532 -15.498 1.00 2.63 H new TER 523 ALA A 355 ATOM 524 N GLY B 325 -14.310 -14.602 -7.170 1.00 1.57 N ATOM 525 CA GLY B 325 -13.328 -13.568 -7.602 1.00 0.97 C ATOM 526 C GLY B 325 -12.712 -13.975 -8.942 1.00 0.89 C ATOM 527 O GLY B 325 -12.852 -15.098 -9.384 1.00 1.09 O ATOM 0 HA2 GLY B 325 -13.821 -12.600 -7.696 1.00 0.97 H new ATOM 0 HA3 GLY B 325 -12.547 -13.457 -6.850 1.00 0.97 H new ATOM 533 N GLU B 326 -12.032 -13.071 -9.592 1.00 0.72 N ATOM 534 CA GLU B 326 -11.408 -13.408 -10.903 1.00 0.74 C ATOM 535 C GLU B 326 -9.919 -13.058 -10.864 1.00 0.67 C ATOM 536 O GLU B 326 -9.372 -12.740 -9.826 1.00 0.66 O ATOM 537 CB GLU B 326 -12.091 -12.608 -12.014 1.00 0.88 C ATOM 538 CG GLU B 326 -13.051 -13.518 -12.783 1.00 1.17 C ATOM 539 CD GLU B 326 -13.246 -12.975 -14.200 1.00 1.36 C ATOM 540 OE1 GLU B 326 -12.878 -11.835 -14.432 1.00 2.13 O ATOM 541 OE2 GLU B 326 -13.759 -13.708 -15.029 1.00 1.71 O ATOM 0 H GLU B 326 -11.881 -12.114 -9.272 1.00 0.72 H new ATOM 0 HA GLU B 326 -11.526 -14.474 -11.098 1.00 0.74 H new ATOM 0 HB2 GLU B 326 -12.635 -11.765 -11.588 1.00 0.88 H new ATOM 0 HB3 GLU B 326 -11.344 -12.195 -12.691 1.00 0.88 H new ATOM 0 HG2 GLU B 326 -12.654 -14.532 -12.823 1.00 1.17 H new ATOM 0 HG3 GLU B 326 -14.010 -13.571 -12.267 1.00 1.17 H new ATOM 548 N TYR B 327 -9.258 -13.116 -11.989 1.00 0.65 N ATOM 549 CA TYR B 327 -7.805 -12.789 -12.018 1.00 0.59 C ATOM 550 C TYR B 327 -7.610 -11.371 -12.562 1.00 0.52 C ATOM 551 O TYR B 327 -7.962 -11.074 -13.687 1.00 0.61 O ATOM 552 CB TYR B 327 -7.077 -13.786 -12.923 1.00 0.67 C ATOM 553 CG TYR B 327 -6.534 -14.922 -12.090 1.00 0.78 C ATOM 554 CD1 TYR B 327 -7.400 -15.902 -11.591 1.00 1.30 C ATOM 555 CD2 TYR B 327 -5.163 -14.996 -11.817 1.00 1.63 C ATOM 556 CE1 TYR B 327 -6.896 -16.955 -10.819 1.00 1.34 C ATOM 557 CE2 TYR B 327 -4.658 -16.049 -11.044 1.00 1.86 C ATOM 558 CZ TYR B 327 -5.525 -17.029 -10.546 1.00 1.23 C ATOM 559 OH TYR B 327 -5.028 -18.067 -9.785 1.00 1.50 O ATOM 0 H TYR B 327 -9.662 -13.376 -12.889 1.00 0.65 H new ATOM 0 HA TYR B 327 -7.399 -12.849 -11.008 1.00 0.59 H new ATOM 0 HB2 TYR B 327 -7.760 -14.171 -13.680 1.00 0.67 H new ATOM 0 HB3 TYR B 327 -6.264 -13.287 -13.451 1.00 0.67 H new ATOM 0 HD1 TYR B 327 -8.458 -15.846 -11.802 1.00 1.30 H new ATOM 0 HD2 TYR B 327 -4.494 -14.241 -12.203 1.00 1.63 H new ATOM 0 HE1 TYR B 327 -7.565 -17.710 -10.434 1.00 1.34 H new ATOM 0 HE2 TYR B 327 -3.600 -16.105 -10.832 1.00 1.86 H new ATOM 0 HH TYR B 327 -4.057 -17.969 -9.692 1.00 1.50 H new ATOM 569 N PHE B 328 -7.051 -10.495 -11.774 1.00 0.45 N ATOM 570 CA PHE B 328 -6.832 -9.098 -12.245 1.00 0.40 C ATOM 571 C PHE B 328 -5.330 -8.835 -12.374 1.00 0.34 C ATOM 572 O PHE B 328 -4.526 -9.448 -11.700 1.00 0.39 O ATOM 573 CB PHE B 328 -7.433 -8.118 -11.235 1.00 0.42 C ATOM 574 CG PHE B 328 -8.937 -8.111 -11.370 1.00 0.44 C ATOM 575 CD1 PHE B 328 -9.667 -9.281 -11.132 1.00 1.44 C ATOM 576 CD2 PHE B 328 -9.600 -6.934 -11.734 1.00 1.12 C ATOM 577 CE1 PHE B 328 -11.061 -9.274 -11.257 1.00 1.50 C ATOM 578 CE2 PHE B 328 -10.995 -6.926 -11.859 1.00 1.13 C ATOM 579 CZ PHE B 328 -11.725 -8.097 -11.620 1.00 0.62 C ATOM 0 H PHE B 328 -6.736 -10.686 -10.823 1.00 0.45 H new ATOM 0 HA PHE B 328 -7.312 -8.962 -13.214 1.00 0.40 H new ATOM 0 HB2 PHE B 328 -7.150 -8.405 -10.222 1.00 0.42 H new ATOM 0 HB3 PHE B 328 -7.038 -7.117 -11.405 1.00 0.42 H new ATOM 0 HD1 PHE B 328 -9.155 -10.189 -10.852 1.00 1.44 H new ATOM 0 HD2 PHE B 328 -9.036 -6.032 -11.919 1.00 1.12 H new ATOM 0 HE1 PHE B 328 -11.624 -10.177 -11.073 1.00 1.50 H new ATOM 0 HE2 PHE B 328 -11.507 -6.018 -12.139 1.00 1.13 H new ATOM 0 HZ PHE B 328 -12.801 -8.092 -11.716 1.00 0.62 H new ATOM 589 N THR B 329 -4.943 -7.927 -13.230 1.00 0.42 N ATOM 590 CA THR B 329 -3.491 -7.629 -13.393 1.00 0.39 C ATOM 591 C THR B 329 -3.219 -6.175 -13.005 1.00 0.39 C ATOM 592 O THR B 329 -3.954 -5.277 -13.363 1.00 0.49 O ATOM 593 CB THR B 329 -3.077 -7.841 -14.851 1.00 0.38 C ATOM 594 OG1 THR B 329 -4.113 -8.526 -15.541 1.00 0.39 O ATOM 595 CG2 THR B 329 -1.792 -8.665 -14.905 1.00 0.38 C ATOM 0 H THR B 329 -5.568 -7.380 -13.822 1.00 0.42 H new ATOM 0 HA THR B 329 -2.918 -8.297 -12.750 1.00 0.39 H new ATOM 0 HB THR B 329 -2.904 -6.874 -15.324 1.00 0.38 H new ATOM 0 HG1 THR B 329 -3.850 -8.661 -16.475 1.00 0.39 H new ATOM 0 HG21 THR B 329 -1.499 -8.815 -15.944 1.00 0.38 H new ATOM 0 HG22 THR B 329 -0.998 -8.136 -14.377 1.00 0.38 H new ATOM 0 HG23 THR B 329 -1.960 -9.633 -14.432 1.00 0.38 H new ATOM 603 N LEU B 330 -2.162 -5.939 -12.284 1.00 0.32 N ATOM 604 CA LEU B 330 -1.827 -4.548 -11.876 1.00 0.33 C ATOM 605 C LEU B 330 -0.490 -4.161 -12.502 1.00 0.31 C ATOM 606 O LEU B 330 0.550 -4.265 -11.883 1.00 0.29 O ATOM 607 CB LEU B 330 -1.712 -4.482 -10.357 1.00 0.35 C ATOM 608 CG LEU B 330 -2.540 -3.321 -9.820 1.00 0.47 C ATOM 609 CD1 LEU B 330 -3.620 -3.874 -8.896 1.00 0.40 C ATOM 610 CD2 LEU B 330 -1.633 -2.372 -9.032 1.00 0.91 C ATOM 0 H LEU B 330 -1.511 -6.653 -11.957 1.00 0.32 H new ATOM 0 HA LEU B 330 -2.606 -3.863 -12.211 1.00 0.33 H new ATOM 0 HB2 LEU B 330 -2.056 -5.418 -9.917 1.00 0.35 H new ATOM 0 HB3 LEU B 330 -0.668 -4.359 -10.068 1.00 0.35 H new ATOM 0 HG LEU B 330 -3.000 -2.778 -10.646 1.00 0.47 H new ATOM 0 HD11 LEU B 330 -4.220 -3.052 -8.505 1.00 0.40 H new ATOM 0 HD12 LEU B 330 -4.260 -4.558 -9.453 1.00 0.40 H new ATOM 0 HD13 LEU B 330 -3.153 -4.408 -8.069 1.00 0.40 H new ATOM 0 HD21 LEU B 330 -2.223 -1.541 -8.647 1.00 0.91 H new ATOM 0 HD22 LEU B 330 -1.178 -2.910 -8.200 1.00 0.91 H new ATOM 0 HD23 LEU B 330 -0.851 -1.989 -9.687 1.00 0.91 H new ATOM 622 N GLN B 331 -0.505 -3.727 -13.729 1.00 0.34 N ATOM 623 CA GLN B 331 0.769 -3.350 -14.395 1.00 0.34 C ATOM 624 C GLN B 331 1.231 -1.979 -13.894 1.00 0.37 C ATOM 625 O GLN B 331 0.611 -0.969 -14.161 1.00 0.43 O ATOM 626 CB GLN B 331 0.555 -3.299 -15.908 1.00 0.36 C ATOM 627 CG GLN B 331 0.508 -4.725 -16.461 1.00 1.06 C ATOM 628 CD GLN B 331 0.866 -4.709 -17.948 1.00 1.25 C ATOM 629 OE1 GLN B 331 1.399 -3.737 -18.446 1.00 2.06 O ATOM 630 NE2 GLN B 331 0.594 -5.752 -18.683 1.00 1.37 N ATOM 0 H GLN B 331 -1.344 -3.617 -14.299 1.00 0.34 H new ATOM 0 HA GLN B 331 1.533 -4.091 -14.160 1.00 0.34 H new ATOM 0 HB2 GLN B 331 -0.374 -2.777 -16.138 1.00 0.36 H new ATOM 0 HB3 GLN B 331 1.361 -2.739 -16.382 1.00 0.36 H new ATOM 0 HG2 GLN B 331 1.205 -5.361 -15.915 1.00 1.06 H new ATOM 0 HG3 GLN B 331 -0.487 -5.148 -16.320 1.00 1.06 H new ATOM 0 HE21 GLN B 331 0.147 -6.568 -18.265 1.00 1.37 H new ATOM 0 HE22 GLN B 331 0.829 -5.752 -19.676 1.00 1.37 H new ATOM 639 N ILE B 332 2.316 -1.936 -13.170 1.00 0.37 N ATOM 640 CA ILE B 332 2.818 -0.630 -12.655 1.00 0.42 C ATOM 641 C ILE B 332 4.141 -0.287 -13.344 1.00 0.44 C ATOM 642 O ILE B 332 5.065 -1.076 -13.362 1.00 0.47 O ATOM 643 CB ILE B 332 3.042 -0.726 -11.145 1.00 0.46 C ATOM 644 CG1 ILE B 332 1.713 -1.031 -10.451 1.00 0.49 C ATOM 645 CG2 ILE B 332 3.594 0.602 -10.624 1.00 0.54 C ATOM 646 CD1 ILE B 332 1.905 -2.184 -9.464 1.00 0.47 C ATOM 0 H ILE B 332 2.877 -2.748 -12.913 1.00 0.37 H new ATOM 0 HA ILE B 332 2.084 0.148 -12.864 1.00 0.42 H new ATOM 0 HB ILE B 332 3.755 -1.523 -10.935 1.00 0.46 H new ATOM 0 HG12 ILE B 332 1.353 -0.146 -9.927 1.00 0.49 H new ATOM 0 HG13 ILE B 332 0.956 -1.293 -11.190 1.00 0.49 H new ATOM 0 HG21 ILE B 332 3.753 0.533 -9.548 1.00 0.54 H new ATOM 0 HG22 ILE B 332 4.541 0.821 -11.118 1.00 0.54 H new ATOM 0 HG23 ILE B 332 2.882 1.400 -10.835 1.00 0.54 H new ATOM 0 HD11 ILE B 332 0.958 -2.401 -8.970 1.00 0.47 H new ATOM 0 HD12 ILE B 332 2.246 -3.069 -10.001 1.00 0.47 H new ATOM 0 HD13 ILE B 332 2.648 -1.904 -8.717 1.00 0.47 H new ATOM 658 N ARG B 333 4.240 0.884 -13.912 1.00 0.50 N ATOM 659 CA ARG B 333 5.503 1.274 -14.599 1.00 0.56 C ATOM 660 C ARG B 333 6.475 1.868 -13.578 1.00 0.55 C ATOM 661 O ARG B 333 6.267 2.949 -13.064 1.00 0.84 O ATOM 662 CB ARG B 333 5.198 2.315 -15.678 1.00 0.67 C ATOM 663 CG ARG B 333 5.914 1.931 -16.974 1.00 1.46 C ATOM 664 CD ARG B 333 5.811 3.084 -17.975 1.00 1.66 C ATOM 665 NE ARG B 333 6.429 4.306 -17.389 1.00 2.46 N ATOM 666 CZ ARG B 333 5.971 5.486 -17.707 1.00 2.75 C ATOM 667 NH1 ARG B 333 6.068 5.914 -18.936 1.00 3.29 N ATOM 668 NH2 ARG B 333 5.417 6.238 -16.796 1.00 3.09 N ATOM 0 H ARG B 333 3.501 1.587 -13.930 1.00 0.50 H new ATOM 0 HA ARG B 333 5.952 0.394 -15.061 1.00 0.56 H new ATOM 0 HB2 ARG B 333 4.123 2.374 -15.848 1.00 0.67 H new ATOM 0 HB3 ARG B 333 5.524 3.302 -15.349 1.00 0.67 H new ATOM 0 HG2 ARG B 333 6.961 1.705 -16.770 1.00 1.46 H new ATOM 0 HG3 ARG B 333 5.469 1.029 -17.395 1.00 1.46 H new ATOM 0 HD2 ARG B 333 6.314 2.819 -18.905 1.00 1.66 H new ATOM 0 HD3 ARG B 333 4.766 3.274 -18.221 1.00 1.66 H new ATOM 0 HE ARG B 333 7.210 4.221 -16.739 1.00 2.46 H new ATOM 0 HH11 ARG B 333 6.502 5.326 -19.648 1.00 3.29 H new ATOM 0 HH12 ARG B 333 5.710 6.836 -19.185 1.00 3.29 H new ATOM 0 HH21 ARG B 333 5.342 5.904 -15.835 1.00 3.09 H new ATOM 0 HH22 ARG B 333 5.059 7.160 -17.045 1.00 3.09 H new ATOM 682 N GLY B 334 7.537 1.170 -13.279 1.00 0.54 N ATOM 683 CA GLY B 334 8.520 1.696 -12.291 1.00 0.50 C ATOM 684 C GLY B 334 9.302 0.532 -11.679 1.00 0.49 C ATOM 685 O GLY B 334 9.733 -0.370 -12.369 1.00 0.59 O ATOM 0 H GLY B 334 7.766 0.259 -13.676 1.00 0.54 H new ATOM 0 HA2 GLY B 334 9.204 2.391 -12.778 1.00 0.50 H new ATOM 0 HA3 GLY B 334 8.003 2.252 -11.509 1.00 0.50 H new ATOM 689 N ARG B 335 9.486 0.544 -10.388 1.00 0.46 N ATOM 690 CA ARG B 335 10.238 -0.561 -9.731 1.00 0.47 C ATOM 691 C ARG B 335 10.030 -0.483 -8.218 1.00 0.43 C ATOM 692 O ARG B 335 9.655 -1.448 -7.582 1.00 0.46 O ATOM 693 CB ARG B 335 11.728 -0.427 -10.049 1.00 0.52 C ATOM 694 CG ARG B 335 12.443 -1.738 -9.715 1.00 0.59 C ATOM 695 CD ARG B 335 13.676 -1.889 -10.606 1.00 0.81 C ATOM 696 NE ARG B 335 13.918 -3.334 -10.879 1.00 0.89 N ATOM 697 CZ ARG B 335 15.139 -3.784 -10.978 1.00 1.23 C ATOM 698 NH1 ARG B 335 15.781 -3.684 -12.110 1.00 2.04 N ATOM 699 NH2 ARG B 335 15.719 -4.333 -9.946 1.00 1.57 N ATOM 0 H ARG B 335 9.148 1.272 -9.759 1.00 0.46 H new ATOM 0 HA ARG B 335 9.875 -1.520 -10.102 1.00 0.47 H new ATOM 0 HB2 ARG B 335 11.865 -0.184 -11.103 1.00 0.52 H new ATOM 0 HB3 ARG B 335 12.161 0.392 -9.474 1.00 0.52 H new ATOM 0 HG2 ARG B 335 12.737 -1.747 -8.665 1.00 0.59 H new ATOM 0 HG3 ARG B 335 11.768 -2.581 -9.864 1.00 0.59 H new ATOM 0 HD2 ARG B 335 13.529 -1.351 -11.542 1.00 0.81 H new ATOM 0 HD3 ARG B 335 14.546 -1.449 -10.119 1.00 0.81 H new ATOM 0 HE ARG B 335 13.129 -3.971 -10.988 1.00 0.89 H new ATOM 0 HH11 ARG B 335 15.328 -3.254 -12.917 1.00 2.04 H new ATOM 0 HH12 ARG B 335 16.735 -4.036 -12.188 1.00 2.04 H new ATOM 0 HH21 ARG B 335 15.218 -4.411 -9.061 1.00 1.57 H new ATOM 0 HH22 ARG B 335 16.673 -4.684 -10.024 1.00 1.57 H new ATOM 713 N GLU B 336 10.269 0.660 -7.636 1.00 0.43 N ATOM 714 CA GLU B 336 10.081 0.800 -6.166 1.00 0.43 C ATOM 715 C GLU B 336 8.590 0.721 -5.836 1.00 0.37 C ATOM 716 O GLU B 336 8.173 -0.039 -4.986 1.00 0.38 O ATOM 717 CB