USER MOD reduce.3.24.130724 H: found=0, std=0, add=999, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1000 hydrogens (13 hets) HEADER TRANSFERASE 23-MAY-05 1ZS5 TITLE STRUCTURE-BASED EVALUATION OF SELECTIVE AND NON-SELECTIVE TITLE 2 SMALL MOLECULES THAT BLOCK HIV-1 TAT AND PCAF ASSOCIATION COMPND MOL_ID: 1; COMPND 2 MOLECULE: HISTONE ACETYLTRANSFERASE PCAF; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: BROMODOMAIN; COMPND 5 SYNONYM: P300/CBP-ASSOCIATED FACTOR, P/CAF, HISTONE COMPND 6 ACETYLASE PCAF; COMPND 7 EC: 2.3.1.48; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: PCAF; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PET14B KEYWDS BROMODOMAIN, HISTONE-ACETYLTRANSFERASE, NMR-STRUCTURE KEYWDS 2 CHEMICAL LIGAND EXPDTA SOLUTION NMR AUTHOR L.ZENG,S.GODBOLE,M.MULLER,S.YAN,R.SANCHEZ,M.ZHOU REVDAT 2 24-FEB-09 1ZS5 1 VERSN REVDAT 1 23-MAY-06 1ZS5 0 JRNL AUTH L.ZENG,S.GODBOLE,M.MULLER,S.YAN,R.SANCHEZ,M.ZHOU JRNL TITL STRUCTURE-BASED EVALUATION OF SELECTIVE NAD JRNL TITL 2 NON-SELECTIVE SMALL MOLECULES THAT BLOCK HIV-1 TAT JRNL TITL 3 AND PCAF ASSOCIATION JRNL REF TO BE PUBLISHED JRNL REFN REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851, ARIA 2.0 REMARK 3 AUTHORS : BRUNGER (X-PLOR), M. NILGES & S. O'DONOGHUE REMARK 3 (ARIA) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1ZS5 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 21-JUN-05. REMARK 100 THE RCSB ID CODE IS RCSB033055. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 0.5MM SAMPLE IN 100MM REMARK 210 PHOSPHATE BUFFER CONTAINING REMARK 210 5MM PERDEUTERATED DTT, 10% REMARK 210 D2O; 0.5MM SAMPLE IN 100MM REMARK 210 PHOSPHATE BUFFER CONTAINING REMARK 210 5MM PERDEUTERATED DTT, 100% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, 3D_ REMARK 210 15N-SEPARATED_NOESY, 3D_13C_SEPERATED_FILTERED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : DISTANCE GEOMETRY REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 200 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR REMARK 210 SPECTROSCOPY 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 SER A 719 84.72 52.79 REMARK 500 LYS A 720 26.53 -162.16 REMARK 500 ASP A 724 158.50 57.66 REMARK 500 SER A 744 45.25 -87.73 REMARK 500 PHE A 748 -38.78 -130.98 REMARK 500 LYS A 753 -153.91 -64.97 REMARK 500 PRO A 758 83.04 -63.13 REMARK 500 TYR A 761 -54.48 69.86 REMARK 500 GLU A 762 44.69 -89.45 REMARK 500 VAL A 763 -42.44 -172.63 REMARK 500 ASN A 779 -73.50 -69.31 REMARK 500 ARG A 780 101.70 -177.00 REMARK 500 TYR A 781 -65.14 -156.94 REMARK 500 LYS A 811 -72.54 -47.79 REMARK 500 LEU A 829 -135.01 -95.07 REMARK 500 ILE A 830 143.04 61.27 REMARK 500 ASP A 831 -45.31 -163.79 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MIB A 201 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1WUG RELATED DB: PDB REMARK 900 THE SAME PROTEIN COMPLEXED WITH OTHER LIGANDS REMARK 900 RELATED ID: 1WUM RELATED DB: PDB REMARK 900 THE SAME PROTEIN COMPLEXED WITH OTHER LIGANDS DBREF 1ZS5 A 719 832 UNP Q92831 PCAF_HUMAN 719 832 SEQADV 1ZS5 GLY A 715 UNP Q92831 CLONING ARTIFACT SEQADV 1ZS5 SER A 716 UNP Q92831 CLONING ARTIFACT SEQADV 1ZS5 HIS A 717 UNP Q92831 CLONING ARTIFACT SEQADV 1ZS5 MET A 718 UNP Q92831 CLONING ARTIFACT SEQRES 1 A 118 GLY SER HIS MET SER LYS GLU PRO ARG ASP PRO ASP GLN SEQRES 2 A 118 LEU TYR SER THR LEU LYS SER ILE LEU GLN GLN VAL LYS SEQRES 3 A 118 SER HIS GLN SER ALA TRP PRO PHE MET GLU PRO VAL LYS SEQRES 4 A 118 ARG THR GLU ALA PRO GLY TYR TYR GLU VAL ILE ARG PHE SEQRES 5 A 118 PRO MET ASP LEU LYS THR MET SER GLU ARG LEU LYS ASN SEQRES 6 A 118 ARG TYR TYR VAL SER LYS LYS LEU PHE MET ALA ASP LEU SEQRES 7 A 118 GLN ARG VAL PHE THR ASN CYS LYS GLU TYR ASN PRO PRO SEQRES 8 A 118 GLU SER GLU TYR TYR LYS CYS ALA ASN ILE LEU GLU LYS SEQRES 9 A 118 PHE PHE PHE SER LYS ILE LYS GLU ALA GLY LEU ILE ASP SEQRES 10 A 118 LYS HET MIB A 201 28 HETNAM MIB (3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT-3-EN-2-ONE FORMUL 2 MIB C13 H13 N O HELIX 1 1 ARG A 723 HIS A 742 1 20 HELIX 2 2 ALA A 745 GLU A 750 1 6 HELIX 3 3 ASP A 769 ARG A 780 1 12 HELIX 4 4 SER A 784 ASN A 803 1 20 HELIX 5 5 SER A 807 ALA A 827 1 21 SITE *** AC1 11 PHE A 748 VAL A 752 LYS A 753 GLU A 756 SITE *** AC1 11 ALA A 757 TYR A 760 MET A 768 ASP A 769 SITE *** AC1 11 VAL A 795 ASN A 798 TYR A 802 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 810 TYR OH : rot -64:sc= 0.128 USER MOD Set 1.2: A 814 ASN : amide:sc= 0.11 X(o=0.24,f=0.15) USER MOD Set 2.1: A 803 ASN : amide:sc= -9.31! C(o=-12!,f=-15!) USER MOD Set 2.2: A 807 SER OG : rot -160:sc= -3.02! USER MOD Set 3.1: A 799 CYS SG : rot 123:sc= 0.635 USER MOD Set 3.2: A 802 TYR OH : rot -107:sc= 0.365 USER MOD Set 4.1: A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 755 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 743 GLN : amide:sc= 0 X(o=-1.5,f=-1.5) USER MOD Set 5.2: A 744 SER OG : rot 150:sc= -1.5! USER MOD Set 6.1: A 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 774 SER OG : rot -110:sc= -4.51! USER MOD Single : A 716 SER OG : rot 180:sc= 0.00207 USER MOD Single : A 717 HIS : no HD1:sc= -2.22 X(o=-2.2,f=-2.7!) USER MOD Single : A 718 MET CE :methyl -114:sc= -0.0433 (180deg=-0.38) USER MOD Single : A 719 SER OG : rot -104:sc= 0.0567 USER MOD Single : A 720 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 727 GLN : amide:sc= -0.0808 X(o=-0.081,f=-0.46) USER MOD Single : A 729 TYR OH : rot 72:sc= 1.09 USER MOD Single : A 730 SER OG : rot 180:sc= -0.011 USER MOD Single : A 731 THR OG1 : rot 62:sc= 0.855 USER MOD Single : A 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 734 SER OG : rot 81:sc= -0.24 USER MOD Single : A 737 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.3) USER MOD Single : A 738 GLN : amide:sc= -0.293 K(o=-0.29,f=-1.1) USER MOD Single : A 741 SER OG : rot 180:sc= 0 USER MOD Single : A 742 HIS : no HE2:sc= -6.06! C(o=-6.1!,f=-7.7!) USER MOD Single : A 749 MET CE :methyl -141:sc= -1.62 (180deg=-5.83!) USER MOD Single : A 760 TYR OH : rot 180:sc= -2.89 USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl -175:sc= 0 (180deg=-0.00423) USER MOD Single : A 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 772 THR OG1 : rot 180:sc= 0 USER MOD Single : A 773 MET CE :methyl -160:sc= -4.18 (180deg=-5.39!) USER MOD Single : A 778 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 779 ASN : amide:sc= -0.294 X(o=-0.29,f=-0.083) USER MOD Single : A 781 TYR OH : rot 180:sc= 0 USER MOD Single : A 782 TYR OH : rot 25:sc= 1.12 USER MOD Single : A 784 SER OG : rot 180:sc= 0 USER MOD Single : A 785 LYS NZ :NH3+ -175:sc= 0.941 (180deg=0.752) USER MOD Single : A 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 789 MET CE :methyl 150:sc= -2.35 (180deg=-7.42!) USER MOD Single : A 793 GLN : amide:sc= -0.214 K(o=-0.21,f=-1.3!) USER MOD Single : A 797 THR OG1 : rot -82:sc= 0.109 USER MOD Single : A 798 ASN : amide:sc= -4.55 K(o=-4.5,f=-1.1) USER MOD Single : A 800 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 809 TYR OH : rot 180:sc= 0 USER MOD Single : A 811 LYS NZ :NH3+ -110:sc= -0.0876 (180deg=-1.37) USER MOD Single : A 812 CYS SG : rot -155:sc= -5.09 USER MOD Single : A 818 LYS NZ :NH3+ 148:sc=-0.00359 (180deg=-0.259) USER MOD Single : A 822 SER OG : rot 180:sc= 0 USER MOD Single : A 823 LYS NZ :NH3+ 140:sc= -2.36! (180deg=-4.63!) USER MOD Single : A 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 832 LYS NZ :NH3+ 174:sc= 0.59 (180deg=0.565) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -31.977 4.812 2.076 1.00 0.00 N ATOM 2 CA GLY A 715 -32.076 5.408 3.437 1.00 0.00 C ATOM 3 C GLY A 715 -31.144 6.617 3.531 1.00 0.00 C ATOM 4 O GLY A 715 -31.424 7.671 2.995 1.00 0.00 O ATOM 0 HA2 GLY A 715 -33.103 5.710 3.640 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -31.807 4.668 4.191 1.00 0.00 H new ATOM 10 N SER A 716 -30.037 6.475 4.207 1.00 0.00 N ATOM 11 CA SER A 716 -29.089 7.617 4.333 1.00 0.00 C ATOM 12 C SER A 716 -27.770 7.291 3.631 1.00 0.00 C ATOM 13 O SER A 716 -27.647 6.289 2.954 1.00 0.00 O ATOM 14 CB SER A 716 -28.868 7.778 5.839 1.00 0.00 C ATOM 15 OG SER A 716 -28.447 6.540 6.392 1.00 0.00 O ATOM 0 H SER A 716 -29.748 5.617 4.677 1.00 0.00 H new ATOM 0 HA SER A 716 -29.475 8.528 3.875 1.00 0.00 H new ATOM 0 HB2 SER A 716 -28.118 8.546 6.027 1.00 0.00 H new ATOM 0 HB3 SER A 716 -29.789 8.108 6.319 1.00 0.00 H new ATOM 0 HG SER A 716 -28.304 6.644 7.356 1.00 0.00 H new ATOM 21 N HIS A 717 -26.783 8.131 3.782 1.00 0.00 N ATOM 22 CA HIS A 717 -25.474 7.869 3.120 1.00 0.00 C ATOM 23 C HIS A 717 -24.375 7.689 4.169 1.00 0.00 C ATOM 24 O HIS A 717 -24.089 8.581 4.942 1.00 0.00 O ATOM 25 CB HIS A 717 -25.205 9.117 2.276 1.00 0.00 C ATOM 26 CG HIS A 717 -25.192 10.330 3.164 1.00 0.00 C ATOM 27 ND1 HIS A 717 -24.021 10.834 3.708 1.00 0.00 N ATOM 28 CD2 HIS A 717 -26.197 11.152 3.610 1.00 0.00 C ATOM 29 CE1 HIS A 717 -24.348 11.912 4.444 1.00 0.00 C ATOM 30 NE2 HIS A 717 -25.662 12.150 4.419 1.00 0.00 N ATOM 0 H HIS A 717 -26.826 8.987 4.335 1.00 0.00 H new ATOM 0 HA HIS A 717 -25.490 6.960 2.518 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -24.250 9.021 1.760 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -25.972 9.223 1.509 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -27.244 11.041 3.370 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -23.634 12.512 4.989 1.00 0.00 H new ATOM 0 HE2 HIS A 717 -26.165 12.901 4.891 1.00 0.00 H new ATOM 38 N MET A 718 -23.757 6.540 4.202 1.00 0.00 N ATOM 39 CA MET A 718 -22.680 6.302 5.204 1.00 0.00 C ATOM 40 C MET A 718 -21.360 5.974 4.503 1.00 0.00 C ATOM 41 O MET A 718 -20.292 6.266 5.004 1.00 0.00 O ATOM 42 CB MET A 718 -23.161 5.102 6.021 1.00 0.00 C ATOM 43 CG MET A 718 -22.668 5.235 7.462 1.00 0.00 C ATOM 44 SD MET A 718 -23.467 3.980 8.492 1.00 0.00 S ATOM 45 CE MET A 718 -25.053 4.828 8.691 1.00 0.00 C ATOM 0 H MET A 718 -23.951 5.756 3.579 1.00 0.00 H new ATOM 0 HA MET A 718 -22.498 7.178 5.826 1.00 0.00 H new ATOM 0 HB2 MET A 718 -24.249 5.048 6.001 1.00 0.00 H new ATOM 0 HB3 MET A 718 -22.788 4.177 5.582 1.00 0.00 H new ATOM 0 HG2 MET A 718 -21.585 5.116 7.499 1.00 0.00 H new ATOM 0 HG3 MET A 718 -22.893 6.231 7.844 1.00 0.00 H new ATOM 0 HE1 MET A 718 -25.187 5.108 9.736 1.00 0.00 H new ATOM 0 HE2 MET A 718 -25.067 5.724 8.071 1.00 0.00 H new ATOM 0 HE3 MET A 718 -25.862 4.163 8.387 1.00 0.00 H new ATOM 55 N SER A 719 -21.423 5.367 3.349 1.00 0.00 N ATOM 56 CA SER A 719 -20.170 5.018 2.621 1.00 0.00 C ATOM 57 C SER A 719 -19.226 4.230 3.533 1.00 0.00 C ATOM 58 O SER A 719 -18.346 4.785 4.159 1.00 0.00 O ATOM 59 CB SER A 719 -19.546 6.365 2.245 1.00 0.00 C ATOM 60 OG SER A 719 -18.941 6.265 0.965 1.00 0.00 O ATOM 0 H SER A 719 -22.287 5.098 2.879 1.00 0.00 H new ATOM 0 HA SER A 719 -20.361 4.394 1.748 1.00 0.00 H new ATOM 0 HB2 SER A 719 -20.310 7.143 2.238 1.00 0.00 H new ATOM 0 HB3 SER A 719 -18.803 6.654 2.989 1.00 0.00 H new ATOM 0 HG SER A 719 -17.968 6.205 1.067 1.00 0.00 H new ATOM 66 N LYS A 720 -19.407 2.940 3.616 1.00 0.00 N ATOM 67 CA LYS A 720 -18.520 2.118 4.488 1.00 0.00 C ATOM 68 C LYS A 720 -18.614 0.641 4.103 1.00 0.00 C ATOM 69 O LYS A 720 -18.385 -0.237 4.911 1.00 0.00 O ATOM 70 CB LYS A 720 -19.050 2.335 5.906 1.00 0.00 C ATOM 71 CG LYS A 720 -17.923 2.867 6.795 1.00 0.00 C ATOM 72 CD LYS A 720 -16.822 1.811 6.909 1.00 0.00 C ATOM 73 CE LYS A 720 -15.537 2.343 6.271 1.00 0.00 C ATOM 74 NZ LYS A 720 -14.801 3.000 7.388 1.00 0.00 N ATOM 0 H LYS A 720 -20.130 2.420 3.118 1.00 0.00 H new ATOM 0 HA LYS A 720 -17.472 2.403 4.393 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -19.880 3.041 5.891 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -19.435 1.398 6.309 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -17.517 3.787 6.374 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -18.310 3.112 7.784 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -16.646 1.565 7.956 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -17.133 0.891 6.414 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -14.950 1.536 5.831 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -15.756 3.051 5.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -13.906 3.391 7.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -15.382 3.767 7.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -14.601 2.300 8.131 1.00 0.00 H new ATOM 88 N GLU A 721 -18.944 0.359 2.872 1.00 0.00 N ATOM 89 CA GLU A 721 -19.046 -1.062 2.435 1.00 0.00 C ATOM 90 C GLU A 721 -18.760 -1.177 0.930 1.00 0.00 C ATOM 91 O GLU A 721 -19.387 -0.503 0.136 1.00 0.00 O ATOM 92 CB GLU A 721 -20.494 -1.460 2.733 1.00 0.00 C ATOM 93 CG GLU A 721 -21.448 -0.489 2.033 1.00 0.00 C ATOM 94 CD GLU A 721 -22.201 -1.224 0.922 1.00 0.00 C ATOM 95 OE1 GLU A 721 -23.153 -1.918 1.238 1.00 0.00 O ATOM 96 OE2 GLU A 721 -21.813 -1.078 -0.225 1.00 0.00 O ATOM 0 H GLU A 721 -19.147 1.051 2.151 1.00 0.00 H new ATOM 0 HA GLU A 721 -18.328 -1.704 2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -20.680 -2.478 2.391 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -20.671 -1.448 3.808 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -22.154 -0.074 2.752 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -20.889 0.349 1.615 1.00 0.00 H new ATOM 103 N PRO A 722 -17.821 -2.025 0.577 1.00 0.00 N ATOM 104 CA PRO A 722 -17.477 -2.207 -0.855 1.00 0.00 C ATOM 105 C PRO A 722 -18.692 -2.715 -1.634 1.00 0.00 C ATOM 106 O PRO A 722 -19.756 -2.914 -1.083 1.00 0.00 O ATOM 107 CB PRO A 722 -16.365 -3.260 -0.846 1.00 0.00 C ATOM 108 CG PRO A 722 -16.415 -3.892 0.511 1.00 0.00 C ATOM 109 CD PRO A 722 -17.011 -2.882 1.451 1.00 0.00 C ATOM 0 HA PRO A 722 -17.166 -1.278 -1.333 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -16.522 -4.002 -1.629 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -15.392 -2.804 -1.030 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -17.017 -4.800 0.490 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -15.416 -4.179 0.838 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -17.620 -3.360 2.218 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -16.239 -2.311 1.967 1.00 0.00 H new ATOM 117 N ARG A 723 -18.543 -2.923 -2.914 1.00 0.00 N ATOM 118 CA ARG A 723 -19.694 -3.412 -3.726 1.00 0.00 C ATOM 119 C ARG A 723 -19.267 -4.589 -4.605 1.00 0.00 C ATOM 120 O ARG A 723 -18.711 -4.408 -5.669 1.00 0.00 O ATOM 121 CB ARG A 723 -20.094 -2.218 -4.595 1.00 0.00 C ATOM 122 CG ARG A 723 -20.394 -1.013 -3.702 1.00 0.00 C ATOM 123 CD ARG A 723 -19.108 -0.217 -3.472 1.00 0.00 C ATOM 124 NE ARG A 723 -19.490 1.207 -3.709 1.00 0.00 N ATOM 125 CZ ARG A 723 -18.573 2.141 -3.819 1.00 0.00 C ATOM 126 NH1 ARG A 723 -17.298 1.851 -3.727 1.00 0.00 N ATOM 127 NH2 ARG A 723 -18.937 3.377 -4.025 1.00 0.00 N ATOM 0 H ARG A 723 -17.676 -2.776 -3.432 1.00 0.00 H new ATOM 0 HA ARG A 723 -20.516 -3.765 -3.103 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -19.291 -1.977 -5.291 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -20.970 -2.468 -5.193 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -21.148 -0.379 -4.169 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -20.804 -1.346 -2.748 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -18.730 -0.361 -2.460 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -18.320 -0.534 -4.155 1.00 0.00 H new ATOM 0 HE ARG A 723 -20.476 1.458 -3.786 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -17.004 0.887 -3.568 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -16.599 2.589 -3.815 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -19.927 3.611 -4.099 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -18.232 4.109 -4.112 1.00 0.00 H new ATOM 141 N ASP A 724 -19.541 -5.793 -4.173 1.00 0.00 N ATOM 