USER MOD reduce.3.24.130724 H: found=0, std=0, add=518, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 520 hydrogens (0 hets) HEADER MATRIX PROTEIN 05-AUG-96 1EMN TITLE NMR STUDY OF A PAIR OF FIBRILLIN CA2+ BINDING EPIDERMAL TITLE 2 GROWTH FACTOR-LIKE DOMAINS, MINIMIZED AVERAGE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: FIBRILLIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: CA2+ BINDING EPIDERMAL GROWTH FACTOR-LIKE DOMAIN, COMPND 5 RESIDUES 2124 - 2205; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 ORGAN: SKIN; SOURCE 6 TISSUE: SKIN (DERMIS); SOURCE 7 CELL: FIBROBLAST; SOURCE 8 GENE: FBN1; SOURCE 9 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 0 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 1 EXPRESSION_SYSTEM_STRAIN: NM554 (HIS TAG); SOURCE 2 EXPRESSION_SYSTEM_PLASMID: PQE30 (QIAGEN); SOURCE 3 EXPRESSION_SYSTEM_GENE: FBN1 KEYWDS EXTRACELLULAR MATRIX, CALCIUM-BINDING, GLYCOPROTEIN, REPEAT, KEYWDS 2 SIGNAL, MULTIGENE FAMILY, DISEASE MUTATION, EGF-LIKE DOMAIN, KEYWDS 3 HUMAN FIBRILLIN-1 FRAGMENT, MATRIX PROTEIN EXPDTA SOLUTION NMR AUTHOR A.K.DOWNING,I.D.CAMPBELL,P.A.HANDFORD REVDAT 2 24-FEB-09 1EMN 1 VERSN REVDAT 1 23-DEC-96 1EMN 0 JRNL AUTH A.K.DOWNING,V.KNOTT,J.M.WERNER,C.M.CARDY, JRNL AUTH 2 I.D.CAMPBELL,P.A.HANDFORD JRNL TITL SOLUTION STRUCTURE OF A PAIR OF CALCIUM-BINDING JRNL TITL 2 EPIDERMAL GROWTH FACTOR-LIKE DOMAINS: IMPLICATIONS JRNL TITL 3 FOR THE MARFAN SYNDROME AND OTHER GENETIC JRNL TITL 4 DISORDERS. JRNL REF CELL(CAMBRIDGE,MASS.) V. 85 597 1996 JRNL REFN ISSN 0092-8674 JRNL PMID 8653794 JRNL DOI 10.1016/S0092-8674(00)81259-3 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH V.KNOTT,A.K.DOWNING,C.M.CARDY,P.HANDFORD REMARK 1 TITL CALCIUM BINDING PROPERTIES OF AN EPIDERMAL GROWTH REMARK 1 TITL 2 FACTOR-LIKE DOMAIN PAIR FROM HUMAN FIBRILLIN-1 REMARK 1 REF J.MOL.BIOL. V. 255 22 1996 REMARK 1 REFN ISSN 0022-2836 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1EMN COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 1H-NOESY, COSY, TOCSY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : NULL REMARK 210 SPECTROMETER MANUFACTURER : BRUKER, OMEGA REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 200 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : F(NOE) < 165 KJ MOL-1 TORSION REMARK 210 ANGLE CONSTRAINTS VIOLATED BY REMARK 210 > 3 DEGREES REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ALA A2125 38.86 95.97 REMARK 500 VAL A2126 107.61 -51.61 REMARK 500 ASP A2127 106.68 -43.92 REMARK 500 MET A2128 121.94 -35.17 REMARK 500 GLU A2130 -41.87 79.52 REMARK 500 VAL A2136 -105.44 -114.40 REMARK 500 CYS A2137 -87.75 -63.31 REMARK 500 LYS A2138 93.13 76.43 REMARK 500 HIS A2139 54.25 72.49 REMARK 500 ASP A2146 -80.39 -50.29 REMARK 500 SER A2148 -161.40 -169.39 REMARK 500 PRO A2154 -168.03 -63.50 REMARK 500 ALA A2160 56.65 -100.36 REMARK 500 ASN A2162 -53.91 166.79 REMARK 500 VAL A2172 -73.52 -90.27 REMARK 500 ASN A2174 99.83 -38.87 REMARK 500 ASN A2178 -36.46 -154.31 REMARK 500 CYS A2192 -176.37 -49.16 REMARK 500 GLU A2194 128.20 -19.85 REMARK 500 PHE A2196 -164.45 -119.79 REMARK 500 PRO A2198 -160.04 -66.78 REMARK 500 PRO A2200 -80.22 -62.45 REMARK 500 MET A2202 -76.02 -118.74 REMARK 500 THR A2203 -166.86 -174.07 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A2150 0.27 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A2224 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP A2127 OD1 REMARK 620 2 MET A2128 O 80.6 REMARK 620 3 GLU A2130 OE1 137.3 69.0 REMARK 620 4 GLU A2130 OE2 93.3 69.3 48.7 REMARK 620 5 ASP A2127 OD2 39.9 117.9 164.1 118.3 REMARK 620 6 ASN A2144 OD1 99.9 101.3 114.6 162.5 79.1 REMARK 620 7 ASN A2144 ND2 131.3 72.3 67.0 112.9 128.0 49.6 REMARK 620 8 THR A2145 O 94.8 168.5 108.9 100.6 61.2 89.8 117.8 REMARK 620 N 1 2 3 4 5 6 7 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A2225 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLY A2187 O REMARK 620 2 ASP A2166 OD2 101.3 REMARK 620 3 THR A2167 O 160.6 91.5 REMARK 620 4 ASN A2183 OD1 122.0 118.1 61.9 REMARK 620 5 GLU A2169 OE1 92.6 110.6 69.1 109.2 REMARK 620 6 GLU A2169 OE2 53.9 87.9 112.8 152.8 49.2 REMARK 620 7 VAL A2184 O 88.8 53.0 110.6 83.8 163.4 121.0 REMARK 620 N 1 2 3 4 5 6 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: CA1 REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: CALCIUM BINDING SITE FOR EGF-LIKE DOMAIN 32. REMARK 800 SITE_IDENTIFIER: CA2 REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: CALCIUM BINDING SITE FOR EGF-LIKE DOMAIN 33. REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 2224 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 2225 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1EMO RELATED DB: PDB DBREF 1EMN A 2124 2205 UNP P35555 FBN1_HUMAN 2124 2205 SEQADV 1EMN ILE A 2158 UNP P35555 THR 2158 CONFLICT SEQRES 1 A 82 SER ALA VAL ASP MET ASP GLU CYS LYS GLU PRO ASP VAL SEQRES 2 A 82 CYS LYS HIS GLY GLN CYS ILE ASN THR ASP GLY SER TYR SEQRES 3 A 82 ARG CYS GLU CYS PRO PHE GLY TYR ILE LEU ALA GLY ASN SEQRES 4 A 82 GLU CYS VAL ASP THR ASP GLU CYS SER VAL GLY ASN PRO SEQRES 5 A 82 CYS GLY ASN GLY THR CYS LYS ASN VAL ILE GLY GLY PHE SEQRES 6 A 82 GLU CYS THR CYS GLU GLU GLY PHE GLU PRO GLY PRO MET SEQRES 7 A 82 MET THR CYS GLU HET CA A2224 1 HET CA A2225 1 HETNAM CA CALCIUM ION FORMUL 2 CA 2(CA 2+) HELIX 1 H1 GLU A 2169 SER A 2171 5 3 SHEET 1 S1 2 GLN A2141 CYS A2142 0 SHEET 2 S1 2 CYS A2151 GLU A2152 -1 N GLU A2152 O GLN A2141 SHEET 1 S2 2 TYR A2157 ALA A2160 0 SHEET 2 S2 2 GLU A2163 ASP A2166 -1 O VAL A2165 N ILE A2158 SHEET 1 S3 2 CYS A2181 ASN A2183 0 SHEET 2 S3 2 PHE A2188 CYS A2190 -1 O GLU A2189 N LYS A2182 SSBOND *** CYS A 2131 CYS A 2142 1555 1555 2.02 SSBOND *** CYS A 2137 CYS A 2151 1555 1555 2.02 SSBOND *** CYS A 2153 CYS A 2164 1555 1555 2.02 SSBOND *** CYS A 2170 CYS A 2181 1555 1555 2.02 SSBOND *** CYS