GLU B 336 10.637 2.150 -5.706 1.00 0.47 C ATOM 718 CG GLU B 336 12.063 1.964 -5.187 1.00 1.18 C ATOM 719 CD GLU B 336 12.689 3.332 -4.911 1.00 1.64 C ATOM 720 OE1 GLU B 336 12.679 4.158 -5.809 1.00 2.25 O ATOM 721 OE2 GLU B 336 13.169 3.531 -3.807 1.00 2.15 O ATOM 0 H GLU B 336 10.586 1.502 -8.116 1.00 0.43 H new ATOM 0 HA GLU B 336 10.610 -0.003 -5.652 1.00 0.43 H new ATOM 0 HB2 GLU B 336 10.629 2.859 -6.533 1.00 0.47 H new ATOM 0 HB3 GLU B 336 10.005 2.568 -4.922 1.00 0.47 H new ATOM 0 HG2 GLU B 336 12.054 1.366 -4.276 1.00 1.18 H new ATOM 0 HG3 GLU B 336 12.660 1.420 -5.919 1.00 1.18 H new ATOM 728 N ARG B 337 7.782 1.498 -6.506 1.00 0.39 N ATOM 729 CA ARG B 337 6.319 1.461 -6.232 1.00 0.36 C ATOM 730 C ARG B 337 5.813 0.025 -6.389 1.00 0.33 C ATOM 731 O ARG B 337 5.034 -0.460 -5.592 1.00 0.34 O ATOM 732 CB ARG B 337 5.589 2.375 -7.219 1.00 0.39 C ATOM 733 CG ARG B 337 5.255 3.701 -6.533 1.00 0.66 C ATOM 734 CD ARG B 337 4.575 4.637 -7.533 1.00 0.42 C ATOM 735 NE ARG B 337 5.407 4.738 -8.765 1.00 1.04 N ATOM 736 CZ ARG B 337 5.782 5.908 -9.205 1.00 1.25 C ATOM 737 NH1 ARG B 337 6.673 6.597 -8.546 1.00 1.85 N ATOM 738 NH2 ARG B 337 5.267 6.389 -10.303 1.00 1.95 N ATOM 0 H ARG B 337 8.072 2.155 -7.230 1.00 0.39 H new ATOM 0 HA ARG B 337 6.128 1.806 -5.216 1.00 0.36 H new ATOM 0 HB2 ARG B 337 6.212 2.553 -8.095 1.00 0.39 H new ATOM 0 HB3 ARG B 337 4.676 1.894 -7.570 1.00 0.39 H new ATOM 0 HG2 ARG B 337 4.600 3.526 -5.680 1.00 0.66 H new ATOM 0 HG3 ARG B 337 6.164 4.162 -6.148 1.00 0.66 H new ATOM 0 HD2 ARG B 337 3.582 4.262 -7.782 1.00 0.42 H new ATOM 0 HD3 ARG B 337 4.441 5.624 -7.090 1.00 0.42 H new ATOM 0 HE ARG B 337 5.683 3.893 -9.264 1.00 1.04 H new ATOM 0 HH11 ARG B 337 7.076 6.221 -7.688 1.00 1.85 H new ATOM 0 HH12 ARG B 337 6.967 7.512 -8.889 1.00 1.85 H new ATOM 0 HH21 ARG B 337 4.571 5.851 -10.818 1.00 1.95 H new ATOM 0 HH22 ARG B 337 5.561 7.304 -10.646 1.00 1.95 H new ATOM 752 N PHE B 338 6.255 -0.661 -7.408 1.00 0.32 N ATOM 753 CA PHE B 338 5.804 -2.068 -7.609 1.00 0.31 C ATOM 754 C PHE B 338 6.156 -2.887 -6.368 1.00 0.29 C ATOM 755 O PHE B 338 5.405 -3.741 -5.943 1.00 0.31 O ATOM 756 CB PHE B 338 6.509 -2.661 -8.830 1.00 0.33 C ATOM 757 CG PHE B 338 6.099 -4.105 -8.994 1.00 0.36 C ATOM 758 CD1 PHE B 338 4.851 -4.419 -9.546 1.00 1.29 C ATOM 759 CD2 PHE B 338 6.964 -5.129 -8.592 1.00 1.15 C ATOM 760 CE1 PHE B 338 4.469 -5.757 -9.696 1.00 1.36 C ATOM 761 CE2 PHE B 338 6.582 -6.467 -8.742 1.00 1.15 C ATOM 762 CZ PHE B 338 5.335 -6.781 -9.294 1.00 0.59 C ATOM 0 H PHE B 338 6.907 -0.309 -8.109 1.00 0.32 H new ATOM 0 HA PHE B 338 4.726 -2.090 -7.770 1.00 0.31 H new ATOM 0 HB2 PHE B 338 6.250 -2.094 -9.724 1.00 0.33 H new ATOM 0 HB3 PHE B 338 7.590 -2.590 -8.710 1.00 0.33 H new ATOM 0 HD1 PHE B 338 4.183 -3.629 -9.856 1.00 1.29 H new ATOM 0 HD2 PHE B 338 7.926 -4.887 -8.166 1.00 1.15 H new ATOM 0 HE1 PHE B 338 3.507 -6.000 -10.122 1.00 1.36 H new ATOM 0 HE2 PHE B 338 7.250 -7.257 -8.432 1.00 1.15 H new ATOM 0 HZ PHE B 338 5.041 -7.814 -9.410 1.00 0.59 H new ATOM 772 N GLU B 339 7.293 -2.631 -5.780 1.00 0.32 N ATOM 773 CA GLU B 339 7.687 -3.391 -4.562 1.00 0.33 C ATOM 774 C GLU B 339 6.716 -3.057 -3.430 1.00 0.30 C ATOM 775 O GLU B 339 6.253 -3.926 -2.718 1.00 0.30 O ATOM 776 CB GLU B 339 9.108 -2.999 -4.150 1.00 0.40 C ATOM 777 CG GLU B 339 10.100 -3.482 -5.209 1.00 0.54 C ATOM 778 CD GLU B 339 11.439 -3.808 -4.545 1.00 0.93 C ATOM 779 OE1 GLU B 339 11.700 -3.262 -3.485 1.00 1.61 O ATOM 780 OE2 GLU B 339 12.180 -4.596 -5.107 1.00 1.47 O ATOM 0 H GLU B 339 7.965 -1.929 -6.091 1.00 0.32 H new ATOM 0 HA GLU B 339 7.656 -4.460 -4.770 1.00 0.33 H new ATOM 0 HB2 GLU B 339 9.179 -1.917 -4.037 1.00 0.40 H new ATOM 0 HB3 GLU B 339 9.351 -3.438 -3.182 1.00 0.40 H new ATOM 0 HG2 GLU B 339 9.708 -4.365 -5.714 1.00 0.54 H new ATOM 0 HG3 GLU B 339 10.237 -2.714 -5.971 1.00 0.54 H new ATOM 787 N MET B 340 6.396 -1.802 -3.264 1.00 0.31 N ATOM 788 CA MET B 340 5.447 -1.412 -2.185 1.00 0.31 C ATOM 789 C MET B 340 4.209 -2.304 -2.265 1.00 0.26 C ATOM 790 O MET B 340 3.864 -2.992 -1.325 1.00 0.28 O ATOM 791 CB MET B 340 5.033 0.048 -2.377 1.00 0.35 C ATOM 792 CG MET B 340 5.916 0.951 -1.514 1.00 0.35 C ATOM 793 SD MET B 340 5.815 2.653 -2.121 1.00 0.64 S ATOM 794 CE MET B 340 4.039 2.667 -2.470 1.00 0.38 C ATOM 0 H MET B 340 6.751 -1.031 -3.829 1.00 0.31 H new ATOM 0 HA MET B 340 5.925 -1.529 -1.212 1.00 0.31 H new ATOM 0 HB2 MET B 340 5.126 0.328 -3.426 1.00 0.35 H new ATOM 0 HB3 MET B 340 3.986 0.178 -2.104 1.00 0.35 H new ATOM 0 HG2 MET B 340 5.594 0.905 -0.474 1.00 0.35 H new ATOM 0 HG3 MET B 340 6.949 0.604 -1.544 1.00 0.35 H new ATOM 0 HE1 MET B 340 3.668 3.691 -2.428 1.00 0.38 H new ATOM 0 HE2 MET B 340 3.860 2.256 -3.464 1.00 0.38 H new ATOM 0 HE3 MET B 340 3.518 2.062 -1.728 1.00 0.38 H new ATOM 804 N PHE B 341 3.542 -2.300 -3.386 1.00 0.27 N ATOM 805 CA PHE B 341 2.330 -3.150 -3.534 1.00 0.28 C ATOM 806 C PHE B 341 2.719 -4.614 -3.333 1.00 0.29 C ATOM 807 O PHE B 341 1.952 -5.407 -2.823 1.00 0.36 O ATOM 808 CB PHE B 341 1.749 -2.968 -4.938 1.00 0.31 C ATOM 809 CG PHE B 341 1.024 -1.646 -5.019 1.00 0.29 C ATOM 810 CD1 PHE B 341 0.183 -1.241 -3.976 1.00 1.22 C ATOM 811 CD2 PHE B 341 1.194 -0.824 -6.140 1.00 1.27 C ATOM 812 CE1 PHE B 341 -0.489 -0.015 -4.053 1.00 1.21 C ATOM 813 CE2 PHE B 341 0.523 0.402 -6.217 1.00 1.30 C ATOM 814 CZ PHE B 341 -0.319 0.806 -5.174 1.00 0.36 C ATOM 0 H PHE B 341 3.785 -1.744 -4.206 1.00 0.27 H new ATOM 0 HA PHE B 341 1.585 -2.861 -2.793 1.00 0.28 H new ATOM 0 HB2 PHE B 341 2.547 -3.003 -5.680 1.00 0.31 H new ATOM 0 HB3 PHE B 341 1.064 -3.784 -5.168 1.00 0.31 H new ATOM 0 HD1 PHE B 341 0.052 -1.875 -3.111 1.00 1.22 H new ATOM 0 HD2 PHE B 341 1.843 -1.136 -6.945 1.00 1.27 H new ATOM 0 HE1 PHE B 341 -1.138 0.297 -3.248 1.00 1.21 H new ATOM 0 HE2 PHE B 341 0.655 1.036 -7.081 1.00 1.30 H new ATOM 0 HZ PHE B 341 -0.838 1.751 -5.234 1.00 0.36 H new ATOM 824 N ARG B 342 3.908 -4.978 -3.728 1.00 0.28 N ATOM 825 CA ARG B 342 4.350 -6.389 -3.558 1.00 0.31 C ATOM 826 C ARG B 342 4.299 -6.758 -2.075 1.00 0.31 C ATOM 827 O ARG B 342 3.982 -7.873 -1.714 1.00 0.36 O ATOM 828 CB ARG B 342 5.780 -6.542 -4.078 1.00 0.35 C ATOM 829 CG ARG B 342 5.780 -7.451 -5.309 1.00 0.52 C ATOM 830 CD ARG B 342 7.067 -8.278 -5.335 1.00 0.84 C ATOM 831 NE ARG B 342 6.727 -9.728 -5.304 1.00 1.26 N ATOM 832 CZ ARG B 342 7.606 -10.613 -5.687 1.00 1.75 C ATOM 833 NH1 ARG B 342 7.737 -10.897 -6.954 1.00 2.37 N ATOM 834 NH2 ARG B 342 8.356 -11.213 -4.803 1.00 2.36 N ATOM 0 H ARG B 342 4.592 -4.358 -4.161 1.00 0.28 H new ATOM 0 HA ARG B 342 3.691 -7.050 -4.120 1.00 0.31 H new ATOM 0 HB2 ARG B 342 6.192 -5.566 -4.333 1.00 0.35 H new ATOM 0 HB3 ARG B 342 6.418 -6.964 -3.301 1.00 0.35 H new ATOM 0 HG2 ARG B 342 4.912 -8.110 -5.287 1.00 0.52 H new ATOM 0 HG3 ARG B 342 5.702 -6.852 -6.216 1.00 0.52 H new ATOM 0 HD2 ARG B 342 7.642 -8.048 -6.232 1.00 0.84 H new ATOM 0 HD3 ARG B 342 7.693 -8.022 -4.480 1.00 0.84 H new ATOM 0 HE ARG B 342 5.807 -10.029 -4.983 1.00 1.26 H new ATOM 0 HH11 ARG B 342 7.152 -10.427 -7.645 1.00 2.37 H new ATOM 0 HH12 ARG B 342 8.424 -11.589 -7.253 1.00 2.37 H new ATOM 0 HH21 ARG B 342 8.255 -10.990 -3.813 1.00 2.36 H new ATOM 0 HH22 ARG B 342 9.043 -11.905 -5.102 1.00 2.36 H new ATOM 848 N GLU B 343 4.602 -5.827 -1.211 1.00 0.28 N ATOM 849 CA GLU B 343 4.561 -6.126 0.247 1.00 0.29 C ATOM 850 C GLU B 343 3.104 -6.289 0.680 1.00 0.24 C ATOM 851 O GLU B 343 2.725 -7.292 1.251 1.00 0.27 O ATOM 852 CB GLU B 343 5.203 -4.978 1.029 1.00 0.34 C ATOM 853 CG GLU B 343 5.499 -5.439 2.457 1.00 0.38 C ATOM 854 CD GLU B 343 6.966 -5.861 2.565 1.00 0.80 C ATOM 855 OE1 GLU B 343 7.821 -5.045 2.260 1.00 1.32 O ATOM 856 OE2 GLU B 343 7.209 -6.993 2.950 1.00 1.62 O ATOM 0 H GLU B 343 4.876 -4.874 -1.452 1.00 0.28 H new ATOM 0 HA GLU B 343 5.112 -7.045 0.448 1.00 0.29 H new ATOM 0 HB2 GLU B 343 6.124 -4.660 0.540 1.00 0.34 H new ATOM 0 HB3 GLU B 343 4.536 -4.116 1.044 1.00 0.34 H new ATOM 0 HG2 GLU B 343 5.289 -4.634 3.161 1.00 0.38 H new ATOM 0 HG3 GLU B 343 4.849 -6.273 2.723 1.00 0.38 H new ATOM 863 N LEU B 344 2.280 -5.315 0.401 1.00 0.24 N ATOM 864 CA LEU B 344 0.846 -5.428 0.786 1.00 0.26 C ATOM 865 C LEU B 344 0.269 -6.691 0.144 1.00 0.28 C ATOM 866 O LEU B 344 -0.736 -7.219 0.576 1.00 0.44 O ATOM 867 CB LEU B 344 0.072 -4.203 0.281 1.00 0.33 C ATOM 868 CG LEU B 344 0.525 -2.931 1.009 1.00 0.27 C ATOM 869 CD1 LEU B 344 0.836 -3.238 2.476 1.00 0.31 C ATOM 870 CD2 LEU B 344 1.772 -2.375 0.322 1.00 0.39 C ATOM 0 H LEU B 344 2.537 -4.450 -0.075 1.00 0.24 H new ATOM 0 HA LEU B 344 0.758 -5.480 1.871 1.00 0.26 H new ATOM 0 HB2 LEU B 344 0.226 -4.087 -0.792 1.00 0.33 H new ATOM 0 HB3 LEU B 344 -0.996 -4.354 0.435 1.00 0.33 H new ATOM 0 HG LEU B 344 -0.277 -2.193 0.971 1.00 0.27 H new ATOM 0 HD11 LEU B 344 1.156 -2.325 2.979 1.00 0.31 H new ATOM 0 HD12 LEU B 344 -0.058 -3.627 2.964 1.00 0.31 H new ATOM 0 HD13 LEU B 344 1.632 -3.981 2.531 1.00 0.31 H new ATOM 0 HD21 LEU B 344 2.098 -1.471 0.836 1.00 0.39 H new ATOM 0 HD22 LEU B 344 2.568 -3.119 0.356 1.00 0.39 H new ATOM 0 HD23 LEU B 344 1.540 -2.139 -0.717 1.00 0.39 H new ATOM 882 N ASN B 345 0.906 -7.177 -0.887 1.00 0.40 N ATOM 883 CA ASN B 345 0.413 -8.406 -1.570 1.00 0.49 C ATOM 884 C ASN B 345 0.936 -9.638 -0.832 1.00 0.44 C ATOM 885 O ASN B 345 0.282 -10.659 -0.765 1.00 0.48 O ATOM 886 CB ASN B 345 0.934 -8.425 -3.008 1.00 0.65 C ATOM 887 CG ASN B 345 -0.239 -8.425 -3.990 1.00 0.94 C ATOM 888 OD1 ASN B 345 -1.384 -8.354 -3.590 1.00 1.77 O ATOM 889 ND2 ASN B 345 0.006 -8.506 -5.270 1.00 1.30 N ATOM 0 H ASN B 345 1.752 -6.772 -1.287 1.00 0.40 H new ATOM 0 HA ASN B 345 -0.677 -8.413 -1.571 1.00 0.49 H new ATOM 0 HB2 ASN B 345 1.567 -7.556 -3.185 1.00 0.65 H new ATOM 0 HB3 ASN B 345 1.553 -9.308 -3.168 1.00 0.65 H new ATOM 0 HD21 ASN B 345 -0.765 -8.510 -5.938 1.00 1.30 H new ATOM 0 HD22 ASN B 345 0.969 -8.565 -5.602 1.00 1.30 H new ATOM 896 N GLU B 346 2.116 -9.552 -0.283 1.00 0.38 N ATOM 897 CA GLU B 346 2.686 -10.718 0.445 1.00 0.38 C ATOM 898 C GLU B 346 1.865 -10.983 1.707 1.00 0.33 C ATOM 899 O GLU B 346 1.624 -12.115 2.073 1.00 0.38 O ATOM 900 CB GLU B 346 4.135 -10.417 0.833 1.00 0.40 C ATOM 901 CG GLU B 346 4.950 -11.712 0.807 1.00 0.87 C ATOM 902 CD GLU B 346 6.394 -11.399 0.408 1.00 1.11 C ATOM 903 OE1 GLU B 346 7.148 -10.979 1.270 1.00 1.59 O ATOM 904 OE2 GLU B 346 6.721 -11.585 -0.752 1.00 1.89 O ATOM 0 H GLU B 346 2.710 -8.723 -0.308 1.00 0.38 H new ATOM 0 HA GLU B 346 2.657 -11.598 -0.198 1.00 0.38 H new ATOM 0 HB2 GLU B 346 4.564 -9.691 0.143 1.00 0.40 H new ATOM 0 HB3 GLU B 346 4.171 -9.972 1.827 1.00 0.40 H new ATOM 0 HG2 GLU B 346 4.927 -12.188 1.787 1.00 0.87 H new ATOM 0 HG3 GLU B 346 4.511 -12.416 0.100 1.00 0.87 H new ATOM 911 N ALA B 347 1.434 -9.947 2.376 1.00 0.27 N ATOM 912 CA ALA B 347 0.631 -10.143 3.616 1.00 0.25 C ATOM 913 C ALA B 347 -0.779 -10.611 3.248 1.00 0.27 C ATOM 914 O ALA B 347 -1.245 -11.631 3.715 1.00 0.30 O ATOM 915 CB ALA B 347 0.545 -8.822 4.383 1.00 0.27 C ATOM 0 H ALA B 347 1.603 -8.975 2.117 1.00 0.27 H new ATOM 0 HA ALA B 347 1.111 -10.897 4.241 1.00 0.25 H new ATOM 0 HB1 ALA B 347 -0.042 -8.965 5.290 1.00 0.27 H new ATOM 0 HB2 ALA B 347 1.548 -8.490 4.649 1.00 0.27 H new ATOM 0 HB3 ALA B 347 0.068 -8.068 3.757 1.00 0.27 H new ATOM 921 N LEU B 348 -1.463 -9.875 2.416 1.00 0.30 N ATOM 922 CA LEU B 348 -2.841 -10.285 2.024 1.00 0.38 C ATOM 923 C LEU B 348 -2.823 -11.748 1.582 1.00 0.42 C ATOM 924 O LEU B 348 -3.564 -12.569 2.085 1.00 0.47 O ATOM 925 CB LEU B 348 -3.326 -9.408 0.867 1.00 0.42 C ATOM 926 CG LEU B 348 -3.336 -7.944 1.308 1.00 0.42 C ATOM 927 CD1 LEU B 348 -3.555 -7.045 0.090 1.00 0.49 C ATOM 928 CD2 LEU B 348 -4.468 -7.723 2.314 1.00 0.49 C ATOM 0 H LEU B 348 -1.129 -9.010 1.992 1.00 0.30 H new ATOM 0 HA LEU B 348 -3.514 -10.166 2.873 1.00 0.38 H new ATOM 0 HB2 LEU B 348 -2.674 -9.534 0.003 1.00 0.42 H new ATOM 0 HB3 LEU B 348 -4.326 -9.713 0.559 1.00 0.42 H new ATOM 0 HG LEU B 348 -2.381 -7.699 1.774 1.00 0.42 H new ATOM 0 HD11 LEU B 348 -3.562 -6.001 0.405 1.00 0.49 H new ATOM 0 HD12 LEU B 348 -2.750 -7.202 -0.628 1.00 0.49 H new ATOM 0 HD13 LEU B 348 -4.509 -7.290 -0.376 1.00 0.49 H new ATOM 0 HD21 LEU B 348 -4.476 -6.680 2.629 1.00 0.49 H new ATOM 0 HD22 LEU B 348 -5.422 -7.969 1.848 1.00 0.49 H new ATOM 0 HD23 LEU B 348 -4.313 -8.363 3.183 1.00 0.49 H new ATOM 940 N GLU B 349 -1.977 -12.081 0.647 1.00 0.44 N ATOM 941 CA GLU B 349 -1.905 -13.491 0.177 1.00 0.52 C ATOM 942 C GLU B 349 -1.564 -14.395 1.361 1.00 0.49 C ATOM 943 O GLU B 349 -1.961 -15.542 1.415 1.00 0.58 O ATOM 944 CB GLU B 349 -0.819 -13.618 -0.894 1.00 0.57 C ATOM 945 CG GLU B 349 -1.177 -14.755 -1.852 1.00 0.99 C ATOM 946 CD GLU B 349 -0.445 -14.552 -3.180 1.00 0.92 C ATOM 947 OE1 GLU B 349 -0.976 -13.851 -4.026 1.00 1.48 O ATOM 948 OE2 GLU B 349 0.634 -15.103 -3.330 1.00 1.42 O ATOM 0 H GLU B 349 -1.333 -11.437 0.189 1.00 0.44 H new ATOM 0 HA GLU B 349 -2.864 -13.787 -0.247 1.00 0.52 H new ATOM 0 HB2 GLU B 349 -0.724 -12.682 -1.444 1.00 0.57 H new ATOM 0 HB3 GLU B 349 0.146 -13.812 -0.427 1.00 0.57 H new ATOM 0 HG2 GLU B 349 -0.900 -15.714 -1.415 1.00 0.99 H new ATOM 0 HG3 GLU B 349 -2.254 -14.780 -2.018 1.00 0.99 H new ATOM 955 N LEU B 350 -0.833 -13.885 2.314 1.00 0.40 N ATOM 956 CA LEU B 350 -0.470 -14.713 3.495 1.00 0.38 C ATOM 957 C LEU B 350 -1.741 -15.013 4.303 1.00 0.38 C ATOM 958 O LEU B 350 -1.869 -16.054 4.914 1.00 0.41 O ATOM 959 CB LEU B 350 0.577 -13.957 4.342 1.00 0.34 C ATOM 960 CG LEU B 350 -0.037 -13.412 5.636 1.00 0.27 C ATOM 961 CD1 LEU B 350 -0.027 -14.512 6.695 1.00 0.31 C ATOM 962 CD2 LEU B 350 0.787 -12.222 6.131 1.00 0.35 C ATOM 0 H LEU B 350 -0.472 -12.931 2.325 1.00 0.40 H new ATOM 0 HA LEU B 350 -0.031 -15.661 3.183 1.00 0.38 H new ATOM 0 HB2 LEU B 350 1.403 -14.626 4.583 1.00 0.34 H new ATOM 0 HB3 LEU B 350 0.992 -13.134 3.760 1.00 0.34 H new ATOM 0 HG LEU B 350 -1.061 -13.089 5.449 1.00 0.27 H new ATOM 0 HD11 LEU B 350 -0.463 -14.132 7.619 1.00 0.31 H new ATOM 0 HD12 LEU B 350 -0.611 -15.362 6.342 1.00 0.31 H new ATOM 0 HD13 LEU B 350 0.999 -14.829 6.881 1.00 0.31 H new ATOM 0 HD21 LEU B 350 0.350 -11.835 7.051 1.00 0.35 H new ATOM 0 HD22 LEU B 350 1.811 -12.543 6.322 1.00 0.35 H new ATOM 0 HD23 LEU B 350 0.788 -11.439 5.372 1.00 0.35 H new ATOM 974 N LYS B 351 -2.684 -14.108 4.300 1.00 0.37 N ATOM 975 CA LYS B 351 -3.945 -14.344 5.057 1.00 0.43 C ATOM 976 C LYS B 351 -4.689 -15.522 4.427 1.00 0.54 C ATOM 977 O LYS B 351 -5.290 -16.328 5.110 1.00 0.58 O ATOM 978 CB LYS B 351 -4.824 -13.092 4.996 1.00 0.46 C ATOM 979 CG LYS B 351 -5.846 -13.129 6.134 1.00 0.57 C ATOM 980 CD LYS B 351 -6.871 -12.010 5.937 1.00 0.75 C ATOM 981 CE LYS B 351 -7.131 -11.313 7.274 1.00 1.39 C ATOM 982 NZ LYS B 351 -8.428 -10.580 7.209 1.00 1.73 N ATOM 0 H LYS B 351 -2.634 -13.217 3.806 1.00 0.37 H new ATOM 0 HA LYS B 351 -3.713 -14.567 6.098 1.00 0.43 H new ATOM 0 HB2 LYS B 351 -4.207 -12.197 5.077 1.00 0.46 H new ATOM 0 HB3 LYS B 351 -5.336 -13.041 4.035 1.00 0.46 H new ATOM 0 HG2 LYS B 351 -6.348 -14.096 6.155 1.00 0.57 H new ATOM 0 HG3 LYS B 351 -5.342 -13.010 7.093 1.00 0.57 H new ATOM 0 HD2 LYS B 351 -6.503 -11.290 5.205 1.00 0.75 H new ATOM 0 HD3 LYS B 351 -7.801 -12.420 5.542 1.00 0.75 H new ATOM 0 HE2 LYS B 351 -7.156 -12.047 8.080 1.00 1.39 H new ATOM 0 HE3 LYS B 351 -6.320 -10.620 7.499 1.00 1.39 H new ATOM 0 HZ1 LYS B 351 -8.605 -10.106 8.118 1.00 1.73 H new ATOM 0 HZ2 LYS B 351 -8.388 -9.870 6.450 1.00 1.73 H new ATOM 0 HZ3 LYS B 351 -9.197 -11.252 7.014 1.00 1.73 H new ATOM 996 N ASP B 352 -4.648 -15.629 3.127 1.00 0.60 N ATOM 997 CA ASP B 352 -5.345 -16.757 2.448 1.00 0.73 C ATOM 998 C ASP B 352 -4.618 -18.064 2.771 1.00 0.77 C ATOM 999 O ASP B 352 -5.216 -19.120 2.831 1.00 0.92 O ATOM 1000 CB ASP B 352 -5.336 -16.526 0.935 1.00 0.75 C ATOM 1001 CG ASP B 352 -6.652 -17.022 0.333 1.00 1.05 C ATOM 1002 OD1 ASP B 352 -7.432 -17.608 1.066 1.00 1.58 O ATOM 1003 OD2 ASP B 352 -6.858 -16.807 -0.850 1.00 1.66 O ATOM 0 H ASP B 352 -4.161 -14.983 2.505 1.00 0.60 H new ATOM 0 HA ASP B 352 -6.376 -16.816 2.797 1.00 0.73 H new ATOM 0 HB2 ASP B 352 -5.202 -15.466 0.719 1.00 0.75 H new ATOM 0 HB3 ASP B 352 -4.496 -17.052 0.482 1.00 0.75 H new ATOM 1008 N ALA B 353 -3.332 -17.999 2.981 1.00 0.69 N ATOM 1009 CA ALA B 353 -2.564 -19.234 3.303 1.00 0.78 C ATOM 1010 C ALA B 353 -2.660 -19.515 4.803 1.00 0.80 C ATOM 1011 O ALA B 353 -2.414 -20.616 5.256 1.00 1.30 O ATOM 1012 CB ALA B 353 -1.097 -19.039 2.915 1.00 0.78 C ATOM 0 H ALA B 353 -2.779 -17.142 2.943 1.00 0.69 H new ATOM 0 HA ALA B 353 -2.978 -20.075 2.747 1.00 0.78 H new ATOM 0 HB1 ALA B 353 -0.535 -19.943 3.151 1.00 0.78 H new ATOM 0 HB2 ALA B 353 -1.027 -18.837 1.846 1.00 0.78 H new ATOM 0 HB3 ALA B 353 -0.682 -18.198 3.471 1.00 0.78 H new ATOM 1018 N GLN B 354 -3.017 -18.528 5.578 1.00 0.67 N ATOM 1019 CA GLN B 354 -3.130 -18.738 7.049 1.00 0.65 C ATOM 1020 C GLN B 354 -3.948 -20.001 7.322 1.00 1.11 C ATOM 1021 O GLN B 354 -4.918 -20.282 6.647 1.00 1.50 O ATOM 1022 CB GLN B 354 -3.824 -17.531 7.683 1.00 0.51 C ATOM 1023 CG GLN B 354 -2.769 -16.569 8.234 1.00 0.47 C ATOM 1024 CD GLN B 354 -3.342 -15.814 9.435 1.00 0.67 C ATOM 1025 OE1 GLN B 354 -4.456 -15.332 9.389 1.00 1.64 O ATOM 1026 NE2 GLN B 354 -2.621 -15.690 10.515 1.00 0.68 N ATOM 0 H GLN B 354 -3.235 -17.585 5.256 1.00 0.67 H new ATOM 0 HA GLN B 354 -2.135 -18.851 7.479 1.00 0.65 H new ATOM 0 HB2 GLN B 354 -4.443 -17.024 6.943 1.00 0.51 H new ATOM 0 HB3 GLN B 354 -4.487 -17.858 8.484 1.00 0.51 H new ATOM 0 HG2 GLN B 354 -1.877 -17.122 8.530 1.00 0.47 H new ATOM 0 HG3 GLN B 354 -2.465 -15.865 7.460 1.00 0.47 H new ATOM 0 HE21 GLN B 354 -1.686 -16.095 10.553 1.00 0.68 H new ATOM 0 HE22 GLN B 354 -2.993 -15.188 11.321 1.00 0.68 H new ATOM 1035 N ALA B 355 -3.563 -20.766 8.306 1.00 1.69 N ATOM 1036 CA ALA B 355 -4.317 -22.011 8.621 1.00 2.14 C ATOM 1037 C ALA B 355 -3.616 -22.758 9.758 1.00 2.68 C ATOM 1038 O ALA B 355 -4.310 -23.324 10.586 1.00 3.11 O ATOM 1039 CB ALA B 355 -4.368 -22.905 7.380 1.00 2.62 C ATOM 1040 OXT ALA B 355 -2.396 -22.751 9.780 1.00 3.15 O ATOM 0 H ALA B 355 -2.758 -20.582 8.906 1.00 1.69 H new ATOM 0 HA ALA B 355 -5.331 -21.754 8.926 1.00 2.14 H new ATOM 0 HB1 ALA B 355 -4.920 -23.816 7.610 1.00 2.62 H new ATOM 0 HB2 ALA B 355 -4.867 -22.374 6.569 1.00 2.62 H new ATOM 0 HB3 ALA B 355 -3.354 -23.162 7.075 1.00 2.62 H new TER 1046 ALA B 355 ATOM 1047 N GLY C 325 12.212 -1.529 15.889 1.00 1.58 N ATOM 1048 CA GLY C 325 11.201 -0.628 15.266 1.00 0.97 C ATOM 1049 C GLY C 325 10.587 0.273 16.339 1.00 0.89 C ATOM 1050 O GLY C 325 10.752 0.047 17.521 1.00 1.10 O ATOM 0 HA2 GLY C 325 11.669 -0.021 14.491 1.00 0.97 H new ATOM 0 HA3 GLY C 325 10.422 -1.218 14.783 1.00 0.97 H new ATOM 1056 N GLU C 326 9.881 1.294 15.936 1.00 0.73 N ATOM 1057 CA GLU C 326 9.258 2.208 16.935 1.00 0.75 C ATOM 1058 C GLU C 326 7.760 2.335 16.647 1.00 0.68 C ATOM 1059 O GLU C 326 7.212 1.618 15.833 1.00 0.67 O ATOM 1060 CB GLU C 326 9.913 3.588 16.842 1.00 0.88 C ATOM 1061 CG GLU C 326 10.890 3.768 18.006 1.00 1.17 C ATOM 1062 CD GLU C 326 11.060 5.259 18.303 1.00 1.36 C ATOM 1063 OE1 GLU C 326 10.663 6.058 17.471 1.00 2.12 O ATOM 1064 OE2 GLU C 326 11.585 5.577 19.358 1.00 1.71 O ATOM 0 H GLU C 326 9.709 1.535 14.960 1.00 0.73 H new ATOM 0 HA GLU C 326 9.403 1.803 17.937 1.00 0.75 H new ATOM 0 HB2 GLU C 326 10.439 3.690 15.893 1.00 0.88 H new ATOM 0 HB3 GLU C 326 9.151 4.367 16.869 1.00 0.88 H new ATOM 0 HG2 GLU C 326 10.518 3.250 18.890 1.00 1.17 H new ATOM 0 HG3 GLU C 326 11.854 3.323 17.758 1.00 1.17 H new ATOM 1071 N TYR C 327 7.094 3.241 17.308 1.00 0.65 N ATOM 1072 CA TYR C 327 5.633 3.412 17.073 1.00 0.60 C ATOM 1073 C TYR C 327 5.399 4.626 16.170 1.00 0.53 C ATOM 1074 O TYR C 327 5.732 5.742 16.516 1.00 0.62 O ATOM 1075 CB TYR C 327 4.923 3.629 18.411 1.00 0.68 C ATOM 1076 CG TYR C 327 4.412 2.307 18.931 1.00 0.78 C ATOM 1077 CD1 TYR C 327 5.305 1.377 19.477 1.00 1.30 C ATOM 1078 CD2 TYR C 327 3.044 2.012 18.871 1.00 1.64 C ATOM 1079 CE1 TYR C 327 4.831 0.151 19.961 1.00 1.34 C ATOM 1080 CE2 TYR C 327 2.570 0.787 19.354 1.00 1.87 C ATOM 1081 CZ TYR C 327 3.463 -0.144 19.900 1.00 1.23 C ATOM 1082 OH TYR C 327 2.996 -1.351 20.377 1.00 1.50 O ATOM 0 H TYR C 327 7.499 3.871 18.001 1.00 0.65 H new ATOM 0 HA TYR C 327 5.236 2.518 16.591 1.00 0.60 H new ATOM 0 HB2 TYR C 327 5.610 4.074 19.131 1.00 0.68 H new ATOM 0 HB3 TYR C 327 4.095 4.327 18.286 1.00 0.68 H new ATOM 0 HD1 TYR C 327 6.360 1.605 19.525 1.00 1.30 H new ATOM 0 HD2 TYR C 327 2.355 2.730 18.452 1.00 1.64 H new ATOM 0 HE1 TYR C 327 5.520 -0.567 20.381 1.00 1.34 H new ATOM 0 HE2 TYR C 327 1.515 0.559 19.306 1.00 1.87 H new ATOM 0 HH TYR C 327 2.024 -1.395 20.260 1.00 1.50 H new ATOM 1092 N PHE C 328 4.826 4.417 15.016 1.00 0.45 N ATOM 1093 CA PHE C 328 4.568 5.559 14.094 1.00 0.40 C ATOM 1094 C PHE C 328 3.059 5.784 13.976 1.00 0.35 C ATOM 1095 O PHE C 328 2.271 4.881 14.171 1.00 0.41 O ATOM 1096 CB PHE C 328 5.147 5.241 12.714 1.00 0.42 C ATOM 1097 CG PHE C 328 6.649 5.390 12.752 1.00 0.44 C ATOM 1098 CD1 PHE C 328 7.411 4.576 13.598 1.00 1.44 C ATOM 1099 CD2 PHE C 328 7.280 6.341 11.941 1.00 1.12 C ATOM 1100 CE1 PHE C 328 8.804 4.713 13.634 1.00 1.50 C ATOM 1101 CE2 PHE C 328 8.673 6.478 11.977 1.00 1.12 C ATOM 1102 CZ PHE C 328 9.435 5.664 12.824 1.00 0.62 C ATOM 0 H PHE C 328 4.526 3.505 14.672 1.00 0.45 H new ATOM 0 HA PHE C 328 5.041 6.459 14.486 1.00 0.40 H new ATOM 0 HB2 PHE C 328 4.879 4.226 12.420 1.00 0.42 H new ATOM 0 HB3 PHE C 328 4.723 5.912 11.967 1.00 0.42 H new ATOM 0 HD1 PHE C 328 6.924 3.842 14.223 1.00 1.44 H new ATOM 0 HD2 PHE C 328 6.692 6.969 11.288 1.00 1.12 H new ATOM 0 HE1 PHE C 328 9.392 4.085 14.287 1.00 1.50 H new ATOM 0 HE2 PHE C 328 9.160 7.212 11.351 1.00 1.12 H new ATOM 0 HZ PHE C 328 10.509 5.770 12.852 1.00 0.62 H new ATOM 1112 N THR C 329 2.650 6.983 