142 CA ASP A 724 -19.158 -6.995 -4.975 1.00 0.00 C ATOM 143 C ASP A 724 -17.649 -7.019 -5.237 1.00 0.00 C ATOM 144 O ASP A 724 -16.987 -6.003 -5.158 1.00 0.00 O ATOM 145 CB ASP A 724 -19.932 -6.872 -6.293 1.00 0.00 C ATOM 146 CG ASP A 724 -21.269 -7.610 -6.175 1.00 0.00 C ATOM 147 OD1 ASP A 724 -21.407 -8.410 -5.264 1.00 0.00 O ATOM 148 OD2 ASP A 724 -22.133 -7.363 -7.001 1.00 0.00 O ATOM 0 H ASP A 724 -20.016 -5.997 -3.294 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.397 -7.919 -4.449 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -20.104 -5.822 -6.528 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -19.345 -7.290 -7.111 1.00 0.00 H new ATOM 153 N PRO A 725 -17.146 -8.194 -5.528 1.00 0.00 N ATOM 154 CA PRO A 725 -15.697 -8.348 -5.790 1.00 0.00 C ATOM 155 C PRO A 725 -15.321 -7.712 -7.130 1.00 0.00 C ATOM 156 O PRO A 725 -14.184 -7.350 -7.360 1.00 0.00 O ATOM 157 CB PRO A 725 -15.495 -9.861 -5.839 1.00 0.00 C ATOM 158 CG PRO A 725 -16.839 -10.434 -6.157 1.00 0.00 C ATOM 159 CD PRO A 725 -17.868 -9.472 -5.631 1.00 0.00 C ATOM 0 HA PRO A 725 -15.077 -7.862 -5.036 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -14.762 -10.135 -6.598 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.123 -10.238 -4.886 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -16.954 -10.571 -7.232 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -16.958 -11.415 -5.696 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -18.722 -9.394 -6.304 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -18.254 -9.791 -4.663 1.00 0.00 H new ATOM 167 N ASP A 726 -16.267 -7.577 -8.020 1.00 0.00 N ATOM 168 CA ASP A 726 -15.963 -6.964 -9.344 1.00 0.00 C ATOM 169 C ASP A 726 -15.524 -5.511 -9.167 1.00 0.00 C ATOM 170 O ASP A 726 -14.407 -5.148 -9.480 1.00 0.00 O ATOM 171 CB ASP A 726 -17.280 -7.031 -10.119 1.00 0.00 C ATOM 172 CG ASP A 726 -17.234 -8.201 -11.103 1.00 0.00 C ATOM 173 OD1 ASP A 726 -17.106 -9.326 -10.649 1.00 0.00 O ATOM 174 OD2 ASP A 726 -17.327 -7.952 -12.294 1.00 0.00 O ATOM 0 H ASP A 726 -17.237 -7.865 -7.887 1.00 0.00 H new ATOM 0 HA ASP A 726 -15.154 -7.480 -9.862 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -18.114 -7.155 -9.429 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -17.446 -6.097 -10.656 1.00 0.00 H new ATOM 179 N GLN A 727 -16.392 -4.676 -8.668 1.00 0.00 N ATOM 180 CA GLN A 727 -16.018 -3.249 -8.469 1.00 0.00 C ATOM 181 C GLN A 727 -14.806 -3.146 -7.542 1.00 0.00 C ATOM 182 O GLN A 727 -13.832 -2.488 -7.848 1.00 0.00 O ATOM 183 CB GLN A 727 -17.245 -2.608 -7.819 1.00 0.00 C ATOM 184 CG GLN A 727 -18.451 -2.759 -8.748 1.00 0.00 C ATOM 185 CD GLN A 727 -18.593 -1.500 -9.605 1.00 0.00 C ATOM 186 OE1 GLN A 727 -18.600 -0.399 -9.091 1.00 0.00 O ATOM 187 NE2 GLN A 727 -18.706 -1.615 -10.900 1.00 0.00 N ATOM 0 H GLN A 727 -17.343 -4.920 -8.390 1.00 0.00 H new ATOM 0 HA GLN A 727 -15.746 -2.758 -9.403 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -17.450 -3.081 -6.859 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -17.055 -1.553 -7.620 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -18.325 -3.634 -9.386 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -19.357 -2.918 -8.163 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -18.700 -2.539 -11.332 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -18.800 -0.781 -11.480 1.00 0.00 H new ATOM 196 N LEU A 728 -14.853 -3.804 -6.416 1.00 0.00 N ATOM 197 CA LEU A 728 -13.701 -3.750 -5.472 1.00 0.00 C ATOM 198 C LEU A 728 -12.406 -4.136 -6.193 1.00 0.00 C ATOM 199 O LEU A 728 -11.366 -3.550 -5.975 1.00 0.00 O ATOM 200 CB LEU A 728 -14.043 -4.774 -4.382 1.00 0.00 C ATOM 201 CG LEU A 728 -12.841 -4.972 -3.453 1.00 0.00 C ATOM 202 CD1 LEU A 728 -12.458 -3.636 -2.812 1.00 0.00 C ATOM 203 CD2 LEU A 728 -13.204 -5.978 -2.358 1.00 0.00 C ATOM 0 H LEU A 728 -15.639 -4.377 -6.109 1.00 0.00 H new ATOM 0 HA LEU A 728 -13.544 -2.753 -5.061 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -14.904 -4.432 -3.808 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -14.321 -5.724 -4.838 1.00 0.00 H new ATOM 0 HG LEU A 728 -11.997 -5.349 -4.030 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -11.603 -3.781 -2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -12.198 -2.920 -3.591 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -13.301 -3.254 -2.235 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -12.349 -6.120 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -14.050 -5.601 -1.783 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -13.472 -6.931 -2.814 1.00 0.00 H new ATOM 215 N TYR A 729 -12.458 -5.119 -7.049 1.00 0.00 N ATOM 216 CA TYR A 729 -11.224 -5.536 -7.774 1.00 0.00 C ATOM 217 C TYR A 729 -10.567 -4.329 -8.447 1.00 0.00 C ATOM 218 O TYR A 729 -9.499 -3.892 -8.060 1.00 0.00 O ATOM 219 CB TYR A 729 -11.703 -6.536 -8.827 1.00 0.00 C ATOM 220 CG TYR A 729 -10.522 -7.012 -9.637 1.00 0.00 C ATOM 221 CD1 TYR A 729 -9.697 -8.028 -9.140 1.00 0.00 C ATOM 222 CD2 TYR A 729 -10.246 -6.432 -10.880 1.00 0.00 C ATOM 223 CE1 TYR A 729 -8.600 -8.467 -9.888 1.00 0.00 C ATOM 224 CE2 TYR A 729 -9.148 -6.871 -11.629 1.00 0.00 C ATOM 225 CZ TYR A 729 -8.324 -7.889 -11.133 1.00 0.00 C ATOM 226 OH TYR A 729 -7.242 -8.322 -11.871 1.00 0.00 O ATOM 0 H TYR A 729 -13.298 -5.650 -7.278 1.00 0.00 H new ATOM 0 HA TYR A 729 -10.481 -5.969 -7.104 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -12.193 -7.382 -8.345 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -12.441 -6.069 -9.479 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -9.908 -8.473 -8.179 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -10.880 -5.646 -11.262 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -7.965 -9.252 -9.505 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -8.936 -6.425 -12.589 1.00 0.00 H new ATOM 0 HH TYR A 729 -7.427 -9.215 -12.229 1.00 0.00 H new ATOM 236 N SER A 730 -11.197 -3.780 -9.448 1.00 0.00 N ATOM 237 CA SER A 730 -10.602 -2.605 -10.141 1.00 0.00 C ATOM 238 C SER A 730 -10.414 -1.447 -9.157 1.00 0.00 C ATOM 239 O SER A 730 -9.492 -0.665 -9.278 1.00 0.00 O ATOM 240 CB SER A 730 -11.606 -2.234 -11.236 1.00 0.00 C ATOM 241 OG SER A 730 -12.556 -1.309 -10.726 1.00 0.00 O ATOM 0 H SER A 730 -12.096 -4.094 -9.815 1.00 0.00 H new ATOM 0 HA SER A 730 -9.618 -2.825 -10.556 1.00 0.00 H new ATOM 0 HB2 SER A 730 -11.084 -1.800 -12.089 1.00 0.00 H new ATOM 0 HB3 SER A 730 -12.113 -3.129 -11.595 1.00 0.00 H new ATOM 0 HG SER A 730 -13.195 -1.074 -11.431 1.00 0.00 H new ATOM 247 N THR A 731 -11.268 -1.335 -8.172 1.00 0.00 N ATOM 248 CA THR A 731 -11.105 -0.237 -7.176 1.00 0.00 C ATOM 249 C THR A 731 -9.700 -0.295 -6.576 1.00 0.00 C ATOM 250 O THR A 731 -8.979 0.683 -6.565 1.00 0.00 O ATOM 251 CB THR A 731 -12.162 -0.502 -6.103 1.00 0.00 C ATOM 252 OG1 THR A 731 -13.456 -0.398 -6.677 1.00 0.00 O ATOM 253 CG2 THR A 731 -12.017 0.529 -4.982 1.00 0.00 C ATOM 0 H THR A 731 -12.065 -1.952 -8.016 1.00 0.00 H new ATOM 0 HA THR A 731 -11.229 0.751 -7.620 1.00 0.00 H new ATOM 0 HB THR A 731 -12.025 -1.504 -5.697 1.00 0.00 H new ATOM 0 HG1 THR A 731 -13.559 -1.077 -7.376 1.00 0.00 H new ATOM 0 HG21 THR A 731 -12.770 0.342 -4.216 1.00 0.00 H new ATOM 0 HG22 THR A 731 -11.023 0.450 -4.541 1.00 0.00 H new ATOM 0 HG23 THR A 731 -12.155 1.531 -5.389 1.00 0.00 H new ATOM 261 N LEU A 732 -9.291 -1.444 -6.108 1.00 0.00 N ATOM 262 CA LEU A 732 -7.909 -1.567 -5.573 1.00 0.00 C ATOM 263 C LEU A 732 -6.919 -1.254 -6.694 1.00 0.00 C ATOM 264 O LEU A 732 -5.899 -0.627 -6.486 1.00 0.00 O ATOM 265 CB LEU A 732 -7.768 -3.029 -5.135 1.00 0.00 C ATOM 266 CG LEU A 732 -8.821 -3.365 -4.075 1.00 0.00 C ATOM 267 CD1 LEU A 732 -8.648 -4.821 -3.635 1.00 0.00 C ATOM 268 CD2 LEU A 732 -8.650 -2.444 -2.864 1.00 0.00 C ATOM 0 H LEU A 732 -9.851 -2.296 -6.074 1.00 0.00 H new ATOM 0 HA LEU A 732 -7.715 -0.884 -4.746 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -7.884 -3.687 -5.996 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -6.769 -3.202 -4.734 1.00 0.00 H new ATOM 0 HG LEU A 732 -9.816 -3.223 -4.496 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -9.396 -5.064 -2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -8.773 -5.478 -4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -7.651 -4.958 -3.216 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -9.402 -2.687 -2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -7.655 -2.582 -2.440 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -8.771 -1.407 -3.176 1.00 0.00 H new ATOM 280 N LYS A 733 -7.237 -1.667 -7.892 1.00 0.00 N ATOM 281 CA LYS A 733 -6.345 -1.380 -9.050 1.00 0.00 C ATOM 282 C LYS A 733 -6.274 0.127 -9.298 1.00 0.00 C ATOM 283 O LYS A 733 -5.258 0.649 -9.711 1.00 0.00 O ATOM 284 CB LYS A 733 -7.003 -2.100 -10.227 1.00 0.00 C ATOM 285 CG LYS A 733 -6.069 -2.067 -11.435 1.00 0.00 C ATOM 286 CD LYS A 733 -6.468 -3.181 -12.404 1.00 0.00 C ATOM 287 CE LYS A 733 -7.149 -2.573 -13.632 1.00 0.00 C ATOM 288 NZ LYS A 733 -6.043 -2.320 -14.599 1.00 0.00 N ATOM 0 H LYS A 733 -8.081 -2.193 -8.118 1.00 0.00 H new ATOM 0 HA LYS A 733 -5.321 -1.716 -8.889 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -7.227 -3.132 -9.956 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -7.951 -1.622 -10.474 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -6.129 -1.098 -11.930 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -5.035 -2.199 -11.115 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -5.587 -3.746 -12.707 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -7.142 -3.881 -11.911 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -7.891 -3.254 -14.050 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -7.670 -1.650 -13.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -6.431 -1.902 -15.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -5.356 -1.664 -14.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -5.569 -3.217 -14.827 1.00 0.00 H new ATOM 302 N SER A 734 -7.335 0.835 -9.023 1.00 0.00 N ATOM 303 CA SER A 734 -7.303 2.313 -9.202 1.00 0.00 C ATOM 304 C SER A 734 -6.510 2.944 -8.059 1.00 0.00 C ATOM 305 O SER A 734 -5.667 3.795 -8.267 1.00 0.00 O ATOM 306 CB SER A 734 -8.765 2.761 -9.140 1.00 0.00 C ATOM 307 OG SER A 734 -9.605 1.729 -9.636 1.00 0.00 O ATOM 0 H SER A 734 -8.219 0.456 -8.684 1.00 0.00 H new ATOM 0 HA SER A 734 -6.831 2.609 -10.139 1.00 0.00 H new ATOM 0 HB2 SER A 734 -9.038 3.002 -8.113 1.00 0.00 H new ATOM 0 HB3 SER A 734 -8.902 3.669 -9.728 1.00 0.00 H new ATOM 0 HG SER A 734 -9.747 1.058 -8.936 1.00 0.00 H new ATOM 313 N ILE A 735 -6.766 2.520 -6.850 1.00 0.00 N ATOM 314 CA ILE A 735 -6.012 3.073 -5.693 1.00 0.00 C ATOM 315 C ILE A 735 -4.514 2.878 -5.917 1.00 0.00 C ATOM 316 O ILE A 735 -3.721 3.768 -5.688 1.00 0.00 O ATOM 317 CB ILE A 735 -6.486 2.262 -4.485 1.00 0.00 C ATOM 318 CG1 ILE A 735 -7.972 2.530 -4.240 1.00 0.00 C ATOM 319 CG2 ILE A 735 -5.686 2.675 -3.248 1.00 0.00 C ATOM 320 CD1 ILE A 735 -8.520 1.496 -3.255 1.00 0.00 C ATOM 0 H ILE A 735 -7.465 1.815 -6.616 1.00 0.00 H new ATOM 0 HA ILE A 735 -6.182 4.140 -5.553 1.00 0.00 H new ATOM 0 HB ILE A 735 -6.335 1.200 -4.680 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -8.111 3.536 -3.843 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -8.522 2.480 -5.180 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -6.023 2.098 -2.387 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -4.627 2.485 -3.420 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -5.838 3.737 -3.055 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -9.579 1.686 -3.080 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -8.395 0.496 -3.670 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -7.977 1.568 -2.312 1.00 0.00 H new ATOM 332 N LEU A 736 -4.121 1.723 -6.378 1.00 0.00 N ATOM 333 CA LEU A 736 -2.677 1.487 -6.648 1.00 0.00 C ATOM 334 C LEU A 736 -2.218 2.396 -7.786 1.00 0.00 C ATOM 335 O LEU A 736 -1.140 2.955 -7.754 1.00 0.00 O ATOM 336 CB LEU A 736 -2.587 0.020 -7.068 1.00 0.00 C ATOM 337 CG LEU A 736 -1.240 -0.558 -6.623 1.00 0.00 C ATOM 338 CD1 LEU A 736 -1.120 -0.466 -5.101 1.00 0.00 C ATOM 339 CD2 LEU A 736 -1.145 -2.023 -7.054 1.00 0.00 C ATOM 0 H LEU A 736 -4.736 0.935 -6.579 1.00 0.00 H new ATOM 0 HA LEU A 736 -2.047 1.699 -5.784 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -3.403 -0.548 -6.622 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -2.692 -0.067 -8.149 1.00 0.00 H new ATOM 0 HG LEU A 736 -0.433 0.010 -7.085 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -0.161 -0.878 -4.786 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -1.186 0.578 -4.793 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -1.928 -1.032 -4.637 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -0.186 -2.434 -6.737 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -1.953 -2.591 -6.593 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -1.227 -2.089 -8.139 1.00 0.00 H new ATOM 351 N GLN A 737 -3.039 2.560 -8.785 1.00 0.00 N ATOM 352 CA GLN A 737 -2.665 3.455 -9.912 1.00 0.00 C ATOM 353 C GLN A 737 -2.341 4.850 -9.376 1.00 0.00 C ATOM 354 O GLN A 737 -1.391 5.482 -9.794 1.00 0.00 O ATOM 355 CB GLN A 737 -3.906 3.496 -10.805 1.00 0.00 C ATOM 356 CG GLN A 737 -3.781 2.435 -11.898 1.00 0.00 C ATOM 357 CD GLN A 737 -2.615 2.789 -12.823 1.00 0.00 C ATOM 358 OE1 GLN A 737 -1.700 2.008 -12.991 1.00 0.00 O ATOM 359 NE2 GLN A 737 -2.610 3.942 -13.433 1.00 0.00 N ATOM 0 H GLN A 737 -3.952 2.113 -8.869 1.00 0.00 H new ATOM 0 HA GLN A 737 -1.786 3.107 -10.454 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -4.802 3.317 -10.210 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -4.013 4.484 -11.253 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -3.619 1.454 -11.451 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -4.707 2.376 -12.470 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -3.379 4.597 -13.291 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -1.837 4.188 -14.052 1.00 0.00 H new ATOM 368 N GLN A 738 -3.112 5.324 -8.435 1.00 0.00 N ATOM 369 CA GLN A 738 -2.836 6.671 -7.858 1.00 0.00 C ATOM 370 C GLN A 738 -1.712 6.580 -6.824 1.00 0.00 C ATOM 371 O GLN A 738 -0.710 7.260 -6.919 1.00 0.00 O ATOM 372 CB GLN A 738 -4.144 7.084 -7.181 1.00 0.00 C ATOM 373 CG GLN A 738 -5.273 7.099 -8.214 1.00 0.00 C ATOM 374 CD GLN A 738 -4.942 8.105 -9.317 1.00 0.00 C ATOM 375 OE1 GLN A 738 -4.236 7.787 -10.253 1.00 0.00 O ATOM 376 NE2 GLN A 738 -5.425 9.315 -9.246 1.00 0.00 N ATOM 0 H GLN A 738 -3.918 4.839 -8.042 1.00 0.00 H new ATOM 0 HA GLN A 738 -2.520 7.388 -8.615 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -4.383 6.390 -6.375 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -4.036 8.071 -6.730 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -5.403 6.105 -8.641 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -6.215 7.365 -7.735 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -6.018 9.582 -8.460 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -5.210 9.994 -9.976 1.00 0.00 H new ATOM 385 N VAL A 739 -1.870 5.735 -5.841 1.00 0.00 N ATOM 386 CA VAL A 739 -0.814 5.582 -4.799 1.00 0.00 C ATOM 387 C VAL A 739 0.556 5.377 -5.455 1.00 0.00 C ATOM 388 O VAL A 739 1.526 6.020 -5.106 1.00 0.00 O ATOM 389 CB VAL A 739 -1.237 4.332 -4.008 1.00 0.00 C ATOM 390 CG1 VAL A 739 -0.105 3.887 -3.074 1.00 0.00 C ATOM 391 CG2 VAL A 739 -2.479 4.657 -3.176 1.00 0.00 C ATOM 0 H VAL A 739 -2.689 5.141 -5.714 1.00 0.00 H new ATOM 0 HA VAL A 739 -0.721 6.461 -4.161 1.00 0.00 H new ATOM 0 HB VAL A 739 -1.458 3.526 -4.708 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -0.417 3.002 -2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 739 0.782 3.653 -3.663 1.00 0.00 H new ATOM 0 HG13 VAL A 739 0.126 4.690 -2.374 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.782 3.774 -2.614 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -2.251 5.467 -2.483 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -3.290 4.962 -3.837 1.00 0.00 H new ATOM 401 N LYS A 740 0.640 4.486 -6.402 1.00 0.00 N ATOM 402 CA LYS A 740 1.943 4.235 -7.076 1.00 0.00 C ATOM 403 C LYS A 740 2.355 5.447 -7.917 1.00 0.00 C ATOM 404 O LYS A 740 3.486 5.887 -7.875 1.00 0.00 O ATOM 405 CB LYS A 740 1.688 3.024 -7.974 1.00 0.00 C ATOM 406 CG LYS A 740 2.990 2.253 -8.169 1.00 0.00 C ATOM 407 CD LYS A 740 3.054 1.707 -9.597 1.00 0.00 C ATOM 408 CE LYS A 740 1.878 0.759 -9.837 1.00 0.00 C ATOM 409 NZ LYS A 740 2.076 0.253 -11.224 1.00 0.00 N ATOM 0 H LYS A 740 -0.139 3.920 -6.739 1.00 0.00 H new ATOM 0 HA LYS A 740 2.749 4.060 -6.363 1.00 0.00 H new ATOM 0 HB2 LYS A 740 0.934 2.378 -7.526 1.00 0.00 H new ATOM 0 HB3 LYS A 740 1.297 3.349 -8.938 1.00 0.00 H new ATOM 0 HG2 LYS A 740 3.843 2.905 -7.980 1.00 0.00 H new ATOM 0 HG3 LYS A 740 3.050 1.434 -7.453 1.00 0.00 H new ATOM 0 HD2 LYS A 740 3.024 2.528 -10.313 1.00 0.00 H new ATOM 0 HD3 LYS A 740 3.996 1.181 -9.754 1.00 0.00 H new ATOM 0 HE2 LYS A 740 1.874 -0.057 -9.115 1.00 0.00 H new ATOM 0 HE3 LYS A 740 0.925 1.278 -9.