USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 897 hydrogens (0 hets) HEADER ELECTRON TRANSPORT 26-MAR-05 1Z7R TITLE SOLUTION STRUCTURE OF REDUCED GLUTAREDOXIN C1 FROM POPULUS TITLE 2 TREMULA X TREMULOIDES COMPND MOL_ID: 1; COMPND 2 MOLECULE: GLUTAREDOXIN; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: GLUTAREDOXIN C1; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: POPULUS TREMULA X POPULUS TREMULOIDES; SOURCE 3 ORGANISM_TAXID: 47664; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 5 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET3D KEYWDS ELECTRON TRANSPORT EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR Y.FENG,N.ZHONG,N.ROUHIER,J.P.JACQUOT,B.XIA REVDAT 3 24-FEB-09 1Z7R 1 VERSN REVDAT 2 25-JUL-06 1Z7R 1 JRNL AUTHOR REVDAT 1 28-MAR-06 1Z7R 0 JRNL AUTH Y.FENG,N.ZHONG,N.ROUHIER,T.HASE,M.KUSUNOKI, JRNL AUTH 2 J.P.JACQUOT,C.JIN,B.XIA JRNL TITL STRUCTURAL INSIGHT INTO POPLAR GLUTAREDOXIN C1 JRNL TITL 2 WITH A BRIDGING IRON-SULFUR CLUSTER AT THE ACTIVE JRNL TITL 3 SITE JRNL REF BIOCHEMISTRY V. 45 7998 2006 JRNL REFN ISSN 0006-2960 JRNL PMID 16800625 JRNL DOI 10.1021/BI060444T REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : AMBER 7 REMARK 3 AUTHORS : CASE, D. A. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: CYS 31 IS PRESENT AS THE THIOLATE REMARK 3 WITH A NEGATIVE CHARGE ON THE SULFUR. REMARK 4 REMARK 4 1Z7R COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 29-MAR-05. REMARK 100 THE RCSB ID CODE IS RCSB032404. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 293 REMARK 210 PH : 6.4 REMARK 210 IONIC STRENGTH : 40MM POTASSIUM PHOSPHATE REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1.1MM UNIFORMLY 13C/15N- REMARK 210 LABELED PROTEIN, 40MM REMARK 210 POTASSIUM PHOSPHATE BUFFER, REMARK 210 90% H2O/10% D2O, 40MM DTT, REMARK 210 0.01% NAN3 AND 0.01% DSS, REMARK 210 PROTEASE INHIBITOR COCKTAIL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 3D_ REMARK 210 13C-SEPARATED_NOESY, 3D_13C- REMARK 210 SEPARATED_NOESY IN AROMATIC REMARK 210 REGION REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : CYANA 1.0.6, NMRVIEW 5.2.2, REMARK 210 NMRPIPE 2.3 REMARK 210 METHOD USED : MOLECULAR DYNAMICS, SIMULATED REMARK 210 ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ALA A 2 -17.57 138.18 REMARK 500 GLN A 116 155.44 70.90 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 6410 RELATED DB: BMRB REMARK 900 CHEMICAL SHIFT ASSIGNMENT REMARK 900 RELATED ID: 1Z7P RELATED DB: PDB REMARK 900 ENSEMBLE DBREF 1Z7R A 3 112 UNP Q5PSJ1 Q5PSJ1_9ROSI 12 121 SEQADV 1Z7R MET A 1 UNP Q5PSJ1 CLONING ARTIFACT SEQADV 1Z7R ALA A 2 UNP Q5PSJ1 CLONING ARTIFACT SEQADV 1Z7R ASN A 113 UNP Q5PSJ1 SEE REMARK 999 SEQADV 1Z7R PRO A 114 UNP Q5PSJ1 SEE REMARK 999 SEQADV 1Z7R ALA A 115 UNP Q5PSJ1 SEE REMARK 999 SEQADV 1Z7R GLN A 116 UNP Q5PSJ1 SEE REMARK 999 SEQADV 1Z7R LEU A 117 UNP Q5PSJ1 SEE REMARK 999 SEQRES 1 A 117 MET ALA SER LYS GLN GLU LEU ASP ALA ALA LEU LYS LYS SEQRES 2 A 117 ALA LYS GLU LEU ALA SER SER ALA PRO VAL VAL VAL PHE SEQRES 3 A 117 SER LYS THR TYR CYS GLY TYR CYS ASN ARG VAL LYS GLN SEQRES 4 A 117 LEU LEU THR GLN VAL GLY ALA SER TYR LYS VAL VAL GLU SEQRES 5 A 117 LEU ASP GLU LEU SER ASP GLY SER GLN LEU GLN SER ALA SEQRES 6 A 117 LEU ALA HIS TRP THR GLY ARG GLY THR VAL PRO ASN VAL SEQRES 7 A 117 PHE ILE GLY GLY LYS GLN ILE GLY GLY CYS ASP THR VAL SEQRES 8 A 117 VAL GLU LYS HIS GLN ARG ASN GLU LEU LEU PRO LEU LEU SEQRES 9 A 117 GLN ASP ALA ALA ALA THR ALA LYS ASN PRO ALA GLN LEU HELIX 1 1 ALA A 2 SER A 20 1 19 HELIX 2 2 CYS A 31 GLY A 45 1 15 HELIX 3 3 ASP A 58 GLY A 71 1 14 HELIX 4 4 CYS A 88 ARG A 97 1 10 HELIX 5 5 GLU A 99 ALA A 107 1 9 SHEET 1 A 4 LYS A 49 GLU A 52 0 SHEET 2 A 4 VAL A 23 SER A 27 1 N SER A 27 O VAL A 51 SHEET 3 A 4 ASN A 77 ILE A 80 -1 O PHE A 79 N VAL A 24 SHEET 4 A 4 LYS A 83 GLY A 87 -1 O ILE A 85 N VAL A 78 CISPEP 1 VAL A 75 PRO A 76 0 -10.09 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 105 GLN : amide:sc= 0.764 K(o=2.7,f=-4.3) USER MOD Set 1.2: A 113 ASN : amide:sc= 1.93 K(o=2.7,f=-3.4!) USER MOD Set 2.1: A 70 THR OG1 : rot -70:sc= 1.37 USER MOD Set 2.2: A 77 ASN : amide:sc= 1.41 K(o=3.6,f=-2.3!) USER MOD Set 2.3: A 84 GLN : amide:sc= 0.839 K(o=3.6,f=0.74!) USER MOD Set 3.1: A 42 THR OG1 : rot 98:sc= 2.05 USER MOD Set 3.2: A 48 TYR OH : rot 171:sc= 0.957 USER MOD Set 4.1: A 35 ASN : amide:sc= 0.503 K(o=1.1,f=0.15) USER MOD Set 4.2: A 39 GLN : amide:sc= 0.556 K(o=1.1,f=0.15) USER MOD Set 5.1: A 28 LYS NZ :NH3+ -167:sc= 0.787 (180deg=0) USER MOD Set 5.2: A 63 GLN : amide:sc= 1.86 K(o=2.6,f=-5.5!) USER MOD Set 6.1: A 1 MET CE :methyl 152:sc= 0 (180deg=-0.000352) USER MOD Set 6.2: A 3 SER OG : rot -130:sc= 0.0021 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 73:sc= 1.24 USER MOD Single : A 20 SER OG : rot 55:sc= 1.24 USER MOD Single : A 27 SER OG : rot -77:sc= 0.641 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0928 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot -24:sc= 0.57 USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 56:sc= -0.748 USER MOD Single : A 38 LYS NZ :NH3+ 175:sc= 1.26 (180deg=1.2) USER MOD Single : A 43 GLN : amide:sc= 0.143 X(o=0.14,f=0) USER MOD Single : A 47 SER OG : rot 77:sc= 0.222 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0.0325 USER MOD Single : A 60 SER OG : rot 180:sc= 0.00213 USER MOD Single : A 61 GLN : amide:sc= 2.36 K(o=2.4,f=0) USER MOD Single : A 64 SER OG : rot 68:sc= 1.2 USER MOD Single : A 68 HIS : no HE2:sc= -0.0519 K(o=-0.052,f=-0.58) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0748 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 CYS SG : rot 161:sc= 0.509 USER MOD Single : A 90 THR OG1 : rot -130:sc= 0.46 USER MOD Single : A 94 LYS NZ :NH3+ 176:sc= 1.25 (180deg=1.2) USER MOD Single : A 95 HIS : no HD1:sc= -0.357 X(o=-0.36,f=-0.015) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 98 ASN : amide:sc= -0.186 K(o=-0.19,f=-0.82) USER MOD Single : A 110 THR OG1 : rot 48:sc= 0.0884 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 1.22 K(o=1.2,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.544 11.202 -1.990 1.00 10.00 N ATOM 2 CA MET A 1 21.608 11.205 -0.837 1.00 10.00 C ATOM 3 C MET A 1 21.194 9.785 -0.420 1.00 10.00 C ATOM 4 O MET A 1 21.645 9.355 0.642 1.00 10.00 O ATOM 5 CB MET A 1 20.449 12.229 -0.963 1.00 10.00 C ATOM 6 CG MET A 1 19.518 12.145 -2.188 1.00 10.00 C ATOM 7 SD MET A 1 18.690 13.715 -2.605 1.00 10.00 S ATOM 8 CE MET A 1 17.491 13.898 -1.252 1.00 10.00 C ATOM 0 H1 MET A 1 22.795 12.181 -2.236 1.00 10.00 H new ATOM 0 H2 MET A 1 23.405 10.677 -1.737 1.00 10.00 H new ATOM 0 H3 MET A 1 22.088 10.747 -2.806 1.00 10.00 H new ATOM 0 HA MET A 1 22.169 11.591 0.014 1.00 10.00 H new ATOM 0 HB2 MET A 1 19.830 12.139 -0.070 1.00 10.00 H new ATOM 0 HB3 MET A 1 20.887 13.227 -0.948 1.00 10.00 H new ATOM 0 HG2 MET A 1 20.098 11.813 -3.049 1.00 10.00 H new ATOM 0 HG3 MET A 1 18.759 11.385 -2.002 1.00 10.00 H new ATOM 0 HE1 MET A 1 17.290 14.956 -1.085 1.00 10.00 H new ATOM 0 HE2 MET A 1 16.564 13.389 -1.516 1.00 10.00 H new ATOM 0 HE3 MET A 1 17.899 13.458 -0.342 1.00 10.00 H new ATOM 20 N ALA A 2 20.377 9.072 -1.223 1.00 10.00 N ATOM 21 CA ALA A 2 19.825 7.703 -1.068 1.00 10.00 C ATOM 22 C ALA A 2 18.351 7.659 -1.488 1.00 10.00 C ATOM 23 O ALA A 2 17.813 6.581 -1.740 1.00 10.00 O ATOM 24 CB ALA A 2 19.951 7.091 0.339 1.00 10.00 C ATOM 0 H ALA A 2 20.049 9.486 -2.096 1.00 10.00 H new ATOM 0 HA ALA A 2 20.447 7.095 -1.725 1.00 10.00 H new ATOM 0 HB1 ALA A 2 19.517 6.091 0.341 1.00 10.00 H new ATOM 0 HB2 ALA A 2 21.003 7.030 0.616 1.00 10.00 H new ATOM 0 HB3 ALA A 2 19.422 7.718 1.057 1.00 10.00 H new ATOM 30 N SER A 3 17.690 8.815 -1.568 1.00 10.00 N ATOM 31 CA SER A 3 16.253 8.925 -1.743 1.00 10.00 C ATOM 32 C SER A 3 15.685 8.218 -2.970 1.00 10.00 C ATOM 33 O SER A 3 14.533 7.823 -2.906 1.00 10.00 O ATOM 34 CB SER A 3 15.857 10.401 -1.704 1.00 10.00 C ATOM 35 OG SER A 3 16.438 11.003 -0.556 1.00 10.00 O ATOM 0 H SER A 3 18.157 9.720 -1.511 1.00 10.00 H new ATOM 0 HA SER A 3 15.800 8.386 -0.911 1.00 10.00 H new ATOM 0 HB2 SER A 3 16.197 10.907 -2.608 1.00 10.00 H new ATOM 0 HB3 SER A 3 14.772 10.499 -1.673 1.00 10.00 H new ATOM 0 HG SER A 3 15.751 11.499 -0.063 1.00 10.00 H new ATOM 41 N LYS A 4 16.433 7.975 -4.052 1.00 10.00 N ATOM 42 CA LYS A 4 15.907 7.144 -5.146 1.00 10.00 C ATOM 43 C LYS A 4 15.667 5.714 -4.651 1.00 10.00 C ATOM 44 O LYS A 4 14.571 5.176 -4.829 1.00 10.00 O ATOM 45 CB LYS A 4 16.825 7.226 -6.379 1.00 10.00 C ATOM 46 CG LYS A 4 16.380 6.285 -7.517 1.00 10.00 C ATOM 47 CD LYS A 4 16.764 6.776 -8.923 1.00 10.00 C ATOM 48 CE LYS A 4 18.249 7.145 -9.069 1.00 10.00 C ATOM 49 NZ LYS A 4 18.577 7.594 -10.446 1.00 10.00 N ATOM 0 H LYS A 4 17.379 8.329 -4.195 1.00 10.00 H new ATOM 0 HA LYS A 4 14.939 7.527 -5.469 1.00 10.00 H new ATOM 0 HB2 LYS A 4 16.841 8.252 -6.747 1.00 10.00 H new ATOM 0 HB3 LYS A 4 17.845 6.977 -6.085 1.00 10.00 H new ATOM 0 HG2 LYS A 4 16.821 5.301 -7.354 1.00 10.00 H new ATOM 0 HG3 LYS A 4 15.298 6.161 -7.470 1.00 10.00 H new ATOM 0 HD2 LYS A 4 16.520 5.999 -9.648 1.00 10.00 H new ATOM 0 HD3 LYS A 4 16.157 7.647 -9.172 1.00 10.00 H new ATOM 0 HE2 LYS A 4 18.498 7.935 -8.361 1.00 10.00 H new ATOM 0 HE3 LYS A 4 18.864 6.282 -8.813 1.00 10.00 H new ATOM 0 HZ1 LYS A 4 19.588 7.833 -10.502 1.00 10.00 H new ATOM 0 HZ2 LYS A 4 18.364 6.831 -11.120 1.00 10.00 H new ATOM 0 HZ3 LYS A 4 18.009 8.433 -10.682 1.00 10.00 H new ATOM 63 N GLN A 5 16.657 5.114 -3.984 1.00 10.00 N ATOM 64 CA GLN A 5 16.520 3.767 -3.449 1.00 10.00 C ATOM 65 C GLN A 5 15.498 3.759 -2.310 1.00 10.00 C ATOM 66 O GLN A 5 14.701 2.830 -2.227 1.00 10.00 O ATOM 67 CB GLN A 5 17.883 3.233 -2.975 1.00 10.00 C ATOM 68 CG GLN A 5 17.839 1.713 -2.744 1.00 10.00 C ATOM 69 CD GLN A 5 19.104 1.185 -2.062 1.00 10.00 C ATOM 70 OE1 GLN A 5 20.225 1.413 -2.512 1.00 10.00 O ATOM 71 NE2 GLN A 5 18.959 0.466 -0.960 1.00 10.00 N ATOM 0 H GLN A 5 17.563 5.546 -3.804 1.00 10.00 H new ATOM 0 HA GLN A 5 16.160 3.107 -4.238 1.00 10.00 H new ATOM 0 HB2 GLN A 5 18.646 3.468 -3.717 1.00 10.00 H new ATOM 0 HB3 GLN A 5 18.171 3.735 -2.051 1.00 10.00 H new ATOM 0 HG2 GLN A 5 16.971 1.467 -2.132 1.00 10.00 H new ATOM 0 HG3 GLN A 5 17.708 1.207 -3.701 1.00 10.00 H new ATOM 0 HE21 GLN A 5 18.026 0.280 -0.591 1.00 10.00 H new ATOM 0 HE22 GLN A 5 19.780 0.098 -0.480 1.00 10.00 H new ATOM 80 N GLU A 6 15.486 4.772 -1.438 1.00 10.00 N ATOM 81 CA GLU A 6 14.560 4.777 -0.307 1.00 10.00 C ATOM 82 C GLU A 6 13.128 5.053 -0.768 1.00 10.00 C ATOM 83 O GLU A 6 12.199 4.509 -0.180 1.00 10.00 O ATOM 84 CB GLU A 6 14.992 5.764 0.785 1.00 10.00 C ATOM 85 CG GLU A 6 16.169 5.218 1.605 1.00 10.00 C ATOM 86 CD GLU A 6 16.414 6.059 2.870 1.00 10.00 C ATOM 87 OE1 GLU A 6 15.643 5.923 3.848 1.00 10.00 O ATOM 88 OE2 GLU A 6 17.393 6.837 2.914 1.00 10.00 O ATOM 0 H GLU A 6 16.098 5.586 -1.493 1.00 10.00 H new ATOM 0 HA GLU A 6 14.586 3.781 0.134 1.00 10.00 H new ATOM 0 HB2 GLU A 6 15.275 6.712 0.328 1.00 10.00 H new ATOM 0 HB3 GLU A 6 14.150 5.967 1.447 1.00 10.00 H new ATOM 0 HG2 GLU A 6 15.969 4.184 1.887 1.00 10.00 H new ATOM 0 HG3 GLU A 6 17.070 5.212 0.991 1.00 10.00 H new ATOM 95 N LEU A 7 12.927 5.830 -1.835 1.00 10.00 N ATOM 96 CA LEU A 7 11.619 6.029 -2.446 1.00 10.00 C ATOM 97 C LEU A 7 11.152 4.723 -3.077 1.00 10.00 C ATOM 98 O LEU A 7 9.984 4.380 -2.938 1.00 10.00 O ATOM 99 CB LEU A 7 11.693 7.138 -3.506 1.00 10.00 C ATOM 100 CG LEU A 7 10.342 7.548 -4.109 1.00 10.00 C ATOM 101 CD1 LEU A 7 9.514 8.333 -3.085 1.00 10.00 C ATOM 102 CD2 LEU A 7 10.596 8.436 -5.331 1.00 10.00 C ATOM 0 H LEU A 7 13.677 6.341 -2.300 1.00 10.00 H new ATOM 0 HA LEU A 7 10.905 6.332 -1.681 1.00 10.00 H new ATOM 0 HB2 LEU A 7 12.156 8.017 -3.059 1.00 10.00 H new ATOM 0 HB3 LEU A 7 12.348 6.807 -4.312 1.00 10.00 H new ATOM 0 HG LEU A 7 9.792 6.651 -4.395 1.00 10.00 H new ATOM 0 HD11 LEU A 7 8.560 8.616 -3.529 1.00 10.00 H new ATOM 0 HD12 LEU A 7 9.336 7.711 -2.208 1.00 10.00 H new ATOM 0 HD13 LEU A 7 10.057 9.231 -2.790 1.00 10.00 H new ATOM 0 HD21 LEU A 7 9.643 8.734 -5.769 1.00 10.00 H new ATOM 0 HD22 LEU A 7 11.149 9.324 -5.026 1.00 10.00 H new ATOM 0 HD23 LEU A 7 11.177 7.882 -6.069 1.00 10.00 H new ATOM 114 N ASP A 8 12.042 3.973 -3.735 1.00 10.00 N ATOM 115 CA ASP A 8 11.699 2.657 -4.274 1.00 10.00 C ATOM 116 C ASP A 8 11.386 1.652 -3.160 1.00 10.00 C ATOM 117 O ASP A 8 10.437 0.877 -3.278 1.00 10.00 O ATOM 118 CB ASP A 8 12.826 2.129 -5.166 1.00 10.00 C ATOM 119 CG ASP A 8 12.500 0.720 -5.688 1.00 10.00 C ATOM 120 OD1 ASP A 8 11.671 0.595 -6.617 1.00 10.00 O ATOM 121 OD2 ASP A 8 13.102 -0.264 -5.202 1.00 10.00 O ATOM 0 H ASP A 8 13.006 4.257 -3.906 1.00 10.00 H new ATOM 0 HA ASP A 8 10.798 2.776 -4.877 1.00 10.00 H new ATOM 0 HB2 ASP A 8 12.977 2.806 -6.007 1.00 10.00 H new ATOM 0 HB3 ASP A 8 13.759 2.106 -4.604 1.00 10.00 H new ATOM 126 N ALA A 9 12.122 1.688 -2.047 1.00 10.00 N ATOM 127 CA ALA A 9 11.839 0.840 -0.897 1.00 10.00 C ATOM 128 C ALA A 9 10.499 1.225 -0.263 1.00 10.00 C ATOM 129 O ALA A 9 9.700 0.352 0.070 1.00 10.00 O ATOM 130 CB ALA A 9 12.976 0.937 0.126 1.00 10.00 C ATOM 0 H ALA A 9 12.926 2.304 -1.922 1.00 10.00 H new ATOM 0 HA ALA A 9 11.768 -0.194 -1.234 1.00 10.00 H new ATOM 0 HB1 ALA A 9 12.752 0.299 0.981 1.00 10.00 H new ATOM 0 HB2 ALA A 9 13.909 0.612 -0.335 1.00 10.00 H new ATOM 0 HB3 ALA