USER MOD reduce.3.24.130724 H: found=0, std=0, add=433, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 434 hydrogens (0 hets) HEADER METAL-BINDING PROTEIN 17-FEB-97 1QLI TITLE QUAIL CYSTEINE AND GLYCINE-RICH PROTEIN, NMR, MINIMIZED TITLE 2 AVERAGE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: CYSTEINE AND GLYCINE-RICH PROTEIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: C-TERMINAL LIM DOMAIN RESIDUES 82 - 194; COMPND 5 SYNONYM: QCRP2(LIM2), ZN(II)-QCRP2(LIM2); COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: COTURNIX JAPONICA; SOURCE 3 ORGANISM_COMMON: JAPANESE QUAIL; SOURCE 4 ORGANISM_TAXID: 93934; SOURCE 5 CELL_LINE: BL21; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) PLYSS; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET3D-QCRP2(LIM2) KEYWDS LIM DOMAIN CONTAINING PROTEINS, METAL-BINDING PROTEIN EXPDTA SOLUTION NMR AUTHOR R.KONRAT,R.WEISKIRCHEN,B.KRAUTLER,K.BISTER REVDAT 2 24-FEB-09 1QLI 1 VERSN REVDAT 1 20-AUG-97 1QLI 0 JRNL AUTH R.KONRAT,R.WEISKIRCHEN,B.KRAUTLER,K.BISTER JRNL TITL SOLUTION STRUCTURE OF THE CARBOXYL-TERMINAL LIM JRNL TITL 2 DOMAIN FROM QUAIL CYSTEINE-RICH PROTEIN CRP2. JRNL REF J.BIOL.CHEM. V. 272 12001 1997 JRNL REFN ISSN 0021-9258 JRNL PMID 9115265 JRNL DOI 10.1074/JBC.272.18.12001 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1QLI COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 299 REMARK 210 PH : 7.2 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D 15N-NOESY-HSQC, 3D 15N- REMARK 210 TOCSY-HSQC, 2D NOESY, 2D REMARK 210 TOCSY, 2D X-FILTERED NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ REMARK 210 SPECTROMETER MODEL : UNITYPLUS 500 REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : DG/SA/EM 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 MET A 82 REMARK 465 ASP A 83 REMARK 465 ARG A 84 REMARK 465 GLY A 85 REMARK 465 GLU A 86 REMARK 465 ARG A 87 REMARK 465 LEU A 88 REMARK 465 GLY A 89 REMARK 465 ILE A 90 REMARK 465 LYS A 91 REMARK 465 PRO A 92 REMARK 465 GLU A 93 REMARK 465 SER A 94 REMARK 465 SER A 95 REMARK 465 PRO A 96 REMARK 465 SER A 97 REMARK 465 PRO A 98 REMARK 465 HIS A 99 REMARK 465 ARG A 100 REMARK 465 PRO A 101 REMARK 465 THR A 102 REMARK 465 THR A 103 REMARK 465 ASN A 104 REMARK 465 PRO A 105 REMARK 465 ASN A 106 REMARK 465 THR A 107 REMARK 465 SER A 108 REMARK 465 LYS A 109 REMARK 465 PHE A 110 REMARK 465 ALA A 111 REMARK 465 GLN A 112 REMARK 465 LYS A 113 REMARK 465 PHE A 114 REMARK 465 GLY A 115 REMARK 465 GLY A 116 REMARK 465 PHE A 176 REMARK 465 GLY A 177 REMARK 465 PRO A 178 REMARK 465 LYS A 179 REMARK 465 GLY A 180 REMARK 465 PHE A 181 REMARK 465 GLY A 182 REMARK 465 TYR A 183 REMARK 465 GLY A 184 REMARK 465 GLN A 185 REMARK 465 GLY A 186 REMARK 465 ALA A 187 REMARK 465 GLY A 188 REMARK 465 ALA A 189 REMARK 465 LEU A 190 REMARK 465 VAL A 191 REMARK 465 HIS A 192 REMARK 465 ALA A 193 REMARK 465 GLN A 194 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 SER A 121 CB SER A 121 OG 0.114 REMARK 500 SER A 126 CB SER A 126 OG 0.112 REMARK 500 HIS A 141 CG HIS A 141 CD2 0.058 REMARK 500 SER A 156 CB SER A 156 OG 0.113 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG A 122 -62.40 -101.31 REMARK 500 TYR A 128 -25.35 -160.17 REMARK 500 ALA A 129 88.85 -163.23 REMARK 500 ALA A 130 -115.22 -160.87 REMARK 500 ASN A 143 -27.64 173.12 REMARK 500 SER A 156 155.24 76.22 REMARK 500 THR A 158 113.57 -172.90 REMARK 500 LEU A 159 -141.84 -168.09 REMARK 500 GLU A 165 -142.10 -135.00 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 195 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 147 SG REMARK 620 2 CYS A 150 SG 106.8 REMARK 620 3 CYS A 168 SG 108.3 111.1 REMARK 620 4 CYS A 171 SG 111.3 109.7 109.6 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 196 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 120 SG REMARK 620 2 CYS A 123 SG 107.6 REMARK 620 3 HIS A 141 ND1 108.9 108.7 REMARK 620 4 CYS A 144 SG 111.1 109.2 111.4 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: ZN1 REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: FIRST ZINC BINDING SITE. REMARK 800 SITE_IDENTIFIER: ZN2 REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: SECOND ZINC BINDING SITE. REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 195 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 196 DBREF 1QLI A 82 194 UNP Q05158 CSRP2_COTJA 81 193 SEQRES 1 A 113 MET ASP ARG GLY GLU ARG LEU GLY ILE LYS PRO GLU SER SEQRES 2 A 113 SER PRO SER PRO HIS ARG PRO THR THR ASN PRO ASN THR SEQRES 3 A 113 SER LYS PHE ALA GLN LYS PHE GLY GLY ALA GLU LYS CYS SEQRES 4 A 113 SER ARG CYS GLY ASP SER VAL TYR ALA ALA GLU LYS VAL SEQRES 5 A 113 ILE GLY ALA GLY LYS PRO TRP HIS LYS ASN CYS PHE ARG SEQRES 6 A 113 CYS ALA LYS CYS GLY LYS SER LEU GLU SER THR THR LEU SEQRES 7 A 113 THR GLU LYS GLU GLY GLU ILE TYR CYS LYS GLY CYS TYR SEQRES 8 A 113 ALA LYS ASN PHE GLY PRO LYS GLY PHE GLY TYR GLY GLN SEQRES 9 A 113 GLY ALA GLY ALA LEU VAL HIS ALA GLN HET ZN A 195 1 HET ZN A 196 1 HETNAM ZN ZINC ION FORMUL 2 ZN 2(ZN 2+) HELIX 1 1 GLY A 170 LYS A 174 1 5 SHEET 1 A 2 GLU A 118 CYS A 120 0 SHEET 2 A 2 GLY A 124 TYR A 128 -1 SHEET 1 B 2 LYS A 132 GLY A 135 0 SHEET 2 B 2 LYS A 138 LYS A 142 -1 SHEET 1 C 2 PHE A 145 CYS A 147 0 SHEET 2 C 2 LYS A 152 LEU A 154 -1 SHEET 1 D 2 THR A 160 LYS A 162 0 SHEET 2 D 2 GLU A 165 LYS A 169 -1 LINK ZN ZN A 195 SG CYS A 147 1555 1555 2.27 LINK ZN ZN A 195 SG CYS A 150 1555 1555 2.29 LINK ZN ZN A 195 SG CYS A 168 1555 1555 2.28 LINK ZN ZN A 195 SG CYS A 171 1555 1555 2.28 LINK ZN ZN A 196 SG CYS A 120 1555 1555 2.28 LINK ZN ZN A 196 SG CYS A 123 1555 1555 2.29 LINK ZN ZN A 196 ND1 HIS A 141 1555 1555 2.00 LINK ZN ZN A 196 SG CYS A 144 1555 1555 2.30 SITE *** ZN1 4 CYS A 120 CYS A 123 HIS A 141 CYS A 144 SITE *** ZN2 4 CYS A 147 CYS A 150 CYS A 168 CYS A 171 SITE *** AC1 4 CYS A 147 CYS A 150 CYS A 168 CYS A 171 SITE *** AC2 4 CYS A 120 CYS A 123 HIS A 141 CYS A 144 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 NoAdj-H: A 141 HIS HD1 : A 141 HIS ND1 : A 196 ZNZN :(H bumps) USER MOD Set 1.1: A 162 LYS NZ :NH3+ 163:sc= -0.426! (180deg=-1.66) USER MOD Set 1.2: A 172 TYR OH : rot 165:sc= 0.789 USER MOD Set 2.1: A 158 THR OG1 : rot 180:sc= 0.148 USER MOD Set 2.2: A 169 LYS NZ :NH3+ 163:sc= 0.152 (180deg=0.0441) USER MOD Set 3.1: A 152 LYS NZ :NH3+ 153:sc= -0.527 (180deg=-0.0773) USER MOD Set 3.2: A 174 LYS NZ :NH3+ -153:sc= -0.763 (180deg=-1.03) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.737) USER MOD Single : A 138 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.032) USER MOD Single : A 142 LYS NZ :NH3+ 162:sc= 0.0155 (180deg=0) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.313 F(o=-0.99,f=-0.31) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot 32:sc= 0.0522 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot -58:sc= 0.181 USER MOD Single : A 160 THR OG1 : rot 180:sc=-0.00803 USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 175 ASN : amide:sc= -0.0634 X(o=-0.063,f=0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 117 -19.304 -6.054 -3.273 1.00 0.00 N ATOM 2 CA ALA A 117 -19.733 -7.030 -2.283 1.00 0.00 C ATOM 3 C ALA A 117 -18.601 -8.016 -1.966 1.00 0.00 C ATOM 4 O ALA A 117 -18.448 -9.051 -2.603 1.00 0.00 O ATOM 5 CB ALA A 117 -20.958 -7.783 -2.807 1.00 0.00 C ATOM 0 HA ALA A 117 -19.995 -6.507 -1.363 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -21.280 -8.514 -2.066 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -21.767 -7.077 -2.995 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -20.701 -8.295 -3.734 1.00 0.00 H new ATOM 11 N GLU A 118 -17.827 -7.616 -0.936 1.00 0.00 N ATOM 12 CA GLU A 118 -16.717 -8.457 -0.517 1.00 0.00 C ATOM 13 C GLU A 118 -16.278 -8.034 0.884 1.00 0.00 C ATOM 14 O GLU A 118 -16.741 -7.040 1.424 1.00 0.00 O ATOM 15 CB GLU A 118 -15.556 -8.337 -1.516 1.00 0.00 C ATOM 16 CG GLU A 118 -14.921 -6.938 -1.507 1.00 0.00 C ATOM 17 CD GLU A 118 -13.824 -6.850 -0.437 1.00 0.00 C ATOM 18 OE1 GLU A 118 -12.947 -7.712 -0.418 1.00 0.00 O ATOM 19 OE2 GLU A 118 -13.860 -5.918 0.364 1.00 0.00 O ATOM 0 H GLU A 118 -17.951 -6.753 -0.407 1.00 0.00 H new ATOM 0 HA GLU A 118 -17.030 -9.501 -0.493 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -14.795 -9.080 -1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -15.918 -8.563 -2.519 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -14.499 -6.718 -2.488 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.686 -6.186 -1.314 1.00 0.00 H new ATOM 26 N LYS A 119 -15.369 -8.859 1.439 1.00 0.00 N ATOM 27 CA LYS A 119 -14.875 -8.547 2.770 1.00 0.00 C ATOM 28 C LYS A 119 -13.349 -8.423 2.753 1.00 0.00 C ATOM 29 O LYS A 119 -12.632 -9.311 2.308 1.00 0.00 O ATOM 30 CB LYS A 119 -15.329 -9.627 3.762 1.00 0.00 C ATOM 31 CG LYS A 119 -14.530 -10.927 3.625 1.00 0.00 C ATOM 32 CD LYS A 119 -15.221 -12.085 4.347 1.00 0.00 C ATOM 33 CE LYS A 119 -14.364 -13.352 4.335 1.00 0.00 C ATOM 34 NZ LYS A 119 -15.048 -14.491 4.934 1.00 0.00 N ATOM 0 H LYS A 119 -14.986 -9.699 1.006 1.00 0.00 H new ATOM 0 HA LYS A 119 -15.288 -7.590 3.091 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -15.226 -9.247 4.779 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -16.387 -9.837 3.605 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -14.411 -11.173 2.570 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -13.530 -10.786 4.034 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -15.431 -11.798 5.377 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -16.180 -12.290 3.871 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -14.092 -13.594 3.307 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -13.436 -13.164 4.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -14.427 -15.325 4.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -15.285 -14.273 5.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -15.921 -14.689 4.405 1.00 0.00 H new ATOM 48 N CYS A 120 -12.912 -7.247 3.251 1.00 0.00 N ATOM 49 CA CYS A 120 -11.480 -6.999 3.316 1.00 0.00 C ATOM 50 C CYS A 120 -10.865 -7.936 4.362 1.00 0.00 C ATOM 51 O CYS A 120 -11.000 -7.740 5.565 1.00 0.00 O ATOM 52 CB CYS A 120 -11.257 -5.533 3.685 1.00 0.00 C ATOM 53 SG CYS A 120 -9.524 -5.136 3.972 1.00 0.00 S ATOM 0 H CYS A 120 -13.508 -6.494 3.596 1.00 0.00 H new ATOM 0 HA CYS A 120 -11.002 -7.193 2.356 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -11.641 -4.900 2.885 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -11.831 -5.298 4.581 1.00 0.00 H new ATOM 58 N SER A 121 -10.187 -8.966 3.810 1.00 0.00 N ATOM 59 CA SER A 121 -9.573 -9.962 4.678 1.00 0.00 C ATOM 60 C SER A 121 -8.208 -9.491 5.208 1.00 0.00 C ATOM 61 O SER A 121 -7.330 -10.291 5.510 1.00 0.00 O ATOM 62 CB SER A 121 -9.419 -11.271 3.904 1.00 0.00 C ATOM 63 OG SER A 121 -10.805 -11.635 3.363 1.00 0.00 O ATOM 0 H SER A 121 -10.060 -9.117 2.809 1.00 0.00 H new ATOM 0 HA SER A 121 -10.219 -10.114 5.542 1.00 0.00 H new ATOM 0 HB2 SER A 121 -8.705 -11.156 3.089 1.00 0.00 H new ATOM 0 HB3 SER A 121 -9.038 -12.060 4.552 1.00 0.00 H new ATOM 0 HG SER A 121 -10.749 -12.472 2.856 1.00 0.00 H new ATOM 69 N ARG A 122 -8.095 -8.150 5.300 1.00 0.00 N ATOM 70 CA ARG A 122 -6.859 -7.577 5.810 1.00 0.00 C ATOM 71 C ARG A 122 -7.079 -7.171 7.270 1.00 0.00 C ATOM 72 O ARG A 122 -6.446 -7.681 8.187 1.00 0.00 O ATOM 73 CB ARG A 122 -6.455 -6.371 4.956 1.00 0.00 C ATOM 74 CG ARG A 122 -4.935 -6.179 4.917 1.00 0.00 C ATOM 75 CD ARG A 122 -4.360 -5.822 6.291 1.00 0.00 C ATOM 76 NE ARG A 122 -5.041 -4.661 6.840 1.00 0.00 N ATOM 77 CZ ARG A 122 -4.680 -4.202 8.055 1.00 0.00 C ATOM 78 NH1 ARG A 122 -3.713 -4.806 8.742 1.00 0.00 N ATOM 79 NH2 ARG A 122 -5.293 -3.140 8.570 1.00 0.00 N ATOM 0 H ARG A 122 -8.817 -7.479 5.038 1.00 0.00 H new ATOM 0 HA ARG A 122 -6.051 -8.306 5.760 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -6.830 -6.503 3.941 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.924 -5.471 5.354 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -4.465 -7.093 4.555 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.689 -5.390 4.206 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -4.468 -6.669 6.969 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -3.293 -5.618 6.204 1.00 0.00 H new ATOM 0 HE ARG A 122 -5.782 -4.200 6.313 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -3.241 -5.621 8.350 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -3.444 -4.454 9.661 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -6.034 -2.675 8.046 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -5.022 -2.791 9.489 1.00 0.00 H new ATOM 93 N CYS A 123 -8.027 -6.220 7.412 1.00 0.00 N ATOM 94 CA CYS A 123 -8.367 -5.753 8.744 1.00 0.00 C ATOM 95 C CYS A 123 -9.330 -6.751 9.380 1.00 0.00 C ATOM 96 O CYS A 123 -9.168 -7.182 10.516 1.00 0.00 O ATOM 97 CB CYS A 123 -9.015 -4.370 8.656 1.00 0.00 C ATOM 98 SG CYS A 123 -10.364 -4.350 7.474 1.00 0.00 S ATOM 0 H CYS A 123 -8.543 -5.785 6.647 1.00 0.00 H new ATOM 0 HA CYS A 123 -7.468 -5.674 9.355 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -9.386 -4.078 9.638 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -8.265 -3.634 8.367 1.00 0.00 H new ATOM 103 N GLY A 124 -10.339 -7.079 8.551 1.00 0.00 N ATOM 104 CA GLY A 124 -11.343 -8.037 8.992 1.00 0.00 C ATOM 105 C GLY A 124 -12.739 -7.411 9.038 1.00 0.00 C ATOM 106 O GLY A 124 -13.585 -7.791 9.839 1.00 0.00 O ATOM 0 H GLY A 124 -10.471 -6.707 7.611 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -11.350 -8.894 8.318 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -11.079 -8.412 9.981 1.00 0.00 H new ATOM 110 N ASP A 125 -12.915 -6.430 8.128 1.00 0.00 N ATOM 111 CA ASP A 125 -14.200 -5.752 8.060 1.00 0.00 C ATOM 112 C ASP A 125 -14.766 -5.854 6.641 1.00 0.00 C ATOM 113 O ASP A 125 -14.064 -5.689 5.648 1.00 0.00 O ATOM 114 CB ASP A 125 -14.030 -4.281 8.455 1.00 0.00 C ATOM 115 CG ASP A 125 -13.509 -4.180 9.893 1.00 0.00 C ATOM 116 OD1 ASP A 125 -14.307 -4.328 10.818 1.00 0.00 O ATOM 117 OD2 ASP A 125 -12.313 -3.955 10.071 1.00 0.00 O ATOM 0 H ASP A 125 -12.211 -6.109 7.463 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.895 -6.227 8.752 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -13.335 -3.791 7.773 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.984 -3.760 8.368 1.00 0.00 H new ATOM 122 N SER A 126 -16.083 -6.146 6.621 1.00 0.00 N ATOM 123 CA SER A 126 -16.754 -6.256 5.338 1.00 0.00 C ATOM 124 C SER A 126 -16.975 -4.852 4.774 1.00 0.00 C ATOM 125 O SER A 126 -17.278 -3.911 5.498 1.00 0.00 O ATOM 126 CB SER A 126 -18.081 -6.997 5.505 1.00 0.00 C ATOM 127 OG SER A 126 -17.739 -8.434 5.904 1.00 0.00 O ATOM 0 H SER A 126 -16.667 -6.301 7.443 1.00 0.00 H new ATOM 0 HA SER A 126 -16.139 -6.825 4.641 1.00 0.00 H new ATOM 0 HB2 SER A 126 -18.696 -6.520 6.268 1.00 0.00 H new ATOM 0 HB3 SER A 126 -18.653 -6.979 4.577 1.00 0.00 H new ATOM 0 HG SER A 126 -18.566 -8.946 6.024 1.00 0.00 H new ATOM 133 N VAL A 127 -16.798 -4.775 3.441 1.00 0.00 N ATOM 134 CA VAL A 127 -16.953 -3.481 2.800 1.00 0.00 C ATOM 135 C VAL A 127 -17.382 -3.648 1.335 1.00 0.00 C ATOM 136 O VAL A 127 -17.238 -4.704 0.726 1.00 0.00 O ATOM 137 CB VAL A 127 -15.622 -2.721 2.903 1.00 0.00 C ATOM 138 CG1 VAL A 127 -14.525 -3.419 2.093 1.00 0.00 C ATOM 139 CG2 VAL A 127 -15.784 -1.275 2.440 1.00 0.00 C ATOM 0 H VAL A 127 -16.561 -5.554 2.826 1.00 0.00 H new ATOM 0 HA VAL A 127 -17.735 -2.912 3.302 1.00 0.00 H new ATOM 0 HB VAL A 127 -15.323 -2.717 3.951 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -13.594 -2.860 2.184 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -14.379 -4.430 2.473 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -14.820 -3.465 1.045 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -14.828 -0.757 2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -16.116 -1.260 1.402 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -16.523 -0.774 3.065 1.00 0.00 H new ATOM 149 N TYR A 128 -17.930 -2.525 0.825 1.00 0.00 N ATOM 150 CA TYR A 128 -18.382 -2.522 -0.556 1.00 0.00 C ATOM 151 C TYR A 128 -18.499 -1.081 -1.070 1.00 0.00 C ATOM 152 O TYR A 128 -18.408 -0.815 -2.262 1.00 0.00 O ATOM 153 CB TYR A 128 -19.731 -3.246 -0.671 1.00 0.00 C ATOM 154 CG TYR A 128 -20.794 -2.571 0.151 1.00 0.00 C ATOM 155 CD1 TYR A 128 -20.932 -2.865 1.500 1.00 0.00 C ATOM 156 CD2 TYR A 128 -21.649 -1.646 -0.433 1.00 0.00 C ATOM 157 CE1 TYR A 128 -21.910 -2.245 2.261 1.00 0.00 C ATOM 158 CE2 TYR A 128 -22.630 -1.020 0.319 1.00 0.00 C ATOM 159 CZ TYR A 128 -22.767 -1.318 1.672 1.00 0.00 C ATOM 160 OH TYR A 128 -23.750 -0.690 2.432 1.00 0.00 O ATOM 0 H TYR A 128 -18.061 -1.651 1.334 1.00 0.00 H new ATOM 0 HA TYR A 128 -17.652 -3.050 -1.169 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -20.041 -3.274 -1.715 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -19.619 -4.280 -0.344 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -20.271 -3.584 1.961 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -21.549 -1.412 -1.483 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -22.008 -2.480 3.310 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -23.289 -0.301 -0.145 1.00 0.00 H new ATOM 0 HH TYR A 128 -24.258 -0.073 1.865 1.00 0.00 H new ATOM 170 N ALA A 129 -18.704 -0.178 -0.089 1.00 0.00 N ATOM 171 CA ALA A 129 -18.831 1.226 -0.442 1.00 0.00 C ATOM 172 C ALA A 129 -18.638 2.092 0.806 1.00 0.00 C ATOM 173 O ALA A 129 -19.581 2.429 1.512 1.00 0.00 O ATOM 174 CB ALA A 129 -20.208 1.487 -1.062 1.00 0.00 C ATOM 0 H ALA A 129 -18.780 -0.393 0.905 1.00 0.00 H new ATOM 0 HA ALA A 129 -18.065 1.484 -1.173 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -20.295 2.542 -1.324 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -20.324 0.880 -1.960 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -20.986 1.226 -0.344 1.00 0.00 H new ATOM 180 N ALA A 130 -17.350 2.422 1.022 1.00 0.00 N ATOM 181 CA ALA A 130 -17.016 3.245 2.174 1.00 0.00 C ATOM 182 C ALA A 130 -15.633 3.876 1.960 1.00 0.00 C ATOM 183 O ALA A 130 -15.431 4.681 1.058 1.00 0.00 O ATOM 184 CB ALA A 130 -17.047 2.391 3.448 1.00 0.00 C ATOM 0 H ALA A 130 -16.563 2.141 0.437 1.00 0.00 H new ATOM 0 HA ALA A 130 -17.748 4.045 2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -16.796 3.012 4.308 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -18.045 1.972 3.581 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -16.322 1.581 3.361 1.00 0.00 H new ATOM 190 N GLU A 131 -14.702 3.456 2.844 1.00 0.00 N ATOM 191 CA GLU A 131 -13.346 3.977 2.740 1.00 0.00 C ATOM 192 C GLU A 131 -12.505 3.070 1.832 1.00 0.00 C ATOM 193 O GLU A 131 -11.296 3.227 1.707 1.00 0.00 O ATOM 194 CB GLU A 131 -12.710 4.060 4.132 1.00 0.00 C ATOM 195 CG GLU A 131 -13.624 4.759 5.144 1.00 0.00 C ATOM 196 CD GLU A 131 -13.904 6.199 4.697 1.00 0.00 C ATOM 197 OE1 GLU A 131 -13.016 7.040 4.837 1.00 0.00 O ATOM 198 OE2 GLU A 131 -15.005 6.462 4.215 1.00 0.00 O ATOM 0 H GLU A 131 -14.863 2.789 3.599 1.00 0.00 H new ATOM 0 HA GLU A 131 -13.382 4.977 2.307 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -12.481 3.055 4.486 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -11.764 4.598 4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -14.561 4.211 5.238 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -13.155 4.760 6.128 1.00 0.00 H new ATOM 205 N LYS A 132 -13.232 2.113 1.215 1.00 0.00 N ATOM 206 CA LYS A 132 -12.557 1.181 0.326 1.00 0.00 C ATOM 207 C LYS A 132 -11.991 1.913 -0.893 1.00 0.00 C ATOM 208 O LYS A 132 -12.441 2.988 -1.272 1.00 0.00 O ATOM 209 CB LYS A 132 -13.526 0.075 -0.115 1.00 0.00 C ATOM 210 CG LYS A 132 -14.602 0.586 -1.087 1.00 0.00 C ATOM 211 CD LYS A 132 -14.296 0.191 -2.535 1.00 0.00 C ATOM 212 CE LYS A 132 -15.353 0.730 -3.500 1.00 0.00 C ATOM 213 NZ LYS A 132 -15.035 0.439 -4.893 1.00 0.00 N ATOM 0 H LYS A 132 -14.238 1.978 1.316 1.00 0.00 H new ATOM 0 HA LYS A 132 -11.727 0.725 0.866 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -12.963 -0.728 -0.591 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -14.009 -0.352 0.764 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -15.573 0.184 -0.798 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -14.672 1.671 -1.014 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -13.315 0.574 -2.818 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -14.250 -0.895 -2.615 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -16.322 0.295 -3.253 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -15.445 1.808 -3.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -15.916 0.357 -5.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -14.454 1.208 -5.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -14.508 -0.456 -4.949 1.00 0.00 H new ATOM 227 N VAL A 133 -10.971 1.246 -1.467 1.00 0.00 N ATOM 228 CA VAL A 133 -10.324 1.809 -2.641 1.00 0.00 C ATOM 229 C VAL A 133 -10.102 0.705 -3.677 1.00 0.00 C ATOM 230 O VAL A 133 -9.951 -0.466 -3.350 1.00 0.00 O ATOM 231 CB VAL A 133 -8.986 2.447 -2.243 1.00 0.00 C ATOM 232 CG1 VAL A 133 -9.214 3.668 -1.349 1.00 0.00 C ATOM 233 CG2 VAL A 133 -8.094 1.427 -1.527 1.00 0.00 C ATOM 0 H VAL A 133 -10.597 0.353 -1.145 1.00 0.00 H new ATOM 0 HA VAL A 133 -10.960 2.580 -3.075 1.00 0.00 H new ATOM 0 HB VAL A 133 -8.482 2.773 -3.153 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -8.253 4.105 -1.078 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -9.810 4.406 -1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -9.742 3.364 -0.445 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -7.150 1.898 -1.253 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.597 1.072 -0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -7.900 0.584 -2.191 1.00 0.00 H new ATOM 243 N ILE A 134 -10.096 1.165 -4.944 1.00 0.00 N ATOM 244 CA ILE A 134 -9.891 0.223 -6.033 1.00 0.00 C ATOM 245 C ILE A 134 -8.406 0.185 -6.399 1.00 0.00 C ATOM 246 O ILE A 134 -7.834 1.154 -6.883 1.00 0.00 O ATOM 247 CB ILE A 134 -10.741 0.632 -7.244 1.00 0.00 C ATOM 248 CG1 ILE A 134 -12.217 0.298 -6.987 1.00 0.00 C ATOM 249 CG2 ILE A 134 -10.248 -0.067 -8.516 1.00 0.00 C ATOM 250 CD1 ILE A 134 -13.142 0.983 -7.995 1.00 0.00 C ATOM 0 H ILE A 134 -10.225 2.139 -5.219 1.00 0.00 H new ATOM 0 HA ILE A 134 -10.200 -0.774 -5.720 1.00 