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 1.308 -0.406 -11.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 2.069 1.052 -11.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 2.989 -0.241 -11.286 1.00 0.00 H new ATOM 423 N SER A 741 1.446 5.990 -8.683 1.00 0.00 N ATOM 424 CA SER A 741 1.788 7.171 -9.525 1.00 0.00 C ATOM 425 C SER A 741 2.131 8.378 -8.646 1.00 0.00 C ATOM 426 O SER A 741 2.773 9.313 -9.081 1.00 0.00 O ATOM 427 CB SER A 741 0.521 7.449 -10.338 1.00 0.00 C ATOM 428 OG SER A 741 0.696 8.635 -11.098 1.00 0.00 O ATOM 0 H SER A 741 0.482 5.666 -8.761 1.00 0.00 H new ATOM 0 HA SER A 741 2.656 6.987 -10.158 1.00 0.00 H new ATOM 0 HB2 SER A 741 0.309 6.609 -10.999 1.00 0.00 H new ATOM 0 HB3 SER A 741 -0.335 7.554 -9.672 1.00 0.00 H new ATOM 0 HG SER A 741 -0.115 8.812 -11.620 1.00 0.00 H new ATOM 434 N HIS A 742 1.704 8.364 -7.413 1.00 0.00 N ATOM 435 CA HIS A 742 1.994 9.508 -6.502 1.00 0.00 C ATOM 436 C HIS A 742 3.505 9.675 -6.305 1.00 0.00 C ATOM 437 O HIS A 742 4.220 8.719 -6.078 1.00 0.00 O ATOM 438 CB HIS A 742 1.323 9.115 -5.183 1.00 0.00 C ATOM 439 CG HIS A 742 1.492 10.212 -4.169 1.00 0.00 C ATOM 440 ND1 HIS A 742 1.749 11.526 -4.527 1.00 0.00 N ATOM 441 CD2 HIS A 742 1.431 10.203 -2.800 1.00 0.00 C ATOM 442 CE1 HIS A 742 1.838 12.244 -3.391 1.00 0.00 C ATOM 443 NE2 HIS A 742 1.648 11.486 -2.310 1.00 0.00 N ATOM 0 H HIS A 742 1.164 7.606 -6.995 1.00 0.00 H new ATOM 0 HA HIS A 742 1.628 10.457 -6.895 1.00 0.00 H new ATOM 0 HB2 HIS A 742 0.263 8.923 -5.349 1.00 0.00 H new ATOM 0 HB3 HIS A 742 1.759 8.190 -4.806 1.00 0.00 H new ATOM 0 HD1 HIS A 742 1.852 11.884 -5.477 1.00 0.00 H new ATOM 0 HD2 HIS A 742 1.243 9.330 -2.193 1.00 0.00 H new ATOM 0 HE1 HIS A 742 2.039 13.305 -3.359 1.00 0.00 H new ATOM 451 N GLN A 743 3.996 10.885 -6.379 1.00 0.00 N ATOM 452 CA GLN A 743 5.460 11.119 -6.187 1.00 0.00 C ATOM 453 C GLN A 743 5.950 10.420 -4.917 1.00 0.00 C ATOM 454 O GLN A 743 7.085 10.005 -4.824 1.00 0.00 O ATOM 455 CB GLN A 743 5.592 12.644 -6.043 1.00 0.00 C ATOM 456 CG GLN A 743 7.008 13.013 -5.575 1.00 0.00 C ATOM 457 CD GLN A 743 6.929 13.730 -4.222 1.00 0.00 C ATOM 458 OE1 GLN A 743 6.564 14.887 -4.160 1.00 0.00 O ATOM 459 NE2 GLN A 743 7.260 13.093 -3.127 1.00 0.00 N ATOM 0 H GLN A 743 3.446 11.723 -6.564 1.00 0.00 H new ATOM 0 HA GLN A 743 6.055 10.726 -7.012 1.00 0.00 H new ATOM 0 HB2 GLN A 743 5.379 13.126 -6.997 1.00 0.00 H new ATOM 0 HB3 GLN A 743 4.857 13.014 -5.328 1.00 0.00 H new ATOM 0 HG2 GLN A 743 7.619 12.115 -5.487 1.00 0.00 H new ATOM 0 HG3 GLN A 743 7.490 13.656 -6.312 1.00 0.00 H new ATOM 0 HE21 GLN A 743 7.567 12.121 -3.175 1.00 0.00 H new ATOM 0 HE22 GLN A 743 7.211 13.568 -2.226 1.00 0.00 H new ATOM 468 N SER A 744 5.110 10.309 -3.931 1.00 0.00 N ATOM 469 CA SER A 744 5.538 9.674 -2.657 1.00 0.00 C ATOM 470 C SER A 744 5.333 8.157 -2.706 1.00 0.00 C ATOM 471 O SER A 744 4.850 7.557 -1.766 1.00 0.00 O ATOM 472 CB SER A 744 4.632 10.310 -1.606 1.00 0.00 C ATOM 473 OG SER A 744 5.266 11.459 -1.067 1.00 0.00 O ATOM 0 H SER A 744 4.142 10.631 -3.952 1.00 0.00 H new ATOM 0 HA SER A 744 6.597 9.827 -2.448 1.00 0.00 H new ATOM 0 HB2 SER A 744 3.676 10.585 -2.053 1.00 0.00 H new ATOM 0 HB3 SER A 744 4.419 9.593 -0.813 1.00 0.00 H new ATOM 0 HG SER A 744 4.586 12.110 -0.794 1.00 0.00 H new ATOM 479 N ALA A 745 5.718 7.529 -3.784 1.00 0.00 N ATOM 480 CA ALA A 745 5.551 6.050 -3.884 1.00 0.00 C ATOM 481 C ALA A 745 6.832 5.380 -4.389 1.00 0.00 C ATOM 482 O ALA A 745 6.897 4.173 -4.499 1.00 0.00 O ATOM 483 CB ALA A 745 4.430 5.848 -4.905 1.00 0.00 C ATOM 0 H ALA A 745 6.140 7.975 -4.598 1.00 0.00 H new ATOM 0 HA ALA A 745 5.326 5.610 -2.913 1.00 0.00 H new ATOM 0 HB1 ALA A 745 4.245 4.782 -5.036 1.00 0.00 H new ATOM 0 HB2 ALA A 745 3.521 6.333 -4.548 1.00 0.00 H new ATOM 0 HB3 ALA A 745 4.724 6.285 -5.859 1.00 0.00 H new ATOM 489 N TRP A 746 7.864 6.136 -4.670 1.00 0.00 N ATOM 490 CA TRP A 746 9.115 5.504 -5.183 1.00 0.00 C ATOM 491 C TRP A 746 9.720 4.475 -4.199 1.00 0.00 C ATOM 492 O TRP A 746 10.391 3.566 -4.645 1.00 0.00 O ATOM 493 CB TRP A 746 10.102 6.650 -5.460 1.00 0.00 C ATOM 494 CG TRP A 746 10.273 7.518 -4.256 1.00 0.00 C ATOM 495 CD1 TRP A 746 9.738 8.751 -4.112 1.00 0.00 C ATOM 496 CD2 TRP A 746 11.060 7.271 -3.055 1.00 0.00 C ATOM 497 NE1 TRP A 746 10.123 9.267 -2.888 1.00 0.00 N ATOM 498 CE2 TRP A 746 10.935 8.390 -2.197 1.00 0.00 C ATOM 499 CE3 TRP A 746 11.838 6.185 -2.618 1.00 0.00 C ATOM 500 CZ2 TRP A 746 11.569 8.435 -0.956 1.00 0.00 C ATOM 501 CZ3 TRP A 746 12.479 6.227 -1.369 1.00 0.00 C ATOM 502 CH2 TRP A 746 12.343 7.350 -0.539 1.00 0.00 C ATOM 0 H TRP A 746 7.894 7.150 -4.568 1.00 0.00 H new ATOM 0 HA TRP A 746 8.895 4.935 -6.086 1.00 0.00 H new ATOM 0 HB2 TRP A 746 11.067 6.239 -5.755 1.00 0.00 H new ATOM 0 HB3 TRP A 746 9.742 7.250 -6.296 1.00 0.00 H new ATOM 0 HD1 TRP A 746 9.112 9.252 -4.835 1.00 0.00 H new ATOM 0 HE1 TRP A 746 9.842 10.183 -2.539 1.00 0.00 H new ATOM 0 HE3 TRP A 746 11.944 5.313 -3.246 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 11.462 9.303 -0.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 13.080 5.390 -1.046 1.00 0.00 H new ATOM 0 HH2 TRP A 746 12.836 7.375 0.421 1.00 0.00 H new ATOM 513 N PRO A 747 9.482 4.598 -2.903 1.00 0.00 N ATOM 514 CA PRO A 747 10.044 3.595 -1.968 1.00 0.00 C ATOM 515 C PRO A 747 9.293 2.261 -2.097 1.00 0.00 C ATOM 516 O PRO A 747 9.657 1.277 -1.484 1.00 0.00 O ATOM 517 CB PRO A 747 9.822 4.203 -0.576 1.00 0.00 C ATOM 518 CG PRO A 747 9.309 5.591 -0.810 1.00 0.00 C ATOM 519 CD PRO A 747 8.694 5.603 -2.178 1.00 0.00 C ATOM 0 HA PRO A 747 11.094 3.383 -2.167 1.00 0.00 H new ATOM 0 HB2 PRO A 747 9.106 3.614 -0.002 1.00 0.00 H new ATOM 0 HB3 PRO A 747 10.750 4.221 -0.005 1.00 0.00 H new ATOM 0 HG2 PRO A 747 8.573 5.863 -0.053 1.00 0.00 H new ATOM 0 HG3 PRO A 747 10.118 6.318 -0.744 1.00 0.00 H new ATOM 0 HD2 PRO A 747 7.636 5.341 -2.147 1.00 0.00 H new ATOM 0 HD3 PRO A 747 8.766 6.586 -2.644 1.00 0.00 H new ATOM 527 N PHE A 748 8.252 2.214 -2.893 1.00 0.00 N ATOM 528 CA PHE A 748 7.484 0.939 -3.043 1.00 0.00 C ATOM 529 C PHE A 748 7.276 0.630 -4.529 1.00 0.00 C ATOM 530 O PHE A 748 7.329 -0.507 -4.953 1.00 0.00 O ATOM 531 CB PHE A 748 6.112 1.170 -2.370 1.00 0.00 C ATOM 532 CG PHE A 748 6.239 2.051 -1.143 1.00 0.00 C ATOM 533 CD1 PHE A 748 7.033 1.647 -0.064 1.00 0.00 C ATOM 534 CD2 PHE A 748 5.568 3.279 -1.099 1.00 0.00 C ATOM 535 CE1 PHE A 748 7.150 2.470 1.063 1.00 0.00 C ATOM 536 CE2 PHE A 748 5.685 4.100 0.026 1.00 0.00 C ATOM 537 CZ PHE A 748 6.476 3.697 1.107 1.00 0.00 C ATOM 0 H PHE A 748 7.903 2.999 -3.442 1.00 0.00 H new ATOM 0 HA PHE A 748 8.017 0.103 -2.589 1.00 0.00 H new ATOM 0 HB2 PHE A 748 5.429 1.632 -3.083 1.00 0.00 H new ATOM 0 HB3 PHE A 748 5.677 0.211 -2.088 1.00 0.00 H new ATOM 0 HD1 PHE A 748 7.555 0.702 -0.100 1.00 0.00 H new ATOM 0 HD2 PHE A 748 4.960 3.592 -1.935 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.760 2.159 1.898 1.00 0.00 H new ATOM 0 HE2 PHE A 748 5.165 5.046 0.061 1.00 0.00 H new ATOM 0 HZ PHE A 748 6.567 4.332 1.976 1.00 0.00 H new ATOM 547 N MET A 749 7.021 1.640 -5.318 1.00 0.00 N ATOM 548 CA MET A 749 6.784 1.426 -6.773 1.00 0.00 C ATOM 549 C MET A 749 7.910 0.562 -7.376 1.00 0.00 C ATOM 550 O MET A 749 7.669 -0.520 -7.873 1.00 0.00 O ATOM 551 CB MET A 749 6.718 2.869 -7.350 1.00 0.00 C ATOM 552 CG MET A 749 7.680 3.093 -8.516 1.00 0.00 C ATOM 553 SD MET A 749 7.132 4.513 -9.496 1.00 0.00 S ATOM 554 CE MET A 749 5.515 3.856 -9.971 1.00 0.00 C ATOM 0 H MET A 749 6.967 2.612 -5.013 1.00 0.00 H new ATOM 0 HA MET A 749 5.872 0.876 -7.004 1.00 0.00 H new ATOM 0 HB2 MET A 749 5.700 3.075 -7.682 1.00 0.00 H new ATOM 0 HB3 MET A 749 6.945 3.582 -6.557 1.00 0.00 H new ATOM 0 HG2 MET A 749 8.688 3.266 -8.140 1.00 0.00 H new ATOM 0 HG3 MET A 749 7.722 2.202 -9.142 1.00 0.00 H new ATOM 0 HE1 MET A 749 5.301 4.129 -11.004 1.00 0.00 H new ATOM 0 HE2 MET A 749 5.521 2.770 -9.876 1.00 0.00 H new ATOM 0 HE3 MET A 749 4.747 4.272 -9.319 1.00 0.00 H new ATOM 564 N GLU A 750 9.128 1.030 -7.344 1.00 0.00 N ATOM 565 CA GLU A 750 10.243 0.224 -7.917 1.00 0.00 C ATOM 566 C GLU A 750 10.721 -0.824 -6.909 1.00 0.00 C ATOM 567 O GLU A 750 10.488 -0.695 -5.723 1.00 0.00 O ATOM 568 CB GLU A 750 11.357 1.229 -8.225 1.00 0.00 C ATOM 569 CG GLU A 750 11.850 1.859 -6.927 1.00 0.00 C ATOM 570 CD GLU A 750 11.656 3.375 -6.987 1.00 0.00 C ATOM 571 OE1 GLU A 750 10.736 3.808 -7.661 1.00 0.00 O ATOM 572 OE2 GLU A 750 12.430 4.076 -6.357 1.00 0.00 O ATOM 0 H GLU A 750 9.398 1.930 -6.948 1.00 0.00 H new ATOM 0 HA GLU A 750 9.934 -0.319 -8.810 1.00 0.00 H new ATOM 0 HB2 GLU A 750 12.181 0.729 -8.734 1.00 0.00 H new ATOM 0 HB3 GLU A 750 10.987 2.002 -8.899 1.00 0.00 H new ATOM 0 HG2 GLU A 750 11.303 1.445 -6.080 1.00 0.00 H new ATOM 0 HG3 GLU A 750 12.903 1.623 -6.773 1.00 0.00 H new ATOM 579 N PRO A 751 11.362 -1.843 -7.421 1.00 0.00 N ATOM 580 CA PRO A 751 11.869 -2.930 -6.554 1.00 0.00 C ATOM 581 C PRO A 751 13.067 -2.450 -5.735 1.00 0.00 C ATOM 582 O PRO A 751 13.804 -1.577 -6.147 1.00 0.00 O ATOM 583 CB PRO A 751 12.291 -4.009 -7.541 1.00 0.00 C ATOM 584 CG PRO A 751 12.553 -3.293 -8.827 1.00 0.00 C ATOM 585 CD PRO A 751 11.678 -2.071 -8.839 1.00 0.00 C ATOM 0 HA PRO A 751 11.129 -3.280 -5.834 1.00 0.00 H new ATOM 0 HB2 PRO A 751 13.182 -4.531 -7.194 1.00 0.00 H new ATOM 0 HB3 PRO A 751 11.509 -4.759 -7.661 1.00 0.00 H new ATOM 0 HG2 PRO A 751 13.604 -3.015 -8.906 1.00 0.00 H new ATOM 0 HG3 PRO A 751 12.329 -3.936 -9.678 1.00 0.00 H new ATOM 0 HD2 PRO A 751 12.194 -1.216 -9.275 1.00 0.00 H new ATOM 0 HD3 PRO A 751 10.775 -2.233 -9.428 1.00 0.00 H new ATOM 593 N VAL A 752 13.268 -3.015 -4.576 1.00 0.00 N ATOM 594 CA VAL A 752 14.418 -2.592 -3.731 1.00 0.00 C ATOM 595 C VAL A 752 15.493 -3.681 -3.713 1.00 0.00 C ATOM 596 O VAL A 752 15.214 -4.845 -3.918 1.00 0.00 O ATOM 597 CB VAL A 752 13.824 -2.404 -2.334 1.00 0.00 C ATOM 598 CG1 VAL A 752 12.779 -1.286 -2.370 1.00 0.00 C ATOM 599 CG2 VAL A 752 13.161 -3.707 -1.881 1.00 0.00 C ATOM 0 H VAL A 752 12.685 -3.751 -4.178 1.00 0.00 H new ATOM 0 HA VAL A 752 14.895 -1.685 -4.102 1.00 0.00 H new ATOM 0 HB VAL A 752 14.617 -2.138 -1.635 1.00 0.00 H new ATOM 0 HG11 VAL A 752 12.355 -1.152 -1.375 1.00 0.00 H new ATOM 0 HG12 VAL A 752 13.250 -0.358 -2.692 1.00 0.00 H new ATOM 0 HG13 VAL A 752 11.986 -1.552 -3.069 1.00 0.00 H new ATOM 0 HG21 VAL A 752 12.738 -3.573 -0.886 1.00 0.00 H new ATOM 0 HG22 VAL A 752 12.368 -3.974 -2.580 1.00 0.00 H new ATOM 0 HG23 VAL A 752 13.905 -4.504 -1.855 1.00 0.00 H new ATOM 609 N LYS A 753 16.721 -3.310 -3.474 1.00 0.00 N ATOM 610 CA LYS A 753 17.813 -4.324 -3.443 1.00 0.00 C ATOM 611 C LYS A 753 17.604 -5.295 -2.280 1.00 0.00 C ATOM 612 O LYS A 753 16.496 -5.513 -1.832 1.00 0.00 O ATOM 613 CB LYS A 753 19.094 -3.513 -3.235 1.00 0.00 C ATOM 614 CG LYS A 753 20.248 -4.176 -3.991 1.00 0.00 C ATOM 615 CD LYS A 753 21.463 -4.300 -3.069 1.00 0.00 C ATOM 616 CE LYS A 753 22.604 -3.436 -3.611 1.00 0.00 C ATOM 617 NZ LYS A 753 23.333 -2.961 -2.401 1.00 0.00 N ATOM 0 H LYS A 753 17.015 -2.349 -3.299 1.00 0.00 H new ATOM 0 HA LYS A 753 17.847 -4.922 -4.353 1.00 0.00 H new ATOM 0 HB2 LYS A 753 18.952 -2.492 -3.590 1.00 0.00 H new ATOM 0 HB3 LYS A 753 19.329 -3.451 -2.172 1.00 0.00 H new ATOM 0 HG2 LYS A 753 19.945 -5.162 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS A 753 20.506 -3.587 -4.871 1.00 0.00 H new ATOM 0 HD2 LYS A 753 21.201 -3.984 -2.059 1.00 0.00 H new ATOM 0 HD3 LYS A 753 21.780 -5.341 -3.005 1.00 0.00 H new ATOM 0 HE2 LYS A 753 23.258 -4.011 -4.266 1.00 0.00 H new ATOM 0 HE3 LYS A 753 22.222 -2.599 -4.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 24.132 -2.361 -2.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 22.687 -2.411 -1.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 23.690 -3.779 -1.868 1.00 0.00 H new ATOM 631 N ARG A 754 18.660 -5.882 -1.790 1.00 0.00 N ATOM 632 CA ARG A 754 18.525 -6.830 -0.649 1.00 0.00 C ATOM 633 C ARG A 754 19.096 -6.205 0.623 1.00 0.00 C ATOM 634 O ARG A 754 18.566 -6.374 1.704 1.00 0.00 O ATOM 635 CB ARG A 754 19.346 -8.055 -1.056 1.00 0.00 C ATOM 636 CG ARG A 754 18.439 -9.287 -1.094 1.00 0.00 C ATOM 637 CD ARG A 754 19.042 -10.337 -2.030 1.00 0.00 C ATOM 638 NE ARG A 754 18.389 -11.621 -1.636 1.00 0.00 N ATOM 639 CZ ARG A 754 18.585 -12.718 -2.331 1.00 0.00 C ATOM 640 NH1 ARG A 754 19.358 -12.719 -3.389 1.00 0.00 N ATOM 641 NH2 ARG A 754 18.000 -13.825 -1.962 1.00 0.00 N ATOM 0 H ARG A 754 19.612 -5.746 -2.131 1.00 0.00 H new ATOM 0 HA ARG A 754 17.485 -7.084 -0.442 1.00 0.00 H new ATOM 0 HB2 ARG A 754 19.799 -7.894 -2.034 1.00 0.00 H new ATOM 0 HB3 ARG A 754 20.161 -8.212 -0.349 1.00 0.00 H new ATOM 0 HG2 ARG A 754 18.327 -9.700 -0.092 1.00 0.00 H new ATOM 0 HG3 ARG A 754 17.443 -9.008 -1.437 1.00 0.00 H new ATOM 0 HD2 ARG A 754 18.843 -10.096 -3.074 1.00 0.00 H new ATOM 0 HD3 ARG A 754 20.125 -10.393 -1.916 1.00 0.00 H new ATOM 0 HE ARG A 754 17.783 -11.646 -0.816 1.00 0.00 H new ATOM 0 HH11 ARG A 754 19.819 -11.858 -3.685 1.00 0.00 H new ATOM 0 HH12 ARG A 754 19.499 -13.580 -3.917 1.00 0.00 H new ATOM 0 HH21 ARG A 754 17.396 -13.833 -1.140 1.00 0.00 H new ATOM 0 HH22 ARG A 754 18.147 -14.682 -2.496 1.00 0.00 H new ATOM 655 N THR A 755 20.172 -5.477 0.502 1.00 0.00 N ATOM 656 CA THR A 755 20.774 -4.829 1.700 1.00 0.00 C ATOM 657 C THR A 755 20.844 -3.315 1.508 1.00 0.00 C ATOM 658 O THR A 755 21.596 -2.630 2.173 1.00 0.00 O ATOM 659 CB THR A 755 22.183 -5.415 1.795 1.00 0.00 C ATOM 660 OG1 THR A 755 22.796 -5.386 0.515 1.00 0.00 O ATOM 661 CG2 THR A 755 22.098 -6.858 2.287 1.00 0.00 C ATOM 0 H THR A 755 20.661 -5.303 -0.376 1.00 0.00 H new ATOM 0 HA THR A 755 20.189 -5.008 2.602 1.00 0.00 H new ATOM 0 HB THR A 755 22.777 -4.826 2.494 1.00 0.00 H new ATOM 0 HG1 THR A 755 23.700 -5.760 0.577 1.00 0.00 H new ATOM 0 HG21 THR A 755 23.101 -7.279 2.356 1.00 0.00 H new ATOM 0 HG22 THR A 755 21.627 -6.880 3.270 1.00 0.00 H new ATOM 0 HG23 THR A 755 21.505 -7.447 1.587 1.00 0.00 H new ATOM 669 N GLU A 756 20.074 -2.784 0.599 1.00 0.00 N ATOM 670 CA GLU A 756 20.107 -1.315 0.370 1.00 0.00 C ATOM 671 C GLU A 756 19.313 -0.588 1.457 1.00 0.00 C ATOM 672 O GLU A 756 19.485 0.594 1.679 1.00 0.00 O ATOM 673 CB GLU A 756 19.450 -1.114 -0.998 1.00 0.00 C ATOM 674 CG GLU A 756 19.434 0.377 -1.343 1.00 0.00 C ATOM 675 CD GLU A 756 20.871 0.897 -1.427 1.00 0.00 C ATOM 676 OE1 GLU A 756 21.410 1.259 -0.394 1.00 0.00 O ATOM 677 OE2 GLU A 756 21.407 