A 9 13.077 1.969 0.461 1.00 10.00 H new ATOM 136 N ALA A 10 10.224 2.524 -0.132 1.00 10.00 N ATOM 137 CA ALA A 10 8.959 3.036 0.367 1.00 10.00 C ATOM 138 C ALA A 10 7.813 2.702 -0.594 1.00 10.00 C ATOM 139 O ALA A 10 6.712 2.417 -0.137 1.00 10.00 O ATOM 140 CB ALA A 10 9.079 4.543 0.600 1.00 10.00 C ATOM 0 H ALA A 10 10.890 3.257 -0.376 1.00 10.00 H new ATOM 0 HA ALA A 10 8.725 2.554 1.317 1.00 10.00 H new ATOM 0 HB1 ALA A 10 8.131 4.930 0.974 1.00 10.00 H new ATOM 0 HB2 ALA A 10 9.864 4.737 1.331 1.00 10.00 H new ATOM 0 HB3 ALA A 10 9.327 5.038 -0.339 1.00 10.00 H new ATOM 146 N LEU A 11 8.050 2.678 -1.908 1.00 10.00 N ATOM 147 CA LEU A 11 7.081 2.218 -2.898 1.00 10.00 C ATOM 148 C LEU A 11 6.786 0.740 -2.692 1.00 10.00 C ATOM 149 O LEU A 11 5.623 0.351 -2.667 1.00 10.00 O ATOM 150 CB LEU A 11 7.614 2.487 -4.317 1.00 10.00 C ATOM 151 CG LEU A 11 6.733 1.920 -5.447 1.00 10.00 C ATOM 152 CD1 LEU A 11 5.369 2.608 -5.472 1.00 10.00 C ATOM 153 CD2 LEU A 11 7.444 2.118 -6.788 1.00 10.00 C ATOM 0 H LEU A 11 8.934 2.982 -2.317 1.00 10.00 H new ATOM 0 HA LEU A 11 6.148 2.769 -2.774 1.00 10.00 H new ATOM 0 HB2 LEU A 11 7.714 3.563 -4.456 1.00 10.00 H new ATOM 0 HB3 LEU A 11 8.613 2.060 -4.403 1.00 10.00 H new ATOM 0 HG LEU A 11 6.572 0.857 -5.268 1.00 10.00 H new ATOM 0 HD11 LEU A 11 4.766 2.191 -6.278 1.00 10.00 H new ATOM 0 HD12 LEU A 11 4.863 2.448 -4.520 1.00 10.00 H new ATOM 0 HD13 LEU A 11 5.504 3.677 -5.636 1.00 10.00 H new ATOM 0 HD21 LEU A 11 6.824 1.718 -7.591 1.00 10.00 H new ATOM 0 HD22 LEU A 11 7.614 3.181 -6.956 1.00 10.00 H new ATOM 0 HD23 LEU A 11 8.400 1.595 -6.773 1.00 10.00 H new ATOM 165 N LYS A 12 7.814 -0.089 -2.511 1.00 10.00 N ATOM 166 CA LYS A 12 7.635 -1.513 -2.251 1.00 10.00 C ATOM 167 C LYS A 12 6.853 -1.723 -0.952 1.00 10.00 C ATOM 168 O LYS A 12 5.906 -2.511 -0.931 1.00 10.00 O ATOM 169 CB LYS A 12 9.024 -2.171 -2.262 1.00 10.00 C ATOM 170 CG LYS A 12 9.015 -3.690 -2.054 1.00 10.00 C ATOM 171 CD LYS A 12 10.413 -4.244 -2.368 1.00 10.00 C ATOM 172 CE LYS A 12 10.509 -5.742 -2.055 1.00 10.00 C ATOM 173 NZ LYS A 12 11.810 -6.314 -2.485 1.00 10.00 N ATOM 0 H LYS A 12 8.789 0.208 -2.541 1.00 10.00 H new ATOM 0 HA LYS A 12 7.034 -1.992 -3.024 1.00 10.00 H new ATOM 0 HB2 LYS A 12 9.508 -1.951 -3.214 1.00 10.00 H new ATOM 0 HB3 LYS A 12 9.633 -1.715 -1.482 1.00 10.00 H new ATOM 0 HG2 LYS A 12 8.737 -3.928 -1.027 1.00 10.00 H new ATOM 0 HG3 LYS A 12 8.271 -4.155 -2.701 1.00 10.00 H new ATOM 0 HD2 LYS A 12 10.644 -4.076 -3.420 1.00 10.00 H new ATOM 0 HD3 LYS A 12 11.159 -3.702 -1.787 1.00 10.00 H new ATOM 0 HE2 LYS A 12 10.380 -5.898 -0.984 1.00 10.00 H new ATOM 0 HE3 LYS A 12 9.697 -6.270 -2.555 1.00 10.00 H new ATOM 0 HZ1 LYS A 12 11.836 -7.328 -2.256 1.00 10.00 H new ATOM 0 HZ2 LYS A 12 11.923 -6.188 -3.511 1.00 10.00 H new ATOM 0 HZ3 LYS A 12 12.584 -5.827 -1.989 1.00 10.00 H new ATOM 187 N LYS A 13 7.181 -0.971 0.103 1.00 10.00 N ATOM 188 CA LYS A 13 6.430 -0.971 1.354 1.00 10.00 C ATOM 189 C LYS A 13 4.977 -0.575 1.086 1.00 10.00 C ATOM 190 O LYS A 13 4.075 -1.277 1.529 1.00 10.00 O ATOM 191 CB LYS A 13 7.111 -0.024 2.361 1.00 10.00 C ATOM 192 CG LYS A 13 6.582 -0.144 3.800 1.00 10.00 C ATOM 193 CD LYS A 13 7.234 -1.300 4.572 1.00 10.00 C ATOM 194 CE LYS A 13 6.715 -1.327 6.017 1.00 10.00 C ATOM 195 NZ LYS A 13 7.475 -2.276 6.870 1.00 10.00 N ATOM 0 H LYS A 13 7.983 -0.341 0.109 1.00 10.00 H new ATOM 0 HA LYS A 13 6.422 -1.971 1.788 1.00 10.00 H new ATOM 0 HB2 LYS A 13 8.183 -0.224 2.362 1.00 10.00 H new ATOM 0 HB3 LYS A 13 6.979 1.004 2.022 1.00 10.00 H new ATOM 0 HG2 LYS A 13 6.764 0.791 4.330 1.00 10.00 H new ATOM 0 HG3 LYS A 13 5.502 -0.291 3.776 1.00 10.00 H new ATOM 0 HD2 LYS A 13 7.013 -2.247 4.080 1.00 10.00 H new ATOM 0 HD3 LYS A 13 8.318 -1.185 4.569 1.00 10.00 H new ATOM 0 HE2 LYS A 13 6.781 -0.326 6.443 1.00 10.00 H new ATOM 0 HE3 LYS A 13 5.661 -1.605 6.017 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 7.089 -2.260 7.836 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 7.392 -3.236 6.480 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 8.477 -1.997 6.893 1.00 10.00 H new ATOM 209 N ALA A 14 4.732 0.509 0.344 1.00 10.00 N ATOM 210 CA ALA A 14 3.389 0.982 0.039 1.00 10.00 C ATOM 211 C ALA A 14 2.596 -0.058 -0.751 1.00 10.00 C ATOM 212 O ALA A 14 1.433 -0.279 -0.433 1.00 10.00 O ATOM 213 CB ALA A 14 3.439 2.308 -0.725 1.00 10.00 C ATOM 0 H ALA A 14 5.470 1.084 -0.063 1.00 10.00 H new ATOM 0 HA ALA A 14 2.877 1.146 0.987 1.00 10.00 H new ATOM 0 HB1 ALA A 14 2.424 2.642 -0.942 1.00 10.00 H new ATOM 0 HB2 ALA A 14 3.946 3.059 -0.118 1.00 10.00 H new ATOM 0 HB3 ALA A 14 3.983 2.169 -1.660 1.00 10.00 H new ATOM 219 N LYS A 15 3.196 -0.720 -1.744 1.00 10.00 N ATOM 220 CA LYS A 15 2.535 -1.775 -2.512 1.00 10.00 C ATOM 221 C LYS A 15 2.142 -2.930 -1.602 1.00 10.00 C ATOM 222 O LYS A 15 1.018 -3.425 -1.697 1.00 10.00 O ATOM 223 CB LYS A 15 3.445 -2.269 -3.648 1.00 10.00 C ATOM 224 CG LYS A 15 3.500 -1.285 -4.825 1.00 10.00 C ATOM 225 CD LYS A 15 4.467 -1.774 -5.911 1.00 10.00 C ATOM 226 CE LYS A 15 4.412 -0.842 -7.129 1.00 10.00 C ATOM 227 NZ LYS A 15 5.273 -1.320 -8.242 1.00 10.00 N ATOM 0 H LYS A 15 4.156 -0.538 -2.037 1.00 10.00 H new ATOM 0 HA LYS A 15 1.629 -1.361 -2.955 1.00 10.00 H new ATOM 0 HB2 LYS A 15 4.452 -2.425 -3.261 1.00 10.00 H new ATOM 0 HB3 LYS A 15 3.087 -3.235 -4.003 1.00 10.00 H new ATOM 0 HG2 LYS A 15 2.503 -1.165 -5.249 1.00 10.00 H new ATOM 0 HG3 LYS A 15 3.815 -0.304 -4.468 1.00 10.00 H new ATOM 0 HD2 LYS A 15 5.482 -1.808 -5.516 1.00 10.00 H new ATOM 0 HD3 LYS A 15 4.207 -2.790 -6.209 1.00 10.00 H new ATOM 0 HE2 LYS A 15 3.382 -0.763 -7.477 1.00 10.00 H new ATOM 0 HE3 LYS A 15 4.726 0.159 -6.833 1.00 10.00 H new ATOM 0 HZ1 LYS A 15 5.204 -0.660 -9.042 1.00 10.00 H new ATOM 0 HZ2 LYS A 15 6.260 -1.371 -7.920 1.00 10.00 H new ATOM 0 HZ3 LYS A 15 4.958 -2.264 -8.544 1.00 10.00 H new ATOM 241 N GLU A 16 3.040 -3.354 -0.713 1.00 10.00 N ATOM 242 CA GLU A 16 2.759 -4.439 0.214 1.00 10.00 C ATOM 243 C GLU A 16 1.636 -4.029 1.174 1.00 10.00 C ATOM 244 O GLU A 16 0.671 -4.776 1.342 1.00 10.00 O ATOM 245 CB GLU A 16 4.058 -4.837 0.931 1.00 10.00 C ATOM 246 CG GLU A 16 3.861 -6.055 1.841 1.00 10.00 C ATOM 247 CD GLU A 16 5.207 -6.648 2.294 1.00 10.00 C ATOM 248 OE1 GLU A 16 5.587 -7.738 1.809 1.00 10.00 O ATOM 249 OE2 GLU A 16 5.891 -6.045 3.152 1.00 10.00 O ATOM 0 H GLU A 16 3.974 -2.956 -0.619 1.00 10.00 H new ATOM 0 HA GLU A 16 2.401 -5.320 -0.318 1.00 10.00 H new ATOM 0 HB2 GLU A 16 4.828 -5.058 0.191 1.00 10.00 H new ATOM 0 HB3 GLU A 16 4.417 -3.996 1.524 1.00 10.00 H new ATOM 0 HG2 GLU A 16 3.278 -5.766 2.715 1.00 10.00 H new ATOM 0 HG3 GLU A 16 3.287 -6.816 1.312 1.00 10.00 H new ATOM 256 N LEU A 17 1.699 -2.819 1.740 1.00 10.00 N ATOM 257 CA LEU A 17 0.664 -2.274 2.619 1.00 10.00 C ATOM 258 C LEU A 17 -0.678 -2.238 1.890 1.00 10.00 C ATOM 259 O LEU A 17 -1.666 -2.740 2.419 1.00 10.00 O ATOM 260 CB LEU A 17 1.044 -0.860 3.102 1.00 10.00 C ATOM 261 CG LEU A 17 2.147 -0.823 4.177 1.00 10.00 C ATOM 262 CD1 LEU A 17 2.667 0.608 4.349 1.00 10.00 C ATOM 263 CD2 LEU A 17 1.646 -1.339 5.533 1.00 10.00 C ATOM 0 H LEU A 17 2.483 -2.183 1.597 1.00 10.00 H new ATOM 0 HA LEU A 17 0.578 -2.922 3.491 1.00 10.00 H new ATOM 0 HB2 LEU A 17 1.372 -0.273 2.244 1.00 10.00 H new ATOM 0 HB3 LEU A 17 0.152 -0.374 3.498 1.00 10.00 H new ATOM 0 HG LEU A 17 2.949 -1.478 3.837 1.00 10.00 H new ATOM 0 HD11 LEU A 17 3.446 0.623 5.111 1.00 10.00 H new ATOM 0 HD12 LEU A 17 3.078 0.962 3.403 1.00 10.00 H new ATOM 0 HD13 LEU A 17 1.848 1.259 4.655 1.00 10.00 H new ATOM 0 HD21 LEU A 17 2.456 -1.295 6.261 1.00 10.00 H new ATOM 0 HD22 LEU A 17 0.817 -0.719 5.875 1.00 10.00 H new ATOM 0 HD23 LEU A 17 1.308 -2.370 5.428 1.00 10.00 H new ATOM 275 N ALA A 18 -0.697 -1.719 0.659 1.00 10.00 N ATOM 276 CA ALA A 18 -1.869 -1.621 -0.205 1.00 10.00 C ATOM 277 C ALA A 18 -2.472 -2.990 -0.549 1.00 10.00 C ATOM 278 O ALA A 18 -3.621 -3.048 -0.987 1.00 10.00 O ATOM 279 CB ALA A 18 -1.497 -0.879 -1.493 1.00 10.00 C ATOM 0 H ALA A 18 0.143 -1.340 0.222 1.00 10.00 H new ATOM 0 HA ALA A 18 -2.630 -1.068 0.346 1.00 10.00 H new ATOM 0 HB1 ALA A 18 -2.373 -0.807 -2.137 1.00 10.00 H new ATOM 0 HB2 ALA A 18 -1.144 0.122 -1.247 1.00 10.00 H new ATOM 0 HB3 ALA A 18 -0.709 -1.424 -2.012 1.00 10.00 H new ATOM 285 N SER A 19 -1.725 -4.078 -0.347 1.00 10.00 N ATOM 286 CA SER A 19 -2.134 -5.442 -0.659 1.00 10.00 C ATOM 287 C SER A 19 -2.360 -6.273 0.616 1.00 10.00 C ATOM 288 O SER A 19 -2.763 -7.434 0.525 1.00 10.00 O ATOM 289 CB SER A 19 -1.064 -6.081 -1.558 1.00 10.00 C ATOM 290 OG SER A 19 -0.748 -5.250 -2.663 1.00 10.00 O ATOM 0 H SER A 19 -0.788 -4.028 0.052 1.00 10.00 H new ATOM 0 HA SER A 19 -3.088 -5.419 -1.185 1.00 10.00 H new ATOM 0 HB2 SER A 19 -0.163 -6.270 -0.974 1.00 10.00 H new ATOM 0 HB3 SER A 19 -1.419 -7.047 -1.918 1.00 10.00 H new ATOM 0 HG SER A 19 -0.227 -4.480 -2.354 1.00 10.00 H new ATOM 296 N SER A 20 -2.120 -5.702 1.803 1.00 10.00 N ATOM 297 CA SER A 20 -2.230 -6.407 3.077 1.00 10.00 C ATOM 298 C SER A 20 -3.690 -6.596 3.526 1.00 10.00 C ATOM 299 O SER A 20 -3.944 -7.379 4.444 1.00 10.00 O ATOM 300 CB SER A 20 -1.427 -5.641 4.135 1.00 10.00 C ATOM 301 OG SER A 20 -0.045 -5.621 3.817 1.00 10.00 O ATOM 0 H SER A 20 -1.841 -4.726 1.902 1.00 10.00 H new ATOM 0 HA SER A 20 -1.822 -7.410 2.950 1.00 10.00 H new ATOM 0 HB2 SER A 20 -1.800 -4.620 4.209 1.00 10.00 H new ATOM 0 HB3 SER A 20 -1.571 -6.105 5.111 1.00 10.00 H new ATOM 0 HG SER A 20 0.078 -5.254 2.917 1.00 10.00 H new ATOM 307 N ALA A 21 -4.651 -5.910 2.896 1.00 10.00 N ATOM 308 CA ALA A 21 -6.084 -6.034 3.153 1.00 10.00 C ATOM 309 C ALA A 21 -6.843 -5.707 1.858 1.00 10.00 C ATOM 310 O ALA A 21 -6.271 -5.056 0.979 1.00 10.00 O ATOM 311 CB ALA A 21 -6.474 -5.056 4.271 1.00 10.00 C ATOM 0 H ALA A 21 -4.440 -5.229 2.167 1.00 10.00 H new ATOM 0 HA ALA A 21 -6.336 -7.047 3.468 1.00 10.00 H new ATOM 0 HB1 ALA A 21 -7.542 -5.140 4.471 1.00 10.00 H new ATOM 0 HB2 ALA A 21 -5.915 -5.296 5.176 1.00 10.00 H new ATOM 0 HB3 ALA A 21 -6.242 -4.037 3.961 1.00 10.00 H new ATOM 317 N PRO A 22 -8.124 -6.103 1.728 1.00 10.00 N ATOM 318 CA PRO A 22 -8.918 -5.818 0.535 1.00 10.00 C ATOM 319 C PRO A 22 -9.254 -4.330 0.371 1.00 10.00 C ATOM 320 O PRO A 22 -9.665 -3.935 -0.720 1.00 10.00 O ATOM 321 CB PRO A 22 -10.181 -6.676 0.667 1.00 10.00 C ATOM 322 CG PRO A 22 -10.339 -6.840 2.177 1.00 10.00 C ATOM 323 CD PRO A 22 -8.890 -6.935 2.649 1.00 10.00 C ATOM 0 HA PRO A 22 -8.353 -6.061 -0.365 1.00 10.00 H new ATOM 0 HB2 PRO A 22 -11.048 -6.187 0.223 1.00 10.00 H new ATOM 0 HB3 PRO A 22 -10.067 -7.638 0.168 1.00 10.00 H new ATOM 0 HG2 PRO A 22 -10.858 -5.993 2.626 1.00 10.00 H new ATOM 0 HG3 PRO A 22 -10.909 -7.734 2.431 1.00 10.00 H new ATOM 0 HD2 PRO A 22 -8.788 -6.581 3.675 1.00 10.00 H new ATOM 0 HD3 PRO A 22 -8.538 -7.967 2.631 1.00 10.00 H new ATOM 331 N VAL A 23 -9.074 -3.500 1.403 1.00 10.00 N ATOM 332 CA VAL A 23 -9.230 -2.050 1.349 1.00 10.00 C ATOM 333 C VAL A 23 -8.136 -1.479 2.243 1.00 10.00 C ATOM 334 O VAL A 23 -7.904 -2.015 3.331 1.00 10.00 O ATOM 335 CB VAL A 23 -10.623 -1.622 1.857 1.00 10.00 C ATOM 336 CG1 VAL A 23 -10.818 -0.098 1.794 1.00 10.00 C ATOM 337 CG2 VAL A 23 -11.768 -2.312 1.113 1.00 10.00 C ATOM 0 H VAL A 23 -8.807 -3.834 2.329 1.00 10.00 H new ATOM 0 HA VAL A 23 -9.146 -1.683 0.326 1.00 10.00 H new ATOM 0 HB VAL A 23 -10.656 -1.942 2.899 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -11.812 0.157 2.161 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -10.066 0.391 2.413 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -10.714 0.240 0.763 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -12.722 -1.970 1.515 1.00 10.00 H new ATOM 0 HG22 VAL A 23 -11.713 -2.067 0.052 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -11.687 -3.391 1.241 1.00 10.00 H new ATOM 347 N VAL A 24 -7.478 -0.403 1.816 1.00 10.00 N ATOM 348 CA VAL A 24 -6.387 0.218 2.558 1.00 10.00 C ATOM 349 C VAL A 24 -6.543 1.735 2.433 1.00 10.00 C ATOM 350 O VAL A 24 -6.863 2.241 1.354 1.00 10.00 O ATOM 351 CB VAL A 24 -5.018 -0.292 2.046 1.00 10.00 C ATOM 352 CG1 VAL A 24 -3.870 0.201 2.944 1.00 10.00 C ATOM 353 CG2 VAL A 24 -4.960 -1.829 1.987 1.00 10.00 C ATOM 0 H VAL A 24 -7.691 0.066 0.936 1.00 10.00 H new ATOM 0 HA VAL A 24 -6.426 -0.052 3.613 1.00 10.00 H new ATOM 0 HB VAL A 24 -4.902 0.109 1.039 1.00 10.00 H new ATOM 0 HG11 VAL A 24 -2.921 -0.173 2.560 1.00 10.00 H new ATOM 0 HG12 VAL A 24 -3.855 1.291 2.950 1.00 10.00 H new ATOM 0 HG13 VAL A 24 -4.020 -0.165 3.960 1.00 10.00 H new ATOM 0 HG21 VAL A 24 -3.982 -2.142 1.622 1.00 10.00 H new ATOM 0 HG22 VAL A 24 -5.124 -2.238 2.984 1.00 10.00 H new ATOM 0 HG23 VAL A 24 -5.733 -2.197 1.313 1.00 10.00 H new ATOM 363 N VAL A 25 -6.322 2.449 3.538 1.00 10.00 N ATOM 364 CA VAL A 25 -6.547 3.882 3.661 1.00 10.00 C ATOM 365 C VAL A 25 -5.248 4.518 4.163 1.00 10.00 C ATOM 366 O VAL A 25 -4.994 4.575 5.372 1.00 10.00 O ATOM 367 CB VAL A 25 -7.754 4.152 4.592 1.00 10.00 C ATOM 368 CG1 VAL A 25 -8.079 5.653 4.644 1.00 10.00 C ATOM 369 CG2 VAL A 25 -9.018 3.394 4.155 1.00 10.00 C ATOM 0 H VAL A 25 -5.970 2.028 4.398 1.00 10.00 H new ATOM 0 HA VAL A 25 -6.801 4.331 2.701 1.00 10.00 H new ATOM 0 HB VAL A 25 -7.460 3.794 5.579 1.00 10.00 H new ATOM 0 HG11 VAL A 25 -8.930 5.818 5.304 1.00 10.00 H new ATOM 0 HG12 VAL A 25 -7.215 6.199 5.022 