0.00 H new ATOM 0 HB ILE A 134 -10.642 1.708 -7.389 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -12.359 -0.781 -7.039 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -12.488 0.607 -5.977 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -10.865 0.238 -9.361 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -9.211 0.211 -8.705 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -10.317 -1.147 -8.388 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -14.177 0.720 -7.777 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -13.020 2.064 -7.925 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -12.889 0.654 -9.003 1.00 0.00 H new ATOM 262 N GLY A 135 -7.833 -1.005 -6.130 1.00 0.00 N ATOM 263 CA GLY A 135 -6.425 -1.196 -6.426 1.00 0.00 C ATOM 264 C GLY A 135 -6.237 -1.782 -7.824 1.00 0.00 C ATOM 265 O GLY A 135 -5.596 -2.809 -8.014 1.00 0.00 O ATOM 0 H GLY A 135 -8.311 -1.810 -5.725 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -5.901 -0.243 -6.353 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.980 -1.861 -5.686 1.00 0.00 H new ATOM 269 N ALA A 136 -6.868 -1.061 -8.775 1.00 0.00 N ATOM 270 CA ALA A 136 -6.782 -1.469 -10.169 1.00 0.00 C ATOM 271 C ALA A 136 -7.257 -2.918 -10.369 1.00 0.00 C ATOM 272 O ALA A 136 -6.912 -3.570 -11.347 1.00 0.00 O ATOM 273 CB ALA A 136 -5.341 -1.310 -10.666 1.00 0.00 C ATOM 0 H ALA A 136 -7.422 -0.223 -8.600 1.00 0.00 H new ATOM 0 HA ALA A 136 -7.442 -0.825 -10.750 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -5.280 -1.616 -11.710 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -5.038 -0.267 -10.576 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -4.678 -1.933 -10.066 1.00 0.00 H new ATOM 279 N GLY A 137 -8.069 -3.377 -9.392 1.00 0.00 N ATOM 280 CA GLY A 137 -8.568 -4.737 -9.506 1.00 0.00 C ATOM 281 C GLY A 137 -9.039 -5.307 -8.164 1.00 0.00 C ATOM 282 O GLY A 137 -10.140 -5.832 -8.046 1.00 0.00 O ATOM 0 H GLY A 137 -8.370 -2.854 -8.570 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -9.395 -4.758 -10.216 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.783 -5.375 -9.912 1.00 0.00 H new ATOM 286 N LYS A 138 -8.139 -5.169 -7.165 1.00 0.00 N ATOM 287 CA LYS A 138 -8.473 -5.710 -5.850 1.00 0.00 C ATOM 288 C LYS A 138 -9.020 -4.614 -4.920 1.00 0.00 C ATOM 289 O LYS A 138 -8.593 -3.474 -4.962 1.00 0.00 O ATOM 290 CB LYS A 138 -7.228 -6.347 -5.217 1.00 0.00 C ATOM 291 CG LYS A 138 -6.948 -7.741 -5.785 1.00 0.00 C ATOM 292 CD LYS A 138 -7.928 -8.784 -5.240 1.00 0.00 C ATOM 293 CE LYS A 138 -7.586 -10.192 -5.731 1.00 0.00 C ATOM 294 NZ LYS A 138 -7.754 -10.334 -7.173 1.00 0.00 N ATOM 0 H LYS A 138 -7.230 -4.714 -7.243 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.247 -6.466 -5.982 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.364 -5.705 -5.389 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.364 -6.415 -4.138 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -7.017 -7.711 -6.872 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -5.928 -8.036 -5.538 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -7.912 -8.765 -4.150 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -8.942 -8.527 -5.548 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -6.556 -10.427 -5.463 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -8.221 -10.916 -5.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -7.609 -11.328 -7.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -8.714 -10.038 -7.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -7.058 -9.737 -7.664 1.00 0.00 H new ATOM 308 N PRO A 139 -10.028 -5.023 -4.097 1.00 0.00 N ATOM 309 CA PRO A 139 -10.638 -4.145 -3.107 1.00 0.00 C ATOM 310 C PRO A 139 -9.779 -4.063 -1.834 1.00 0.00 C ATOM 311 O PRO A 139 -9.342 -5.074 -1.296 1.00 0.00 O ATOM 312 CB PRO A 139 -11.977 -4.801 -2.750 1.00 0.00 C ATOM 313 CG PRO A 139 -11.957 -6.211 -3.356 1.00 0.00 C ATOM 314 CD PRO A 139 -10.705 -6.308 -4.227 1.00 0.00 C ATOM 0 HA PRO A 139 -10.745 -3.134 -3.501 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -12.109 -4.847 -1.669 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -12.810 -4.221 -3.148 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -11.940 -6.967 -2.571 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -12.854 -6.388 -3.950 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -10.062 -7.124 -3.897 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -10.966 -6.509 -5.266 1.00 0.00 H new ATOM 322 N TRP A 140 -9.566 -2.803 -1.394 1.00 0.00 N ATOM 323 CA TRP A 140 -8.778 -2.607 -0.179 1.00 0.00 C ATOM 324 C TRP A 140 -9.419 -1.516 0.685 1.00 0.00 C ATOM 325 O TRP A 140 -10.575 -1.153 0.524 1.00 0.00 O ATOM 326 CB TRP A 140 -7.336 -2.192 -0.514 1.00 0.00 C ATOM 327 CG TRP A 140 -6.789 -2.987 -1.674 1.00 0.00 C ATOM 328 CD1 TRP A 140 -6.893 -2.636 -3.014 1.00 0.00 C ATOM 329 CD2 TRP A 140 -5.990 -4.171 -1.612 1.00 0.00 C ATOM 330 NE1 TRP A 140 -6.200 -3.533 -3.765 1.00 0.00 N ATOM 331 CE2 TRP A 140 -5.628 -4.494 -2.931 1.00 0.00 C ATOM 332 CE3 TRP A 140 -5.569 -4.946 -0.574 1.00 0.00 C ATOM 333 CZ2 TRP A 140 -4.855 -5.581 -3.188 1.00 0.00 C ATOM 334 CZ3 TRP A 140 -4.777 -6.062 -0.830 1.00 0.00 C ATOM 335 CH2 TRP A 140 -4.422 -6.376 -2.141 1.00 0.00 C ATOM 0 H TRP A 140 -9.912 -1.954 -1.841 1.00 0.00 H new ATOM 0 HA TRP A 140 -8.756 -3.553 0.362 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -7.308 -1.129 -0.754 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -6.702 -2.338 0.360 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -7.438 -1.786 -3.398 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -6.112 -3.507 -4.781 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -5.847 -4.697 0.439 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -4.580 -5.824 -4.204 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -4.438 -6.683 -0.014 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -3.808 -7.242 -2.340 1.00 0.00 H new ATOM 346 N HIS A 141 -8.562 -1.038 1.610 1.00 0.00 N ATOM 347 CA HIS A 141 -8.967 0.031 2.512 1.00 0.00 C ATOM 348 C HIS A 141 -7.878 1.109 2.468 1.00 0.00 C ATOM 349 O HIS A 141 -6.810 0.908 1.903 1.00 0.00 O ATOM 350 CB HIS A 141 -9.096 -0.512 3.945 1.00 0.00 C ATOM 351 CG HIS A 141 -10.511 -0.927 4.249 1.00 0.00 C ATOM 352 ND1 HIS A 141 -10.839 -2.044 4.905 1.00 0.00 N ATOM 353 CD2 HIS A 141 -11.718 -0.247 3.974 1.00 0.00 C ATOM 354 CE1 HIS A 141 -12.158 -2.091 5.058 1.00 0.00 C ATOM 355 NE2 HIS A 141 -12.732 -1.005 4.497 1.00 0.00 N ATOM 0 H HIS A 141 -7.608 -1.374 1.742 1.00 0.00 H new ATOM 0 HA HIS A 141 -9.931 0.440 2.210 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -8.429 -1.365 4.074 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -8.778 0.251 4.655 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -11.822 0.692 3.451 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -12.694 -2.884 5.559 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -13.729 -0.790 4.468 1.00 0.00 H new ATOM 363 N LYS A 142 -8.218 2.255 3.089 1.00 0.00 N ATOM 364 CA LYS A 142 -7.236 3.340 3.130 1.00 0.00 C ATOM 365 C LYS A 142 -6.335 3.159 4.364 1.00 0.00 C ATOM 366 O LYS A 142 -6.166 4.054 5.183 1.00 0.00 O ATOM 367 CB LYS A 142 -7.933 4.715 3.134 1.00 0.00 C ATOM 368 CG LYS A 142 -8.830 4.951 4.363 1.00 0.00 C ATOM 369 CD LYS A 142 -9.205 6.429 4.513 1.00 0.00 C ATOM 370 CE LYS A 142 -9.829 6.991 3.234 1.00 0.00 C ATOM 371 NZ LYS A 142 -10.355 8.338 3.419 1.00 0.00 N ATOM 0 H LYS A 142 -9.112 2.443 3.543 1.00 0.00 H new ATOM 0 HA LYS A 142 -6.616 3.302 2.234 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -7.175 5.497 3.093 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -8.537 4.809 2.231 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -9.737 4.353 4.273 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -8.313 4.613 5.261 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -9.906 6.544 5.340 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -8.315 7.005 4.767 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -9.080 7.002 2.442 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -10.632 6.332 2.