A 2176 CYS A 2190 1555 1555 2.02 SSBOND *** CYS A 2192 CYS A 2204 1555 1555 2.02 LINK CA CA A2224 OD1 ASP A2127 1555 1555 2.47 LINK CA CA A2224 O MET A2128 1555 1555 2.65 LINK CA CA A2224 OE1 GLU A2130 1555 1555 2.61 LINK CA CA A2224 OE2 GLU A2130 1555 1555 2.61 LINK CA CA A2224 OD2 ASP A2127 1555 1555 3.36 LINK CA CA A2224 OD1 ASN A2144 1555 1555 2.64 LINK CA CA A2224 ND2 ASN A2144 1555 1555 2.56 LINK CA CA A2224 O THR A2145 1555 1555 2.63 LINK CA CA A2225 O GLY A2187 1555 1555 2.44 LINK CA CA A2225 OD2 ASP A2166 1555 1555 2.56 LINK CA CA A2225 O THR A2167 1555 1555 2.46 LINK CA CA A2225 OD1 ASN A2183 1555 1555 2.62 LINK CA CA A2225 OE1 GLU A2169 1555 1555 2.54 LINK CA CA A2225 OE2 GLU A2169 1555 1555 2.62 LINK CA CA A2225 O VAL A2184 1555 1555 2.61 SITE *** CA1 6 ASP A2127 ASP A2129 GLU A2130 ASN A2144 SITE *** CA1 6 TYR A2149 CA A2224 SITE *** CA2 6 ASP A2166 ASP A2168 GLU A2169 ASN A2183 SITE *** CA2 6 PHE A2188 CA A2225 SITE *** AC1 7 ASP A2127 MET A2128 GLU A2130 ASN A2144 SITE *** AC1 7 THR A2145 ASP A2146 SER A2148 SITE *** AC2 6 ASP A2166 THR A2167 GLU A2169 ASN A2183 SITE *** AC2 6 VAL A2184 GLY A2187 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A2144 ASNHD21 : A2144 ASN OD1 : A2224 CACA :(metal ligand) USER MOD NoAdj : A2144 ASNHD22 : A2144 ASN OD1 : A2224 CACA :(metal ligand) USER MOD NoAdj : A2183 ASNHD21 : A2183 ASN OD1 : A2225 CACA :(metal ligand) USER MOD NoAdj : A2183 ASNHD22 : A2183 ASN OD1 : A2225 CACA :(metal ligand) USER MOD Set 1.1: A2149 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A2162 ASN : amide:sc= -4.79! C(o=-4.8!,f=-7.3!) USER MOD Single : A2124 SER OG : rot 180:sc= 0 USER MOD Single : A2128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A2132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2139 HIS :FLIP no HD1:sc= -0.633 F(o=-1.8!,f=-0.63) USER MOD Single : A2141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2145 THR OG1 : rot -9:sc= -2.79! USER MOD Single : A2148 SER OG : rot 180:sc= 0 USER MOD Single : A2157 TYR OH : rot -166:sc= -4.48! USER MOD Single : A2167 THR OG1 : rot 180:sc= -0.0863 USER MOD Single : A2171 SER OG : rot 84:sc= 0.146 USER MOD Single : A2174 ASN : amide:sc= -4.34! C(o=-4.3!,f=-4.5!) USER MOD Single : A2178 ASN :FLIP amide:sc= 0.699 F(o=0,f=0.7) USER MOD Single : A2180 THR OG1 : rot 180:sc= 0 USER MOD Single : A2182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2191 THR OG1 : rot 180:sc= 0 USER MOD Single : A2201 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A2202 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A2203 THR OG1 : rot 42:sc= 1.2 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A2124 -20.337 29.673 -1.621 1.00 7.57 N ATOM 2 CA SER A2124 -19.941 29.667 -0.185 1.00 7.11 C ATOM 3 C SER A2124 -18.429 29.455 -0.071 1.00 6.17 C ATOM 4 O SER A2124 -17.817 29.831 0.908 1.00 6.38 O ATOM 5 CB SER A2124 -20.668 28.535 0.540 1.00 7.73 C ATOM 6 OG SER A2124 -21.098 