1.00 10.00 H new ATOM 0 HG13 VAL A 25 -8.322 6.007 3.642 1.00 10.00 H new ATOM 0 HG21 VAL A 25 -9.833 3.619 4.842 1.00 10.00 H new ATOM 0 HG22 VAL A 25 -9.297 3.702 3.147 1.00 10.00 H new ATOM 0 HG23 VAL A 25 -8.821 2.322 4.165 1.00 10.00 H new ATOM 379 N PHE A 26 -4.395 4.961 3.238 1.00 10.00 N ATOM 380 CA PHE A 26 -3.244 5.781 3.596 1.00 10.00 C ATOM 381 C PHE A 26 -3.839 7.103 4.075 1.00 10.00 C ATOM 382 O PHE A 26 -4.658 7.699 3.372 1.00 10.00 O ATOM 383 CB PHE A 26 -2.300 5.932 2.398 1.00 10.00 C ATOM 384 CG PHE A 26 -1.701 4.612 1.941 1.00 10.00 C ATOM 385 CD1 PHE A 26 -0.574 4.077 2.596 1.00 10.00 C ATOM 386 CD2 PHE A 26 -2.299 3.892 0.888 1.00 10.00 C ATOM 387 CE1 PHE A 26 -0.052 2.829 2.206 1.00 10.00 C ATOM 388 CE2 PHE A 26 -1.775 2.648 0.497 1.00 10.00 C ATOM 389 CZ PHE A 26 -0.653 2.116 1.156 1.00 10.00 C ATOM 0 H PHE A 26 -4.481 4.765 2.241 1.00 10.00 H new ATOM 0 HA PHE A 26 -2.626 5.340 4.378 1.00 10.00 H new ATOM 0 HB2 PHE A 26 -2.844 6.384 1.569 1.00 10.00 H new ATOM 0 HB3 PHE A 26 -1.495 6.618 2.662 1.00 10.00 H new ATOM 0 HD1 PHE A 26 -0.109 4.627 3.401 1.00 10.00 H new ATOM 0 HD2 PHE A 26 -3.162 4.297 0.380 1.00 10.00 H new ATOM 0 HE1 PHE A 26 0.809 2.421 2.714 1.00 10.00 H new ATOM 0 HE2 PHE A 26 -2.235 2.100 -0.312 1.00 10.00 H new ATOM 0 HZ PHE A 26 -0.253 1.159 0.855 1.00 10.00 H new ATOM 399 N SER A 27 -3.478 7.541 5.276 1.00 10.00 N ATOM 400 CA SER A 27 -4.138 8.642 5.968 1.00 10.00 C ATOM 401 C SER A 27 -3.178 9.321 6.949 1.00 10.00 C ATOM 402 O SER A 27 -1.986 9.012 6.968 1.00 10.00 O ATOM 403 CB SER A 27 -5.366 8.044 6.684 1.00 10.00 C ATOM 404 OG SER A 27 -5.083 6.794 7.288 1.00 10.00 O ATOM 0 H SER A 27 -2.706 7.135 5.805 1.00 10.00 H new ATOM 0 HA SER A 27 -4.452 9.417 5.269 1.00 10.00 H new ATOM 0 HB2 SER A 27 -5.715 8.742 7.445 1.00 10.00 H new ATOM 0 HB3 SER A 27 -6.178 7.923 5.967 1.00 10.00 H new ATOM 0 HG SER A 27 -5.068 6.095 6.601 1.00 10.00 H new ATOM 410 N LYS A 28 -3.681 10.235 7.785 1.00 10.00 N ATOM 411 CA LYS A 28 -2.952 10.811 8.914 1.00 10.00 C ATOM 412 C LYS A 28 -3.865 10.799 10.141 1.00 10.00 C ATOM 413 O LYS A 28 -5.056 10.497 10.046 1.00 10.00 O ATOM 414 CB LYS A 28 -2.405 12.212 8.574 1.00 10.00 C ATOM 415 CG LYS A 28 -1.198 12.115 7.631 1.00 10.00 C ATOM 416 CD LYS A 28 -0.547 13.474 7.350 1.00 10.00 C ATOM 417 CE LYS A 28 0.606 13.255 6.360 1.00 10.00 C ATOM 418 NZ LYS A 28 1.345 14.499 6.039 1.00 10.00 N ATOM 0 H LYS A 28 -4.628 10.602 7.691 1.00 10.00 H new ATOM 0 HA LYS A 28 -2.072 10.209 9.140 1.00 10.00 H new ATOM 0 HB2 LYS A 28 -3.189 12.809 8.108 1.00 10.00 H new ATOM 0 HB3 LYS A 28 -2.115 12.726 9.491 1.00 10.00 H new ATOM 0 HG2 LYS A 28 -0.456 11.446 8.067 1.00 10.00 H new ATOM 0 HG3 LYS A 28 -1.515 11.668 6.689 1.00 10.00 H new ATOM 0 HD2 LYS A 28 -1.278 14.168 6.935 1.00 10.00 H new ATOM 0 HD3 LYS A 28 -0.176 13.917 8.274 1.00 10.00 H new ATOM 0 HE2 LYS A 28 1.300 12.525 6.777 1.00 10.00 H new ATOM 0 HE3 LYS A 28 0.209 12.828 5.439 1.00 10.00 H new ATOM 0 HZ1 LYS A 28 1.957 14.336 5.214 1.00 10.00 H new ATOM 0 HZ2 LYS A 28 0.668 15.259 5.824 1.00 10.00 H new ATOM 0 HZ3 LYS A 28 1.929 14.776 6.854 1.00 10.00 H new ATOM 432 N THR A 29 -3.281 11.094 11.295 1.00 10.00 N ATOM 433 CA THR A 29 -3.862 10.940 12.620 1.00 10.00 C ATOM 434 C THR A 29 -5.053 11.852 12.939 1.00 10.00 C ATOM 435 O THR A 29 -5.821 11.512 13.844 1.00 10.00 O ATOM 436 CB THR A 29 -2.729 11.200 13.635 1.00 10.00 C ATOM 437 OG1 THR A 29 -1.913 12.272 13.190 1.00 10.00 O ATOM 438 CG2 THR A 29 -1.814 9.987 13.799 1.00 10.00 C ATOM 0 H THR A 29 -2.333 11.469 11.332 1.00 10.00 H new ATOM 0 HA THR A 29 -4.276 9.933 12.672 1.00 10.00 H new ATOM 0 HB THR A 29 -3.212 11.427 14.585 1.00 10.00 H new ATOM 0 HG1 THR A 29 -1.198 12.431 13.841 1.00 10.00 H new ATOM 0 HG21 THR A 29 -1.032 10.216 14.523 1.00 10.00 H new ATOM 0 HG22 THR A 29 -2.397 9.137 14.152 1.00 10.00 H new ATOM 0 HG23 THR A 29 -1.360 9.742 12.839 1.00 10.00 H new ATOM 446 N TYR A 30 -5.244 12.974 12.231 1.00 10.00 N ATOM 447 CA TYR A 30 -6.207 13.999 12.646 1.00 10.00 C ATOM 448 C TYR A 30 -7.180 14.471 11.560 1.00 10.00 C ATOM 449 O TYR A 30 -8.227 15.019 11.915 1.00 10.00 O ATOM 450 CB TYR A 30 -5.415 15.193 13.210 1.00 10.00 C ATOM 451 CG TYR A 30 -4.481 15.854 12.206 1.00 10.00 C ATOM 452 CD1 TYR A 30 -3.150 15.410 12.073 1.00 10.00 C ATOM 453 CD2 TYR A 30 -4.960 16.880 11.368 1.00 10.00 C ATOM 454 CE1 TYR A 30 -2.305 15.979 11.105 1.00 10.00 C ATOM 455 CE2 TYR A 30 -4.126 17.443 10.386 1.00 10.00 C ATOM 456 CZ TYR A 30 -2.790 16.995 10.250 1.00 10.00 C ATOM 457 OH TYR A 30 -1.962 17.533 9.310 1.00 10.00 O ATOM 0 H TYR A 30 -4.744 13.193 11.369 1.00 10.00 H new ATOM 0 HA TYR A 30 -6.850 13.538 13.396 1.00 10.00 H new ATOM 0 HB2 TYR A 30 -6.119 15.939 13.580 1.00 10.00 H new ATOM 0 HB3 TYR A 30 -4.830 14.855 14.065 1.00 10.00 H new ATOM 0 HD1 TYR A 30 -2.777 14.628 12.718 1.00 10.00 H new ATOM 0 HD2 TYR A 30 -5.973 17.236 11.480 1.00 10.00 H new ATOM 0 HE1 TYR A 30 -1.284 15.640 11.014 1.00 10.00 H new ATOM 0 HE2 TYR A 30 -4.505 18.217 9.735 1.00 10.00 H new ATOM 0 HH TYR A 30 -2.445 18.218 8.802 1.00 10.00 H new ATOM 467 N CYS A 31 -6.867 14.299 10.272 1.00 10.00 N ATOM 468 CA CYS A 31 -7.629 14.904 9.190 1.00 10.00 C ATOM 469 C CYS A 31 -9.096 14.446 9.190 1.00 10.00 C ATOM 470 O CYS A 31 -9.396 13.245 9.173 1.00 10.00 O ATOM 471 CB CYS A 31 -6.941 14.588 7.857 1.00 10.00 C ATOM 472 SG CYS A 31 -5.161 14.962 7.919 1.00 10.00 S ATOM 0 H CYS A 31 -6.077 13.736 9.957 1.00 10.00 H new ATOM 0 HA CYS A 31 -7.650 15.984 9.338 1.00 10.00 H new ATOM 0 HB2 CYS A 31 -7.084 13.535 7.613 1.00 10.00 H new ATOM 0 HB3 CYS A 31 -7.408 15.166 7.060 1.00 10.00 H new ATOM 0 HG CYS A 31 -4.937 15.857 8.835 1.00 10.00 H new ATOM 477 N GLY A 32 -10.005 15.423 9.127 1.00 10.00 N ATOM 478 CA GLY A 32 -11.440 15.188 9.043 1.00 10.00 C ATOM 479 C GLY A 32 -11.800 14.340 7.827 1.00 10.00 C ATOM 480 O GLY A 32 -12.682 13.490 7.918 1.00 10.00 O ATOM 0 H GLY A 32 -9.756 16.412 9.133 1.00 10.00 H new ATOM 0 HA2 GLY A 32 -11.781 14.688 9.950 1.00 10.00 H new ATOM 0 HA3 GLY A 32 -11.963 16.143 8.989 1.00 10.00 H new ATOM 484 N TYR A 33 -11.084 14.503 6.709 1.00 10.00 N ATOM 485 CA TYR A 33 -11.276 13.685 5.516 1.00 10.00 C ATOM 486 C TYR A 33 -10.899 12.220 5.761 1.00 10.00 C ATOM 487 O TYR A 33 -11.592 11.324 5.276 1.00 10.00 O ATOM 488 CB TYR A 33 -10.469 14.269 4.351 1.00 10.00 C ATOM 489 CG TYR A 33 -10.953 15.631 3.888 1.00 10.00 C ATOM 490 CD1 TYR A 33 -10.213 16.791 4.191 1.00 10.00 C ATOM 491 CD2 TYR A 33 -12.150 15.739 3.152 1.00 10.00 C ATOM 492 CE1 TYR A 33 -10.665 18.052 3.762 1.00 10.00 C ATOM 493 CE2 TYR A 33 -12.603 16.996 2.711 1.00 10.00 C ATOM 494 CZ TYR A 33 -11.861 18.161 3.018 1.00 10.00 C ATOM 495 OH TYR A 33 -12.284 19.388 2.601 1.00 10.00 O ATOM 0 H TYR A 33 -10.354 15.209 6.610 1.00 10.00 H new ATOM 0 HA TYR A 33 -12.336 13.702 5.261 1.00 10.00 H new ATOM 0 HB2 TYR A 33 -9.424 14.348 4.650 1.00 10.00 H new ATOM 0 HB3 TYR A 33 -10.509 13.576 3.511 1.00 10.00 H new ATOM 0 HD1 TYR A 33 -9.295 16.712 4.755 1.00 10.00 H new ATOM 0 HD2 TYR A 33 -12.723 14.852 2.925 1.00 10.00 H new ATOM 0 HE1 TYR A 33 -10.097 18.939 4.002 1.00 10.00 H new ATOM 0 HE2 TYR A 33 -13.516 17.072 2.139 1.00 10.00 H new ATOM 0 HH TYR A 33 -13.121 19.293 2.101 1.00 10.00 H new ATOM 505 N CYS A 34 -9.832 11.954 6.525 1.00 10.00 N ATOM 506 CA CYS A 34 -9.450 10.588 6.875 1.00 10.00 C ATOM 507 C CYS A 34 -10.528 9.971 7.767 1.00 10.00 C ATOM 508 O CYS A 34 -10.965 8.849 7.502 1.00 10.00 O ATOM 509 CB CYS A 34 -8.072 10.562 7.554 1.00 10.00 C ATOM 510 SG CYS A 34 -6.782 11.079 6.378 1.00 10.00 S ATOM 0 H CYS A 34 -9.219 12.672 6.912 1.00 10.00 H new ATOM 0 HA CYS A 34 -9.370 9.992 5.966 1.00 10.00 H new ATOM 0 HB2 CYS A 34 -8.072 11.225 8.419 1.00 10.00 H new ATOM 0 HB3 CYS A 34 -7.858 9.558 7.921 1.00 10.00 H new ATOM 0 HG CYS A 34 -7.076 12.251 5.899 1.00 10.00 H new ATOM 516 N ASN A 35 -11.015 10.723 8.765 1.00 10.00 N ATOM 517 CA ASN A 35 -12.174 10.294 9.550 1.00 10.00 C ATOM 518 C ASN A 35 -13.366 10.000 8.635 1.00 10.00 C ATOM 519 O ASN A 35 -13.965 8.940 8.761 1.00 10.00 O ATOM 520 CB ASN A 35 -12.539 11.323 10.631 1.00 10.00 C ATOM 521 CG ASN A 35 -13.899 11.016 11.263 1.00 10.00 C ATOM 522 OD1 ASN A 35 -14.078 10.017 11.955 1.00 10.00 O ATOM 523 ND2 ASN A 35 -14.890 11.862 11.033 1.00 10.00 N ATOM 0 H ASN A 35 -10.626 11.624 9.044 1.00 10.00 H new ATOM 0 HA ASN A 35 -11.905 9.372 10.065 1.00 10.00 H new ATOM 0 HB2 ASN A 35 -11.770 11.328 11.404 1.00 10.00 H new ATOM 0 HB3 ASN A 35 -12.557 12.321 10.193 1.00 10.00 H new ATOM 0 HD21 ASN A 35 -15.812 11.687 11.432 1.00 10.00 H new ATOM 0 HD22 ASN A 35 -14.731 12.689 10.457 1.00 10.00 H new ATOM 530 N ARG A 36 -13.684 10.872 7.673 1.00 10.00 N ATOM 531 CA ARG A 36 -14.790 10.657 6.736 1.00 10.00 C ATOM 532 C ARG A 36 -14.656 9.321 6.019 1.00 10.00 C ATOM 533 O ARG A 36 -15.625 8.568 5.997 1.00 10.00 O ATOM 534 CB ARG A 36 -14.886 11.812 5.720 1.00 10.00 C ATOM 535 CG ARG A 36 -16.151 12.654 5.920 1.00 10.00 C ATOM 536 CD ARG A 36 -16.177 13.810 4.912 1.00 10.00 C ATOM 537 NE ARG A 36 -17.092 14.881 5.345 1.00 10.00 N ATOM 538 CZ ARG A 36 -16.890 16.198 5.191 1.00 10.00 C ATOM 539 NH1 ARG A 36 -15.854 16.652 4.488 1.00 10.00 N ATOM 540 NH2 ARG A 36 -17.730 17.062 5.750 1.00 10.00 N ATOM 0 H ARG A 36 -13.182 11.747 7.522 1.00 10.00 H new ATOM 0 HA ARG A 36 -15.713 10.635 7.316 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -14.008 12.451 5.814 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -14.878 11.406 4.709 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -17.036 12.031 5.794 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -16.180 13.046 6.937 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -15.172 14.214 4.794 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -16.487 13.437 3.936 1.00 10.00 H new ATOM 0 HE ARG A 36 -17.957 14.595 5.803 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -15.202 15.995 4.059 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -15.712 17.656 4.379 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -18.524 16.723 6.293 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -17.581 18.065 5.636 1.00 10.00 H new ATOM 554 N VAL A 37 -13.486 8.999 5.463 1.00 10.00 N ATOM 555 CA VAL A 37 -13.297 7.725 4.768 1.00 10.00 C ATOM 556 C VAL A 37 -13.503 6.555 5.730 1.00 10.00 C ATOM 557 O VAL A 37 -14.243 5.626 5.398 1.00 10.00 O ATOM 558 CB VAL A 37 -11.921 7.690 4.078 1.00 10.00 C ATOM 559 CG1 VAL A 37 -11.578 6.306 3.512 1.00 10.00 C ATOM 560 CG2 VAL A 37 -11.928 8.692 2.918 1.00 10.00 C ATOM 0 H VAL A 37 -12.661 9.598 5.480 1.00 10.00 H new ATOM 0 HA VAL A 37 -14.049 7.627 3.985 1.00 10.00 H new ATOM 0 HB VAL A 37 -11.172 7.940 4.830 1.00 10.00 H new ATOM 0 HG11 VAL A 37 -10.597 6.340 3.037 1.00 10.00 H new ATOM 0 HG12 VAL A 37 -11.564 5.575 4.321 1.00 10.00 H new ATOM 0 HG13 VAL A 37 -12.328 6.018 2.775 1.00 10.00 H new ATOM 0 HG21 VAL A 37 -10.959 8.678 2.419 1.00 10.00 H new ATOM 0 HG22 VAL A 37 -12.706 8.419 2.206 1.00 10.00 H new ATOM 0 HG23 VAL A 37 -12.124 9.693 3.303 1.00 10.00 H new ATOM 570 N LYS A 38 -12.902 6.602 6.924 1.00 10.00 N ATOM 571 CA LYS A 38 -13.106 5.558 7.930 1.00 10.00 C ATOM 572 C LYS A 38 -14.596 5.369 8.211 1.00 10.00 C ATOM 573 O LYS A 38 -15.088 4.243 8.162 1.00 10.00 O ATOM 574 CB LYS A 38 -12.371 5.906 9.231 1.00 10.00 C ATOM 575 CG LYS A 38 -10.839 5.863 9.122 1.00 10.00 C ATOM 576 CD LYS A 38 -10.251 6.440 10.417 1.00 10.00 C ATOM 577 CE LYS A 38 -8.741 6.211 10.519 1.00 10.00 C ATOM 578 NZ LYS A 38 -8.200 6.760 11.786 1.00 10.00 N ATOM 0 H LYS A 38 -12.273 7.350 7.215 1.00 10.00 H new ATOM 0 HA LYS A 38 -12.699 4.627 7.537 1.00 10.00 H new ATOM 0 HB2 LYS A 38 -12.673 6.904 9.550 1.00 10.00 H new ATOM 0 HB3 LYS A 38 -12.688 5.213 10.010 1.00 10.00 H new ATOM 0 HG2 LYS A 38 -10.497 4.839 8.972 1.00 10.00 H new ATOM 0 HG3 LYS A 38 -10.503 6.441 8.261 1.00 10.00 H new ATOM 0 HD2 LYS A 38 -10.459 7.509 10.463 1.00 10.00 H new ATOM 0 HD3 LYS A 38 -10.745 5.982 11.274 1.00 10.00 H new ATOM 0 HE2 LYS A 38 -8.528 5.144 10.462 1.00 10.00 H new ATOM 0 HE3 LYS A 38 -8.241 6.682 9.673 1.00 10.00 H new ATOM 0 HZ1 LYS A 38 -7.192 6.517 11.867 1.00 10.00 H new ATOM 0 HZ2 LYS A 38 -8.308 7.794 11.790 1.00 10.00 H new ATOM 0 HZ3 LYS A 38 -8.720 6.354 12.590 1.00 10.00 H new ATOM 592 N GLN A 39 -15.330 6.452 8.474 1.00 10.00 N ATOM 593 CA GLN A 39 -16.754 6.402 8.793 1.00 10.00 C ATOM 594 C GLN A 39 -17.543 5.839 7.607 1.00 10.00 C ATOM 595 O GLN A 39 -18.458 5.042 7.806 1.00 10.00 O ATOM 596 CB GLN A 39 -17.269 7.808 9.153 1.00 10.00 C ATOM 597 CG GLN A 39 -16.609 8.448 10.390 1.00 10.00 C ATOM 598 CD GLN A 39 -17.157 8.032 11.754 1.00 10.00 C ATOM 599 OE1 GLN A 39 -18.169 7.346 11.886 1.00 10.00 O ATOM 600 NE2 GLN A 39 -16.480 8.457 12.809 1.00 10.00 N ATOM 0 H GLN A 39 -14.946 7.397 8.471 1.00 10.00 H new ATOM 0 HA GLN A 39 -16.896 5.746 9.652 1.00 10.00 H new ATOM 0 HB2 GLN A 39 -17.115 8.465 8.297 1.00 10.00 H new ATOM 0 HB3 GLN A 39 -18.344 7.752 9.322 1.00 10.00 H new ATOM 0 HG2 GLN A 39 -15.544 8.215 10.366 1.00 10.00 H new ATOM 0 HG3 GLN A 39 -16.701 9.531 10.302 1.00 10.00 H new ATOM 0 HE21 GLN A 39 -15.642 9.025 12.682 1.00 10.00 H new ATOM 0 HE22 GLN A 39 -16.796 8.216 13.749 1.00 10.00 H new ATOM 609 N LEU A 40 -17.214 6.237 6.375 1.00 10.00 