USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 920 hydrogens (0 hets) HEADER REPLICATION 25-APR-00 1EWI TITLE HUMAN REPLICATION PROTEIN A: GLOBAL FOLD OF THE N-TERMINAL TITLE 2 RPA-70 DOMAIN REVEALS A BASIC CLEFT AND FLEXIBLE C- TITLE 3 TERMINAL LINKER COMPND MOL_ID: 1; COMPND 2 MOLECULE: REPLICATION PROTEIN A; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: N-TERMINAL FRAGMENT (RESIDUES 1-114); COMPND 5 SYNONYM: RPA70 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606 KEYWDS 5-STRANDED ANTI-PARALLEL, BETA BARREL, REPLICATION EXPDTA SOLUTION NMR AUTHOR D.M.JACOBS,A.S.LIPTON,N.G.ISERN,G.W.DAUGHDRILL,D.F.LOWRY, AUTHOR 2 X.GOMES,M.S.WOLD REVDAT 2 24-FEB-09 1EWI 1 VERSN REVDAT 1 10-MAY-00 1EWI 0 JRNL AUTH D.M.JACOBS,A.S.LIPTON,N.G.ISERN,G.W.DAUGHDRILL, JRNL AUTH 2 D.F.LOWRY,X.GOMES,M.S.WOLD JRNL TITL HUMAN REPLICATION PROTEIN A: GLOBAL FOLD OF THE JRNL TITL 2 N-TERMINAL RPA-70 DOMAIN REVEALS A BASIC CLEFT AND JRNL TITL 3 FLEXIBLE C-TERMINAL LINKER. JRNL REF J.BIOMOL.NMR V. 14 321 1999 JRNL REFN ISSN 0925-2738 JRNL PMID 10526407 JRNL DOI 10.1023/A:1008373009786 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.0 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1EWI COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 26-APR-00. REMARK 100 THE RCSB ID CODE IS RCSB010963. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 7.6 REMARK 210 IONIC STRENGTH : 50 MM REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1MM D169, 100 MM TRIS, 100 MM REMARK 210 TRIS-HCL, 0.25 MM EDTA, 50 MM REMARK 210 NACL, 0.2% NAN3 AND 1MM DTT, REMARK 210 PH 7.6 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, REMARK 210 HNCACB, CBCACONNH REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : INOVA REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : FELIX 97, X-PLOR 3.0 REMARK 210 METHOD USED : DISTANCE GEOMETRY/SIMULATED REMARK 210 ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 8 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: DUE TO AGGREGATION DURING AGING, NMR SPECTRA WERE REMARK 210 RECORDED WITH FRESHLY PREPARED SAMPLES. 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 VAL A 2 84.38 -179.23 REMARK 500 GLN A 4 26.16 45.16 REMARK 500 LEU A 5 93.29 -37.04 REMARK 500 LYS A 22 59.68 -141.69 REMARK 500 PRO A 23 48.44 -82.71 REMARK 500 ILE A 24 30.08 -150.12 REMARK 500 ILE A 33 72.49 -109.73 REMARK 500 LEU A 50 -59.55 179.88 REMARK 500 LEU A 53 -71.03 -138.40 REMARK 500 SER A 54 41.07 71.68 REMARK 500 MET A 57 65.45 -150.06 REMARK 500 LEU A 58 55.62 -149.97 REMARK 500 ALA A 59 -135.14 -113.07 REMARK 500 ASN A 63 177.32 -48.70 REMARK 500 LEU A 71 57.35 179.29 REMARK 500 SER A 73 47.83 -162.24 REMARK 500 ASN A 74 64.57 83.09 REMARK 500 PHE A 82 142.56 178.60 REMARK 500 ARG A 92 156.99 -43.36 REMARK 500 MET A 97 -64.56 -106.71 REMARK 500 GLU A 100 76.88 -154.31 REMARK 500 VAL A 101 -158.56 -179.83 REMARK 500 LEU A 102 -29.41 -36.87 REMARK 500 SER A 104 43.26 164.99 REMARK 500 ALA A 105 44.42 -82.68 REMARK 500 VAL A 110 85.53 44.36 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 31 0.23 SIDE_CHAIN REMARK 500 ARG A 41 0.21 SIDE_CHAIN REMARK 500 ARG A 43 0.23 SIDE_CHAIN REMARK 500 ARG A 81 0.15 SIDE_CHAIN REMARK 500 ARG A 91 0.20 SIDE_CHAIN REMARK 500 ARG A 92 0.30 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL DBREF 1EWI A 1 114 UNP P27694 RFA1_HUMAN 1 114 SEQRES 1 A 114 MET VAL GLY GLN LEU SER GLU GLY ALA ILE ALA ALA ILE SEQRES 2 A 114 MET GLN LYS GLY ASP THR ASN ILE LYS PRO ILE LEU GLN SEQRES 3 A 114 VAL ILE ASN ILE ARG PRO ILE THR THR GLY ASN SER PRO SEQRES 4 A 114 PRO ARG TYR ARG LEU LEU MET SER ASP GLY LEU ASN THR SEQRES 5 A 114 LEU SER SER PHE MET LEU ALA THR GLN LEU ASN PRO LEU SEQRES 6 A 114 VAL GLU GLU GLU GLN LEU SER SER ASN CYS VAL CYS GLN SEQRES 7 A 114 ILE HIS ARG PHE ILE VAL ASN THR LEU LYS ASP GLY ARG SEQRES 8 A 114 ARG VAL VAL ILE LEU MET GLU LEU GLU VAL LEU LYS SER SEQRES 9 A 114 ALA GLU ALA VAL GLY VAL LYS ILE GLY ASN HELIX 1 1 GLY A 8 GLN A 15 1 8 HELIX 2 2 ALA A 59 ASN A 63 5 5 HELIX 3 3 LEU A 65 GLN A 70 1 6 SHEET 1 A 3 ARG A 41 SER A 47 0 SHEET 2 A 3 LEU A 25 ILE A 33 -1 N GLN A 26 O SER A 47 SHEET 3 A 3 VAL A 76 CYS A 77 -1 N CYS A 77 O LEU A 25 SHEET 1 B 2 PHE A 82 ASN A 85 0 SHEET 2 B 2 VAL A 93 LEU A 96 -1 O VAL A 93 N ASN A 85 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 Set 1.1: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 38 SER OG : rot -32:sc= -0.0533! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -0.0105 X(o=-0.01,f=-0.18) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.418 K(o=-0.42,f=-3!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot -56:sc= -2.36! USER MOD Single : A 20 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.32) USER MOD Single : A 22 LYS NZ :NH3+ 144:sc= 0.0765 (180deg=-0.000559) USER MOD Single : A 26 GLN : amide:sc= -9.81! C(o=-9.8!,f=-15!) USER MOD Single : A 29 ASN : amide:sc= -0.274 X(o=-0.27,f=-0.49) USER MOD Single : A 34 THR OG1 : rot -62:sc= 0.745 USER MOD Single : A 37 ASN : amide:sc= -0.281 X(o=-0.28,f=-0.45) USER MOD Single : A 42 TYR OH : rot 76:sc= 0.981 USER MOD Single : A 46 MET CE :methyl -120:sc= -1.78 (180deg=-2.88!) USER MOD Single : A 47 SER OG : rot 180:sc= -0.281 USER MOD Single : A 51 ASN : amide:sc= -0.133 K(o=-0.13,f=-3.6!) USER MOD Single : A 52 THR OG1 : rot 35:sc= 0.999 USER MOD Single : A 54 SER OG : rot 3:sc= -3.81! USER MOD Single : A 55 SER OG : rot 60:sc= -1.21 USER MOD Single : A 57 MET CE :methyl -151:sc= -4.51! (180deg=-6.09!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0.0265 USER MOD Single : A 61 GLN : amide:sc= -2.94! C(o=-2.9!,f=-10!) USER MOD Single : A 63 ASN : amide:sc= -4.95! C(o=-4.9!,f=-10!) USER MOD Single : A 70 GLN :FLIP amide:sc= -9.61! C(o=-11!,f=-9.6!) USER MOD Single : A 72 SER OG : rot 180:sc= -0.506 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -1.44 K(o=-1.4,f=-4.4!) USER MOD Single : A 75 CYS SG : rot 36:sc= 0.0155 USER MOD Single : A 77 CYS SG : rot 19:sc= 0.943 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 80 HIS : no HD1:sc= -1.36 X(o=-1.4,f=-1.6) USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ -143:sc= -0.222 (180deg=-1.51!) USER MOD Single : A 104 SER OG : rot 71:sc= 0.874 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.473 1.595 5.676 1.00 0.00 N ATOM 2 CA MET A 1 -25.333 2.807 5.795 1.00 0.00 C ATOM 3 C MET A 1 -24.648 3.989 5.107 1.00 0.00 C ATOM 4 O MET A 1 -25.246 4.692 4.317 1.00 0.00 O ATOM 5 CB MET A 1 -25.551 3.134 7.274 1.00 0.00 C ATOM 6 CG MET A 1 -26.753 2.348 7.799 1.00 0.00 C ATOM 7 SD MET A 1 -27.355 3.113 9.325 1.00 0.00 S ATOM 8 CE MET A 1 -28.621 1.880 9.714 1.00 0.00 C ATOM 0 H1 MET A 1 -24.939 0.791 6.144 1.00 0.00 H new ATOM 0 H2 MET A 1 -24.325 1.372 4.671 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.555 1.775 6.130 1.00 0.00 H new ATOM 0 HA MET A 1 -26.295 2.618 5.319 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.659 2.882 7.848 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.719 4.204 7.400 1.00 0.00 H new ATOM 0 HG2 MET A 1 -27.545 2.332 7.051 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.470 1.312 7.986 1.00 0.00 H new ATOM 0 HE1 MET A 1 -29.129 2.159 10.637 1.00 0.00 H new ATOM 0 HE2 MET A 1 -29.346 1.834 8.901 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.152 0.904 9.838 1.00 0.00 H new ATOM 20 N VAL A 2 -23.396 4.213 5.400 1.00 0.00 N ATOM 21 CA VAL A 2 -22.674 5.350 4.761 1.00 0.00 C ATOM 22 C VAL A 2 -21.227 5.379 5.258 1.00 0.00 C ATOM 23 O VAL A 2 -20.893 6.089 6.185 1.00 0.00 O ATOM 24 CB VAL A 2 -23.366 6.664 5.129 1.00 0.00 C ATOM 25 CG1 VAL A 2 -23.455 6.786 6.651 1.00 0.00 C ATOM 26 CG2 VAL A 2 -22.557 7.838 4.572 1.00 0.00 C ATOM 0 H VAL A 2 -22.842 3.659 6.053 1.00 0.00 H new ATOM 0 HA VAL A 2 -22.684 5.225 3.678 1.00 0.00 H new ATOM 0 HB VAL A 2 -24.370 6.677 4.704 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -23.948 7.722 6.913 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -24.029 5.950 7.050 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -22.451 6.773 7.076 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -23.049 8.775 4.833 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -21.554 7.823 4.998 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -22.492 7.753 3.487 1.00 0.00 H new ATOM 36 N GLY A 3 -20.366 4.612 4.648 1.00 0.00 N ATOM 37 CA GLY A 3 -18.941 4.596 5.086 1.00 0.00 C ATOM 38 C GLY A 3 -18.055 5.131 3.961 1.00 0.00 C ATOM 39 O GLY A 3 -18.107 6.296 3.617 1.00 0.00 O ATOM 0 H GLY A 3 -20.587 3.996 3.866 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -18.818 5.206 5.981 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -18.641 3.581 5.348 1.00 0.00 H new ATOM 43 N GLN A 4 -17.240 4.291 3.384 1.00 0.00 N ATOM 44 CA GLN A 4 -16.350 4.754 2.282 1.00 0.00 C ATOM 45 C GLN A 4 -15.704 6.084 2.673 1.00 0.00 C ATOM 46 O GLN A 4 -15.348 6.880 1.828 1.00 0.00 O ATOM 47 CB GLN A 4 -17.174 4.942 1.007 1.00 0.00 C ATOM 48 CG GLN A 4 -16.235 5.148 -0.183 1.00 0.00 C ATOM 49 CD GLN A 4 -16.891 4.604 -1.453 1.00 0.00 C ATOM 50 OE1 GLN A 4 -17.239 3.441 -1.521 1.00 0.00 O ATOM 51 NE2 GLN A 4 -17.077 5.401 -2.469 1.00 0.00 N ATOM 0 H GLN A 4 -17.152 3.305 3.628 1.00 0.00 H new ATOM 0 HA GLN A 4 -15.572 4.011 2.106 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -17.806 4.070 0.838 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -17.837 5.801 1.113 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -16.010 6.208 -0.303 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -15.288 4.639 -0.004 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -16.785 6.377 -2.412 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -17.514 5.048 -3.320 1.00 0.00 H new ATOM 60 N LEU A 5 -15.563 6.330 3.951 1.00 0.00 N ATOM 61 CA LEU A 5 -14.953 7.600 4.423 1.00 0.00 C ATOM 62 C LEU A 5 -13.815 8.023 3.492 1.00 0.00 C ATOM 63 O LEU A 5 -12.683 7.616 3.655 1.00 0.00 O ATOM 64 CB LEU A 5 -14.405 7.405 5.838 1.00 0.00 C ATOM 65 CG LEU A 5 -13.780 8.712 6.328 1.00 0.00 C ATOM 66 CD1 LEU A 5 -14.882 9.743 6.579 1.00 0.00 C ATOM 67 CD2 LEU A 5 -13.018 8.455 7.630 1.00 0.00 C ATOM 0 H LEU A 5 -15.850 5.693 4.694 1.00 0.00 H new ATOM 0 HA LEU A 5 -15.716 8.379 4.424 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -15.206 7.098 6.510 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -13.661 6.609 5.845 1.00 0.00 H new ATOM 0 HG LEU A 5 -13.093 9.092 5.572 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -14.436 10.674 6.928 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -15.427 9.926 5.653 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -15.570 9.364 7.335 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -12.572 9.386 7.980 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -13.706 8.075 8.385 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -12.232 7.720 7.453 1.00 0.00 H new ATOM 79 N SER A 6 -14.109 8.842 2.521 1.00 0.00 N ATOM 80 CA SER A 6 -13.046 9.299 1.585 1.00 0.00 C ATOM 81 C SER A 6 -12.982 10.826 1.610 1.00 0.00 C ATOM 82 O SER A 6 -11.940 11.415 1.399 1.00 0.00 O ATOM 83 CB SER A 6 -13.365 8.819 0.169 1.00 0.00 C ATOM 84 OG SER A 6 -12.524 9.495 -0.756 1.00 0.00 O ATOM 0 H SER A 6 -15.040 9.215 2.336 1.00 0.00 H new ATOM 0 HA SER A 6 -12.085 8.887 1.892 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.215 7.742 0.095 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.412 9.012 -0.066 1.00 0.00 H new ATOM 0 HG SER A 6 -12.725 9.189 -1.665 1.00 0.00 H new ATOM 90 N GLU A 7 -14.085 11.472 1.881 1.00 0.00 N ATOM 91 CA GLU A 7 -14.077 12.959 1.939 1.00 0.00 C ATOM 92 C GLU A 7 -13.717 13.379 3.358 1.00 0.00 C ATOM 93 O GLU A 7 -14.393 14.170 3.987 1.00 0.00 O ATOM 94 CB GLU A 7 -15.457 13.504 1.565 1.00 0.00 C ATOM 95 CG GLU A 7 -16.529 12.795 2.395 1.00 0.00 C ATOM 96 CD GLU A 7 -17.781 13.670 2.467 1.00 0.00 C ATOM 97 OE1 GLU A 7 -18.280 14.043 1.418 1.00 0.00 O ATOM 98 OE2 GLU A 7 -18.220 13.953 3.569 1.00 0.00 O ATOM 0 H GLU A 7 -14.988 11.034 2.064 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.348 13.358 1.234 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -15.496 14.579 1.743 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -15.644 13.350 0.502 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -16.772 11.831 1.948 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -16.154 12.595 3.399 1.00 0.00 H new ATOM 105 N GLY A 8 -12.651 12.835 3.857 1.00 0.00 N ATOM 106 CA GLY A 8 -12.200 13.156 5.235 1.00 0.00 C ATOM 107 C GLY A 8 -11.137 12.136 5.641 1.00 0.00 C ATOM 108 O GLY A 8 -10.272 12.412 6.446 1.00 0.00 O ATOM 0 H GLY A 8 -12.060 12.168 3.360 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -11.792 14.166 5.276 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -13.041 13.124 5.927 1.00 0.00 H new ATOM 112 N ALA A 9 -11.197 10.956 5.080 1.00 0.00 N ATOM 113 CA ALA A 9 -10.191 9.914 5.422 1.00 0.00 C ATOM 114 C ALA A 9 -8.821 10.328 4.890 1.00 0.00 C ATOM 115 O ALA A 9 -7.908 10.563 5.647 1.00 0.00 O ATOM 116 CB ALA A 9 -10.590 8.580 4.792 1.00 0.00 C ATOM 0 H ALA A 9 -11.901 10.671 4.399 1.00 0.00 H new ATOM 0 HA ALA A 9 -10.147 9.806 6.506 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -9.849 7.822 5.046 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -11.566 8.276 5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.640 8.690 3.709 1.00 0.00 H new ATOM 122 N ILE A 10 -8.675 10.407 3.590 1.00 0.00 N ATOM 123 CA ILE A 10 -7.360 10.793 2.991 1.00 0.00 C ATOM 124 C ILE A 10 -6.772 12.004 3.723 1.00 0.00 C ATOM 125 O ILE A 10 -5.642 11.977 4.169 1.00 0.00 O ATOM 126 CB ILE A 10 -7.554 11.135 1.512 1.00 0.00 C ATOM 127 CG1 ILE A 10 -6.260 11.733 0.955 1.00 0.00 C ATOM 128 CG2 ILE A 10 -8.689 12.150 1.364 1.00 0.00 C ATOM 129 CD1 ILE A 10 -5.138 10.696 1.046 1.00 0.00 C ATOM 0 H ILE A 10 -9.415 10.219 2.914 1.00 0.00 H new ATOM 0 HA ILE A 10 -6.670 9.955 3.089 1.00 0.00 H new ATOM 0 HB ILE A 10 -7.805 10.229 0.960 