0.926 -2.522 1.00 0.00 O ATOM 0 H GLU A 756 19.426 -3.303 0.007 1.00 0.00 H new ATOM 0 HA GLU A 756 21.121 -0.916 0.400 1.00 0.00 H new ATOM 0 HB2 GLU A 756 19.997 -1.669 -1.761 1.00 0.00 H new ATOM 0 HB3 GLU A 756 18.433 -1.506 -0.986 1.00 0.00 H new ATOM 0 HG2 GLU A 756 18.922 0.536 -2.292 1.00 0.00 H new ATOM 0 HG3 GLU A 756 18.879 0.931 -0.585 1.00 0.00 H new ATOM 684 N ALA A 757 18.445 -1.284 2.142 1.00 0.00 N ATOM 685 CA ALA A 757 17.648 -0.629 3.216 1.00 0.00 C ATOM 686 C ALA A 757 18.397 -0.709 4.555 1.00 0.00 C ATOM 687 O ALA A 757 18.812 -1.776 4.961 1.00 0.00 O ATOM 688 CB ALA A 757 16.350 -1.435 3.288 1.00 0.00 C ATOM 0 H ALA A 757 18.255 -2.276 2.003 1.00 0.00 H new ATOM 0 HA ALA A 757 17.468 0.426 3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 757 15.704 -1.016 4.059 1.00 0.00 H new ATOM 0 HB2 ALA A 757 15.841 -1.392 2.325 1.00 0.00 H new ATOM 0 HB3 ALA A 757 16.579 -2.472 3.531 1.00 0.00 H new ATOM 694 N PRO A 758 18.547 0.421 5.206 1.00 0.00 N ATOM 695 CA PRO A 758 19.262 0.450 6.508 1.00 0.00 C ATOM 696 C PRO A 758 18.517 -0.383 7.554 1.00 0.00 C ATOM 697 O PRO A 758 17.765 0.137 8.354 1.00 0.00 O ATOM 698 CB PRO A 758 19.253 1.931 6.900 1.00 0.00 C ATOM 699 CG PRO A 758 18.175 2.552 6.070 1.00 0.00 C ATOM 700 CD PRO A 758 18.089 1.757 4.804 1.00 0.00 C ATOM 0 HA PRO A 758 20.267 0.034 6.443 1.00 0.00 H new ATOM 0 HB2 PRO A 758 19.051 2.055 7.964 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.219 2.396 6.702 1.00 0.00 H new ATOM 0 HG2 PRO A 758 17.223 2.538 6.600 1.00 0.00 H new ATOM 0 HG3 PRO A 758 18.405 3.596 5.856 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.071 1.732 4.414 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.720 2.179 4.022 1.00 0.00 H new ATOM 708 N GLY A 759 18.727 -1.672 7.562 1.00 0.00 N ATOM 709 CA GLY A 759 18.040 -2.532 8.567 1.00 0.00 C ATOM 710 C GLY A 759 16.863 -3.254 7.911 1.00 0.00 C ATOM 711 O GLY A 759 15.717 -2.921 8.131 1.00 0.00 O ATOM 0 H GLY A 759 19.344 -2.166 6.917 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.741 -3.258 8.978 1.00 0.00 H new ATOM 0 HA3 GLY A 759 17.687 -1.924 9.400 1.00 0.00 H new ATOM 715 N TYR A 760 17.136 -4.252 7.121 1.00 0.00 N ATOM 716 CA TYR A 760 16.034 -4.996 6.452 1.00 0.00 C ATOM 717 C TYR A 760 16.191 -6.499 6.704 1.00 0.00 C ATOM 718 O TYR A 760 17.194 -6.945 7.225 1.00 0.00 O ATOM 719 CB TYR A 760 16.203 -4.663 4.966 1.00 0.00 C ATOM 720 CG TYR A 760 15.279 -5.522 4.133 1.00 0.00 C ATOM 721 CD1 TYR A 760 13.961 -5.111 3.901 1.00 0.00 C ATOM 722 CD2 TYR A 760 15.741 -6.729 3.597 1.00 0.00 C ATOM 723 CE1 TYR A 760 13.105 -5.908 3.130 1.00 0.00 C ATOM 724 CE2 TYR A 760 14.886 -7.526 2.826 1.00 0.00 C ATOM 725 CZ TYR A 760 13.568 -7.115 2.593 1.00 0.00 C ATOM 726 OH TYR A 760 12.725 -7.900 1.833 1.00 0.00 O ATOM 0 H TYR A 760 18.076 -4.586 6.909 1.00 0.00 H new ATOM 0 HA TYR A 760 15.046 -4.722 6.821 1.00 0.00 H new ATOM 0 HB2 TYR A 760 15.985 -3.609 4.794 1.00 0.00 H new ATOM 0 HB3 TYR A 760 17.237 -4.828 4.664 1.00 0.00 H new ATOM 0 HD1 TYR A 760 13.604 -4.180 4.316 1.00 0.00 H new ATOM 0 HD2 TYR A 760 16.757 -7.046 3.778 1.00 0.00 H new ATOM 0 HE1 TYR A 760 12.088 -5.591 2.950 1.00 0.00 H new ATOM 0 HE2 TYR A 760 15.243 -8.457 2.411 1.00 0.00 H new ATOM 0 HH TYR A 760 13.204 -8.702 1.536 1.00 0.00 H new ATOM 736 N TYR A 761 15.203 -7.285 6.345 1.00 0.00 N ATOM 737 CA TYR A 761 15.271 -8.774 6.560 1.00 0.00 C ATOM 738 C TYR A 761 15.184 -9.125 8.052 1.00 0.00 C ATOM 739 O TYR A 761 14.354 -9.913 8.461 1.00 0.00 O ATOM 740 CB TYR A 761 16.618 -9.232 5.979 1.00 0.00 C ATOM 741 CG TYR A 761 16.546 -10.701 5.638 1.00 0.00 C ATOM 742 CD1 TYR A 761 15.602 -11.159 4.710 1.00 0.00 C ATOM 743 CD2 TYR A 761 17.423 -11.605 6.249 1.00 0.00 C ATOM 744 CE1 TYR A 761 15.536 -12.522 4.394 1.00 0.00 C ATOM 745 CE2 TYR A 761 17.357 -12.967 5.933 1.00 0.00 C ATOM 746 CZ TYR A 761 16.414 -13.425 5.006 1.00 0.00 C ATOM 747 OH TYR A 761 16.349 -14.768 4.694 1.00 0.00 O ATOM 0 H TYR A 761 14.342 -6.958 5.907 1.00 0.00 H new ATOM 0 HA TYR A 761 14.434 -9.273 6.073 1.00 0.00 H new ATOM 0 HB2 TYR A 761 16.858 -8.652 5.088 1.00 0.00 H new ATOM 0 HB3 TYR A 761 17.416 -9.054 6.699 1.00 0.00 H new ATOM 0 HD1 TYR A 761 14.925 -10.462 4.238 1.00 0.00 H new ATOM 0 HD2 TYR A 761 18.151 -11.251 6.964 1.00 0.00 H new ATOM 0 HE1 TYR A 761 14.808 -12.876 3.679 1.00 0.00 H new ATOM 0 HE2 TYR A 761 18.034 -13.664 6.404 1.00 0.00 H new ATOM 0 HH TYR A 761 17.028 -15.256 5.205 1.00 0.00 H new ATOM 757 N GLU A 762 16.036 -8.563 8.868 1.00 0.00 N ATOM 758 CA GLU A 762 15.994 -8.876 10.325 1.00 0.00 C ATOM 759 C GLU A 762 15.054 -7.910 11.048 1.00 0.00 C ATOM 760 O GLU A 762 15.370 -7.387 12.099 1.00 0.00 O ATOM 761 CB GLU A 762 17.434 -8.679 10.808 1.00 0.00 C ATOM 762 CG GLU A 762 18.173 -10.019 10.779 1.00 0.00 C ATOM 763 CD GLU A 762 19.681 -9.769 10.833 1.00 0.00 C ATOM 764 OE1 GLU A 762 20.277 -9.633 9.777 1.00 0.00 O ATOM 765 OE2 GLU A 762 20.214 -9.716 11.929 1.00 0.00 O ATOM 0 H GLU A 762 16.759 -7.901 8.588 1.00 0.00 H new ATOM 0 HA GLU A 762 15.627 -9.883 10.521 1.00 0.00 H new ATOM 0 HB2 GLU A 762 17.946 -7.956 10.173 1.00 0.00 H new ATOM 0 HB3 GLU A 762 17.437 -8.273 11.819 1.00 0.00 H new ATOM 0 HG2 GLU A 762 17.865 -10.635 11.624 1.00 0.00 H new ATOM 0 HG3 GLU A 762 17.917 -10.569 9.873 1.00 0.00 H new ATOM 772 N VAL A 763 13.903 -7.667 10.488 1.00 0.00 N ATOM 773 CA VAL A 763 12.937 -6.730 11.130 1.00 0.00 C ATOM 774 C VAL A 763 11.604 -6.761 10.375 1.00 0.00 C ATOM 775 O VAL A 763 10.543 -6.774 10.968 1.00 0.00 O ATOM 776 CB VAL A 763 13.596 -5.338 11.041 1.00 0.00 C ATOM 777 CG1 VAL A 763 14.106 -5.082 9.619 1.00 0.00 C ATOM 778 CG2 VAL A 763 12.577 -4.255 11.411 1.00 0.00 C ATOM 0 H VAL A 763 13.587 -8.078 9.610 1.00 0.00 H new ATOM 0 HA VAL A 763 12.721 -6.997 12.164 1.00 0.00 H new ATOM 0 HB VAL A 763 14.435 -5.307 11.736 1.00 0.00 H new ATOM 0 HG11 VAL A 763 14.569 -4.096 9.570 1.00 0.00 H new ATOM 0 HG12 VAL A 763 14.841 -5.842 9.354 1.00 0.00 H new ATOM 0 HG13 VAL A 763 13.271 -5.126 8.920 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.049 -3.274 11.346 1.00 0.00 H new ATOM 0 HG22 VAL A 763 11.734 -4.298 10.722 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.223 -4.421 12.428 1.00 0.00 H new ATOM 788 N ILE A 764 11.649 -6.774 9.072 1.00 0.00 N ATOM 789 CA ILE A 764 10.386 -6.819 8.286 1.00 0.00 C ATOM 790 C ILE A 764 9.914 -8.270 8.148 1.00 0.00 C ATOM 791 O ILE A 764 10.400 -9.016 7.321 1.00 0.00 O ATOM 792 CB ILE A 764 10.757 -6.226 6.921 1.00 0.00 C ATOM 793 CG1 ILE A 764 11.018 -4.724 7.070 1.00 0.00 C ATOM 794 CG2 ILE A 764 9.608 -6.439 5.931 1.00 0.00 C ATOM 795 CD1 ILE A 764 9.744 -4.024 7.552 1.00 0.00 C ATOM 0 H ILE A 764 12.505 -6.755 8.518 1.00 0.00 H new ATOM 0 HA ILE A 764 9.572 -6.267 8.756 1.00 0.00 H new ATOM 0 HB ILE A 764 11.653 -6.722 6.549 1.00 0.00 H new ATOM 0 HG12 ILE A 764 11.828 -4.554 7.779 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.337 -4.304 6.116 1.00 0.00 H new ATOM 0 HG21 ILE A 764 9.878 -6.015 4.964 1.00 0.00 H new ATOM 0 HG22 ILE A 764 9.417 -7.506 5.819 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.710 -5.947 6.305 1.00 0.00 H new ATOM 0 HD11 ILE A 764 9.933 -2.956 7.657 1.00 0.00 H new ATOM 0 HD12 ILE A 764 8.946 -4.182 6.827 1.00 0.00 H new ATOM 0 HD13 ILE A 764 9.445 -4.436 8.516 1.00 0.00 H new ATOM 807 N ARG A 765 8.978 -8.678 8.961 1.00 0.00 N ATOM 808 CA ARG A 765 8.485 -10.082 8.887 1.00 0.00 C ATOM 809 C ARG A 765 8.005 -10.411 7.472 1.00 0.00 C ATOM 810 O ARG A 765 8.189 -11.509 6.985 1.00 0.00 O ATOM 811 CB ARG A 765 7.315 -10.140 9.871 1.00 0.00 C ATOM 812 CG ARG A 765 7.250 -11.533 10.502 1.00 0.00 C ATOM 813 CD ARG A 765 7.020 -11.401 12.010 1.00 0.00 C ATOM 814 NE ARG A 765 6.027 -12.466 12.338 1.00 0.00 N ATOM 815 CZ ARG A 765 5.856 -12.870 13.576 1.00 0.00 C ATOM 816 NH1 ARG A 765 6.550 -12.350 14.559 1.00 0.00 N ATOM 817 NH2 ARG A 765 4.980 -13.804 13.832 1.00 0.00 N ATOM 0 H ARG A 765 8.533 -8.099 9.673 1.00 0.00 H new ATOM 0 HA ARG A 765 9.266 -10.802 9.129 1.00 0.00 H new ATOM 0 HB2 ARG A 765 7.439 -9.383 10.646 1.00 0.00 H new ATOM 0 HB3 ARG A 765 6.381 -9.918 9.356 1.00 0.00 H new ATOM 0 HG2 ARG A 765 6.444 -12.111 10.050 1.00 0.00 H new ATOM 0 HG3 ARG A 765 8.177 -12.074 10.311 1.00 0.00 H new ATOM 0 HD2 ARG A 765 7.947 -11.540 12.565 1.00 0.00 H new ATOM 0 HD3 ARG A 765 6.640 -10.412 12.267 1.00 0.00 H new ATOM 0 HE ARG A 765 5.474 -12.886 11.591 1.00 0.00 H new ATOM 0 HH11 ARG A 765 7.236 -11.619 14.368 1.00 0.00 H new ATOM 0 HH12 ARG A 765 6.404 -12.676 15.514 1.00 0.00 H new ATOM 0 HH21 ARG A 765 4.435 -14.214 13.073 1.00 0.00 H new ATOM 0 HH22 ARG A 765 4.841 -14.124 14.791 1.00 0.00 H new ATOM 831 N PHE A 766 7.386 -9.474 6.807 1.00 0.00 N ATOM 832 CA PHE A 766 6.885 -9.750 5.430 1.00 0.00 C ATOM 833 C PHE A 766 7.173 -8.564 4.502 1.00 0.00 C ATOM 834 O PHE A 766 6.318 -7.725 4.294 1.00 0.00 O ATOM 835 CB PHE A 766 5.374 -9.941 5.592 1.00 0.00 C ATOM 836 CG PHE A 766 5.104 -11.018 6.616 1.00 0.00 C ATOM 837 CD1 PHE A 766 5.555 -12.325 6.394 1.00 0.00 C ATOM 838 CD2 PHE A 766 4.410 -10.707 7.791 1.00 0.00 C ATOM 839 CE1 PHE A 766 5.307 -13.322 7.346 1.00 0.00 C ATOM 840 CE2 PHE A 766 4.162 -11.704 8.742 1.00 0.00 C ATOM 841 CZ PHE A 766 4.611 -13.011 8.520 1.00 0.00 C ATOM 0 H PHE A 766 7.206 -8.533 7.156 1.00 0.00 H new ATOM 0 HA PHE A 766 7.368 -10.621 4.987 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.911 -9.005 5.904 1.00 0.00 H new ATOM 0 HB3 PHE A 766 4.928 -10.215 4.636 1.00 0.00 H new ATOM 0 HD1 PHE A 766 6.094 -12.564 5.489 1.00 0.00 H new ATOM 0 HD2 PHE A 766 4.066 -9.698 7.964 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.653 -14.331 7.174 1.00 0.00 H new ATOM 0 HE2 PHE A 766 3.624 -11.465 9.647 1.00 0.00 H new ATOM 0 HZ PHE A 766 4.420 -13.780 9.254 1.00 0.00 H new ATOM 851 N PRO A 767 8.367 -8.535 3.958 1.00 0.00 N ATOM 852 CA PRO A 767 8.747 -7.440 3.032 1.00 0.00 C ATOM 853 C PRO A 767 7.696 -7.281 1.932 1.00 0.00 C ATOM 854 O PRO A 767 7.229 -8.249 1.366 1.00 0.00 O ATOM 855 CB PRO A 767 10.075 -7.906 2.446 1.00 0.00 C ATOM 856 CG PRO A 767 10.630 -8.850 3.461 1.00 0.00 C ATOM 857 CD PRO A 767 9.458 -9.501 4.144 1.00 0.00 C ATOM 0 HA PRO A 767 8.821 -6.471 3.526 1.00 0.00 H new ATOM 0 HB2 PRO A 767 9.932 -8.399 1.484 1.00 0.00 H new ATOM 0 HB3 PRO A 767 10.749 -7.066 2.277 1.00 0.00 H new ATOM 0 HG2 PRO A 767 11.264 -9.599 2.985 1.00 0.00 H new ATOM 0 HG3 PRO A 767 11.251 -8.319 4.183 1.00 0.00 H new ATOM 0 HD2 PRO A 767 9.219 -10.466 3.697 1.00 0.00 H new ATOM 0 HD3 PRO A 767 9.659 -9.680 5.200 1.00 0.00 H new ATOM 865 N MET A 768 7.314 -6.072 1.628 1.00 0.00 N ATOM 866 CA MET A 768 6.283 -5.866 0.573 1.00 0.00 C ATOM 867 C MET A 768 6.494 -4.528 -0.135 1.00 0.00 C ATOM 868 O MET A 768 7.049 -3.600 0.419 1.00 0.00 O ATOM 869 CB MET A 768 4.952 -5.863 1.326 1.00 0.00 C ATOM 870 CG MET A 768 3.797 -5.873 0.323 1.00 0.00 C ATOM 871 SD MET A 768 2.512 -7.011 0.896 1.00 0.00 S ATOM 872 CE MET A 768 3.299 -8.542 0.337 1.00 0.00 C ATOM 0 H MET A 768 7.670 -5.220 2.063 1.00 0.00 H new ATOM 0 HA MET A 768 6.325 -6.637 -0.196 1.00 0.00 H new ATOM 0 HB2 MET A 768 4.889 -6.734 1.978 1.00 0.00 H new ATOM 0 HB3 MET A 768 4.885 -4.982 1.964 1.00 0.00 H new ATOM 0 HG2 MET A 768 3.387 -4.869 0.214 1.00 0.00 H new ATOM 0 HG3 MET A 768 4.157 -6.178 -0.660 1.00 0.00 H new ATOM 0 HE1 MET A 768 2.627 -9.382 0.512 1.00 0.00 H new ATOM 0 HE2 MET A 768 3.520 -8.470 -0.728 1.00 0.00 H new ATOM 0 HE3 MET A 768 4.226 -8.698 0.890 1.00 0.00 H new ATOM 882 N ASP A 769 6.051 -4.422 -1.358 1.00 0.00 N ATOM 883 CA ASP A 769 6.215 -3.143 -2.106 1.00 0.00 C ATOM 884 C ASP A 769 5.099 -2.990 -3.141 1.00 0.00 C ATOM 885 O ASP A 769 4.350 -3.911 -3.402 1.00 0.00 O ATOM 886 CB ASP A 769 7.573 -3.262 -2.799 1.00 0.00 C ATOM 887 CG ASP A 769 8.670 -3.435 -1.746 1.00 0.00 C ATOM 888 OD1 ASP A 769 8.957 -4.568 -1.398 1.00 0.00 O ATOM 889 OD2 ASP A 769 9.202 -2.430 -1.304 1.00 0.00 O ATOM 0 H ASP A 769 5.582 -5.167 -1.872 1.00 0.00 H new ATOM 0 HA ASP A 769 6.165 -2.273 -1.452 1.00 0.00 H new ATOM 0 HB2 ASP A 769 7.572 -4.112 -3.481 1.00 0.00 H new ATOM 0 HB3 ASP A 769 7.767 -2.372 -3.398 1.00 0.00 H new ATOM 894 N LEU A 770 4.979 -1.832 -3.731 1.00 0.00 N ATOM 895 CA LEU A 770 3.908 -1.621 -4.746 1.00 0.00 C ATOM 896 C LEU A 770 4.241 -2.372 -6.038 1.00 0.00 C ATOM 897 O LEU A 770 3.367 -2.728 -6.803 1.00 0.00 O ATOM 898 CB LEU A 770 3.896 -0.111 -4.992 1.00 0.00 C ATOM 899 CG LEU A 770 3.046 0.573 -3.919 1.00 0.00 C ATOM 900 CD1 LEU A 770 3.219 2.090 -4.021 1.00 0.00 C ATOM 901 CD2 LEU A 770 1.574 0.213 -4.127 1.00 0.00 C ATOM 0 H LEU A 770 5.576 -1.024 -3.554 1.00 0.00 H new ATOM 0 HA LEU A 770 2.940 -1.991 -4.408 1.00 0.00 H new ATOM 0 HB2 LEU A 770 4.913 0.280 -4.970 1.00 0.00 H new ATOM 0 HB3 LEU A 770 3.494 0.104 -5.982 1.00 0.00 H new ATOM 0 HG LEU A 770 3.366 0.236 -2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 770 2.614 2.577 -3.257 1.00 0.00 H new ATOM 0 HD12 LEU A 770 4.268 2.347 -3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 770 2.899 2.427 -5.007 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.969 0.700 -3.363 1.00 0.00 H new ATOM 0 HD22 LEU A 770 1.253 0.549 -5.113 1.00 0.00 H new ATOM 0 HD23 LEU A 770 1.450 -0.867 -4.054 1.00 0.00 H new ATOM 913 N LYS A 771 5.499 -2.617 -6.286 1.00 0.00 N ATOM 914 CA LYS A 771 5.886 -3.346 -7.527 1.00 0.00 C ATOM 915 C LYS A 771 5.305 -4.762 -7.519 1.00 0.00 C ATOM 916 O LYS A 771 5.164 -5.391 -8.549 1.00 0.00 O ATOM 917 CB LYS A 771 7.415 -3.398 -7.488 1.00 0.00 C ATOM 918 CG LYS A 771 7.969 -3.224 -8.904 1.00 0.00 C ATOM 919 CD LYS A 771 8.568 -4.548 -9.383 1.00 0.00 C ATOM 920 CE LYS A 771 9.017 -4.407 -10.838 1.00 0.00 C ATOM 921 NZ LYS A 771 8.870 -5.772 -11.417 1.00 0.00 N ATOM 0 H LYS A 771 6.275 -2.344 -5.683 1.00 0.00 H new ATOM 0 HA LYS A 771 5.511 -2.857 -8.426 1.00 0.00 H new ATOM 0 HB2 LYS A 771 7.799 -2.613 -6.837 1.00 0.00 H new ATOM 0 HB3 LYS A 771 7.746 -4.349 -7.071 1.00 0.00 H new ATOM 0 HG2 LYS A 771 7.175 -2.906 -9.580 1.00 0.00 H new ATOM 0 HG3 LYS A 771 8.729 -2.443 -8.915 1.00 0.00 H new ATOM 0 HD2 LYS A 771 9.415 -4.825 -8.755 1.00 0.00 H new ATOM 0 HD3 LYS A 771 7.831 -5.346 -9.294 1.00 0.00 H new ATOM 0 HE2 LYS A 771 8.403 -3.682 -11.373 1.00 0.00 H new ATOM 0 HE3 LYS A 771 10.048 -4.059 -10.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 9.159 -5.758 -12.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 9.471 -6.439 -10.