N ATOM 610 CA LEU A 40 -17.894 5.794 5.158 1.00 10.00 C ATOM 611 C LEU A 40 -17.771 4.274 5.024 1.00 10.00 C ATOM 612 O LEU A 40 -18.775 3.580 4.870 1.00 10.00 O ATOM 613 CB LEU A 40 -17.269 6.517 3.947 1.00 10.00 C ATOM 614 CG LEU A 40 -18.065 6.412 2.631 1.00 10.00 C ATOM 615 CD1 LEU A 40 -19.332 7.273 2.675 1.00 10.00 C ATOM 616 CD2 LEU A 40 -17.179 6.877 1.475 1.00 10.00 C ATOM 0 H LEU A 40 -16.451 6.890 6.194 1.00 10.00 H new ATOM 0 HA LEU A 40 -18.955 6.041 5.203 1.00 10.00 H new ATOM 0 HB2 LEU A 40 -17.150 7.571 4.197 1.00 10.00 H new ATOM 0 HB3 LEU A 40 -16.270 6.114 3.781 1.00 10.00 H new ATOM 0 HG LEU A 40 -18.364 5.373 2.491 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -19.870 7.177 1.732 1.00 10.00 H new ATOM 0 HD12 LEU A 40 -19.970 6.939 3.493 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -19.058 8.316 2.831 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -17.734 6.806 0.540 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -16.878 7.911 1.641 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -16.292 6.245 1.419 1.00 10.00 H new ATOM 628 N LEU A 41 -16.544 3.757 5.146 1.00 10.00 N ATOM 629 CA LEU A 41 -16.243 2.333 5.027 1.00 10.00 C ATOM 630 C LEU A 41 -16.866 1.538 6.175 1.00 10.00 C ATOM 631 O LEU A 41 -17.398 0.448 5.956 1.00 10.00 O ATOM 632 CB LEU A 41 -14.720 2.129 5.004 1.00 10.00 C ATOM 633 CG LEU A 41 -14.044 2.618 3.708 1.00 10.00 C ATOM 634 CD1 LEU A 41 -12.526 2.591 3.893 1.00 10.00 C ATOM 635 CD2 LEU A 41 -14.434 1.758 2.496 1.00 10.00 C ATOM 0 H LEU A 41 -15.721 4.329 5.333 1.00 10.00 H new ATOM 0 HA LEU A 41 -16.673 1.965 4.095 1.00 10.00 H new ATOM 0 HB2 LEU A 41 -14.280 2.654 5.852 1.00 10.00 H new ATOM 0 HB3 LEU A 41 -14.503 1.069 5.138 1.00 10.00 H new ATOM 0 HG LEU A 41 -14.385 3.634 3.511 1.00 10.00 H new ATOM 0 HD11 LEU A 41 -12.042 2.936 2.979 1.00 10.00 H new ATOM 0 HD12 LEU A 41 -12.249 3.245 4.720 1.00 10.00 H new ATOM 0 HD13 LEU A 41 -12.204 1.573 4.112 1.00 10.00 H new ATOM 0 HD21 LEU A 41 -13.935 2.138 1.605 1.00 10.00 H new ATOM 0 HD22 LEU A 41 -14.130 0.726 2.670 1.00 10.00 H new ATOM 0 HD23 LEU A 41 -15.514 1.799 2.353 1.00 10.00 H new ATOM 647 N THR A 42 -16.841 2.087 7.389 1.00 10.00 N ATOM 648 CA THR A 42 -17.448 1.463 8.556 1.00 10.00 C ATOM 649 C THR A 42 -18.958 1.311 8.344 1.00 10.00 C ATOM 650 O THR A 42 -19.506 0.243 8.616 1.00 10.00 O ATOM 651 CB THR A 42 -17.121 2.299 9.807 1.00 10.00 C ATOM 652 OG1 THR A 42 -15.719 2.402 9.955 1.00 10.00 O ATOM 653 CG2 THR A 42 -17.686 1.702 11.097 1.00 10.00 C ATOM 0 H THR A 42 -16.395 2.983 7.588 1.00 10.00 H new ATOM 0 HA THR A 42 -17.040 0.463 8.702 1.00 10.00 H new ATOM 0 HB THR A 42 -17.585 3.273 9.653 1.00 10.00 H new ATOM 0 HG1 THR A 42 -15.413 3.255 9.583 1.00 10.00 H new ATOM 0 HG21 THR A 42 -17.420 2.340 11.940 1.00 10.00 H new ATOM 0 HG22 THR A 42 -18.771 1.634 11.022 1.00 10.00 H new ATOM 0 HG23 THR A 42 -17.270 0.706 11.250 1.00 10.00 H new ATOM 661 N GLN A 43 -19.633 2.344 7.826 1.00 10.00 N ATOM 662 CA GLN A 43 -21.089 2.334 7.702 1.00 10.00 C ATOM 663 C GLN A 43 -21.555 1.278 6.697 1.00 10.00 C ATOM 664 O GLN A 43 -22.575 0.629 6.933 1.00 10.00 O ATOM 665 CB GLN A 43 -21.603 3.724 7.298 1.00 10.00 C ATOM 666 CG GLN A 43 -21.639 4.685 8.495 1.00 10.00 C ATOM 667 CD GLN A 43 -21.857 6.127 8.040 1.00 10.00 C ATOM 668 OE1 GLN A 43 -22.959 6.668 8.106 1.00 10.00 O ATOM 669 NE2 GLN A 43 -20.808 6.770 7.556 1.00 10.00 N ATOM 0 H GLN A 43 -19.190 3.198 7.486 1.00 10.00 H new ATOM 0 HA GLN A 43 -21.506 2.075 8.675 1.00 10.00 H new ATOM 0 HB2 GLN A 43 -20.962 4.137 6.519 1.00 10.00 H new ATOM 0 HB3 GLN A 43 -22.603 3.633 6.874 1.00 10.00 H new ATOM 0 HG2 GLN A 43 -22.437 4.391 9.176 1.00 10.00 H new ATOM 0 HG3 GLN A 43 -20.704 4.614 9.050 1.00 10.00 H new ATOM 0 HE21 GLN A 43 -19.902 6.305 7.509 1.00 10.00 H new ATOM 0 HE22 GLN A 43 -20.905 7.731 7.230 1.00 10.00 H new ATOM 678 N VAL A 44 -20.813 1.070 5.603 1.00 10.00 N ATOM 679 CA VAL A 44 -21.152 0.036 4.623 1.00 10.00 C ATOM 680 C VAL A 44 -20.734 -1.369 5.096 1.00 10.00 C ATOM 681 O VAL A 44 -21.102 -2.358 4.461 1.00 10.00 O ATOM 682 CB VAL A 44 -20.607 0.395 3.223 1.00 10.00 C ATOM 683 CG1 VAL A 44 -21.186 1.737 2.749 1.00 10.00 C ATOM 684 CG2 VAL A 44 -19.079 0.468 3.152 1.00 10.00 C ATOM 0 H VAL A 44 -19.975 1.605 5.376 1.00 10.00 H new ATOM 0 HA VAL A 44 -22.238 0.003 4.534 1.00 10.00 H new ATOM 0 HB VAL A 44 -20.924 -0.419 2.571 1.00 10.00 H new ATOM 0 HG11 VAL A 44 -20.792 1.975 1.761 1.00 10.00 H new ATOM 0 HG12 VAL A 44 -22.273 1.667 2.699 1.00 10.00 H new ATOM 0 HG13 VAL A 44 -20.905 2.523 3.450 1.00 10.00 H new ATOM 0 HG21 VAL A 44 -18.774 0.725 2.138 1.00 10.00 H new ATOM 0 HG22 VAL A 44 -18.719 1.230 3.843 1.00 10.00 H new ATOM 0 HG23 VAL A 44 -18.656 -0.499 3.425 1.00 10.00 H new ATOM 694 N GLY A 45 -19.999 -1.479 6.209 1.00 10.00 N ATOM 695 CA GLY A 45 -19.556 -2.751 6.765 1.00 10.00 C ATOM 696 C GLY A 45 -18.380 -3.338 5.986 1.00 10.00 C ATOM 697 O GLY A 45 -18.255 -4.561 5.901 1.00 10.00 O ATOM 0 H GLY A 45 -19.694 -0.671 6.752 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -19.267 -2.610 7.806 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -20.385 -3.458 6.757 1.00 10.00 H new ATOM 701 N ALA A 46 -17.545 -2.492 5.372 1.00 10.00 N ATOM 702 CA ALA A 46 -16.330 -2.936 4.713 1.00 10.00 C ATOM 703 C ALA A 46 -15.271 -3.265 5.763 1.00 10.00 C ATOM 704 O ALA A 46 -15.164 -2.591 6.790 1.00 10.00 O ATOM 705 CB ALA A 46 -15.800 -1.836 3.787 1.00 10.00 C ATOM 0 H ALA A 46 -17.699 -1.485 5.323 1.00 10.00 H new ATOM 0 HA ALA A 46 -16.553 -3.825 4.122 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -14.889 -2.180 3.298 1.00 10.00 H new ATOM 0 HB2 ALA A 46 -16.551 -1.603 3.032 1.00 10.00 H new ATOM 0 HB3 ALA A 46 -15.583 -0.942 4.371 1.00 10.00 H new ATOM 711 N SER A 47 -14.463 -4.276 5.470 1.00 10.00 N ATOM 712 CA SER A 47 -13.257 -4.606 6.213 1.00 10.00 C ATOM 713 C SER A 47 -12.130 -3.807 5.550 1.00 10.00 C ATOM 714 O SER A 47 -12.008 -3.848 4.322 1.00 10.00 O ATOM 715 CB SER A 47 -12.994 -6.117 6.119 1.00 10.00 C ATOM 716 OG SER A 47 -14.160 -6.864 6.437 1.00 10.00 O ATOM 0 H SER A 47 -14.635 -4.906 4.686 1.00 10.00 H new ATOM 0 HA SER A 47 -13.339 -4.358 7.271 1.00 10.00 H new ATOM 0 HB2 SER A 47 -12.662 -6.369 5.112 1.00 10.00 H new ATOM 0 HB3 SER A 47 -12.187 -6.391 6.799 1.00 10.00 H new ATOM 0 HG SER A 47 -14.779 -6.844 5.677 1.00 10.00 H new ATOM 722 N TYR A 48 -11.331 -3.063 6.320 1.00 10.00 N ATOM 723 CA TYR A 48 -10.291 -2.197 5.772 1.00 10.00 C ATOM 724 C TYR A 48 -9.101 -2.089 6.727 1.00 10.00 C ATOM 725 O TYR A 48 -9.222 -2.341 7.929 1.00 10.00 O ATOM 726 CB TYR A 48 -10.872 -0.808 5.435 1.00 10.00 C ATOM 727 CG TYR A 48 -11.411 0.008 6.598 1.00 10.00 C ATOM 728 CD1 TYR A 48 -10.584 0.940 7.253 1.00 10.00 C ATOM 729 CD2 TYR A 48 -12.755 -0.128 6.996 1.00 10.00 C ATOM 730 CE1 TYR A 48 -11.092 1.710 8.315 1.00 10.00 C ATOM 731 CE2 TYR A 48 -13.273 0.644 8.052 1.00 10.00 C ATOM 732 CZ TYR A 48 -12.435 1.563 8.724 1.00 10.00 C ATOM 733 OH TYR A 48 -12.900 2.305 9.766 1.00 10.00 O ATOM 0 H TYR A 48 -11.389 -3.046 7.338 1.00 10.00 H new ATOM 0 HA TYR A 48 -9.923 -2.644 4.848 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.094 -0.225 4.942 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.677 -0.942 4.712 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -9.558 1.064 6.940 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -13.395 -0.832 6.485 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.451 2.417 8.820 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -14.306 0.535 8.348 1.00 10.00 H new ATOM 0 HH TYR A 48 -13.871 2.195 9.838 1.00 10.00 H new ATOM 743 N LYS A 49 -7.955 -1.683 6.177 1.00 10.00 N ATOM 744 CA LYS A 49 -6.716 -1.376 6.886 1.00 10.00 C ATOM 745 C LYS A 49 -6.481 0.124 6.768 1.00 10.00 C ATOM 746 O LYS A 49 -6.954 0.764 5.827 1.00 10.00 O ATOM 747 CB LYS A 49 -5.578 -2.207 6.260 1.00 10.00 C ATOM 748 CG LYS A 49 -4.180 -1.977 6.860 1.00 10.00 C ATOM 749 CD LYS A 49 -3.138 -2.888 6.191 1.00 10.00 C ATOM 750 CE LYS A 49 -1.716 -2.644 6.726 1.00 10.00 C ATOM 751 NZ LYS A 49 -1.536 -3.086 8.135 1.00 10.00 N ATOM 0 H LYS A 49 -7.864 -1.553 5.169 1.00 10.00 H new ATOM 0 HA LYS A 49 -6.764 -1.633 7.944 1.00 10.00 H new ATOM 0 HB2 LYS A 49 -5.827 -3.264 6.359 1.00 10.00 H new ATOM 0 HB3 LYS A 49 -5.537 -1.988 5.193 1.00 10.00 H new ATOM 0 HG2 LYS A 49 -3.892 -0.934 6.732 1.00 10.00 H new ATOM 0 HG3 LYS A 49 -4.204 -2.172 7.932 1.00 10.00 H new ATOM 0 HD2 LYS A 49 -3.411 -3.930 6.356 1.00 10.00 H new ATOM 0 HD3 LYS A 49 -3.152 -2.721 5.114 1.00 10.00 H new ATOM 0 HE2 LYS A 49 -1.001 -3.170 6.093 1.00 10.00 H new ATOM 0 HE3 LYS A 49 -1.485 -1.581 6.653 1.00 10.00 H new ATOM 0 HZ1 LYS A 49 -0.559 -2.895 8.437 1.00 10.00 H new ATOM 0 HZ2 LYS A 49 -2.196 -2.567 8.749 1.00 10.00 H new ATOM 0 HZ3 LYS A 49 -1.727 -4.106 8.206 1.00 10.00 H new ATOM 765 N VAL A 50 -5.722 0.685 7.699 1.00 10.00 N ATOM 766 CA VAL A 50 -5.409 2.102 7.753 1.00 10.00 C ATOM 767 C VAL A 50 -3.893 2.200 7.930 1.00 10.00 C ATOM 768 O VAL A 50 -3.289 1.360 8.604 1.00 10.00 O ATOM 769 CB VAL A 50 -6.189 2.751 8.918 1.00 10.00 C ATOM 770 CG1 VAL A 50 -6.056 4.275 8.901 1.00 10.00 C ATOM 771 CG2 VAL A 50 -7.694 2.437 8.885 1.00 10.00 C ATOM 0 H VAL A 50 -5.297 0.151 8.457 1.00 10.00 H new ATOM 0 HA VAL A 50 -5.703 2.636 6.849 1.00 10.00 H new ATOM 0 HB VAL A 50 -5.746 2.325 9.818 1.00 10.00 H new ATOM 0 HG11 VAL A 50 -6.617 4.699 9.734 1.00 10.00 H new ATOM 0 HG12 VAL A 50 -5.005 4.550 8.994 1.00 10.00 H new ATOM 0 HG13 VAL A 50 -6.451 4.664 7.963 1.00 10.00 H new ATOM 0 HG21 VAL A 50 -8.185 2.921 9.729 1.00 10.00 H new ATOM 0 HG22 VAL A 50 -8.123 2.808 7.954 1.00 10.00 H new ATOM 0 HG23 VAL A 50 -7.842 1.359 8.949 1.00 10.00 H new ATOM 781 N VAL A 51 -3.282 3.223 7.336 1.00 10.00 N ATOM 782 CA VAL A 51 -1.865 3.523 7.463 1.00 10.00 C ATOM 783 C VAL A 51 -1.807 5.010 7.802 1.00 10.00 C ATOM 784 O VAL A 51 -1.803 5.856 6.908 1.00 10.00 O ATOM 785 CB VAL A 51 -1.093 3.137 6.179 1.00 10.00 C ATOM 786 CG1 VAL A 51 0.414 3.376 6.362 1.00 10.00 C ATOM 787 CG2 VAL A 51 -1.311 1.668 5.777 1.00 10.00 C ATOM 0 H VAL A 51 -3.777 3.883 6.736 1.00 10.00 H new ATOM 0 HA VAL A 51 -1.374 2.941 8.243 1.00 10.00 H new ATOM 0 HB VAL A 51 -1.486 3.772 5.385 1.00 10.00 H new ATOM 0 HG11 VAL A 51 0.940 3.099 5.448 1.00 10.00 H new ATOM 0 HG12 VAL A 51 0.592 4.430 6.577 1.00 10.00 H new ATOM 0 HG13 VAL A 51 0.781 2.769 7.190 1.00 10.00 H new ATOM 0 HG21 VAL A 51 -0.747 1.451 4.870 1.00 10.00 H new ATOM 0 HG22 VAL A 51 -0.970 1.016 6.581 1.00 10.00 H new ATOM 0 HG23 VAL A 51 -2.371 1.494 5.595 1.00 10.00 H new ATOM 797 N GLU A 52 -1.852 5.330 9.097 1.00 10.00 N ATOM 798 CA GLU A 52 -1.747 6.697 9.591 1.00 10.00 C ATOM 799 C GLU A 52 -0.277 7.107 9.489 1.00 10.00 C ATOM 800 O GLU A 52 0.531 6.841 10.381 1.00 10.00 O ATOM 801 CB GLU A 52 -2.310 6.820 11.016 1.00 10.00 C ATOM 802 CG GLU A 52 -3.832 6.600 11.011 1.00 10.00 C ATOM 803 CD GLU A 52 -4.495 6.624 12.397 1.00 10.00 C ATOM 804 OE1 GLU A 52 -3.925 7.153 13.375 1.00 10.00 O ATOM 805 OE2 GLU A 52 -5.634 6.117 12.503 1.00 10.00 O ATOM 0 H GLU A 52 -1.964 4.637 9.837 1.00 10.00 H new ATOM 0 HA GLU A 52 -2.350 7.377 8.990 1.00 10.00 H new ATOM 0 HB2 GLU A 52 -1.832 6.088 11.667 1.00 10.00 H new ATOM 0 HB3 GLU A 52 -2.080 7.805 11.421 1.00 10.00 H new ATOM 0 HG2 GLU A 52 -4.293 7.368 10.391 1.00 10.00 H new ATOM 0 HG3 GLU A 52 -4.044 5.640 10.540 1.00 10.00 H new ATOM 812 N LEU A 53 0.075 7.709 8.355 1.00 10.00 N ATOM 813 CA LEU A 53 1.440 8.003 7.938 1.00 10.00 C ATOM 814 C LEU A 53 2.188 8.838 8.974 1.00 10.00 C ATOM 815 O LEU A 53 3.384 8.636 9.151 1.00 10.00 O ATOM 816 CB LEU A 53 1.412 8.724 6.575 1.00 10.00 C ATOM 817 CG LEU A 53 0.900 7.844 5.414 1.00 10.00 C ATOM 818 CD1 LEU A 53 0.587 8.706 4.189 1.00 10.00 C ATOM 819 CD2 LEU A 53 1.928 6.782 5.012 1.00 10.00 C ATOM 0 H LEU A 53 -0.617 8.018 7.672 1.00 10.00 H new ATOM 0 HA LEU A 53 1.979 7.060 7.844 1.00 10.00 H new ATOM 0 HB2 LEU A 53 0.779 9.608 6.655 1.00 10.00 H new ATOM 0 HB3 LEU A 53 2.417 9.072 6.338 1.00 10.00 H new ATOM 0 HG LEU A 53 -0.003 7.346 5.766 1.00 10.00 H new ATOM 0 HD11 LEU A 53 0.227 8.071 3.379 1.00 10.00 H new ATOM 0 HD12 LEU A 53 -0.180 9.437 4.445 1.00 10.00 H new ATOM 0 HD13 LEU A 53 1.490 9.225 3.869 1.00 10.00 H new ATOM 0 HD21 LEU A 53 1.531 6.183 4.192 1.00 10.00 H new ATOM 0 HD22 LEU A 53 2.849 7.270 4.692 1.00 10.00 H new ATOM 0 HD23 LEU A 53 2.137 6.136 5.865 1.00 10.00 H new ATOM 831 N ASP A 54 1.508 9.737 9.690 1.00 10.00 N ATOM 832 CA ASP A 54 2.149 10.587 10.697 1.00 10.00 C ATOM 833 C ASP A 54 2.730 9.775 11.867 1.00 10.00 C ATOM 834 O ASP A 54 3.704 10.204 12.486 1.00 10.00 O ATOM 835 CB ASP A 54 1.146 11.619 11.224 1.00 10.00 C ATOM 836 CG ASP A 54 1.811 12.571 12.236 1.00 10.00 C ATOM 837 OD1 ASP A 54 1.545 12.464 13.454 1.00 10.00 O ATOM 838 OD2 ASP A 54 2.584 13.458 11.809 1.00 10.00 O ATOM 0 H ASP A 54 0.505 9.896 9.590 1.00 10.00 H new ATOM 0 HA ASP A 54 2.982 11.094 10.210 1.00 10.00 H new ATOM 0 HB2 ASP A 54 0.740 12.194 10.392 1.00 10.00 H new ATOM 0 HB3 ASP A 54 0.308 11.108 11.697 1.00 10.00 H new ATOM 843 N GLU A 55 2.175 8.590 12.150 1.00 10.00 N ATOM 844 CA GLU A 55 2.657 7.688 13.199 1.00 10.00 C ATOM 845 C GLU A 55 3.623 6.634 12.642 1.00 10.00 C ATOM 846 O GLU A 55 4.372 6.030 13.414 1.00 10.00 