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -6.404 12.038 -0.081 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -5.989 12.628 1.516 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -8.825 12.392 0.310 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -9.611 11.725 1.761 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -8.440 13.057 1.915 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.216 11.122 0.649 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.988 10.413 2.088 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -5.410 9.814 0.466 1.00 0.00 H new ATOM 141 N ALA A 11 -7.516 13.067 3.851 1.00 0.00 N ATOM 142 CA ALA A 11 -6.972 14.260 4.558 1.00 0.00 C ATOM 143 C ALA A 11 -6.776 13.912 6.032 1.00 0.00 C ATOM 144 O ALA A 11 -5.946 14.476 6.710 1.00 0.00 O ATOM 145 CB ALA A 11 -7.951 15.428 4.429 1.00 0.00 C ATOM 0 H ALA A 11 -8.469 13.162 3.500 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.018 14.548 4.116 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -7.549 16.298 4.948 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -8.095 15.668 3.375 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.908 15.151 4.872 1.00 0.00 H new ATOM 151 N ALA A 12 -7.538 12.980 6.524 1.00 0.00 N ATOM 152 CA ALA A 12 -7.408 12.574 7.948 1.00 0.00 C ATOM 153 C ALA A 12 -6.220 11.617 8.101 1.00 0.00 C ATOM 154 O ALA A 12 -5.781 11.332 9.196 1.00 0.00 O ATOM 155 CB ALA A 12 -8.693 11.871 8.388 1.00 0.00 C ATOM 0 H ALA A 12 -8.252 12.477 5.996 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.242 13.455 8.568 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -8.604 11.570 9.432 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -9.537 12.552 8.277 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -8.855 10.989 7.769 1.00 0.00 H new ATOM 161 N ILE A 13 -5.687 11.126 7.013 1.00 0.00 N ATOM 162 CA ILE A 13 -4.520 10.200 7.112 1.00 0.00 C ATOM 163 C ILE A 13 -3.239 11.026 7.138 1.00 0.00 C ATOM 164 O ILE A 13 -2.366 10.816 7.956 1.00 0.00 O ATOM 165 CB ILE A 13 -4.475 9.253 5.905 1.00 0.00 C ATOM 166 CG1 ILE A 13 -5.857 9.124 5.283 1.00 0.00 C ATOM 167 CG2 ILE A 13 -4.007 7.873 6.358 1.00 0.00 C ATOM 168 CD1 ILE A 13 -5.836 8.023 4.224 1.00 0.00 C ATOM 0 H ILE A 13 -6.007 11.325 6.065 1.00 0.00 H new ATOM 0 HA ILE A 13 -4.616 9.607 8.021 1.00 0.00 H new ATOM 0 HB ILE A 13 -3.784 9.660 5.167 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.594 8.890 6.052 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -6.155 10.071 4.833 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.975 7.200 5.501 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.012 7.952 6.795 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.700 7.480 7.102 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -6.826 7.929 3.777 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -5.111 8.276 3.450 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -5.556 7.077 4.688 1.00 0.00 H new ATOM 180 N MET A 14 -3.120 11.968 6.244 1.00 0.00 N ATOM 181 CA MET A 14 -1.894 12.810 6.214 1.00 0.00 C ATOM 182 C MET A 14 -2.041 13.963 7.209 1.00 0.00 C ATOM 183 O MET A 14 -1.067 14.528 7.664 1.00 0.00 O ATOM 184 CB MET A 14 -1.698 13.375 4.805 1.00 0.00 C ATOM 185 CG MET A 14 -0.558 12.630 4.110 1.00 0.00 C ATOM 186 SD MET A 14 0.381 13.786 3.082 1.00 0.00 S ATOM 187 CE MET A 14 1.448 14.438 4.389 1.00 0.00 C ATOM 0 H MET A 14 -3.818 12.190 5.534 1.00 0.00 H new ATOM 0 HA MET A 14 -1.031 12.203 6.487 1.00 0.00 H new ATOM 0 HB2 MET A 14 -2.618 13.272 4.229 1.00 0.00 H new ATOM 0 HB3 MET A 14 -1.472 14.440 4.857 1.00 0.00 H new ATOM 0 HG2 MET A 14 0.097 12.172 4.852 1.00 0.00 H new ATOM 0 HG3 MET A 14 -0.958 11.823 3.496 1.00 0.00 H new ATOM 0 HE1 MET A 14 2.123 15.184 3.969 1.00 0.00 H new ATOM 0 HE2 MET A 14 0.835 14.899 5.163 1.00 0.00 H new ATOM 0 HE3 MET A 14 2.030 13.625 4.823 1.00 0.00 H new ATOM 197 N GLN A 15 -3.250 14.321 7.548 1.00 0.00 N ATOM 198 CA GLN A 15 -3.446 15.442 8.510 1.00 0.00 C ATOM 199 C GLN A 15 -3.487 14.904 9.936 1.00 0.00 C ATOM 200 O GLN A 15 -2.942 15.498 10.846 1.00 0.00 O ATOM 201 CB GLN A 15 -4.750 16.177 8.198 1.00 0.00 C ATOM 202 CG GLN A 15 -4.716 17.570 8.831 1.00 0.00 C ATOM 203 CD GLN A 15 -6.001 17.800 9.629 1.00 0.00 C ATOM 204 OE1 GLN A 15 -6.680 16.861 9.992 1.00 0.00 O ATOM 205 NE2 GLN A 15 -6.365 19.019 9.918 1.00 0.00 N ATOM 0 H GLN A 15 -4.106 13.888 7.202 1.00 0.00 H new ATOM 0 HA GLN A 15 -2.612 16.138 8.415 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.884 16.259 7.119 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.599 15.612 8.583 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.848 17.663 9.484 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -4.615 18.330 8.057 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -5.794 19.808 9.613 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -7.220 19.184 10.449 1.00 0.00 H new ATOM 214 N LYS A 16 -4.114 13.782 10.147 1.00 0.00 N ATOM 215 CA LYS A 16 -4.161 13.222 11.525 1.00 0.00 C ATOM 216 C LYS A 16 -2.763 12.732 11.913 1.00 0.00 C ATOM 217 O LYS A 16 -2.540 12.277 13.017 1.00 0.00 O ATOM 218 CB LYS A 16 -5.145 12.051 11.572 1.00 0.00 C ATOM 219 CG LYS A 16 -5.487 11.729 13.028 1.00 0.00 C ATOM 220 CD LYS A 16 -6.606 12.657 13.506 1.00 0.00 C ATOM 221 CE LYS A 16 -7.374 11.986 14.646 1.00 0.00 C ATOM 222 NZ LYS A 16 -8.435 12.908 15.141 1.00 0.00 N ATOM 0 H LYS A 16 -4.592 13.233 9.433 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.489 13.993 12.223 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.052 12.302 11.021 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -4.710 11.177 11.088 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.799 10.689 13.118 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.605 11.852 13.656 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -6.187 13.605 13.844 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.282 12.883 12.682 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.820 11.054 14.299 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.692 11.730 15.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.957 12.452 15.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -7.998 13.786 15.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.091 13.130 14.365 1.00 0.00 H new ATOM 236 N GLY A 17 -1.821 12.812 11.009 1.00 0.00 N ATOM 237 CA GLY A 17 -0.447 12.340 11.321 1.00 0.00 C ATOM 238 C GLY A 17 -0.391 10.830 11.117 1.00 0.00 C ATOM 239 O GLY A 17 0.575 10.180 11.465 1.00 0.00 O ATOM 0 H GLY A 17 -1.948 13.185 10.068 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.278 12.836 10.676 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.185 12.593 12.348 1.00 0.00 H new ATOM 243 N ASP A 18 -1.432 10.262 10.568 1.00 0.00 N ATOM 244 CA ASP A 18 -1.447 8.792 10.360 1.00 0.00 C ATOM 245 C ASP A 18 -1.504 8.126 11.723 1.00 0.00 C ATOM 246 O ASP A 18 -0.746 7.229 12.034 1.00 0.00 O ATOM 247 CB ASP A 18 -0.186 8.355 9.612 1.00 0.00 C ATOM 248 CG ASP A 18 -0.572 7.440 8.449 1.00 0.00 C ATOM 249 OD1 ASP A 18 -1.520 7.767 7.754 1.00 0.00 O ATOM 250 OD2 ASP A 18 0.087 6.428 8.272 1.00 0.00 O ATOM 0 H ASP A 18 -2.269 10.755 10.257 1.00 0.00 H new ATOM 0 HA ASP A 18 -2.313 8.503 9.764 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.349 9.228 9.239 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.489 7.833 10.290 1.00 0.00 H new ATOM 255 N THR A 19 -2.406 8.579 12.536 1.00 0.00 N ATOM 256 CA THR A 19 -2.544 8.003 13.900 1.00 0.00 C ATOM 257 C THR A 19 -3.492 6.807 13.848 1.00 0.00 C ATOM 258 O THR A 19 -4.506 6.776 14.517 1.00 0.00 O ATOM 259 CB THR A 19 -3.109 9.063 14.848 1.00 0.00 C ATOM 260 OG1 THR A 19 -2.996 10.344 14.245 1.00 0.00 O ATOM 261 CG2 THR A 19 -2.327 9.045 16.162 1.00 0.00 C ATOM 0 H THR A 19 -3.061 9.330 12.316 1.00 0.00 H new ATOM 0 HA THR A 19 -1.568 7.680 14.261 1.00 0.00 H new ATOM 0 HB THR A 19 -4.158 8.847 15.050 1.00 0.00 H new ATOM 0 HG1 THR A 19 -2.061 10.509 14.001 1.00 0.00 H new ATOM 0 HG21 THR A 19 -2.731 9.801 16.836 1.00 0.00 H new ATOM 0 HG22 THR A 19 -2.415 8.062 16.624 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.277 9.260 15.963 1.00 0.00 H new ATOM 269 N ASN A 20 -3.174 5.823 13.055 1.00 0.00 N ATOM 270 CA ASN A 20 -4.061 4.634 12.956 1.00 0.00 C ATOM 271 C ASN A 20 -5.386 5.052 12.317 1.00 0.00 C ATOM 272 O ASN A 20 -6.451 4.770 12.830 1.00 0.00 O ATOM 273 CB ASN A 20 -4.323 4.073 14.356 1.00 0.00 C ATOM 274 CG ASN A 20 -5.014 2.714 14.240 1.00 0.00 C ATOM 275 OD1 ASN A 20 -6.162 2.570 14.609 1.00 0.00 O ATOM 276 ND2 ASN A 20 -4.358 1.702 13.739 1.00 0.00 N ATOM 0 H ASN A 20 -2.338 5.792 12.472 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.583 3.868 12.345 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -3.384 3.970 14.900 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.947 4.763 14.925 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -4.810 0.791 13.658 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -3.394 1.822 13.429 1.00 0.00 H new ATOM 283 N ILE A 21 -5.329 5.719 11.196 1.00 0.00 N ATOM 284 CA ILE A 21 -6.582 6.149 10.521 1.00 0.00 C ATOM 285 C ILE A 21 -6.324 6.160 9.023 1.00 0.00 C ATOM 286 O ILE A 21 -6.354 7.189 8.378 1.00 0.00 O ATOM 287 CB ILE A 21 -6.969 7.553 10.990 1.00 0.00 C ATOM 288 CG1 ILE A 21 -7.148 7.549 12.511 1.00 0.00 C ATOM 289 CG2 ILE A 21 -8.282 7.971 10.325 1.00 0.00 C ATOM 290 CD1 ILE A 21 -7.699 8.903 12.963 1.00 0.00 C ATOM 0 H ILE A 21 -4.467 5.984 10.720 1.00 0.00 H new ATOM 0 HA ILE A 21 -7.397 5.467 10.762 1.00 0.00 H new ATOM 0 HB ILE A 21 -6.183 8.257 10.716 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -7.829 6.750 12.806 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -6.194 7.351 13.000 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.557 8.971 10.660 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.157 7.972 9.242 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -9.069 7.268 10.599 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -7.827 8.901 14.045 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -7.002 9.692 12.681 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.662 9.082 12.484 1.00 0.00 H new ATOM 302 N LYS A 22 -6.039 5.018 8.473 1.00 0.00 N ATOM 303 CA LYS A 22 -5.741 4.948 7.024 1.00 0.00 C ATOM 304 C LYS A 22 -6.343 3.677 6.419 1.00 0.00 C ATOM 305 O LYS A 22 -5.626 2.861 5.874 1.00 0.00 O ATOM 306 CB LYS A 22 -4.223 4.931 6.858 1.00 0.00 C ATOM 307 CG LYS A 22 -3.862 4.976 5.371 1.00 0.00 C ATOM 308 CD LYS A 22 -2.396 4.580 5.188 1.00 0.00 C ATOM 309 CE LYS A 22 -1.500 5.572 5.933 1.00 0.00 C ATOM 310 NZ LYS A 22 -1.122 6.685 5.017 1.00 0.00 N ATOM 0 H LYS A 22 -6.000 4.127 8.968 1.00 0.00 H new ATOM 0 HA LYS A 22 -6.173 5.807 6.511 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -3.782 5.784 7.374 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -3.808 4.033 7.315 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -4.505 4.299 4.809 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -4.031 5.977 4.975 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -2.231 3.571 5.566 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -2.141 4.569 4.128 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.022 5.966 6.805 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -0.605 5.067 6.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -1.078 7.576 5.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.191 6.488 4.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -1.832 6.770 4.262 1.00 0.00 H new ATOM 324 N PRO A 23 -7.645 3.550 6.524 1.00 0.00 N ATOM 325 CA PRO A 23 -8.373 2.392 5.978 1.00 0.00 C ATOM 326 C PRO A 23 -8.639 2.601 4.491 1.00 0.00 C ATOM 327 O PRO A 23 -9.740 2.427 4.007 1.00 0.00 O ATOM 328 CB PRO A 23 -9.684 2.389 6.764 1.00 0.00 C ATOM 329 CG PRO A 23 -9.887 3.839 7.272 1.00 0.00 C ATOM 330 CD PRO A 23 -8.510 4.531 7.210 1.00 0.00 C ATOM 0 HA PRO A 23 -7.825 1.454 6.070 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -10.516 2.078 6.132 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -9.637 1.688 7.597 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -10.613 4.367 6.654 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -10.275 3.841 8.291 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -8.561 5.471 6.660 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -8.136 4.764 8.207 1.00 0.00 H new ATOM 338 N ILE A 24 -7.630 2.976 3.773 1.00 0.00 N ATOM 339 CA ILE A 24 -7.787 3.208 2.313 1.00 0.00 C ATOM 340 C ILE A 24 -6.464 2.904 1.612 1.00 0.00 C ATOM 341 O ILE A 24 -6.141 3.488 0.597 1.00 0.00 O ATOM 342 CB ILE A 24 -8.176 4.667 2.062 1.00 0.00 C ATOM 343 CG1 ILE A 24 -9.013 5.183 3.236 1.00 0.00 C ATOM 344 CG2 ILE A 24 -8.996 4.762 0.775 1.00 0.00 C ATOM 345 CD1 ILE A 24 -9.480 6.610 2.941 1.00 0.00 C ATOM 0 H ILE A 24 -6.690 3.135 4.135 1.00 0.00 H new ATOM 0 HA ILE A 24 -8.568 2.557 1.922 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.273 5.270 1.965 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.873 4.533 3.396 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.424 5.164 4.153 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.273 5.801 0.596 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.402 4.395 -0.062 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.898 4.158 0.873 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -10.076 6.978 3.776 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -8.613 7.255 2.802 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -10.085 6.615 2.034 1.00 0.00 H new ATOM 357 N LEU A 25 -5.690 1.998 2.144 1.00 0.00 N ATOM 358 CA LEU A 25 -4.388 1.671 1.502 1.00 0.00 C ATOM 359 C LEU A 25 -4.597 0.545 0.491 1.00 0.00 C ATOM 360 O LEU A 25 -4.331 -0.609 0.765 1.00 0.00 O ATOM 361 CB LEU A 25 -3.392 1.219 2.573 1.00 0.00 C ATOM 362 CG LEU A 25 -2.008 1.788 2.260 1.00 0.00 C ATOM 363 CD1 LEU A 25 -1.493 1.189 0.951 1.00 0.00 C ATOM 364 CD2 LEU A 25 -2.101 3.309 