13.662 1.00 0.43 N ATOM 1113 CA THR C 329 1.191 7.261 13.537 1.00 0.39 C ATOM 1114 C THR C 329 0.871 7.708 12.110 1.00 0.39 C ATOM 1115 O THR C 329 1.554 8.535 11.539 1.00 0.48 O ATOM 1116 CB THR C 329 0.797 8.370 14.515 1.00 0.38 C ATOM 1117 OG1 THR C 329 1.818 8.526 15.490 1.00 0.39 O ATOM 1118 CG2 THR C 329 -0.519 8.004 15.203 1.00 0.39 C ATOM 0 H THR C 329 3.261 7.780 13.487 1.00 0.43 H new ATOM 0 HA THR C 329 0.632 6.354 13.767 1.00 0.39 H new ATOM 0 HB THR C 329 0.670 9.306 13.970 1.00 0.38 H new ATOM 0 HG1 THR C 329 1.567 9.237 16.116 1.00 0.39 H new ATOM 0 HG21 THR C 329 -0.798 8.795 15.899 1.00 0.39 H new ATOM 0 HG22 THR C 329 -1.302 7.888 14.453 1.00 0.39 H new ATOM 0 HG23 THR C 329 -0.397 7.068 15.748 1.00 0.39 H new ATOM 1126 N LEU C 330 -0.169 7.172 11.534 1.00 0.32 N ATOM 1127 CA LEU C 330 -0.544 7.569 10.148 1.00 0.33 C ATOM 1128 C LEU C 330 -1.899 8.277 10.184 1.00 0.31 C ATOM 1129 O LEU C 330 -2.933 7.672 9.982 1.00 0.29 O ATOM 1130 CB LEU C 330 -0.641 6.320 9.270 1.00 0.34 C ATOM 1131 CG LEU C 330 0.145 6.537 7.977 1.00 0.48 C ATOM 1132 CD1 LEU C 330 1.289 5.526 7.901 1.00 0.42 C ATOM 1133 CD2 LEU C 330 -0.785 6.341 6.778 1.00 0.92 C ATOM 0 H LEU C 330 -0.777 6.475 11.964 1.00 0.32 H new ATOM 0 HA LEU C 330 0.211 8.240 9.737 1.00 0.33 H new ATOM 0 HB2 LEU C 330 -0.248 5.456 9.805 1.00 0.34 H new ATOM 0 HB3 LEU C 330 -1.685 6.105 9.041 1.00 0.34 H new ATOM 0 HG LEU C 330 0.551 7.549 7.963 1.00 0.48 H new ATOM 0 HD11 LEU C 330 1.850 5.680 6.979 1.00 0.42 H new ATOM 0 HD12 LEU C 330 1.951 5.661 8.756 1.00 0.42 H new ATOM 0 HD13 LEU C 330 0.882 4.515 7.914 1.00 0.42 H new ATOM 0 HD21 LEU C 330 -0.226 6.495 5.855 1.00 0.92 H new ATOM 0 HD22 LEU C 330 -1.189 5.329 6.793 1.00 0.92 H new ATOM 0 HD23 LEU C 330 -1.603 7.059 6.831 1.00 0.92 H new ATOM 1145 N GLN C 331 -1.903 9.554 10.451 1.00 0.34 N ATOM 1146 CA GLN C 331 -3.191 10.299 10.511 1.00 0.34 C ATOM 1147 C GLN C 331 -3.677 10.606 9.094 1.00 0.37 C ATOM 1148 O GLN C 331 -3.076 11.379 8.374 1.00 0.43 O ATOM 1149 CB GLN C 331 -2.986 11.607 11.277 1.00 0.36 C ATOM 1150 CG GLN C 331 -2.908 11.314 12.777 1.00 1.06 C ATOM 1151 CD GLN C 331 -3.275 12.573 13.564 1.00 1.24 C ATOM 1152 OE1 GLN C 331 -3.834 13.504 13.018 1.00 2.05 O ATOM 1153 NE2 GLN C 331 -2.982 12.643 14.834 1.00 1.37 N ATOM 0 H GLN C 331 -1.069 10.114 10.630 1.00 0.34 H new ATOM 0 HA GLN C 331 -3.937 9.690 11.022 1.00 0.34 H new ATOM 0 HB2 GLN C 331 -2.071 12.096 10.943 1.00 0.36 H new ATOM 0 HB3 GLN C 331 -3.808 12.293 11.072 1.00 0.36 H new ATOM 0 HG2 GLN C 331 -3.586 10.501 13.035 1.00 1.06 H new ATOM 0 HG3 GLN C 331 -1.903 10.987 13.042 1.00 1.06 H new ATOM 0 HE21 GLN C 331 -2.513 11.862 15.293 1.00 1.37 H new ATOM 0 HE22 GLN C 331 -3.222 13.479 15.367 1.00 1.37 H new ATOM 1162 N ILE C 332 -4.764 10.007 8.689 1.00 0.37 N ATOM 1163 CA ILE C 332 -5.292 10.265 7.320 1.00 0.42 C ATOM 1164 C ILE C 332 -6.627 11.006 7.422 1.00 0.43 C ATOM 1165 O ILE C 332 -7.532 10.580 8.112 1.00 0.47 O ATOM 1166 CB ILE C 332 -5.504 8.935 6.595 1.00 0.46 C ATOM 1167 CG1 ILE C 332 -4.163 8.209 6.459 1.00 0.49 C ATOM 1168 CG2 ILE C 332 -6.083 9.196 5.204 1.00 0.53 C ATOM 1169 CD1 ILE C 332 -4.320 6.756 6.910 1.00 0.47 C ATOM 0 H ILE C 332 -5.309 9.350 9.248 1.00 0.37 H new ATOM 0 HA ILE C 332 -4.578 10.872 6.764 1.00 0.42 H new ATOM 0 HB ILE C 332 -6.197 8.318 7.167 1.00 0.46 H new ATOM 0 HG12 ILE C 332 -3.822 8.245 5.424 1.00 0.49 H new ATOM 0 HG13 ILE C 332 -3.405 8.708 7.062 1.00 0.49 H new ATOM 0 HG21 ILE C 332 -6.233 8.247 4.689 1.00 0.53 H new ATOM 0 HG22 ILE C 332 -7.038 9.713 5.299 1.00 0.53 H new ATOM 0 HG23 ILE C 332 -5.391 9.814 4.632 1.00 0.53 H new ATOM 0 HD11 ILE C 332 -3.365 6.240 6.813 1.00 0.47 H new ATOM 0 HD12 ILE C 332 -4.642 6.731 7.951 1.00 0.47 H new ATOM 0 HD13 ILE C 332 -5.065 6.260 6.288 1.00 0.47 H new ATOM 1181 N ARG C 333 -6.757 12.112 6.742 1.00 0.51 N ATOM 1182 CA ARG C 333 -8.034 12.877 6.804 1.00 0.55 C ATOM 1183 C ARG C 333 -9.014 12.316 5.772 1.00 0.54 C ATOM 1184 O ARG C 333 -8.831 12.469 4.581 1.00 0.83 O ATOM 1185 CB ARG C 333 -7.761 14.352 6.500 1.00 0.67 C ATOM 1186 CG ARG C 333 -8.472 15.227 7.534 1.00 1.46 C ATOM 1187 CD ARG C 333 -8.408 16.691 7.094 1.00 1.66 C ATOM 1188 NE ARG C 333 -9.051 16.837 5.758 1.00 2.45 N ATOM 1189 CZ ARG C 333 -8.625 17.747 4.925 1.00 2.74 C ATOM 1190 NH1 ARG C 333 -8.742 19.012 5.225 1.00 3.29 N ATOM 1191 NH2 ARG C 333 -8.083 17.391 3.793 1.00 3.09 N ATOM 0 H ARG C 333 -6.035 12.518 6.147 1.00 0.51 H new ATOM 0 HA ARG C 333 -8.464 12.786 7.801 1.00 0.55 H new ATOM 0 HB2 ARG C 333 -6.689 14.546 6.520 1.00 0.67 H new ATOM 0 HB3 ARG C 333 -8.111 14.598 5.497 1.00 0.67 H new ATOM 0 HG2 ARG C 333 -9.510 14.913 7.639 1.00 1.46 H new ATOM 0 HG3 ARG C 333 -8.003 15.109 8.511 1.00 1.46 H new ATOM 0 HD2 ARG C 333 -8.913 17.324 7.824 1.00 1.66 H new ATOM 0 HD3 ARG C 333 -7.371 17.023 7.048 1.00 1.66 H new ATOM 0 HE ARG C 333 -9.824 16.226 5.494 1.00 2.45 H new ATOM 0 HH11 ARG C 333 -9.166 19.289 6.110 1.00 3.29 H new ATOM 0 HH12 ARG C 333 -8.409 19.723 4.574 1.00 3.29 H new ATOM 0 HH21 ARG C 333 -7.992 16.402 3.560 1.00 3.09 H new ATOM 0 HH22 ARG C 333 -7.750 18.101 3.141 1.00 3.09 H new ATOM 1205 N GLY C 334 -10.054 11.668 6.220 1.00 0.53 N ATOM 1206 CA GLY C 334 -11.045 11.097 5.264 1.00 0.50 C ATOM 1207 C GLY C 334 -11.793 9.942 5.931 1.00 0.49 C ATOM 1208 O GLY C 334 -12.207 10.033 7.070 1.00 0.59 O ATOM 0 H GLY C 334 -10.261 11.509 7.206 1.00 0.53 H new ATOM 0 HA2 GLY C 334 -11.750 11.868 4.951 1.00 0.50 H new ATOM 0 HA3 GLY C 334 -10.538 10.745 4.366 1.00 0.50 H new ATOM 1212 N ARG C 335 -11.968 8.856 5.231 1.00 0.46 N ATOM 1213 CA ARG C 335 -12.688 7.694 5.824 1.00 0.47 C ATOM 1214 C ARG C 335 -12.472 6.463 4.943 1.00 0.43 C ATOM 1215 O ARG C 335 -12.068 5.417 5.410 1.00 0.47 O ATOM 1216 CB ARG C 335 -14.184 8.007 5.907 1.00 0.52 C ATOM 1217 CG ARG C 335 -14.864 7.008 6.844 1.00 0.59 C ATOM 1218 CD ARG C 335 -16.100 7.655 7.472 1.00 0.80 C ATOM 1219 NE ARG C 335 -16.308 7.106 8.841 1.00 0.89 N ATOM 1220 CZ ARG C 335 -17.518 6.926 9.294 1.00 1.23 C ATOM 1221 NH1 ARG C 335 -18.170 7.923 9.828 1.00 2.04 N ATOM 1222 NH2 ARG C 335 -18.077 5.749 9.214 1.00 1.58 N ATOM 0 H ARG C 335 -11.643 8.723 4.273 1.00 0.46 H new ATOM 0 HA ARG C 335 -12.304 7.499 6.825 1.00 0.47 H new ATOM 0 HB2 ARG C 335 -14.334 9.023 6.271 1.00 0.52 H new ATOM 0 HB3 ARG C 335 -14.633 7.955 4.915 1.00 0.52 H new ATOM 0 HG2 ARG C 335 -15.150 6.113 6.292 1.00 0.59 H new ATOM 0 HG3 ARG C 335 -14.170 6.694 7.623 1.00 0.59 H new ATOM 0 HD2 ARG C 335 -15.973 8.737 7.518 1.00 0.80 H new ATOM 0 HD3 ARG C 335 -16.977 7.463 6.855 1.00 0.80 H new ATOM 0 HE ARG C 335 -15.505 6.871 9.424 1.00 0.89 H new ATOM 0 HH11 ARG C 335 -17.733 8.843 9.891 1.00 2.04 H new ATOM 0 HH12 ARG C 335 -19.116 7.782 10.182 1.00 2.04 H new ATOM 0 HH21 ARG C 335 -17.568 4.970 8.797 1.00 1.58 H new ATOM 0 HH22 ARG C 335 -19.023 5.609 9.568 1.00 1.58 H new ATOM 1236 N GLU C 336 -12.736 6.580 3.671 1.00 0.43 N ATOM 1237 CA GLU C 336 -12.542 5.417 2.761 1.00 0.43 C ATOM 1238 C GLU C 336 -11.047 5.126 2.627 1.00 0.37 C ATOM 1239 O GLU C 336 -10.604 4.010 2.808 1.00 0.39 O ATOM 1240 CB GLU C 336 -13.125 5.741 1.385 1.00 0.47 C ATOM 1241 CG GLU C 336 -14.543 5.176 1.286 1.00 1.18 C ATOM 1242 CD GLU C 336 -15.200 5.664 -0.006 1.00 1.64 C ATOM 1243 OE1 GLU C 336 -15.215 6.865 -0.222 1.00 2.25 O ATOM 1244 OE2 GLU C 336 -15.676 4.830 -0.758 1.00 2.15 O ATOM 0 H GLU C 336 -13.077 7.430 3.223 1.00 0.43 H new ATOM 0 HA GLU C 336 -13.049 4.544 3.171 1.00 0.43 H new ATOM 0 HB2 GLU C 336 -13.140 6.820 1.230 1.00 0.47 H new ATOM 0 HB3 GLU C 336 -12.497 5.315 0.603 1.00 0.47 H new ATOM 0 HG2 GLU C 336 -14.513 4.087 1.302 1.00 1.18 H new ATOM 0 HG3 GLU C 336 -15.132 5.491 2.147 1.00 1.18 H new ATOM 1251 N ARG C 337 -10.264 6.123 2.314 1.00 0.39 N ATOM 1252 CA ARG C 337 -8.798 5.899 2.174 1.00 0.36 C ATOM 1253 C ARG C 337 -8.259 5.275 3.463 1.00 0.32 C ATOM 1254 O ARG C 337 -7.459 4.362 3.434 1.00 0.34 O ATOM 1255 CB ARG C 337 -8.097 7.236 1.920 1.00 0.39 C ATOM 1256 CG ARG C 337 -7.788 7.373 0.427 1.00 0.66 C ATOM 1257 CD ARG C 337 -7.138 8.731 0.162 1.00 0.42 C ATOM 1258 NE ARG C 337 -7.980 9.809 0.752 1.00 1.05 N ATOM 1259 CZ ARG C 337 -8.387 10.800 0.007 1.00 1.25 C ATOM 1260 NH1 ARG C 337 -9.290 10.597 -0.913 1.00 1.85 N ATOM 1261 NH2 ARG C 337 -7.891 11.994 0.181 1.00 1.95 N ATOM 0 H ARG C 337 -10.576 7.080 2.150 1.00 0.39 H new ATOM 0 HA ARG C 337 -8.609 5.229 1.336 1.00 0.36 H new ATOM 0 HB2 ARG C 337 -8.731 8.060 2.248 1.00 0.39 H new ATOM 0 HB3 ARG C 337 -7.176 7.292 2.500 1.00 0.39 H new ATOM 0 HG2 ARG C 337 -7.122 6.571 0.108 1.00 0.66 H new ATOM 0 HG3 ARG C 337 -8.705 7.277 -0.155 1.00 0.66 H new ATOM 0 HD2 ARG C 337 -6.138 8.758 0.595 1.00 0.42 H new ATOM 0 HD3 ARG C 337 -7.025 8.889 -0.911 1.00 0.42 H new ATOM 0 HE ARG C 337 -8.238 9.772 1.738 1.00 1.05 H new ATOM 0 HH11 ARG C 337 -9.678 9.664 -1.050 1.00 1.85 H new ATOM 0 HH12 ARG C 337 -9.608 11.372 -1.495 1.00 1.85 H new ATOM 0 HH21 ARG C 337 -7.185 12.153 0.900 1.00 1.95 H new ATOM 0 HH22 ARG C 337 -8.209 12.768 -0.402 1.00 1.95 H new ATOM 1275 N PHE C 338 -8.697 5.757 4.594 1.00 0.32 N ATOM 1276 CA PHE C 338 -8.214 5.185 5.882 1.00 0.30 C ATOM 1277 C PHE C 338 -8.532 3.690 5.915 1.00 0.29 C ATOM 1278 O PHE C 338 -7.753 2.889 6.392 1.00 0.31 O ATOM 1279 CB PHE C 338 -8.914 5.882 7.050 1.00 0.33 C ATOM 1280 CG PHE C 338 -8.469 5.255 8.350 1.00 0.36 C ATOM 1281 CD1 PHE C 338 -7.221 5.584 8.894 1.00 1.29 C ATOM 1282 CD2 PHE C 338 -9.303 4.345 9.010 1.00 1.14 C ATOM 1283 CE1 PHE C 338 -6.808 5.002 10.098 1.00 1.36 C ATOM 1284 CE2 PHE C 338 -8.889 3.764 10.215 1.00 1.15 C ATOM 1285 CZ PHE C 338 -7.642 4.093 10.759 1.00 0.59 C ATOM 0 H PHE C 338 -9.367 6.521 4.681 1.00 0.32 H new ATOM 0 HA PHE C 338 -7.138 5.335 5.968 1.00 0.30 H new ATOM 0 HB2 PHE C 338 -8.677 6.946 7.047 1.00 0.33 H new ATOM 0 HB3 PHE C 338 -9.995 5.796 6.944 1.00 0.33 H new ATOM 0 HD1 PHE C 338 -6.578 6.286 8.385 1.00 1.29 H new ATOM 0 HD2 PHE C 338 -10.265 4.091 8.590 1.00 1.14 H new ATOM 0 HE1 PHE C 338 -5.845 5.254 10.517 1.00 1.36 H new ATOM 0 HE2 PHE C 338 -9.532 3.062 10.725 1.00 1.15 H new ATOM 0 HZ PHE C 338 -7.323 3.645 11.689 1.00 0.59 H new ATOM 1295 N GLU C 339 -9.670 3.306 5.404 1.00 0.32 N ATOM 1296 CA GLU C 339 -10.035 1.862 5.399 1.00 0.34 C ATOM 1297 C GLU C 339 -9.062 1.105 4.494 1.00 0.31 C ATOM 1298 O GLU C 339 -8.570 0.050 4.840 1.00 0.31 O ATOM 1299 CB GLU C 339 -11.461 1.696 4.870 1.00 0.40 C ATOM 1300 CG GLU C 339 -12.449 2.313 5.862 1.00 0.55 C ATOM 1301 CD GLU C 339 -13.775 1.552 5.802 1.00 0.94 C ATOM 1302 OE1 GLU C 339 -14.041 0.945 4.778 1.00 1.62 O ATOM 1303 OE2 GLU C 339 -14.501 1.590 6.782 1.00 1.46 O ATOM 0 H GLU C 339 -10.362 3.930 4.990 1.00 0.32 H new ATOM 0 HA GLU C 339 -9.980 1.465 6.413 1.00 0.34 H new ATOM 0 HB2 GLU C 339 -11.558 2.178 3.897 1.00 0.40 H new ATOM 0 HB3 GLU C 339 -11.686 0.639 4.726 1.00 0.40 H