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -10.485 8.790 2.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -11.270 8.289 3.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -9.686 8.897 3.986 1.00 0.00 H new ATOM 385 N ASN A 143 -5.738 1.943 4.393 1.00 0.00 N ATOM 386 CA ASN A 143 -4.877 1.576 5.515 1.00 0.00 C ATOM 387 C ASN A 143 -4.464 0.095 5.396 1.00 0.00 C ATOM 388 O ASN A 143 -3.410 -0.316 5.869 1.00 0.00 O ATOM 389 CB ASN A 143 -5.619 1.804 6.846 1.00 0.00 C ATOM 390 CG ASN A 143 -4.774 1.308 8.025 1.00 0.00 C ATOM 391 OD1 ASN A 143 -4.070 2.288 8.617 1.00 0.00 O flip ATOM 392 ND2 ASN A 143 -4.769 0.132 8.368 1.00 0.00 N flip ATOM 0 H ASN A 143 -5.839 1.229 3.672 1.00 0.00 H new ATOM 0 HA ASN A 143 -3.984 2.200 5.494 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -5.839 2.864 6.969 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -6.575 1.280 6.830 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -5.335 -0.549 7.862 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -4.199 -0.166 9.160 1.00 0.00 H new ATOM 399 N CYS A 144 -5.366 -0.669 4.730 1.00 0.00 N ATOM 400 CA CYS A 144 -5.110 -2.097 4.560 1.00 0.00 C ATOM 401 C CYS A 144 -4.225 -2.354 3.331 1.00 0.00 C ATOM 402 O CYS A 144 -4.276 -3.409 2.710 1.00 0.00 O ATOM 403 CB CYS A 144 -6.444 -2.843 4.415 1.00 0.00 C ATOM 404 SG CYS A 144 -7.471 -2.606 5.882 1.00 0.00 S ATOM 0 H CYS A 144 -6.237 -0.328 4.323 1.00 0.00 H new ATOM 0 HA CYS A 144 -4.581 -2.464 5.440 1.00 0.00 H new ATOM 0 HB2 CYS A 144 -6.973 -2.484 3.533 1.00 0.00 H new ATOM 0 HB3 CYS A 144 -6.257 -3.906 4.264 1.00 0.00 H new ATOM 409 N PHE A 145 -3.418 -1.320 3.029 1.00 0.00 N ATOM 410 CA PHE A 145 -2.517 -1.442 1.886 1.00 0.00 C ATOM 411 C PHE A 145 -1.398 -2.457 2.184 1.00 0.00 C ATOM 412 O PHE A 145 -0.624 -2.315 3.129 1.00 0.00 O ATOM 413 CB PHE A 145 -1.890 -0.081 1.534 1.00 0.00 C ATOM 414 CG PHE A 145 -2.733 0.699 0.560 1.00 0.00 C ATOM 415 CD1 PHE A 145 -3.852 1.400 0.990 1.00 0.00 C ATOM 416 CD2 PHE A 145 -2.378 0.757 -0.785 1.00 0.00 C ATOM 417 CE1 PHE A 145 -4.598 2.147 0.090 1.00 0.00 C ATOM 418 CE2 PHE A 145 -3.122 1.502 -1.676 1.00 0.00 C ATOM 419 CZ PHE A 145 -4.230 2.196 -1.243 1.00 0.00 C ATOM 0 H PHE A 145 -3.375 -0.436 3.536 1.00 0.00 H new ATOM 0 HA PHE A 145 -3.104 -1.792 1.037 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -1.757 0.502 2.445 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -0.899 -0.239 1.109 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -4.143 1.363 2.029 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -1.512 0.214 -1.134 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -5.467 2.691 0.430 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -2.835 1.541 -2.716 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.811 2.778 -1.943 1.00 0.00 H new ATOM 429 N ARG A 146 -1.385 -3.484 1.304 1.00 0.00 N ATOM 430 CA ARG A 146 -0.370 -4.525 1.407 1.00 0.00 C ATOM 431 C ARG A 146 0.410 -4.560 0.091 1.00 0.00 C ATOM 432 O ARG A 146 -0.135 -4.832 -0.973 1.00 0.00 O ATOM 433 CB ARG A 146 -1.030 -5.881 1.678 1.00 0.00 C ATOM 434 CG ARG A 146 -1.422 -6.033 3.150 1.00 0.00 C ATOM 435 CD ARG A 146 -1.791 -7.478 3.489 1.00 0.00 C ATOM 436 NE ARG A 146 -2.005 -7.625 4.921 1.00 0.00 N ATOM 437 CZ ARG A 146 -2.376 -8.827 5.409 1.00 0.00 C ATOM 438 NH1 ARG A 146 -2.537 -9.863 4.590 1.00 0.00 N ATOM 439 NH2 ARG A 146 -2.582 -8.976 6.714 1.00 0.00 N ATOM 0 H ARG A 146 -2.050 -3.603 0.540 1.00 0.00 H new ATOM 0 HA ARG A 146 0.307 -4.313 2.234 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -1.916 -5.986 1.052 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -0.345 -6.682 1.399 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -0.595 -5.710 3.782 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -2.266 -5.380 3.371 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -2.693 -7.766 2.949 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -0.996 -8.149 3.163 1.00 0.00 H new ATOM 0 HE ARG A 146 -1.876 -6.830 5.547 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -2.380 -9.751 3.588 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -2.818 -10.770 4.964 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -2.460 -8.183 7.343 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -2.863 -9.883 7.086 1.00 0.00 H new ATOM 453 N CYS A 147 1.715 -4.260 0.239 1.00 0.00 N ATOM 454 CA CYS A 147 2.568 -4.221 -0.943 1.00 0.00 C ATOM 455 C CYS A 147 2.564 -5.550 -1.701 1.00 0.00 C ATOM 456 O CYS A 147 2.664 -6.625 -1.127 1.00 0.00 O ATOM 457 CB CYS A 147 3.987 -3.883 -0.531 1.00 0.00 C ATOM 458 SG CYS A 147 4.962 -3.327 -1.935 1.00 0.00 S ATOM 0 H CYS A 147 2.176 -4.052 1.125 1.00 0.00 H new ATOM 0 HA CYS A 147 2.171 -3.456 -1.611 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.970 -3.106 0.233 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.456 -4.759 -0.084 1.00 0.00 H new ATOM 463 N ALA A 148 2.481 -5.387 -3.036 1.00 0.00 N ATOM 464 CA ALA A 148 2.461 -6.563 -3.886 1.00 0.00 C ATOM 465 C ALA A 148 3.858 -7.196 -4.030 1.00 0.00 C ATOM 466 O ALA A 148 3.983 -8.349 -4.426 1.00 0.00 O ATOM 467 CB ALA A 148 1.929 -6.172 -5.264 1.00 0.00 C ATOM 0 H ALA A 148 2.429 -4.490 -3.519 1.00 0.00 H new ATOM 0 HA ALA A 148 1.812 -7.306 -3.422 1.00 0.00 H new ATOM 0 HB1 ALA A 148 1.911 -7.050 -5.910 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.919 -5.773 -5.165 1.00 0.00 H new ATOM 0 HB3 ALA A 148 2.577 -5.413 -5.702 1.00 0.00 H new ATOM 473 N LYS A 149 4.894 -6.385 -3.687 1.00 0.00 N ATOM 474 CA LYS A 149 6.256 -6.907 -3.830 1.00 0.00 C ATOM 475 C LYS A 149 6.938 -7.196 -2.475 1.00 0.00 C ATOM 476 O LYS A 149 7.332 -8.324 -2.206 1.00 0.00 O ATOM 477 CB LYS A 149 7.123 -5.957 -4.673 1.00 0.00 C ATOM 478 CG LYS A 149 6.828 -4.479 -4.405 1.00 0.00 C ATOM 479 CD LYS A 149 7.891 -3.562 -5.029 1.00 0.00 C ATOM 480 CE LYS A 149 8.052 -3.785 -6.535 1.00 0.00 C ATOM 481 NZ LYS A 149 9.181 -3.045 -7.085 1.00 0.00 N ATOM 0 H LYS A 149 4.813 -5.432 -3.334 1.00 0.00 H new ATOM 0 HA LYS A 149 6.164 -7.862 -4.348 1.00 0.00 H new ATOM 0 HB2 LYS A 149 8.175 -6.155 -4.466 1.00 0.00 H new ATOM 0 HB3 LYS A 149 6.961 -6.168 -5.730 1.00 0.00 H new ATOM 0 HG2 LYS A 149 5.848 -4.225 -4.808 1.00 0.00 H new ATOM 0 HG3 LYS A 149 6.785 -4.306 -3.330 1.00 0.00 H new ATOM 0 HD2 LYS A 149 7.620 -2.522 -4.847 1.00 0.00 H new ATOM 0 HD3 LYS A 149 8.848 -3.734 -4.536 1.00 0.00 H new ATOM 0 HE2 LYS A 149 8.188 -4.849 -6.730 1.00 0.00 H new ATOM 0 HE3 LYS A 149 7.138 -3.481 -7.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 9.251 -3.227 -8.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 9.041 -2.027 -6.