2.122 1.00 0.00 C ATOM 0 H LEU A 25 -5.903 1.473 2.992 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.996 2.552 0.993 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.721 1.557 3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.349 0.130 2.608 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.322 1.537 3.069 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -0.506 1.595 0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -1.426 0.105 1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.179 1.439 0.142 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.114 3.715 1.899 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.788 3.560 1.314 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.467 3.737 3.055 1.00 0.00 H new ATOM 376 N GLN A 26 -5.073 0.873 -0.680 1.00 0.00 N ATOM 377 CA GLN A 26 -5.301 -0.180 -1.712 1.00 0.00 C ATOM 378 C GLN A 26 -4.223 -0.078 -2.790 1.00 0.00 C ATOM 379 O GLN A 26 -3.573 0.938 -2.940 1.00 0.00 O ATOM 380 CB GLN A 26 -6.686 -0.010 -2.358 1.00 0.00 C ATOM 381 CG GLN A 26 -7.243 1.388 -2.073 1.00 0.00 C ATOM 382 CD GLN A 26 -6.496 2.420 -2.920 1.00 0.00 C ATOM 383 OE1 GLN A 26 -5.502 2.106 -3.543 1.00 0.00 O ATOM 384 NE2 GLN A 26 -6.937 3.647 -2.971 1.00 0.00 N ATOM 0 H GLN A 26 -5.313 1.822 -0.966 1.00 0.00 H new ATOM 0 HA GLN A 26 -5.254 -1.157 -1.232 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -6.613 -0.167 -3.434 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.369 -0.766 -1.971 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -8.309 1.419 -2.300 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -7.135 1.625 -1.014 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -7.772 3.911 -2.448 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -6.447 4.342 -3.534 1.00 0.00 H new ATOM 393 N VAL A 27 -4.027 -1.126 -3.539 1.00 0.00 N ATOM 394 CA VAL A 27 -2.993 -1.102 -4.605 1.00 0.00 C ATOM 395 C VAL A 27 -3.616 -0.606 -5.910 1.00 0.00 C ATOM 396 O VAL A 27 -4.463 -1.254 -6.491 1.00 0.00 O ATOM 397 CB VAL A 27 -2.449 -2.515 -4.798 1.00 0.00 C ATOM 398 CG1 VAL A 27 -1.520 -2.864 -3.634 1.00 0.00 C ATOM 399 CG2 VAL A 27 -3.611 -3.510 -4.838 1.00 0.00 C ATOM 0 H VAL A 27 -4.542 -2.002 -3.457 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.182 -0.432 -4.320 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.896 -2.567 -5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.130 -3.873 -3.770 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.692 -2.156 -3.604 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.075 -2.812 -2.697 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.222 -4.519 -4.976 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.165 -3.460 -3.901 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.275 -3.261 -5.666 1.00 0.00 H new ATOM 409 N ILE A 28 -3.203 0.541 -6.375 1.00 0.00 N ATOM 410 CA ILE A 28 -3.772 1.081 -7.640 1.00 0.00 C ATOM 411 C ILE A 28 -2.742 0.946 -8.764 1.00 0.00 C ATOM 412 O ILE A 28 -3.077 0.977 -9.931 1.00 0.00 O ATOM 413 CB ILE A 28 -4.128 2.556 -7.450 1.00 0.00 C ATOM 414 CG1 ILE A 28 -4.836 3.074 -8.704 1.00 0.00 C ATOM 415 CG2 ILE A 28 -2.851 3.364 -7.217 1.00 0.00 C ATOM 416 CD1 ILE A 28 -6.261 2.519 -8.753 1.00 0.00 C ATOM 0 H ILE A 28 -2.495 1.127 -5.932 1.00 0.00 H new ATOM 0 HA ILE A 28 -4.670 0.521 -7.902 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.787 2.662 -6.588 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.859 4.164 -8.697 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -4.286 2.772 -9.596 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.105 4.415 -7.082 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.345 2.995 -6.325 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.191 3.258 -8.078 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.765 2.888 -9.646 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -6.227 1.430 -8.780 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.808 2.843 -7.868 1.00 0.00 H new ATOM 428 N ASN A 29 -1.490 0.798 -8.424 1.00 0.00 N ATOM 429 CA ASN A 29 -0.447 0.665 -9.481 1.00 0.00 C ATOM 430 C ASN A 29 0.706 -0.195 -8.962 1.00 0.00 C ATOM 431 O ASN A 29 0.748 -0.563 -7.805 1.00 0.00 O ATOM 432 CB ASN A 29 0.079 2.052 -9.856 1.00 0.00 C ATOM 433 CG ASN A 29 -0.143 2.295 -11.350 1.00 0.00 C ATOM 434 OD1 ASN A 29 -1.129 1.857 -11.909 1.00 0.00 O ATOM 435 ND2 ASN A 29 0.739 2.981 -12.025 1.00 0.00 N ATOM 0 H ASN A 29 -1.146 0.764 -7.465 1.00 0.00 H new ATOM 0 HA ASN A 29 -0.883 0.191 -10.360 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -0.433 2.817 -9.272 1.00 0.00 H new ATOM 0 HB3 ASN A 29 1.140 2.127 -9.618 1.00 0.00 H new ATOM 0 HD21 ASN A 29 0.600 3.149 -13.021 1.00 0.00 H new ATOM 0 HD22 ASN A 29 1.567 3.349 -11.556 1.00 0.00 H new ATOM 442 N ILE A 30 1.641 -0.516 -9.812 1.00 0.00 N ATOM 443 CA ILE A 30 2.795 -1.351 -9.375 1.00 0.00 C ATOM 444 C ILE A 30 4.045 -0.937 -10.154 1.00 0.00 C ATOM 445 O ILE A 30 3.961 -0.431 -11.256 1.00 0.00 O ATOM 446 CB ILE A 30 2.489 -2.826 -9.645 1.00 0.00 C ATOM 447 CG1 ILE A 30 3.767 -3.650 -9.470 1.00 0.00 C ATOM 448 CG2 ILE A 30 1.973 -2.987 -11.076 1.00 0.00 C ATOM 449 CD1 ILE A 30 3.487 -5.110 -9.833 1.00 0.00 C ATOM 0 H ILE A 30 1.656 -0.236 -10.793 1.00 0.00 H new ATOM 0 HA ILE A 30 2.967 -1.206 -8.308 1.00 0.00 H new ATOM 0 HB ILE A 30 1.730 -3.174 -8.944 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.559 -3.252 -10.105 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.119 -3.581 -8.441 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.755 -4.038 -11.268 1.00 0.00 H new ATOM 0 HG22 ILE A 30 1.064 -2.399 -11.203 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.731 -2.640 -11.778 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.397 -5.697 -9.708 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.709 -5.504 -9.180 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.156 -5.170 -10.870 1.00 0.00 H new ATOM 461 N ARG A 31 5.204 -1.148 -9.593 1.00 0.00 N ATOM 462 CA ARG A 31 6.456 -0.764 -10.304 1.00 0.00 C ATOM 463 C ARG A 31 7.555 -1.785 -9.995 1.00 0.00 C ATOM 464 O ARG A 31 8.275 -1.644 -9.026 1.00 0.00 O ATOM 465 CB ARG A 31 6.903 0.623 -9.838 1.00 0.00 C ATOM 466 CG ARG A 31 7.646 1.329 -10.973 1.00 0.00 C ATOM 467 CD ARG A 31 6.669 2.212 -11.752 1.00 0.00 C ATOM 468 NE ARG A 31 6.341 3.421 -10.944 1.00 0.00 N ATOM 469 CZ ARG A 31 6.567 4.611 -11.428 1.00 0.00 C ATOM 470 NH1 ARG A 31 6.167 4.911 -12.634 1.00 0.00 N ATOM 471 NH2 ARG A 31 7.192 5.501 -10.707 1.00 0.00 N ATOM 0 H ARG A 31 5.338 -1.569 -8.674 1.00 0.00 H new ATOM 0 HA ARG A 31 6.271 -0.745 -11.378 1.00 0.00 H new ATOM 0 HB2 ARG A 31 6.038 1.212 -9.534 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.550 0.534 -8.966 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.457 1.935 -10.569 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.098 0.594 -11.639 1.00 0.00 H new ATOM 0 HD2 ARG A 31 7.108 2.506 -12.705 1.00 0.00 H new ATOM 0 HD3 ARG A 31 5.760 1.655 -11.979 1.00 0.00 H new ATOM 0 HE ARG A 31 5.940 3.318 -10.012 1.00 0.00 H new ATOM 0 HH11 ARG A 31 5.678 4.215 -13.197 1.00 0.00 H new ATOM 0 HH12 ARG A 31 6.343 5.841 -13.013 1.00 0.00 H new ATOM 0 HH21 ARG A 31 7.504 5.266 -9.765 1.00 0.00 H new ATOM 0 HH22 ARG A 31 7.369 6.431 -11.086 1.00 0.00 H new ATOM 485 N PRO A 32 7.650 -2.786 -10.833 1.00 0.00 N ATOM 486 CA PRO A 32 8.652 -3.855 -10.684 1.00 0.00 C ATOM 487 C PRO A 32 10.023 -3.373 -11.168 1.00 0.00 C ATOM 488 O PRO A 32 10.157 -2.845 -12.255 1.00 0.00 O ATOM 489 CB PRO A 32 8.118 -4.974 -11.583 1.00 0.00 C ATOM 490 CG PRO A 32 7.181 -4.298 -12.612 1.00 0.00 C ATOM 491 CD PRO A 32 6.766 -2.944 -12.006 1.00 0.00 C ATOM 0 HA PRO A 32 8.790 -4.174 -9.651 1.00 0.00 H new ATOM 0 HB2 PRO A 32 8.935 -5.493 -12.084 1.00 0.00 H new ATOM 0 HB3 PRO A 32 7.579 -5.719 -10.997 1.00 0.00 H new ATOM 0 HG2 PRO A 32 7.690 -4.156 -13.565 1.00 0.00 H new ATOM 0 HG3 PRO A 32 6.307 -4.919 -12.807 1.00 0.00 H new ATOM 0 HD2 PRO A 32 6.901 -2.131 -12.719 1.00 0.00 H new ATOM 0 HD3 PRO A 32 5.715 -2.943 -11.716 1.00 0.00 H new ATOM 499 N ILE A 33 11.041 -3.549 -10.371 1.00 0.00 N ATOM 500 CA ILE A 33 12.399 -3.100 -10.787 1.00 0.00 C ATOM 501 C ILE A 33 13.276 -4.321 -11.069 1.00 0.00 C ATOM 502 O ILE A 33 14.169 -4.645 -10.312 1.00 0.00 O ATOM 503 CB ILE A 33 13.027 -2.270 -9.667 1.00 0.00 C ATOM 504 CG1 ILE A 33 12.310 -0.921 -9.570 1.00 0.00 C ATOM 505 CG2 ILE A 33 14.508 -2.037 -9.971 1.00 0.00 C ATOM 506 CD1 ILE A 33 11.215 -1.000 -8.505 1.00 0.00 C ATOM 0 H ILE A 33 10.991 -3.984 -9.450 1.00 0.00 H new ATOM 0 HA ILE A 33 12.320 -2.493 -11.689 1.00 0.00 H new ATOM 0 HB ILE A 33 12.930 -2.804 -8.722 1.00 0.00 H new ATOM 0 HG12 ILE A 33 13.022 -0.136 -9.317 1.00 0.00 H new ATOM 0 HG13 ILE A 33 11.876 -0.658 -10.534 1.00 0.00 H new ATOM 0 HG21 ILE A 33 14.955 -1.445 -9.172 1.00 0.00 H new ATOM 0 HG22 ILE A 33 15.020 -2.997 -10.042 1.00 0.00 H new ATOM 0 HG23 ILE A 33 14.606 -1.503 -10.916 1.00 0.00 H new ATOM 0 HD11 ILE A 33 10.705 -0.039 -8.436 1.00 0.00 H new ATOM 0 HD12 ILE A 33 10.497 -1.774 -8.778 1.00 0.00 H new ATOM 0 HD13 ILE A 33 11.662 -1.243 -7.541 1.00 0.00 H new ATOM 518 N THR A 34 13.029 -5.003 -12.155 1.00 0.00 N ATOM 519 CA THR A 34 13.850 -6.202 -12.485 1.00 0.00 C ATOM 520 C THR A 34 14.393 -6.072 -13.909 1.00 0.00 C ATOM 521 O THR A 34 14.742 -7.048 -14.542 1.00 0.00 O ATOM 522 CB THR A 34 12.981 -7.458 -12.383 1.00 0.00 C ATOM 523 OG1 THR A 34 13.614 -8.526 -13.073 1.00 0.00 O ATOM 524 CG2 THR A 34 11.611 -7.186 -13.006 1.00 0.00 C ATOM 0 H THR A 34 12.294 -4.781 -12.827 1.00 0.00 H new ATOM 0 HA THR A 34 14.682 -6.277 -11.785 1.00 0.00 H new ATOM 0 HB THR A 34 12.853 -7.727 -11.335 1.00 0.00 H new ATOM 0 HG1 THR A 34 13.697 -8.299 -14.023 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.994 -8.081 -12.933 1.00 0.00 H new ATOM 0 HG22 THR A 34 11.126 -6.366 -12.475 1.00 0.00 H new ATOM 0 HG23 THR A 34 11.735 -6.916 -14.055 1.00 0.00 H new ATOM 532 N THR A 35 14.469 -4.872 -14.418 1.00 0.00 N ATOM 533 CA THR A 35 14.990 -4.681 -15.800 1.00 0.00 C ATOM 534 C THR A 35 16.497 -4.943 -15.818 1.00 0.00 C ATOM 535 O THR A 35 17.146 -4.963 -14.791 1.00 0.00 O ATOM 536 CB THR A 35 14.716 -3.246 -16.255 1.00 0.00 C ATOM 537 OG1 THR A 35 15.201 -2.340 -15.274 1.00 0.00 O ATOM 538 CG2 THR A 35 13.211 -3.045 -16.439 1.00 0.00 C ATOM 0 H THR A 35 14.193 -4.017 -13.936 1.00 0.00 H new ATOM 0 HA THR A 35 14.492 -5.377 -16.475 1.00 0.00 H new ATOM 0 HB THR A 35 15.222 -3.062 -17.203 1.00 0.00 H new ATOM 0 HG1 THR A 35 15.028 -1.420 -15.564 1.00 0.00 H new ATOM 0 HG21 THR A 35 13.017 -2.022 -16.763 1.00 0.00 H new ATOM 0 HG22 THR A 35 12.840 -3.741 -17.192 1.00 0.00 H new ATOM 0 HG23 THR A 35 12.701 -3.229 -15.493 1.00 0.00 H new ATOM 546 N GLY A 36 17.060 -5.144 -16.978 1.00 0.00 N ATOM 547 CA GLY A 36 18.526 -5.404 -17.060 1.00 0.00 C ATOM 548 C GLY A 36 19.292 -4.140 -16.670 1.00 0.00 C ATOM 549 O GLY A 36 18.807 -3.036 -16.821 1.00 0.00 O ATOM 0 H GLY A 36 16.569 -5.140 -17.872 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.798 -6.225 -16.397 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.796 -5.708 -18.071 1.00 0.00 H new ATOM 553 N ASN A 37 20.487 -4.290 -16.168 1.00 0.00 N ATOM 554 CA ASN A 37 21.283 -3.096 -15.768 1.00 0.00 C ATOM 555 C ASN A 37 20.604 -2.402 -14.586 1.00 0.00 C ATOM 556 O ASN A 37 20.499 -1.193 -14.540 1.00 0.00 O ATOM 557 CB ASN A 37 21.373 -2.124 -16.946 1.00 0.00 C ATOM 558 CG ASN A 37 22.432 -1.060 -16.652 1.00 0.00 C ATOM 559 OD1 ASN A 37 22.108 0.085 -16.408 1.00 0.00 O ATOM 560 ND2 ASN A 37 23.694 -1.392 -16.666 1.00 0.00 N ATOM 0 H ASN A 37 20.946 -5.188 -16.018 1.00 0.00 H new ATOM 0 HA ASN A 37 22.286 -3.410 -15.478 1.00 0.00 H new ATOM 0 HB2 ASN A 37 21.629 -2.664 -17.858 1.00 0.00 H new ATOM 0 HB3 ASN A 37 20.405 -1.652 -17.116 1.00 0.00 H new ATOM 0 HD21 ASN A 37 24.408 -0.690 -16.472 1.00 0.00 H new ATOM 0 HD22 ASN A 37 23.966 -2.353 -16.871 1.00 0.00 H new ATOM 567 N SER A 38 20.140 -3.159 -13.628 1.00 0.00 N ATOM 568 CA SER A 38 19.468 -2.542 -12.451 1.00 0.00 C ATOM 569 C SER A 38 19.320 -3.587 -11.341 1.00 0.00 C ATOM 570 O SER A 38 19.280 -4.771 -11.609 1.00 0.00 O ATOM 571 CB SER A 38 18.084 -2.036 -12.861 1.00 0.00 C ATOM 572 OG SER A 38 18.194 -1.298 -14.071 1.00 0.00 O ATOM 0 H SER A 38 20.198 -4.177 -13.611 1.00 0.00 H new ATOM 0 HA SER A 38 20.068 -1.708 -12.087 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.402 -2.876 -12.994 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.666 -1.407 -12.075 1.00 0.00 H new ATOM 0 HG SER A 38 19.066 -0.852 -14.104 1.00 0.00 H new ATOM 578 N PRO A 39 19.244 -3.112 -10.124 1.00 0.00 N ATOM 579 CA PRO A 39 19.100 -3.979 -8.941 1.00 0.00 C ATOM 580 C PRO A 39 17.651 -4.459 -8.802 1.00 0.00 C ATOM 581 O PRO A 39 16.756 -3.908 -9.413 1.00 0.00 O ATOM 582 CB PRO A 39 19.486 -3.062 -7.776 1.00 0.00 C ATOM 583 CG PRO A 39 19.276 -1.612 -8.275 1.00 0.00 C ATOM 584 CD PRO A 39 19.295 -1.668 -9.814 1.00 0.00 C ATOM 0 HA PRO A 39 19.713 -4.879 -8.991 1.00 0.00 H new ATOM 0 HB2 PRO A 39 18.869 -3.265 -6.901 1.00 0.00 H new ATOM 0 HB3 PRO A 39 20.522 -3.225 -7.480 1.00 0.00 H new ATOM 0 HG2 PRO A 39 18.329 -1.212 -7.914 1.00 0.00 H new ATOM 0 HG3 PRO A 39 20.063 -0.956 -7.902 1.00 0.00 H new ATOM 0 HD2 PRO A 39 18.444 -1.138 -10.242 1.00 0.00 H new ATOM 0 HD3 PRO A 39 20.195 -1.205 -10.218 1.00 0.00 H new ATOM 592 N PRO A 40 17.467 -5.476 -7.999 1.00 0.00 N ATOM 593 CA PRO A 40 16.138 -6.062 -7.752 1.00 0.00 C ATOM 594 C PRO A 40 15.344 -5.193 -6.772 1.00 0.00 C ATOM 595 O PRO A 40 15.646 -5.132 -5.597 1.00 0.00 O ATOM 596 CB PRO A 40 16.458 -7.427 -7.137 1.00 0.00 C ATOM 597 CG PRO A 40 17.885 -7.318 -6.550 1.00 0.00 C ATOM 598 CD PRO A 40 18.566 -6.135 -7.264 1.00 0.00 C ATOM 0 HA PRO A 40 15.528 -6.138 -8.652 1.00 0.00 H new ATOM 0 HB2 PRO A 40 15.737 -7.682 -6.360 1.00 0.00 H new ATOM 0 HB3 PRO A 40 16.407 -8.214 -7.890 1.00 0.00 H new ATOM 0 HG2 PRO A 40 17.849 -7.152 -5.473 1.00 0.00 H new ATOM 0 HG3 PRO A 40 18.442 -8.241 -6.712 1.00 0.00 H new ATOM 0 HD2 PRO A 40 19.033 -5.455 -6.552 1.00 0.00 H new ATOM 0 HD3 PRO A 40 19.350 -6.476 -7.940 1.00 0.00 H new ATOM 606 N ARG A 41 14.331 -4.521 -7.247 1.00 0.00 N ATOM 607 CA ARG A 41 13.520 -3.658 -6.343 1.00 0.00 C ATOM 608 C ARG A 41 12.033 -3.922 -6.585 1.00 0.00 C ATOM 609 O ARG A 41 11.649 -4.495 -7.585 1.00 0.00 O ATOM 610 CB ARG A 41 13.831 -2.187 -6.628 1.00 0.00 C ATOM 611 CG ARG A 41 14.409 -1.534 -5.371 1.00 0.00 C ATOM 612 CD ARG A 41 14.960 -0.150 -5.721 1.00 0.00 C ATOM 613 NE ARG A 41 16.035 -0.288 -6.744 1.00 0.00 N ATOM 614 CZ ARG A 41 16.479 0.767 -7.370 1.00 0.00 C ATOM 615 NH1 ARG A 41 16.721 1.865 -6.708 1.00 0.00 N ATOM 616 NH2 ARG A 41 16.681 0.724 -8.659 1.00 0.00 N ATOM 0 H ARG A 41 14.030 -4.532 -8.222 1.00 0.00 H new ATOM 0 HA ARG A 41 13.765 -3.886 -5.306 1.00 0.00 H new ATOM 0 HB2 ARG A 41 14.541 -2.107 -7.451 1.00 0.00 H new ATOM 0 HB3 ARG A 41 12.925 -1.666 -6.937 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.637 -1.447 -4.606 1.00 0.00 H new ATOM 0 HG3 ARG A 41 15.201 -2.158 -4.956 1.00 0.00 H new ATOM 0 HD2 ARG A 41 14.161 0.486 -6.101 1.00 0.00 H new ATOM 0 HD3 ARG A 41 15.354 0.333 -4.827 1.00 0.00 H new ATOM 0 HE ARG A 41 16.424 -1.207 -6.955 1.00 0.00 H new ATOM 0 HH11 ARG A 41 16.563 1.899 -5.701 1.00 0.00 H new ATOM 0 HH12 ARG A 41 17.068 2.690 -7.198 1.00 0.00 H new ATOM 0 HH21 ARG A 41 16.492 -0.134 -9.177 1.00 0.00 H new ATOM 0 HH22 ARG A 41 17.028 1.549 -9.149 1.00 0.00 H new ATOM 630 N TYR A 42 11.192 -3.509 -5.676 1.00 0.00 N ATOM 631 CA TYR A 42 9.730 -3.737 -5.856 1.00 0.00 C ATOM 632 C TYR A 42 8.959 -2.505 -5.379 1.00 0.00 C ATOM 633 O TYR A 42 8.387 -2.496 -4.307 1.00 0.00 O ATOM 634 CB TYR A 42 9.301 -4.957 -5.038 1.00 0.00 C ATOM 635 CG TYR A 42 8.578 -5.935 -5.933 1.00 0.00 C ATOM 636 CD1 TYR A 42 9.149 -6.321 -7.152 1.00 0.00 C ATOM 637 CD2 TYR A 42 7.338 -6.455 -5.545 1.00 0.00 C ATOM 638 CE1 TYR A 42 8.479 -7.228 -7.982 1.00 0.00 C ATOM 639 CE2 TYR A 42 6.668 -7.362 -6.375 1.00 0.00 C ATOM 640 CZ TYR A 42 7.239 -7.749 -7.594 1.00 0.00 C ATOM 641 OH TYR A 42 6.579 -8.643 -8.412 1.00 0.00 O ATOM 0 H TYR A 42 11.454 -3.024 -4.818 1.00 0.00 H new ATOM 0 HA TYR A 42 9.516 -3.913 -6.910 1.00 0.00 H new ATOM 0 HB2 TYR A 42 10.174 -5.433 -4.591 1.00 0.00 H new ATOM 0 HB3 TYR A 42 8.651 -4.649 -4.219 1.00 0.00 H new ATOM 0 HD1 TYR A 42 10.106 -5.919 -7.452 1.00 0.00 H new ATOM 0 HD2 TYR A 42 6.898 -6.157 -4.605 1.00 0.00 H new ATOM 0 HE1 TYR A 42 8.919 -7.526 -8.922 1.00 0.00 H new ATOM 0 HE2 TYR A 42 5.711 -7.763 -6.075 1.00 0.00 H new ATOM 0 HH TYR A 42 7.004 -9.523 -8.344 1.00 0.00 H new ATOM 651 N ARG A 43 8.938 -1.465 -6.166 1.00 0.00 N ATOM 652 CA ARG A 43 8.203 -0.235 -5.757 1.00 0.00 C ATOM 653 C ARG A 43 6.758 -0.316 -6.254 1.00 0.00 C ATOM 654 O ARG A 43 6.505 -0.438 -7.436 1.00 0.00 O ATOM 655 CB ARG A 43 8.883 0.993 -6.366 1.00 0.00 C ATOM 656 CG ARG A 43 9.348 1.927 -5.247 1.00 0.00 C ATOM 657 CD ARG A 43 8.327 3.050 -5.062 1.00 0.00 C ATOM 658 NE ARG A 43 8.997 4.368 -5.252 1.00 0.00 N ATOM 659 CZ ARG A 43 9.123 4.868 -6.450 1.00 0.00 C ATOM 660 NH1 ARG A 43 9.568 4.123 -7.425 1.00 0.00 N ATOM 661 NH2 ARG A 43 8.804 6.114 -6.674 1.00 0.00 N ATOM 0 H ARG A 43 9.398 -1.414 -7.075 1.00 0.00 H new ATOM 0 HA ARG A 43 8.210 -0.152 -4.670 1.00 0.00 H new ATOM 0 HB2 ARG A 43 9.733 0.686 -6.975 1.00 0.00 H new ATOM 0 HB3 ARG A 43 8.190 1.515 -7.026 1.00 0.00 H new ATOM 0 HG2 ARG A 43 9.463 1.369 -4.318 1.00 0.00 H new ATOM 0 HG3 ARG A 43 10.325 2.346 -5.491 1.00 0.00 H new ATOM 0 HD2 ARG A 43 7.513 2.937 -5.778 1.00 0.00 H new ATOM 0 HD3 ARG A 43 7.886 2.994 -4.067 1.00 0.00 H new ATOM 0 HE ARG A 43 9.357 4.879 -4.446 1.00 0.00 H new ATOM 0 HH11 ARG A 43 9.817 3.150 -7.250 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.666 4.514 -8.362 1.00 0.00 H new ATOM 0 HH21 ARG A 43 8.456 6.696 -5.912 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.903 6.505 -7.611 1.00 0.00 H new ATOM 675 N LEU A 44 5.808 -0.252 -5.361 1.00 0.00 N ATOM 676 CA LEU A 44 4.382 -0.327 -5.786 1.00 0.00 C ATOM 677 C LEU A 44 3.717 1.037 -5.590 1.00 0.00 C ATOM 678 O LEU A 44 4.224 1.891 -4.890 1.00 0.00 O ATOM 679 CB LEU A 44 3.653 -1.376 -4.943 1.00 0.00 C ATOM 680 CG LEU A 44 2.533 -2.007 -5.771 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.007 -3.348 -6.334 1.00 0.00 C ATOM 682 CD2 LEU A 44 1.309 -2.233 -4.881 1.00 0.00 C ATOM 0 H LEU A 44 5.958 -0.151 -4.357 1.00 0.00 H new ATOM 0 HA LEU A 44 4.332 -0.607 -6.838 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.353 -2.144 -4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.241 -0.914 -4.046 1.00 0.00 H new ATOM 0 HG LEU A 44 2.269 -1.341 -6.593 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.208 -3.798 -6.924 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.880 -3.189 -6.967 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.271 -4.015 -5.513 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.509 -2.683 -5.469 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.574 -2.899 -4.060 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.970 -1.278 -4.479 1.00 0.00 H new ATOM 694 N LEU A 45 2.584 1.249 -6.203 1.00 0.00 N ATOM 695 CA LEU A 45 1.888 2.557 -6.052 1.00 0.00 C ATOM 696 C LEU A 45 0.642 2.374 -5.183 1.00 0.00 C ATOM 697 O LEU A 45 -0.312 1.731 -5.576 1.00 0.00 O ATOM 698 CB LEU A 45 1.474 3.077 -7.431 1.00 0.00 C ATOM 699 CG LEU A 45 1.513 4.606 -7.433 1.00 0.00 C ATOM 700 CD1 LEU A 45 2.861 5.082 -7.979 1.00 0.00 C ATOM 701 CD2 LEU A 45 0.387 5.141 -8.320 1.00 0.00 C ATOM 0 H LEU A 45 2.111 0.572 -6.802 1.00 0.00 H new ATOM 0 HA LEU A 45 2.560 3.273 -5.579 1.00 0.00 H new ATOM 0 HB2 LEU A 45 2.144 2.685 -8.196 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.471 2.728 -7.677 1.00 0.00 H new ATOM 0 HG LEU A 45 1.383 4.975 -6.416 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.889 6.172 -7.980 1.00 0.00 H new ATOM 0 HD12 LEU A 45 3.664 4.699 -7.349 1.00 0.00 H new ATOM 0 HD13 LEU A 45 2.992 4.714 -8.997 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.413 6.231 -8.323 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.519 4.772 -9.337 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.574 4.802 -7.933 1.00 0.00 H new ATOM 713 N MET A 46 0.643 2.935 -4.004 1.00 0.00 N ATOM 714 CA MET A 46 -0.541 2.794 -3.111 1.00 0.00 C ATOM 715 C MET A 46 -1.320 4.110 -3.094 1.00 0.00 C ATOM 716 O MET A 46 -0.754 5.178 -3.208 1.00 0.00 O ATOM 717 CB MET A 46 -0.075 2.458 -1.693 1.00 0.00 C ATOM 718 CG MET A 46 1.193 1.604 -1.759 1.00 0.00 C ATOM 719 SD MET A 46 1.065 0.242 -0.573 1.00 0.00 S ATOM 720 CE MET A 46 -0.235 -0.682 -1.428 1.00 0.00 C ATOM 0 H MET A 46 1.412 3.484 -3.621 1.00 0.00 H new ATOM 0 HA MET A 46 -1.183 1.994 -3.479 1.00 0.00 H new ATOM 0 HB2 MET A 46 0.120 3.375 -1.137 1.00 0.00 H new ATOM 0 HB3 MET A 46 -0.859 1.922 -1.159 1.00 0.00 H new ATOM 0 HG2 MET A 46 1.328 1.211 -2.767 1.00 0.00 H new ATOM 0 HG3 MET A 46 2.068 2.215 -1.535 1.00 0.00 H new ATOM 0 HE1 MET A 46 -1.105 -0.772 -0.778 1.00 0.00 H new ATOM 0 HE2 MET A 46 -0.516 -0.155 -2.340 1.00 0.00 H new ATOM 0 HE3 MET A 46 0.132 -1.676 -1.682 1.00 0.00 H new ATOM 730 N SER A 47 -2.616 4.044 -2.956 1.00 0.00 N ATOM 731 CA SER A 47 -3.423 5.295 -2.936 1.00 0.00 C ATOM 732 C SER A 47 -4.668 5.093 -2.071 1.00 0.00 C ATOM 733 O SER A 47 -4.951 4.003 -1.612 1.00 0.00 O ATOM 734 CB SER A 47 -3.847 5.650 -4.361 1.00 0.00 C ATOM 735 OG SER A 47 -4.753 6.744 -4.324 1.00 0.00 O ATOM 0 H SER A 47 -3.149 3.180 -2.857 1.00 0.00 H new ATOM 0 HA SER A 47 -2.822 6.104 -2.520 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.973 5.907 -4.959 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.317 4.790 -4.837 1.00 0.00 H new ATOM 0 HG SER A 47 -5.025 6.975 -5.237 1.00 0.00 H new ATOM 741 N ASP A 48 -5.413 6.140 -1.848 1.00 0.00 N ATOM 742 CA ASP A 48 -6.643 6.022 -1.016 1.00 0.00 C ATOM 743 C ASP A 48 -7.854 6.477 -1.832 1.00 0.00 C ATOM 744 O ASP A 48 -8.987 6.288 -1.438 1.00 0.00 O ATOM 745 CB ASP A 48 -6.505 6.904 0.227 1.00 0.00 C ATOM 746 CG ASP A 48 -5.244 6.508 0.998 1.00 0.00 C ATOM 747 OD1 ASP A 48 -5.226 5.417 1.544 1.00 0.00 O ATOM 748 OD2 ASP A 48 -4.319 7.302 1.030 1.00 0.00 O ATOM 0 H ASP A 48 -5.222 7.075 -2.207 1.00 0.00 H new ATOM 0 HA ASP A 48 -6.778 4.984 -0.711 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.452 7.953 -0.063 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -7.383 6.793 0.864 1.00 0.00 H new ATOM 753 N GLY A 49 -7.624 7.076 -2.969 1.00 0.00 N ATOM 754 CA GLY A 49 -8.762 7.543 -3.809 1.00 0.00 C ATOM 755 C GLY A 49 -8.637 9.049 -4.047 1.00 0.00 C ATOM 756 O GLY A 49 -9.618 9.741 -4.230 1.00 0.00 O ATOM 0 H GLY A 49 -6.697 7.262 -3.352 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -8.766 7.013 -4.761 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -9.708 7.319 -3.315 1.00 0.00 H new ATOM 760 N LEU A 50 -7.437 9.562 -4.047 1.00 0.00 N ATOM 761 CA LEU A 50 -7.250 11.022 -4.273 1.00 0.00 C ATOM 762 C LEU A 50 -5.759 11.348 -4.219 1.00 0.00 C ATOM 763 O LEU A 50 -5.184 11.837 -5.171 1.00 0.00 O ATOM 764 CB LEU A 50 -7.986 11.807 -3.184 1.00 0.00 C ATOM 765 CG LEU A 50 -8.659 13.033 -3.804 1.00 0.00 C ATOM 766 CD1 LEU A 50 -10.178 12.864 -3.749 1.00 0.00 C ATOM 767 CD2 LEU A 50 -8.258 14.284 -3.020 1.00 0.00 C ATOM 0 H LEU A 50 -6.578 9.032 -3.900 1.00 0.00 H new ATOM 0 HA LEU A 50 -7.652 11.298 -5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -8.732 11.173 -2.705 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.286 12.117 -2.408 1.00 0.00 H new ATOM 0 HG LEU A 50 -8.342 13.135 -4.842 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -10.658 13.738 -4.191 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -10.465 11.972 -4.306 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -10.495 12.762 -2.711 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.737 15.159 -3.461 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -8.576 14.181 -1.982 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.175 14.406 -3.058 1.00 0.00 H new ATOM 779 N ASN A 51 -5.126 11.071 -3.113 1.00 0.00 N ATOM 780 CA ASN A 51 -3.670 11.353 -2.999 1.00 0.00 C ATOM 781 C ASN A 51 -2.908 10.030 -2.963 1.00 0.00 C ATOM 782 O ASN A 51 -3.094 9.217 -2.079 1.00 0.00 O ATOM 783 CB ASN A 51 -3.393 12.135 -1.715 1.00 0.00 C ATOM 784 CG ASN A 51 -4.066 13.506 -1.796 1.00 0.00 C ATOM 785 OD1 ASN A 51 -5.274 13.609 -1.704 1.00 0.00 O ATOM 786 ND2 ASN A 51 -3.332 14.571 -1.964 1.00 0.00 N ATOM 0 H ASN A 51 -5.555 10.661 -2.283 1.00 0.00 H new ATOM 0 HA ASN A 51 -3.345 11.945 -3.855 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -3.769 11.584 -0.853 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -2.319 12.253 -1.574 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -3.771 15.490 -2.018 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -2.319 14.485 -2.041 1.00 0.00 H new ATOM 793 N THR A 52 -2.053 9.804 -3.920 1.00 0.00 N ATOM 794 CA THR A 52 -1.283 8.531 -3.944 1.00 0.00 C ATOM 795 C THR A 52 0.114 8.767 -3.367 1.00 0.00 C ATOM 796 O THR A 52 0.506 9.886 -3.103 1.00 0.00 O ATOM 797 CB THR A 52 -1.164 8.035 -5.387 1.00 0.00 C ATOM 798 OG1 THR A 52 -0.555 6.751 -5.396 1.00 0.00 O ATOM 799 CG2 THR A 52 -0.312 9.013 -6.196 1.00 0.00 C ATOM 0 H THR A 52 -1.854 10.446 -4.687 1.00 0.00 H new ATOM 0 HA THR A 52 -1.800 7.782 -3.344 1.00 0.00 H new ATOM 0 HB THR A 52 -2.157 7.969 -5.832 1.00 0.00 H new ATOM 0 HG1 THR A 52 -0.844 6.246 -4.607 1.00 0.00 H new ATOM 0 HG21 THR A 52 -0.228 8.659 -7.223 1.00 0.00 H new ATOM 0 HG22 THR A 52 -0.781 9.997 -6.189 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.682 9.082 -5.754 1.00 0.00 H new ATOM 807 N LEU A 53 0.867 7.720 -3.169 1.00 0.00 N ATOM 808 CA LEU A 53 2.238 7.884 -2.608 1.00 0.00 C ATOM 809 C LEU A 53 3.205 6.959 -3.347 1.00 0.00 C ATOM 810 O LEU A 53 4.040 7.399 -4.112 1.00 0.00 O ATOM 811 CB LEU A 53 2.224 7.531 -1.120 1.00 0.00 C ATOM 812 CG LEU A 53 0.929 8.041 -0.487 1.00 0.00 C ATOM 813 CD1 LEU A 53 -0.195 7.036 -0.743 1.00 0.00 C ATOM 814 CD2 LEU A 53 1.129 8.208 1.021 1.00 0.00 C ATOM 0 H LEU A 53 0.593 6.759 -3.371 1.00 0.00 H new ATOM 0 HA LEU A 53 2.562 8.917 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.304 6.452 -0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.085 7.976 -0.622 1.00 0.00 H new ATOM 0 HG LEU A 53 0.664 9.002 -0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.118 7.400 -0.292 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.339 6.917 -1.817 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.070 6.074 -0.303 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.206 8.572 1.472 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.394 7.247 1.461 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.929 8.925 1.205 1.00 0.00 H new ATOM 826 N SER A 54 3.098 5.681 -3.124 1.00 0.00 N ATOM 827 CA SER A 54 4.009 4.723 -3.813 1.00 0.00 C ATOM 828 C SER A 54 5.418 4.845 -3.228 1.00 0.00 C ATOM 829 O SER A 54 6.400 4.817 -3.942 1.00 0.00 O ATOM 830 CB SER A 54 4.049 5.046 -5.307 1.00 0.00 C ATOM 831 OG SER A 54 4.525 3.912 -6.020 1.00 0.00 O ATOM 0 H SER A 54 2.418 5.256 -2.493 1.00 0.00 H new ATOM 0 HA SER A 54 3.643 3.706 -3.669 1.00 0.00 H new ATOM 0 HB2 SER A 54 3.054 5.320 -5.658 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.698 5.903 -5.488 1.00 0.00 H new ATOM 0 HG SER A 54 4.668 3.170 -5.396 1.00 0.00 H new ATOM 837 N SER A 55 5.525 4.981 -1.935 1.00 0.00 N ATOM 838 CA SER A 55 6.873 5.105 -1.310 1.00 0.00 C ATOM 839 C SER A 55 7.065 3.994 -0.276 1.00 0.00 C ATOM 840 O SER A 55 8.167 3.717 0.153 1.00 0.00 O ATOM 841 CB SER A 55 6.991 6.466 -0.623 1.00 0.00 C ATOM 842 OG SER A 55 8.355 6.865 -0.605 1.00 0.00 O ATOM 0 H SER A 55 4.740 5.012 -1.285 1.00 0.00 H new ATOM 0 HA SER A 55 7.639 5.017 -2.081 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.390 7.206 -1.151 1.00 0.00 H new ATOM 0 HB3 