new ATOM 0 HG2 GLU C 339 -12.040 2.273 6.872 1.00 0.55 H new ATOM 0 HG3 GLU C 339 -12.610 3.365 5.625 1.00 0.55 H new ATOM 1310 N MET C 340 -8.776 1.642 3.339 1.00 0.31 N ATOM 1311 CA MET C 340 -7.829 0.959 2.416 1.00 0.31 C ATOM 1312 C MET C 340 -6.571 0.571 3.191 1.00 0.26 C ATOM 1313 O MET C 340 -6.205 -0.585 3.264 1.00 0.28 O ATOM 1314 CB MET C 340 -7.451 1.910 1.280 1.00 0.35 C ATOM 1315 CG MET C 340 -8.349 1.648 0.070 1.00 0.35 C ATOM 1316 SD MET C 340 -8.294 3.076 -1.042 1.00 0.64 S ATOM 1317 CE MET C 340 -6.522 3.414 -0.894 1.00 0.39 C ATOM 0 H MET C 340 -9.158 2.524 2.996 1.00 0.31 H new ATOM 0 HA MET C 340 -8.298 0.067 2.001 1.00 0.31 H new ATOM 0 HB2 MET C 340 -7.558 2.944 1.607 1.00 0.35 H new ATOM 0 HB3 MET C 340 -6.405 1.769 1.007 1.00 0.35 H new ATOM 0 HG2 MET C 340 -8.018 0.752 -0.455 1.00 0.35 H new ATOM 0 HG3 MET C 340 -9.373 1.467 0.396 1.00 0.35 H new ATOM 0 HE1 MET C 340 -6.183 3.967 -1.770 1.00 0.39 H new ATOM 0 HE2 MET C 340 -6.338 4.006 0.003 1.00 0.39 H new ATOM 0 HE3 MET C 340 -5.977 2.473 -0.825 1.00 0.39 H new ATOM 1327 N PHE C 341 -5.911 1.532 3.777 1.00 0.27 N ATOM 1328 CA PHE C 341 -4.681 1.224 4.555 1.00 0.28 C ATOM 1329 C PHE C 341 -5.033 0.261 5.688 1.00 0.29 C ATOM 1330 O PHE C 341 -4.245 -0.580 6.069 1.00 0.37 O ATOM 1331 CB PHE C 341 -4.113 2.517 5.144 1.00 0.31 C ATOM 1332 CG PHE C 341 -3.421 3.307 4.059 1.00 0.29 C ATOM 1333 CD1 PHE C 341 -2.587 2.656 3.143 1.00 1.22 C ATOM 1334 CD2 PHE C 341 -3.614 4.690 3.970 1.00 1.27 C ATOM 1335 CE1 PHE C 341 -1.946 3.387 2.138 1.00 1.21 C ATOM 1336 CE2 PHE C 341 -2.973 5.423 2.964 1.00 1.30 C ATOM 1337 CZ PHE C 341 -2.138 4.771 2.048 1.00 0.37 C ATOM 0 H PHE C 341 -6.172 2.518 3.750 1.00 0.27 H new ATOM 0 HA PHE C 341 -3.938 0.767 3.901 1.00 0.28 H new ATOM 0 HB2 PHE C 341 -4.914 3.110 5.585 1.00 0.31 H new ATOM 0 HB3 PHE C 341 -3.410 2.286 5.944 1.00 0.31 H new ATOM 0 HD1 PHE C 341 -2.438 1.589 3.212 1.00 1.22 H new ATOM 0 HD2 PHE C 341 -4.257 5.192 4.677 1.00 1.27 H new ATOM 0 HE1 PHE C 341 -1.303 2.884 1.431 1.00 1.21 H new ATOM 0 HE2 PHE C 341 -3.122 6.490 2.894 1.00 1.30 H new ATOM 0 HZ PHE C 341 -1.642 5.336 1.272 1.00 0.37 H new ATOM 1347 N ARG C 342 -6.215 0.377 6.227 1.00 0.28 N ATOM 1348 CA ARG C 342 -6.621 -0.533 7.333 1.00 0.31 C ATOM 1349 C ARG C 342 -6.548 -1.981 6.847 1.00 0.31 C ATOM 1350 O ARG C 342 -6.197 -2.877 7.588 1.00 0.36 O ATOM 1351 CB ARG C 342 -8.051 -0.207 7.766 1.00 0.35 C ATOM 1352 CG ARG C 342 -8.037 0.350 9.191 1.00 0.52 C ATOM 1353 CD ARG C 342 -9.303 -0.094 9.926 1.00 0.84 C ATOM 1354 NE ARG C 342 -8.926 -0.890 11.128 1.00 1.26 N ATOM 1355 CZ ARG C 342 -9.786 -1.058 12.095 1.00 1.75 C ATOM 1356 NH1 ARG C 342 -9.918 -0.143 13.017 1.00 2.37 N ATOM 1357 NH2 ARG C 342 -10.513 -2.140 12.141 1.00 2.36 N ATOM 0 H ARG C 342 -6.917 1.063 5.949 1.00 0.28 H new ATOM 0 HA ARG C 342 -5.950 -0.399 8.182 1.00 0.31 H new ATOM 0 HB2 ARG C 342 -8.492 0.520 7.084 1.00 0.35 H new ATOM 0 HB3 ARG C 342 -8.670 -1.103 7.720 1.00 0.35 H new ATOM 0 HG2 ARG C 342 -7.153 -0.003 9.722 1.00 0.52 H new ATOM 0 HG3 ARG C 342 -7.981 1.438 9.167 1.00 0.52 H new ATOM 0 HD2 ARG C 342 -9.889 0.776 10.222 1.00 0.84 H new ATOM 0 HD3 ARG C 342 -9.931 -0.690 9.264 1.00 0.84 H new ATOM 0 HE ARG C 342 -7.996 -1.303 11.195 1.00 1.26 H new ATOM 0 HH11 ARG C 342 -9.349 0.703 12.981 1.00 2.37 H new ATOM 0 HH12 ARG C 342 -10.590 -0.274 13.773 1.00 2.37 H new ATOM 0 HH21 ARG C 342 -10.409 -2.855 11.421 1.00 2.36 H new ATOM 0 HH22 ARG C 342 -11.185 -2.271 12.897 1.00 2.36 H new ATOM 1371 N GLU C 343 -6.869 -2.217 5.603 1.00 0.28 N ATOM 1372 CA GLU C 343 -6.806 -3.608 5.073 1.00 0.29 C ATOM 1373 C GLU C 343 -5.341 -4.026 4.955 1.00 0.23 C ATOM 1374 O GLU C 343 -4.928 -5.035 5.492 1.00 0.27 O ATOM 1375 CB GLU C 343 -7.467 -3.668 3.694 1.00 0.34 C ATOM 1376 CG GLU C 343 -7.746 -5.127 3.330 1.00 0.38 C ATOM 1377 CD GLU C 343 -9.202 -5.465 3.652 1.00 0.81 C ATOM 1378 OE1 GLU C 343 -10.075 -4.783 3.140 1.00 1.32 O ATOM 1379 OE2 GLU C 343 -9.420 -6.399 4.405 1.00 1.63 O ATOM 0 H GLU C 343 -7.171 -1.509 4.934 1.00 0.28 H new ATOM 0 HA GLU C 343 -7.332 -4.282 5.749 1.00 0.29 H new ATOM 0 HB2 GLU C 343 -8.396 -3.098 3.698 1.00 0.34 H new ATOM 0 HB3 GLU C 343 -6.817 -3.213 2.947 1.00 0.34 H new ATOM 0 HG2 GLU C 343 -7.549 -5.292 2.271 1.00 0.38 H new ATOM 0 HG3 GLU C 343 -7.078 -5.785 3.885 1.00 0.38 H new ATOM 1386 N LEU C 344 -4.549 -3.251 4.266 1.00 0.24 N ATOM 1387 CA LEU C 344 -3.108 -3.599 4.128 1.00 0.26 C ATOM 1388 C LEU C 344 -2.503 -3.731 5.527 1.00 0.28 C ATOM 1389 O LEU C 344 -1.480 -4.357 5.720 1.00 0.44 O ATOM 1390 CB LEU C 344 -2.376 -2.487 3.366 1.00 0.32 C ATOM 1391 CG LEU C 344 -2.844 -2.426 1.903 1.00 0.26 C ATOM 1392 CD1 LEU C 344 -3.102 -3.837 1.366 1.00 0.31 C ATOM 1393 CD2 LEU C 344 -4.129 -1.597 1.811 1.00 0.37 C ATOM 0 H LEU C 344 -4.837 -2.394 3.794 1.00 0.24 H new ATOM 0 HA LEU C 344 -3.006 -4.536 3.580 1.00 0.26 H new ATOM 0 HB2 LEU C 344 -2.558 -1.528 3.851 1.00 0.32 H new ATOM 0 HB3 LEU C 344 -1.301 -2.663 3.401 1.00 0.32 H new ATOM 0 HG LEU C 344 -2.063 -1.960 1.302 1.00 0.26 H new ATOM 0 HD11 LEU C 344 -3.433 -3.777 0.329 1.00 0.31 H new ATOM 0 HD12 LEU C 344 -2.183 -4.421 1.421 1.00 0.31 H new ATOM 0 HD13 LEU C 344 -3.874 -4.319 1.966 1.00 0.31 H new ATOM 0 HD21 LEU C 344 -4.461 -1.554 0.774 1.00 0.37 H new ATOM 0 HD22 LEU C 344 -4.905 -2.060 2.421 1.00 0.37 H new ATOM 0 HD23 LEU C 344 -3.937 -0.587 2.173 1.00 0.37 H new ATOM 1405 N ASN C 345 -3.134 -3.139 6.505 1.00 0.40 N ATOM 1406 CA ASN C 345 -2.611 -3.216 7.897 1.00 0.49 C ATOM 1407 C ASN C 345 -3.105 -4.505 8.554 1.00 0.44 C ATOM 1408 O ASN C 345 -2.430 -5.094 9.374 1.00 0.48 O ATOM 1409 CB ASN C 345 -3.122 -2.015 8.696 1.00 0.65 C ATOM 1410 CG ASN C 345 -1.937 -1.203 9.220 1.00 0.94 C ATOM 1411 OD1 ASN C 345 -0.799 -1.503 8.921 1.00 1.77 O ATOM 1412 ND2 ASN C 345 -2.159 -0.178 9.997 1.00 1.32 N ATOM 0 H ASN C 345 -3.995 -2.602 6.397 1.00 0.40 H new ATOM 0 HA ASN C 345 -1.521 -3.209 7.879 1.00 0.49 H new ATOM 0 HB2 ASN C 345 -3.754 -1.389 8.066 1.00 0.65 H new ATOM 0 HB3 ASN C 345 -3.739 -2.355 9.528 1.00 0.65 H new ATOM 0 HD21 ASN C 345 -1.377 0.371 10.353 1.00 1.32 H new ATOM 0 HD22 ASN C 345 -3.115 0.074 10.248 1.00 1.32 H new ATOM 1419 N GLU C 346 -4.281 -4.946 8.203 1.00 0.38 N ATOM 1420 CA GLU C 346 -4.818 -6.195 8.809 1.00 0.38 C ATOM 1421 C GLU C 346 -3.983 -7.388 8.341 1.00 0.32 C ATOM 1422 O GLU C 346 -3.712 -8.299 9.095 1.00 0.37 O ATOM 1423 CB GLU C 346 -6.272 -6.389 8.375 1.00 0.40 C ATOM 1424 CG GLU C 346 -7.054 -7.075 9.497 1.00 0.87 C ATOM 1425 CD GLU C 346 -8.507 -6.600 9.471 1.00 1.11 C ATOM 1426 OE1 GLU C 346 -9.265 -7.118 8.667 1.00 1.59 O ATOM 1427 OE2 GLU C 346 -8.839 -5.727 10.256 1.00 1.90 O ATOM 0 H GLU C 346 -4.893 -4.495 7.523 1.00 0.38 H new ATOM 0 HA GLU C 346 -4.770 -6.121 9.895 1.00 0.38 H new ATOM 0 HB2 GLU C 346 -6.724 -5.425 8.139 1.00 0.40 H new ATOM 0 HB3 GLU C 346 -6.314 -6.991 7.467 1.00 0.40 H new ATOM 0 HG2 GLU C 346 -7.012 -8.157 9.375 1.00 0.87 H new ATOM 0 HG3 GLU C 346 -6.603 -6.845 10.462 1.00 0.87 H new ATOM 1434 N ALA C 347 -3.576 -7.390 7.100 1.00 0.27 N ATOM 1435 CA ALA C 347 -2.762 -8.526 6.584 1.00 0.25 C ATOM 1436 C ALA C 347 -1.342 -8.439 7.150 1.00 0.26 C ATOM 1437 O ALA C 347 -0.845 -9.373 7.748 1.00 0.30 O ATOM 1438 CB ALA C 347 -2.713 -8.468 5.054 1.00 0.26 C ATOM 0 H ALA C 347 -3.772 -6.654 6.422 1.00 0.27 H new ATOM 0 HA ALA C 347 -3.216 -9.467 6.894 1.00 0.25 H new ATOM 0 HB1 ALA C 347 -2.117 -9.299 4.677 1.00 0.26 H new ATOM 0 HB2 ALA C 347 -3.725 -8.536 4.655 1.00 0.26 H new ATOM 0 HB3 ALA C 347 -2.262 -7.527 4.740 1.00 0.26 H new ATOM 1444 N LEU C 348 -0.684 -7.326 6.972 1.00 0.29 N ATOM 1445 CA LEU C 348 0.701 -7.189 7.506 1.00 0.37 C ATOM 1446 C LEU C 348 0.715 -7.601 8.979 1.00 0.41 C ATOM 1447 O LEU C 348 1.478 -8.453 9.389 1.00 0.46 O ATOM 1448 CB LEU C 348 1.159 -5.736 7.377 1.00 0.42 C ATOM 1449 CG LEU C 348 1.139 -5.323 5.905 1.00 0.41 C ATOM 1450 CD1 LEU C 348 1.327 -3.809 5.796 1.00 0.49 C ATOM 1451 CD2 LEU C 348 2.273 -6.032 5.162 1.00 0.48 C ATOM 0 H LEU C 348 -1.044 -6.508 6.481 1.00 0.29 H new ATOM 0 HA LEU C 348 1.376 -7.830 6.940 1.00 0.37 H new ATOM 0 HB2 LEU C 348 0.505 -5.085 7.957 1.00 0.42 H new ATOM 0 HB3 LEU C 348 2.164 -5.623 7.784 1.00 0.42 H new ATOM 0 HG LEU C 348 0.183 -5.602 5.463 1.00 0.41 H new ATOM 0 HD11 LEU C 348 1.313 -3.515 4.746 1.00 0.49 H new ATOM 0 HD12 LEU C 348 0.520 -3.303 6.325 1.00 0.49 H new ATOM 0 HD13 LEU C 348 2.283 -3.528 6.238 1.00 0.49 H new ATOM 0 HD21 LEU C 348 2.260 -5.738 4.112 1.00 0.48 H new ATOM 0 HD22 LEU C 348 3.229 -5.752 5.605 1.00 0.48 H new ATOM 0 HD23 LEU C 348 2.139 -7.111 5.239 1.00 0.48 H new ATOM 1463 N GLU C 349 -0.128 -7.005 9.776 1.00 0.44 N ATOM 1464 CA GLU C 349 -0.168 -7.366 11.220 1.00 0.51 C ATOM 1465 C GLU C 349 -0.478 -8.857 11.355 1.00 0.49 C ATOM 1466 O GLU C 349 -0.056 -9.507 12.290 1.00 0.57 O ATOM 1467 CB GLU C 349 -1.257 -6.552 11.921 1.00 0.57 C ATOM 1468 CG GLU C 349 -0.878 -6.346 13.388 1.00 0.98 C ATOM 1469 CD GLU C 349 -1.622 -5.130 13.944 1.00 0.92 C ATOM 1470 OE1 GLU C 349 -1.113 -4.031 13.796 1.00 1.48 O ATOM 1471 OE2 GLU C 349 -2.688 -5.319 14.507 1.00 1.42 O ATOM 0 H GLU C 349 -0.790 -6.284 9.490 1.00 0.44 H new ATOM 0 HA GLU C 349 0.796 -7.148 11.680 1.00 0.51 H new ATOM 0 HB2 GLU C 349 -1.379 -5.588 11.427 1.00 0.57 H new ATOM 0 HB3 GLU C 349 -2.214 -7.069 11.851 1.00 0.57 H new ATOM 0 HG2 GLU C 349 -1.129 -7.235 13.967 1.00 0.98 H new ATOM 0 HG3 GLU C 349 0.198 -6.199 13.479 1.00 0.98 H new ATOM 1478 N LEU C 350 -1.211 -9.404 10.424 1.00 0.40 N ATOM 1479 CA LEU C 350 -1.545 -10.852 10.497 1.00 0.38 C ATOM 1480 C LEU C 350 -0.262 -11.670 10.295 1.00 0.37 C ATOM 1481 O LEU C 350 -0.103 -12.742 10.845 1.00 0.41 O ATOM 1482 CB LEU C 350 -2.605 -11.183 9.424 1.00 0.34 C ATOM 1483 CG LEU C 350 -1.999 -11.980 8.262 1.00 0.27 C ATOM 1484 CD1 LEU C 350 -1.985 -13.466 8.623 1.00 0.31 C ATOM 1485 CD2 LEU C 350 -2.846 -11.770 7.004 1.00 0.36 C ATOM 0 H LEU C 350 -1.592 -8.910 9.617 1.00 0.40 H new ATOM 0 HA LEU C 350 -1.962 -11.104 11.472 1.00 0.38 H new ATOM 0 HB2 LEU C 350 -3.415 -11.756 9.876 1.00 0.34 H new ATOM 0 HB3 LEU C 350 -3.041 -10.259 9.044 1.00 0.34 H new ATOM 0 HG LEU C 350 -0.981 -11.639 8.076 1.00 0.27 H new ATOM 0 HD11 LEU C 350 -1.555 -14.036 7.800 1.00 0.31 H new ATOM 0 HD12 LEU C 350 -1.386 -13.617 9.521 1.00 0.31 H new ATOM 0 HD13 LEU C 350 -3.004 -13.806 8.806 1.00 0.31 H new ATOM 0 HD21 LEU C 350 -2.416 -12.336 6.177 1.00 0.36 H new ATOM 0 HD22 LEU C 350 -3.864 -12.114 7.189 1.00 0.36 H new ATOM 0 HD23 LEU C 350 -2.862 -10.710 6.749 1.00 0.36 H new ATOM 1497 N LYS C 351 0.657 -11.165 9.516 1.00 0.37 N ATOM 1498 CA LYS C 351 1.929 -11.906 9.288 1.00 0.42 C ATOM 1499 C LYS C 351 2.696 -11.992 10.607 1.00 0.53 C ATOM 1500 O LYS C 351 3.320 -12.989 10.913 1.00 0.58 O ATOM 1501 CB LYS C 351 2.776 -11.167 8.248 1.00 0.45 C ATOM 1502 CG LYS C 351 3.809 -12.127 7.655 