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 7.877 -6.073 -11.348 1.00 0.00 H new ATOM 935 N THR A 772 4.970 -5.269 -6.365 1.00 0.00 N ATOM 936 CA THR A 772 4.404 -6.645 -6.290 1.00 0.00 C ATOM 937 C THR A 772 2.875 -6.599 -6.342 1.00 0.00 C ATOM 938 O THR A 772 2.241 -7.411 -6.987 1.00 0.00 O ATOM 939 CB THR A 772 4.877 -7.185 -4.938 1.00 0.00 C ATOM 940 OG1 THR A 772 6.293 -7.292 -4.942 1.00 0.00 O ATOM 941 CG2 THR A 772 4.263 -8.564 -4.691 1.00 0.00 C ATOM 0 H THR A 772 5.064 -4.789 -5.470 1.00 0.00 H new ATOM 0 HA THR A 772 4.727 -7.271 -7.122 1.00 0.00 H new ATOM 0 HB THR A 772 4.564 -6.504 -4.147 1.00 0.00 H new ATOM 0 HG1 THR A 772 6.598 -7.636 -4.076 1.00 0.00 H new ATOM 0 HG21 THR A 772 4.602 -8.946 -3.728 1.00 0.00 H new ATOM 0 HG22 THR A 772 3.176 -8.483 -4.687 1.00 0.00 H new ATOM 0 HG23 THR A 772 4.573 -9.247 -5.482 1.00 0.00 H new ATOM 949 N MET A 773 2.278 -5.658 -5.665 1.00 0.00 N ATOM 950 CA MET A 773 0.791 -5.562 -5.671 1.00 0.00 C ATOM 951 C MET A 773 0.272 -5.428 -7.104 1.00 0.00 C ATOM 952 O MET A 773 -0.450 -6.273 -7.594 1.00 0.00 O ATOM 953 CB MET A 773 0.478 -4.296 -4.871 1.00 0.00 C ATOM 954 CG MET A 773 0.488 -4.623 -3.377 1.00 0.00 C ATOM 955 SD MET A 773 -1.200 -4.973 -2.826 1.00 0.00 S ATOM 956 CE MET A 773 -1.419 -3.496 -1.804 1.00 0.00 C ATOM 0 H MET A 773 2.756 -4.950 -5.107 1.00 0.00 H new ATOM 0 HA MET A 773 0.319 -6.447 -5.245 1.00 0.00 H new ATOM 0 HB2 MET A 773 1.214 -3.523 -5.090 1.00 0.00 H new ATOM 0 HB3 MET A 773 -0.495 -3.901 -5.161 1.00 0.00 H new ATOM 0 HG2 MET A 773 1.130 -5.483 -3.186 1.00 0.00 H new ATOM 0 HG3 MET A 773 0.900 -3.786 -2.813 1.00 0.00 H new ATOM 0 HE1 MET A 773 -2.229 -3.662 -1.094 1.00 0.00 H new ATOM 0 HE2 MET A 773 -0.497 -3.289 -1.261 1.00 0.00 H new ATOM 0 HE3 MET A 773 -1.663 -2.646 -2.441 1.00 0.00 H new ATOM 966 N SER A 774 0.635 -4.372 -7.781 1.00 0.00 N ATOM 967 CA SER A 774 0.165 -4.186 -9.184 1.00 0.00 C ATOM 968 C SER A 774 0.451 -5.440 -10.013 1.00 0.00 C ATOM 969 O SER A 774 -0.263 -5.755 -10.944 1.00 0.00 O ATOM 970 CB SER A 774 0.964 -3.004 -9.716 1.00 0.00 C ATOM 971 OG SER A 774 0.439 -1.795 -9.189 1.00 0.00 O ATOM 0 H SER A 774 1.237 -3.630 -7.423 1.00 0.00 H new ATOM 0 HA SER A 774 -0.909 -4.010 -9.236 1.00 0.00 H new ATOM 0 HB2 SER A 774 2.013 -3.108 -9.439 1.00 0.00 H new ATOM 0 HB3 SER A 774 0.923 -2.985 -10.805 1.00 0.00 H new ATOM 0 HG SER A 774 -0.003 -1.291 -9.904 1.00 0.00 H new ATOM 977 N GLU A 775 1.485 -6.162 -9.679 1.00 0.00 N ATOM 978 CA GLU A 775 1.808 -7.398 -10.445 1.00 0.00 C ATOM 979 C GLU A 775 0.679 -8.421 -10.301 1.00 0.00 C ATOM 980 O GLU A 775 0.143 -8.910 -11.276 1.00 0.00 O ATOM 981 CB GLU A 775 3.095 -7.929 -9.812 1.00 0.00 C ATOM 982 CG GLU A 775 4.252 -7.750 -10.795 1.00 0.00 C ATOM 983 CD GLU A 775 5.562 -8.170 -10.126 1.00 0.00 C ATOM 984 OE1 GLU A 775 5.771 -9.362 -9.972 1.00 0.00 O ATOM 985 OE2 GLU A 775 6.336 -7.292 -9.780 1.00 0.00 O ATOM 0 H GLU A 775 2.120 -5.949 -8.909 1.00 0.00 H new ATOM 0 HA GLU A 775 1.926 -7.204 -11.511 1.00 0.00 H new ATOM 0 HB2 GLU A 775 3.305 -7.396 -8.885 1.00 0.00 H new ATOM 0 HB3 GLU A 775 2.980 -8.982 -9.555 1.00 0.00 H new ATOM 0 HG2 GLU A 775 4.080 -8.350 -11.689 1.00 0.00 H new ATOM 0 HG3 GLU A 775 4.313 -6.710 -11.116 1.00 0.00 H new ATOM 992 N ARG A 776 0.311 -8.748 -9.092 1.00 0.00 N ATOM 993 CA ARG A 776 -0.790 -9.735 -8.890 1.00 0.00 C ATOM 994 C ARG A 776 -2.143 -9.071 -9.152 1.00 0.00 C ATOM 995 O ARG A 776 -2.971 -9.588 -9.875 1.00 0.00 O ATOM 996 CB ARG A 776 -0.678 -10.160 -7.425 1.00 0.00 C ATOM 997 CG ARG A 776 0.735 -10.673 -7.147 1.00 0.00 C ATOM 998 CD ARG A 776 0.816 -11.200 -5.713 1.00 0.00 C ATOM 999 NE ARG A 776 1.795 -12.324 -5.776 1.00 0.00 N ATOM 1000 CZ ARG A 776 2.210 -12.920 -4.682 1.00 0.00 C ATOM 1001 NH1 ARG A 776 1.777 -12.545 -3.503 1.00 0.00 N ATOM 1002 NH2 ARG A 776 3.066 -13.900 -4.770 1.00 0.00 N ATOM 0 H ARG A 776 0.724 -8.376 -8.237 1.00 0.00 H new ATOM 0 HA ARG A 776 -0.714 -10.585 -9.567 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -0.905 -9.317 -6.773 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -1.408 -10.938 -7.205 1.00 0.00 H new ATOM 0 HG2 ARG A 776 0.991 -11.465 -7.851 1.00 0.00 H new ATOM 0 HG3 ARG A 776 1.459 -9.871 -7.292 1.00 0.00 H new ATOM 0 HD2 ARG A 776 1.149 -10.424 -5.024 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -0.157 -11.542 -5.362 1.00 0.00 H new ATOM 0 HE ARG A 776 2.147 -12.634 -6.682 1.00 0.00 H new ATOM 0 HH11 ARG A 776 1.107 -11.779 -3.425 1.00 0.00 H new ATOM 0 HH12 ARG A 776 2.110 -13.019 -2.663 1.00 0.00 H new ATOM 0 HH21 ARG A 776 3.408 -14.198 -5.684 1.00 0.00 H new ATOM 0 HH22 ARG A 776 3.394 -14.368 -3.925 1.00 0.00 H new ATOM 1016 N LEU A 777 -2.367 -7.919 -8.580 1.00 0.00 N ATOM 1017 CA LEU A 777 -3.656 -7.203 -8.808 1.00 0.00 C ATOM 1018 C LEU A 777 -3.938 -7.095 -10.311 1.00 0.00 C ATOM 1019 O LEU A 777 -5.071 -7.154 -10.746 1.00 0.00 O ATOM 1020 CB LEU A 777 -3.435 -5.821 -8.174 1.00 0.00 C ATOM 1021 CG LEU A 777 -4.477 -4.790 -8.650 1.00 0.00 C ATOM 1022 CD1 LEU A 777 -5.880 -5.407 -8.749 1.00 0.00 C ATOM 1023 CD2 LEU A 777 -4.516 -3.650 -7.640 1.00 0.00 C ATOM 0 H LEU A 777 -1.711 -7.441 -7.962 1.00 0.00 H new ATOM 0 HA LEU A 777 -4.516 -7.714 -8.375 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -3.483 -5.909 -7.089 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -2.435 -5.465 -8.421 1.00 0.00 H new ATOM 0 HG LEU A 777 -4.190 -4.438 -9.641 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -6.587 -4.650 -9.088 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -5.865 -6.233 -9.460 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -6.185 -5.776 -7.770 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -5.248 -2.907 -7.958 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -4.796 -4.040 -6.661 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -3.532 -3.186 -7.577 1.00 0.00 H new ATOM 1035 N LYS A 778 -2.913 -6.969 -11.109 1.00 0.00 N ATOM 1036 CA LYS A 778 -3.124 -6.888 -12.580 1.00 0.00 C ATOM 1037 C LYS A 778 -3.929 -8.098 -13.060 1.00 0.00 C ATOM 1038 O LYS A 778 -5.044 -7.969 -13.525 1.00 0.00 O ATOM 1039 CB LYS A 778 -1.718 -6.915 -13.182 1.00 0.00 C ATOM 1040 CG LYS A 778 -1.373 -5.531 -13.736 1.00 0.00 C ATOM 1041 CD LYS A 778 -0.304 -5.669 -14.821 1.00 0.00 C ATOM 1042 CE LYS A 778 -0.973 -5.683 -16.197 1.00 0.00 C ATOM 1043 NZ LYS A 778 0.024 -6.326 -17.099 1.00 0.00 N ATOM 0 H LYS A 778 -1.941 -6.919 -10.805 1.00 0.00 H new ATOM 0 HA LYS A 778 -3.678 -5.995 -12.871 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -0.992 -7.206 -12.423 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -1.665 -7.660 -13.976 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -2.265 -5.059 -14.147 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -1.012 -4.886 -12.935 1.00 0.00 H new ATOM 0 HD2 LYS A 778 0.403 -4.842 -14.757 1.00 0.00 H new ATOM 0 HD3 LYS A 778 0.265 -6.587 -14.672 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -1.907 -6.244 -16.177 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -1.214 -4.673 -16.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -0.361 -6.373 -18.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 0.901 -5.766 -17.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 0.229 -7.288 -16.761 1.00 0.00 H new ATOM 1057 N ASN A 779 -3.379 -9.276 -12.934 1.00 0.00 N ATOM 1058 CA ASN A 779 -4.110 -10.491 -13.384 1.00 0.00 C ATOM 1059 C ASN A 779 -5.311 -10.767 -12.472 1.00 0.00 C ATOM 1060 O ASN A 779 -6.444 -10.551 -12.851 1.00 0.00 O ATOM 1061 CB ASN A 779 -3.079 -11.623 -13.299 1.00 0.00 C ATOM 1062 CG ASN A 779 -3.326 -12.608 -14.435 1.00 0.00 C ATOM 1063 OD1 ASN A 779 -3.406 -13.801 -14.218 1.00 0.00 O ATOM 1064 ND2 ASN A 779 -3.462 -12.155 -15.646 1.00 0.00 N ATOM 0 H ASN A 779 -2.455 -9.447 -12.538 1.00 0.00 H new ATOM 0 HA ASN A 779 -4.512 -10.384 -14.391 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -2.069 -11.218 -13.365 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -3.156 -12.131 -12.338 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -3.636 -12.801 -16.416 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -3.395 -11.153 -15.826 1.00 0.00 H new ATOM 1071 N ARG A 780 -5.078 -11.240 -11.274 1.00 0.00 N ATOM 1072 CA ARG A 780 -6.215 -11.520 -10.348 1.00 0.00 C ATOM 1073 C ARG A 780 -5.702 -11.994 -8.985 1.00 0.00 C ATOM 1074 O ARG A 780 -5.344 -13.143 -8.814 1.00 0.00 O ATOM 1075 CB ARG A 780 -7.012 -12.641 -11.023 1.00 0.00 C ATOM 1076 CG ARG A 780 -8.178 -13.052 -10.120 1.00 0.00 C ATOM 1077 CD ARG A 780 -8.163 -14.569 -9.924 1.00 0.00 C ATOM 1078 NE ARG A 780 -9.579 -14.929 -9.617 1.00 0.00 N ATOM 1079 CZ ARG A 780 -9.894 -16.132 -9.195 1.00 0.00 C ATOM 1080 NH1 ARG A 780 -8.976 -17.053 -9.033 1.00 0.00 N ATOM 1081 NH2 ARG A 780 -11.141 -16.415 -8.934 1.00 0.00 N ATOM 0 H ARG A 780 -4.152 -11.444 -10.898 1.00 0.00 H new ATOM 0 HA ARG A 780 -6.817 -10.629 -10.170 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -7.387 -12.304 -11.989 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -6.366 -13.498 -11.213 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -8.100 -12.550 -9.156 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -9.123 -12.742 -10.565 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -7.811 -15.080 -10.820 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -7.497 -14.856 -9.110 1.00 0.00 H new ATOM 0 HE ARG A 780 -10.312 -14.230 -9.737 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -7.999 -16.841 -9.236 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -9.238 -17.982 -8.704 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -11.862 -15.704 -9.058 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -11.395 -17.347 -8.606 1.00 0.00 H new ATOM 1095 N TYR A 781 -5.688 -11.131 -8.005 1.00 0.00 N ATOM 1096 CA TYR A 781 -5.222 -11.551 -6.652 1.00 0.00 C ATOM 1097 C TYR A 781 -5.797 -10.632 -5.571 1.00 0.00 C ATOM 1098 O TYR A 781 -6.570 -11.056 -4.735 1.00 0.00 O ATOM 1099 CB TYR A 781 -3.698 -11.435 -6.701 1.00 0.00 C ATOM 1100 CG TYR A 781 -3.085 -12.613 -5.982 1.00 0.00 C ATOM 1101 CD1 TYR A 781 -2.860 -12.551 -4.601 1.00 0.00 C ATOM 1102 CD2 TYR A 781 -2.746 -13.769 -6.695 1.00 0.00 C ATOM 1103 CE1 TYR A 781 -2.294 -13.645 -3.934 1.00 0.00 C ATOM 1104 CE2 TYR A 781 -2.180 -14.863 -6.028 1.00 0.00 C ATOM 1105 CZ TYR A 781 -1.954 -14.801 -4.648 1.00 0.00 C ATOM 1106 OH TYR A 781 -1.396 -15.879 -3.990 1.00 0.00 O ATOM 0 H TYR A 781 -5.978 -10.156 -8.082 1.00 0.00 H new ATOM 0 HA TYR A 781 -5.548 -12.562 -6.406 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -3.357 -11.408 -7.736 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -3.377 -10.503 -6.235 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -3.123 -11.660 -4.050 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -2.921 -13.817 -7.760 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -2.120 -13.597 -2.869 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -1.918 -15.754 -6.579 1.00 0.00 H new ATOM 0 HH TYR A 781 -1.221 -16.599 -4.631 1.00 0.00 H new ATOM 1116 N TYR A 782 -5.426 -9.378 -5.570 1.00 0.00 N ATOM 1117 CA TYR A 782 -5.959 -8.451 -4.530 1.00 0.00 C ATOM 1118 C TYR A 782 -7.408 -8.073 -4.839 1.00 0.00 C ATOM 1119 O TYR A 782 -7.717 -6.931 -5.114 1.00 0.00 O ATOM 1120 CB TYR A 782 -5.068 -7.209 -4.597 1.00 0.00 C ATOM 1121 CG TYR A 782 -3.690 -7.542 -4.077 1.00 0.00 C ATOM 1122 CD1 TYR A 782 -3.456 -7.574 -2.698 1.00 0.00 C ATOM 1123 CD2 TYR A 782 -2.645 -7.810 -4.970 1.00 0.00 C ATOM 1124 CE1 TYR A 782 -2.181 -7.878 -2.210 1.00 0.00 C ATOM 1125 CE2 TYR A 782 -1.368 -8.115 -4.481 1.00 0.00 C ATOM 1126 CZ TYR A 782 -1.136 -8.149 -3.101 1.00 0.00 C ATOM 1127 OH TYR A 782 0.122 -8.449 -2.619 1.00 0.00 O ATOM 0 H TYR A 782 -4.781 -8.959 -6.240 1.00 0.00 H new ATOM 0 HA TYR A 782 -5.951 -8.910 -3.541 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -5.003 -6.852 -5.625 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -5.505 -6.404 -4.007 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -4.261 -7.364 -2.009 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -2.823 -7.782 -6.035 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -2.003 -7.904 -1.145 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -0.562 -8.324 -5.169 1.00 0.00 H new ATOM 0 HH TYR A 782 0.046 -8.817 -1.714 1.00 0.00 H new ATOM 1137 N VAL A 783 -8.300 -9.021 -4.792 1.00 0.00 N ATOM 1138 CA VAL A 783 -9.731 -8.709 -5.058 1.00 0.00 C ATOM 1139 C VAL A 783 -10.481 -8.487 -3.739 1.00 0.00 C ATOM 1140 O VAL A 783 -11.605 -8.025 -3.725 1.00 0.00 O ATOM 1141 CB VAL A 783 -10.273 -9.946 -5.775 1.00 0.00 C ATOM 1142 CG1 VAL A 783 -10.123 -11.165 -4.864 1.00 0.00 C ATOM 1143 CG2 VAL A 783 -11.751 -9.738 -6.110 1.00 0.00 C ATOM 0 H VAL A 783 -8.100 -9.999 -4.581 1.00 0.00 H new ATOM 0 HA VAL A 783 -9.853 -7.802 -5.650 1.00 0.00 H new ATOM 0 HB VAL A 783 -9.713 -10.107 -6.696 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -10.509 -12.049 -5.372 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -9.070 -11.314 -4.626 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -10.684 -11.002 -3.943 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.136 -10.620 -6.621 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -12.313 -9.577 -5.190 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -11.858 -8.868 -6.758 1.00 0.00 H new ATOM 1153 N SER A 784 -9.868 -8.811 -2.629 1.00 0.00 N ATOM 1154 CA SER A 784 -10.548 -8.627 -1.317 1.00 0.00 C ATOM 1155 C SER A 784 -10.224 -7.252 -0.729 1.00 0.00 C ATOM 1156 O SER A 784 -9.337 -6.561 -1.190 1.00 0.00 O ATOM 1157 CB SER A 784 -9.971 -9.728 -0.427 1.00 0.00 C ATOM 1158 OG SER A 784 -11.019 -10.343 0.307 1.00 0.00 O ATOM 0 H SER A 784 -8.925 -9.195 -2.577 1.00 0.00 H new ATOM 0 HA SER A 784 -11.633 -8.684 -1.406 1.00 0.00 H new ATOM 0 HB2 SER A 784 -9.456 -10.470 -1.037 1.00 0.00 H new ATOM 0 HB3 SER A 784 -9.232 -9.308 0.256 1.00 0.00 H new ATOM 0 HG SER A 784 -10.649 -11.050 0.876 1.00 0.00 H new ATOM 1164 N LYS A 785 -10.926 -6.860 0.298 1.00 0.00 N ATOM 1165 CA LYS A 785 -10.657 -5.536 0.927 1.00 0.00 C ATOM 1166 C LYS A 785 -9.552 -5.664 1.980 1.00 0.00 C ATOM 1167 O LYS A 785 -8.692 -4.813 2.099 1.00 0.00 O ATOM 1168 CB LYS A 785 -11.985 -5.146 1.584 1.00 0.00 C ATOM 1169 CG LYS A 785 -11.803 -3.859 2.394 1.00 0.00 C ATOM 1170 CD LYS A 785 -13.121 -3.502 3.089 1.00 0.00 C ATOM 1171 CE LYS A 785 -13.553 -4.656 3.996 1.00 0.00 C ATOM 1172 NZ LYS A 785 -13.811 -4.024 5.321 1.00 0.00 N ATOM 0 H LYS A 785 -11.676 -7.400 0.730 1.00 0.00 H new ATOM 0 HA LYS A 785 -10.319 -4.791 0.206 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -12.750 -5.002 0.821 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -12.330 -5.950 2.234 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -11.014 -3.991 3.134 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -11.493 -3.045 1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -12.999 -2.591 3.675 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -13.893 -3.302 2.346 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -14.447 -5.148 3.612 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -12.775 -5.417 4.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -14.030 -4.762 6.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -12.967 -3.498 5.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -14.616 -3.371 5.243 1.00 0.00 H new ATOM 1186 N LYS A 786 -9.567 -6.722 2.745 1.00 0.00 N ATOM 1187 CA LYS A 786 -8.521 -6.901 3.794 1.00 0.00 C ATOM 1188 C LYS A 786 -7.197 -7.334 3.161 1.00 0.00 C ATOM 1189 O LYS A 786 -6.136 -6.905 3.566 1.00 0.00 O ATOM 1190 CB LYS A 786 -9.062 -8.003 4.707 1.00 0.00 C ATOM 1191 CG LYS A 786 -8.173 -8.116 5.948 1.00 0.00 C ATOM 1192 CD LYS A 786 -8.347 -9.500 6.577 1.00 0.00 C ATOM 1193 CE LYS A 786 -7.323 -9.681 7.700 1.00 0.00 C ATOM 1194 NZ LYS A 786 -7.312 -11.145 7.974 1.00 0.00 N ATOM 0 H LYS A 786 -10.258 -7.470 2.689 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.323 -5.977 4.338 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -10.087 -7.777 5.000 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -9.085 -8.954 4.174 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -7.129 -7.957 5.676 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -8.436 -7.342 6.669 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -9.358 -9.608 6.971 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -8.215 -10.274 5.821 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -6.337 -9.328 7.397 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -7.605 -9.115 8.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -6.633 -11.351 8.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -8.262 -11.451 8.