O ATOM 847 CB GLU A 55 1.455 6.991 13.866 1.00 10.00 C ATOM 848 CG GLU A 55 0.833 7.837 14.984 1.00 10.00 C ATOM 849 CD GLU A 55 1.663 7.790 16.281 1.00 10.00 C ATOM 850 OE1 GLU A 55 1.489 6.846 17.086 1.00 10.00 O ATOM 851 OE2 GLU A 55 2.483 8.704 16.524 1.00 10.00 O ATOM 0 H GLU A 55 1.365 8.227 11.647 1.00 10.00 H new ATOM 0 HA GLU A 55 3.201 8.282 13.933 1.00 10.00 H new ATOM 0 HB2 GLU A 55 0.698 6.778 13.111 1.00 10.00 H new ATOM 0 HB3 GLU A 55 1.776 6.033 14.275 1.00 10.00 H new ATOM 0 HG2 GLU A 55 0.745 8.870 14.649 1.00 10.00 H new ATOM 0 HG3 GLU A 55 -0.177 7.481 15.188 1.00 10.00 H new ATOM 858 N LEU A 56 3.614 6.390 11.328 1.00 10.00 N ATOM 859 CA LEU A 56 4.443 5.364 10.706 1.00 10.00 C ATOM 860 C LEU A 56 5.921 5.760 10.796 1.00 10.00 C ATOM 861 O LEU A 56 6.278 6.916 10.560 1.00 10.00 O ATOM 862 CB LEU A 56 4.002 5.155 9.248 1.00 10.00 C ATOM 863 CG LEU A 56 4.771 4.036 8.518 1.00 10.00 C ATOM 864 CD1 LEU A 56 4.566 2.655 9.154 1.00 10.00 C ATOM 865 CD2 LEU A 56 4.322 3.986 7.060 1.00 10.00 C ATOM 0 H LEU A 56 3.029 6.902 10.668 1.00 10.00 H new ATOM 0 HA LEU A 56 4.318 4.419 11.236 1.00 10.00 H new ATOM 0 HB2 LEU A 56 2.937 4.922 9.230 1.00 10.00 H new ATOM 0 HB3 LEU A 56 4.133 6.089 8.701 1.00 10.00 H new ATOM 0 HG LEU A 56 5.832 4.273 8.595 1.00 10.00 H new ATOM 0 HD11 LEU A 56 5.132 1.910 8.596 1.00 10.00 H new ATOM 0 HD12 LEU A 56 4.913 2.675 10.187 1.00 10.00 H new ATOM 0 HD13 LEU A 56 3.507 2.398 9.132 1.00 10.00 H new ATOM 0 HD21 LEU A 56 4.863 3.196 6.539 1.00 10.00 H new ATOM 0 HD22 LEU A 56 3.252 3.783 7.016 1.00 10.00 H new ATOM 0 HD23 LEU A 56 4.530 4.943 6.582 1.00 10.00 H new ATOM 877 N SER A 57 6.782 4.780 11.075 1.00 10.00 N ATOM 878 CA SER A 57 8.214 4.950 11.303 1.00 10.00 C ATOM 879 C SER A 57 8.977 5.559 10.113 1.00 10.00 C ATOM 880 O SER A 57 10.084 6.066 10.300 1.00 10.00 O ATOM 881 CB SER A 57 8.804 3.579 11.669 1.00 10.00 C ATOM 882 OG SER A 57 7.957 2.884 12.580 1.00 10.00 O ATOM 0 H SER A 57 6.486 3.807 11.151 1.00 10.00 H new ATOM 0 HA SER A 57 8.333 5.669 12.114 1.00 10.00 H new ATOM 0 HB2 SER A 57 8.938 2.984 10.766 1.00 10.00 H new ATOM 0 HB3 SER A 57 9.791 3.711 12.113 1.00 10.00 H new ATOM 0 HG SER A 57 8.353 2.014 12.796 1.00 10.00 H new ATOM 888 N ASP A 58 8.401 5.533 8.904 1.00 10.00 N ATOM 889 CA ASP A 58 9.008 6.062 7.677 1.00 10.00 C ATOM 890 C ASP A 58 7.997 6.934 6.915 1.00 10.00 C ATOM 891 O ASP A 58 8.070 7.089 5.696 1.00 10.00 O ATOM 892 CB ASP A 58 9.530 4.883 6.841 1.00 10.00 C ATOM 893 CG ASP A 58 10.422 5.329 5.673 1.00 10.00 C ATOM 894 OD1 ASP A 58 11.258 6.243 5.859 1.00 10.00 O ATOM 895 OD2 ASP A 58 10.355 4.696 4.595 1.00 10.00 O ATOM 0 H ASP A 58 7.476 5.133 8.749 1.00 10.00 H new ATOM 0 HA ASP A 58 9.853 6.709 7.912 1.00 10.00 H new ATOM 0 HB2 ASP A 58 10.094 4.208 7.485 1.00 10.00 H new ATOM 0 HB3 ASP A 58 8.684 4.318 6.450 1.00 10.00 H new ATOM 900 N GLY A 59 7.008 7.461 7.648 1.00 10.00 N ATOM 901 CA GLY A 59 5.821 8.144 7.151 1.00 10.00 C ATOM 902 C GLY A 59 6.067 9.115 6.007 1.00 10.00 C ATOM 903 O GLY A 59 5.413 9.004 4.974 1.00 10.00 O ATOM 0 H GLY A 59 7.023 7.416 8.667 1.00 10.00 H new ATOM 0 HA2 GLY A 59 5.101 7.395 6.823 1.00 10.00 H new ATOM 0 HA3 GLY A 59 5.361 8.688 7.976 1.00 10.00 H new ATOM 907 N SER A 60 7.007 10.046 6.162 1.00 10.00 N ATOM 908 CA SER A 60 7.271 11.075 5.162 1.00 10.00 C ATOM 909 C SER A 60 7.734 10.483 3.824 1.00 10.00 C ATOM 910 O SER A 60 7.277 10.915 2.762 1.00 10.00 O ATOM 911 CB SER A 60 8.313 12.055 5.717 1.00 10.00 C ATOM 912 OG SER A 60 7.986 12.439 7.047 1.00 10.00 O ATOM 0 H SER A 60 7.606 10.107 6.985 1.00 10.00 H new ATOM 0 HA SER A 60 6.339 11.602 4.958 1.00 10.00 H new ATOM 0 HB2 SER A 60 9.300 11.592 5.699 1.00 10.00 H new ATOM 0 HB3 SER A 60 8.364 12.938 5.080 1.00 10.00 H new ATOM 0 HG SER A 60 8.663 13.062 7.383 1.00 10.00 H new ATOM 918 N GLN A 61 8.609 9.473 3.849 1.00 10.00 N ATOM 919 CA GLN A 61 9.084 8.840 2.621 1.00 10.00 C ATOM 920 C GLN A 61 7.994 7.939 2.041 1.00 10.00 C ATOM 921 O GLN A 61 7.851 7.866 0.823 1.00 10.00 O ATOM 922 CB GLN A 61 10.377 8.048 2.856 1.00 10.00 C ATOM 923 CG GLN A 61 11.523 8.931 3.374 1.00 10.00 C ATOM 924 CD GLN A 61 12.883 8.238 3.252 1.00 10.00 C ATOM 925 OE1 GLN A 61 13.720 8.627 2.442 1.00 10.00 O ATOM 926 NE2 GLN A 61 13.138 7.207 4.037 1.00 10.00 N ATOM 0 H GLN A 61 9.000 9.079 4.705 1.00 10.00 H new ATOM 0 HA GLN A 61 9.313 9.627 1.902 1.00 10.00 H new ATOM 0 HB2 GLN A 61 10.185 7.250 3.573 1.00 10.00 H new ATOM 0 HB3 GLN A 61 10.682 7.572 1.924 1.00 10.00 H new ATOM 0 HG2 GLN A 61 11.541 9.866 2.814 1.00 10.00 H new ATOM 0 HG3 GLN A 61 11.339 9.188 4.417 1.00 10.00 H new ATOM 0 HE21 GLN A 61 12.437 6.891 4.707 1.00 10.00 H new ATOM 0 HE22 GLN A 61 14.036 6.727 3.973 1.00 10.00 H new ATOM 935 N LEU A 62 7.186 7.301 2.890 1.00 10.00 N ATOM 936 CA LEU A 62 6.032 6.519 2.468 1.00 10.00 C ATOM 937 C LEU A 62 5.026 7.428 1.749 1.00 10.00 C ATOM 938 O LEU A 62 4.576 7.100 0.653 1.00 10.00 O ATOM 939 CB LEU A 62 5.448 5.807 3.705 1.00 10.00 C ATOM 940 CG LEU A 62 4.706 4.483 3.450 1.00 10.00 C ATOM 941 CD1 LEU A 62 3.615 4.576 2.386 1.00 10.00 C ATOM 942 CD2 LEU A 62 5.686 3.367 3.077 1.00 10.00 C ATOM 0 H LEU A 62 7.320 7.316 3.901 1.00 10.00 H new ATOM 0 HA LEU A 62 6.311 5.749 1.749 1.00 10.00 H new ATOM 0 HB2 LEU A 62 6.263 5.612 4.403 1.00 10.00 H new ATOM 0 HB3 LEU A 62 4.761 6.493 4.201 1.00 10.00 H new ATOM 0 HG LEU A 62 4.210 4.249 4.392 1.00 10.00 H new ATOM 0 HD11 LEU A 62 3.140 3.602 2.266 1.00 10.00 H new ATOM 0 HD12 LEU A 62 2.868 5.308 2.693 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.056 4.884 1.438 1.00 10.00 H new ATOM 0 HD21 LEU A 62 5.135 2.443 2.902 1.00 10.00 H new ATOM 0 HD22 LEU A 62 6.226 3.644 2.172 1.00 10.00 H new ATOM 0 HD23 LEU A 62 6.395 3.218 3.891 1.00 10.00 H new ATOM 954 N GLN A 63 4.734 8.613 2.296 1.00 10.00 N ATOM 955 CA GLN A 63 3.875 9.594 1.643 1.00 10.00 C ATOM 956 C GLN A 63 4.499 10.050 0.321 1.00 10.00 C ATOM 957 O GLN A 63 3.790 10.187 -0.675 1.00 10.00 O ATOM 958 CB GLN A 63 3.612 10.800 2.564 1.00 10.00 C ATOM 959 CG GLN A 63 2.424 11.614 2.019 1.00 10.00 C ATOM 960 CD GLN A 63 2.130 12.911 2.770 1.00 10.00 C ATOM 961 OE1 GLN A 63 2.646 13.196 3.849 1.00 10.00 O ATOM 962 NE2 GLN A 63 1.275 13.735 2.192 1.00 10.00 N ATOM 0 H GLN A 63 5.089 8.914 3.204 1.00 10.00 H new ATOM 0 HA GLN A 63 2.916 9.120 1.431 1.00 10.00 H new ATOM 0 HB2 GLN A 63 3.398 10.458 3.577 1.00 10.00 H new ATOM 0 HB3 GLN A 63 4.501 11.428 2.621 1.00 10.00 H new ATOM 0 HG2 GLN A 63 2.617 11.853 0.973 1.00 10.00 H new ATOM 0 HG3 GLN A 63 1.532 10.988 2.044 1.00 10.00 H new ATOM 0 HE21 GLN A 63 0.854 13.487 1.297 1.00 10.00 H new ATOM 0 HE22 GLN A 63 1.036 14.619 2.641 1.00 10.00 H new ATOM 971 N SER A 64 5.817 10.262 0.289 1.00 10.00 N ATOM 972 CA SER A 64 6.516 10.637 -0.934 1.00 10.00 C ATOM 973 C SER A 64 6.377 9.538 -1.996 1.00 10.00 C ATOM 974 O SER A 64 6.161 9.849 -3.167 1.00 10.00 O ATOM 975 CB SER A 64 7.987 10.948 -0.630 1.00 10.00 C ATOM 976 OG SER A 64 8.105 11.959 0.360 1.00 10.00 O ATOM 0 H SER A 64 6.422 10.178 1.106 1.00 10.00 H new ATOM 0 HA SER A 64 6.060 11.541 -1.339 1.00 10.00 H new ATOM 0 HB2 SER A 64 8.490 10.043 -0.290 1.00 10.00 H new ATOM 0 HB3 SER A 64 8.490 11.269 -1.543 1.00 10.00 H new ATOM 0 HG SER A 64 7.782 11.615 1.219 1.00 10.00 H new ATOM 982 N ALA A 65 6.440 8.259 -1.604 1.00 10.00 N ATOM 983 CA ALA A 65 6.228 7.146 -2.518 1.00 10.00 C ATOM 984 C ALA A 65 4.797 7.152 -3.040 1.00 10.00 C ATOM 985 O ALA A 65 4.608 6.985 -4.242 1.00 10.00 O ATOM 986 CB ALA A 65 6.556 5.815 -1.842 1.00 10.00 C ATOM 0 H ALA A 65 6.639 7.974 -0.645 1.00 10.00 H new ATOM 0 HA ALA A 65 6.903 7.265 -3.366 1.00 10.00 H new ATOM 0 HB1 ALA A 65 6.390 4.999 -2.545 1.00 10.00 H new ATOM 0 HB2 ALA A 65 7.599 5.815 -1.526 1.00 10.00 H new ATOM 0 HB3 ALA A 65 5.913 5.681 -0.972 1.00 10.00 H new ATOM 992 N LEU A 66 3.805 7.393 -2.177 1.00 10.00 N ATOM 993 CA LEU A 66 2.411 7.549 -2.591 1.00 10.00 C ATOM 994 C LEU A 66 2.288 8.666 -3.627 1.00 10.00 C ATOM 995 O LEU A 66 1.651 8.458 -4.659 1.00 10.00 O ATOM 996 CB LEU A 66 1.493 7.827 -1.380 1.00 10.00 C ATOM 997 CG LEU A 66 0.681 6.625 -0.864 1.00 10.00 C ATOM 998 CD1 LEU A 66 -0.358 6.143 -1.881 1.00 10.00 C ATOM 999 CD2 LEU A 66 1.572 5.452 -0.453 1.00 10.00 C ATOM 0 H LEU A 66 3.948 7.485 -1.171 1.00 10.00 H new ATOM 0 HA LEU A 66 2.087 6.612 -3.044 1.00 10.00 H new ATOM 0 HB2 LEU A 66 2.107 8.205 -0.562 1.00 10.00 H new ATOM 0 HB3 LEU A 66 0.798 8.622 -1.650 1.00 10.00 H new ATOM 0 HG LEU A 66 0.158 6.989 0.020 1.00 10.00 H new ATOM 0 HD11 LEU A 66 -0.904 5.294 -1.469 1.00 10.00 H new ATOM 0 HD12 LEU A 66 -1.056 6.951 -2.099 1.00 10.00 H new ATOM 0 HD13 LEU A 66 0.145 5.840 -2.799 1.00 10.00 H new ATOM 0 HD21 LEU A 66 0.951 4.630 -0.097 1.00 10.00 H new ATOM 0 HD22 LEU A 66 2.155 5.120 -1.312 1.00 10.00 H new ATOM 0 HD23 LEU A 66 2.246 5.769 0.343 1.00 10.00 H new ATOM 1011 N ALA A 67 2.914 9.825 -3.391 1.00 10.00 N ATOM 1012 CA ALA A 67 2.896 10.936 -4.335 1.00 10.00 C ATOM 1013 C ALA A 67 3.474 10.531 -5.689 1.00 10.00 C ATOM 1014 O ALA A 67 2.833 10.736 -6.719 1.00 10.00 O ATOM 1015 CB ALA A 67 3.656 12.138 -3.754 1.00 10.00 C ATOM 0 H ALA A 67 3.445 10.014 -2.541 1.00 10.00 H new ATOM 0 HA ALA A 67 1.857 11.223 -4.498 1.00 10.00 H new ATOM 0 HB1 ALA A 67 3.636 12.961 -4.468 1.00 10.00 H new ATOM 0 HB2 ALA A 67 3.183 12.453 -2.824 1.00 10.00 H new ATOM 0 HB3 ALA A 67 4.690 11.854 -3.557 1.00 10.00 H new ATOM 1021 N HIS A 68 4.660 9.924 -5.684 1.00 10.00 N ATOM 1022 CA HIS A 68 5.340 9.444 -6.879 1.00 10.00 C ATOM 1023 C HIS A 68 4.474 8.421 -7.637 1.00 10.00 C ATOM 1024 O HIS A 68 4.386 8.469 -8.865 1.00 10.00 O ATOM 1025 CB HIS A 68 6.703 8.874 -6.438 1.00 10.00 C ATOM 1026 CG HIS A 68 7.236 7.750 -7.285 1.00 10.00 C ATOM 1027 ND1 HIS A 68 8.049 7.849 -8.392 1.00 10.00 N ATOM 1028 CD2 HIS A 68 6.982 6.422 -7.080 1.00 10.00 C ATOM 1029 CE1 HIS A 68 8.276 6.605 -8.847 1.00 10.00 C ATOM 1030 NE2 HIS A 68 7.642 5.696 -8.080 1.00 10.00 N ATOM 0 H HIS A 68 5.184 9.750 -4.827 1.00 10.00 H new ATOM 0 HA HIS A 68 5.507 10.256 -7.587 1.00 10.00 H new ATOM 0 HB2 HIS A 68 7.433 9.683 -6.437 1.00 10.00 H new ATOM 0 HB3 HIS A 68 6.615 8.522 -5.410 1.00 10.00 H new ATOM 0 HD1 HIS A 68 8.414 8.712 -8.795 1.00 10.00 H new ATOM 0 HD2 HIS A 68 6.379 6.006 -6.287 1.00 10.00 H new ATOM 0 HE1 HIS A 68 8.883 6.367 -9.708 1.00 10.00 H new ATOM 1038 N TRP A 69 3.840 7.499 -6.911 1.00 10.00 N ATOM 1039 CA TRP A 69 3.148 6.346 -7.471 1.00 10.00 C ATOM 1040 C TRP A 69 1.783 6.724 -8.047 1.00 10.00 C ATOM 1041 O TRP A 69 1.419 6.246 -9.123 1.00 10.00 O ATOM 1042 CB TRP A 69 2.983 5.318 -6.341 1.00 10.00 C ATOM 1043 CG TRP A 69 2.369 3.985 -6.648 1.00 10.00 C ATOM 1044 CD1 TRP A 69 2.252 3.400 -7.863 1.00 10.00 C ATOM 1045 CD2 TRP A 69 1.805 3.027 -5.700 1.00 10.00 C ATOM 1046 NE1 TRP A 69 1.636 2.175 -7.738 1.00 10.00 N ATOM 1047 CE2 TRP A 69 1.334 1.890 -6.424 1.00 10.00 C ATOM 1048 CE3 TRP A 69 1.647 3.005 -4.296 1.00 10.00 C ATOM 1049 CZ2 TRP A 69 0.719 0.800 -5.791 1.00 10.00 C ATOM 1050 CZ3 TRP A 69 1.038 1.913 -3.649 1.00 10.00 C ATOM 1051 CH2 TRP A 69 0.573 0.815 -4.394 1.00 10.00 C ATOM 0 H TRP A 69 3.795 7.538 -5.893 1.00 10.00 H new ATOM 0 HA TRP A 69 3.731 5.936 -8.296 1.00 10.00 H new ATOM 0 HB2 TRP A 69 3.971 5.135 -5.918 1.00 10.00 H new ATOM 0 HB3 TRP A 69 2.383 5.783 -5.559 1.00 10.00 H new ATOM 0 HD1 TRP A 69 2.592 3.831 -8.793 1.00 10.00 H new ATOM 0 HE1 TRP A 69 1.429 1.555 -8.521 1.00 10.00 H new ATOM 0 HE3 TRP A 69 2.000 3.840 -3.709 1.00 10.00 H new ATOM 0 HZ2 TRP A 69 0.363 -0.039 -6.370 1.00 10.00 H new ATOM 0 HZ3 TRP A 69 0.927 1.919 -2.575 1.00 10.00 H new ATOM 0 HH2 TRP A 69 0.103 -0.018 -3.892 1.00 10.00 H new ATOM 1062 N THR A 70 1.042 7.596 -7.361 1.00 10.00 N ATOM 1063 CA THR A 70 -0.360 7.859 -7.677 1.00 10.00 C ATOM 1064 C THR A 70 -0.572 9.232 -8.325 1.00 10.00 C ATOM 1065 O THR A 70 -1.631 9.480 -8.906 1.00 10.00 O ATOM 1066 CB THR A 70 -1.200 7.706 -6.393 1.00 10.00 C ATOM 1067 OG1 THR A 70 -0.906 8.726 -5.458 1.00 10.00 O ATOM 1068 CG2 THR A 70 -0.999 6.362 -5.681 1.00 10.00 C ATOM 0 H THR A 70 1.397 8.138 -6.573 1.00 10.00 H new ATOM 0 HA THR A 70 -0.687 7.130 -8.418 1.00 10.00 H new ATOM 0 HB THR A 70 -2.233 7.771 -6.735 1.00 10.00 H new ATOM 0 HG1 THR A 70 -0.004 8.591 -5.099 1.00 10.00 H new ATOM 0 HG21 THR A 70 -1.622 6.327 -4.787 1.00 10.00 H new ATOM 0 HG22 THR A 70 -1.280 5.550 -6.351 1.00 10.00 H new ATOM 0 HG23 THR A 70 0.048 6.253 -5.398 1.00 10.00 H new ATOM 1076 N GLY A 71 0.415 10.133 -8.234 1.00 10.00 N ATOM 1077 CA GLY A 71 0.249 11.533 -8.606 1.00 10.00 C ATOM 1078 C GLY A 71 -0.698 12.259 -7.639 1.00 10.00 C ATOM 1079 O GLY A 71 -1.200 13.335 -7.970 1.00 10.00 O ATOM 0 H GLY A 71 1.351 9.905 -7.899 1.00 10.00 H new ATOM 0 HA2 GLY A 71 1.220 12.028 -8.608 1.00 10.00 H new ATOM 0 HA3 GLY A 71 -0.144 11.598 -9.621 1.00 10.00 H new ATOM 1083 N ARG A 72 -0.975 11.675 -6.462 1.00 10.00 N ATOM 1084 CA ARG A 72 -1.984 12.123 -5.507 1.00 10.00 C ATOM 1085 C ARG A 72 -1.429 11.889 -4.099 1.00 10.00 C ATOM 1086 O ARG A 72 -1.917 11.052 -3.340 1.00 10.00 O ATOM 1087 CB ARG A 72 -3.310 11.393 -5.801 1.00 10.00 C ATOM 1088 CG ARG A 72 -4.482 11.968 -4.994 1.00 10.00 C ATOM 1089 CD ARG A 72 -5.787 11.231 -5.312 1.00 10.00 C ATOM 1090 NE ARG A 72 -6.882 11.723 -4.456 1.00 10.00 N