SER A 55 6.603 6.408 0.394 1.00 0.00 H new ATOM 0 HG SER A 55 8.689 6.930 -1.524 1.00 0.00 H new ATOM 848 N PHE A 56 6.003 3.355 0.131 1.00 0.00 N ATOM 849 CA PHE A 56 6.131 2.263 1.140 1.00 0.00 C ATOM 850 C PHE A 56 5.943 0.909 0.460 1.00 0.00 C ATOM 851 O PHE A 56 4.841 0.417 0.326 1.00 0.00 O ATOM 852 CB PHE A 56 5.078 2.427 2.248 1.00 0.00 C ATOM 853 CG PHE A 56 4.002 3.397 1.814 1.00 0.00 C ATOM 854 CD1 PHE A 56 4.309 4.753 1.651 1.00 0.00 C ATOM 855 CD2 PHE A 56 2.701 2.940 1.577 1.00 0.00 C ATOM 856 CE1 PHE A 56 3.315 5.652 1.250 1.00 0.00 C ATOM 857 CE2 PHE A 56 1.706 3.840 1.176 1.00 0.00 C ATOM 858 CZ PHE A 56 2.013 5.196 1.013 1.00 0.00 C ATOM 0 H PHE A 56 5.053 3.541 -0.190 1.00 0.00 H new ATOM 0 HA PHE A 56 7.124 2.317 1.585 1.00 0.00 H new ATOM 0 HB2 PHE A 56 4.632 1.460 2.481 1.00 0.00 H new ATOM 0 HB3 PHE A 56 5.554 2.786 3.160 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.313 5.105 1.835 1.00 0.00 H new ATOM 0 HD2 PHE A 56 2.464 1.894 1.703 1.00 0.00 H new ATOM 0 HE1 PHE A 56 3.552 6.698 1.123 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.702 3.488 0.992 1.00 0.00 H new ATOM 0 HZ PHE A 56 1.245 5.890 0.704 1.00 0.00 H new ATOM 868 N MET A 57 7.015 0.300 0.031 1.00 0.00 N ATOM 869 CA MET A 57 6.895 -1.025 -0.637 1.00 0.00 C ATOM 870 C MET A 57 8.157 -1.851 -0.388 1.00 0.00 C ATOM 871 O MET A 57 8.897 -2.163 -1.300 1.00 0.00 O ATOM 872 CB MET A 57 6.702 -0.825 -2.141 1.00 0.00 C ATOM 873 CG MET A 57 6.039 -2.067 -2.740 1.00 0.00 C ATOM 874 SD MET A 57 4.342 -2.200 -2.126 1.00 0.00 S ATOM 875 CE MET A 57 4.675 -3.372 -0.789 1.00 0.00 C ATOM 0 H MET A 57 7.965 0.662 0.114 1.00 0.00 H new ATOM 0 HA MET A 57 6.035 -1.555 -0.227 1.00 0.00 H new ATOM 0 HB2 MET A 57 6.085 0.054 -2.325 1.00 0.00 H new ATOM 0 HB3 MET A 57 7.664 -0.646 -2.621 1.00 0.00 H new ATOM 0 HG2 MET A 57 6.039 -2.004 -3.828 1.00 0.00 H new ATOM 0 HG3 MET A 57 6.605 -2.959 -2.472 1.00 0.00 H new ATOM 0 HE1 MET A 57 3.788 -3.980 -0.609 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.507 -4.018 -1.070 1.00 0.00 H new ATOM 0 HE3 MET A 57 4.931 -2.825 0.119 1.00 0.00 H new ATOM 885 N LEU A 58 8.405 -2.215 0.838 1.00 0.00 N ATOM 886 CA LEU A 58 9.614 -3.031 1.142 1.00 0.00 C ATOM 887 C LEU A 58 9.335 -3.919 2.350 1.00 0.00 C ATOM 888 O LEU A 58 10.046 -3.900 3.335 1.00 0.00 O ATOM 889 CB LEU A 58 10.801 -2.111 1.436 1.00 0.00 C ATOM 890 CG LEU A 58 11.637 -1.935 0.167 1.00 0.00 C ATOM 891 CD1 LEU A 58 11.579 -0.474 -0.283 1.00 0.00 C ATOM 892 CD2 LEU A 58 13.089 -2.321 0.457 1.00 0.00 C ATOM 0 H LEU A 58 7.823 -1.983 1.643 1.00 0.00 H new ATOM 0 HA LEU A 58 9.855 -3.656 0.282 1.00 0.00 H new ATOM 0 HB2 LEU A 58 10.446 -1.142 1.787 1.00 0.00 H new ATOM 0 HB3 LEU A 58 11.414 -2.534 2.232 1.00 0.00 H new ATOM 0 HG LEU A 58 11.240 -2.574 -0.622 1.00 0.00 H new ATOM 0 HD11 LEU A 58 12.175 -0.348 -1.187 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.545 -0.197 -0.488 1.00 0.00 H new ATOM 0 HD13 LEU A 58 11.976 0.166 0.505 1.00 0.00 H new ATOM 0 HD21 LEU A 58 13.686 -2.196 -0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 58 13.485 -1.681 1.245 1.00 0.00 H new ATOM 0 HD23 LEU A 58 13.132 -3.361 0.779 1.00 0.00 H new ATOM 904 N ALA A 59 8.302 -4.702 2.269 1.00 0.00 N ATOM 905 CA ALA A 59 7.952 -5.609 3.397 1.00 0.00 C ATOM 906 C ALA A 59 8.155 -7.060 2.949 1.00 0.00 C ATOM 907 O ALA A 59 9.146 -7.389 2.328 1.00 0.00 O ATOM 908 CB ALA A 59 6.490 -5.383 3.782 1.00 0.00 C ATOM 0 H ALA A 59 7.678 -4.755 1.464 1.00 0.00 H new ATOM 0 HA ALA A 59 8.588 -5.404 4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 59 6.225 -6.043 4.608 1.00 0.00 H new ATOM 0 HB2 ALA A 59 6.350 -4.346 4.087 1.00 0.00 H new ATOM 0 HB3 ALA A 59 5.851 -5.598 2.926 1.00 0.00 H new ATOM 914 N THR A 60 7.227 -7.932 3.244 1.00 0.00 N ATOM 915 CA THR A 60 7.382 -9.346 2.815 1.00 0.00 C ATOM 916 C THR A 60 6.756 -9.507 1.431 1.00 0.00 C ATOM 917 O THR A 60 6.469 -10.601 0.989 1.00 0.00 O ATOM 918 CB THR A 60 6.670 -10.267 3.811 1.00 0.00 C ATOM 919 OG1 THR A 60 6.335 -9.529 4.978 1.00 0.00 O ATOM 920 CG2 THR A 60 7.594 -11.427 4.186 1.00 0.00 C ATOM 0 H THR A 60 6.373 -7.724 3.761 1.00 0.00 H new ATOM 0 HA THR A 60 8.439 -9.611 2.780 1.00 0.00 H new ATOM 0 HB THR A 60 5.761 -10.662 3.357 1.00 0.00 H new ATOM 0 HG1 THR A 60 5.878 -10.116 5.616 1.00 0.00 H new ATOM 0 HG21 THR A 60 7.087 -12.082 4.895 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.851 -11.992 3.290 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.504 -11.035 4.641 1.00 0.00 H new ATOM 928 N GLN A 61 6.539 -8.415 0.747 1.00 0.00 N ATOM 929 CA GLN A 61 5.933 -8.479 -0.599 1.00 0.00 C ATOM 930 C GLN A 61 6.879 -9.204 -1.559 1.00 0.00 C ATOM 931 O GLN A 61 6.521 -9.522 -2.676 1.00 0.00 O ATOM 932 CB GLN A 61 5.676 -7.060 -1.110 1.00 0.00 C ATOM 933 CG GLN A 61 4.192 -6.722 -0.953 1.00 0.00 C ATOM 934 CD GLN A 61 3.866 -6.532 0.529 1.00 0.00 C ATOM 935 OE1 GLN A 61 4.747 -6.557 1.365 1.00 0.00 O ATOM 936 NE2 GLN A 61 2.627 -6.341 0.893 1.00 0.00 N ATOM 0 H GLN A 61 6.761 -7.475 1.074 1.00 0.00 H new ATOM 0 HA GLN A 61 4.990 -9.024 -0.544 1.00 0.00 H new ATOM 0 HB2 GLN A 61 6.283 -6.346 -0.554 1.00 0.00 H new ATOM 0 HB3 GLN A 61 5.969 -6.980 -2.157 1.00 0.00 H new ATOM 0 HG2 GLN A 61 3.954 -5.814 -1.508 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.580 -7.521 -1.371 1.00 0.00 H new ATOM 0 HE21 GLN A 61 1.887 -6.320 0.191 1.00 0.00 H new ATOM 0 HE22 GLN A 61 2.399 -6.213 1.879 1.00 0.00 H new ATOM 945 N LEU A 62 8.084 -9.470 -1.133 1.00 0.00 N ATOM 946 CA LEU A 62 9.049 -10.175 -2.022 1.00 0.00 C ATOM 947 C LEU A 62 8.590 -11.620 -2.212 1.00 0.00 C ATOM 948 O LEU A 62 9.072 -12.329 -3.072 1.00 0.00 O ATOM 949 CB LEU A 62 10.439 -10.160 -1.382 1.00 0.00 C ATOM 950 CG LEU A 62 11.273 -9.037 -1.999 1.00 0.00 C ATOM 951 CD1 LEU A 62 11.579 -9.370 -3.460 1.00 0.00 C ATOM 952 CD2 LEU A 62 10.489 -7.724 -1.930 1.00 0.00 C ATOM 0 H LEU A 62 8.441 -9.229 -0.208 1.00 0.00 H new ATOM 0 HA LEU A 62 9.092 -9.673 -2.989 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.354 -10.014 -0.305 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.932 -11.120 -1.536 1.00 0.00 H new ATOM 0 HG LEU A 62 12.207 -8.934 -1.447 1.00 0.00 H new ATOM 0 HD11 LEU A 62 12.174 -8.569 -3.899 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.136 -10.305 -3.511 1.00 0.00 H new ATOM 0 HD13 LEU A 62 10.645 -9.474 -4.013 1.00 0.00 H new ATOM 0 HD21 LEU A 62 11.082 -6.922 -2.370 1.00 0.00 H new ATOM 0 HD22 LEU A 62 9.555 -7.829 -2.482 1.00 0.00 H new ATOM 0 HD23 LEU A 62 10.271 -7.485 -0.889 1.00 0.00 H new ATOM 964 N ASN A 63 7.661 -12.059 -1.410 1.00 0.00 N ATOM 965 CA ASN A 63 7.163 -13.457 -1.534 1.00 0.00 C ATOM 966 C ASN A 63 6.832 -13.754 -3.001 1.00 0.00 C ATOM 967 O ASN A 63 6.949 -12.890 -3.848 1.00 0.00 O ATOM 968 CB ASN A 63 5.907 -13.627 -0.678 1.00 0.00 C ATOM 969 CG ASN A 63 6.172 -14.658 0.420 1.00 0.00 C ATOM 970 OD1 ASN A 63 7.103 -15.433 0.329 1.00 0.00 O ATOM 971 ND2 ASN A 63 5.387 -14.701 1.461 1.00 0.00 N ATOM 0 H ASN A 63 7.224 -11.508 -0.671 1.00 0.00 H new ATOM 0 HA ASN A 63 7.931 -14.150 -1.191 1.00 0.00 H new ATOM 0 HB2 ASN A 63 5.625 -12.672 -0.234 1.00 0.00 H new ATOM 0 HB3 ASN A 63 5.072 -13.949 -1.300 1.00 0.00 H new ATOM 0 HD21 ASN A 63 5.555 -15.385 2.198 1.00 0.00 H new ATOM 0 HD22 ASN A 63 4.605 -14.050 1.537 1.00 0.00 H new ATOM 978 N PRO A 64 6.433 -14.974 -3.258 1.00 0.00 N ATOM 979 CA PRO A 64 6.084 -15.427 -4.617 1.00 0.00 C ATOM 980 C PRO A 64 4.682 -14.950 -5.019 1.00 0.00 C ATOM 981 O PRO A 64 4.528 -14.134 -5.906 1.00 0.00 O ATOM 982 CB PRO A 64 6.127 -16.953 -4.507 1.00 0.00 C ATOM 983 CG PRO A 64 5.935 -17.290 -3.008 1.00 0.00 C ATOM 984 CD PRO A 64 6.297 -16.017 -2.220 1.00 0.00 C ATOM 0 HA PRO A 64 6.758 -15.033 -5.377 1.00 0.00 H new ATOM 0 HB2 PRO A 64 5.342 -17.408 -5.111 1.00 0.00 H new ATOM 0 HB3 PRO A 64 7.077 -17.342 -4.874 1.00 0.00 H new ATOM 0 HG2 PRO A 64 4.907 -17.590 -2.807 1.00 0.00 H new ATOM 0 HG3 PRO A 64 6.574 -18.123 -2.713 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.521 -15.762 -1.498 1.00 0.00 H new ATOM 0 HD3 PRO A 64 7.224 -16.145 -1.660 1.00 0.00 H new ATOM 992 N LEU A 65 3.660 -15.456 -4.382 1.00 0.00 N ATOM 993 CA LEU A 65 2.278 -15.035 -4.740 1.00 0.00 C ATOM 994 C LEU A 65 1.876 -13.833 -3.900 1.00 0.00 C ATOM 995 O LEU A 65 0.736 -13.415 -3.904 1.00 0.00 O ATOM 996 CB LEU A 65 1.305 -16.190 -4.490 1.00 0.00 C ATOM 997 CG LEU A 65 1.236 -16.483 -2.990 1.00 0.00 C ATOM 998 CD1 LEU A 65 -0.100 -15.986 -2.434 1.00 0.00 C ATOM 999 CD2 LEU A 65 1.353 -17.991 -2.761 1.00 0.00 C ATOM 0 H LEU A 65 3.724 -16.142 -3.630 1.00 0.00 H new ATOM 0 HA LEU A 65 2.247 -14.763 -5.795 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.315 -15.934 -4.867 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.632 -17.078 -5.030 1.00 0.00 H new ATOM 0 HG LEU A 65 2.054 -15.972 -2.482 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -0.150 -16.195 -1.365 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -0.186 -14.912 -2.598 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.918 -16.497 -2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.304 -18.202 -1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.535 -18.501 -3.269 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.304 -18.347 -3.158 1.00 0.00 H new ATOM 1011 N VAL A 66 2.805 -13.256 -3.197 1.00 0.00 N ATOM 1012 CA VAL A 66 2.468 -12.063 -2.384 1.00 0.00 C ATOM 1013 C VAL A 66 2.413 -10.850 -3.310 1.00 0.00 C ATOM 1014 O VAL A 66 2.133 -9.753 -2.884 1.00 0.00 O ATOM 1015 CB VAL A 66 3.535 -11.846 -1.309 1.00 0.00 C ATOM 1016 CG1 VAL A 66 4.820 -11.333 -1.959 1.00 0.00 C ATOM 1017 CG2 VAL A 66 3.032 -10.816 -0.296 1.00 0.00 C ATOM 0 H VAL A 66 3.778 -13.558 -3.151 1.00 0.00 H new ATOM 0 HA VAL A 66 1.505 -12.205 -1.894 1.00 0.00 H new ATOM 0 HB VAL A 66 3.737 -12.790 -0.802 1.00 0.00 H new ATOM 0 HG11 VAL A 66 5.579 -11.179 -1.192 1.00 0.00 H new ATOM 0 HG12 VAL A 66 5.179 -12.065 -2.683 1.00 0.00 H new ATOM 0 HG13 VAL A 66 4.620 -10.389 -2.466 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.790 -10.660 0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.831 -9.873 -0.805 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.116 -11.180 0.169 1.00 0.00 H new ATOM 1027 N GLU A 67 2.631 -11.059 -4.589 1.00 0.00 N ATOM 1028 CA GLU A 67 2.543 -9.944 -5.568 1.00 0.00 C ATOM 1029 C GLU A 67 1.109 -9.938 -6.029 1.00 0.00 C ATOM 1030 O GLU A 67 0.498 -8.923 -6.292 1.00 0.00 O ATOM 1031 CB GLU A 67 3.474 -10.212 -6.754 1.00 0.00 C ATOM 1032 CG GLU A 67 4.866 -10.581 -6.237 1.00 0.00 C ATOM 1033 CD GLU A 67 5.602 -11.404 -7.296 1.00 0.00 C ATOM 1034 OE1 GLU A 67 5.124 -12.479 -7.620 1.00 0.00 O ATOM 1035 OE2 GLU A 67 6.631 -10.946 -7.765 1.00 0.00 O ATOM 0 H GLU A 67 2.868 -11.965 -4.993 1.00 0.00 H new ATOM 0 HA GLU A 67 2.838 -8.990 -5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.076 -11.021 -7.367 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.533 -9.329 -7.390 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.431 -9.678 -6.006 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.783 -11.151 -5.311 1.00 0.00 H new ATOM 1042 N GLU A 68 0.586 -11.117 -6.093 1.00 0.00 N ATOM 1043 CA GLU A 68 -0.804 -11.337 -6.492 1.00 0.00 C ATOM 1044 C GLU A 68 -1.694 -11.033 -5.291 1.00 0.00 C ATOM 1045 O GLU A 68 -2.831 -10.626 -5.426 1.00 0.00 O ATOM 1046 CB GLU A 68 -0.907 -12.808 -6.856 1.00 0.00 C ATOM 1047 CG GLU A 68 -2.241 -13.089 -7.549 1.00 0.00 C ATOM 1048 CD GLU A 68 -2.096 -12.851 -9.053 1.00 0.00 C ATOM 1049 OE1 GLU A 68 -2.077 -11.698 -9.451 1.00 0.00 O ATOM 1050 OE2 GLU A 68 -2.008 -13.826 -9.781 1.00 0.00 O ATOM 0 H GLU A 68 1.096 -11.973 -5.873 1.00 0.00 H new ATOM 0 HA GLU A 68 -1.109 -10.707 -7.328 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -0.082 -13.086 -7.512 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -0.820 -13.419 -5.958 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.551 -14.117 -7.361 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -3.018 -12.442 -7.141 1.00 0.00 H new ATOM 1057 N GLU A 69 -1.172 -11.237 -4.111 1.00 0.00 N ATOM 1058 CA GLU A 69 -1.969 -10.972 -2.885 1.00 0.00 C ATOM 1059 C GLU A 69 -1.768 -9.524 -2.430 1.00 0.00 C ATOM 1060 O GLU A 69 -2.668 -8.898 -1.906 1.00 0.00 O ATOM 1061 CB GLU A 69 -1.528 -11.924 -1.772 1.00 0.00 C ATOM 1062 CG GLU A 69 -2.146 -11.479 -0.444 1.00 0.00 C ATOM 1063 CD GLU A 69 -2.169 -12.659 0.529 1.00 0.00 C ATOM 1064 OE1 GLU A 69 -1.241 -13.451 0.492 1.00 0.00 O ATOM 1065 OE2 GLU A 69 -3.114 -12.752 1.295 1.00 0.00 O ATOM 0 H GLU A 69 -0.225 -11.577 -3.946 1.00 0.00 H new ATOM 0 HA GLU A 69 -3.024 -11.132 -3.106 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.838 -12.942 -2.006 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.441 -11.931 -1.695 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.570 -10.656 -0.021 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.158 -11.109 -0.608 1.00 0.00 H new ATOM 1072 N GLN A 70 -0.597 -8.987 -2.627 1.00 0.00 N ATOM 1073 CA GLN A 70 -0.341 -7.585 -2.209 1.00 0.00 C ATOM 1074 C GLN A 70 -1.012 -6.636 -3.203 1.00 0.00 C ATOM 1075 O GLN A 70 -1.014 -5.435 -3.026 1.00 0.00 O ATOM 1076 CB GLN A 70 1.169 -7.331 -2.183 1.00 0.00 C ATOM 1077 CG GLN A 70 1.704 -7.254 -3.613 1.00 0.00 C ATOM 1078 CD GLN A 70 3.212 -6.961 -3.592 1.00 0.00 C ATOM 1079 OE1 GLN A 70 4.074 -7.949 -3.603 1.00 0.00 O flip ATOM 1080 NE2 GLN A 70 3.613 -5.814 -3.565 1.00 0.00 N flip ATOM 0 H GLN A 70 0.195 -9.462 -3.061 1.00 0.00 H new ATOM 0 HA GLN A 70 -0.749 -7.413 -1.213 1.00 0.00 H new ATOM 0 HB2 GLN A 70 1.382 -6.402 -1.654 1.00 0.00 H new ATOM 0 HB3 GLN A 70 1.672 -8.130 -1.639 1.00 0.00 H new ATOM 0 HG2 GLN A 70 1.514 -8.193 -4.133 1.00 0.00 H new ATOM 0 HG3 GLN A 70 1.181 -6.473 -4.165 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.947 -5.041 -3.556 1.00 0.00 H new ATOM 0 HE22 GLN A 70 4.615 -5.624 -3.551 1.00 0.00 H new ATOM 1089 N LEU A 71 -1.589 -7.171 -4.246 1.00 0.00 N ATOM 1090 CA LEU A 71 -2.270 -6.309 -5.249 1.00 0.00 C ATOM 1091 C LEU A 71 -2.834 -7.191 -6.358 1.00 0.00 C ATOM 1092 O LEU A 71 -2.521 -7.034 -7.521 1.00 0.00 O ATOM 1093 CB LEU A 71 -1.273 -5.305 -5.834 1.00 0.00 C ATOM 1094 CG LEU A 71 -0.287 -6.032 -6.750 1.00 0.00 C ATOM 1095 CD1 LEU A 71 -0.518 -5.595 -8.196 1.00 0.00 C ATOM 1096 CD2 LEU A 71 1.145 -5.684 -6.338 1.00 0.00 C ATOM 0 H LEU A 71 -1.617 -8.171 -4.445 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.081 -5.758 -4.772 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.804 -4.535 -6.393 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.735 -4.802 -5.031 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.439 -7.108 -6.665 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.184 -6.113 -8.849 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.538 -5.841 -8.492 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.366 -4.519 -8.280 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.848 -6.202 -6.991 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.297 -4.608 -6.423 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.312 -5.994 -5.306 1.00 0.00 H new ATOM 1108 N SER A 72 -3.665 -8.124 -6.000 1.00 0.00 N ATOM 1109 CA SER A 72 -4.255 -9.030 -7.024 1.00 0.00 C ATOM 1110 C SER A 72 -5.066 -8.214 -8.029 1.00 0.00 C ATOM 1111 O SER A 72 -4.943 -8.385 -9.226 1.00 0.00 O ATOM 1112 CB SER A 72 -5.166 -10.049 -6.339 1.00 0.00 C ATOM 1113 OG SER A 72 -5.048 -11.303 -6.999 1.00 0.00 O ATOM 0 H SER A 72 -3.963 -8.301 -5.041 1.00 0.00 H new ATOM 0 HA SER A 72 -3.454 -9.552 -7.548 1.00 0.00 H new ATOM 0 HB2 SER A 72 -4.892 -10.151 -5.289 1.00 0.00 H new ATOM 0 HB3 SER A 72 -6.200 -9.706 -6.367 1.00 0.00 H new ATOM 0 HG SER A 72 -5.630 -11.959 -6.561 1.00 0.00 H new ATOM 1119 N SER A 73 -5.896 -7.331 -7.555 1.00 0.00 N ATOM 1120 CA SER A 73 -6.716 -6.507 -8.485 1.00 0.00 C ATOM 1121 C SER A 73 -7.250 -5.288 -7.738 1.00 0.00 C ATOM 1122 O SER A 73 -8.421 -4.970 -7.809 1.00 0.00 O ATOM 1123 CB SER A 73 -7.887 -7.336 -9.006 1.00 0.00 C ATOM 1124 OG SER A 73 -8.057 -7.087 -10.396 1.00 0.00 O ATOM 0 H SER A 73 -6.043 -7.143 -6.563 1.00 0.00 H new ATOM 0 HA SER A 73 -6.101 -6.183 -9.325 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.702 -8.396 -8.835 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.798 -7.080 -8.465 1.00 0.00 H new ATOM 0 HG SER A 73 -8.807 -7.619 -10.734 1.00 0.00 H new ATOM 1130 N ASN A 74 -6.395 -4.609 -7.023 1.00 0.00 N ATOM 1131 CA ASN A 74 -6.831 -3.402 -6.259 1.00 0.00 C ATOM 1132 C ASN A 74 -7.438 -3.826 -4.919 1.00 0.00 C ATOM 1133 O ASN A 74 -8.608 -3.621 -4.662 1.00 0.00 O ATOM 1134 CB ASN A 74 -7.870 -2.619 -7.067 1.00 0.00 C ATOM 1135 CG ASN A 74 -7.682 -1.120 -6.825 1.00 0.00 C ATOM 1136 OD1 ASN A 74 -6.821 -0.719 -6.067 1.00 0.00 O ATOM 1137 ND2 ASN A 74 -8.457 -0.270 -7.441 1.00 0.00 N ATOM 0 H ASN A 74 -5.405 -4.839 -6.934 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.964 -2.767 -6.078 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -7.764 -2.843 -8.129 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -8.876 -2.922 -6.776 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.340 0.731 -7.286 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -9.180 -0.607 -8.077 1.00 0.00 H new ATOM 1144 N CYS A 75 -6.647 -4.411 -4.061 1.00 0.00 N ATOM 1145 CA CYS A 75 -7.160 -4.844 -2.739 1.00 0.00 C ATOM 1146 C CYS A 75 -6.923 -3.722 -1.725 1.00 0.00 C ATOM 1147 O CYS A 75 -5.833 -3.196 -1.613 1.00 0.00 O ATOM 1148 CB CYS A 75 -6.409 -6.102 -2.304 1.00 0.00 C ATOM 1149 SG CYS A 75 -4.625 -5.810 -2.402 1.00 0.00 S ATOM 0 H CYS A 75 -5.660 -4.607 -4.225 1.00 0.00 H new ATOM 0 HA CYS A 75 -8.227 -5.061 -2.799 1.00 0.00 H new ATOM 0 HB2 CYS A 75 -6.688 -6.370 -1.285 1.00 0.00 H new ATOM 0 HB3 CYS A 75 -6.686 -6.942 -2.942 1.00 0.00 H new ATOM 0 HG CYS A 75 -4.368 -4.580 -2.068 1.00 0.00 H new ATOM 1155 N VAL A 76 -7.933 -3.344 -0.993 1.00 0.00 N ATOM 1156 CA VAL A 76 -7.762 -2.249 0.001 1.00 0.00 C ATOM 1157 C VAL A 76 -7.379 -2.836 1.358 1.00 0.00 C ATOM 1158 O VAL A 76 -7.910 -3.841 1.781 1.00 0.00 O ATOM 1159 CB VAL A 76 -9.073 -1.472 0.133 1.00 0.00 C ATOM 1160 CG1 VAL A 76 -10.194 -2.429 0.542 1.00 0.00 C ATOM 1161 CG2 VAL A 76 -8.916 -0.387 1.201 1.00 0.00 C ATOM 0 H VAL A 76 -8.869 -3.746 -1.040 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.972 -1.578 -0.336 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.320 -1.010 -0.823 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -11.128 -1.876 0.636 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -10.306 -3.204 -0.217 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -9.948 -2.890 1.498 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.850 0.168 1.296 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -8.670 -0.850 2.157 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -8.117 0.295 0.912 1.00 0.00 H new ATOM 1171 N CYS A 77 -6.458 -2.210 2.038 1.00 0.00 N ATOM 1172 CA CYS A 77 -6.027 -2.705 3.377 1.00 0.00 C ATOM 1173 C CYS A 77 -5.571 -1.508 4.223 1.00 0.00 C ATOM 1174 O CYS A 77 -5.079 -0.526 3.699 1.00 0.00 O ATOM 1175 CB CYS A 77 -4.861 -3.680 3.212 1.00 0.00 C ATOM 1176 SG CYS A 77 -3.769 -3.103 1.889 1.00 0.00 S ATOM 0 H CYS A 77 -5.980 -1.367 1.719 1.00 0.00 H new ATOM 0 HA CYS A 77 -6.857 -3.215 3.866 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -4.306 -3.760 4.147 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -5.237 -4.676 2.978 1.00 0.00 H new ATOM 0 HG CYS A 77 -3.987 -1.841 1.666 1.00 0.00 H new ATOM 1182 N GLN A 78 -5.710 -1.574 5.521 1.00 0.00 N ATOM 1183 CA GLN A 78 -5.254 -0.438 6.369 1.00 0.00 C ATOM 1184 C GLN A 78 -3.919 -0.819 7.002 1.00 0.00 C ATOM 1185 O GLN A 78 -3.872 -1.444 8.041 1.00 0.00 O ATOM 1186 CB GLN A 78 -6.277 -0.161 7.472 1.00 0.00 C ATOM 1187 CG GLN A 78 -6.085 1.260 8.005 1.00 0.00 C ATOM 1188 CD GLN A 78 -5.925 1.217 9.525 1.00 0.00 C ATOM 1189 OE1 GLN A 78 -6.757 0.670 10.221 1.00 0.00 O ATOM 1190 NE2 GLN A 78 -4.881 1.776 10.075 1.00 0.00 N ATOM 0 H GLN A 78 -6.117 -2.361 6.026 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.146 0.458 5.758 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.288 -0.281 7.083 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -6.159 -0.882 8.281 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -5.206 1.715 7.549 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -6.941 1.879 7.736 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -4.182 2.236 9.492 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.765 1.753 11.088 1.00 0.00 H new ATOM 1199 N ILE A 79 -2.832 -0.466 6.377 1.00 0.00 N ATOM 1200 CA ILE A 79 -1.505 -0.827 6.944 1.00 0.00 C ATOM 1201 C ILE A 79 -1.464 -0.454 8.427 1.00 0.00 C ATOM 1202 O ILE A 79 -2.002 0.554 8.839 1.00 0.00 O ATOM 1203 CB ILE A 79 -0.404 -0.075 6.196 1.00 0.00 C ATOM 1204 CG1 ILE A 79 -0.444 -0.456 4.714 1.00 0.00 C ATOM 1205 CG2 ILE A 79 0.959 -0.449 6.780 1.00 0.00 C ATOM 1206 CD1 ILE A 79 0.697 0.247 3.975 1.00 0.00 C ATOM 0 H ILE A 79 -2.805 0.055 5.501 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.346 -1.900 6.835 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.562 0.998 6.302 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.352 -1.536 4.603 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.402 -0.171 4.280 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.743 0.088 6.246 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.989 -0.179 7.836 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.118 -1.522 6.675 1.00 0.00 H new ATOM 0 HD11 ILE A 79 0.669 -0.024 2.920 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.585 1.327 4.075 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.651 -0.060 4.403 1.00 0.00 H new ATOM 1218 N HIS A 80 -0.830 -1.262 9.233 1.00 0.00 N ATOM 1219 CA HIS A 80 -0.755 -0.955 10.688 1.00 0.00 C ATOM 1220 C HIS A 80 0.607 -0.340 11.013 1.00 0.00 C ATOM 1221 O HIS A 80 0.722 0.526 11.858 1.00 0.00 O ATOM 1222 CB HIS A 80 -0.937 -2.244 11.491 1.00 0.00 C ATOM 1223 CG HIS A 80 -2.197 -2.154 12.307 1.00 0.00 C ATOM 1224 ND1 HIS A 80 -2.283 -2.660 13.594 1.00 0.00 N ATOM 1225 CD2 HIS A 80 -3.432 -1.618 12.032 1.00 0.00 C ATOM 1226 CE1 HIS A 80 -3.529 -2.421 14.042 1.00 0.00 C ATOM 1227 NE2 HIS A 80 -4.271 -1.788 13.129 1.00 0.00 N ATOM 0 H HIS A 80 -0.361 -2.121 8.946 1.00 0.00 H new ATOM 0 HA HIS A 80 -1.543 -0.249 10.950 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -0.987 -3.100 10.818 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.079 -2.402 12.144 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.709 -1.138 11.105 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -3.886 -2.706 15.021 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -5.243 -1.493 13.217 1.00 0.00 H new ATOM 1235 N ARG A 81 1.643 -0.780 10.352 1.00 0.00 N ATOM 1236 CA ARG A 81 2.995 -0.216 10.629 1.00 0.00 C ATOM 1237 C ARG A 81 3.745 -0.011 9.312 1.00 0.00 C ATOM 1238 O ARG A 81 3.312 -0.449 8.264 1.00 0.00 O ATOM 1239 CB ARG A 81 3.778 -1.184 11.518 1.00 0.00 C ATOM 1240 CG ARG A 81 4.096 -0.509 12.853 1.00 0.00 C ATOM 1241 CD ARG A 81 3.867 -1.501 13.994 1.00 0.00 C ATOM 1242 NE ARG A 81 2.775 -1.001 14.876 1.00 0.00 N ATOM 1243 CZ ARG A 81 3.049 -0.584 16.082 1.00 0.00 C ATOM 1244 NH1 ARG A 81 4.215 -0.060 16.341 1.00 0.00 N ATOM 1245 NH2 ARG A 81 2.156 -0.690 17.028 1.00 0.00 N ATOM 0 H ARG A 81 1.612 -1.504 9.634 1.00 0.00 H new ATOM 0 HA ARG A 81 2.891 0.742 11.138 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.197 -2.091 11.686 1.00 0.00 H new ATOM 0 HB3 ARG A 81 4.701 -1.485 11.022 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.129 -0.162 12.860 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.464 0.369 12.988 1.00 0.00 H new ATOM 0 HD2 ARG A 81 3.605 -2.480 13.592 1.00 0.00 H new ATOM 0 HD3 ARG A 81 4.784 -1.628 14.569 1.00 0.00 H new ATOM 0 HE ARG A 81 1.813 -0.985 14.537 1.00 0.00 H new ATOM 0 HH11 ARG A 81 4.912 0.024 15.601 1.00 0.00 H new ATOM 0 HH12 ARG A 81 4.430 0.266 17.283 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.244 -1.099 16.825 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.370 -0.364 17.970 1.00 0.00 H new ATOM 1259 N PHE A 82 4.868 0.652 9.356 1.00 0.00 N ATOM 1260 CA PHE A 82 5.646 0.886 8.108 1.00 0.00 C ATOM 1261 C PHE A 82 6.893 1.712 8.432 1.00 0.00 C ATOM 1262 O PHE A 82 6.861 2.603 9.257 1.00 0.00 O ATOM 1263 CB PHE A 82 4.780 1.644 7.101 1.00 0.00 C ATOM 1264 CG PHE A 82 3.894 2.622 7.834 1.00 0.00 C ATOM 1265 CD1 PHE A 82 4.449 3.766 8.421 1.00 0.00 C ATOM 1266 CD2 PHE A 82 2.517 2.386 7.928 1.00 0.00 C ATOM 1267 CE1 PHE A 82 3.627 4.673 9.102 1.00 0.00 C ATOM 1268 CE2 PHE A 82 1.695 3.293 8.608 1.00 0.00 C ATOM 1269 CZ PHE A 82 2.250 4.436 9.195 1.00 0.00 C ATOM 0 H PHE A 82 5.280 1.042 10.204 1.00 0.00 H new ATOM 0 HA PHE A 82 5.945 -0.072 7.681 1.00 0.00 H new ATOM 0 HB2 PHE A 82 5.412 2.173 6.388 1.00 0.00 H new ATOM 0 HB3 PHE A 82 4.171 0.944 6.529 1.00 0.00 H new ATOM 0 HD1 PHE A 82 5.511 3.949 8.349 1.00 0.00 H new ATOM 0 HD2 PHE A 82 2.089 1.504 7.476 1.00 0.00 H new ATOM 0 HE1 PHE A 82 4.055 5.555 9.555 1.00 0.00 H new ATOM 0 HE2 PHE A 82 0.633 3.111 8.680 1.00 0.00 H new ATOM 0 HZ PHE A 82 1.616 5.135 9.720 1.00 0.00 H new ATOM 1279 N ILE A 83 7.991 1.423 7.789 1.00 0.00 N ATOM 1280 CA ILE A 83 9.238 2.193 8.062 1.00 0.00 C ATOM 1281 C ILE A 83 9.284 3.424 7.155 1.00 0.00 C ATOM 1282 O ILE A 83 9.744 3.364 6.033 1.00 0.00 O ATOM 1283 CB ILE A 83 10.455 1.308 7.782 1.00 0.00 C ATOM 1284 CG1 ILE A 83 10.253 -0.058 8.442 1.00 0.00 C ATOM 1285 CG2 ILE A 83 11.710 1.969 8.355 1.00 0.00 C ATOM 1286 CD1 ILE A 83 11.517 -0.901 8.268 1.00 0.00 C ATOM 0 H ILE A 83 8.079 0.688 7.087 1.00 0.00 H new ATOM 0 HA ILE A 83 9.250 2.508 9.105 1.00 0.00 H new ATOM 0 HB ILE A 83 10.571 1.180 6.706 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.030 0.068 9.502 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.399 -0.567 7.995 1.00 0.00 H new ATOM 0 HG21 ILE A 83 12.577 1.339 8.156 1.00 0.00 H new ATOM 0 HG22 ILE A 83 11.854 2.943 7.887 1.00 0.00 H new ATOM 0 HG23 ILE A 83 11.595 2.097 9.431 1.00 0.00 H new ATOM 0 HD11 ILE A 83 11.373 -1.874 8.738 1.00 0.00 H new ATOM 0 HD12 ILE A 83 11.720 -1.038 7.206 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.360 -0.393 8.736 1.00 0.00 H new ATOM 1298 N VAL A 84 8.808 4.542 7.632 1.00 0.00 N ATOM 1299 CA VAL A 84 8.822 5.775 6.795 1.00 0.00 C ATOM 1300 C VAL A 84 10.129 6.537 7.020 1.00 0.00 C ATOM 1301 O VAL A 84 10.365 7.086 8.078 1.00 0.00 O ATOM 1302 CB VAL A 84 7.640 6.666 7.183 1.00 0.00 C ATOM 1303 CG1 VAL A 84 7.597 7.886 6.261 1.00 0.00 C ATOM 1304 CG2 VAL A 84 6.338 5.875 7.040 1.00 0.00 C ATOM 0 H VAL A 84 8.410 4.655 8.565 1.00 0.00 H new ATOM 0 HA VAL A 84 8.743 5.498 5.744 1.00 0.00 H new ATOM 0 HB VAL A 84 7.756 6.994 8.216 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.755 8.521 6.537 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.525 8.450 6.360 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.481 7.558 5.228 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.495 6.509 7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.223 5.548 6.007 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.367 5.004 7.695 1.00 0.00 H new ATOM 1314 N ASN A 85 10.979 6.579 6.030 1.00 0.00 N ATOM 1315 CA ASN A 85 12.268 7.310 6.181 1.00 0.00 C ATOM 1316 C ASN A 85 12.691 7.843 4.816 1.00 0.00 C ATOM 1317 O ASN A 85 12.877 7.093 3.879 1.00 0.00 O ATOM 1318 CB ASN A 85 13.339 6.358 6.717 1.00 0.00 C ATOM 1319 CG ASN A 85 13.974 6.958 7.973 1.00 0.00 C ATOM 1320 OD1 ASN A 85 14.459 8.072 7.950 1.00 0.00 O ATOM 1321 ND2 ASN A 85 13.989 6.262 9.077 1.00 0.00 N ATOM 0 H ASN A 85 10.835 6.138 5.122 1.00 0.00 H new ATOM 0 HA ASN A 85 12.147 8.137 6.881 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.896 5.389 6.948 1.00 0.00 H new ATOM 0 HB3 ASN A 85 14.102 6.187 5.957 