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -7.033 -11.657 7.113 1.00 0.00 H new ATOM 1208 N LEU A 787 -7.248 -8.187 2.175 1.00 0.00 N ATOM 1209 CA LEU A 787 -5.992 -8.638 1.512 1.00 0.00 C ATOM 1210 C LEU A 787 -5.222 -7.420 0.985 1.00 0.00 C ATOM 1211 O LEU A 787 -4.082 -7.187 1.346 1.00 0.00 O ATOM 1212 CB LEU A 787 -6.475 -9.551 0.366 1.00 0.00 C ATOM 1213 CG LEU A 787 -5.389 -9.733 -0.710 1.00 0.00 C ATOM 1214 CD1 LEU A 787 -4.048 -10.090 -0.061 1.00 0.00 C ATOM 1215 CD2 LEU A 787 -5.804 -10.859 -1.659 1.00 0.00 C ATOM 0 H LEU A 787 -8.106 -8.591 1.800 1.00 0.00 H new ATOM 0 HA LEU A 787 -5.310 -9.164 2.180 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -6.755 -10.524 0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.369 -9.124 -0.088 1.00 0.00 H new ATOM 0 HG LEU A 787 -5.278 -8.799 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -3.291 -10.215 -0.835 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -3.747 -9.290 0.615 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -4.151 -11.019 0.499 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -5.038 -10.992 -2.423 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -5.919 -11.785 -1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.751 -10.603 -2.135 1.00 0.00 H new ATOM 1227 N PHE A 788 -5.842 -6.636 0.149 1.00 0.00 N ATOM 1228 CA PHE A 788 -5.155 -5.433 -0.396 1.00 0.00 C ATOM 1229 C PHE A 788 -4.748 -4.490 0.737 1.00 0.00 C ATOM 1230 O PHE A 788 -3.608 -4.083 0.840 1.00 0.00 O ATOM 1231 CB PHE A 788 -6.195 -4.767 -1.296 1.00 0.00 C ATOM 1232 CG PHE A 788 -5.566 -3.596 -2.011 1.00 0.00 C ATOM 1233 CD1 PHE A 788 -4.653 -3.817 -3.049 1.00 0.00 C ATOM 1234 CD2 PHE A 788 -5.894 -2.289 -1.635 1.00 0.00 C ATOM 1235 CE1 PHE A 788 -4.071 -2.731 -3.713 1.00 0.00 C ATOM 1236 CE2 PHE A 788 -5.314 -1.203 -2.300 1.00 0.00 C ATOM 1237 CZ PHE A 788 -4.402 -1.424 -3.338 1.00 0.00 C ATOM 0 H PHE A 788 -6.797 -6.777 -0.181 1.00 0.00 H new ATOM 0 HA PHE A 788 -4.243 -5.688 -0.936 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -6.578 -5.486 -2.020 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -7.044 -4.430 -0.701 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -4.398 -4.826 -3.338 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -6.595 -2.118 -0.831 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -3.367 -2.902 -4.514 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -5.570 -0.194 -2.012 1.00 0.00 H new ATOM 0 HZ PHE A 788 -3.953 -0.586 -3.850 1.00 0.00 H new ATOM 1247 N MET A 789 -5.671 -4.136 1.589 1.00 0.00 N ATOM 1248 CA MET A 789 -5.334 -3.216 2.712 1.00 0.00 C ATOM 1249 C MET A 789 -4.155 -3.760 3.519 1.00 0.00 C ATOM 1250 O MET A 789 -3.230 -3.043 3.843 1.00 0.00 O ATOM 1251 CB MET A 789 -6.591 -3.168 3.571 1.00 0.00 C ATOM 1252 CG MET A 789 -6.570 -1.902 4.431 1.00 0.00 C ATOM 1253 SD MET A 789 -6.586 -0.421 3.384 1.00 0.00 S ATOM 1254 CE MET A 789 -7.985 -0.882 2.333 1.00 0.00 C ATOM 0 H MET A 789 -6.643 -4.444 1.556 1.00 0.00 H new ATOM 0 HA MET A 789 -5.040 -2.228 2.357 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.478 -3.176 2.938 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.645 -4.052 4.206 1.00 0.00 H new ATOM 0 HG2 MET A 789 -7.433 -1.893 5.096 1.00 0.00 H new ATOM 0 HG3 MET A 789 -5.681 -1.899 5.062 1.00 0.00 H new ATOM 0 HE1 MET A 789 -8.503 0.018 2.002 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.622 -1.432 1.465 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.674 -1.510 2.899 1.00 0.00 H new ATOM 1264 N ALA A 790 -4.180 -5.020 3.850 1.00 0.00 N ATOM 1265 CA ALA A 790 -3.058 -5.603 4.637 1.00 0.00 C ATOM 1266 C ALA A 790 -1.720 -5.317 3.953 1.00 0.00 C ATOM 1267 O ALA A 790 -0.852 -4.677 4.511 1.00 0.00 O ATOM 1268 CB ALA A 790 -3.333 -7.108 4.657 1.00 0.00 C ATOM 0 H ALA A 790 -4.928 -5.671 3.610 1.00 0.00 H new ATOM 0 HA ALA A 790 -2.997 -5.181 5.640 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -2.549 -7.614 5.220 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.297 -7.295 5.130 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -3.350 -7.488 3.636 1.00 0.00 H new ATOM 1274 N ASP A 791 -1.545 -5.789 2.747 1.00 0.00 N ATOM 1275 CA ASP A 791 -0.257 -5.551 2.032 1.00 0.00 C ATOM 1276 C ASP A 791 0.030 -4.050 1.925 1.00 0.00 C ATOM 1277 O ASP A 791 1.024 -3.561 2.423 1.00 0.00 O ATOM 1278 CB ASP A 791 -0.468 -6.155 0.644 1.00 0.00 C ATOM 1279 CG ASP A 791 -0.510 -7.680 0.756 1.00 0.00 C ATOM 1280 OD1 ASP A 791 -1.017 -8.168 1.752 1.00 0.00 O ATOM 1281 OD2 ASP A 791 -0.034 -8.335 -0.157 1.00 0.00 O ATOM 0 H ASP A 791 -2.237 -6.328 2.227 1.00 0.00 H new ATOM 0 HA ASP A 791 0.592 -5.994 2.552 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -1.398 -5.785 0.212 1.00 0.00 H new ATOM 0 HB3 ASP A 791 0.338 -5.850 -0.024 1.00 0.00 H new ATOM 1286 N LEU A 792 -0.837 -3.318 1.279 1.00 0.00 N ATOM 1287 CA LEU A 792 -0.638 -1.842 1.137 1.00 0.00 C ATOM 1288 C LEU A 792 -0.260 -1.219 2.491 1.00 0.00 C ATOM 1289 O LEU A 792 0.751 -0.539 2.628 1.00 0.00 O ATOM 1290 CB LEU A 792 -2.011 -1.343 0.663 1.00 0.00 C ATOM 1291 CG LEU A 792 -1.885 0.011 -0.042 1.00 0.00 C ATOM 1292 CD1 LEU A 792 -1.462 1.069 0.967 1.00 0.00 C ATOM 1293 CD2 LEU A 792 -0.849 -0.062 -1.163 1.00 0.00 C ATOM 0 H LEU A 792 -1.683 -3.680 0.839 1.00 0.00 H new ATOM 0 HA LEU A 792 0.166 -1.578 0.450 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -2.453 -2.072 -0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -2.684 -1.253 1.516 1.00 0.00 H new ATOM 0 HG LEU A 792 -2.851 0.273 -0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -1.372 2.033 0.467 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -2.210 1.138 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -0.501 0.794 1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -0.773 0.909 -1.652 1.00 0.00 H new ATOM 0 HD22 LEU A 792 0.120 -0.334 -0.745 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.154 -0.813 -1.892 1.00 0.00 H new ATOM 1305 N GLN A 793 -1.046 -1.476 3.503 1.00 0.00 N ATOM 1306 CA GLN A 793 -0.713 -0.951 4.854 1.00 0.00 C ATOM 1307 C GLN A 793 0.658 -1.481 5.273 1.00 0.00 C ATOM 1308 O GLN A 793 1.408 -0.822 5.966 1.00 0.00 O ATOM 1309 CB GLN A 793 -1.814 -1.495 5.771 1.00 0.00 C ATOM 1310 CG GLN A 793 -1.470 -1.194 7.232 1.00 0.00 C ATOM 1311 CD GLN A 793 -1.124 -2.499 7.954 1.00 0.00 C ATOM 1312 OE1 GLN A 793 -1.706 -3.530 7.681 1.00 0.00 O ATOM 1313 NE2 GLN A 793 -0.193 -2.498 8.869 1.00 0.00 N ATOM 0 H GLN A 793 -1.903 -2.027 3.450 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.666 0.137 4.891 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.771 -1.042 5.513 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.921 -2.570 5.627 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -0.629 -0.503 7.284 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -2.313 -0.707 7.722 1.00 0.00 H new ATOM 0 HE21 GLN A 793 0.296 -1.633 9.098 1.00 0.00 H new ATOM 0 HE22 GLN A 793 0.046 -3.363 9.355 1.00 0.00 H new ATOM 1322 N ARG A 794 0.997 -2.665 4.837 1.00 0.00 N ATOM 1323 CA ARG A 794 2.332 -3.228 5.170 1.00 0.00 C ATOM 1324 C ARG A 794 3.421 -2.413 4.476 1.00 0.00 C ATOM 1325 O ARG A 794 4.525 -2.292 4.965 1.00 0.00 O ATOM 1326 CB ARG A 794 2.306 -4.652 4.629 1.00 0.00 C ATOM 1327 CG ARG A 794 3.162 -5.535 5.529 1.00 0.00 C ATOM 1328 CD ARG A 794 3.012 -6.988 5.097 1.00 0.00 C ATOM 1329 NE ARG A 794 2.164 -7.618 6.151 1.00 0.00 N ATOM 1330 CZ ARG A 794 1.728 -8.849 6.019 1.00 0.00 C ATOM 1331 NH1 ARG A 794 2.025 -9.562 4.960 1.00 0.00 N ATOM 1332 NH2 ARG A 794 0.988 -9.372 6.957 1.00 0.00 N ATOM 0 H ARG A 794 0.404 -3.265 4.264 1.00 0.00 H new ATOM 0 HA ARG A 794 2.541 -3.205 6.240 1.00 0.00 H new ATOM 0 HB2 ARG A 794 1.282 -5.025 4.598 1.00 0.00 H new ATOM 0 HB3 ARG A 794 2.685 -4.675 3.607 1.00 0.00 H new ATOM 0 HG2 ARG A 794 4.207 -5.231 5.468 1.00 0.00 H new ATOM 0 HG3 ARG A 794 2.856 -5.419 6.569 1.00 0.00 H new ATOM 0 HD2 ARG A 794 2.542 -7.062 4.116 1.00 0.00 H new ATOM 0 HD3 ARG A 794 3.982 -7.480 5.024 1.00 0.00 H new ATOM 0 HE ARG A 794 1.920 -7.085 6.985 1.00 0.00 H new ATOM 0 HH11 ARG A 794 2.604 -9.162 4.222 1.00 0.00 H new ATOM 0 HH12 ARG A 794 1.677 -10.517 4.874 1.00 0.00 H new ATOM 0 HH21 ARG A 794 0.752 -8.825 7.785 1.00 0.00 H new ATOM 0 HH22 ARG A 794 0.645 -10.328 6.862 1.00 0.00 H new ATOM 1346 N VAL A 795 3.110 -1.842 3.344 1.00 0.00 N ATOM 1347 CA VAL A 795 4.117 -1.013 2.627 1.00 0.00 C ATOM 1348 C VAL A 795 4.428 0.244 3.438 1.00 0.00 C ATOM 1349 O VAL A 795 5.563 0.504 3.794 1.00 0.00 O ATOM 1350 CB VAL A 795 3.450 -0.633 1.302 1.00 0.00 C ATOM 1351 CG1 VAL A 795 4.422 0.199 0.464 1.00 0.00 C ATOM 1352 CG2 VAL A 795 3.068 -1.898 0.532 1.00 0.00 C ATOM 0 H VAL A 795 2.202 -1.915 2.886 1.00 0.00 H new ATOM 0 HA VAL A 795 5.056 -1.544 2.475 1.00 0.00 H new ATOM 0 HB VAL A 795 2.551 -0.051 1.506 1.00 0.00 H new ATOM 0 HG11 VAL A 795 3.949 0.470 -0.480 1.00 0.00 H new ATOM 0 HG12 VAL A 795 4.690 1.104 1.009 1.00 0.00 H new ATOM 0 HG13 VAL A 795 5.321 -0.384 0.264 1.00 0.00 H new ATOM 0 HG21 VAL A 795 2.594 -1.621 -0.410 1.00 0.00 H new ATOM 0 HG22 VAL A 795 3.964 -2.485 0.329 1.00 0.00 H new ATOM 0 HG23 VAL A 795 2.374 -2.491 1.128 1.00 0.00 H new ATOM 1362 N PHE A 796 3.425 1.025 3.744 1.00 0.00 N ATOM 1363 CA PHE A 796 3.673 2.272 4.530 1.00 0.00 C ATOM 1364 C PHE A 796 4.410 1.953 5.833 1.00 0.00 C ATOM 1365 O PHE A 796 5.400 2.575 6.164 1.00 0.00 O ATOM 1366 CB PHE A 796 2.287 2.841 4.836 1.00 0.00 C ATOM 1367 CG PHE A 796 1.623 3.292 3.556 1.00 0.00 C ATOM 1368 CD1 PHE A 796 2.358 3.973 2.573 1.00 0.00 C ATOM 1369 CD2 PHE A 796 0.263 3.039 3.359 1.00 0.00 C ATOM 1370 CE1 PHE A 796 1.731 4.387 1.393 1.00 0.00 C ATOM 1371 CE2 PHE A 796 -0.361 3.452 2.179 1.00 0.00 C ATOM 1372 CZ PHE A 796 0.371 4.129 1.197 1.00 0.00 C ATOM 0 H PHE A 796 2.452 0.856 3.487 1.00 0.00 H new ATOM 0 HA PHE A 796 4.294 2.977 3.977 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.674 2.085 5.327 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.373 3.680 5.527 1.00 0.00 H new ATOM 0 HD1 PHE A 796 3.407 4.177 2.728 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.306 2.524 4.119 1.00 0.00 H new ATOM 0 HE1 PHE A 796 2.297 4.906 0.634 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -1.410 3.248 2.024 1.00 0.00 H new ATOM 0 HZ PHE A 796 -0.115 4.452 0.288 1.00 0.00 H new ATOM 1382 N THR A 797 3.934 0.996 6.580 1.00 0.00 N ATOM 1383 CA THR A 797 4.599 0.666 7.871 1.00 0.00 C ATOM 1384 C THR A 797 5.989 0.063 7.632 1.00 0.00 C ATOM 1385 O THR A 797 6.933 0.385 8.322 1.00 0.00 O ATOM 1386 CB THR A 797 3.675 -0.352 8.545 1.00 0.00 C ATOM 1387 OG1 THR A 797 4.176 -0.665 9.835 1.00 0.00 O ATOM 1388 CG2 THR A 797 3.608 -1.625 7.702 1.00 0.00 C ATOM 0 H THR A 797 3.116 0.430 6.353 1.00 0.00 H new ATOM 0 HA THR A 797 4.751 1.552 8.488 1.00 0.00 H new ATOM 0 HB THR A 797 2.676 0.074 8.635 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.882 -1.341 9.757 1.00 0.00 H new ATOM 0 HG21 THR A 797 2.950 -2.347 8.185 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.220 -1.386 6.712 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.607 -2.052 7.607 1.00 0.00 H new ATOM 1396 N ASN A 798 6.129 -0.802 6.659 1.00 0.00 N ATOM 1397 CA ASN A 798 7.466 -1.417 6.396 1.00 0.00 C ATOM 1398 C ASN A 798 8.539 -0.333 6.274 1.00 0.00 C ATOM 1399 O ASN A 798 9.602 -0.425 6.863 1.00 0.00 O ATOM 1400 CB ASN A 798 7.314 -2.160 5.067 1.00 0.00 C ATOM 1401 CG ASN A 798 6.922 -3.617 5.331 1.00 0.00 C ATOM 1402 OD1 ASN A 798 7.254 -4.495 4.559 1.00 0.00 O ATOM 1403 ND2 ASN A 798 6.225 -3.915 6.394 1.00 0.00 N ATOM 0 H ASN A 798 5.380 -1.108 6.038 1.00 0.00 H new ATOM 0 HA ASN A 798 7.772 -2.081 7.204 1.00 0.00 H new ATOM 0 HB2 ASN A 798 6.555 -1.675 4.453 1.00 0.00 H new ATOM 0 HB3 ASN A 798 8.249 -2.121 4.508 1.00 0.00 H new ATOM 0 HD21 ASN A 798 5.960 -4.883 6.575 1.00 0.00 H new ATOM 0 HD22 ASN A 798 5.945 -3.180 7.043 1.00 0.00 H new ATOM 1410 N CYS A 799 8.281 0.682 5.494 1.00 0.00 N ATOM 1411 CA CYS A 799 9.274 1.783 5.372 1.00 0.00 C ATOM 1412 C CYS A 799 9.436 2.429 6.738 1.00 0.00 C ATOM 1413 O CYS A 799 10.506 2.456 7.311 1.00 0.00 O ATOM 1414 CB CYS A 799 8.661 2.768 4.375 1.00 0.00 C ATOM 1415 SG CYS A 799 9.916 3.266 3.169 1.00 0.00 S ATOM 0 H CYS A 799 7.432 0.795 4.941 1.00 0.00 H new ATOM 0 HA CYS A 799 10.255 1.447 5.036 1.00 0.00 H new ATOM 0 HB2 CYS A 799 7.815 2.307 3.866 1.00 0.00 H new ATOM 0 HB3 CYS A 799 8.279 3.643 4.900 1.00 0.00 H new ATOM 0 HG CYS A 799 9.496 2.996 1.969 1.00 0.00 H new ATOM 1421 N LYS A 800 8.346 2.856 7.298 1.00 0.00 N ATOM 1422 CA LYS A 800 8.372 3.441 8.659 1.00 0.00 C ATOM 1423 C LYS A 800 9.041 2.476 9.647 1.00 0.00 C ATOM 1424 O LYS A 800 9.496 2.872 10.702 1.00 0.00 O ATOM 1425 CB LYS A 800 6.893 3.607 8.999 1.00 0.00 C ATOM 1426 CG LYS A 800 6.486 5.063 8.786 1.00 0.00 C ATOM 1427 CD LYS A 800 4.967 5.152 8.637 1.00 0.00 C ATOM 1428 CE LYS A 800 4.390 5.977 9.787 1.00 0.00 C ATOM 1429 NZ LYS A 800 3.275 5.149 10.328 1.00 0.00 N ATOM 0 H LYS A 800 7.424 2.824 6.863 1.00 0.00 H new ATOM 0 HA LYS A 800 8.933 4.374 8.712 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.288 2.953 8.371 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.711 3.314 10.033 1.00 0.00 H new ATOM 0 HG2 LYS A 800 6.815 5.671 9.629 1.00 0.00 H new ATOM 0 HG3 LYS A 800 6.973 5.461 7.896 1.00 0.00 H new ATOM 0 HD2 LYS A 800 4.711 5.611 7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.532 4.153 8.638 1.00 0.00 H new ATOM 0 HE2 LYS A 800 5.143 6.173 10.550 1.00 0.00 H new ATOM 0 HE3 LYS A 800 4.031 6.945 9.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 2.826 5.648 11.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 2.571 4.984 9.