ATOM 1091 CZ ARG A 72 -7.688 12.764 -4.716 1.00 10.00 C ATOM 1092 NH1 ARG A 72 -7.607 13.419 -5.871 1.00 10.00 N ATOM 1093 NH2 ARG A 72 -8.571 13.156 -3.803 1.00 10.00 N ATOM 0 H ARG A 72 -0.478 10.844 -6.143 1.00 10.00 H new ATOM 0 HA ARG A 72 -2.205 13.187 -5.592 1.00 10.00 H new ATOM 0 HB2 ARG A 72 -3.534 11.466 -6.865 1.00 10.00 H new ATOM 0 HB3 ARG A 72 -3.198 10.334 -5.570 1.00 10.00 H new ATOM 0 HG2 ARG A 72 -4.267 11.889 -3.928 1.00 10.00 H new ATOM 0 HG3 ARG A 72 -4.596 13.029 -5.218 1.00 10.00 H new ATOM 0 HD2 ARG A 72 -6.046 11.374 -6.361 1.00 10.00 H new ATOM 0 HD3 ARG A 72 -5.653 10.160 -5.160 1.00 10.00 H new ATOM 0 HE ARG A 72 -7.043 11.224 -3.581 1.00 10.00 H new ATOM 0 HH11 ARG A 72 -6.925 13.132 -6.573 1.00 10.00 H new ATOM 0 HH12 ARG A 72 -8.226 14.208 -6.054 1.00 10.00 H new ATOM 0 HH21 ARG A 72 -8.633 12.666 -2.910 1.00 10.00 H new ATOM 0 HH22 ARG A 72 -9.186 13.947 -3.995 1.00 10.00 H new ATOM 1107 N GLY A 73 -0.349 12.600 -3.770 1.00 10.00 N ATOM 1108 CA GLY A 73 0.337 12.482 -2.484 1.00 10.00 C ATOM 1109 C GLY A 73 -0.469 13.009 -1.297 1.00 10.00 C ATOM 1110 O GLY A 73 -0.015 12.885 -0.159 1.00 10.00 O ATOM 0 H GLY A 73 0.078 13.282 -4.397 1.00 10.00 H new ATOM 0 HA2 GLY A 73 0.579 11.434 -2.308 1.00 10.00 H new ATOM 0 HA3 GLY A 73 1.282 13.023 -2.537 1.00 10.00 H new ATOM 1114 N THR A 74 -1.624 13.628 -1.536 1.00 10.00 N ATOM 1115 CA THR A 74 -2.569 14.064 -0.522 1.00 10.00 C ATOM 1116 C THR A 74 -3.124 12.866 0.272 1.00 10.00 C ATOM 1117 O THR A 74 -2.937 11.703 -0.102 1.00 10.00 O ATOM 1118 CB THR A 74 -3.675 14.872 -1.236 1.00 10.00 C ATOM 1119 OG1 THR A 74 -4.039 14.259 -2.465 1.00 10.00 O ATOM 1120 CG2 THR A 74 -3.181 16.286 -1.562 1.00 10.00 C ATOM 0 H THR A 74 -1.935 13.846 -2.483 1.00 10.00 H new ATOM 0 HA THR A 74 -2.081 14.700 0.217 1.00 10.00 H new ATOM 0 HB THR A 74 -4.531 14.907 -0.562 1.00 10.00 H new ATOM 0 HG1 THR A 74 -4.742 14.787 -2.898 1.00 10.00 H new ATOM 0 HG21 THR A 74 -3.973 16.841 -2.065 1.00 10.00 H new ATOM 0 HG22 THR A 74 -2.908 16.798 -0.639 1.00 10.00 H new ATOM 0 HG23 THR A 74 -2.310 16.226 -2.214 1.00 10.00 H new ATOM 1128 N VAL A 75 -3.836 13.149 1.366 1.00 10.00 N ATOM 1129 CA VAL A 75 -4.460 12.143 2.220 1.00 10.00 C ATOM 1130 C VAL A 75 -5.937 12.514 2.454 1.00 10.00 C ATOM 1131 O VAL A 75 -6.266 13.705 2.448 1.00 10.00 O ATOM 1132 CB VAL A 75 -3.681 11.980 3.547 1.00 10.00 C ATOM 1133 CG1 VAL A 75 -2.385 11.187 3.335 1.00 10.00 C ATOM 1134 CG2 VAL A 75 -3.343 13.308 4.242 1.00 10.00 C ATOM 0 H VAL A 75 -3.996 14.104 1.687 1.00 10.00 H new ATOM 0 HA VAL A 75 -4.427 11.174 1.721 1.00 10.00 H new ATOM 0 HB VAL A 75 -4.359 11.434 4.203 1.00 10.00 H new ATOM 0 HG11 VAL A 75 -1.859 11.089 4.285 1.00 10.00 H new ATOM 0 HG12 VAL A 75 -2.624 10.196 2.948 1.00 10.00 H new ATOM 0 HG13 VAL A 75 -1.750 11.712 2.621 1.00 10.00 H new ATOM 0 HG21 VAL A 75 -2.797 13.108 5.164 1.00 10.00 H new ATOM 0 HG22 VAL A 75 -2.727 13.918 3.581 1.00 10.00 H new ATOM 0 HG23 VAL A 75 -4.264 13.842 4.474 1.00 10.00 H new ATOM 1144 N PRO A 76 -6.829 11.532 2.690 1.00 10.00 N ATOM 1145 CA PRO A 76 -6.568 10.106 2.543 1.00 10.00 C ATOM 1146 C PRO A 76 -6.398 9.727 1.065 1.00 10.00 C ATOM 1147 O PRO A 76 -6.927 10.395 0.174 1.00 10.00 O ATOM 1148 CB PRO A 76 -7.771 9.396 3.168 1.00 10.00 C ATOM 1149 CG PRO A 76 -8.905 10.397 2.970 1.00 10.00 C ATOM 1150 CD PRO A 76 -8.220 11.760 3.042 1.00 10.00 C ATOM 0 HA PRO A 76 -5.640 9.815 3.035 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -7.980 8.447 2.674 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -7.606 9.177 4.223 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -9.402 10.251 2.011 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -9.667 10.293 3.742 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -8.685 12.466 2.354 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -8.304 12.186 4.042 1.00 10.00 H new ATOM 1158 N ASN A 77 -5.690 8.628 0.819 1.00 10.00 N ATOM 1159 CA ASN A 77 -5.525 8.004 -0.490 1.00 10.00 C ATOM 1160 C ASN A 77 -5.966 6.559 -0.269 1.00 10.00 C ATOM 1161 O ASN A 77 -5.463 5.894 0.644 1.00 10.00 O ATOM 1162 CB ASN A 77 -4.074 8.159 -0.976 1.00 10.00 C ATOM 1163 CG ASN A 77 -3.890 7.740 -2.432 1.00 10.00 C ATOM 1164 OD1 ASN A 77 -4.423 6.732 -2.880 1.00 10.00 O ATOM 1165 ND2 ASN A 77 -3.153 8.505 -3.220 1.00 10.00 N ATOM 0 H ASN A 77 -5.195 8.127 1.557 1.00 10.00 H new ATOM 0 HA ASN A 77 -6.117 8.461 -1.283 1.00 10.00 H new ATOM 0 HB2 ASN A 77 -3.766 9.198 -0.860 1.00 10.00 H new ATOM 0 HB3 ASN A 77 -3.418 7.560 -0.345 1.00 10.00 H new ATOM 0 HD21 ASN A 77 -3.028 8.256 -4.201 1.00 10.00 H new ATOM 0 HD22 ASN A 77 -2.709 9.344 -2.847 1.00 10.00 H new ATOM 1172 N VAL A 78 -6.948 6.097 -1.042 1.00 10.00 N ATOM 1173 CA VAL A 78 -7.645 4.841 -0.796 1.00 10.00 C ATOM 1174 C VAL A 78 -7.372 3.856 -1.929 1.00 10.00 C ATOM 1175 O VAL A 78 -7.339 4.220 -3.110 1.00 10.00 O ATOM 1176 CB VAL A 78 -9.157 5.115 -0.592 1.00 10.00 C ATOM 1177 CG1 VAL A 78 -9.901 3.850 -0.131 1.00 10.00 C ATOM 1178 CG2 VAL A 78 -9.415 6.215 0.456 1.00 10.00 C ATOM 0 H VAL A 78 -7.284 6.593 -1.867 1.00 10.00 H new ATOM 0 HA VAL A 78 -7.272 4.380 0.118 1.00 10.00 H new ATOM 0 HB VAL A 78 -9.528 5.442 -1.563 1.00 10.00 H new ATOM 0 HG11 VAL A 78 -10.958 4.078 0.002 1.00 10.00 H new ATOM 0 HG12 VAL A 78 -9.790 3.068 -0.883 1.00 10.00 H new ATOM 0 HG13 VAL A 78 -9.482 3.506 0.815 1.00 10.00 H new ATOM 0 HG21 VAL A 78 -10.488 6.371 0.563 1.00 10.00 H new ATOM 0 HG22 VAL A 78 -8.995 5.910 1.414 1.00 10.00 H new ATOM 0 HG23 VAL A 78 -8.944 7.143 0.132 1.00 10.00 H new ATOM 1188 N PHE A 79 -7.219 2.591 -1.544 1.00 10.00 N ATOM 1189 CA PHE A 79 -6.993 1.452 -2.413 1.00 10.00 C ATOM 1190 C PHE A 79 -8.047 0.409 -2.072 1.00 10.00 C ATOM 1191 O PHE A 79 -8.399 0.250 -0.900 1.00 10.00 O ATOM 1192 CB PHE A 79 -5.595 0.861 -2.167 1.00 10.00 C ATOM 1193 CG PHE A 79 -4.433 1.649 -2.737 1.00 10.00 C ATOM 1194 CD1 PHE A 79 -3.651 1.093 -3.767 1.00 10.00 C ATOM 1195 CD2 PHE A 79 -4.110 2.925 -2.235 1.00 10.00 C ATOM 1196 CE1 PHE A 79 -2.563 1.808 -4.292 1.00 10.00 C ATOM 1197 CE2 PHE A 79 -3.032 3.644 -2.773 1.00 10.00 C ATOM 1198 CZ PHE A 79 -2.250 3.084 -3.796 1.00 10.00 C ATOM 0 H PHE A 79 -7.252 2.325 -0.560 1.00 10.00 H new ATOM 0 HA PHE A 79 -7.057 1.754 -3.458 1.00 10.00 H new ATOM 0 HB2 PHE A 79 -5.448 0.761 -1.092 1.00 10.00 H new ATOM 0 HB3 PHE A 79 -5.568 -0.144 -2.587 1.00 10.00 H new ATOM 0 HD1 PHE A 79 -3.889 0.113 -4.155 1.00 10.00 H new ATOM 0 HD2 PHE A 79 -4.694 3.351 -1.433 1.00 10.00 H new ATOM 0 HE1 PHE A 79 -1.965 1.375 -5.080 1.00 10.00 H new ATOM 0 HE2 PHE A 79 -2.803 4.631 -2.399 1.00 10.00 H new ATOM 0 HZ PHE A 79 -1.412 3.632 -4.200 1.00 10.00 H new ATOM 1208 N ILE A 80 -8.515 -0.325 -3.079 1.00 10.00 N ATOM 1209 CA ILE A 80 -9.437 -1.444 -2.937 1.00 10.00 C ATOM 1210 C ILE A 80 -8.927 -2.518 -3.899 1.00 10.00 C ATOM 1211 O ILE A 80 -8.495 -2.205 -5.009 1.00 10.00 O ATOM 1212 CB ILE A 80 -10.903 -1.015 -3.221 1.00 10.00 C ATOM 1213 CG1 ILE A 80 -11.377 0.083 -2.240 1.00 10.00 C ATOM 1214 CG2 ILE A 80 -11.827 -2.246 -3.160 1.00 10.00 C ATOM 1215 CD1 ILE A 80 -12.792 0.622 -2.477 1.00 10.00 C ATOM 0 H ILE A 80 -8.252 -0.149 -4.049 1.00 10.00 H new ATOM 0 HA ILE A 80 -9.463 -1.828 -1.917 1.00 10.00 H new ATOM 0 HB ILE A 80 -10.947 -0.588 -4.223 1.00 10.00 H new ATOM 0 HG12 ILE A 80 -11.325 -0.314 -1.226 1.00 10.00 H new ATOM 0 HG13 ILE A 80 -10.677 0.917 -2.292 1.00 10.00 H new ATOM 0 HG21 ILE A 80 -12.854 -1.940 -3.360 1.00 10.00 H new ATOM 0 HG22 ILE A 80 -11.513 -2.974 -3.908 1.00 10.00 H new ATOM 0 HG23 ILE A 80 -11.769 -2.696 -2.169 1.00 10.00 H new ATOM 0 HD11 ILE A 80 -13.020 1.385 -1.733 1.00 10.00 H new ATOM 0 HD12 ILE A 80 -12.853 1.057 -3.474 1.00 10.00 H new ATOM 0 HD13 ILE A 80 -13.511 -0.193 -2.392 1.00 10.00 H new ATOM 1227 N GLY A 81 -8.938 -3.781 -3.468 1.00 10.00 N ATOM 1228 CA GLY A 81 -8.471 -4.916 -4.260 1.00 10.00 C ATOM 1229 C GLY A 81 -7.013 -4.767 -4.712 1.00 10.00 C ATOM 1230 O GLY A 81 -6.652 -5.260 -5.783 1.00 10.00 O ATOM 0 H GLY A 81 -9.278 -4.046 -2.543 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -8.573 -5.829 -3.673 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -9.109 -5.028 -5.137 1.00 10.00 H new ATOM 1234 N GLY A 82 -6.183 -4.062 -3.934 1.00 10.00 N ATOM 1235 CA GLY A 82 -4.788 -3.801 -4.274 1.00 10.00 C ATOM 1236 C GLY A 82 -4.616 -2.821 -5.440 1.00 10.00 C ATOM 1237 O GLY A 82 -3.548 -2.807 -6.056 1.00 10.00 O ATOM 0 H GLY A 82 -6.468 -3.655 -3.043 1.00 10.00 H new ATOM 0 HA2 GLY A 82 -4.277 -3.403 -3.397 1.00 10.00 H new ATOM 0 HA3 GLY A 82 -4.301 -4.743 -4.527 1.00 10.00 H new ATOM 1241 N LYS A 83 -5.630 -2.004 -5.757 1.00 10.00 N ATOM 1242 CA LYS A 83 -5.595 -1.018 -6.835 1.00 10.00 C ATOM 1243 C LYS A 83 -6.024 0.326 -6.261 1.00 10.00 C ATOM 1244 O LYS A 83 -6.939 0.382 -5.437 1.00 10.00 O ATOM 1245 CB LYS A 83 -6.517 -1.495 -7.971 1.00 10.00 C ATOM 1246 CG LYS A 83 -6.494 -0.557 -9.187 1.00 10.00 C ATOM 1247 CD LYS A 83 -7.299 -1.149 -10.351 1.00 10.00 C ATOM 1248 CE LYS A 83 -7.289 -0.181 -11.541 1.00 10.00 C ATOM 1249 NZ LYS A 83 -7.997 -0.737 -12.721 1.00 10.00 N ATOM 0 H LYS A 83 -6.518 -2.014 -5.255 1.00 10.00 H new ATOM 0 HA LYS A 83 -4.594 -0.905 -7.251 1.00 10.00 H new ATOM 0 HB2 LYS A 83 -6.215 -2.495 -8.283 1.00 10.00 H new ATOM 0 HB3 LYS A 83 -7.538 -1.573 -7.597 1.00 10.00 H new ATOM 0 HG2 LYS A 83 -6.907 0.413 -8.911 1.00 10.00 H new ATOM 0 HG3 LYS A 83 -5.464 -0.388 -9.501 1.00 10.00 H new ATOM 0 HD2 LYS A 83 -6.874 -2.108 -10.648 1.00 10.00 H new ATOM 0 HD3 LYS A 83 -8.325 -1.339 -10.035 1.00 10.00 H new ATOM 0 HE2 LYS A 83 -7.758 0.758 -11.247 1.00 10.00 H new ATOM 0 HE3 LYS A 83 -6.258 0.048 -11.812 1.00 10.00 H new ATOM 0 HZ1 LYS A 83 -7.965 -0.049 -13.501 1.00 10.00 H new ATOM 0 HZ2 LYS A 83 -7.535 -1.620 -13.019 1.00 10.00 H new ATOM 0 HZ3 LYS A 83 -8.988 -0.932 -12.471 1.00 10.00 H new ATOM 1263 N GLN A 84 -5.341 1.400 -6.654 1.00 10.00 N ATOM 1264 CA GLN A 84 -5.643 2.738 -6.165 1.00 10.00 C ATOM 1265 C GLN A 84 -6.975 3.195 -6.756 1.00 10.00 C ATOM 1266 O GLN A 84 -7.228 2.978 -7.944 1.00 10.00 O ATOM 1267 CB GLN A 84 -4.496 3.689 -6.535 1.00 10.00 C ATOM 1268 CG GLN A 84 -4.515 4.971 -5.686 1.00 10.00 C ATOM 1269 CD GLN A 84 -5.245 6.166 -6.297 1.00 10.00 C ATOM 1270 OE1 GLN A 84 -5.645 6.182 -7.457 1.00 10.00 O ATOM 1271 NE2 GLN A 84 -5.421 7.214 -5.514 1.00 10.00 N ATOM 0 H GLN A 84 -4.567 1.365 -7.317 1.00 10.00 H new ATOM 0 HA GLN A 84 -5.736 2.738 -5.079 1.00 10.00 H new ATOM 0 HB2 GLN A 84 -3.543 3.178 -6.399 1.00 10.00 H new ATOM 0 HB3 GLN A 84 -4.569 3.952 -7.590 1.00 10.00 H new ATOM 0 HG2 GLN A 84 -4.976 4.741 -4.726 1.00 10.00 H new ATOM 0 HG3 GLN A 84 -3.485 5.264 -5.483 1.00 10.00 H new ATOM 0 HE21 GLN A 84 -5.086 7.193 -4.551 1.00 10.00 H new ATOM 0 HE22 GLN A 84 -5.892 8.045 -5.872 1.00 10.00 H new ATOM 1280 N ILE A 85 -7.808 3.846 -5.941 1.00 10.00 N ATOM 1281 CA ILE A 85 -9.141 4.286 -6.344 1.00 10.00 C ATOM 1282 C ILE A 85 -9.156 5.812 -6.446 1.00 10.00 C ATOM 1283 O ILE A 85 -9.634 6.347 -7.447 1.00 10.00 O ATOM 1284 CB ILE A 85 -10.202 3.752 -5.349 1.00 10.00 C ATOM 1285 CG1 ILE A 85 -10.129 2.220 -5.144 1.00 10.00 C ATOM 1286 CG2 ILE A 85 -11.628 4.157 -5.773 1.00 10.00 C ATOM 1287 CD1 ILE A 85 -10.178 1.362 -6.418 1.00 10.00 C ATOM 0 H ILE A 85 -7.573 4.083 -4.977 1.00 10.00 H new ATOM 0 HA ILE A 85 -9.392 3.881 -7.324 1.00 10.00 H new ATOM 0 HB ILE A 85 -9.967 4.219 -4.392 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -9.207 1.989 -4.611 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -10.954 1.921 -4.498 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -12.347 3.766 -5.053 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -11.703 5.244 -5.806 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -11.844 3.748 -6.760 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -10.119 0.307 -6.149 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -11.112 1.550 -6.948 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -9.337 1.619 -7.062 1.00 10.00 H new ATOM 1299 N GLY A 86 -8.632 6.516 -5.439 1.00 10.00 N ATOM 1300 CA GLY A 86 -8.746 7.961 -5.342 1.00 10.00 C ATOM 1301 C GLY A 86 -8.513 8.380 -3.901 1.00 10.00 C ATOM 1302 O GLY A 86 -7.637 7.829 -3.233 1.00 10.00 O ATOM 0 H GLY A 86 -8.116 6.091 -4.668 1.00 10.00 H new ATOM 0 HA2 GLY A 86 -8.018 8.441 -5.996 1.00 10.00 H new ATOM 0 HA3 GLY A 86 -9.733 8.284 -5.673 1.00 10.00 H new ATOM 1306 N GLY A 87 -9.305 9.330 -3.416 1.00 10.00 N ATOM 1307 CA GLY A 87 -9.290 9.773 -2.030 1.00 10.00 C ATOM 1308 C GLY A 87 -10.714 9.967 -1.531 1.00 10.00 C ATOM 1309 O GLY A 87 -11.653 9.393 -2.086 1.00 10.00 O ATOM 0 H GLY A 87 -9.989 9.823 -3.989 1.00 10.00 H new ATOM 0 HA2 GLY A 87 -8.776 9.039 -1.410 1.00 10.00 H new ATOM 0 HA3 GLY A 87 -8.735 10.707 -1.944 1.00 10.00 H new ATOM 1313 N CYS A 88 -10.861 10.770 -0.475 1.00 10.00 N ATOM 1314 CA CYS A 88 -12.118 11.016 0.226 1.00 10.00 C ATOM 1315 C CYS A 88 -13.264 11.348 -0.727 1.00 10.00 C ATOM 1316 O CYS A 88 -14.288 10.668 -0.719 1.00 10.00 O ATOM 1317 CB CYS A 88 -11.915 12.130 1.270 1.00 10.00 C ATOM 1318 SG CYS A 88 -10.929 13.510 0.592 1.00 10.00 S ATOM 0 H CYS A 88 -10.078 11.284 -0.072 1.00 10.00 H new ATOM 0 HA CYS A 88 -12.407 10.096 0.734 1.00 10.00 H new ATOM 0 HB2 CYS A 88 -12.885 12.502 1.600 1.00 10.00 H new ATOM 0 HB3 CYS A 