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.408 6.653 9.921 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.582 5.327 9.096 1.00 0.00 H new ATOM 1328 N THR A 86 12.833 9.132 4.686 1.00 0.00 N ATOM 1329 CA THR A 86 13.229 9.691 3.367 1.00 0.00 C ATOM 1330 C THR A 86 14.749 9.764 3.263 1.00 0.00 C ATOM 1331 O THR A 86 15.444 9.917 4.248 1.00 0.00 O ATOM 1332 CB THR A 86 12.647 11.096 3.201 1.00 0.00 C ATOM 1333 OG1 THR A 86 11.366 11.155 3.812 1.00 0.00 O ATOM 1334 CG2 THR A 86 12.525 11.431 1.712 1.00 0.00 C ATOM 0 H THR A 86 12.693 9.816 5.429 1.00 0.00 H new ATOM 0 HA THR A 86 12.843 9.040 2.583 1.00 0.00 H new ATOM 0 HB THR A 86 13.308 11.820 3.678 1.00 0.00 H new ATOM 0 HG1 THR A 86 10.995 12.056 3.707 1.00 0.00 H new ATOM 0 HG21 THR A 86 12.110 12.432 1.597 1.00 0.00 H new ATOM 0 HG22 THR A 86 13.511 11.391 1.248 1.00 0.00 H new ATOM 0 HG23 THR A 86 11.867 10.708 1.229 1.00 0.00 H new ATOM 1342 N LEU A 87 15.273 9.663 2.072 1.00 0.00 N ATOM 1343 CA LEU A 87 16.748 9.735 1.908 1.00 0.00 C ATOM 1344 C LEU A 87 17.135 11.120 1.388 1.00 0.00 C ATOM 1345 O LEU A 87 17.100 11.379 0.202 1.00 0.00 O ATOM 1346 CB LEU A 87 17.213 8.672 0.912 1.00 0.00 C ATOM 1347 CG LEU A 87 17.224 7.299 1.587 1.00 0.00 C ATOM 1348 CD1 LEU A 87 18.401 7.217 2.561 1.00 0.00 C ATOM 1349 CD2 LEU A 87 15.915 7.093 2.354 1.00 0.00 C ATOM 0 H LEU A 87 14.744 9.534 1.210 1.00 0.00 H new ATOM 0 HA LEU A 87 17.225 9.558 2.872 1.00 0.00 H new ATOM 0 HB2 LEU A 87 16.550 8.657 0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 87 18.210 8.915 0.546 1.00 0.00 H new ATOM 0 HG LEU A 87 17.325 6.525 0.827 1.00 0.00 H new ATOM 0 HD11 LEU A 87 18.408 6.239 3.041 1.00 0.00 H new ATOM 0 HD12 LEU A 87 19.334 7.361 2.017 1.00 0.00 H new ATOM 0 HD13 LEU A 87 18.300 7.993 3.320 1.00 0.00 H new ATOM 0 HD21 LEU A 87 15.925 6.114 2.834 1.00 0.00 H new ATOM 0 HD22 LEU A 87 15.812 7.869 3.113 1.00 0.00 H new ATOM 0 HD23 LEU A 87 15.075 7.149 1.662 1.00 0.00 H new ATOM 1361 N LYS A 88 17.501 12.013 2.265 1.00 0.00 N ATOM 1362 CA LYS A 88 17.887 13.379 1.816 1.00 0.00 C ATOM 1363 C LYS A 88 16.630 14.164 1.435 1.00 0.00 C ATOM 1364 O LYS A 88 16.703 15.174 0.766 1.00 0.00 O ATOM 1365 CB LYS A 88 18.812 13.275 0.602 1.00 0.00 C ATOM 1366 CG LYS A 88 19.668 14.540 0.501 1.00 0.00 C ATOM 1367 CD LYS A 88 20.291 14.625 -0.894 1.00 0.00 C ATOM 1368 CE LYS A 88 21.604 13.840 -0.915 1.00 0.00 C ATOM 1369 NZ LYS A 88 21.791 13.222 -2.258 1.00 0.00 N ATOM 0 H LYS A 88 17.549 11.856 3.272 1.00 0.00 H new ATOM 0 HA LYS A 88 18.406 13.894 2.624 1.00 0.00 H new ATOM 0 HB2 LYS A 88 19.451 12.397 0.693 1.00 0.00 H new ATOM 0 HB3 LYS A 88 18.224 13.148 -0.307 1.00 0.00 H new ATOM 0 HG2 LYS A 88 19.056 15.422 0.692 1.00 0.00 H new ATOM 0 HG3 LYS A 88 20.450 14.524 1.260 1.00 0.00 H new ATOM 0 HD2 LYS A 88 19.602 14.222 -1.637 1.00 0.00 H new ATOM 0 HD3 LYS A 88 20.473 15.666 -1.160 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.440 14.502 -0.688 1.00 0.00 H new ATOM 0 HE3 LYS A 88 21.591 13.068 -0.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 22.683 12.688 -2.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 20.999 12.578 -2.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 21.821 13.968 -2.982 1.00 0.00 H new ATOM 1383 N ASP A 89 15.481 13.696 1.851 1.00 0.00 N ATOM 1384 CA ASP A 89 14.207 14.397 1.520 1.00 0.00 C ATOM 1385 C ASP A 89 13.936 14.286 0.021 1.00 0.00 C ATOM 1386 O ASP A 89 13.026 14.896 -0.505 1.00 0.00 O ATOM 1387 CB ASP A 89 14.327 15.866 1.902 1.00 0.00 C ATOM 1388 CG ASP A 89 13.014 16.587 1.594 1.00 0.00 C ATOM 1389 OD1 ASP A 89 12.162 16.623 2.466 1.00 0.00 O ATOM 1390 OD2 ASP A 89 12.883 17.092 0.491 1.00 0.00 O ATOM 0 H ASP A 89 15.372 12.850 2.411 1.00 0.00 H new ATOM 0 HA ASP A 89 13.387 13.939 2.072 1.00 0.00 H new ATOM 0 HB2 ASP A 89 14.564 15.958 2.962 1.00 0.00 H new ATOM 0 HB3 ASP A 89 15.146 16.329 1.351 1.00 0.00 H new ATOM 1395 N GLY A 90 14.726 13.518 -0.669 1.00 0.00 N ATOM 1396 CA GLY A 90 14.527 13.370 -2.140 1.00 0.00 C ATOM 1397 C GLY A 90 14.207 11.915 -2.481 1.00 0.00 C ATOM 1398 O GLY A 90 13.142 11.601 -2.971 1.00 0.00 O ATOM 0 H GLY A 90 15.503 12.984 -0.281 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.715 14.017 -2.472 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.425 13.687 -2.670 1.00 0.00 H new ATOM 1402 N ARG A 91 15.129 11.030 -2.228 1.00 0.00 N ATOM 1403 CA ARG A 91 14.904 9.595 -2.529 1.00 0.00 C ATOM 1404 C ARG A 91 14.158 8.961 -1.359 1.00 0.00 C ATOM 1405 O ARG A 91 14.680 8.131 -0.642 1.00 0.00 O ATOM 1406 CB ARG A 91 16.256 8.913 -2.713 1.00 0.00 C ATOM 1407 CG ARG A 91 16.051 7.492 -3.241 1.00 0.00 C ATOM 1408 CD ARG A 91 16.009 7.517 -4.770 1.00 0.00 C ATOM 1409 NE ARG A 91 14.661 7.087 -5.237 1.00 0.00 N ATOM 1410 CZ ARG A 91 14.211 5.901 -4.928 1.00 0.00 C ATOM 1411 NH1 ARG A 91 15.018 4.875 -4.935 1.00 0.00 N ATOM 1412 NH2 ARG A 91 12.955 5.741 -4.612 1.00 0.00 N ATOM 0 H ARG A 91 16.039 11.245 -1.821 1.00 0.00 H new ATOM 0 HA ARG A 91 14.315 9.483 -3.440 1.00 0.00 H new ATOM 0 HB2 ARG A 91 16.870 9.484 -3.409 1.00 0.00 H new ATOM 0 HB3 ARG A 91 16.792 8.885 -1.764 1.00 0.00 H new ATOM 0 HG2 ARG A 91 16.859 6.846 -2.899 1.00 0.00 H new ATOM 0 HG3 ARG A 91 15.123 7.077 -2.848 1.00 0.00 H new ATOM 0 HD2 ARG A 91 16.229 8.521 -5.134 1.00 0.00 H new ATOM 0 HD3 ARG A 91 16.774 6.856 -5.176 1.00 0.00 H new ATOM 0 HE ARG A 91 14.090 7.719 -5.798 1.00 0.00 H new ATOM 0 HH11 ARG A 91 16.000 5.000 -5.182 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.667 3.948 -4.694 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.324 6.543 -4.606 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.604 4.814 -4.371 1.00 0.00 H new ATOM 1426 N ARG A 92 12.945 9.366 -1.149 1.00 0.00 N ATOM 1427 CA ARG A 92 12.161 8.809 -0.016 1.00 0.00 C ATOM 1428 C ARG A 92 12.356 7.293 0.059 1.00 0.00 C ATOM 1429 O ARG A 92 12.697 6.651 -0.914 1.00 0.00 O ATOM 1430 CB ARG A 92 10.675 9.124 -0.205 1.00 0.00 C ATOM 1431 CG ARG A 92 10.515 10.555 -0.725 1.00 0.00 C ATOM 1432 CD ARG A 92 10.212 10.523 -2.224 1.00 0.00 C ATOM 1433 NE ARG A 92 8.818 10.040 -2.439 1.00 0.00 N ATOM 1434 CZ ARG A 92 7.887 10.878 -2.805 1.00 0.00 C ATOM 1435 NH1 ARG A 92 7.870 11.343 -4.024 1.00 0.00 N ATOM 1436 NH2 ARG A 92 6.972 11.250 -1.952 1.00 0.00 N ATOM 0 H ARG A 92 12.458 10.062 -1.714 1.00 0.00 H new ATOM 0 HA ARG A 92 12.511 9.263 0.911 1.00 0.00 H new ATOM 0 HB2 ARG A 92 10.230 8.419 -0.908 1.00 0.00 H new ATOM 0 HB3 ARG A 92 10.145 9.009 0.741 1.00 0.00 H new ATOM 0 HG2 ARG A 92 9.709 11.059 -0.191 1.00 0.00 H new ATOM 0 HG3 ARG A 92 11.426 11.125 -0.539 1.00 0.00 H new ATOM 0 HD2 ARG A 92 10.333 11.518 -2.652 1.00 0.00 H new ATOM 0 HD3 ARG A 92 10.918 9.868 -2.735 1.00 0.00 H new ATOM 0 HE ARG A 92 8.592 9.055 -2.300 1.00 0.00 H new ATOM 0 HH11 ARG A 92 8.584 11.051 -4.691 1.00 0.00 H new ATOM 0 HH12 ARG A 92 7.142 11.998 -4.310 1.00 0.00 H new ATOM 0 HH21 ARG A 92 6.985 10.886 -0.999 1.00 0.00 H new ATOM 0 HH22 ARG A 92 6.244 11.905 -2.238 1.00 0.00 H new ATOM 1450 N VAL A 93 12.139 6.716 1.212 1.00 0.00 N ATOM 1451 CA VAL A 93 12.309 5.244 1.355 1.00 0.00 C ATOM 1452 C VAL A 93 11.351 4.737 2.431 1.00 0.00 C ATOM 1453 O VAL A 93 11.676 4.714 3.602 1.00 0.00 O ATOM 1454 CB VAL A 93 13.749 4.931 1.763 1.00 0.00 C ATOM 1455 CG1 VAL A 93 13.859 3.459 2.163 1.00 0.00 C ATOM 1456 CG2 VAL A 93 14.684 5.209 0.583 1.00 0.00 C ATOM 0 H VAL A 93 11.851 7.203 2.061 1.00 0.00 H new ATOM 0 HA VAL A 93 12.092 4.754 0.406 1.00 0.00 H new ATOM 0 HB VAL A 93 14.031 5.559 2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 93 14.886 3.237 2.454 1.00 0.00 H new ATOM 0 HG12 VAL A 93 13.193 3.259 3.002 1.00 0.00 H new ATOM 0 HG13 VAL A 93 13.577 2.830 1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 93 15.711 4.986 0.872 1.00 0.00 H new ATOM 0 HG22 VAL A 93 14.401 4.581 -0.262 1.00 0.00 H new ATOM 0 HG23 VAL A 93 14.607 6.258 0.297 1.00 0.00 H new ATOM 1466 N VAL A 94 10.169 4.342 2.053 1.00 0.00 N ATOM 1467 CA VAL A 94 9.197 3.851 3.065 1.00 0.00 C ATOM 1468 C VAL A 94 8.999 2.343 2.897 1.00 0.00 C ATOM 1469 O VAL A 94 9.138 1.803 1.815 1.00 0.00 O ATOM 1470 CB VAL A 94 7.862 4.578 2.883 1.00 0.00 C ATOM 1471 CG1 VAL A 94 7.156 4.688 4.232 1.00 0.00 C ATOM 1472 CG2 VAL A 94 8.112 5.985 2.330 1.00 0.00 C ATOM 0 H VAL A 94 9.835 4.338 1.089 1.00 0.00 H new ATOM 0 HA VAL A 94 9.580 4.050 4.066 1.00 0.00 H new ATOM 0 HB VAL A 94 7.239 4.018 2.185 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.205 5.205 4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 94 6.975 3.690 4.630 1.00 0.00 H new ATOM 0 HG13 VAL A 94 7.783 5.248 4.926 1.00 0.00 H new ATOM 0 HG21 VAL A 94 7.160 6.500 2.202 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.736 6.544 3.027 1.00 0.00 H new ATOM 0 HG23 VAL A 94 8.618 5.913 1.367 1.00 0.00 H new ATOM 1482 N ILE A 95 8.676 1.656 3.959 1.00 0.00 N ATOM 1483 CA ILE A 95 8.472 0.183 3.863 1.00 0.00 C ATOM 1484 C ILE A 95 7.095 -0.181 4.422 1.00 0.00 C ATOM 1485 O ILE A 95 6.588 0.465 5.317 1.00 0.00 O ATOM 1486 CB ILE A 95 9.555 -0.530 4.675 1.00 0.00 C ATOM 1487 CG1 ILE A 95 10.896 -0.418 3.945 1.00 0.00 C ATOM 1488 CG2 ILE A 95 9.187 -2.005 4.839 1.00 0.00 C ATOM 1489 CD1 ILE A 95 11.920 0.258 4.858 1.00 0.00 C ATOM 0 H ILE A 95 8.545 2.052 4.890 1.00 0.00 H new ATOM 0 HA ILE A 95 8.532 -0.126 2.819 1.00 0.00 H new ATOM 0 HB ILE A 95 9.634 -0.066 5.658 1.00 0.00 H new ATOM 0 HG12 ILE A 95 11.249 -1.408 3.656 1.00 0.00 H new ATOM 0 HG13 ILE A 95 10.775 0.158 3.027 1.00 0.00 H new ATOM 0 HG21 ILE A 95 9.960 -2.511 5.418 1.00 0.00 H new ATOM 0 HG22 ILE A 95 8.233 -2.086 5.359 1.00 0.00 H new ATOM 0 HG23 ILE A 95 9.106 -2.471 3.857 1.00 0.00 H new ATOM 0 HD11 ILE A 95 12.875 0.338 4.338 1.00 0.00 H new ATOM 0 HD12 ILE A 95 11.568 1.255 5.125 1.00 0.00 H new ATOM 0 HD13 ILE A 95 12.048 -0.336 5.763 1.00 0.00 H new ATOM 1501 N LEU A 96 6.486 -1.215 3.905 1.00 0.00 N ATOM 1502 CA LEU A 96 5.145 -1.619 4.414 1.00 0.00 C ATOM 1503 C LEU A 96 5.319 -2.613 5.563 1.00 0.00 C ATOM 1504 O LEU A 96 6.219 -3.430 5.558 1.00 0.00 O ATOM 1505 CB LEU A 96 4.348 -2.277 3.285 1.00 0.00 C ATOM 1506 CG LEU A 96 2.853 -2.053 3.519 1.00 0.00 C ATOM 1507 CD1 LEU A 96 2.106 -2.157 2.188 1.00 0.00 C ATOM 1508 CD2 LEU A 96 2.324 -3.117 4.483 1.00 0.00 C ATOM 0 H LEU A 96 6.859 -1.796 3.154 1.00 0.00 H new ATOM 0 HA LEU A 96 4.609 -0.739 4.770 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.644 -1.857 2.324 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.565 -3.344 3.246 1.00 0.00 H new ATOM 0 HG LEU A 96 2.697 -1.063 3.947 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.041 -1.997 2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.483 -1.401 1.499 1.00 0.00 H new ATOM 0 HD13 LEU A 96 2.262 -3.147 1.760 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.259 -2.959 4.651 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.481 -4.107 4.054 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.855 -3.045 5.432 1.00 0.00 H new ATOM 1520 N MET A 97 4.469 -2.552 6.552 1.00 0.00 N ATOM 1521 CA MET A 97 4.594 -3.495 7.698 1.00 0.00 C ATOM 1522 C MET A 97 3.485 -4.545 7.621 1.00 0.00 C ATOM 1523 O MET A 97 3.742 -5.720 7.449 1.00 0.00 O ATOM 1524 CB MET A 97 4.474 -2.721 9.013 1.00 0.00 C ATOM 1525 CG MET A 97 4.855 -3.635 10.179 1.00 0.00 C ATOM 1526 SD MET A 97 6.504 -3.192 10.779 1.00 0.00 S ATOM 1527 CE MET A 97 6.974 -4.831 11.383 1.00 0.00 C ATOM 0 H MET A 97 3.695 -1.891 6.615 1.00 0.00 H new ATOM 0 HA MET A 97 5.564 -3.989 7.655 1.00 0.00 H new ATOM 0 HB2 MET A 97 5.125 -1.847 8.994 1.00 0.00 H new ATOM 0 HB3 MET A 97 3.455 -2.356 9.141 1.00 0.00 H new ATOM 0 HG2 MET A 97 4.126 -3.539 10.983 1.00 0.00 H new ATOM 0 HG3 MET A 97 4.841 -4.677 9.858 1.00 0.00 H new ATOM 0 HE1 MET A 97 7.978 -4.789 11.804 1.00 0.00 H new ATOM 0 HE2 MET A 97 6.271 -5.151 12.152 1.00 0.00 H new ATOM 0 HE3 MET A 97 6.956 -5.542 10.557 1.00 0.00 H new ATOM 1537 N GLU A 98 2.253 -4.133 7.749 1.00 0.00 N ATOM 1538 CA GLU A 98 1.134 -5.115 7.684 1.00 0.00 C ATOM 1539 C GLU A 98 -0.089 -4.464 7.037 1.00 0.00 C ATOM 1540 O GLU A 98 0.006 -3.432 6.403 1.00 0.00 O ATOM 1541 CB GLU A 98 0.777 -5.573 9.100 1.00 0.00 C ATOM 1542 CG GLU A 98 0.624 -7.096 9.122 1.00 0.00 C ATOM 1543 CD GLU A 98 1.103 -7.638 10.470 1.00 0.00 C ATOM 1544 OE1 GLU A 98 2.291 -7.881 10.600 1.00 0.00 O ATOM 1545 OE2 GLU A 98 0.273 -7.801 11.349 1.00 0.00 O ATOM 0 H GLU A 98 1.974 -3.163 7.895 1.00 0.00 H new ATOM 0 HA GLU A 98 1.442 -5.974 7.087 1.00 0.00 H new ATOM 0 HB2 GLU A 98 1.554 -5.265 9.800 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -0.150 -5.099 9.424 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -0.418 -7.370 8.958 1.00 0.00 H new ATOM 0 HG3 GLU A 98 1.202 -7.542 8.313 1.00 0.00 H new ATOM 1552 N LEU A 99 -1.239 -5.062 7.193 1.00 0.00 N ATOM 1553 CA LEU A 99 -2.474 -4.484 6.590 1.00 0.00 C ATOM 1554 C LEU A 99 -3.624 -4.599 7.593 1.00 0.00 C ATOM 1555 O LEU A 99 -3.580 -5.395 8.510 1.00 0.00 O ATOM 1556 CB LEU A 99 -2.832 -5.253 5.314 1.00 0.00 C ATOM 1557 CG LEU A 99 -2.369 -6.706 5.440 1.00 0.00 C ATOM 1558 CD1 LEU A 99 -3.221 -7.426 6.485 1.00 0.00 C ATOM 1559 CD2 LEU A 99 -2.522 -7.407 4.088 1.00 0.00 C ATOM 0 H LEU A 99 -1.377 -5.928 7.714 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.304 -3.436 6.343 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.908 -5.218 5.147 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.360 -4.784 4.451 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.323 -6.728 5.747 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.890 -8.461 6.574 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.114 -6.927 7.448 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.267 -7.404 6.179 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.193 -8.442 4.176 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -3.568 -7.384 3.782 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.914 -6.895 3.342 1.00 