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.058 -3.352 -6.618 1.00 0.00 H new ATOM 495 N CYS A 150 7.056 -6.131 -1.642 1.00 0.00 N ATOM 496 CA CYS A 150 7.745 -6.341 -0.365 1.00 0.00 C ATOM 497 C CYS A 150 6.784 -6.862 0.723 1.00 0.00 C ATOM 498 O CYS A 150 7.201 -7.225 1.816 1.00 0.00 O ATOM 499 CB CYS A 150 8.499 -5.067 0.084 1.00 0.00 C ATOM 500 SG CYS A 150 7.417 -3.775 0.736 1.00 0.00 S ATOM 0 H CYS A 150 6.708 -5.189 -1.819 1.00 0.00 H new ATOM 0 HA CYS A 150 8.493 -7.118 -0.519 1.00 0.00 H new ATOM 0 HB2 CYS A 150 9.229 -5.337 0.847 1.00 0.00 H new ATOM 0 HB3 CYS A 150 9.057 -4.668 -0.763 1.00 0.00 H new ATOM 505 N GLY A 151 5.482 -6.896 0.342 1.00 0.00 N ATOM 506 CA GLY A 151 4.469 -7.403 1.273 1.00 0.00 C ATOM 507 C GLY A 151 4.425 -6.670 2.628 1.00 0.00 C ATOM 508 O GLY A 151 3.698 -7.062 3.533 1.00 0.00 O ATOM 0 H GLY A 151 5.129 -6.591 -0.565 1.00 0.00 H new ATOM 0 HA2 GLY A 151 3.489 -7.328 0.801 1.00 0.00 H new ATOM 0 HA3 GLY A 151 4.656 -8.462 1.452 1.00 0.00 H new ATOM 512 N LYS A 152 5.237 -5.599 2.714 1.00 0.00 N ATOM 513 CA LYS A 152 5.276 -4.851 3.962 1.00 0.00 C ATOM 514 C LYS A 152 3.906 -4.253 4.296 1.00 0.00 C ATOM 515 O LYS A 152 3.059 -4.036 3.432 1.00 0.00 O ATOM 516 CB LYS A 152 6.316 -3.732 3.857 1.00 0.00 C ATOM 517 CG LYS A 152 7.742 -4.281 3.943 1.00 0.00 C ATOM 518 CD LYS A 152 8.785 -3.164 3.867 1.00 0.00 C ATOM 519 CE LYS A 152 10.191 -3.682 4.175 1.00 0.00 C ATOM 520 NZ LYS A 152 10.597 -4.760 3.281 1.00 0.00 N ATOM 0 H LYS A 152 5.842 -5.253 1.969 1.00 0.00 H new ATOM 0 HA LYS A 152 5.550 -5.538 4.763 1.00 0.00 H new ATOM 0 HB2 LYS A 152 6.186 -3.200 2.914 1.00 0.00 H new ATOM 0 HB3 LYS A 152 6.155 -3.008 4.656 1.00 0.00 H new ATOM 0 HG2 LYS A 152 7.865 -4.830 4.876 1.00 0.00 H new ATOM 0 HG3 LYS A 152 7.908 -4.990 3.132 1.00 0.00 H new ATOM 0 HD2 LYS A 152 8.771 -2.720 2.872 1.00 0.00 H new ATOM 0 HD3 LYS A 152 8.525 -2.375 4.572 1.00 0.00 H new ATOM 0 HE2 LYS A 152 10.903 -2.861 4.095 1.00 0.00 H new ATOM 0 HE3 LYS A 152 10.227 -4.036 5.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 11.634 -4.771 3.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 10.271 -5.670 3.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 10.177 -4.609 2.342 1.00 0.00 H new ATOM 534 N SER A 153 3.764 -4.017 5.620 1.00 0.00 N ATOM 535 CA SER A 153 2.538 -3.415 6.117 1.00 0.00 C ATOM 536 C SER A 153 2.624 -1.908 5.886 1.00 0.00 C ATOM 537 O SER A 153 3.589 -1.257 6.271 1.00 0.00 O ATOM 538 CB SER A 153 2.388 -3.723 7.633 1.00 0.00 C ATOM 539 OG SER A 153 3.556 -3.338 8.473 1.00 0.00 O ATOM 0 H SER A 153 4.464 -4.230 6.330 1.00 0.00 H new ATOM 0 HA SER A 153 1.670 -3.820 5.596 1.00 0.00 H new ATOM 0 HB2 SER A 153 1.504 -3.206 8.007 1.00 0.00 H new ATOM 0 HB3 SER A 153 2.208 -4.791 7.755 1.00 0.00 H new ATOM 0 HG SER A 153 3.990 -2.549 8.087 1.00 0.00 H new ATOM 545 N LEU A 154 1.560 -1.402 5.236 1.00 0.00 N ATOM 546 CA LEU A 154 1.550 0.014 4.912 1.00 0.00 C ATOM 547 C LEU A 154 0.223 0.633 5.359 1.00 0.00 C ATOM 548 O LEU A 154 -0.815 0.477 4.727 1.00 0.00 O ATOM 549 CB LEU A 154 1.761 0.192 3.393 1.00 0.00 C ATOM 550 CG LEU A 154 2.421 -1.038 2.746 1.00 0.00 C ATOM 551 CD1 LEU A 154 2.008 -1.156 1.291 1.00 0.00 C ATOM 552 CD2 LEU A 154 3.946 -0.957 2.874 1.00 0.00 C ATOM 0 H LEU A 154 0.739 -1.931 4.942 1.00 0.00 H new ATOM 0 HA LEU A 154 2.359 0.523 5.436 1.00 0.00 H new ATOM 0 HB2 LEU A 154 0.800 0.379 2.915 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.382 1.070 3.215 1.00 0.00 H new ATOM 0 HG LEU A 154 2.082 -1.931 3.271 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.483 -2.031 0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 154 0.925 -1.260 1.228 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.319 -0.262 0.751 1.00 0.00 H new ATOM 0 HD21 LEU A 154 4.397 -1.835 2.411 1.00 0.00 H new ATOM 0 HD22 LEU A 154 4.306 -0.058 2.374 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.221 -0.921 3.928 1.00 0.00 H new ATOM 564 N GLU A 155 0.344 1.342 6.499 1.00 0.00 N ATOM 565 CA GLU A 155 -0.828 1.991 7.062 1.00 0.00 C ATOM 566 C GLU A 155 -0.935 3.421 6.517 1.00 0.00 C ATOM 567 O GLU A 155 -0.163 3.843 5.664 1.00 0.00 O ATOM 568 CB GLU A 155 -0.715 1.996 8.595 1.00 0.00 C ATOM 569 CG GLU A 155 -1.094 0.638 9.201 1.00 0.00 C ATOM 570 CD GLU A 155 -0.095 -0.442 8.768 1.00 0.00 C ATOM 571 OE1 GLU A 155 1.053 -0.392 9.208 1.00 0.00 O ATOM 572 OE2 GLU A 155 -0.478 -1.321 7.995 1.00 0.00 O ATOM 0 H GLU A 155 1.211 1.470 7.021 1.00 0.00 H new ATOM 0 HA GLU A 155 -1.729 1.447 6.779 1.00 0.00 H new ATOM 0 HB2 GLU A 155 0.305 2.250 8.883 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -1.364 2.770 9.004 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -1.111 0.711 10.288 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -2.099 0.360 8.884 1.00 0.00 H new ATOM 579 N SER A 156 -1.952 4.122 7.066 1.00 0.00 N ATOM 580 CA SER A 156 -2.186 5.501 6.654 1.00 0.00 C ATOM 581 C SER A 156 -2.860 5.529 5.276 1.00 0.00 C ATOM 582 O SER A 156 -2.744 4.605 4.480 1.00 0.00 O ATOM 583 CB SER A 156 -0.873 6.297 6.644 1.00 0.00 C ATOM 584 OG SER A 156 -1.220 7.739 7.024 1.00 0.00 O ATOM 0 H SER A 156 -2.597 3.762 7.770 1.00 0.00 H new ATOM 0 HA SER A 156 -2.853 5.975 7.374 1.00 0.00 H new ATOM 0 HB2 SER A 156 -0.160 5.873 7.351 1.00 0.00 H new ATOM 0 HB3 SER A 156 -0.407 6.259 5.659 1.00 0.00 H new ATOM 0 HG SER A 156 -0.404 8.281 7.030 1.00 0.00 H new ATOM 590 N THR A 157 -3.570 6.656 5.064 1.00 0.00 N ATOM 591 CA THR A 157 -4.286 6.819 3.806 1.00 0.00 C ATOM 592 C THR A 157 -3.445 7.630 2.811 1.00 0.00 C ATOM 593 O THR A 157 -3.732 8.781 2.506 1.00 0.00 O ATOM 594 CB THR A 157 -5.637 7.529 4.080 1.00 0.00 C ATOM 595 OG1 THR A 157 -6.339 7.879 2.839 1.00 0.00 O ATOM 596 CG2 THR A 157 -5.461 8.758 5.018 1.00 0.00 C ATOM 0 H THR A 157 -3.656 7.430 5.723 1.00 0.00 H new ATOM 0 HA THR A 157 -4.475 5.839 3.367 1.00 0.00 H new ATOM 0 HB THR A 157 -6.271 6.815 4.605 1.00 0.00 H new ATOM 0 HG1 THR A 157 -5.766 8.454 2.290 1.00 0.00 H new ATOM 0 HG21 THR A 157 -6.430 9.229 5.186 1.00 0.00 H new ATOM 0 HG22 THR A 157 -5.046 8.432 5.971 1.00 0.00 H new ATOM 0 HG23 THR A 157 -4.784 9.476 4.554 1.00 0.00 H new ATOM 604 N THR A 158 -2.393 6.941 2.330 1.00 0.00 N ATOM 605 CA THR A 158 -1.507 7.582 1.368 1.00 0.00 C ATOM 606 C THR A 158 -0.506 6.549 0.844 1.00 0.00 C ATOM 607 O THR A 158 0.346 6.050 1.570 1.00 0.00 O ATOM 608 CB THR A 158 -0.766 8.781 2.026 1.00 0.00 C ATOM 609 OG1 THR A 158 0.491 9.092 1.337 1.00 0.00 O ATOM 610 CG2 THR A 158 -0.550 8.565 3.550 1.00 0.00 C ATOM 0 H THR A 158 -2.150 5.983 2.583 1.00 0.00 H new ATOM 0 HA THR A 158 -2.094 7.969 0.535 1.00 0.00 H new ATOM 0 HB THR A 158 -1.414 9.651 1.917 1.00 0.00 H new ATOM 0 HG1 THR A 158 0.927 9.851 1.778 1.00 0.00 H new ATOM 0 HG21 THR A 158 -0.029 9.426 3.969 1.00 0.00 H new ATOM 0 HG22 THR A 158 -1.516 8.450 4.042 1.00 0.00 H new ATOM 0 HG23 THR A 158 0.047 7.667 3.709 1.00 0.00 H new ATOM 618 N LEU A 159 -0.671 6.270 -0.466 1.00 0.00 N ATOM 619 CA LEU A 159 0.200 5.288 -1.096 1.00 0.00 C ATOM 620 C LEU A 159 0.022 5.364 -2.623 1.00 0.00 C ATOM 621 O LEU A 159 -0.131 6.439 -3.189 1.00 0.00 O ATOM 622 CB LEU A 159 -0.152 3.897 -0.546 1.00 0.00 C ATOM 623 CG LEU A 159 1.066 2.975 -0.465 1.00 0.00 C ATOM 624 CD1 LEU A 159 2.224 3.657 0.266 1.00 0.00 C ATOM 625 CD2 LEU A 159 0.687 1.683 0.254 1.00 0.00 C ATOM 0 H LEU A 159 -1.370 6.695 -1.075 1.00 0.00 H new ATOM 0 HA LEU A 159 1.248 5.490 -0.872 