28.994 1.814 1.00 8.26 O ATOM 0 HA SER A2124 -20.209 30.622 0.268 1.00 7.11 H new ATOM 0 HB2 SER A2124 -21.524 28.202 -0.047 1.00 7.73 H new ATOM 0 HB3 SER A2124 -20.006 27.676 0.654 1.00 7.73 H new ATOM 0 HG SER A2124 -21.566 28.271 2.281 1.00 8.26 H new ATOM 14 N ALA A2125 -17.828 28.857 -1.068 1.00 5.43 N ATOM 15 CA ALA A2125 -16.353 28.613 -1.037 1.00 4.81 C ATOM 16 C ALA A2125 -16.075 27.194 -0.534 1.00 4.08 C ATOM 17 O ALA A2125 -15.137 26.961 0.202 1.00 4.22 O ATOM 18 CB ALA A2125 -15.669 29.623 -0.112 1.00 5.10 C ATOM 0 H ALA A2125 -18.299 28.524 -1.909 1.00 5.43 H new ATOM 0 HA ALA A2125 -15.957 28.728 -2.046 1.00 4.81 H new ATOM 0 HB1 ALA A2125 -14.595 29.435 -0.098 1.00 5.10 H new ATOM 0 HB2 ALA A2125 -15.855 30.634 -0.475 1.00 5.10 H new ATOM 0 HB3 ALA A2125 -16.068 29.521 0.897 1.00 5.10 H new ATOM 24 N VAL A2126 -16.877 26.243 -0.931 1.00 3.61 N ATOM 25 CA VAL A2126 -16.649 24.841 -0.479 1.00 3.08 C ATOM 26 C VAL A2126 -15.193 24.456 -0.757 1.00 2.42 C ATOM 27 O VAL A2126 -14.801 24.254 -1.889 1.00 2.61 O ATOM 28 CB VAL A2126 -17.594 23.899 -1.240 1.00 3.53 C ATOM 29 CG1 VAL A2126 -16.851 22.624 -1.651 1.00 3.59 C ATOM 30 CG2 VAL A2126 -18.771 23.526 -0.337 1.00 4.14 C ATOM 0 H VAL A2126 -17.679 26.376 -1.548 1.00 3.61 H new ATOM 0 HA VAL A2126 -16.848 24.758 0.589 1.00 3.08 H new ATOM 0 HB VAL A2126 -17.956 24.406 -2.135 1.00 3.53 H new ATOM 0 HG11 VAL A2126 -17.531 21.964 -2.190 1.00 3.59 H new ATOM 0 HG12 VAL A2126 -16.011 22.884 -2.295 1.00 3.59 H new ATOM 0 HG13 VAL A2126 -16.481 22.115 -0.761 1.00 3.59 H new ATOM 0 HG21 VAL A2126 -19.444 22.857 -0.874 1.00 4.14 H new ATOM 0 HG22 VAL A2126 -18.399 23.025 0.557 1.00 4.14 H new ATOM 0 HG23 VAL A2126 -19.310 24.429 -0.050 1.00 4.14 H new ATOM 40 N ASP A2127 -14.389 24.355 0.265 1.00 2.01 N ATOM 41 CA ASP A2127 -12.962 23.984 0.051 1.00 1.80 C ATOM 42 C ASP A2127 -12.885 22.834 -0.955 1.00 1.48 C ATOM 43 O ASP A2127 -13.214 21.706 -0.646 1.00 1.83 O ATOM 44 CB ASP A2127 -12.343 23.544 1.380 1.00 2.14 C ATOM 45 CG ASP A2127 -10.823 23.450 1.232 1.00 2.01 C ATOM 46 OD1 ASP A2127 -10.370 23.200 0.127 1.00 1.69 O ATOM 47 OD2 ASP A2127 -10.139 23.631 2.226 1.00 2.64 O ATOM 0 H ASP A2127 -14.657 24.513 1.236 1.00 2.01 H new ATOM 0 HA ASP A2127 -12.414 24.844 -0.335 1.00 1.80 H new ATOM 0 HB2 ASP A2127 -12.599 24.256 2.165 1.00 2.14 H new ATOM 0 HB3 ASP A2127 -12.750 22.578 1.680 1.00 2.14 H new ATOM 52 N MET A2128 -12.457 23.114 -2.158 1.00 1.36 N ATOM 53 CA MET A2128 -12.359 22.042 -3.193 1.00 1.09 C ATOM 54 C MET A2128 -11.949 20.725 -2.534 1.00 0.94 C ATOM 55 O MET A2128 -10.914 20.630 -1.900 1.00 0.91 O ATOM 56 CB MET A2128 -11.311 22.438 -4.236 1.00 1.18 C ATOM 57 CG MET A2128 -12.002 23.119 -5.419 1.00 1.44 C ATOM 58 SD MET A2128 -10.803 24.138 -6.314 1.00 2.22 S ATOM 59 CE MET A2128 -11.784 24.368 -7.818 1.00 2.47 C ATOM 0 H MET A2128 -12.170 24.042 -2.469 1.00 1.36 H new ATOM 0 HA MET A2128 -13.328 21.916 -3.676 1.00 1.09 H new ATOM 0 HB2 MET A2128 -10.577 23.111 -3.793 1.00 1.18 H new ATOM 0 HB3 MET A2128 -10.769 21.556 -4.576 1.00 1.18 H new ATOM 0 HG2 MET A2128 -12.428 22.369 -6.086 1.00 1.44 H new ATOM 0 HG3 MET A2128 -12.828 23.736 -5.065 1.00 1.44 H new ATOM 0 HE1 MET A2128 -11.226 24.981 -8.526 1.00 2.47 H new ATOM 0 HE2 MET A2128 -11.996 23.397 -8.266 1.00 2.47 H new ATOM 0 HE3 MET A2128 -12.722 24.865 -7.568 1.00 2.47 H new ATOM 69 N ASP A2129 -12.752 19.707 -2.680 1.00 0.93 N ATOM 70 CA ASP A2129 -12.404 18.399 -2.066 1.00 0.92 C ATOM 71 C ASP A2129 -11.046 17.951 -2.604 1.00 0.87 C ATOM 72 O ASP A2129 -10.161 17.588 -1.857 1.00 1.38 O ATOM 73 CB ASP A2129 -13.465 17.357 -2.423 1.00 1.01 C ATOM 74 CG ASP A2129 -13.287 16.132 -1.526 1.00 1.04 C ATOM 75 OD1 ASP A2129 -12.197 15.583 -1.516 1.00 0.98 O ATOM 76 OD2 ASP A2129 -14.243 15.764 -0.863 1.00 1.31 O ATOM 0 H ASP A2129 -13.631 19.726 -3.197 1.00 0.93 H new ATOM 0 HA ASP A2129 -12.362 18.502 -0.982 1.00 0.92 H new ATOM 0 HB2 ASP A2129 -14.463 17.777 -2.292 1.00 1.01 H new ATOM 0 HB3 ASP A2129 -13.374 17.072 -3.471 1.00 1.01 H new ATOM 81 N GLU A2130 -10.879 17.985 -3.898 1.00 0.76 N ATOM 82 CA GLU A2130 -9.581 17.575 -4.506 1.00 0.74 C ATOM 83 C GLU A2130 -9.491 16.050 -4.578 1.00 0.79 C ATOM 84 O GLU A2130 -9.042 15.495 -5.560 1.00 0.87 O ATOM 85 CB GLU A2130 -8.422 18.122 -3.668 1.00 0.87 C ATOM 86 CG GLU A2130 -8.663 19.605 -3.374 1.00 0.84 C ATOM 87 CD GLU A2130 -8.365 19.895 -1.901 1.00 0.80 C ATOM 88 OE1 GLU A2130 -8.547 19.002 -1.091 1.00 1.46 O ATOM 89 OE2 GLU A2130 -7.961 21.008 -1.608 1.00 1.22 O ATOM 0 H GLU A2130 -11.591 18.281 -4.565 1.00 0.76 H new ATOM 0 HA GLU A2130 -9.520 17.981 -5.516 1.00 0.74 H new ATOM 0 HB2 GLU A2130 -8.338 17.564 -2.735 1.00 0.87 H new ATOM 0 HB3 GLU A2130 -7.480 17.994 -4.202 1.00 0.87 H new ATOM 0 HG2 GLU A2130 -8.027 20.220 -4.011 1.00 0.84 H new ATOM 0 HG3 GLU A2130 -9.695 19.868 -3.605 1.00 0.84 H new ATOM 96 N CYS A2131 -9.909 15.366 -3.553 1.00 0.83 N ATOM 97 CA CYS A2131 -9.839 13.880 -3.580 1.00 0.99 C ATOM 98 C CYS A2131 -11.144 13.315 -4.153 1.00 1.06 C ATOM 99 O CYS A2131 -11.161 12.262 -4.757 1.00 1.32 O ATOM 100 CB CYS A2131 -9.606 13.353 -2.158 1.00 1.13 C ATOM 101 SG CYS A2131 -11.190 13.023 -1.345 1.00 1.56 S ATOM 0 H CYS A2131 -10.295 15.769 -2.699 1.00 0.83 H new ATOM 0 HA CYS A2131 -9.011 13.562 -4.214 1.00 0.99 H new ATOM 0 HB2 CYS A2131 -9.010 12.441 -2.194 1.00 1.13 H new ATOM 0 HB3 CYS A2131 -9.038 14.082 -1.581 1.00 1.13 H new ATOM 106 N LYS A2132 -12.235 14.010 -3.974 1.00 0.99 N ATOM 107 CA LYS A2132 -13.531 13.509 -4.514 1.00 1.16 C ATOM 108 C LYS A2132 -13.583 13.753 -6.022 1.00 1.04 C ATOM 109 O LYS A2132 -14.532 13.387 -6.688 1.00 1.21 O ATOM 110 CB LYS A2132 -14.687 14.244 -3.841 1.00 1.32 C ATOM 111 CG LYS A2132 -15.493 13.262 -2.989 1.00 1.90 C ATOM 112 CD LYS A2132 -16.210 12.263 -3.899 1.00 2.20 C ATOM 113 CE LYS A2132 -17.127 13.017 -4.864 1.00 2.54 C ATOM 114 NZ LYS A2132 -18.523 12.516 -4.717 1.00 3.00 N ATOM 0 H LYS A2132 -12.285 14.900 -3.479 1.00 0.99 H new ATOM 0 HA LYS A2132 -13.616 12.441 -4.314 1.00 1.16 H new ATOM 0 HB2 LYS A2132 -14.304 15.052 -3.218 1.00 1.32 H new ATOM 0 HB3 LYS A2132 -15.329 14.700 -4.595 1.00 1.32 H new ATOM 0 HG2 LYS A2132 -14.832 12.734 -2.301 1.00 1.90 H new ATOM 0 HG3 LYS A2132 -16.219 13.802 -2.382 1.00 1.90 H new ATOM 0 HD2 LYS A2132 -15.481 11.676 -4.458 1.00 2.20 H new ATOM 0 HD3 LYS A2132 -16.792 11.563 -3.300 1.00 2.20 H new ATOM 0 HE2 LYS A2132 -17.090 14.087 -4.657 1.00 2.54 H new ATOM 0 HE3 LYS A2132 -16.786 12.878 -5.890 1.00 2.54 H new ATOM 0 HZ1 LYS A2132 -19.147 13.028 -5.373 1.00 3.00 H new ATOM 0 HZ2 LYS A2132 -18.552 11.499 -4.935 1.00 3.00 H new ATOM 0 HZ3 LYS A2132 -18.846 12.670 -3.741 1.00 3.00 H new ATOM 128 N GLU A2133 -12.570 14.369 -6.568 1.00 0.91 N ATOM 129 CA GLU A2133 -12.562 14.635 -8.032 1.00 0.90 C ATOM 130 C GLU A2133 -12.388 13.313 -8.787 1.00 0.91 C ATOM 131 O GLU A2133 -11.708 12.419 -8.323 1.00 0.83 O ATOM 132 CB GLU A2133 -11.408 15.578 -8.375 1.00 0.89 C ATOM 133 CG GLU A2133 -11.503 16.843 -7.513 1.00 0.86 C ATOM 134 CD GLU A2133 -10.985 18.043 -8.309 1.00 1.25 C ATOM 135 OE1 GLU A2133 -11.450 18.237 -9.420 1.00 1.90 O ATOM 136 OE2 GLU A2133 -10.133 18.747 -7.793 1.00 1.68 O ATOM 0 H GLU A2133 -11.748 14.699 -6.062 1.00 0.91 H new ATOM 0 HA GLU A2133 -13.504 15.099 -8.323 1.00 0.90 H new ATOM 0 HB2 GLU A2133 -10.454 15.079 -8.203 1.00 0.89 H new ATOM 0 HB3 GLU A2133 -11.443 15.843 -9.432 1.00 0.89 H new ATOM 0 HG2 GLU A2133 -12.536 17.013 -7.210 1.00 0.86 H new ATOM 0 HG3 GLU A2133 -10.920 16.719 -6.601 1.00 0.86 H new ATOM 143 N PRO A2134 -13.021 13.232 -9.927 1.00 1.12 N ATOM 144 CA PRO A2134 -12.974 12.029 -10.782 1.00 1.25 C ATOM 145 C PRO A2134 -11.563 11.800 -11.335 1.00 1.15 C ATOM 146 O PRO A2134 -11.319 10.844 -12.045 1.00 1.23 O ATOM 147 CB PRO A2134 -13.944 12.331 -11.929 1.00 1.57 C ATOM 148 CG PRO A2134 -14.417 13.799 -11.771 1.00 1.63 C ATOM 149 CD PRO A2134 -13.839 14.336 -10.454 1.00 1.34 C ATOM 0 HA PRO A2134 -13.241 11.129 -10.228 1.00 1.25 H new ATOM 0 HB2 PRO A2134 -13.454 12.189 -12.892 1.00 1.57 H new ATOM 0 HB3 PRO A2134 -14.794 11.650 -11.900 1.00 1.57 H new ATOM 0 HG2 PRO A2134 -14.077 14.403 -12.612 1.00 1.63 H new ATOM 0 HG3 PRO A2134 -15.506 13.851 -11.760 1.00 1.63 H new ATOM 0 HD2 PRO A2134 -13.238 15.230 -10.621 1.00 1.34 H new ATOM 0 HD3 PRO A2134 -14.631 14.610 -9.757 1.00 1.34 H new ATOM 157 N ASP A2135 -10.634 12.664 -11.033 1.00 1.05 N ATOM 158 CA ASP A2135 -9.255 12.475 -11.565 1.00 1.03 C ATOM 159 C ASP A2135 -8.246 12.467 -10.416 1.00 0.98 C ATOM 160 O ASP A2135 -7.051 12.524 -10.632 1.00 1.13 O ATOM 161 CB ASP A2135 -8.919 13.617 -12.525 1.00 1.17 C ATOM 162 CG ASP A2135 -9.682 13.423 -13.837 1.00 1.90 C ATOM 163 OD1 ASP A2135 -9.898 12.282 -14.211 1.00 2.65 O ATOM 164 OD2 ASP A2135 -10.037 14.420 -14.445 1.00 2.45 O ATOM 0 H ASP A2135 -10.768 13.487 -10.445 1.00 1.05 H new ATOM 0 HA ASP A2135 -9.205 11.522 -12.092 1.00 1.03 H new ATOM 0 HB2 ASP A2135 -9.185 14.574 -12.076 1.00 1.17 H new ATOM 0 HB3 ASP A2135 -7.846 13.642 -12.716 1.00 1.17 H new ATOM 169 N VAL A2136 -8.705 12.398 -9.199 1.00 0.99 N ATOM 170 CA VAL A2136 -7.748 12.391 -8.056 1.00 0.97 C ATOM 171 C VAL A2136 -7.810 11.045 -7.324 1.00 1.03 C ATOM 172 O VAL A2136 -7.301 10.050 -7.799 1.00 1.59 O ATOM 173 CB VAL A2136 -8.092 13.525 -7.088 1.00 0.92 C ATOM 174 CG1 VAL A2136 -7.112 13.504 -5.913 1.00 1.01 C ATOM 175 CG2 VAL A2136 -7.975 14.866 -7.818 1.00 1.04 C ATOM 0 H VAL A2136 -9.692 12.347 -8.946 1.00 0.99 H new ATOM 0 HA VAL A2136 -6.738 12.538 -8.438 1.00 0.97 H new ATOM 0 HB VAL A2136 -9.109 13.394 -6.719 1.00 0.92 H new ATOM 0 HG11 VAL A2136 -7.355 14.311 -5.222 1.00 1.01 H new ATOM 0 HG12 VAL A2136 -7.186 12.548 -5.395 1.00 1.01 H new ATOM 0 HG13 VAL A2136 -6.096 13.638 -6.284 1.00 1.01 H new ATOM 0 HG21 VAL A2136 -8.219 15.677 -7.131 1.00 1.04 H new ATOM 0 HG22 VAL A2136 -6.956 14.994 -8.183 1.00 1.04 H new ATOM 0 HG23 VAL A2136 -8.666 14.883 -8.660 1.00 1.04 H new ATOM 185 N CYS A2137 -8.415 11.008 -6.168 1.00 0.99 N ATOM 186 CA CYS A2137 -8.491 9.729 -5.402 1.00 1.00 C ATOM 187 C CYS A2137 -9.293 8.691 -6.182 1.00 1.07 C ATOM 188 O CYS A2137 -8.743 7.900 -6.921 1.00 1.90 O ATOM 189 CB CYS A2137 -9.171 9.986 -4.058 1.00 1.05 C ATOM 190 SG CYS A2137 -7.919 10.093 -2.758 1.00 1.54 S ATOM 0 H CYS A2137 -8.861 11.808 -5.720 1.00 0.99 H new ATOM 0 HA CYS A2137 -7.481 9.350 -5.243 1.00 1.00 H new ATOM 0 HB2 CYS A2137 -9.746 10.911 -4.101 1.00 1.05 H new ATOM 0 HB3 CYS A2137 -9.874 9.184 -3.835 1.00 1.05 H new ATOM 195 N LYS A2138 -10.587 8.678 -6.009 1.00 1.02 N ATOM 196 CA LYS A2138 -11.430 7.683 -6.729 1.00 0.95 C ATOM 197 C LYS A2138 -11.292 6.312 -6.058 1.00 1.04 C ATOM 198 O LYS A2138 -10.403 5.546 -6.369 1.00 1.72 O ATOM 199 CB LYS A2138 -10.981 7.588 -8.191 1.00 0.87 C ATOM 200 CG LYS A2138 -11.612 8.725 -8.996 1.00 0.95 C ATOM 201 CD LYS A2138 -11.663 8.332 -10.473 1.00 1.28 C ATOM 202 CE LYS A2138 -13.119 8.274 -10.936 1.00 1.46 C ATOM 203 NZ LYS A2138 -13.282 7.168 -11.921 1.00 1.86 N ATOM 0 H LYS A2138 -11.097 9.316 -5.398 1.00 1.02 H new ATOM 0 HA LYS A2138 -12.472 8.000 -6.693 1.00 0.95 H new ATOM 0 HB2 LYS A2138 -9.894 7.645 -8.253 1.00 0.87 H new ATOM 0 HB3 LYS A2138 -11.274 6.626 -8.610 1.00 0.87 H new ATOM 0 HG2 LYS A2138 -12.617 8.932 -8.628 1.00 0.95 H new ATOM 0 HG3 LYS A2138 -11.032 9.640 -8.871 1.00 0.95 H new ATOM 0 HD2 LYS A2138 -11.109 9.055 -11.072 1.00 1.28 H new ATOM 0 HD3 LYS A2138 -11.185 7.363 -10.619 1.00 1.28 H new ATOM 0 HE2 LYS A2138 -13.778 8.115 -10.082 1.00 1.46 H new ATOM 0 HE3 LYS A2138 -13.406 9.223 -11.388 1.00 1.46 H new ATOM 0 HZ1 LYS A2138 -14.272 7.127 -12.237 1.00 1.86 H new ATOM 0 HZ2 LYS A2138 -12.664 7.339 -12.740 1.00 1.86 H new ATOM 0 