88 -11.415 11.721 2.148 1.00 10.00 H new ATOM 0 HG CYS A 88 -11.109 14.571 1.321 1.00 10.00 H new ATOM 1324 N ASP A 89 -13.083 12.366 -1.570 1.00 10.00 N ATOM 1325 CA ASP A 89 -14.126 12.807 -2.490 1.00 10.00 C ATOM 1326 C ASP A 89 -14.509 11.696 -3.463 1.00 10.00 C ATOM 1327 O ASP A 89 -15.693 11.511 -3.742 1.00 10.00 O ATOM 1328 CB ASP A 89 -13.664 14.049 -3.256 1.00 10.00 C ATOM 1329 CG ASP A 89 -14.713 14.481 -4.294 1.00 10.00 C ATOM 1330 OD1 ASP A 89 -15.741 15.078 -3.904 1.00 10.00 O ATOM 1331 OD2 ASP A 89 -14.491 14.268 -5.507 1.00 10.00 O ATOM 0 H ASP A 89 -12.217 12.902 -1.632 1.00 10.00 H new ATOM 0 HA ASP A 89 -15.010 13.060 -1.904 1.00 10.00 H new ATOM 0 HB2 ASP A 89 -13.483 14.865 -2.556 1.00 10.00 H new ATOM 0 HB3 ASP A 89 -12.718 13.841 -3.755 1.00 10.00 H new ATOM 1336 N THR A 90 -13.531 10.915 -3.927 1.00 10.00 N ATOM 1337 CA THR A 90 -13.765 9.811 -4.839 1.00 10.00 C ATOM 1338 C THR A 90 -14.660 8.761 -4.182 1.00 10.00 C ATOM 1339 O THR A 90 -15.672 8.376 -4.768 1.00 10.00 O ATOM 1340 CB THR A 90 -12.426 9.189 -5.272 1.00 10.00 C ATOM 1341 OG1 THR A 90 -11.402 10.168 -5.391 1.00 10.00 O ATOM 1342 CG2 THR A 90 -12.588 8.428 -6.589 1.00 10.00 C ATOM 0 H THR A 90 -12.550 11.038 -3.674 1.00 10.00 H new ATOM 0 HA THR A 90 -14.274 10.188 -5.726 1.00 10.00 H new ATOM 0 HB THR A 90 -12.125 8.489 -4.492 1.00 10.00 H new ATOM 0 HG1 THR A 90 -10.953 10.069 -6.257 1.00 10.00 H new ATOM 0 HG21 THR A 90 -11.631 7.995 -6.879 1.00 10.00 H new ATOM 0 HG22 THR A 90 -13.322 7.633 -6.462 1.00 10.00 H new ATOM 0 HG23 THR A 90 -12.927 9.113 -7.366 1.00 10.00 H new ATOM 1350 N VAL A 91 -14.325 8.295 -2.974 1.00 10.00 N ATOM 1351 CA VAL A 91 -15.111 7.236 -2.350 1.00 10.00 C ATOM 1352 C VAL A 91 -16.485 7.757 -1.926 1.00 10.00 C ATOM 1353 O VAL A 91 -17.458 7.019 -2.068 1.00 10.00 O ATOM 1354 CB VAL A 91 -14.345 6.512 -1.224 1.00 10.00 C ATOM 1355 CG1 VAL A 91 -13.145 5.751 -1.811 1.00 10.00 C ATOM 1356 CG2 VAL A 91 -13.848 7.422 -0.094 1.00 10.00 C ATOM 0 H VAL A 91 -13.534 8.627 -2.423 1.00 10.00 H new ATOM 0 HA VAL A 91 -15.288 6.464 -3.099 1.00 10.00 H new ATOM 0 HB VAL A 91 -15.071 5.834 -0.776 1.00 10.00 H new ATOM 0 HG11 VAL A 91 -12.609 5.242 -1.009 1.00 10.00 H new ATOM 0 HG12 VAL A 91 -13.499 5.016 -2.534 1.00 10.00 H new ATOM 0 HG13 VAL A 91 -12.475 6.454 -2.306 1.00 10.00 H new ATOM 0 HG21 VAL A 91 -13.322 6.824 0.650 1.00 10.00 H new ATOM 0 HG22 VAL A 91 -13.170 8.172 -0.502 1.00 10.00 H new ATOM 0 HG23 VAL A 91 -14.698 7.918 0.374 1.00 10.00 H new ATOM 1366 N VAL A 92 -16.611 9.015 -1.485 1.00 10.00 N ATOM 1367 CA VAL A 92 -17.914 9.582 -1.148 1.00 10.00 C ATOM 1368 C VAL A 92 -18.775 9.647 -2.420 1.00 10.00 C ATOM 1369 O VAL A 92 -19.939 9.247 -2.382 1.00 10.00 O ATOM 1370 CB VAL A 92 -17.722 10.954 -0.461 1.00 10.00 C ATOM 1371 CG1 VAL A 92 -19.036 11.733 -0.297 1.00 10.00 C ATOM 1372 CG2 VAL A 92 -17.113 10.780 0.942 1.00 10.00 C ATOM 0 H VAL A 92 -15.827 9.654 -1.355 1.00 10.00 H new ATOM 0 HA VAL A 92 -18.445 8.952 -0.434 1.00 10.00 H new ATOM 0 HB VAL A 92 -17.056 11.517 -1.116 1.00 10.00 H new ATOM 0 HG11 VAL A 92 -18.835 12.687 0.191 1.00 10.00 H new ATOM 0 HG12 VAL A 92 -19.477 11.913 -1.277 1.00 10.00 H new ATOM 0 HG13 VAL A 92 -19.729 11.153 0.312 1.00 10.00 H new ATOM 0 HG21 VAL A 92 -16.986 11.757 1.407 1.00 10.00 H new ATOM 0 HG22 VAL A 92 -17.777 10.170 1.554 1.00 10.00 H new ATOM 0 HG23 VAL A 92 -16.143 10.289 0.859 1.00 10.00 H new ATOM 1382 N GLU A 93 -18.220 10.084 -3.556 1.00 10.00 N ATOM 1383 CA GLU A 93 -18.957 10.159 -4.813 1.00 10.00 C ATOM 1384 C GLU A 93 -19.383 8.759 -5.261 1.00 10.00 C ATOM 1385 O GLU A 93 -20.551 8.539 -5.577 1.00 10.00 O ATOM 1386 CB GLU A 93 -18.089 10.842 -5.882 1.00 10.00 C ATOM 1387 CG GLU A 93 -18.863 11.073 -7.187 1.00 10.00 C ATOM 1388 CD GLU A 93 -17.926 11.547 -8.305 1.00 10.00 C ATOM 1389 OE1 GLU A 93 -17.817 12.770 -8.550 1.00 10.00 O ATOM 1390 OE2 GLU A 93 -17.320 10.676 -8.968 1.00 10.00 O ATOM 0 H GLU A 93 -17.251 10.394 -3.625 1.00 10.00 H new ATOM 0 HA GLU A 93 -19.859 10.754 -4.669 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -17.728 11.797 -5.500 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -17.212 10.227 -6.084 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -19.358 10.150 -7.489 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -19.645 11.815 -7.024 1.00 10.00 H new ATOM 1397 N LYS A 94 -18.462 7.791 -5.259 1.00 10.00 N ATOM 1398 CA LYS A 94 -18.769 6.416 -5.649 1.00 10.00 C ATOM 1399 C LYS A 94 -19.787 5.801 -4.693 1.00 10.00 C ATOM 1400 O LYS A 94 -20.599 4.994 -5.140 1.00 10.00 O ATOM 1401 CB LYS A 94 -17.476 5.585 -5.743 1.00 10.00 C ATOM 1402 CG LYS A 94 -16.601 6.021 -6.934 1.00 10.00 C ATOM 1403 CD LYS A 94 -15.233 5.316 -6.954 1.00 10.00 C ATOM 1404 CE LYS A 94 -15.287 3.844 -7.396 1.00 10.00 C ATOM 1405 NZ LYS A 94 -15.429 3.694 -8.868 1.00 10.00 N ATOM 0 H LYS A 94 -17.490 7.939 -4.989 1.00 10.00 H new ATOM 0 HA LYS A 94 -19.224 6.418 -6.639 1.00 10.00 H new ATOM 0 HB2 LYS A 94 -16.909 5.689 -4.818 1.00 10.00 H new ATOM 0 HB3 LYS A 94 -17.729 4.530 -5.845 1.00 10.00 H new ATOM 0 HG2 LYS A 94 -17.128 5.809 -7.864 1.00 10.00 H new ATOM 0 HG3 LYS A 94 -16.449 7.100 -6.893 1.00 10.00 H new ATOM 0 HD2 LYS A 94 -14.567 5.860 -7.623 1.00 10.00 H new ATOM 0 HD3 LYS A 94 -14.796 5.368 -5.957 1.00 10.00 H new ATOM 0 HE2 LYS A 94 -14.379 3.337 -7.069 1.00 10.00 H new ATOM 0 HE3 LYS A 94 -16.124 3.351 -6.902 1.00 10.00 H new ATOM 0 HZ1 LYS A 94 -15.392 2.685 -9.119 1.00 10.00 H new ATOM 0 HZ2 LYS A 94 -16.340 4.094 -9.171 1.00 10.00 H new ATOM 0 HZ3 LYS A 94 -14.654 4.198 -9.345 1.00 10.00 H new ATOM 1419 N HIS A 95 -19.794 6.154 -3.406 1.00 10.00 N ATOM 1420 CA HIS A 95 -20.822 5.683 -2.486 1.00 10.00 C ATOM 1421 C HIS A 95 -22.178 6.280 -2.865 1.00 10.00 C ATOM 1422 O HIS A 95 -23.155 5.540 -2.966 1.00 10.00 O ATOM 1423 CB HIS A 95 -20.450 6.006 -1.032 1.00 10.00 C ATOM 1424 CG HIS A 95 -21.484 5.511 -0.050 1.00 10.00 C ATOM 1425 ND1 HIS A 95 -21.915 4.210 0.100 1.00 10.00 N ATOM 1426 CD2 HIS A 95 -22.225 6.280 0.809 1.00 10.00 C ATOM 1427 CE1 HIS A 95 -22.895 4.200 1.020 1.00 10.00 C ATOM 1428 NE2 HIS A 95 -23.119 5.442 1.489 1.00 10.00 N ATOM 0 H HIS A 95 -19.097 6.765 -2.980 1.00 10.00 H new ATOM 0 HA HIS A 95 -20.893 4.598 -2.566 1.00 10.00 H new ATOM 0 HB2 HIS A 95 -19.486 5.555 -0.798 1.00 10.00 H new ATOM 0 HB3 HIS A 95 -20.334 7.084 -0.920 1.00 10.00 H new ATOM 0 HD2 HIS A 95 -22.135 7.348 0.939 1.00 10.00 H new ATOM 0 HE1 HIS A 95 -23.429 3.317 1.339 1.00 10.00 H new ATOM 0 HE2 HIS A 95 -23.801 5.717 2.196 1.00 10.00 H new ATOM 1436 N GLN A 96 -22.248 7.588 -3.136 1.00 10.00 N ATOM 1437 CA GLN A 96 -23.494 8.242 -3.537 1.00 10.00 C ATOM 1438 C GLN A 96 -24.020 7.674 -4.864 1.00 10.00 C ATOM 1439 O GLN A 96 -25.229 7.487 -5.012 1.00 10.00 O ATOM 1440 CB GLN A 96 -23.297 9.764 -3.627 1.00 10.00 C ATOM 1441 CG GLN A 96 -23.165 10.411 -2.238 1.00 10.00 C ATOM 1442 CD GLN A 96 -22.912 11.922 -2.295 1.00 10.00 C ATOM 1443 OE1 GLN A 96 -23.188 12.599 -3.284 1.00 10.00 O ATOM 1444 NE2 GLN A 96 -22.382 12.497 -1.227 1.00 10.00 N ATOM 0 H GLN A 96 -21.447 8.218 -3.083 1.00 10.00 H new ATOM 0 HA GLN A 96 -24.245 8.038 -2.773 1.00 10.00 H new ATOM 0 HB2 GLN A 96 -22.404 9.980 -4.214 1.00 10.00 H new ATOM 0 HB3 GLN A 96 -24.141 10.208 -4.155 1.00 10.00 H new ATOM 0 HG2 GLN A 96 -24.076 10.223 -1.669 1.00 10.00 H new ATOM 0 HG3 GLN A 96 -22.348 9.933 -1.698 1.00 10.00 H new ATOM 0 HE21 GLN A 96 -22.153 11.936 -0.407 1.00 10.00 H new ATOM 0 HE22 GLN A 96 -22.203 13.501 -1.224 1.00 10.00 H new ATOM 1453 N ARG A 97 -23.132 7.342 -5.811 1.00 10.00 N ATOM 1454 CA ARG A 97 -23.491 6.678 -7.070 1.00 10.00 C ATOM 1455 C ARG A 97 -23.802 5.183 -6.895 1.00 10.00 C ATOM 1456 O ARG A 97 -24.109 4.517 -7.884 1.00 10.00 O ATOM 1457 CB ARG A 97 -22.394 6.916 -8.129 1.00 10.00 C ATOM 1458 CG ARG A 97 -22.379 8.385 -8.590 1.00 10.00 C ATOM 1459 CD ARG A 97 -21.670 8.587 -9.938 1.00 10.00 C ATOM 1460 NE ARG A 97 -20.198 8.628 -9.837 1.00 10.00 N ATOM 1461 CZ ARG A 97 -19.349 8.397 -10.851 1.00 10.00 C ATOM 1462 NH1 ARG A 97 -19.781 7.877 -11.998 1.00 10.00 N ATOM 1463 NH2 ARG A 97 -18.065 8.706 -10.725 1.00 10.00 N ATOM 0 H ARG A 97 -22.133 7.529 -5.723 1.00 10.00 H new ATOM 0 HA ARG A 97 -24.419 7.129 -7.422 1.00 10.00 H new ATOM 0 HB2 ARG A 97 -21.421 6.651 -7.715 1.00 10.00 H new ATOM 0 HB3 ARG A 97 -22.564 6.264 -8.986 1.00 10.00 H new ATOM 0 HG2 ARG A 97 -23.405 8.745 -8.668 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -21.885 8.992 -7.832 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -21.956 7.780 -10.613 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -22.020 9.517 -10.386 1.00 10.00 H new ATOM 0 HE ARG A 97 -19.795 8.849 -8.927 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -20.768 7.649 -12.115 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -19.125 7.707 -12.760 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -17.723 9.119 -9.858 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -17.420 8.530 -11.496 1.00 10.00 H new ATOM 1477 N ASN A 98 -23.747 4.653 -5.667 1.00 10.00 N ATOM 1478 CA ASN A 98 -23.880 3.232 -5.333 1.00 10.00 C ATOM 1479 C ASN A 98 -22.978 2.352 -6.214 1.00 10.00 C ATOM 1480 O ASN A 98 -23.364 1.274 -6.661 1.00 10.00 O ATOM 1481 CB ASN A 98 -25.357 2.798 -5.315 1.00 10.00 C ATOM 1482 CG ASN A 98 -25.532 1.411 -4.696 1.00 10.00 C ATOM 1483 OD1 ASN A 98 -24.919 1.086 -3.683 1.00 10.00 O ATOM 1484 ND2 ASN A 98 -26.382 0.570 -5.263 1.00 10.00 N ATOM 0 H ASN A 98 -23.601 5.232 -4.840 1.00 10.00 H new ATOM 0 HA ASN A 98 -23.517 3.084 -4.316 1.00 10.00 H new ATOM 0 HB2 ASN A 98 -25.943 3.524 -4.752 1.00 10.00 H new ATOM 0 HB3 ASN A 98 -25.747 2.794 -6.333 1.00 10.00 H new ATOM 0 HD21 ASN A 98 -26.531 -0.354 -4.859 1.00 10.00 H new ATOM 0 HD22 ASN A 98 -26.888 0.846 -6.104 1.00 10.00 H new ATOM 1491 N GLU A 99 -21.767 2.844 -6.480 1.00 10.00 N ATOM 1492 CA GLU A 99 -20.741 2.201 -7.294 1.00 10.00 C ATOM 1493 C GLU A 99 -19.622 1.659 -6.392 1.00 10.00 C ATOM 1494 O GLU A 99 -19.003 0.641 -6.705 1.00 10.00 O ATOM 1495 CB GLU A 99 -20.222 3.237 -8.305 1.00 10.00 C ATOM 1496 CG GLU A 99 -19.302 2.617 -9.363 1.00 10.00 C ATOM 1497 CD GLU A 99 -18.837 3.670 -10.380 1.00 10.00 C ATOM 1498 OE1 GLU A 99 -19.490 3.838 -11.436 1.00 10.00 O ATOM 1499 OE2 GLU A 99 -17.791 4.309 -10.131 1.00 10.00 O ATOM 0 H GLU A 99 -21.463 3.746 -6.114 1.00 10.00 H new ATOM 0 HA GLU A 99 -21.147 1.349 -7.840 1.00 10.00 H new ATOM 0 HB2 GLU A 99 -21.069 3.713 -8.799 1.00 10.00 H new ATOM 0 HB3 GLU A 99 -19.682 4.020 -7.773 1.00 10.00 H new ATOM 0 HG2 GLU A 99 -18.435 2.169 -8.877 1.00 10.00 H new ATOM 0 HG3 GLU A 99 -19.828 1.815 -9.881 1.00 10.00 H new ATOM 1506 N LEU A 100 -19.407 2.291 -5.228 1.00 10.00 N ATOM 1507 CA LEU A 100 -18.453 1.815 -4.228 1.00 10.00 C ATOM 1508 C LEU A 100 -18.878 0.443 -3.698 1.00 10.00 C ATOM 1509 O LEU A 100 -18.023 -0.409 -3.481 1.00 10.00 O ATOM 1510 CB LEU A 100 -18.339 2.835 -3.077 1.00 10.00 C ATOM 1511 CG LEU A 100 -17.218 2.527 -2.065 1.00 10.00 C ATOM 1512 CD1 LEU A 100 -15.826 2.664 -2.694 1.00 10.00 C ATOM 1513 CD2 LEU A 100 -17.320 3.476 -0.866 1.00 10.00 C ATOM 0 H LEU A 100 -19.893 3.147 -4.958 1.00 10.00 H new ATOM 0 HA LEU A 100 -17.474 1.711 -4.695 1.00 10.00 H new ATOM 0 HB2 LEU A 100 -18.169 3.825 -3.500 1.00 10.00 H new ATOM 0 HB3 LEU A 100 -19.290 2.875 -2.547 1.00 10.00 H new ATOM 0 HG LEU A 100 -17.347 1.494 -1.742 1.00 10.00 H new ATOM 0 HD11 LEU A 100 -15.065 2.438 -1.947 1.00 10.00 H new ATOM 0 HD12 LEU A 100 -15.733 1.968 -3.528 1.00 10.00 H new ATOM 0 HD13 LEU A 100 -15.689 3.683 -3.055 1.00 10.00 H new ATOM 0 HD21 LEU A 100 -16.524 3.252 -0.156 1.00 10.00 H new ATOM 0 HD22 LEU A 100 -17.221 4.506 -1.208 1.00 10.00 H new ATOM 0 HD23 LEU A 100 -18.287 3.346 -0.380 1.00 10.00 H new ATOM 1525 N LEU A 101 -20.184 0.216 -3.501 1.00 10.00 N ATOM 1526 CA LEU A 101 -20.687 -1.050 -2.966 1.00 10.00 C ATOM 1527 C LEU A 101 -20.343 -2.222 -3.892 1.00 10.00 C ATOM 1528 O LEU A 101 -19.677 -3.137 -3.415 1.00 10.00 O ATOM 1529 CB LEU A 101 -22.197 -0.983 -2.646 1.00 10.00 C ATOM 1530 CG LEU A 101 -22.552 -0.999 -1.150 1.00 10.00 C ATOM 1531 CD1 LEU A 101 -22.161 -2.323 -0.477 1.00 10.00 C ATOM 1532 CD2 LEU A 101 -21.931 0.185 -0.403 1.00 10.00 C ATOM 0 H LEU A 101 -20.913 0.899 -3.707 1.00 10.00 H new ATOM 0 HA LEU A 101 -20.179 -1.229 -2.019 1.00 10.00 H new ATOM 0 HB2 LEU A 101 -22.606 -0.075 -3.090 1.00 10.00 H new ATOM 0 HB3 LEU A 101 -22.692 -1.825 -3.129 1.00 10.00 H new ATOM 0 HG LEU A 101 -23.636 -0.903 -1.093 1.00 10.00 H new ATOM 0 HD11 LEU A 101 -22.431 -2.288 0.579 1.00 10.00 H new ATOM 0 HD12 LEU A 101 -22.688 -3.146 -0.959 1.00 10.00 H new ATOM 0 HD13 LEU A 101 -21.086 -2.476 -0.572 1.00 10.00 H new ATOM 0 HD21 LEU A 101 -22.207 0.136 0.650 1.00 10.00 H new ATOM 0 HD22 LEU A 101 -20.846 0.145 -0.496 1.00 10.00 H new ATOM 0 HD23 LEU A 101 -22.298 1.118 -0.831 1.00 10.00 H new ATOM 1544 N PRO A 102 -20.711 -2.226 -5.191 1.00 10.00 N ATOM 1545 CA PRO A 102 -20.265 -3.244 -6.137 1.00 10.00 C ATOM 1546 C PRO A 102 -18.758 -3.512 -6.084 1.00 10.00 C ATOM 1547 O PRO A 102 -18.348 -4.672 -6.041 1.00 10.00 O ATOM 1548 CB PRO A 102 -20.697 -2.734 -7.516 1.00 10.00 C ATOM 1549 CG PRO A 102 -21.972 -1.960 -7.202 1.00 10.00 C ATOM 1550 CD PRO A 102 -21.675 -1.343 -5.837 1.00 10.00 C