1.00 0.56 C ATOM 1503 CD LYS C 351 4.805 -11.342 6.800 1.00 0.74 C ATOM 1504 CE LYS C 351 5.056 -12.093 5.491 1.00 1.38 C ATOM 1505 NZ LYS C 351 6.333 -11.622 4.884 1.00 1.72 N ATOM 0 H LYS C 351 0.581 -10.272 9.029 1.00 0.37 H new ATOM 0 HA LYS C 351 1.711 -12.909 8.922 1.00 0.42 H new ATOM 0 HB2 LYS C 351 2.137 -10.770 7.459 1.00 0.45 H new ATOM 0 HB3 LYS C 351 3.277 -10.316 8.710 1.00 0.45 H new ATOM 0 HG2 LYS C 351 4.334 -12.652 8.453 1.00 0.56 H new ATOM 0 HG3 LYS C 351 3.311 -12.884 7.049 1.00 0.56 H new ATOM 0 HD2 LYS C 351 4.415 -10.346 6.591 1.00 0.74 H new ATOM 0 HD3 LYS C 351 5.742 -11.211 7.342 1.00 0.74 H new ATOM 0 HE2 LYS C 351 5.104 -13.166 5.678 1.00 1.38 H new ATOM 0 HE3 LYS C 351 4.230 -11.927 4.800 1.00 1.38 H new ATOM 0 HZ1 LYS C 351 6.504 -12.133 3.994 1.00 1.72 H new ATOM 0 HZ2 LYS C 351 6.270 -10.602 4.691 1.00 1.72 H new ATOM 0 HZ3 LYS C 351 7.118 -11.802 5.542 1.00 1.72 H new ATOM 1519 N ASP C 352 2.649 -10.952 11.395 1.00 0.59 N ATOM 1520 CA ASP C 352 3.369 -10.970 12.699 1.00 0.72 C ATOM 1521 C ASP C 352 2.676 -11.956 13.641 1.00 0.77 C ATOM 1522 O ASP C 352 3.300 -12.560 14.491 1.00 0.92 O ATOM 1523 CB ASP C 352 3.341 -9.570 13.315 1.00 0.74 C ATOM 1524 CG ASP C 352 4.664 -9.301 14.035 1.00 1.05 C ATOM 1525 OD1 ASP C 352 5.464 -10.218 14.125 1.00 1.58 O ATOM 1526 OD2 ASP C 352 4.854 -8.183 14.484 1.00 1.66 O ATOM 0 H ASP C 352 2.143 -10.090 11.191 1.00 0.59 H new ATOM 0 HA ASP C 352 4.404 -11.276 12.544 1.00 0.72 H new ATOM 0 HB2 ASP C 352 3.179 -8.823 12.538 1.00 0.74 H new ATOM 0 HB3 ASP C 352 2.510 -9.486 14.016 1.00 0.74 H new ATOM 1531 N ALA C 353 1.390 -12.124 13.496 1.00 0.69 N ATOM 1532 CA ALA C 353 0.656 -13.071 14.380 1.00 0.78 C ATOM 1533 C ALA C 353 0.769 -14.487 13.814 1.00 0.80 C ATOM 1534 O ALA C 353 0.549 -15.463 14.504 1.00 1.29 O ATOM 1535 CB ALA C 353 -0.818 -12.666 14.448 1.00 0.78 C ATOM 0 H ALA C 353 0.816 -11.645 12.802 1.00 0.69 H new ATOM 0 HA ALA C 353 1.087 -13.043 15.381 1.00 0.78 H new ATOM 0 HB1 ALA C 353 -1.356 -13.359 15.095 1.00 0.78 H new ATOM 0 HB2 ALA C 353 -0.900 -11.656 14.850 1.00 0.78 H new ATOM 0 HB3 ALA C 353 -1.250 -12.694 13.447 1.00 0.78 H new ATOM 1541 N GLN C 354 1.111 -14.608 12.560 1.00 0.68 N ATOM 1542 CA GLN C 354 1.237 -15.960 11.949 1.00 0.65 C ATOM 1543 C GLN C 354 2.087 -16.852 12.854 1.00 1.12 C ATOM 1544 O GLN C 354 3.060 -16.416 13.436 1.00 1.51 O ATOM 1545 CB GLN C 354 1.905 -15.840 10.579 1.00 0.51 C ATOM 1546 CG GLN C 354 0.831 -15.813 9.493 1.00 0.46 C ATOM 1547 CD GLN C 354 1.395 -16.407 8.202 1.00 0.65 C ATOM 1548 OE1 GLN C 354 2.495 -16.084 7.801 1.00 1.62 O ATOM 1549 NE2 GLN C 354 0.681 -17.267 7.529 1.00 0.69 N ATOM 0 H GLN C 354 1.308 -13.828 11.933 1.00 0.68 H new ATOM 0 HA GLN C 354 0.246 -16.400 11.833 1.00 0.65 H new ATOM 0 HB2 GLN C 354 2.507 -14.932 10.534 1.00 0.51 H new ATOM 0 HB3 GLN C 354 2.581 -16.679 10.417 1.00 0.51 H new ATOM 0 HG2 GLN C 354 -0.042 -16.381 9.816 1.00 0.46 H new ATOM 0 HG3 GLN C 354 0.499 -14.789 9.320 1.00 0.46 H new ATOM 0 HE21 GLN C 354 -0.243 -17.538 7.866 1.00 0.69 H new ATOM 0 HE22 GLN C 354 1.047 -17.669 6.666 1.00 0.69 H new ATOM 1558 N ALA C 355 1.727 -18.100 12.976 1.00 1.70 N ATOM 1559 CA ALA C 355 2.514 -19.020 13.844 1.00 2.15 C ATOM 1560 C ALA C 355 1.838 -20.392 13.875 1.00 2.70 C ATOM 1561 O ALA C 355 2.551 -21.381 13.896 1.00 3.13 O ATOM 1562 CB ALA C 355 2.579 -18.450 15.262 1.00 2.63 C ATOM 1563 OXT ALA C 355 0.619 -20.429 13.877 1.00 3.17 O ATOM 0 H ALA C 355 0.922 -18.522 12.512 1.00 1.70 H new ATOM 0 HA ALA C 355 3.524 -19.122 13.447 1.00 2.15 H new ATOM 0 HB1 ALA C 355 3.155 -19.122 15.898 1.00 2.63 H new ATOM 0 HB2 ALA C 355 3.059 -17.472 15.239 1.00 2.63 H new ATOM 0 HB3 ALA C 355 1.569 -18.349 15.660 1.00 2.63 H new TER 1569 ALA C 355 ATOM 1570 N GLY D 325 -15.712 13.655 6.192 1.00 1.58 N ATOM 1571 CA GLY D 325 -14.696 12.687 6.694 1.00 0.97 C ATOM 1572 C GLY D 325 -14.202 13.132 8.072 1.00 0.88 C ATOM 1573 O GLY D 325 -14.445 14.242 8.501 1.00 1.09 O ATOM 0 HA2 GLY D 325 -15.129 11.689 6.756 1.00 0.97 H new ATOM 0 HA3 GLY D 325 -13.859 12.628 5.998 1.00 0.97 H new ATOM 1579 N GLU D 326 -13.510 12.273 8.771 1.00 0.72 N ATOM 1580 CA GLU D 326 -13.002 12.648 10.121 1.00 0.74 C ATOM 1581 C GLU D 326 -11.494 12.398 10.186 1.00 0.67 C ATOM 1582 O GLU D 326 -10.857 12.122 9.189 1.00 0.66 O ATOM 1583 CB GLU D 326 -13.706 11.801 11.184 1.00 0.88 C ATOM 1584 CG GLU D 326 -14.773 12.645 11.883 1.00 1.17 C ATOM 1585 CD GLU D 326 -15.028 12.087 13.285 1.00 1.36 C ATOM 1586 OE1 GLU D 326 -14.602 10.973 13.544 1.00 2.12 O ATOM 1587 OE2 GLU D 326 -15.644 12.783 14.075 1.00 1.72 O ATOM 0 H GLU D 326 -13.275 11.329 8.465 1.00 0.72 H new ATOM 0 HA GLU D 326 -13.203 13.703 10.305 1.00 0.74 H new ATOM 0 HB2 GLU D 326 -14.164 10.926 10.723 1.00 0.88 H new ATOM 0 HB3 GLU D 326 -12.982 11.436 11.912 1.00 0.88 H new ATOM 0 HG2 GLU D 326 -14.446 13.683 11.947 1.00 1.17 H new ATOM 0 HG3 GLU D 326 -15.696 12.636 11.303 1.00 1.17 H new ATOM 1594 N TYR D 327 -10.917 12.495 11.353 1.00 0.65 N ATOM 1595 CA TYR D 327 -9.451 12.265 11.481 1.00 0.60 C ATOM 1596 C TYR D 327 -9.200 10.862 12.039 1.00 0.53 C ATOM 1597 O TYR D 327 -9.604 10.540 13.138 1.00 0.62 O ATOM 1598 CB TYR D 327 -8.853 13.305 12.431 1.00 0.67 C ATOM 1599 CG TYR D 327 -8.328 14.475 11.633 1.00 0.78 C ATOM 1600 CD1 TYR D 327 -9.221 15.397 11.072 1.00 1.30 C ATOM 1601 CD2 TYR D 327 -6.949 14.639 11.454 1.00 1.64 C ATOM 1602 CE1 TYR D 327 -8.735 16.483 10.334 1.00 1.33 C ATOM 1603 CE2 TYR D 327 -6.463 15.725 10.716 1.00 1.87 C ATOM 1604 CZ TYR D 327 -7.356 16.646 10.155 1.00 1.23 C ATOM 1605 OH TYR D 327 -6.876 17.716 9.427 1.00 1.50 O ATOM 0 H TYR D 327 -11.398 12.724 12.223 1.00 0.65 H new ATOM 0 HA TYR D 327 -8.983 12.355 10.501 1.00 0.60 H new ATOM 0 HB2 TYR D 327 -9.610 13.644 13.138 1.00 0.67 H new ATOM 0 HB3 TYR D 327 -8.048 12.859 13.015 1.00 0.67 H new ATOM 0 HD1 TYR D 327 -10.285 15.270 11.209 1.00 1.30 H new ATOM 0 HD2 TYR D 327 -6.260 13.928 11.885 1.00 1.64 H new ATOM 0 HE1 TYR D 327 -9.424 17.195 9.903 1.00 1.33 H new ATOM 0 HE2 TYR D 327 -5.399 15.852 10.579 1.00 1.87 H new ATOM 0 HH TYR D 327 -5.897 17.681 9.401 1.00 1.50 H new ATOM 1615 N PHE D 328 -8.533 10.026 11.290 1.00 0.45 N ATOM 1616 CA PHE D 328 -8.254 8.646 11.779 1.00 0.40 C ATOM 1617 C PHE D 328 -6.752 8.488 12.020 1.00 0.34 C ATOM 1618 O PHE D 328 -5.943 9.171 11.422 1.00 0.41 O ATOM 1619 CB PHE D 328 -8.714 7.631 10.731 1.00 0.42 C ATOM 1620 CG PHE D 328 -10.220 7.522 10.762 1.00 0.44 C ATOM 1621 CD1 PHE D 328 -11.008 8.641 10.471 1.00 1.44 C ATOM 1622 CD2 PHE D 328 -10.827 6.302 11.083 1.00 1.12 C ATOM 1623 CE1 PHE D 328 -12.404 8.540 10.501 1.00 1.50 C ATOM 1624 CE2 PHE D 328 -12.223 6.201 11.113 1.00 1.12 C ATOM 1625 CZ PHE D 328 -13.012 7.320 10.822 1.00 0.62 C ATOM 0 H PHE D 328 -8.170 10.239 10.361 1.00 0.45 H new ATOM 0 HA PHE D 328 -8.792 8.473 12.711 1.00 0.40 H new ATOM 0 HB2 PHE D 328 -8.381 7.940 9.740 1.00 0.42 H new ATOM 0 HB3 PHE D 328 -8.264 6.658 10.930 1.00 0.42 H new ATOM 0 HD1 PHE D 328 -10.540 9.582 10.223 1.00 1.44 H new ATOM 0 HD2 PHE D 328 -10.218 5.439 11.308 1.00 1.12 H new ATOM 0 HE1 PHE D 328 -13.012 9.404 10.276 1.00 1.50 H new ATOM 0 HE2 PHE D 328 -12.691 5.260 11.361 1.00 1.12 H new ATOM 0 HZ PHE D 328 -14.089 7.243 10.845 1.00 0.62 H new ATOM 1635 N THR D 329 -6.369 7.597 12.893 1.00 0.42 N ATOM 1636 CA THR D 329 -4.918 7.402 13.170 1.00 0.39 C ATOM 1637 C THR D 329 -4.511 5.973 12.809 1.00 0.38 C ATOM 1638 O THR D 329 -5.183 5.019 13.149 1.00 0.48 O ATOM 1639 CB THR D 329 -4.645 7.646 14.656 1.00 0.37 C ATOM 1640 OG1 THR D 329 -5.742 8.342 15.231 1.00 0.39 O ATOM 1641 CG2 THR D 329 -3.371 8.478 14.813 1.00 0.39 C ATOM 0 H THR D 329 -6.998 6.996 13.426 1.00 0.42 H new ATOM 0 HA THR D 329 -4.340 8.105 12.571 1.00 0.39 H new ATOM 0 HB THR D 329 -4.516 6.690 15.163 1.00 0.37 H new ATOM 0 HG1 THR D 329 -5.568 8.497 16.183 1.00 0.39 H new ATOM 0 HG21 THR D 329 -3.178 8.651 15.872 1.00 0.39 H new ATOM 0 HG22 THR D 329 -2.530 7.942 14.373 1.00 0.39 H new ATOM 0 HG23 THR D 329 -3.496 9.435 14.306 1.00 0.39 H new ATOM 1649 N LEU D 330 -3.409 5.819 12.128 1.00 0.32 N ATOM 1650 CA LEU D 330 -2.948 4.454 11.750 1.00 0.33 C ATOM 1651 C LEU D 330 -1.630 4.160 12.468 1.00 0.31 C ATOM 1652 O LEU D 330 -0.560 4.358 11.929 1.00 0.28 O ATOM 1653 CB LEU D 330 -2.733 4.390 10.237 1.00 0.34 C ATOM 1654 CG LEU D 330 -3.428 3.152 9.669 1.00 0.48 C ATOM 1655 CD1 LEU D 330 -4.519 3.586 8.690 1.00 0.42 C ATOM 1656 CD2 LEU D 330 -2.402 2.286 8.934 1.00 0.92 C ATOM 0 H LEU D 330 -2.807 6.581 11.817 1.00 0.32 H new ATOM 0 HA LEU D 330 -3.697 3.716 12.038 1.00 0.33 H new ATOM 0 HB2 LEU D 330 -3.129 5.289 9.765 1.00 0.34 H new ATOM 0 HB3 LEU D 330 -1.667 4.355 10.013 1.00 0.34 H new ATOM 0 HG LEU D 330 -3.874 2.579 10.482 1.00 0.48 H new ATOM 0 HD11 LEU D 330 -5.015 2.704 8.284 1.00 0.42 H new ATOM 0 HD12 LEU D 330 -5.249 4.206 9.210 1.00 0.42 H new ATOM 0 HD13 LEU D 330 -4.072 4.157 7.877 1.00 0.42 H new ATOM 0 HD21 LEU D 330 -2.895 1.403 8.528 1.00 0.92 H new ATOM 0 HD22 LEU D 330 -1.958 2.860 8.120 1.00 0.92 H new ATOM 0 HD23 LEU D 330 -1.621 1.978 9.629 1.00 0.92 H new ATOM 1668 N GLN D 331 -1.699 3.698 13.686 1.00 0.34 N ATOM 1669 CA GLN D 331 -0.451 3.402 14.443 1.00 0.34 C ATOM 1670 C GLN D 331 0.127 2.063 13.982 1.00 0.37 C ATOM 1671 O GLN D 331 -0.449 1.016 14.205 1.00 0.42 O ATOM 1672 CB GLN D 331 -0.769 3.335 15.939 1.00 0.36 C ATOM 1673 CG GLN D 331 -0.947 4.753 16.486 1.00 1.06 C ATOM 1674 CD GLN D 331 -0.693 4.753 17.995 1.00 1.24 C ATOM 1675 OE1 GLN D 331 -0.134 3.816 18.529 1.00 2.05 O ATOM 1676 NE2 GLN D 331 -1.083 5.773 18.710 1.00 1.37 N ATOM 0 H GLN D 331 -2.566 3.513 14.190 1.00 0.34 H new ATOM 0 HA GLN D 331 0.279 4.190 14.260 1.00 0.34 H new ATOM 0 HB2 GLN D 331 -1.676 2.754 16.103 1.00 0.36 H new ATOM 0 HB3 GLN D 331 0.036 2.827 16.470 1.00 0.36 H new ATOM 0 HG2 GLN D 331 -0.256 5.435 15.990 1.00 1.06 H new ATOM 0 HG3 GLN D 331 -1.955 5.112 16.276 1.00 1.06 H new ATOM 0 HE21 GLN D 331 -1.552 6.560 18.262 1.00 1.37 H new ATOM 0 HE22 GLN D 331 -0.918 5.783 19.717 1.00 1.37 H new ATOM 1685 N ILE D 332 1.264 2.088 13.342 1.00 0.37 N ATOM 1686 CA ILE D 332 1.883 0.819 12.868 1.00 0.42 C ATOM 1687 C ILE D 332 3.174 0.562 13.648 1.00 0.43 C ATOM 1688 O ILE D 332 4.041 1.409 13.726 1.00 0.47 O ATOM 1689 CB ILE D 332 2.203 0.932 11.377 1.00 0.46 C ATOM 1690 CG1 ILE D 332 0.907 1.152 10.593 1.00 0.49 C ATOM 1691 CG2 ILE D 332 2.874 -0.356 10.899 1.00 0.54 C ATOM 1692 CD1 ILE D 332 1.088 2.320 9.622 1.00 0.47 C ATOM 0 H ILE D 332 1.791 2.934 13.127 1.00 0.37 H new ATOM 0 HA ILE D 332 1.189 -0.006 13.028 1.00 0.42 H new ATOM 0 HB ILE D 332 2.876 1.774 11.213 1.00 0.46 H new ATOM 0 HG12 ILE D 332 0.643 0.247 10.045 1.00 0.49 H new ATOM 0 HG13 ILE D 332 0.086 1.360 11.279 1.00 0.49 H new ATOM 0 HG21 ILE D 332 3.102 -0.275 9.836 1.00 0.54 H new ATOM 0 HG22 ILE D 332 3.797 -0.514 11.457 1.00 