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 3.649 4.236 10.658 1.00 0.00 H new ATOM 1443 N GLU A 801 9.103 1.212 9.313 1.00 0.00 N ATOM 1444 CA GLU A 801 9.704 0.218 10.249 1.00 0.00 C ATOM 1445 C GLU A 801 11.234 0.283 10.238 1.00 0.00 C ATOM 1446 O GLU A 801 11.855 0.505 11.258 1.00 0.00 O ATOM 1447 CB GLU A 801 9.239 -1.145 9.732 1.00 0.00 C ATOM 1448 CG GLU A 801 8.739 -1.990 10.905 1.00 0.00 C ATOM 1449 CD GLU A 801 7.659 -2.956 10.414 1.00 0.00 C ATOM 1450 OE1 GLU A 801 8.017 -4.000 9.895 1.00 0.00 O ATOM 1451 OE2 GLU A 801 6.492 -2.636 10.568 1.00 0.00 O ATOM 0 H GLU A 801 8.763 0.827 8.432 1.00 0.00 H new ATOM 0 HA GLU A 801 9.395 0.410 11.276 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.444 -1.016 8.998 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.060 -1.654 9.227 1.00 0.00 H new ATOM 0 HG2 GLU A 801 9.567 -2.546 11.345 1.00 0.00 H new ATOM 0 HG3 GLU A 801 8.337 -1.345 11.686 1.00 0.00 H new ATOM 1458 N TYR A 802 11.855 0.037 9.113 1.00 0.00 N ATOM 1459 CA TYR A 802 13.349 0.031 9.092 1.00 0.00 C ATOM 1460 C TYR A 802 13.912 1.440 8.899 1.00 0.00 C ATOM 1461 O TYR A 802 15.086 1.676 9.104 1.00 0.00 O ATOM 1462 CB TYR A 802 13.744 -0.877 7.921 1.00 0.00 C ATOM 1463 CG TYR A 802 13.251 -0.306 6.612 1.00 0.00 C ATOM 1464 CD1 TYR A 802 13.877 0.815 6.054 1.00 0.00 C ATOM 1465 CD2 TYR A 802 12.206 -0.937 5.926 1.00 0.00 C ATOM 1466 CE1 TYR A 802 13.432 1.329 4.830 1.00 0.00 C ATOM 1467 CE2 TYR A 802 11.764 -0.428 4.700 1.00 0.00 C ATOM 1468 CZ TYR A 802 12.376 0.706 4.150 1.00 0.00 C ATOM 1469 OH TYR A 802 11.932 1.210 2.941 1.00 0.00 O ATOM 0 H TYR A 802 11.401 -0.157 8.221 1.00 0.00 H new ATOM 0 HA TYR A 802 13.753 -0.329 10.038 1.00 0.00 H new ATOM 0 HB2 TYR A 802 14.828 -0.988 7.890 1.00 0.00 H new ATOM 0 HB3 TYR A 802 13.326 -1.873 8.069 1.00 0.00 H new ATOM 0 HD1 TYR A 802 14.703 1.283 6.568 1.00 0.00 H new ATOM 0 HD2 TYR A 802 11.741 -1.818 6.344 1.00 0.00 H new ATOM 0 HE1 TYR A 802 13.902 2.206 4.410 1.00 0.00 H new ATOM 0 HE2 TYR A 802 10.951 -0.909 4.177 1.00 0.00 H new ATOM 0 HH TYR A 802 11.062 1.643 3.067 1.00 0.00 H new ATOM 1479 N ASN A 803 13.097 2.378 8.511 1.00 0.00 N ATOM 1480 CA ASN A 803 13.609 3.764 8.324 1.00 0.00 C ATOM 1481 C ASN A 803 13.471 4.560 9.633 1.00 0.00 C ATOM 1482 O ASN A 803 12.472 4.448 10.315 1.00 0.00 O ATOM 1483 CB ASN A 803 12.727 4.362 7.228 1.00 0.00 C ATOM 1484 CG ASN A 803 13.076 5.833 7.040 1.00 0.00 C ATOM 1485 OD1 ASN A 803 13.948 6.164 6.264 1.00 0.00 O ATOM 1486 ND2 ASN A 803 12.428 6.730 7.724 1.00 0.00 N ATOM 0 H ASN A 803 12.104 2.248 8.316 1.00 0.00 H new ATOM 0 HA ASN A 803 14.664 3.787 8.053 1.00 0.00 H new ATOM 0 HB2 ASN A 803 12.873 3.820 6.293 1.00 0.00 H new ATOM 0 HB3 ASN A 803 11.676 4.258 7.496 1.00 0.00 H new ATOM 0 HD21 ASN A 803 12.652 7.719 7.610 1.00 0.00 H new ATOM 0 HD22 ASN A 803 11.696 6.445 8.375 1.00 0.00 H new ATOM 1493 N PRO A 804 14.479 5.342 9.945 1.00 0.00 N ATOM 1494 CA PRO A 804 14.452 6.143 11.196 1.00 0.00 C ATOM 1495 C PRO A 804 13.344 7.204 11.142 1.00 0.00 C ATOM 1496 O PRO A 804 12.691 7.361 10.133 1.00 0.00 O ATOM 1497 CB PRO A 804 15.829 6.811 11.241 1.00 0.00 C ATOM 1498 CG PRO A 804 16.362 6.731 9.845 1.00 0.00 C ATOM 1499 CD PRO A 804 15.726 5.535 9.193 1.00 0.00 C ATOM 0 HA PRO A 804 14.249 5.532 12.076 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.751 7.847 11.572 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.489 6.301 11.942 1.00 0.00 H new ATOM 0 HG2 PRO A 804 16.128 7.640 9.291 1.00 0.00 H new ATOM 0 HG3 PRO A 804 17.448 6.633 9.853 1.00 0.00 H new ATOM 0 HD2 PRO A 804 15.531 5.713 8.136 1.00 0.00 H new ATOM 0 HD3 PRO A 804 16.369 4.657 9.255 1.00 0.00 H new ATOM 1507 N PRO A 805 13.173 7.913 12.233 1.00 0.00 N ATOM 1508 CA PRO A 805 12.115 8.950 12.294 1.00 0.00 C ATOM 1509 C PRO A 805 12.428 10.114 11.347 1.00 0.00 C ATOM 1510 O PRO A 805 11.548 10.849 10.946 1.00 0.00 O ATOM 1511 CB PRO A 805 12.131 9.428 13.745 1.00 0.00 C ATOM 1512 CG PRO A 805 13.418 8.941 14.330 1.00 0.00 C ATOM 1513 CD PRO A 805 13.900 7.781 13.500 1.00 0.00 C ATOM 0 HA PRO A 805 11.144 8.560 11.990 1.00 0.00 H new ATOM 0 HB2 PRO A 805 12.066 10.515 13.798 1.00 0.00 H new ATOM 0 HB3 PRO A 805 11.278 9.031 14.295 1.00 0.00 H new ATOM 0 HG2 PRO A 805 14.160 9.740 14.335 1.00 0.00 H new ATOM 0 HG3 PRO A 805 13.273 8.634 15.366 1.00 0.00 H new ATOM 0 HD2 PRO A 805 14.978 7.823 13.346 1.00 0.00 H new ATOM 0 HD3 PRO A 805 13.684 6.829 13.985 1.00 0.00 H new ATOM 1521 N GLU A 806 13.673 10.299 10.997 1.00 0.00 N ATOM 1522 CA GLU A 806 14.033 11.430 10.092 1.00 0.00 C ATOM 1523 C GLU A 806 14.626 10.908 8.782 1.00 0.00 C ATOM 1524 O GLU A 806 15.801 10.615 8.693 1.00 0.00 O ATOM 1525 CB GLU A 806 15.082 12.232 10.866 1.00 0.00 C ATOM 1526 CG GLU A 806 14.389 13.322 11.687 1.00 0.00 C ATOM 1527 CD GLU A 806 15.445 14.231 12.320 1.00 0.00 C ATOM 1528 OE1 GLU A 806 16.231 14.798 11.580 1.00 0.00 O ATOM 1529 OE2 GLU A 806 15.448 14.345 13.535 1.00 0.00 O ATOM 0 H GLU A 806 14.455 9.717 11.298 1.00 0.00 H new ATOM 0 HA GLU A 806 13.164 12.031 9.825 1.00 0.00 H new ATOM 0 HB2 GLU A 806 15.648 11.572 11.523 1.00 0.00 H new ATOM 0 HB3 GLU A 806 15.795 12.681 10.174 1.00 0.00 H new ATOM 0 HG2 GLU A 806 13.725 13.906 11.049 1.00 0.00 H new ATOM 0 HG3 GLU A 806 13.770 12.870 12.462 1.00 0.00 H new ATOM 1536 N SER A 807 13.819 10.798 7.762 1.00 0.00 N ATOM 1537 CA SER A 807 14.329 10.304 6.447 1.00 0.00 C ATOM 1538 C SER A 807 13.295 10.568 5.354 1.00 0.00 C ATOM 1539 O SER A 807 12.113 10.659 5.616 1.00 0.00 O ATOM 1540 CB SER A 807 14.532 8.792 6.604 1.00 0.00 C ATOM 1541 OG SER A 807 14.318 8.393 7.953 1.00 0.00 O ATOM 0 H SER A 807 12.826 11.029 7.781 1.00 0.00 H new ATOM 0 HA SER A 807 15.254 10.808 6.168 1.00 0.00 H new ATOM 0 HB2 SER A 807 13.845 8.258 5.948 1.00 0.00 H new ATOM 0 HB3 SER A 807 15.542 8.522 6.295 1.00 0.00 H new ATOM 0 HG SER A 807 14.746 7.525 8.109 1.00 0.00 H new ATOM 1547 N GLU A 808 13.723 10.656 4.126 1.00 0.00 N ATOM 1548 CA GLU A 808 12.756 10.888 3.018 1.00 0.00 C ATOM 1549 C GLU A 808 11.862 9.660 2.835 1.00 0.00 C ATOM 1550 O GLU A 808 10.703 9.769 2.486 1.00 0.00 O ATOM 1551 CB GLU A 808 13.624 11.104 1.779 1.00 0.00 C ATOM 1552 CG GLU A 808 13.620 12.589 1.409 1.00 0.00 C ATOM 1553 CD GLU A 808 14.302 12.779 0.053 1.00 0.00 C ATOM 1554 OE1 GLU A 808 15.509 12.956 0.039 1.00 0.00 O ATOM 1555 OE2 GLU A 808 13.605 12.747 -0.948 1.00 0.00 O ATOM 0 H GLU A 808 14.699 10.577 3.842 1.00 0.00 H new ATOM 0 HA GLU A 808 12.099 11.736 3.211 1.00 0.00 H new ATOM 0 HB2 GLU A 808 14.643 10.769 1.972 1.00 0.00 H new ATOM 0 HB3 GLU A 808 13.245 10.510 0.948 1.00 0.00 H new ATOM 0 HG2 GLU A 808 12.597 12.962 1.369 1.00 0.00 H new ATOM 0 HG3 GLU A 808 14.140 13.167 2.173 1.00 0.00 H new ATOM 1562 N TYR A 809 12.394 8.490 3.069 1.00 0.00 N ATOM 1563 CA TYR A 809 11.574 7.254 2.920 1.00 0.00 C ATOM 1564 C TYR A 809 10.311 7.362 3.776 1.00 0.00 C ATOM 1565 O TYR A 809 9.215 7.100 3.322 1.00 0.00 O ATOM 1566 CB TYR A 809 12.467 6.118 3.430 1.00 0.00 C ATOM 1567 CG TYR A 809 13.718 6.026 2.586 1.00 0.00 C ATOM 1568 CD1 TYR A 809 13.696 5.323 1.376 1.00 0.00 C ATOM 1569 CD2 TYR A 809 14.907 6.621 3.028 1.00 0.00 C ATOM 1570 CE1 TYR A 809 14.857 5.233 0.597 1.00 0.00 C ATOM 1571 CE2 TYR A 809 16.067 6.531 2.249 1.00 0.00 C ATOM 1572 CZ TYR A 809 16.042 5.837 1.034 1.00 0.00 C ATOM 1573 OH TYR A 809 17.186 5.746 0.268 1.00 0.00 O ATOM 0 H TYR A 809 13.361 8.337 3.357 1.00 0.00 H new ATOM 0 HA TYR A 809 11.255 7.090 1.891 1.00 0.00 H new ATOM 0 HB2 TYR A 809 12.733 6.294 4.472 1.00 0.00 H new ATOM 0 HB3 TYR A 809 11.924 5.174 3.395 1.00 0.00 H new ATOM 0 HD1 TYR A 809 12.784 4.850 1.043 1.00 0.00 H new ATOM 0 HD2 TYR A 809 14.929 7.149 3.970 1.00 0.00 H new ATOM 0 HE1 TYR A 809 14.838 4.698 -0.341 1.00 0.00 H new ATOM 0 HE2 TYR A 809 16.981 6.997 2.586 1.00 0.00 H new ATOM 0 HH TYR A 809 17.918 6.221 0.715 1.00 0.00 H new ATOM 1583 N TYR A 810 10.454 7.750 5.013 1.00 0.00 N ATOM 1584 CA TYR A 810 9.260 7.895 5.890 1.00 0.00 C ATOM 1585 C TYR A 810 8.369 9.024 5.358 1.00 0.00 C ATOM 1586 O TYR A 810 7.176 8.863 5.212 1.00 0.00 O ATOM 1587 CB TYR A 810 9.842 8.218 7.280 1.00 0.00 C ATOM 1588 CG TYR A 810 8.815 8.904 8.161 1.00 0.00 C ATOM 1589 CD1 TYR A 810 7.956 8.141 8.961 1.00 0.00 C ATOM 1590 CD2 TYR A 810 8.733 10.301 8.180 1.00 0.00 C ATOM 1591 CE1 TYR A 810 7.011 8.776 9.777 1.00 0.00 C ATOM 1592 CE2 TYR A 810 7.788 10.936 8.996 1.00 0.00 C ATOM 1593 CZ TYR A 810 6.928 10.173 9.794 1.00 0.00 C ATOM 1594 OH TYR A 810 5.997 10.799 10.598 1.00 0.00 O ATOM 0 H TYR A 810 11.346 7.973 5.454 1.00 0.00 H new ATOM 0 HA TYR A 810 8.632 7.005 5.926 1.00 0.00 H new ATOM 0 HB2 TYR A 810 10.179 7.298 7.758 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.717 8.859 7.170 1.00 0.00 H new ATOM 0 HD1 TYR A 810 8.022 7.063 8.949 1.00 0.00 H new ATOM 0 HD2 TYR A 810 9.398 10.889 7.566 1.00 0.00 H new ATOM 0 HE1 TYR A 810 6.347 8.188 10.393 1.00 0.00 H new ATOM 0 HE2 TYR A 810 7.723 12.014 9.009 1.00 0.00 H new ATOM 0 HH TYR A 810 5.094 10.568 10.294 1.00 0.00 H new ATOM 1604 N LYS A 811 8.945 10.157 5.047 1.00 0.00 N ATOM 1605 CA LYS A 811 8.133 11.293 4.514 1.00 0.00 C ATOM 1606 C LYS A 811 7.200 10.812 3.395 1.00 0.00 C ATOM 1607 O LYS A 811 6.007 10.684 3.586 1.00 0.00 O ATOM 1608 CB LYS A 811 9.161 12.283 3.963 1.00 0.00 C ATOM 1609 CG LYS A 811 10.052 12.780 5.103 1.00 0.00 C ATOM 1610 CD LYS A 811 10.034 14.309 5.140 1.00 0.00 C ATOM 1611 CE LYS A 811 11.459 14.827 5.341 1.00 0.00 C ATOM 1612 NZ LYS A 811 12.159 14.521 4.061 1.00 0.00 N ATOM 0 H LYS A 811 9.943 10.345 5.139 1.00 0.00 H new ATOM 0 HA LYS A 811 7.498 11.739 5.280 1.00 0.00 H new ATOM 0 HB2 LYS A 811 9.768 11.804 3.195 1.00 0.00 H new ATOM 0 HB3 LYS A 811 8.654 13.124 3.490 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.701 12.379 6.054 1.00 0.00 H new ATOM 0 HG3 LYS A 811 11.072 12.422 4.963 1.00 0.00 H new ATOM 0 HD2 LYS A 811 9.620 14.702 4.211 1.00 0.00 H new ATOM 0 HD3 LYS A 811 9.391 14.657 5.948 1.00 0.00 H new ATOM 0 HE2 LYS A 811 11.465 15.897 5.549 1.00 0.00 H new ATOM 0 HE3 LYS A 811 11.944 14.335 6.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 12.855 13.764 4.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 11.465 14.211 3.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 12.646 15.374 3.719 1.00 0.00 H new ATOM 1626 N CYS A 812 7.734 10.509 2.241 1.00 0.00 N ATOM 1627 CA CYS A 812 6.869 10.030 1.125 1.00 0.00 C ATOM 1628 C CYS A 812 5.958 8.888 1.592 1.00 0.00 C ATOM 1629 O CYS A 812 4.829 8.771 1.159 1.00 0.00 O ATOM 1630 CB CYS A 812 7.843 9.535 0.050 1.00 0.00 C ATOM 1631 SG CYS A 812 8.950 8.286 0.749 1.00 0.00 S ATOM 0 H CYS A 812 8.729 10.572 2.024 1.00 0.00 H new ATOM 0 HA CYS A 812 6.213 10.818 0.754 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.289 9.114 -0.789 1.00 0.00 H new ATOM 0 HB3 CYS A 812 8.424 10.371 -0.339 1.00 0.00 H new ATOM 0 HG CYS A 812 10.055 8.253 0.065 1.00 0.00 H new ATOM 1637 N ALA A 813 6.429 8.049 2.475 1.00 0.00 N ATOM 1638 CA ALA A 813 5.572 6.925 2.956 1.00 0.00 C ATOM 1639 C ALA A 813 4.435 7.459 3.832 1.00 0.00 C ATOM 1640 O ALA A 813 3.346 6.921 3.847 1.00 0.00 O ATOM 1641 CB ALA A 813 6.505 6.034 3.779 1.00 0.00 C ATOM 0 H ALA A 813 7.363 8.092 2.882 1.00 0.00 H new ATOM 0 HA ALA A 813 5.110 6.382 2.132 1.00 0.00 H new ATOM 0 HB1 ALA A 813 5.946 5.183 4.168 1.00 0.00 H new ATOM 0 HB2 ALA A 813 7.318 5.676 3.147 1.00 0.00 H new ATOM 0 HB3 ALA A 813 6.917 6.607 4.609 1.00 0.00 H new ATOM 1647 N ASN A 814 4.680 8.512 4.563 1.00 0.00 N ATOM 1648 CA ASN A 814 3.612 9.085 5.428 1.00 0.00 C ATOM 1649 C ASN A 814 2.672 9.952 4.590 1.00 0.00 C ATOM 1650 O ASN A 814 1.492 10.052 4.863 1.00 0.00 O ATOM 1651 CB ASN A 814 4.354 9.942 6.455 1.00 0.00 C ATOM 1652 CG ASN A 814 3.588 9.928 7.779 1.00 0.00 C ATOM 1653 OD1 ASN A 814 4.054 9.380 8.759 1.00 0.00 O ATOM 1654 ND2 ASN A 814 2.422 10.510 7.850 1.00 0.00 N ATOM 0 H ASN A 814 5.575 9.000 4.598 1.00 0.00 H new ATOM 0 HA ASN A 814 3.003 8.315 5.902 1.00 0.00 H new ATOM 0 HB2 ASN A 814 5.364 9.559 6.603 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.451 10.964 6.089 1.00 0.00 H new ATOM 0 HD21 ASN A 814 1.902 10.505 8.728 1.00 0.00 H new ATOM 0 HD22 ASN A 814 2.031 10.970 7.028 1.00 0.00 H new ATOM 1661 N ILE A 815 3.188 10.578 3.568 1.00 0.00 N ATOM 1662 CA ILE A 815 2.325 11.424 2.699 1.00 0.00 C ATOM 1663 C ILE A 815 1.411 10.533 1.859 1.00 0.00 C ATOM 1664 O ILE A 815 0.203 10.669 1.880 1.00 0.00 O ATOM 1665 CB ILE A 815 3.300 12.190 1.803 1.00 0.00 C ATOM 1666 CG1 ILE A 815 4.153 13.127 2.663 1.00 0.00 C ATOM 1667 CG2 ILE A 815 2.515 13.012 0.779 1.00 0.00 C ATOM 1668 CD1 ILE A 815 5.403 13.538 1.881 1.00 0.00 C ATOM 0 H ILE A 815 4.171 10.540 3.298 1.00 0.00 H new ATOM 0 HA ILE A 815 1.685 12.097 3.269 1.00 0.00 H new ATOM 0 HB ILE A 815 3.947 11.484 1.282 1.00 0.00 H new ATOM 0 HG12 ILE A 815 3.577 14.010 2.939 1.00 0.00 H new ATOM 0 HG13 ILE A 815 4.438 12.629 3.590 1.00 0.00 H new ATOM 0 HG21 ILE A 815 3.210 13.558 0.141 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.907 12.346 0.167 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.868 13.719 1.299 1.00 0.00 H new ATOM 0 HD11 ILE A 815 6.011 14.205 2.492 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.982 12.650 1.627 1.00 0.00 H new ATOM 0 HD13 ILE A 815 5.107 14.052 0.966 1.00 0.00 H new ATOM 1680 N LEU A 816 1.977 9.606 1.135 1.00 0.00 N ATOM 1681 CA LEU A 816 1.138 8.685 0.323 1.00 0.00 C ATOM 1682 C LEU A 816 0.228 7.876 1.247 1.00 0.00 C ATOM 1683 O LEU A 816 -0.931 7.662 0.960 1.00 0.00 O ATOM 1684 CB LEU A 816 2.143 7.775 -0.399 1.00 0.00 C ATOM 1685 CG LEU A 816 1.424 6.582 -1.034 1.00 0.00 C ATOM 1686 CD1 LEU A 816 0.362 7.090 -2.002 1.00 0.00 C ATOM 1687 CD2 LEU A 816 2.439 5.720 -1.789 1.00 0.00 C ATOM 0 H LEU A 816 2.983 9.448 1.072 1.00 0.00 H new ATOM 0 HA LEU A 816 0.492 9.206 -0.383 1.00 0.00 H new ATOM 0 HB2 LEU A 816 2.669 8.341 -1.167 1.00 0.00 H new ATOM 0 HB3 LEU A 816 2.895 7.421 0.307 1.00 0.00 H new ATOM 0 HG LEU A 816 0.949 5.983 -0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 816 -0.152 6.243 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 816 -0.358 7.704 -1.462 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.836 7.687 -2.781 1.00 0.00 H new ATOM 0 HD21 LEU A 816 1.929 4.870 -2.242 1.00 0.00 H new ATOM 0 HD22 LEU A 816 2.914 6.316 -2.569 1.00 0.00 H new ATOM 0 HD23 LEU A 816 3.198 5.360 -1.095 1.00 0.00 H new ATOM 1699 N GLU A 817 0.744 7.426 2.358 1.00 0.00 N ATOM 1700 CA GLU A 817 -0.102 6.648 3.301 1.00 0.00 C ATOM 1701 C GLU A 817 -1.312 7.486 3.716 1.00 0.00 C ATOM 1702 O GLU A 817 -2.422 6.998 3.794 1.00 0.00 O ATOM 1703 CB GLU A 817 0.812 6.342 4.494 1.00 0.00 C ATOM 1704 CG GLU A 817 -0.005 5.721 5.629 1.00 0.00 C ATOM 1705 CD GLU A 817 -0.022 6.673 6.826 1.00 0.00 C ATOM 1706 OE1 GLU A 817 -0.268 7.850 6.619 1.00 0.00 O ATOM 1707 OE2 GLU A 817 0.213 6.209 7.930 1.00 0.00 O ATOM 0 H GLU A 817 1.711 7.564 2.651 1.00 0.00 H new ATOM 0 HA GLU A 817 -0.495 5.730 2.864 1.00 0.00 H new ATOM 0 HB2 GLU A 817 1.606 5.660 4.190 1.00 0.00 H new ATOM 0 HB3 GLU A 817 1.293 7.257 4.839 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.023 5.524 5.293 1.00 0.00 H new ATOM 0 HG3 GLU A 817 0.426 4.763 5.919 1.00 0.00 H new ATOM 1714 N LYS A 818 -1.112 8.753 3.940 1.00 0.00 N ATOM 1715 CA LYS A 818 -2.262 9.641 4.263 1.00 0.00 C ATOM 1716 C LYS A 818 -3.237 9.621 3.081 1.00 0.00 C ATOM 1717 O LYS A 818 -4.427 9.433 3.241 1.00 0.00 O ATOM 1718 CB LYS A 818 -1.640 11.025 4.459 1.00 0.00 C ATOM 1719 CG LYS A 818 -2.717 12.114 4.429 1.00 0.00 C ATOM 1720 CD LYS A 818 -3.550 12.049 5.709 1.00 0.00 C ATOM 1721 CE LYS A 818 -3.456 13.391 6.433 1.00 0.00 C ATOM 1722 NZ LYS A 818 -4.227 14.339 5.578 1.00 0.00 N ATOM 0 H LYS A 818 -0.202 9.213 3.914 1.00 0.00 H new ATOM 0 HA LYS A 818 -2.821 9.337 5.148 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.109 11.059 5.410 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.905 11.213 3.676 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.253 13.096 4.335 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.359 11.980 3.558 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -4.589 11.822 5.471 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -3.188 11.248 6.353 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -3.878 13.330 7.436 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -2.419 13.710 6.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -4.673 15.063 6.