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -0.591 4.002 0.446 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -0.909 3.439 -1.182 1.00 0.00 H new ATOM 0 HG LEU A 159 1.392 2.746 -1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 159 3.077 2.979 0.309 1.00 0.00 H new ATOM 0 HD12 LEU A 159 2.508 4.564 -0.268 1.00 0.00 H new ATOM 0 HD13 LEU A 159 1.914 3.915 1.279 1.00 0.00 H new ATOM 0 HD21 LEU A 159 1.557 1.029 0.310 1.00 0.00 H new ATOM 0 HD22 LEU A 159 0.342 1.915 1.262 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -0.110 1.181 -0.295 1.00 0.00 H new ATOM 637 N THR A 160 0.053 4.165 -3.251 1.00 0.00 N ATOM 638 CA THR A 160 -0.112 4.137 -4.697 1.00 0.00 C ATOM 639 C THR A 160 -0.666 2.776 -5.131 1.00 0.00 C ATOM 640 O THR A 160 -0.471 1.758 -4.478 1.00 0.00 O ATOM 641 CB THR A 160 1.245 4.426 -5.398 1.00 0.00 C ATOM 642 OG1 THR A 160 1.222 4.033 -6.813 1.00 0.00 O ATOM 643 CG2 THR A 160 2.442 3.776 -4.635 1.00 0.00 C ATOM 0 H THR A 160 0.184 3.260 -2.799 1.00 0.00 H new ATOM 0 HA THR A 160 -0.820 4.912 -4.991 1.00 0.00 H new ATOM 0 HB THR A 160 1.396 5.505 -5.369 1.00 0.00 H new ATOM 0 HG1 THR A 160 2.091 4.231 -7.222 1.00 0.00 H new ATOM 0 HG21 THR A 160 3.372 4.001 -5.157 1.00 0.00 H new ATOM 0 HG22 THR A 160 2.488 4.176 -3.622 1.00 0.00 H new ATOM 0 HG23 THR A 160 2.303 2.696 -4.592 1.00 0.00 H new ATOM 651 N GLU A 161 -1.377 2.847 -6.277 1.00 0.00 N ATOM 652 CA GLU A 161 -1.978 1.637 -6.824 1.00 0.00 C ATOM 653 C GLU A 161 -1.600 1.507 -8.303 1.00 0.00 C ATOM 654 O GLU A 161 -1.680 2.461 -9.067 1.00 0.00 O ATOM 655 CB GLU A 161 -3.501 1.699 -6.663 1.00 0.00 C ATOM 656 CG GLU A 161 -3.908 1.985 -5.213 1.00 0.00 C ATOM 657 CD GLU A 161 -5.427 2.162 -5.110 1.00 0.00 C ATOM 658 OE1 GLU A 161 -5.962 3.047 -5.776 1.00 0.00 O ATOM 659 OE2 GLU A 161 -6.056 1.415 -4.362 1.00 0.00 O ATOM 0 H GLU A 161 -1.539 3.698 -6.815 1.00 0.00 H new ATOM 0 HA GLU A 161 -1.607 0.765 -6.286 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -3.904 2.475 -7.314 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -3.939 0.754 -6.984 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -3.586 1.166 -4.570 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -3.406 2.885 -4.858 1.00 0.00 H new ATOM 666 N LYS A 162 -1.190 0.266 -8.655 1.00 0.00 N ATOM 667 CA LYS A 162 -0.786 0.038 -10.037 1.00 0.00 C ATOM 668 C LYS A 162 -0.536 -1.452 -10.305 1.00 0.00 C ATOM 669 O LYS A 162 -0.445 -2.271 -9.399 1.00 0.00 O ATOM 670 CB LYS A 162 0.498 0.827 -10.327 1.00 0.00 C ATOM 671 CG LYS A 162 1.661 0.357 -9.443 1.00 0.00 C ATOM 672 CD LYS A 162 2.874 1.284 -9.559 1.00 0.00 C ATOM 673 CE LYS A 162 3.834 0.830 -10.662 1.00 0.00 C ATOM 674 NZ LYS A 162 4.354 -0.514 -10.435 1.00 0.00 N ATOM 0 H LYS A 162 -1.135 -0.541 -8.034 1.00 0.00 H new ATOM 0 HA LYS A 162 -1.592 0.373 -10.689 1.00 0.00 H new ATOM 0 HB2 LYS A 162 0.768 0.711 -11.377 1.00 0.00 H new ATOM 0 HB3 LYS A 162 0.319 1.889 -10.160 1.00 0.00 H new ATOM 0 HG2 LYS A 162 1.334 0.315 -8.404 1.00 0.00 H new ATOM 0 HG3 LYS A 162 1.948 -0.655 -9.728 1.00 0.00 H new ATOM 0 HD2 LYS A 162 2.537 2.300 -9.766 1.00 0.00 H new ATOM 0 HD3 LYS A 162 3.402 1.312 -8.606 1.00 0.00 H new ATOM 0 HE2 LYS A 162 3.318 0.859 -11.622 1.00 0.00 H new ATOM 0 HE3 LYS A 162 4.666 1.531 -10.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 4.755 -0.885 -11.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 5.095 -0.481 -9.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 3.583 -1.135 -10.117 1.00 0.00 H new ATOM 688 N GLU A 163 -0.430 -1.720 -11.629 1.00 0.00 N ATOM 689 CA GLU A 163 -0.152 -3.079 -12.090 1.00 0.00 C ATOM 690 C GLU A 163 -1.268 -4.062 -11.702 1.00 0.00 C ATOM 691 O GLU A 163 -1.031 -5.241 -11.463 1.00 0.00 O ATOM 692 CB GLU A 163 1.192 -3.554 -11.534 1.00 0.00 C ATOM 693 CG GLU A 163 2.339 -2.622 -11.945 1.00 0.00 C ATOM 694 CD GLU A 163 2.552 -2.684 -13.462 1.00 0.00 C ATOM 695 OE1 GLU A 163 3.099 -3.677 -13.939 1.00 0.00 O ATOM 696 OE2 GLU A 163 2.168 -1.737 -14.148 1.00 0.00 O ATOM 0 H GLU A 163 -0.531 -1.026 -12.370 1.00 0.00 H new ATOM 0 HA GLU A 163 -0.108 -3.055 -13.179 1.00 0.00 H new ATOM 0 HB2 GLU A 163 1.138 -3.606 -10.447 1.00 0.00 H new ATOM 0 HB3 GLU A 163 1.397 -4.563 -11.892 1.00 0.00 H new ATOM 0 HG2 GLU A 163 2.112 -1.599 -11.643 1.00 0.00 H new ATOM 0 HG3 GLU A 163 3.255 -2.911 -11.429 1.00 0.00 H new ATOM 703 N GLY A 164 -2.488 -3.498 -11.658 1.00 0.00 N ATOM 704 CA GLY A 164 -3.637 -4.333 -11.331 1.00 0.00 C ATOM 705 C GLY A 164 -3.761 -4.610 -9.826 1.00 0.00 C ATOM 706 O GLY A 164 -4.699 -5.252 -9.370 1.00 0.00 O ATOM 0 H GLY A 164 -2.691 -2.515 -11.837 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -4.546 -3.846 -11.682 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -3.556 -5.280 -11.865 1.00 0.00 H new ATOM 710 N GLU A 165 -2.757 -4.085 -9.096 1.00 0.00 N ATOM 711 CA GLU A 165 -2.760 -4.272 -7.654 1.00 0.00 C ATOM 712 C GLU A 165 -2.420 -2.934 -6.985 1.00 0.00 C ATOM 713 O GLU A 165 -2.831 -1.876 -7.446 1.00 0.00 O ATOM 714 CB GLU A 165 -1.764 -5.375 -7.267 1.00 0.00 C ATOM 715 CG GLU A 165 -2.207 -6.112 -5.996 1.00 0.00 C ATOM 716 CD GLU A 165 -1.221 -7.236 -5.658 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.794 -7.942 -6.571 1.00 0.00 O ATOM 718 OE2 GLU A 165 -0.893 -7.395 -4.482 1.00 0.00 O ATOM 0 H GLU A 165 -1.972 -3.553 -9.471 1.00 0.00 H new ATOM 0 HA GLU A 165 -3.744 -4.591 -7.311 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -1.670 -6.086 -8.087 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -0.778 -4.938 -7.110 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -2.268 -5.411 -5.164 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -3.205 -6.526 -6.137 1.00 0.00 H new ATOM 725 N ILE A 166 -1.637 -3.043 -5.891 1.00 0.00 N ATOM 726 CA ILE A 166 -1.268 -1.840 -5.180 1.00 0.00 C ATOM 727 C ILE A 166 0.135 -2.028 -4.621 1.00 0.00 C ATOM 728 O ILE A 166 0.457 -3.038 -4.001 1.00 0.00 O ATOM 729 CB ILE A 166 -2.284 -1.537 -4.066 1.00 0.00 C ATOM 730 CG1 ILE A 166 -2.254 -2.631 -2.984 1.00 0.00 C ATOM 731 CG2 ILE A 166 -3.691 -1.411 -4.655 1.00 0.00 C ATOM 732 CD1 ILE A 166 -3.324 -2.404 -1.907 1.00 0.00 C ATOM 0 H ILE A 166 -1.272 -3.915 -5.509 1.00 0.00 H new ATOM 0 HA ILE A 166 -1.275 -0.985 -5.856 1.00 0.00 H new ATOM 0 HB ILE A 166 -2.010 -0.590 -3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -2.408 -3.605 -3.449 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -1.269 -2.653 -2.518 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -4.402 -1.196 -3.857 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -3.709 -0.601 -5.384 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -3.966 -2.346 -5.144 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -3.267 -3.199 -1.164 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -3.155 -1.442 -1.423 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -4.312 -2.409 -2.368 1.00 0.00 H new ATOM 744 N TYR A 167 0.949 -1.001 -4.909 1.00 0.00 N ATOM 745 CA TYR A 167 2.321 -1.065 -4.457 1.00 0.00 C ATOM 746 C TYR A 167 2.545 -0.038 -3.337 1.00 0.00 C ATOM 747 O TYR A 167 1.746 0.872 -3.133 1.00 0.00 O ATOM 748 CB TYR A 167 3.265 -0.837 -5.641 1.00 0.00 C ATOM 749 CG TYR A 167 3.337 -2.084 -6.479 1.00 0.00 C ATOM 750 CD1 TYR A 167 2.226 -2.519 -7.189 1.00 0.00 C ATOM 751 CD2 TYR A 167 4.497 -2.841 -6.513 1.00 0.00 C ATOM 752 CE1 TYR A 167 2.269 -3.693 -7.920 1.00 0.00 C ATOM 753 CE2 