0.54 H new ATOM 0 HG23 ILE D 332 2.202 -1.199 11.063 1.00 0.54 H new ATOM 0 HD11 ILE D 332 0.165 2.476 9.064 1.00 0.47 H new ATOM 0 HD12 ILE D 332 1.331 3.224 10.181 1.00 0.47 H new ATOM 0 HD13 ILE D 332 1.897 2.094 8.928 1.00 0.47 H new ATOM 1704 N ARG D 333 3.309 -0.601 14.225 1.00 0.51 N ATOM 1705 CA ARG D 333 4.545 -0.908 14.998 1.00 0.55 C ATOM 1706 C ARG D 333 5.623 -1.434 14.049 1.00 0.54 C ATOM 1707 O ARG D 333 5.524 -2.526 13.525 1.00 0.83 O ATOM 1708 CB ARG D 333 4.235 -1.968 16.056 1.00 0.67 C ATOM 1709 CG ARG D 333 4.832 -1.538 17.397 1.00 1.46 C ATOM 1710 CD ARG D 333 4.739 -2.696 18.393 1.00 1.65 C ATOM 1711 NE ARG D 333 5.475 -3.874 17.854 1.00 2.45 N ATOM 1712 CZ ARG D 333 5.074 -5.082 18.143 1.00 2.74 C ATOM 1713 NH1 ARG D 333 5.114 -5.505 19.377 1.00 3.29 N ATOM 1714 NH2 ARG D 333 4.634 -5.867 17.198 1.00 3.09 N ATOM 0 H ARG D 333 2.618 -1.350 14.194 1.00 0.51 H new ATOM 0 HA ARG D 333 4.902 -0.001 15.486 1.00 0.55 H new ATOM 0 HB2 ARG D 333 3.157 -2.099 16.151 1.00 0.67 H new ATOM 0 HB3 ARG D 333 4.647 -2.931 15.754 1.00 0.67 H new ATOM 0 HG2 ARG D 333 5.872 -1.241 17.265 1.00 1.46 H new ATOM 0 HG3 ARG D 333 4.299 -0.669 17.783 1.00 1.46 H new ATOM 0 HD2 ARG D 333 5.160 -2.399 19.353 1.00 1.65 H new ATOM 0 HD3 ARG D 333 3.695 -2.955 18.569 1.00 1.65 H new ATOM 0 HE ARG D 333 6.292 -3.736 17.259 1.00 2.45 H new ATOM 0 HH11 ARG D 333 5.459 -4.892 20.115 1.00 3.29 H new ATOM 0 HH12 ARG D 333 4.801 -6.449 19.603 1.00 3.29 H new ATOM 0 HH21 ARG D 333 4.603 -5.537 16.233 1.00 3.09 H new ATOM 0 HH22 ARG D 333 4.321 -6.811 17.424 1.00 3.09 H new ATOM 1728 N GLY D 334 6.653 -0.666 13.822 1.00 0.53 N ATOM 1729 CA GLY D 334 7.736 -1.122 12.907 1.00 0.50 C ATOM 1730 C GLY D 334 8.479 0.092 12.347 1.00 0.49 C ATOM 1731 O GLY D 334 8.802 1.019 13.063 1.00 0.59 O ATOM 0 H GLY D 334 6.791 0.258 14.231 1.00 0.53 H new ATOM 0 HA2 GLY D 334 8.430 -1.770 13.443 1.00 0.50 H new ATOM 0 HA3 GLY D 334 7.314 -1.710 12.092 1.00 0.50 H new ATOM 1735 N ARG D 335 8.752 0.094 11.072 1.00 0.46 N ATOM 1736 CA ARG D 335 9.473 1.247 10.464 1.00 0.47 C ATOM 1737 C ARG D 335 9.375 1.159 8.940 1.00 0.43 C ATOM 1738 O ARG D 335 8.980 2.098 8.278 1.00 0.47 O ATOM 1739 CB ARG D 335 10.944 1.210 10.884 1.00 0.53 C ATOM 1740 CG ARG D 335 11.592 2.566 10.594 1.00 0.60 C ATOM 1741 CD ARG D 335 12.749 2.797 11.568 1.00 0.80 C ATOM 1742 NE ARG D 335 12.876 4.254 11.852 1.00 0.89 N ATOM 1743 CZ ARG D 335 14.055 4.783 12.034 1.00 1.24 C ATOM 1744 NH1 ARG D 335 14.622 4.724 13.207 1.00 2.05 N ATOM 1745 NH2 ARG D 335 14.666 5.371 11.042 1.00 1.58 N ATOM 0 H ARG D 335 8.507 -0.654 10.424 1.00 0.46 H new ATOM 0 HA ARG D 335 9.023 2.179 10.806 1.00 0.47 H new ATOM 0 HB2 ARG D 335 11.024 0.976 11.946 1.00 0.53 H new ATOM 0 HB3 ARG D 335 11.468 0.422 10.343 1.00 0.53 H new ATOM 0 HG2 ARG D 335 11.956 2.595 9.567 1.00 0.60 H new ATOM 0 HG3 ARG D 335 10.854 3.362 10.693 1.00 0.60 H new ATOM 0 HD2 ARG D 335 12.574 2.249 12.494 1.00 0.80 H new ATOM 0 HD3 ARG D 335 13.678 2.416 11.143 1.00 0.80 H new ATOM 0 HE ARG D 335 12.041 4.838 11.904 1.00 0.89 H new ATOM 0 HH11 ARG D 335 14.144 4.264 13.982 1.00 2.05 H new ATOM 0 HH12 ARG D 335 15.544 5.137 13.349 1.00 2.05 H new ATOM 0 HH21 ARG D 335 14.222 5.417 10.125 1.00 1.58 H new ATOM 0 HH22 ARG D 335 15.588 5.785 11.184 1.00 1.58 H new ATOM 1759 N GLU D 336 9.729 0.035 8.379 1.00 0.43 N ATOM 1760 CA GLU D 336 9.652 -0.114 6.900 1.00 0.43 C ATOM 1761 C GLU D 336 8.185 -0.132 6.470 1.00 0.38 C ATOM 1762 O GLU D 336 7.776 0.602 5.593 1.00 0.39 O ATOM 1763 CB GLU D 336 10.324 -1.424 6.481 1.00 0.47 C ATOM 1764 CG GLU D 336 11.767 -1.144 6.059 1.00 1.18 C ATOM 1765 CD GLU D 336 12.498 -2.468 5.831 1.00 1.64 C ATOM 1766 OE1 GLU D 336 12.480 -3.295 6.728 1.00 2.25 O ATOM 1767 OE2 GLU D 336 13.064 -2.633 4.762 1.00 2.15 O ATOM 0 H GLU D 336 10.068 -0.785 8.881 1.00 0.43 H new ATOM 0 HA GLU D 336 10.163 0.722 6.422 1.00 0.43 H new ATOM 0 HB2 GLU D 336 10.307 -2.135 7.307 1.00 0.47 H new ATOM 0 HB3 GLU D 336 9.775 -1.880 5.657 1.00 0.47 H new ATOM 0 HG2 GLU D 336 11.781 -0.547 5.147 1.00 1.18 H new ATOM 0 HG3 GLU D 336 12.276 -0.563 6.828 1.00 1.18 H new ATOM 1774 N ARG D 337 7.387 -0.964 7.083 1.00 0.39 N ATOM 1775 CA ARG D 337 5.946 -1.022 6.710 1.00 0.36 C ATOM 1776 C ARG D 337 5.338 0.376 6.832 1.00 0.33 C ATOM 1777 O ARG D 337 4.580 0.810 5.987 1.00 0.34 O ATOM 1778 CB ARG D 337 5.212 -1.984 7.647 1.00 0.39 C ATOM 1779 CG ARG D 337 5.010 -3.327 6.942 1.00 0.66 C ATOM 1780 CD ARG D 337 4.325 -4.308 7.895 1.00 0.42 C ATOM 1781 NE ARG D 337 5.075 -4.356 9.181 1.00 1.05 N ATOM 1782 CZ ARG D 337 5.496 -5.499 9.649 1.00 1.25 C ATOM 1783 NH1 ARG D 337 6.473 -6.127 9.055 1.00 1.85 N ATOM 1784 NH2 ARG D 337 4.939 -6.015 10.710 1.00 1.95 N ATOM 0 H ARG D 337 7.671 -1.605 7.824 1.00 0.39 H new ATOM 0 HA ARG D 337 5.848 -1.375 5.684 1.00 0.36 H new ATOM 0 HB2 ARG D 337 5.785 -2.125 8.563 1.00 0.39 H new ATOM 0 HB3 ARG D 337 4.248 -1.564 7.935 1.00 0.39 H new ATOM 0 HG2 ARG D 337 4.404 -3.191 6.046 1.00 0.66 H new ATOM 0 HG3 ARG D 337 5.971 -3.728 6.620 1.00 0.66 H new ATOM 0 HD2 ARG D 337 3.295 -3.999 8.074 1.00 0.42 H new ATOM 0 HD3 ARG D 337 4.287 -5.301 7.447 1.00 0.42 H new ATOM 0 HE ARG D 337 5.260 -3.495 9.696 1.00 1.05 H new ATOM 0 HH11 ARG D 337 6.908 -5.725 8.225 1.00 1.85 H new ATOM 0 HH12 ARG D 337 6.802 -7.020 9.421 1.00 1.85 H new ATOM 0 HH21 ARG D 337 4.174 -5.525 11.174 1.00 1.95 H new ATOM 0 HH22 ARG D 337 5.268 -6.908 11.076 1.00 1.95 H new ATOM 1798 N PHE D 338 5.669 1.089 7.875 1.00 0.32 N ATOM 1799 CA PHE D 338 5.114 2.460 8.043 1.00 0.31 C ATOM 1800 C PHE D 338 5.491 3.305 6.826 1.00 0.30 C ATOM 1801 O PHE D 338 4.712 4.106 6.348 1.00 0.31 O ATOM 1802 CB PHE D 338 5.694 3.098 9.308 1.00 0.33 C ATOM 1803 CG PHE D 338 5.178 4.511 9.440 1.00 0.36 C ATOM 1804 CD1 PHE D 338 3.879 4.741 9.910 1.00 1.29 C ATOM 1805 CD2 PHE D 338 5.997 5.591 9.091 1.00 1.14 C ATOM 1806 CE1 PHE D 338 3.401 6.051 10.031 1.00 1.36 C ATOM 1807 CE2 PHE D 338 5.519 6.901 9.212 1.00 1.15 C ATOM 1808 CZ PHE D 338 4.220 7.131 9.683 1.00 0.59 C ATOM 0 H PHE D 338 6.299 0.781 8.616 1.00 0.32 H new ATOM 0 HA PHE D 338 4.029 2.407 8.133 1.00 0.31 H new ATOM 0 HB2 PHE D 338 5.414 2.514 10.184 1.00 0.33 H new ATOM 0 HB3 PHE D 338 6.783 3.100 9.261 1.00 0.33 H new ATOM 0 HD1 PHE D 338 3.246 3.908 10.179 1.00 1.29 H new ATOM 0 HD2 PHE D 338 6.999 5.413 8.728 1.00 1.14 H new ATOM 0 HE1 PHE D 338 2.399 6.228 10.393 1.00 1.36 H new ATOM 0 HE2 PHE D 338 6.151 7.734 8.942 1.00 1.15 H new ATOM 0 HZ PHE D 338 3.851 8.141 9.778 1.00 0.59 H new ATOM 1818 N GLU D 339 6.680 3.127 6.316 1.00 0.32 N ATOM 1819 CA GLU D 339 7.104 3.915 5.125 1.00 0.34 C ATOM 1820 C GLU D 339 6.235 3.520 3.930 1.00 0.31 C ATOM 1821 O GLU D 339 5.764 4.358 3.188 1.00 0.31 O ATOM 1822 CB GLU D 339 8.571 3.617 4.810 1.00 0.41 C ATOM 1823 CG GLU D 339 9.454 4.163 5.934 1.00 0.55 C ATOM 1824 CD GLU D 339 10.811 4.577 5.362 1.00 0.94 C ATOM 1825 OE1 GLU D 339 11.179 4.052 4.324 1.00 1.62 O ATOM 1826 OE2 GLU D 339 11.460 5.411 5.972 1.00 1.47 O ATOM 0 H GLU D 339 7.375 2.471 6.673 1.00 0.32 H new ATOM 0 HA GLU D 339 6.989 4.980 5.329 1.00 0.34 H new ATOM 0 HB2 GLU D 339 8.721 2.542 4.705 1.00 0.41 H new ATOM 0 HB3 GLU D 339 8.850 4.072 3.860 1.00 0.41 H new ATOM 0 HG2 GLU D 339 8.971 5.018 6.408 1.00 0.55 H new ATOM 0 HG3 GLU D 339 9.589 3.405 6.706 1.00 0.55 H new ATOM 1833 N MET D 340 6.012 2.247 3.745 1.00 0.31 N ATOM 1834 CA MET D 340 5.166 1.798 2.605 1.00 0.31 C ATOM 1835 C MET D 340 3.870 2.608 2.598 1.00 0.27 C ATOM 1836 O MET D 340 3.546 3.273 1.634 1.00 0.28 O ATOM 1837 CB MET D 340 4.835 0.313 2.771 1.00 0.35 C ATOM 1838 CG MET D 340 5.833 -0.527 1.973 1.00 0.36 C ATOM 1839 SD MET D 340 5.803 -2.233 2.577 1.00 0.64 S ATOM 1840 CE MET D 340 4.012 -2.367 2.804 1.00 0.39 C ATOM 0 H MET D 340 6.379 1.500 4.334 1.00 0.31 H new ATOM 0 HA MET D 340 5.701 1.948 1.667 1.00 0.31 H new ATOM 0 HB2 MET D 340 4.873 0.037 3.825 1.00 0.35 H new ATOM 0 HB3 MET D 340 3.820 0.115 2.426 1.00 0.35 H new ATOM 0 HG2 MET D 340 5.581 -0.501 0.913 1.00 0.36 H new ATOM 0 HG3 MET D 340 6.836 -0.112 2.073 1.00 0.36 H new ATOM 0 HE1 MET D 340 3.726 -3.419 2.829 1.00 0.39 H new ATOM 0 HE2 MET D 340 3.728 -1.891 3.743 1.00 0.39 H new ATOM 0 HE3 MET D 340 3.502 -1.872 1.977 1.00 0.39 H new ATOM 1850 N PHE D 341 3.130 2.560 3.671 1.00 0.27 N ATOM 1851 CA PHE D 341 1.858 3.330 3.735 1.00 0.28 C ATOM 1852 C PHE D 341 2.163 4.816 3.556 1.00 0.29 C ATOM 1853 O PHE D 341 1.384 5.557 2.993 1.00 0.36 O ATOM 1854 CB PHE D 341 1.195 3.106 5.095 1.00 0.31 C ATOM 1855 CG PHE D 341 0.555 1.739 5.126 1.00 0.29 C ATOM 1856 CD1 PHE D 341 -0.179 1.283 4.024 1.00 1.22 C ATOM 1857 CD2 PHE D 341 0.696 0.927 6.258 1.00 1.27 C ATOM 1858 CE1 PHE D 341 -0.771 0.017 4.054 1.00 1.22 C ATOM 1859 CE2 PHE D 341 0.103 -0.340 6.287 1.00 1.30 C ATOM 1860 CZ PHE D 341 -0.631 -0.796 5.186 1.00 0.37 C ATOM 0 H PHE D 341 3.352 2.020 4.507 1.00 0.27 H new ATOM 0 HA PHE D 341 1.185 2.995 2.945 1.00 0.28 H new ATOM 0 HB2 PHE D 341 1.935 3.190 5.890 1.00 0.31 H new ATOM 0 HB3 PHE D 341 0.444 3.875 5.276 1.00 0.31 H new ATOM 0 HD1 PHE D 341 -0.288 1.909 3.151 1.00 1.22 H new ATOM 0 HD2 PHE D 341 1.262 1.278 7.108 1.00 1.27 H new ATOM 0 HE1 PHE D 341 -1.337 -0.334 3.204 1.00 1.22 H new ATOM 0 HE2 PHE D 341 0.212 -0.967 7.160 1.00 1.30 H new ATOM 0 HZ PHE D 341 -1.089 -1.774 5.209 1.00 0.37 H new ATOM 1870 N ARG D 342 3.296 5.256 4.031 1.00 0.28 N ATOM 1871 CA ARG D 342 3.655 6.693 3.887 1.00 0.31 C ATOM 1872 C ARG D 342 3.681 7.059 2.402 1.00 0.31 C ATOM 1873 O ARG D 342 3.316 8.151 2.016 1.00 0.36 O ATOM 1874 CB ARG D 342 5.034 6.941 4.502 1.00 0.35 C ATOM 1875 CG ARG D 342 4.889 7.841 5.730 1.00 0.52 C ATOM 1876 CD ARG D 342 6.114 8.752 5.842 1.00 0.85 C ATOM 1877 NE ARG D 342 5.681 10.176 5.783 1.00 1.27 N ATOM 1878 CZ ARG D 342 6.471 11.116 6.223 1.00 1.76 C ATOM 1879 NH1 ARG D 342 6.496 11.406 7.495 1.00 2.37 N ATOM 1880 NH2 ARG D 342 7.238 11.767 5.391 1.00 2.36 N ATOM 0 H ARG D 342 3.988 4.682 4.512 1.00 0.28 H new ATOM 0 HA ARG D 342 2.917 7.308 4.402 1.00 0.31 H new ATOM 0 HB2 ARG D 342 5.494 5.994 4.784 1.00 0.35 H new ATOM 0 HB3 ARG D 342 5.692 7.409 3.770 1.00 0.35 H new ATOM 0 HG2 ARG D 342 3.982 8.441 5.650 1.00 0.52 H new ATOM 0 HG3 ARG D 342 4.791 7.234 6.630 1.00 0.52 H new ATOM 0 HD2 ARG D 342 6.640 8.559 6.777 1.00 0.85 H new ATOM 0 HD3 ARG D 342 6.814 8.540 5.033 1.00 0.85 H new ATOM 0 HE ARG D 342 4.767 10.416 5.399 1.00 1.27 H new ATOM 0 HH11 ARG D 342 5.898 10.897 8.146 1.00 2.37 H new ATOM 0 HH12 ARG D 342 7.114 12.141 7.838 1.00 2.37 H new ATOM 0 HH21 ARG D 342 7.220 11.541 4.397 1.00 2.36 H new ATOM 0 HH22 ARG D 342 7.856 12.502 5.735 1.00 2.36 H new ATOM 1894 N GLU D 343 4.104 6.151 1.565 1.00 0.28 N ATOM 1895 CA GLU D 343 4.142 6.448 0.106 1.00 0.29 C ATOM 1896 C GLU D 343 2.710 6.516 -0.422 1.00 0.24 C ATOM 1897 O GLU D 343 2.303 7.493 -1.019 1.00 0.27 O ATOM 1898 CB