0.00 H new ATOM 1571 N GLU A 100 -4.654 -3.812 7.432 1.00 0.00 N ATOM 1572 CA GLU A 100 -5.795 -3.891 8.390 1.00 0.00 C ATOM 1573 C GLU A 100 -7.099 -3.416 7.732 1.00 0.00 C ATOM 1574 O GLU A 100 -7.562 -2.323 7.962 1.00 0.00 O ATOM 1575 CB GLU A 100 -5.497 -3.023 9.615 1.00 0.00 C ATOM 1576 CG GLU A 100 -5.759 -3.830 10.888 1.00 0.00 C ATOM 1577 CD GLU A 100 -7.130 -3.458 11.455 1.00 0.00 C ATOM 1578 OE1 GLU A 100 -7.736 -2.538 10.931 1.00 0.00 O ATOM 1579 OE2 GLU A 100 -7.552 -4.101 12.402 1.00 0.00 O ATOM 0 H GLU A 100 -4.755 -3.124 6.686 1.00 0.00 H new ATOM 0 HA GLU A 100 -5.919 -4.931 8.692 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -4.461 -2.686 9.592 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -6.122 -2.130 9.602 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -5.722 -4.897 10.669 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -4.982 -3.629 11.625 1.00 0.00 H new ATOM 1586 N VAL A 101 -7.690 -4.236 6.913 1.00 0.00 N ATOM 1587 CA VAL A 101 -8.969 -3.866 6.239 1.00 0.00 C ATOM 1588 C VAL A 101 -9.321 -5.069 5.391 1.00 0.00 C ATOM 1589 O VAL A 101 -8.845 -6.148 5.682 1.00 0.00 O ATOM 1590 CB VAL A 101 -8.776 -2.527 5.467 1.00 0.00 C ATOM 1591 CG1 VAL A 101 -8.938 -2.650 3.952 1.00 0.00 C ATOM 1592 CG2 VAL A 101 -9.794 -1.510 5.987 1.00 0.00 C ATOM 0 H VAL A 101 -7.337 -5.163 6.676 1.00 0.00 H new ATOM 0 HA VAL A 101 -9.802 -3.662 6.912 1.00 0.00 H new ATOM 0 HB VAL A 101 -7.748 -2.211 5.646 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -8.788 -1.674 3.490 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -8.201 -3.353 3.563 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -9.940 -3.011 3.721 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -9.670 -0.567 5.455 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.803 -1.889 5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.635 -1.349 7.053 1.00 0.00 H new ATOM 1602 N LEU A 102 -10.122 -4.942 4.380 1.00 0.00 N ATOM 1603 CA LEU A 102 -10.450 -6.130 3.532 1.00 0.00 C ATOM 1604 C LEU A 102 -9.186 -6.989 3.417 1.00 0.00 C ATOM 1605 O LEU A 102 -9.245 -8.196 3.305 1.00 0.00 O ATOM 1606 CB LEU A 102 -10.887 -5.666 2.141 1.00 0.00 C ATOM 1607 CG LEU A 102 -12.201 -6.352 1.764 1.00 0.00 C ATOM 1608 CD1 LEU A 102 -11.959 -7.851 1.573 1.00 0.00 C ATOM 1609 CD2 LEU A 102 -13.225 -6.141 2.881 1.00 0.00 C ATOM 0 H LEU A 102 -10.569 -4.070 4.097 1.00 0.00 H new ATOM 0 HA LEU A 102 -11.262 -6.705 3.979 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -11.013 -4.583 2.130 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.117 -5.904 1.408 1.00 0.00 H new ATOM 0 HG LEU A 102 -12.580 -5.924 0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.896 -8.339 1.304 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.229 -8.003 0.778 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.579 -8.279 2.501 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -14.162 -6.630 2.613 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.845 -6.569 3.809 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -13.399 -5.074 3.018 1.00 0.00 H new ATOM 1621 N LYS A 103 -8.039 -6.349 3.487 1.00 0.00 N ATOM 1622 CA LYS A 103 -6.751 -7.072 3.435 1.00 0.00 C ATOM 1623 C LYS A 103 -6.757 -8.005 2.221 1.00 0.00 C ATOM 1624 O LYS A 103 -6.039 -8.984 2.166 1.00 0.00 O ATOM 1625 CB LYS A 103 -6.553 -7.859 4.749 1.00 0.00 C ATOM 1626 CG LYS A 103 -7.000 -9.325 4.612 1.00 0.00 C ATOM 1627 CD LYS A 103 -5.772 -10.214 4.406 1.00 0.00 C ATOM 1628 CE LYS A 103 -5.727 -11.285 5.497 1.00 0.00 C ATOM 1629 NZ LYS A 103 -5.808 -10.633 6.835 1.00 0.00 N ATOM 0 H LYS A 103 -7.954 -5.337 3.580 1.00 0.00 H new ATOM 0 HA LYS A 103 -5.921 -6.373 3.332 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -5.502 -7.825 5.038 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.119 -7.380 5.548 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.542 -9.636 5.505 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -7.684 -9.431 3.770 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.811 -10.683 3.423 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.864 -9.611 4.436 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.554 -11.984 5.370 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.806 -11.863 5.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -5.199 -11.142 7.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.490 -9.646 6.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -6.791 -10.656 7.173 1.00 0.00 H new ATOM 1643 N SER A 104 -7.593 -7.717 1.263 1.00 0.00 N ATOM 1644 CA SER A 104 -7.694 -8.587 0.062 1.00 0.00 C ATOM 1645 C SER A 104 -8.959 -8.238 -0.676 1.00 0.00 C ATOM 1646 O SER A 104 -9.716 -9.088 -1.102 1.00 0.00 O ATOM 1647 CB SER A 104 -7.824 -10.014 0.496 1.00 0.00 C ATOM 1648 OG SER A 104 -6.543 -10.626 0.560 1.00 0.00 O ATOM 0 H SER A 104 -8.215 -6.909 1.262 1.00 0.00 H new ATOM 0 HA SER A 104 -6.811 -8.447 -0.562 1.00 0.00 H new ATOM 0 HB2 SER A 104 -8.307 -10.062 1.472 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.460 -10.558 -0.202 1.00 0.00 H new ATOM 0 HG SER A 104 -6.041 -10.256 1.316 1.00 0.00 H new ATOM 1654 N ALA A 105 -9.195 -6.999 -0.787 1.00 0.00 N ATOM 1655 CA ALA A 105 -10.415 -6.517 -1.455 1.00 0.00 C ATOM 1656 C ALA A 105 -10.220 -6.495 -2.970 1.00 0.00 C ATOM 1657 O ALA A 105 -10.610 -5.562 -3.644 1.00 0.00 O ATOM 1658 CB ALA A 105 -10.692 -5.123 -0.945 1.00 0.00 C ATOM 0 H ALA A 105 -8.582 -6.263 -0.436 1.00 0.00 H new ATOM 0 HA ALA A 105 -11.253 -7.179 -1.238 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -11.592 -4.734 -1.421 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -10.836 -5.153 0.135 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -9.848 -4.475 -1.181 1.00 0.00 H new ATOM 1664 N GLU A 106 -9.649 -7.530 -3.515 1.00 0.00 N ATOM 1665 CA GLU A 106 -9.461 -7.589 -4.983 1.00 0.00 C ATOM 1666 C GLU A 106 -10.789 -7.236 -5.622 1.00 0.00 C ATOM 1667 O GLU A 106 -10.865 -6.689 -6.704 1.00 0.00 O ATOM 1668 CB GLU A 106 -9.091 -9.017 -5.361 1.00 0.00 C ATOM 1669 CG GLU A 106 -8.494 -9.044 -6.767 1.00 0.00 C ATOM 1670 CD GLU A 106 -8.239 -10.494 -7.186 1.00 0.00 C ATOM 1671 OE1 GLU A 106 -8.475 -11.374 -6.375 1.00 0.00 O ATOM 1672 OE2 GLU A 106 -7.812 -10.698 -8.310 1.00 0.00 O ATOM 0 H GLU A 106 -9.304 -8.341 -3.001 1.00 0.00 H new ATOM 0 HA GLU A 106 -8.679 -6.905 -5.313 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -8.374 -9.418 -4.644 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -9.974 -9.654 -5.319 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -9.174 -8.565 -7.471 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -7.562 -8.479 -6.789 1.00 0.00 H new ATOM 1679 N ALA A 107 -11.838 -7.559 -4.932 1.00 0.00 N ATOM 1680 CA ALA A 107 -13.204 -7.266 -5.450 1.00 0.00 C ATOM 1681 C ALA A 107 -13.532 -8.219 -6.602 1.00 0.00 C ATOM 1682 O ALA A 107 -14.574 -8.124 -7.219 1.00 0.00 O ATOM 1683 CB ALA A 107 -13.259 -5.822 -5.951 1.00 0.00 C ATOM 0 H ALA A 107 -11.812 -8.018 -4.022 1.00 0.00 H new ATOM 0 HA ALA A 107 -13.932 -7.402 -4.650 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -14.258 -5.606 -6.330 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -13.028 -5.143 -5.130 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -12.530 -5.686 -6.750 1.00 0.00 H new ATOM 1689 N VAL A 108 -12.652 -9.136 -6.898 1.00 0.00 N ATOM 1690 CA VAL A 108 -12.917 -10.091 -8.011 1.00 0.00 C ATOM 1691 C VAL A 108 -12.758 -11.525 -7.501 1.00 0.00 C ATOM 1692 O VAL A 108 -13.444 -12.428 -7.937 1.00 0.00 O ATOM 1693 CB VAL A 108 -11.923 -9.840 -9.146 1.00 0.00 C ATOM 1694 CG1 VAL A 108 -12.304 -10.694 -10.357 1.00 0.00 C ATOM 1695 CG2 VAL A 108 -11.958 -8.361 -9.535 1.00 0.00 C ATOM 0 H VAL A 108 -11.762 -9.265 -6.418 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.933 -9.947 -8.379 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.919 -10.106 -8.815 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.596 -10.515 -11.166 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.281 -11.748 -10.081 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -13.308 -10.428 -10.688 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -11.250 -8.181 -10.344 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -12.962 -8.095 -9.866 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -11.687 -7.752 -8.673 1.00 0.00 H new ATOM 1705 N GLY A 109 -11.859 -11.741 -6.581 1.00 0.00 N ATOM 1706 CA GLY A 109 -11.657 -13.117 -6.045 1.00 0.00 C ATOM 1707 C GLY A 109 -12.873 -13.525 -5.211 1.00 0.00 C ATOM 1708 O GLY A 109 -13.891 -13.929 -5.737 1.00 0.00 O ATOM 0 H GLY A 109 -11.256 -11.025 -6.177 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.513 -13.820 -6.865 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -10.755 -13.152 -5.433 1.00 0.00 H new ATOM 1712 N VAL A 110 -12.777 -13.421 -3.914 1.00 0.00 N ATOM 1713 CA VAL A 110 -13.928 -13.803 -3.048 1.00 0.00 C ATOM 1714 C VAL A 110 -14.519 -15.126 -3.540 1.00 0.00 C ATOM 1715 O VAL A 110 -15.461 -15.148 -4.308 1.00 0.00 O ATOM 1716 CB VAL A 110 -14.997 -12.711 -3.111 1.00 0.00 C ATOM 1717 CG1 VAL A 110 -16.116 -13.034 -2.120 1.00 0.00 C ATOM 1718 CG2 VAL A 110 -14.370 -11.363 -2.749 1.00 0.00 C ATOM 0 H VAL A 110 -11.951 -13.088 -3.416 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.587 -13.918 -2.019 1.00 0.00 H new ATOM 0 HB VAL A 110 -15.408 -12.663 -4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -16.878 -12.256 -2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -16.563 -13.994 -2.376 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -15.706 -13.082 -1.111 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -15.131 -10.584 -2.794 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -13.959 -11.412 -1.740 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -13.572 -11.132 -3.455 1.00 0.00 H new ATOM 1728 N LYS A 111 -13.975 -16.229 -3.104 1.00 0.00 N ATOM 1729 CA LYS A 111 -14.507 -17.548 -3.547 1.00 0.00 C ATOM 1730 C LYS A 111 -15.811 -17.847 -2.805 1.00 0.00 C ATOM 1731 O LYS A 111 -15.832 -17.984 -1.598 1.00 0.00 O ATOM 1732 CB LYS A 111 -13.482 -18.641 -3.239 1.00 0.00 C ATOM 1733 CG LYS A 111 -12.655 -18.934 -4.492 1.00 0.00 C ATOM 1734 CD LYS A 111 -12.943 -20.357 -4.973 1.00 0.00 C ATOM 1735 CE LYS A 111 -14.011 -20.320 -6.068 1.00 0.00 C ATOM 1736 NZ LYS A 111 -15.048 -21.352 -5.786 1.00 0.00 N ATOM 0 H LYS A 111 -13.185 -16.274 -2.460 1.00 0.00 H new ATOM 0 HA LYS A 111 -14.698 -17.521 -4.620 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -12.829 -18.323 -2.426 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -13.989 -19.546 -2.905 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -12.898 -18.218 -5.277 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -11.593 -18.820 -4.274 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -12.031 -20.814 -5.356 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -13.283 -20.972 -4.140 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -14.469 -19.332 -6.111 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -13.556 -20.503 -7.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -15.774 -21.327 -6.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -14.605 -22.293 -5.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -15.490 -21.158 -4.865 1.00 0.00 H new ATOM 1750 N ILE A 112 -16.900 -17.949 -3.517 1.00 0.00 N ATOM 1751 CA ILE A 112 -18.201 -18.240 -2.852 1.00 0.00 C ATOM 1752 C ILE A 112 -18.790 -19.531 -3.424 1.00 0.00 C ATOM 1753 O ILE A 112 -18.630 -19.834 -4.590 1.00 0.00 O ATOM 1754 CB ILE A 112 -19.170 -17.083 -3.101 1.00 0.00 C ATOM 1755 CG1 ILE A 112 -20.553 -17.451 -2.556 1.00 0.00 C ATOM 1756 CG2 ILE A 112 -19.271 -16.815 -4.603 1.00 0.00 C ATOM 1757 CD1 ILE A 112 -20.479 -17.599 -1.035 1.00 0.00 C ATOM 0 H ILE A 112 -16.945 -17.843 -4.531 1.00 0.00 H new ATOM 0 HA ILE A 112 -18.043 -18.358 -1.780 1.00 0.00 H new ATOM 0 HB ILE A 112 -18.805 -16.189 -2.596 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -21.277 -16.681 -2.822 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -20.897 -18.382 -3.006 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -19.962 -15.990 -4.780 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -18.287 -16.554 -4.993 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -19.636 -17.709 -5.108 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -21.463 -17.861 -0.647 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -19.767 -18.384 -0.780 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -20.153 -16.657 -0.593 1.00 0.00 H new ATOM 1769 N GLY A 113 -19.470 -20.294 -2.613 1.00 0.00 N ATOM 1770 CA GLY A 113 -20.068 -21.565 -3.111 1.00 0.00 C ATOM 1771 C GLY A 113 -19.858 -22.670 -2.076 1.00 0.00 C ATOM 1772 O GLY A 113 -18.937 -22.625 -1.284 1.00 0.00 O ATOM 0 H GLY A 113 -19.637 -20.092 -1.627 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -21.133 -21.428 -3.301 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -19.609 -21.848 -4.058 1.00 0.00 H new ATOM 1776 N ASN A 114 -20.704 -23.664 -2.074 1.00 0.00 N ATOM 1777 CA ASN A 114 -20.552 -24.771 -1.089 1.00 0.00 C ATOM 1778 C ASN A 114 -20.664 -24.210 0.330 1.00 0.00 C ATOM 1779 O ASN A 114 -20.530 -23.007 0.483 1.00 0.00 O ATOM 1780 CB ASN A 114 -19.183 -25.430 -1.270 1.00 0.00 C ATOM 1781 CG ASN A 114 -19.313 -26.628 -2.212 1.00 0.00 C ATOM 1782 OD1 ASN A 114 -19.428 -26.465 -3.410 1.00 0.00 O ATOM 1783 ND2 ASN A 114 -19.301 -27.836 -1.717 1.00 0.00 N ATOM 1784 OXT ASN A 114 -20.881 -24.993 1.240 1.00 0.00 O ATOM 0 H ASN A 114 -21.494 -23.757 -2.712 1.00 0.00 H new ATOM 0 HA ASN A 114 -21.336 -25.511 -1.250 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -18.472 -24.710 -1.676 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -18.793 -25.754 -0.305 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -19.388 -28.642 -2.336 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -19.204 -27.974 -0.711 1.00 0.00 H new TER 1791 ASN A 114 END