TYR A 167 4.550 -4.019 -7.243 1.00 0.00 C ATOM 754 CZ TYR A 167 3.434 -4.451 -7.953 1.00 0.00 C ATOM 755 OH TYR A 167 3.475 -5.644 -8.666 1.00 0.00 O ATOM 0 H TYR A 167 0.688 -0.162 -5.427 1.00 0.00 H new ATOM 0 HA TYR A 167 2.535 -2.053 -4.048 1.00 0.00 H new ATOM 0 HB2 TYR A 167 2.911 -0.001 -6.245 1.00 0.00 H new ATOM 0 HB3 TYR A 167 4.259 -0.572 -5.280 1.00 0.00 H new ATOM 0 HD1 TYR A 167 1.318 -1.934 -7.171 1.00 0.00 H new ATOM 0 HD2 TYR A 167 5.368 -2.511 -5.966 1.00 0.00 H new ATOM 0 HE1 TYR A 167 1.397 -4.021 -8.466 1.00 0.00 H new ATOM 0 HE2 TYR A 167 5.459 -4.602 -7.260 1.00 0.00 H new ATOM 0 HH TYR A 167 4.366 -6.044 -8.583 1.00 0.00 H new ATOM 765 N CYS A 168 3.673 -0.254 -2.620 1.00 0.00 N ATOM 766 CA CYS A 168 3.990 0.649 -1.518 1.00 0.00 C ATOM 767 C CYS A 168 5.049 1.659 -1.943 1.00 0.00 C ATOM 768 O CYS A 168 5.970 1.353 -2.687 1.00 0.00 O ATOM 769 CB CYS A 168 4.481 -0.148 -0.299 1.00 0.00 C ATOM 770 SG CYS A 168 6.279 -0.321 -0.248 1.00 0.00 S ATOM 0 H CYS A 168 4.340 -1.008 -2.781 1.00 0.00 H new ATOM 0 HA CYS A 168 3.083 1.189 -1.244 1.00 0.00 H new ATOM 0 HB2 CYS A 168 4.143 0.346 0.612 1.00 0.00 H new ATOM 0 HB3 CYS A 168 4.026 -1.138 -0.312 1.00 0.00 H new ATOM 775 N LYS A 169 4.843 2.890 -1.429 1.00 0.00 N ATOM 776 CA LYS A 169 5.810 3.928 -1.728 1.00 0.00 C ATOM 777 C LYS A 169 7.133 3.614 -1.018 1.00 0.00 C ATOM 778 O LYS A 169 8.185 4.130 -1.369 1.00 0.00 O ATOM 779 CB LYS A 169 5.271 5.297 -1.299 1.00 0.00 C ATOM 780 CG LYS A 169 5.121 5.414 0.221 1.00 0.00 C ATOM 781 CD LYS A 169 4.164 6.546 0.594 1.00 0.00 C ATOM 782 CE LYS A 169 3.764 6.492 2.069 1.00 0.00 C ATOM 783 NZ LYS A 169 2.894 7.598 2.450 1.00 0.00 N ATOM 0 H LYS A 169 4.058 3.166 -0.839 1.00 0.00 H new ATOM 0 HA LYS A 169 5.987 3.959 -2.803 1.00 0.00 H new ATOM 0 HB2 LYS A 169 5.943 6.077 -1.656 1.00 0.00 H new ATOM 0 HB3 LYS A 169 4.304 5.468 -1.771 1.00 0.00 H new ATOM 0 HG2 LYS A 169 4.751 4.472 0.627 1.00 0.00 H new ATOM 0 HG3 LYS A 169 6.096 5.594 0.673 1.00 0.00 H new ATOM 0 HD2 LYS A 169 4.636 7.505 0.381 1.00 0.00 H new ATOM 0 HD3 LYS A 169 3.270 6.485 -0.027 1.00 0.00 H new ATOM 0 HE2 LYS A 169 3.257 5.548 2.271 1.00 0.00 H new ATOM 0 HE3 LYS A 169 4.662 6.510 2.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 2.423 7.375 3.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 3.461 8.463 2.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 2.177 7.746 1.711 1.00 0.00 H new ATOM 797 N GLY A 170 7.002 2.727 0.003 1.00 0.00 N ATOM 798 CA GLY A 170 8.192 2.332 0.747 1.00 0.00 C ATOM 799 C GLY A 170 9.216 1.612 -0.150 1.00 0.00 C ATOM 800 O GLY A 170 10.412 1.620 0.106 1.00 0.00 O ATOM 0 H GLY A 170 6.127 2.300 0.307 1.00 0.00 H new ATOM 0 HA2 GLY A 170 8.654 3.215 1.189 1.00 0.00 H new ATOM 0 HA3 GLY A 170 7.905 1.677 1.569 1.00 0.00 H new ATOM 804 N CYS A 171 8.659 0.994 -1.212 1.00 0.00 N ATOM 805 CA CYS A 171 9.515 0.278 -2.151 1.00 0.00 C ATOM 806 C CYS A 171 10.316 1.276 -2.984 1.00 0.00 C ATOM 807 O CYS A 171 11.532 1.190 -3.112 1.00 0.00 O ATOM 808 CB CYS A 171 8.648 -0.571 -3.076 1.00 0.00 C ATOM 809 SG CYS A 171 8.523 -2.275 -2.498 1.00 0.00 S ATOM 0 H CYS A 171 7.662 0.980 -1.427 1.00 0.00 H new ATOM 0 HA CYS A 171 10.202 -0.363 -1.598 1.00 0.00 H new ATOM 0 HB2 CYS A 171 7.651 -0.135 -3.141 1.00 0.00 H new ATOM 0 HB3 CYS A 171 9.068 -0.558 -4.082 1.00 0.00 H new ATOM 814 N TYR A 172 9.535 2.222 -3.544 1.00 0.00 N ATOM 815 CA TYR A 172 10.148 3.252 -4.365 1.00 0.00 C ATOM 816 C TYR A 172 10.957 4.214 -3.488 1.00 0.00 C ATOM 817 O TYR A 172 11.618 5.123 -3.972 1.00 0.00 O ATOM 818 CB TYR A 172 9.062 4.018 -5.126 1.00 0.00 C ATOM 819 CG TYR A 172 8.256 3.097 -5.997 1.00 0.00 C ATOM 820 CD1 TYR A 172 8.794 2.596 -7.173 1.00 0.00 C ATOM 821 CD2 TYR A 172 6.963 2.742 -5.637 1.00 0.00 C ATOM 822 CE1 TYR A 172 8.054 1.751 -7.983 1.00 0.00 C ATOM 823 CE2 TYR A 172 6.214 1.898 -6.440 1.00 0.00 C ATOM 824 CZ TYR A 172 6.757 1.395 -7.620 1.00 0.00 C ATOM 825 OH TYR A 172 6.007 0.552 -8.433 1.00 0.00 O ATOM 0 H TYR A 172 8.522 2.285 -3.442 1.00 0.00 H new ATOM 0 HA TYR A 172 10.823 2.783 -5.081 1.00 0.00 H new ATOM 0 HB2 TYR A 172 8.404 4.521 -4.417 1.00 0.00 H new ATOM 0 HB3 TYR A 172 9.522 4.793 -5.739 1.00 0.00 H new ATOM 0 HD1 TYR A 172 9.799 2.867 -7.460 1.00 0.00 H new ATOM 0 HD2 TYR A 172 6.537 3.128 -4.722 1.00 0.00 H new ATOM 0 HE1 TYR A 172 8.483 1.368 -8.897 1.00 0.00 H new ATOM 0 HE2 TYR A 172 5.209 1.630 -6.151 1.00 0.00 H new ATOM 0 HH TYR A 172 5.231 0.221 -7.934 1.00 0.00 H new ATOM 835 N ALA A 173 10.847 3.952 -2.167 1.00 0.00 N ATOM 836 CA ALA A 173 11.577 4.792 -1.223 1.00 0.00 C ATOM 837 C ALA A 173 12.984 4.227 -0.990 1.00 0.00 C ATOM 838 O ALA A 173 13.923 4.948 -0.674 1.00 0.00 O ATOM 839 CB ALA A 173 10.817 4.877 0.102 1.00 0.00 C ATOM 0 H ALA A 173 10.288 3.204 -1.756 1.00 0.00 H new ATOM 0 HA ALA A 173 11.667 5.794 -1.642 1.00 0.00 H new ATOM 0 HB1 ALA A 173 11.370 5.506 0.799 1.00 0.00 H new ATOM 0 HB2 ALA A 173 9.831 5.308 -0.071 1.00 0.00 H new ATOM 0 HB3 ALA A 173 10.708 3.878 0.523 1.00 0.00 H new ATOM 845 N LYS A 174 13.059 2.892 -1.169 1.00 0.00 N ATOM 846 CA LYS A 174 14.340 2.226 -0.977 1.00 0.00 C ATOM 847 C LYS A 174 15.301 2.587 -2.115 1.00 0.00 C ATOM 848 O LYS A 174 16.366 3.151 -1.901 1.00 0.00 O ATOM 849 CB LYS A 174 14.131 0.709 -0.926 1.00 0.00 C ATOM 850 CG LYS A 174 13.366 0.280 0.329 1.00 0.00 C ATOM 851 CD LYS A 174 12.687 -1.078 0.137 1.00 0.00 C ATOM 852 CE LYS A 174 11.714 -1.392 1.274 1.00 0.00 C ATOM 853 NZ LYS A 174 10.941 -2.601 1.022 1.00 0.00 N ATOM 0 H LYS A 174 12.281 2.287 -1.434 1.00 0.00 H new ATOM 0 HA LYS A 174 14.776 2.559 -0.035 1.00 0.00 H new ATOM 0 HB2 LYS A 174 13.584 0.388 -1.812 1.00 0.00 H new ATOM 0 HB3 LYS A 174 15.099 0.208 -0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 174 14.052 0.228 1.174 1.00 0.00 H new ATOM 0 HG3 LYS A 174 12.615 1.032 0.573 1.00 0.00 H new ATOM 0 HD2 LYS A 174 12.151 -1.086 -0.812 1.00 0.00 H new ATOM 0 HD3 LYS A 174 13.445 -1.859 0.081 1.00 0.00 H new ATOM 0 HE2 LYS A 174 12.270 -1.506 2.204 1.00 0.00 H new ATOM 0 HE3 LYS A 174 11.034 -0.551 1.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 10.032 -2.543 1.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 10.767 -2.695 0.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 11.471 -3.429 1.361 1.00 0.00 H new ATOM 867 N ASN A 175 14.841 2.215 -3.330 1.00 0.00 N ATOM 868 CA ASN A 175 15.645 2.482 -4.519 1.00 0.00 C ATOM 869 C ASN A 175 16.962 1.699 -4.456 1.00 0.00 C ATOM 870 O ASN A 175 17.920 2.098 -3.805 1.00 0.00 O ATOM 871 CB ASN A 175 15.928 3.984 -4.659 1.00 0.00 C ATOM 872 CG ASN A 175 14.620 4.776 -4.615 1.00 0.00 C ATOM 873 OD1 ASN A 175 14.290 5.424 -3.629 1.00 0.00 O ATOM 874 ND2 ASN A 175 13.906 4.677 -5.750 1.00 0.00 N ATOM 0 H ASN A 175 13.951 1.747 -3.500 1.00 0.00 H new ATOM 0 HA ASN A 175 15.082 2.156 -5.393 1.00 0.00 H new ATOM 0 HB2 ASN A 175 16.588 4.313 -3.856 1.00 0.00 H new ATOM 0 HB3 ASN A 175 16.447 4.177 -5.598 1.00 0.00 H new ATOM 0 HD21 ASN A 175 13.014 5.165 -5.836 1.00 0.00 H new ATOM 0 HD22 ASN A 175 14.256 4.114 -6.525 1.00 0.00 H new TER 881 ASN A 175 HETATM 882 ZN ZN A 195 6.813 -2.412 -0.995 1.00 0.00 ZN HETATM 883 ZN ZN A 196 -9.572 -3.461 5.523 1.00 0.00 ZN CONECT 53 883 CONECT 98 883 CONECT 352 883 CONECT 404 883 CONECT 458 882 CONECT 500 882 CONECT 770 882 CONECT 809 882 CONECT 882 458 500 770 809 CONECT 883 53 98 352 404 END