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.584 14.797 4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -4.963 13.819 5.059 1.00 0.00 H new ATOM 1736 N PHE A 819 -2.726 9.796 1.892 1.00 0.00 N ATOM 1737 CA PHE A 819 -3.596 9.764 0.684 1.00 0.00 C ATOM 1738 C PHE A 819 -4.321 8.419 0.598 1.00 0.00 C ATOM 1739 O PHE A 819 -5.496 8.352 0.297 1.00 0.00 O ATOM 1740 CB PHE A 819 -2.624 9.926 -0.491 1.00 0.00 C ATOM 1741 CG PHE A 819 -3.357 9.740 -1.801 1.00 0.00 C ATOM 1742 CD1 PHE A 819 -3.548 8.453 -2.317 1.00 0.00 C ATOM 1743 CD2 PHE A 819 -3.837 10.853 -2.502 1.00 0.00 C ATOM 1744 CE1 PHE A 819 -4.223 8.277 -3.531 1.00 0.00 C ATOM 1745 CE2 PHE A 819 -4.512 10.678 -3.716 1.00 0.00 C ATOM 1746 CZ PHE A 819 -4.705 9.389 -4.231 1.00 0.00 C ATOM 0 H PHE A 819 -1.737 9.961 1.706 1.00 0.00 H new ATOM 0 HA PHE A 819 -4.363 10.538 0.695 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -2.165 10.914 -0.459 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -1.818 9.197 -0.410 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -3.174 7.595 -1.778 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -3.687 11.847 -2.106 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -4.372 7.283 -3.927 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -4.884 11.536 -4.256 1.00 0.00 H new ATOM 0 HZ PHE A 819 -5.225 9.254 -5.168 1.00 0.00 H new ATOM 1756 N PHE A 820 -3.623 7.347 0.853 1.00 0.00 N ATOM 1757 CA PHE A 820 -4.264 6.008 0.780 1.00 0.00 C ATOM 1758 C PHE A 820 -5.439 5.927 1.753 1.00 0.00 C ATOM 1759 O PHE A 820 -6.573 5.773 1.351 1.00 0.00 O ATOM 1760 CB PHE A 820 -3.170 5.018 1.188 1.00 0.00 C ATOM 1761 CG PHE A 820 -3.712 3.615 1.071 1.00 0.00 C ATOM 1762 CD1 PHE A 820 -4.170 3.144 -0.164 1.00 0.00 C ATOM 1763 CD2 PHE A 820 -3.788 2.797 2.204 1.00 0.00 C ATOM 1764 CE1 PHE A 820 -4.687 1.849 -0.270 1.00 0.00 C ATOM 1765 CE2 PHE A 820 -4.302 1.499 2.098 1.00 0.00 C ATOM 1766 CZ PHE A 820 -4.751 1.024 0.860 1.00 0.00 C ATOM 0 H PHE A 820 -2.636 7.342 1.109 1.00 0.00 H new ATOM 0 HA PHE A 820 -4.657 5.798 -0.215 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -2.295 5.139 0.549 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -2.847 5.213 2.211 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -4.124 3.780 -1.035 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -3.450 3.167 3.161 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -5.037 1.485 -1.224 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -4.352 0.865 2.971 1.00 0.00 H new ATOM 0 HZ PHE A 820 -5.146 0.022 0.776 1.00 0.00 H new ATOM 1776 N PHE A 821 -5.173 6.039 3.029 1.00 0.00 N ATOM 1777 CA PHE A 821 -6.269 5.954 4.043 1.00 0.00 C ATOM 1778 C PHE A 821 -7.466 6.817 3.636 1.00 0.00 C ATOM 1779 O PHE A 821 -8.599 6.386 3.699 1.00 0.00 O ATOM 1780 CB PHE A 821 -5.647 6.484 5.332 1.00 0.00 C ATOM 1781 CG PHE A 821 -4.962 5.353 6.061 1.00 0.00 C ATOM 1782 CD1 PHE A 821 -5.720 4.304 6.595 1.00 0.00 C ATOM 1783 CD2 PHE A 821 -3.569 5.350 6.199 1.00 0.00 C ATOM 1784 CE1 PHE A 821 -5.086 3.253 7.269 1.00 0.00 C ATOM 1785 CE2 PHE A 821 -2.935 4.300 6.873 1.00 0.00 C ATOM 1786 CZ PHE A 821 -3.693 3.252 7.408 1.00 0.00 C ATOM 0 H PHE A 821 -4.240 6.186 3.415 1.00 0.00 H new ATOM 0 HA PHE A 821 -6.646 4.937 4.147 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -4.929 7.272 5.105 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.416 6.926 5.965 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -6.795 4.305 6.487 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -2.984 6.158 5.785 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -5.671 2.444 7.681 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -1.860 4.298 6.980 1.00 0.00 H new ATOM 0 HZ PHE A 821 -3.203 2.442 7.928 1.00 0.00 H new ATOM 1796 N SER A 822 -7.226 8.030 3.223 1.00 0.00 N ATOM 1797 CA SER A 822 -8.355 8.904 2.802 1.00 0.00 C ATOM 1798 C SER A 822 -9.128 8.244 1.661 1.00 0.00 C ATOM 1799 O SER A 822 -10.306 7.965 1.774 1.00 0.00 O ATOM 1800 CB SER A 822 -7.694 10.196 2.319 1.00 0.00 C ATOM 1801 OG SER A 822 -7.420 11.034 3.432 1.00 0.00 O ATOM 0 H SER A 822 -6.300 8.453 3.159 1.00 0.00 H new ATOM 0 HA SER A 822 -9.064 9.085 3.610 1.00 0.00 H new ATOM 0 HB2 SER A 822 -6.771 9.967 1.787 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.348 10.711 1.615 1.00 0.00 H new ATOM 0 HG SER A 822 -6.995 11.861 3.122 1.00 0.00 H new ATOM 1807 N LYS A 823 -8.463 7.971 0.570 1.00 0.00 N ATOM 1808 CA LYS A 823 -9.142 7.320 -0.588 1.00 0.00 C ATOM 1809 C LYS A 823 -9.978 6.121 -0.127 1.00 0.00 C ATOM 1810 O LYS A 823 -11.168 6.057 -0.367 1.00 0.00 O ATOM 1811 CB LYS A 823 -7.999 6.850 -1.489 1.00 0.00 C ATOM 1812 CG LYS A 823 -8.569 6.121 -2.709 1.00 0.00 C ATOM 1813 CD LYS A 823 -8.801 7.123 -3.839 1.00 0.00 C ATOM 1814 CE LYS A 823 -7.460 7.510 -4.467 1.00 0.00 C ATOM 1815 NZ LYS A 823 -6.824 6.221 -4.870 1.00 0.00 N ATOM 0 H LYS A 823 -7.473 8.172 0.431 1.00 0.00 H new ATOM 0 HA LYS A 823 -9.826 8.000 -1.096 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -7.402 7.703 -1.810 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -7.335 6.187 -0.934 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.880 5.342 -3.035 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -9.506 5.629 -2.447 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -9.456 6.689 -4.595 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -9.303 8.011 -3.454 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -7.603 8.163 -5.328 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -6.835 8.051 -3.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -6.358 6.337 -5.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -6.118 5.945 -4.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -7.552 5.482 -4.941 1.00 0.00 H new ATOM 1829 N ILE A 824 -9.368 5.166 0.523 1.00 0.00 N ATOM 1830 CA ILE A 824 -10.142 3.979 0.980 1.00 0.00 C ATOM 1831 C ILE A 824 -11.237 4.409 1.957 1.00 0.00 C ATOM 1832 O ILE A 824 -12.363 3.960 1.876 1.00 0.00 O ATOM 1833 CB ILE A 824 -9.118 3.058 1.657 1.00 0.00 C ATOM 1834 CG1 ILE A 824 -8.481 3.751 2.865 1.00 0.00 C ATOM 1835 CG2 ILE A 824 -8.024 2.700 0.648 1.00 0.00 C ATOM 1836 CD1 ILE A 824 -7.483 2.793 3.519 1.00 0.00 C ATOM 0 H ILE A 824 -8.375 5.157 0.755 1.00 0.00 H new ATOM 0 HA ILE A 824 -10.643 3.470 0.157 1.00 0.00 H new ATOM 0 HB ILE A 824 -9.628 2.157 2.000 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -7.976 4.665 2.552 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.250 4.041 3.581 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -7.292 2.046 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -8.469 2.189 -0.205 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -7.530 3.610 0.308 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -7.024 3.278 4.381 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -8.003 1.892 3.844 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -6.710 2.526 2.799 1.00 0.00 H new ATOM 1848 N LYS A 825 -10.935 5.316 2.846 1.00 0.00 N ATOM 1849 CA LYS A 825 -11.974 5.798 3.801 1.00 0.00 C ATOM 1850 C LYS A 825 -13.229 6.226 3.037 1.00 0.00 C ATOM 1851 O LYS A 825 -14.336 6.122 3.527 1.00 0.00 O ATOM 1852 CB LYS A 825 -11.341 7.008 4.488 1.00 0.00 C ATOM 1853 CG LYS A 825 -10.793 6.594 5.855 1.00 0.00 C ATOM 1854 CD LYS A 825 -10.911 7.770 6.829 1.00 0.00 C ATOM 1855 CE LYS A 825 -10.143 8.972 6.274 1.00 0.00 C ATOM 1856 NZ LYS A 825 -9.773 9.777 7.471 1.00 0.00 N ATOM 0 H LYS A 825 -10.015 5.744 2.952 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.273 5.028 4.512 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -10.538 7.411 3.870 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.081 7.800 4.606 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -11.346 5.735 6.236 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -9.751 6.287 5.763 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -11.959 8.031 6.975 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -10.513 7.490 7.804 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -9.258 8.655 5.722 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -10.758 9.550 5.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -9.243 10.620 7.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -10.636 10.070 7.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -9.182 9.203 8.106 1.00 0.00 H new ATOM 1870 N GLU A 826 -13.058 6.698 1.832 1.00 0.00 N ATOM 1871 CA GLU A 826 -14.230 7.138 1.025 1.00 0.00 C ATOM 1872 C GLU A 826 -14.834 5.955 0.262 1.00 0.00 C ATOM 1873 O GLU A 826 -16.008 5.940 -0.049 1.00 0.00 O ATOM 1874 CB GLU A 826 -13.661 8.165 0.046 1.00 0.00 C ATOM 1875 CG GLU A 826 -13.414 9.483 0.781 1.00 0.00 C ATOM 1876 CD GLU A 826 -14.688 10.329 0.751 1.00 0.00 C ATOM 1877 OE1 GLU A 826 -15.672 9.904 1.333 1.00 0.00 O ATOM 1878 OE2 GLU A 826 -14.659 11.386 0.142 1.00 0.00 O ATOM 0 H GLU A 826 -12.154 6.798 1.371 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.026 7.550 1.646 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -12.730 7.796 -0.385 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -14.355 8.321 -0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -13.119 9.287 1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -12.593 10.025 0.312 1.00 0.00 H new ATOM 1885 N ALA A 827 -14.039 4.966 -0.047 1.00 0.00 N ATOM 1886 CA ALA A 827 -14.567 3.791 -0.799 1.00 0.00 C ATOM 1887 C ALA A 827 -15.101 2.725 0.162 1.00 0.00 C ATOM 1888 O ALA A 827 -15.305 1.587 -0.213 1.00 0.00 O ATOM 1889 CB ALA A 827 -13.363 3.251 -1.574 1.00 0.00 C ATOM 0 H ALA A 827 -13.048 4.921 0.189 1.00 0.00 H new ATOM 0 HA ALA A 827 -15.395 4.064 -1.453 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -13.666 2.381 -2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -12.986 4.023 -2.244 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -12.579 2.963 -0.874 1.00 0.00 H new ATOM 1895 N GLY A 828 -15.334 3.081 1.397 1.00 0.00 N ATOM 1896 CA GLY A 828 -15.862 2.085 2.374 1.00 0.00 C ATOM 1897 C GLY A 828 -14.964 0.846 2.384 1.00 0.00 C ATOM 1898 O GLY A 828 -15.426 -0.268 2.541 1.00 0.00 O ATOM 0 H GLY A 828 -15.182 4.018 1.771 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -15.902 2.525 3.371 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -16.881 1.805 2.108 1.00 0.00 H new ATOM 1902 N LEU A 829 -13.685 1.031 2.217 1.00 0.00 N ATOM 1903 CA LEU A 829 -12.755 -0.131 2.220 1.00 0.00 C ATOM 1904 C LEU A 829 -12.163 -0.324 3.627 1.00 0.00 C ATOM 1905 O LEU A 829 -12.876 -0.270 4.609 1.00 0.00 O ATOM 1906 CB LEU A 829 -11.674 0.246 1.201 1.00 0.00 C ATOM 1907 CG LEU A 829 -12.317 0.514 -0.163 1.00 0.00 C ATOM 1908 CD1 LEU A 829 -11.223 0.832 -1.185 1.00 0.00 C ATOM 1909 CD2 LEU A 829 -13.092 -0.724 -0.619 1.00 0.00 C ATOM 0 H LEU A 829 -13.243 1.940 2.078 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.241 -1.072 1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.135 1.131 1.539 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -10.944 -0.559 1.117 1.00 0.00 H new ATOM 0 HG LEU A 829 -13.001 1.359 -0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.678 1.023 -2.157 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.670 1.714 -0.863 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.541 -0.015 -1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.548 -0.530 -1.590 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -12.410 -1.570 -0.701 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -13.870 -0.954 0.108 1.00 0.00 H new ATOM 1921 N ILE A 830 -10.874 -0.548 3.738 1.00 0.00 N ATOM 1922 CA ILE A 830 -10.242 -0.748 5.081 1.00 0.00 C ATOM 1923 C ILE A 830 -10.835 -1.974 5.780 1.00 0.00 C ATOM 1924 O ILE A 830 -12.011 -2.260 5.673 1.00 0.00 O ATOM 1925 CB ILE A 830 -10.540 0.526 5.886 1.00 0.00 C ATOM 1926 CG1 ILE A 830 -10.149 1.759 5.067 1.00 0.00 C ATOM 1927 CG2 ILE A 830 -9.730 0.503 7.184 1.00 0.00 C ATOM 1928 CD1 ILE A 830 -11.383 2.631 4.835 1.00 0.00 C ATOM 0 H ILE A 830 -10.229 -0.601 2.950 1.00 0.00 H new ATOM 0 HA ILE A 830 -9.170 -0.921 4.991 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.605 0.568 6.115 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -9.382 2.329 5.592 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -9.722 1.454 4.112 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.938 1.405 7.759 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -10.007 -0.373 7.770 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.667 0.460 6.949 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -11.104 3.509 4.252 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -12.136 2.059 4.292 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -11.790 2.948 5.795 1.00 0.00 H new ATOM 1940 N ASP A 831 -10.022 -2.707 6.491 1.00 0.00 N ATOM 1941 CA ASP A 831 -10.528 -3.917 7.196 1.00 0.00 C ATOM 1942 C ASP A 831 -9.523 -4.367 8.258 1.00 0.00 C ATOM 1943 O ASP A 831 -9.882 -4.673 9.378 1.00 0.00 O ATOM 1944 CB ASP A 831 -10.659 -4.980 6.104 1.00 0.00 C ATOM 1945 CG ASP A 831 -11.308 -6.236 6.690 1.00 0.00 C ATOM 1946 OD1 ASP A 831 -10.949 -6.602 7.796 1.00 0.00 O ATOM 1947 OD2 ASP A 831 -12.153 -6.809 6.022 1.00 0.00 O ATOM 0 H ASP A 831 -9.027 -2.519 6.614 1.00 0.00 H new ATOM 0 HA ASP A 831 -11.473 -3.734 7.708 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -11.261 -4.598 5.280 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -9.677 -5.221 5.697 1.00 0.00 H new ATOM 1952 N LYS A 832 -8.264 -4.406 7.915 1.00 0.00 N ATOM 1953 CA LYS A 832 -7.235 -4.833 8.903 1.00 0.00 C ATOM 1954 C LYS A 832 -5.831 -4.558 8.361 1.00 0.00 C ATOM 1955 O LYS A 832 -5.561 -4.959 7.241 1.00 0.00 O ATOM 1956 CB LYS A 832 -7.455 -6.336 9.074 1.00 0.00 C ATOM 1957 CG LYS A 832 -6.993 -6.763 10.468 1.00 0.00 C ATOM 1958 CD LYS A 832 -5.545 -7.249 10.397 1.00 0.00 C ATOM 1959 CE LYS A 832 -4.765 -6.698 11.591 1.00 0.00 C ATOM 1960 NZ LYS A 832 -3.660 -5.901 10.990 1.00 0.00 N ATOM 1961 OXT LYS A 832 -5.031 -4.005 9.098 1.00 0.00 O ATOM 0 H LYS A 832 -7.904 -4.160 6.993 1.00 0.00 H new ATOM 0 HA LYS A 832 -7.321 -4.295 9.847 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -8.509 -6.578 8.939 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -6.902 -6.885 8.312 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -7.074 -5.926 11.162 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -7.636 -7.556 10.849 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -5.515 -8.339 10.401 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -5.085 -6.920 9.465 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -5.399 -6.079 12.226 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -4.378 -7.503 12.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -3.139 -5.407 11.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -3.012 -6.535 10.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -4.055 -5.204 10.327 1.00 0.00 H new TER 1975 LYS A 832 HETATM 1976 O1 MIB A 201 8.414 -3.399 2.651 1.00 0.00 O HETATM 1977 CO MIB A 201 9.008 -2.424 2.233 1.00 0.00 C HETATM 1978 CM MIB A 201 8.262 -1.106 2.021 1.00 0.00 C HETATM 1979 CA MIB A 201 10.355 -2.535 1.954 1.00 0.00 C HETATM 1980 CB MIB A 201 11.139 -1.504 1.476 1.00 0.00 C HETATM 1981 CG MIB A 201 12.569 -1.730 1.209 1.00 0.00 C HETATM 1982 CD1 MIB A 201 13.184 -2.934 1.239 1.00 0.00 C HETATM 1983 CD2 MIB A 201 13.597 -0.754 0.874 1.00 0.00 C HETATM 1984 NE1 MIB A 201 14.525 -2.762 0.939 1.00 0.00 N HETATM 1985 CN1 MIB A 201 15.517 -3.847 0.873 1.00 0.00 C HETATM 1986 CE2 MIB A 201 14.827 -1.434 0.708 1.00 0.00 C HETATM 1987 CE3 MIB A 201 13.583 0.642 0.700 1.00 0.00 C HETATM 1988 CZ2 MIB A 201 16.000 -0.754 0.379 1.00 0.00 C HETATM 1989 CZ3 MIB A 201 14.762 1.329 0.369 1.00 0.00 C HETATM 1990 CH2 MIB A 201 15.968 0.633 0.209 1.00 0.00 C HETATM 0 HZ3 MIB A 201 14.739 2.411 0.236 1.00 0.00 H new HETATM 0 HZ2 MIB A 201 16.935 -1.301 0.255 1.00 0.00 H new HETATM 0 HN3 MIB A 201 15.576 -4.345 1.841 1.00 0.00 H new HETATM 0 HN2 MIB A 201 15.218 -4.568 0.112 1.00 0.00 H new HETATM 0 HN1 MIB A 201 16.492 -3.433 0.618 1.00 0.00 H new HETATM 0 HM3 MIB A 201 7.459 -1.254 1.299 1.00 0.00 H new HETATM 0 HM2 MIB A 201 7.840 -0.770 2.968 1.00 0.00 H new HETATM 0 HM1 MIB A 201 8.954 -0.353 1.645 1.00 0.00 H new HETATM 0 HH2 MIB A 201 16.880 1.173 -0.048 1.00 0.00 H new HETATM 0 HE3 MIB A 201 12.651 1.194 0.823 1.00 0.00 H new HETATM 0 HD1 MIB A 201 12.702 -3.886 1.463 1.00 0.00 H new HETATM 0 HB MIB A 201 10.699 -0.523 1.296 1.00 0.00 H new HETATM 0 HA MIB A 201 10.832 -3.501 2.122 1.00 0.00 H new CONECT 1976 1977 CONECT 1977 1976 1978 1979 CONECT 1978 1977 1991 1992 1993 CONECT 1979 1977 1980 1994 CONECT 1980 1979 1981 1995 CONECT 1981 1980 1982 1983 CONECT 1982 1981 1984 1996 CONECT 1983 1981 1986 1987 CONECT 1984 1982 1985 1986 CONECT 1985 1984 1997 1998 1999 CONECT 1986 1983 1984 1988 CONECT 1987 1983 1989 2000 CONECT 1988 1986 1990 2001 CONECT 1989 1987 1990 2002 CONECT 1990 1988 1989 2003 CONECT 1991 1978 CONECT 1992 1978 CONECT 1993 1978 CONECT 1994 1979 CONECT 1995 1980 CONECT 1996 1982 CONECT 1997 1985 CONECT 1998 1985 CONECT 1999 1985 CONECT 2000 1987 CONECT 2001 1988 CONECT 2002 1989 CONECT 2003 1990 END