ATOM 0 HA PRO A 102 -20.712 -4.208 -5.892 1.00 10.00 H new ATOM 0 HB2 PRO A 102 -19.937 -2.097 -7.968 1.00 10.00 H new ATOM 0 HB3 PRO A 102 -20.881 -3.553 -8.211 1.00 10.00 H new ATOM 0 HG2 PRO A 102 -22.176 -1.197 -7.953 1.00 10.00 H new ATOM 0 HG3 PRO A 102 -22.843 -2.615 -7.168 1.00 10.00 H new ATOM 0 HD2 PRO A 102 -21.270 -0.337 -5.945 1.00 10.00 H new ATOM 0 HD3 PRO A 102 -22.584 -1.258 -5.242 1.00 10.00 H new ATOM 1558 N LEU A 103 -17.933 -2.458 -6.052 1.00 10.00 N ATOM 1559 CA LEU A 103 -16.481 -2.590 -6.000 1.00 10.00 C ATOM 1560 C LEU A 103 -16.035 -3.280 -4.703 1.00 10.00 C ATOM 1561 O LEU A 103 -15.183 -4.167 -4.737 1.00 10.00 O ATOM 1562 CB LEU A 103 -15.858 -1.192 -6.166 1.00 10.00 C ATOM 1563 CG LEU A 103 -14.325 -1.148 -6.040 1.00 10.00 C ATOM 1564 CD1 LEU A 103 -13.606 -2.051 -7.050 1.00 10.00 C ATOM 1565 CD2 LEU A 103 -13.851 0.296 -6.228 1.00 10.00 C ATOM 0 H LEU A 103 -18.259 -1.491 -6.062 1.00 10.00 H new ATOM 0 HA LEU A 103 -16.133 -3.227 -6.813 1.00 10.00 H new ATOM 0 HB2 LEU A 103 -16.139 -0.798 -7.143 1.00 10.00 H new ATOM 0 HB3 LEU A 103 -16.289 -0.527 -5.418 1.00 10.00 H new ATOM 0 HG LEU A 103 -14.074 -1.522 -5.047 1.00 10.00 H new ATOM 0 HD11 LEU A 103 -12.528 -1.972 -6.906 1.00 10.00 H new ATOM 0 HD12 LEU A 103 -13.917 -3.085 -6.900 1.00 10.00 H new ATOM 0 HD13 LEU A 103 -13.860 -1.739 -8.063 1.00 10.00 H new ATOM 0 HD21 LEU A 103 -12.765 0.337 -6.140 1.00 10.00 H new ATOM 0 HD22 LEU A 103 -14.149 0.651 -7.214 1.00 10.00 H new ATOM 0 HD23 LEU A 103 -14.301 0.929 -5.463 1.00 10.00 H new ATOM 1577 N LEU A 104 -16.623 -2.914 -3.562 1.00 10.00 N ATOM 1578 CA LEU A 104 -16.318 -3.531 -2.274 1.00 10.00 C ATOM 1579 C LEU A 104 -16.767 -4.991 -2.241 1.00 10.00 C ATOM 1580 O LEU A 104 -16.027 -5.825 -1.715 1.00 10.00 O ATOM 1581 CB LEU A 104 -16.987 -2.755 -1.130 1.00 10.00 C ATOM 1582 CG LEU A 104 -16.326 -1.403 -0.799 1.00 10.00 C ATOM 1583 CD1 LEU A 104 -17.258 -0.597 0.109 1.00 10.00 C ATOM 1584 CD2 LEU A 104 -14.975 -1.578 -0.094 1.00 10.00 C ATOM 0 H LEU A 104 -17.327 -2.178 -3.508 1.00 10.00 H new ATOM 0 HA LEU A 104 -15.237 -3.499 -2.141 1.00 10.00 H new ATOM 0 HB2 LEU A 104 -18.031 -2.580 -1.389 1.00 10.00 H new ATOM 0 HB3 LEU A 104 -16.981 -3.376 -0.235 1.00 10.00 H new ATOM 0 HG LEU A 104 -16.150 -0.881 -1.740 1.00 10.00 H new ATOM 0 HD11 LEU A 104 -16.795 0.361 0.347 1.00 10.00 H new ATOM 0 HD12 LEU A 104 -18.205 -0.426 -0.402 1.00 10.00 H new ATOM 0 HD13 LEU A 104 -17.438 -1.152 1.030 1.00 10.00 H new ATOM 0 HD21 LEU A 104 -14.546 -0.599 0.120 1.00 10.00 H new ATOM 0 HD22 LEU A 104 -15.119 -2.122 0.839 1.00 10.00 H new ATOM 0 HD23 LEU A 104 -14.298 -2.138 -0.739 1.00 10.00 H new ATOM 1596 N GLN A 105 -17.933 -5.325 -2.808 1.00 10.00 N ATOM 1597 CA GLN A 105 -18.393 -6.709 -2.859 1.00 10.00 C ATOM 1598 C GLN A 105 -17.480 -7.534 -3.759 1.00 10.00 C ATOM 1599 O GLN A 105 -17.175 -8.680 -3.442 1.00 10.00 O ATOM 1600 CB GLN A 105 -19.848 -6.834 -3.344 1.00 10.00 C ATOM 1601 CG GLN A 105 -20.856 -6.183 -2.382 1.00 10.00 C ATOM 1602 CD GLN A 105 -22.275 -6.746 -2.474 1.00 10.00 C ATOM 1603 OE1 GLN A 105 -22.623 -7.522 -3.359 1.00 10.00 O ATOM 1604 NE2 GLN A 105 -23.124 -6.408 -1.516 1.00 10.00 N ATOM 0 H GLN A 105 -18.571 -4.654 -3.236 1.00 10.00 H new ATOM 0 HA GLN A 105 -18.356 -7.091 -1.839 1.00 10.00 H new ATOM 0 HB2 GLN A 105 -19.940 -6.371 -4.326 1.00 10.00 H new ATOM 0 HB3 GLN A 105 -20.097 -7.888 -3.464 1.00 10.00 H new ATOM 0 HG2 GLN A 105 -20.496 -6.306 -1.361 1.00 10.00 H new ATOM 0 HG3 GLN A 105 -20.890 -5.112 -2.582 1.00 10.00 H new ATOM 0 HE21 GLN A 105 -22.833 -5.763 -0.781 1.00 10.00 H new ATOM 0 HE22 GLN A 105 -24.069 -6.793 -1.513 1.00 10.00 H new ATOM 1613 N ASP A 106 -17.013 -6.958 -4.865 1.00 10.00 N ATOM 1614 CA ASP A 106 -16.085 -7.624 -5.773 1.00 10.00 C ATOM 1615 C ASP A 106 -14.732 -7.877 -5.102 1.00 10.00 C ATOM 1616 O ASP A 106 -14.146 -8.945 -5.276 1.00 10.00 O ATOM 1617 CB ASP A 106 -15.901 -6.801 -7.047 1.00 10.00 C ATOM 1618 CG ASP A 106 -14.921 -7.515 -7.989 1.00 10.00 C ATOM 1619 OD1 ASP A 106 -13.831 -6.968 -8.266 1.00 10.00 O ATOM 1620 OD2 ASP A 106 -15.253 -8.626 -8.458 1.00 10.00 O ATOM 0 H ASP A 106 -17.269 -6.014 -5.156 1.00 10.00 H new ATOM 0 HA ASP A 106 -16.514 -8.591 -6.037 1.00 10.00 H new ATOM 0 HB2 ASP A 106 -16.861 -6.662 -7.543 1.00 10.00 H new ATOM 0 HB3 ASP A 106 -15.524 -5.809 -6.799 1.00 10.00 H new ATOM 1625 N ALA A 107 -14.269 -6.936 -4.271 1.00 10.00 N ATOM 1626 CA ALA A 107 -13.101 -7.114 -3.411 1.00 10.00 C ATOM 1627 C ALA A 107 -13.380 -8.045 -2.214 1.00 10.00 C ATOM 1628 O ALA A 107 -12.465 -8.320 -1.437 1.00 10.00 O ATOM 1629 CB ALA A 107 -12.624 -5.739 -2.928 1.00 10.00 C ATOM 0 H ALA A 107 -14.704 -6.018 -4.178 1.00 10.00 H new ATOM 0 HA ALA A 107 -12.320 -7.598 -3.998 1.00 10.00 H new ATOM 0 HB1 ALA A 107 -11.752 -5.861 -2.285 1.00 10.00 H new ATOM 0 HB2 ALA A 107 -12.358 -5.124 -3.787 1.00 10.00 H new ATOM 0 HB3 ALA A 107 -13.423 -5.253 -2.368 1.00 10.00 H new ATOM 1635 N ALA A 108 -14.625 -8.511 -2.047 1.00 10.00 N ATOM 1636 CA ALA A 108 -15.148 -9.230 -0.883 1.00 10.00 C ATOM 1637 C ALA A 108 -14.840 -8.518 0.449 1.00 10.00 C ATOM 1638 O ALA A 108 -14.749 -9.162 1.497 1.00 10.00 O ATOM 1639 CB ALA A 108 -14.700 -10.700 -0.928 1.00 10.00 C ATOM 0 H ALA A 108 -15.336 -8.387 -2.768 1.00 10.00 H new ATOM 0 HA ALA A 108 -16.237 -9.226 -0.935 1.00 10.00 H new ATOM 0 HB1 ALA A 108 -15.093 -11.227 -0.059 1.00 10.00 H new ATOM 0 HB2 ALA A 108 -15.077 -11.168 -1.837 1.00 10.00 H new ATOM 0 HB3 ALA A 108 -13.611 -10.749 -0.920 1.00 10.00 H new ATOM 1645 N ALA A 109 -14.663 -7.193 0.414 1.00 10.00 N ATOM 1646 CA ALA A 109 -14.364 -6.380 1.583 1.00 10.00 C ATOM 1647 C ALA A 109 -15.588 -6.270 2.488 1.00 10.00 C ATOM 1648 O ALA A 109 -15.467 -6.326 3.713 1.00 10.00 O ATOM 1649 CB ALA A 109 -13.947 -4.984 1.122 1.00 10.00 C ATOM 0 H ALA A 109 -14.726 -6.651 -0.448 1.00 10.00 H new ATOM 0 HA ALA A 109 -13.557 -6.849 2.146 1.00 10.00 H new ATOM 0 HB1 ALA A 109 -13.721 -4.366 1.991 1.00 10.00 H new ATOM 0 HB2 ALA A 109 -13.062 -5.059 0.490 1.00 10.00 H new ATOM 0 HB3 ALA A 109 -14.760 -4.530 0.556 1.00 10.00 H new ATOM 1655 N THR A 110 -16.763 -6.086 1.890 1.00 10.00 N ATOM 1656 CA THR A 110 -18.043 -6.081 2.573 1.00 10.00 C ATOM 1657 C THR A 110 -18.486 -7.537 2.722 1.00 10.00 C ATOM 1658 O THR A 110 -18.811 -8.197 1.731 1.00 10.00 O ATOM 1659 CB THR A 110 -19.036 -5.231 1.756 1.00 10.00 C ATOM 1660 OG1 THR A 110 -18.841 -5.435 0.369 1.00 10.00 O ATOM 1661 CG2 THR A 110 -18.834 -3.739 2.019 1.00 10.00 C ATOM 0 H THR A 110 -16.847 -5.932 0.885 1.00 10.00 H new ATOM 0 HA THR A 110 -17.986 -5.636 3.567 1.00 10.00 H new ATOM 0 HB THR A 110 -20.037 -5.538 2.060 1.00 10.00 H new ATOM 0 HG1 THR A 110 -18.792 -6.396 0.183 1.00 10.00 H new ATOM 0 HG21 THR A 110 -19.549 -3.165 1.429 1.00 10.00 H new ATOM 0 HG22 THR A 110 -18.989 -3.532 3.078 1.00 10.00 H new ATOM 0 HG23 THR A 110 -17.820 -3.454 1.738 1.00 10.00 H new ATOM 1669 N ALA A 111 -18.508 -8.047 3.957 1.00 10.00 N ATOM 1670 CA ALA A 111 -18.876 -9.433 4.253 1.00 10.00 C ATOM 1671 C ALA A 111 -20.350 -9.758 3.938 1.00 10.00 C ATOM 1672 O ALA A 111 -20.747 -10.920 4.031 1.00 10.00 O ATOM 1673 CB ALA A 111 -18.543 -9.739 5.718 1.00 10.00 C ATOM 0 H ALA A 111 -18.269 -7.504 4.786 1.00 10.00 H new ATOM 0 HA ALA A 111 -18.292 -10.076 3.595 1.00 10.00 H new ATOM 0 HB1 ALA A 111 -18.815 -10.770 5.945 1.00 10.00 H new ATOM 0 HB2 ALA A 111 -17.475 -9.600 5.885 1.00 10.00 H new ATOM 0 HB3 ALA A 111 -19.102 -9.065 6.367 1.00 10.00 H new ATOM 1679 N LYS A 112 -21.160 -8.758 3.553 1.00 10.00 N ATOM 1680 CA LYS A 112 -22.546 -8.924 3.103 1.00 10.00 C ATOM 1681 C LYS A 112 -22.683 -10.009 2.037 1.00 10.00 C ATOM 1682 O LYS A 112 -23.670 -10.747 2.039 1.00 10.00 O ATOM 1683 CB LYS A 112 -23.072 -7.604 2.511 1.00 10.00 C ATOM 1684 CG LYS A 112 -23.395 -6.531 3.559 1.00 10.00 C ATOM 1685 CD LYS A 112 -23.922 -5.265 2.862 1.00 10.00 C ATOM 1686 CE LYS A 112 -24.660 -4.361 3.858 1.00 10.00 C ATOM 1687 NZ LYS A 112 -25.278 -3.186 3.193 1.00 10.00 N ATOM 0 H LYS A 112 -20.857 -7.784 3.547 1.00 10.00 H new ATOM 0 HA LYS A 112 -23.125 -9.218 3.978 1.00 10.00 H new ATOM 0 HB2 LYS A 112 -22.330 -7.208 1.818 1.00 10.00 H new ATOM 0 HB3 LYS A 112 -23.971 -7.812 1.930 1.00 10.00 H new ATOM 0 HG2 LYS A 112 -24.139 -6.907 4.261 1.00 10.00 H new ATOM 0 HG3 LYS A 112 -22.502 -6.294 4.138 1.00 10.00 H new ATOM 0 HD2 LYS A 112 -23.092 -4.719 2.414 1.00 10.00 H new ATOM 0 HD3 LYS A 112 -24.594 -5.544 2.051 1.00 10.00 H new ATOM 0 HE2 LYS A 112 -25.433 -4.937 4.366 1.00 10.00 H new ATOM 0 HE3 LYS A 112 -23.962 -4.019 4.623 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 -25.766 -2.603 3.902 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 -24.538 -2.621 2.729 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 -25.963 -3.511 2.481 1.00 10.00 H new ATOM 1701 N ASN A 113 -21.721 -10.083 1.117 1.00 10.00 N ATOM 1702 CA ASN A 113 -21.768 -10.956 -0.048 1.00 10.00 C ATOM 1703 C ASN A 113 -20.343 -11.429 -0.350 1.00 10.00 C ATOM 1704 O ASN A 113 -19.600 -10.716 -1.027 1.00 10.00 O ATOM 1705 CB ASN A 113 -22.377 -10.208 -1.242 1.00 10.00 C ATOM 1706 CG ASN A 113 -22.286 -11.003 -2.542 1.00 10.00 C ATOM 1707 OD1 ASN A 113 -22.008 -12.201 -2.559 1.00 10.00 O ATOM 1708 ND2 ASN A 113 -22.504 -10.339 -3.658 1.00 10.00 N ATOM 0 H ASN A 113 -20.870 -9.523 1.165 1.00 10.00 H new ATOM 0 HA ASN A 113 -22.399 -11.823 0.147 1.00 10.00 H new ATOM 0 HB2 ASN A 113 -23.422 -9.984 -1.030 1.00 10.00 H new ATOM 0 HB3 ASN A 113 -21.865 -9.254 -1.367 1.00 10.00 H new ATOM 0 HD21 ASN A 113 -22.444 -10.818 -4.557 1.00 10.00 H new ATOM 0 HD22 ASN A 113 -22.733 -9.346 -3.624 1.00 10.00 H new ATOM 1715 N PRO A 114 -19.934 -12.608 0.148 1.00 10.00 N ATOM 1716 CA PRO A 114 -18.582 -13.126 -0.041 1.00 10.00 C ATOM 1717 C PRO A 114 -18.333 -13.682 -1.457 1.00 10.00 C ATOM 1718 O PRO A 114 -17.242 -14.198 -1.711 1.00 10.00 O ATOM 1719 CB PRO A 114 -18.431 -14.207 1.038 1.00 10.00 C ATOM 1720 CG PRO A 114 -19.848 -14.753 1.193 1.00 10.00 C ATOM 1721 CD PRO A 114 -20.713 -13.511 0.989 1.00 10.00 C ATOM 0 HA PRO A 114 -17.839 -12.334 0.055 1.00 10.00 H new ATOM 0 HB2 PRO A 114 -17.732 -14.985 0.732 1.00 10.00 H new ATOM 0 HB3 PRO A 114 -18.056 -13.791 1.973 1.00 10.00 H new ATOM 0 HG2 PRO A 114 -20.067 -15.524 0.455 1.00 10.00 H new ATOM 0 HG3 PRO A 114 -20.005 -15.198 2.175 1.00 10.00 H new ATOM 0 HD2 PRO A 114 -21.659 -13.769 0.512 1.00 10.00 H new ATOM 0 HD3 PRO A 114 -20.954 -13.043 1.944 1.00 10.00 H new ATOM 1729 N ALA A 115 -19.306 -13.602 -2.378 1.00 10.00 N ATOM 1730 CA ALA A 115 -19.274 -14.276 -3.675 1.00 10.00 C ATOM 1731 C ALA A 115 -19.326 -13.288 -4.856 1.00 10.00 C ATOM 1732 O ALA A 115 -19.639 -13.703 -5.974 1.00 10.00 O ATOM 1733 CB ALA A 115 -20.406 -15.312 -3.716 1.00 10.00 C ATOM 0 H ALA A 115 -20.154 -13.053 -2.233 1.00 10.00 H new ATOM 0 HA ALA A 115 -18.320 -14.790 -3.788 1.00 10.00 H new ATOM 0 HB1 ALA A 115 -20.396 -15.824 -4.678 1.00 10.00 H new ATOM 0 HB2 ALA A 115 -20.263 -16.039 -2.916 1.00 10.00 H new ATOM 0 HB3 ALA A 115 -21.364 -14.810 -3.583 1.00 10.00 H new ATOM 1739 N GLN A 116 -18.983 -12.013 -4.612 1.00 10.00 N ATOM 1740 CA GLN A 116 -18.910 -10.908 -5.579 1.00 10.00 C ATOM 1741 C GLN A 116 -20.303 -10.465 -6.053 1.00 10.00 C ATOM 1742 O GLN A 116 -21.271 -11.229 -5.992 1.00 10.00 O ATOM 1743 CB GLN A 116 -17.981 -11.226 -6.772 1.00 10.00 C ATOM 1744 CG GLN A 116 -16.562 -11.658 -6.368 1.00 10.00 C ATOM 1745 CD GLN A 116 -15.798 -12.240 -7.557 1.00 10.00 C ATOM 1746 OE1 GLN A 116 -15.704 -13.456 -7.716 1.00 10.00 O ATOM 1747 NE2 GLN A 116 -15.245 -11.414 -8.430 1.00 10.00 N ATOM 0 H GLN A 116 -18.733 -11.707 -3.672 1.00 10.00 H new ATOM 0 HA GLN A 116 -18.464 -10.067 -5.048 1.00 10.00 H new ATOM 0 HB2 GLN A 116 -18.433 -12.018 -7.369 1.00 10.00 H new ATOM 0 HB3 GLN A 116 -17.913 -10.345 -7.410 1.00 10.00 H new ATOM 0 HG2 GLN A 116 -16.019 -10.802 -5.968 1.00 10.00 H new ATOM 0 HG3 GLN A 116 -16.619 -12.400 -5.571 1.00 10.00 H new ATOM 0 HE21 GLN A 116 -15.323 -10.406 -8.298 1.00 10.00 H new ATOM 0 HE22 GLN A 116 -14.741 -11.786 -9.235 1.00 10.00 H new ATOM 1756 N LEU A 117 -20.409 -9.207 -6.501 1.00 10.00 N ATOM 1757 CA LEU A 117 -21.648 -8.638 -7.035 1.00 10.00 C ATOM 1758 C LEU A 117 -22.058 -9.472 -8.249 1.00 10.00 C ATOM 1759 O LEU A 117 -21.267 -9.544 -9.215 1.00 10.00 O ATOM 1760 CB LEU A 117 -21.440 -7.147 -7.387 1.00 10.00 C ATOM 1761 CG LEU A 117 -22.710 -6.283 -7.537 1.00 10.00 C ATOM 1762 CD1 LEU A 117 -23.738 -6.805 -8.545 1.00 10.00 C ATOM 1763 CD2 LEU A 117 -23.392 -6.052 -6.185 1.00 10.00 C ATOM 1764 OXT LEU A 117 -23.144 -10.086 -8.229 1.00 10.00 O ATOM 0 H LEU A 117 -19.628 -8.551 -6.502 1.00 10.00 H new ATOM 0 HA LEU A 117 -22.449 -8.672 -6.296 1.00 10.00 H new ATOM 0 HB2 LEU A 117 -20.814 -6.700 -6.615 1.00 10.00 H new ATOM 0 HB3 LEU A 117 -20.881 -7.093 -8.321 1.00 10.00 H new ATOM 0 HG LEU A 117 -22.341 -5.340 -7.941 1.00 10.00 H new ATOM 0 HD11 LEU A 117 -24.592 -6.129 -8.577 1.00 10.00 H new ATOM 0 HD12 LEU A 117 -23.282 -6.861 -9.534 1.00 10.00 H new ATOM 0 HD13 LEU A 117 -24.072 -7.798 -8.243 1.00 10.00 H new ATOM 0 HD21 LEU A 117 -24.283 -5.440 -6.327 1.00 10.00 H new ATOM 0 HD22 LEU A 117 -23.676 -7.011 -5.752 1.00 10.00 H new ATOM 0 HD23 LEU A 117 -22.703 -5.540 -5.513 1.00 10.00 H new TER 1776 LEU A 117 END