GLU D 343 4.908 5.345 -0.627 1.00 0.34 C ATOM 1899 CG GLU D 343 5.270 5.827 -2.034 1.00 0.38 C ATOM 1900 CD GLU D 343 6.708 6.346 -2.042 1.00 0.81 C ATOM 1901 OE1 GLU D 343 7.593 5.589 -1.677 1.00 1.33 O ATOM 1902 OE2 GLU D 343 6.902 7.492 -2.412 1.00 1.63 O ATOM 0 H GLU D 343 4.424 5.219 1.828 1.00 0.28 H new ATOM 0 HA GLU D 343 4.645 7.400 -0.062 1.00 0.29 H new ATOM 0 HB2 GLU D 343 5.812 5.086 -0.075 1.00 0.34 H new ATOM 0 HB3 GLU D 343 4.301 4.442 -0.685 1.00 0.34 H new ATOM 0 HG2 GLU D 343 5.163 5.011 -2.748 1.00 0.38 H new ATOM 0 HG3 GLU D 343 4.586 6.616 -2.347 1.00 0.38 H new ATOM 1909 N LEU D 344 1.936 5.489 -0.197 1.00 0.24 N ATOM 1910 CA LEU D 344 0.527 5.504 -0.675 1.00 0.26 C ATOM 1911 C LEU D 344 -0.177 6.725 -0.082 1.00 0.28 C ATOM 1912 O LEU D 344 -1.185 7.181 -0.583 1.00 0.44 O ATOM 1913 CB LEU D 344 -0.189 4.230 -0.211 1.00 0.32 C ATOM 1914 CG LEU D 344 0.387 2.993 -0.919 1.00 0.27 C ATOM 1915 CD1 LEU D 344 0.751 3.328 -2.368 1.00 0.31 C ATOM 1916 CD2 LEU D 344 1.636 2.513 -0.178 1.00 0.38 C ATOM 0 H LEU D 344 2.219 4.642 0.296 1.00 0.24 H new ATOM 0 HA LEU D 344 0.506 5.550 -1.764 1.00 0.26 H new ATOM 0 HB2 LEU D 344 -0.082 4.120 0.868 1.00 0.32 H new ATOM 0 HB3 LEU D 344 -1.256 4.310 -0.419 1.00 0.32 H new ATOM 0 HG LEU D 344 -0.367 2.206 -0.918 1.00 0.27 H new ATOM 0 HD11 LEU D 344 1.157 2.442 -2.855 1.00 0.31 H new ATOM 0 HD12 LEU D 344 -0.141 3.658 -2.900 1.00 0.31 H new ATOM 0 HD13 LEU D 344 1.496 4.123 -2.381 1.00 0.31 H new ATOM 0 HD21 LEU D 344 2.043 1.636 -0.681 1.00 0.38 H new ATOM 0 HD22 LEU D 344 2.383 3.307 -0.172 1.00 0.38 H new ATOM 0 HD23 LEU D 344 1.373 2.254 0.848 1.00 0.38 H new ATOM 1928 N ASN D 345 0.353 7.254 0.987 1.00 0.40 N ATOM 1929 CA ASN D 345 -0.271 8.446 1.626 1.00 0.49 C ATOM 1930 C ASN D 345 0.223 9.713 0.927 1.00 0.43 C ATOM 1931 O ASN D 345 -0.489 10.690 0.814 1.00 0.48 O ATOM 1932 CB ASN D 345 0.128 8.494 3.102 1.00 0.65 C ATOM 1933 CG ASN D 345 -1.125 8.449 3.978 1.00 0.94 C ATOM 1934 OD1 ASN D 345 -2.225 8.309 3.480 1.00 1.77 O ATOM 1935 ND2 ASN D 345 -1.004 8.563 5.272 1.00 1.32 N ATOM 0 H ASN D 345 1.196 6.909 1.447 1.00 0.40 H new ATOM 0 HA ASN D 345 -1.356 8.381 1.541 1.00 0.49 H new ATOM 0 HB2 ASN D 345 0.780 7.653 3.340 1.00 0.65 H new ATOM 0 HB3 ASN D 345 0.693 9.403 3.306 1.00 0.65 H new ATOM 0 HD21 ASN D 345 -1.833 8.535 5.866 1.00 1.32 H new ATOM 0 HD22 ASN D 345 -0.081 8.680 5.690 1.00 1.32 H new ATOM 1942 N GLU D 346 1.441 9.705 0.460 1.00 0.38 N ATOM 1943 CA GLU D 346 1.982 10.908 -0.230 1.00 0.38 C ATOM 1944 C GLU D 346 1.232 11.122 -1.545 1.00 0.32 C ATOM 1945 O GLU D 346 0.941 12.236 -1.927 1.00 0.37 O ATOM 1946 CB GLU D 346 3.471 10.703 -0.520 1.00 0.40 C ATOM 1947 CG GLU D 346 4.198 12.047 -0.442 1.00 0.87 C ATOM 1948 CD GLU D 346 5.628 11.827 0.056 1.00 1.11 C ATOM 1949 OE1 GLU D 346 6.465 11.458 -0.752 1.00 1.59 O ATOM 1950 OE2 GLU D 346 5.862 12.031 1.236 1.00 1.90 O ATOM 0 H GLU D 346 2.085 8.917 0.527 1.00 0.38 H new ATOM 0 HA GLU D 346 1.853 11.782 0.408 1.00 0.38 H new ATOM 0 HB2 GLU D 346 3.899 10.004 0.199 1.00 0.40 H new ATOM 0 HB3 GLU D 346 3.602 10.264 -1.509 1.00 0.40 H new ATOM 0 HG2 GLU D 346 4.212 12.522 -1.423 1.00 0.87 H new ATOM 0 HG3 GLU D 346 3.667 12.721 0.231 1.00 0.87 H new ATOM 1957 N ALA D 347 0.918 10.062 -2.240 1.00 0.26 N ATOM 1958 CA ALA D 347 0.189 10.206 -3.532 1.00 0.24 C ATOM 1959 C ALA D 347 -1.270 10.579 -3.262 1.00 0.26 C ATOM 1960 O ALA D 347 -1.770 11.566 -3.763 1.00 0.30 O ATOM 1961 CB ALA D 347 0.242 8.883 -4.299 1.00 0.27 C ATOM 0 H ALA D 347 1.135 9.103 -1.969 1.00 0.26 H new ATOM 0 HA ALA D 347 0.659 10.991 -4.125 1.00 0.24 H new ATOM 0 HB1 ALA D 347 -0.291 8.989 -5.244 1.00 0.27 H new ATOM 0 HB2 ALA D 347 1.281 8.618 -4.496 1.00 0.27 H new ATOM 0 HB3 ALA D 347 -0.226 8.099 -3.704 1.00 0.27 H new ATOM 1967 N LEU D 348 -1.959 9.798 -2.475 1.00 0.29 N ATOM 1968 CA LEU D 348 -3.384 10.116 -2.179 1.00 0.37 C ATOM 1969 C LEU D 348 -3.492 11.576 -1.740 1.00 0.41 C ATOM 1970 O LEU D 348 -4.248 12.348 -2.295 1.00 0.46 O ATOM 1971 CB LEU D 348 -3.888 9.205 -1.058 1.00 0.42 C ATOM 1972 CG LEU D 348 -3.771 7.745 -1.496 1.00 0.41 C ATOM 1973 CD1 LEU D 348 -4.013 6.830 -0.295 1.00 0.48 C ATOM 1974 CD2 LEU D 348 -4.814 7.453 -2.577 1.00 0.48 C ATOM 0 H LEU D 348 -1.598 8.956 -2.026 1.00 0.29 H new ATOM 0 HA LEU D 348 -3.989 9.957 -3.072 1.00 0.37 H new ATOM 0 HB2 LEU D 348 -3.307 9.371 -0.151 1.00 0.42 H new ATOM 0 HB3 LEU D 348 -4.925 9.443 -0.820 1.00 0.42 H new ATOM 0 HG LEU D 348 -2.773 7.564 -1.894 1.00 0.41 H new ATOM 0 HD11 LEU D 348 -3.929 5.789 -0.608 1.00 0.48 H new ATOM 0 HD12 LEU D 348 -3.271 7.038 0.476 1.00 0.48 H new ATOM 0 HD13 LEU D 348 -5.011 7.010 0.104 1.00 0.48 H new ATOM 0 HD21 LEU D 348 -4.732 6.412 -2.890 1.00 0.48 H new ATOM 0 HD22 LEU D 348 -5.812 7.634 -2.178 1.00 0.48 H new ATOM 0 HD23 LEU D 348 -4.642 8.104 -3.434 1.00 0.48 H new ATOM 1986 N GLU D 349 -2.735 11.962 -0.750 1.00 0.44 N ATOM 1987 CA GLU D 349 -2.787 13.374 -0.280 1.00 0.52 C ATOM 1988 C GLU D 349 -2.425 14.300 -1.440 1.00 0.49 C ATOM 1989 O GLU D 349 -2.888 15.420 -1.523 1.00 0.57 O ATOM 1990 CB GLU D 349 -1.786 13.570 0.861 1.00 0.57 C ATOM 1991 CG GLU D 349 -2.281 14.680 1.789 1.00 0.99 C ATOM 1992 CD GLU D 349 -1.631 14.523 3.165 1.00 0.92 C ATOM 1993 OE1 GLU D 349 -2.172 13.786 3.973 1.00 1.48 O ATOM 1994 OE2 GLU D 349 -0.604 15.142 3.387 1.00 1.43 O ATOM 0 H GLU D 349 -2.083 11.360 -0.247 1.00 0.44 H new ATOM 0 HA GLU D 349 -3.790 13.606 0.077 1.00 0.52 H new ATOM 0 HB2 GLU D 349 -1.668 12.641 1.419 1.00 0.57 H new ATOM 0 HB3 GLU D 349 -0.806 13.827 0.459 1.00 0.57 H new ATOM 0 HG2 GLU D 349 -2.037 15.656 1.369 1.00 0.99 H new ATOM 0 HG3 GLU D 349 -3.366 14.635 1.880 1.00 0.99 H new ATOM 2001 N LEU D 350 -1.602 13.838 -2.341 1.00 0.39 N ATOM 2002 CA LEU D 350 -1.213 14.689 -3.497 1.00 0.38 C ATOM 2003 C LEU D 350 -2.444 14.912 -4.389 1.00 0.37 C ATOM 2004 O LEU D 350 -2.594 15.945 -5.010 1.00 0.40 O ATOM 2005 CB LEU D 350 -0.068 13.999 -4.271 1.00 0.34 C ATOM 2006 CG LEU D 350 -0.559 13.424 -5.605 1.00 0.27 C ATOM 2007 CD1 LEU D 350 -0.533 14.525 -6.663 1.00 0.31 C ATOM 2008 CD2 LEU D 350 0.362 12.283 -6.043 1.00 0.36 C ATOM 0 H LEU D 350 -1.183 12.908 -2.325 1.00 0.39 H new ATOM 0 HA LEU D 350 -0.855 15.661 -3.158 1.00 0.38 H new ATOM 0 HB2 LEU D 350 0.732 14.716 -4.455 1.00 0.34 H new ATOM 0 HB3 LEU D 350 0.354 13.199 -3.662 1.00 0.34 H new ATOM 0 HG LEU D 350 -1.574 13.045 -5.487 1.00 0.27 H new ATOM 0 HD11 LEU D 350 -0.881 14.123 -7.615 1.00 0.31 H new ATOM 0 HD12 LEU D 350 -1.185 15.342 -6.354 1.00 0.31 H new ATOM 0 HD13 LEU D 350 0.485 14.896 -6.777 1.00 0.31 H new ATOM 0 HD21 LEU D 350 0.011 11.876 -6.991 1.00 0.36 H new ATOM 0 HD22 LEU D 350 1.377 12.661 -6.164 1.00 0.36 H new ATOM 0 HD23 LEU D 350 0.354 11.498 -5.286 1.00 0.36 H new ATOM 2020 N LYS D 351 -3.326 13.950 -4.447 1.00 0.37 N ATOM 2021 CA LYS D 351 -4.546 14.107 -5.287 1.00 0.42 C ATOM 2022 C LYS D 351 -5.406 15.231 -4.713 1.00 0.53 C ATOM 2023 O LYS D 351 -6.010 15.999 -5.436 1.00 0.58 O ATOM 2024 CB LYS D 351 -5.342 12.798 -5.285 1.00 0.45 C ATOM 2025 CG LYS D 351 -6.285 12.770 -6.490 1.00 0.57 C ATOM 2026 CD LYS D 351 -7.243 11.582 -6.364 1.00 0.75 C ATOM 2027 CE LYS D 351 -7.361 10.874 -7.715 1.00 1.38 C ATOM 2028 NZ LYS D 351 -8.606 10.056 -7.741 1.00 1.72 N ATOM 0 H LYS D 351 -3.253 13.063 -3.949 1.00 0.37 H new ATOM 0 HA LYS D 351 -4.259 14.350 -6.310 1.00 0.42 H new ATOM 0 HB2 LYS D 351 -4.662 11.947 -5.322 1.00 0.45 H new ATOM 0 HB3 LYS D 351 -5.913 12.709 -4.361 1.00 0.45 H new ATOM 0 HG2 LYS D 351 -6.849 13.701 -6.545 1.00 0.57 H new ATOM 0 HG3 LYS D 351 -5.710 12.691 -7.413 1.00 0.57 H new ATOM 0 HD2 LYS D 351 -6.879 10.886 -5.608 1.00 0.75 H new ATOM 0 HD3 LYS D 351 -8.224 11.926 -6.035 1.00 0.75 H new ATOM 0 HE2 LYS D 351 -7.378 11.607 -8.521 1.00 1.38 H new ATOM 0 HE3 LYS D 351 -6.492 10.238 -7.881 1.00 1.38 H new ATOM 0 HZ1 LYS D 351 -8.686 9.575 -8.659 1.00 1.72 H new ATOM 0 HZ2 LYS D 351 -8.572 9.347 -6.981 1.00 1.72 H new ATOM 0 HZ3 LYS D 351 -9.431 10.674 -7.601 1.00 1.72 H new ATOM 2042 N ASP D 352 -5.460 15.337 -3.414 1.00 0.59 N ATOM 2043 CA ASP D 352 -6.273 16.415 -2.788 1.00 0.72 C ATOM 2044 C ASP D 352 -5.612 17.767 -3.064 1.00 0.77 C ATOM 2045 O ASP D 352 -6.270 18.783 -3.162 1.00 0.92 O ATOM 2046 CB ASP D 352 -6.350 16.182 -1.278 1.00 0.74 C ATOM 2047 CG ASP D 352 -7.734 16.587 -0.768 1.00 1.05 C ATOM 2048 OD1 ASP D 352 -8.499 17.121 -1.553 1.00 1.58 O ATOM 2049 OD2 ASP D 352 -8.004 16.355 0.399 1.00 1.66 O ATOM 0 H ASP D 352 -4.976 14.723 -2.759 1.00 0.59 H new ATOM 0 HA ASP D 352 -7.279 16.407 -3.207 1.00 0.72 H new ATOM 0 HB2 ASP D 352 -6.160 15.133 -1.051 1.00 0.74 H new ATOM 0 HB3 ASP D 352 -5.580 16.762 -0.770 1.00 0.74 H new ATOM 2054 N ALA D 353 -4.313 17.784 -3.192 1.00 0.69 N ATOM 2055 CA ALA D 353 -3.606 19.067 -3.463 1.00 0.78 C ATOM 2056 C ALA D 353 -3.616 19.346 -4.967 1.00 0.80 C ATOM 2057 O ALA D 353 -3.410 20.462 -5.402 1.00 1.29 O ATOM 2058 CB ALA D 353 -2.160 18.965 -2.973 1.00 0.78 C ATOM 0 H ALA D 353 -3.711 16.964 -3.120 1.00 0.69 H new ATOM 0 HA ALA D 353 -4.111 19.879 -2.939 1.00 0.78 H new ATOM 0 HB1 ALA D 353 -1.642 19.903 -3.171 1.00 0.78 H new ATOM 0 HB2 ALA D 353 -2.152 18.765 -1.902 1.00 0.78 H new ATOM 0 HB3 ALA D 353 -1.655 18.154 -3.497 1.00 0.78 H new ATOM 2064 N GLN D 354 -3.852 18.342 -5.766 1.00 0.67 N ATOM 2065 CA GLN D 354 -3.872 18.552 -7.241 1.00 0.64 C ATOM 2066 C GLN D 354 -4.754 19.757 -7.572 1.00 1.11 C ATOM 2067 O GLN D 354 -5.785 19.970 -6.966 1.00 1.50 O ATOM 2068 CB GLN D 354 -4.430 17.305 -7.929 1.00 0.51 C ATOM 2069 CG GLN D 354 -3.269 16.451 -8.440 1.00 0.46 C ATOM 2070 CD GLN D 354 -3.728 15.621 -9.637 1.00 0.65 C ATOM 2071 OE1 GLN D 354 -4.828 15.104 -9.651 1.00 1.62 O ATOM 2072 NE2 GLN D 354 -2.922 15.470 -10.650 1.00 0.67 N ATOM 0 H GLN D 354 -4.032 17.385 -5.461 1.00 0.67 H new ATOM 0 HA GLN D 354 -2.858 18.736 -7.595 1.00 0.64 H new ATOM 0 HB2 GLN D 354 -5.039 16.731 -7.230 1.00 0.51 H new ATOM 0 HB3 GLN D 354 -5.079 17.591 -8.757 1.00 0.51 H new ATOM 0 HG2 GLN D 354 -2.434 17.090 -8.727 1.00 0.46 H new ATOM 0 HG3 GLN D 354 -2.911 15.795 -7.647 1.00 0.46 H new ATOM 0 HE21 GLN D 354 -1.999 15.904 -10.637 1.00 0.67 H new ATOM 0 HE22 GLN D 354 -3.214 14.917 -11.456 1.00 0.67 H new ATOM 2081 N ALA D 355 -4.355 20.547 -8.531 1.00 1.70 N ATOM 2082 CA ALA D 355 -5.170 21.738 -8.900 1.00 2.14 C ATOM 2083 C ALA D 355 -4.445 22.533 -9.988 1.00 2.69 C ATOM 2084 O ALA D 355 -5.119 23.054 -10.862 1.00 3.12 O ATOM 2085 CB ALA D 355 -5.366 22.623 -7.667 1.00 2.63 C ATOM 2086 OXT ALA D 355 -3.229 22.609 -9.929 1.00 3.16 O ATOM 0 H ALA D 355 -3.501 20.419 -9.074 1.00 1.70 H new ATOM 0 HA ALA D 355 -6.142 21.413 -9.273 1.00 2.14 H new ATOM 0 HB1 ALA D 355 -5.962 23.495 -7.936 1.00 2.63 H new ATOM 0 HB2 ALA D 355 -5.881 22.057 -6.891 1.00 2.63 H new ATOM 0 HB3 ALA D 355 -4.395 22.949 -7.295 1.00 2.63 H new TER 2092 ALA D 355 END