HZ3 LYS A2138 -13.024 6.265 -11.475 1.00 1.86 H new ATOM 217 N HIS A2139 -12.171 6.002 -5.140 1.00 0.84 N ATOM 218 CA HIS A2139 -12.108 4.681 -4.443 1.00 0.87 C ATOM 219 C HIS A2139 -10.926 4.654 -3.469 1.00 0.92 C ATOM 220 O HIS A2139 -10.094 3.770 -3.518 1.00 1.19 O ATOM 221 CB HIS A2139 -11.942 3.561 -5.473 1.00 0.96 C ATOM 222 CG HIS A2139 -13.102 3.581 -6.431 1.00 1.32 C ATOM 223 ND1 HIS A2139 -13.869 4.608 -6.923 1.00 1.98 N flip ATOM 224 CD2 HIS A2139 -13.602 2.424 -7.007 1.00 1.90 C flip ATOM 225 CE1 HIS A2139 -14.831 4.098 -7.791 1.00 2.26 C flip ATOM 226 NE2 HIS A2139 -14.626 2.779 -7.805 1.00 2.17 N flip ATOM 0 H HIS A2139 -12.934 6.610 -4.841 1.00 0.84 H new ATOM 0 HA HIS A2139 -13.034 4.533 -3.887 1.00 0.87 H new ATOM 0 HB2 HIS A2139 -11.006 3.689 -6.017 1.00 0.96 H new ATOM 0 HB3 HIS A2139 -11.889 2.595 -4.970 1.00 0.96 H new ATOM 0 HD2 HIS A2139 -13.237 1.421 -6.845 1.00 1.90 H new ATOM 0 HE1 HIS A2139 -15.582 4.651 -8.336 1.00 2.26 H new ATOM 0 HE2 HIS A2139 -15.178 2.120 -8.354 1.00 2.17 H new ATOM 234 N GLY A2140 -10.846 5.606 -2.578 1.00 0.86 N ATOM 235 CA GLY A2140 -9.714 5.618 -1.604 1.00 0.93 C ATOM 236 C GLY A2140 -10.054 6.528 -0.420 1.00 0.87 C ATOM 237 O GLY A2140 -10.968 7.325 -0.479 1.00 0.86 O ATOM 0 H GLY A2140 -11.512 6.373 -2.482 1.00 0.86 H new ATOM 0 HA2 GLY A2140 -9.516 4.606 -1.251 1.00 0.93 H new ATOM 0 HA3 GLY A2140 -8.805 5.968 -2.094 1.00 0.93 H new ATOM 241 N GLN A2141 -9.316 6.419 0.654 1.00 0.94 N ATOM 242 CA GLN A2141 -9.587 7.280 1.839 1.00 0.98 C ATOM 243 C GLN A2141 -8.720 8.534 1.744 1.00 0.87 C ATOM 244 O GLN A2141 -7.510 8.471 1.829 1.00 0.96 O ATOM 245 CB GLN A2141 -9.243 6.512 3.118 1.00 1.20 C ATOM 246 CG GLN A2141 -9.662 7.334 4.338 1.00 1.46 C ATOM 247 CD GLN A2141 -9.927 6.397 5.518 1.00 2.10 C ATOM 248 OE1 GLN A2141 -9.009 5.826 6.073 1.00 2.67 O ATOM 249 NE2 GLN A2141 -11.152 6.213 5.928 1.00 2.72 N ATOM 0 H GLN A2141 -8.537 5.769 0.760 1.00 0.94 H new ATOM 0 HA GLN A2141 -10.640 7.560 1.863 1.00 0.98 H new ATOM 0 HB2 GLN A2141 -9.752 5.548 3.124 1.00 1.20 H new ATOM 0 HB3 GLN A2141 -8.173 6.307 3.155 1.00 1.20 H new ATOM 0 HG2 GLN A2141 -8.879 8.048 4.595 1.00 1.46 H new ATOM 0 HG3 GLN A2141 -10.558 7.912 4.110 1.00 1.46 H new ATOM 0 HE21 GLN A2141 -11.923 6.692 5.463 1.00 2.72 H new ATOM 0 HE22 GLN A2141 -11.339 5.590 6.714 1.00 2.72 H new ATOM 258 N CYS A2142 -9.324 9.672 1.549 1.00 0.91 N ATOM 259 CA CYS A2142 -8.531 10.920 1.429 1.00 0.84 C ATOM 260 C CYS A2142 -8.773 11.822 2.637 1.00 0.89 C ATOM 261 O CYS A2142 -9.600 11.546 3.483 1.00 1.08 O ATOM 262 CB CYS A2142 -8.958 11.661 0.165 1.00 0.82 C ATOM 263 SG CYS A2142 -10.757 11.565 -0.018 1.00 1.43 S ATOM 0 H CYS A2142 -10.334 9.789 1.468 1.00 0.91 H new ATOM 0 HA CYS A2142 -7.472 10.664 1.381 1.00 0.84 H new ATOM 0 HB2 CYS A2142 -8.643 12.703 0.218 1.00 0.82 H new ATOM 0 HB3 CYS A2142 -8.470 11.225 -0.707 1.00 0.82 H new ATOM 268 N ILE A2143 -8.057 12.908 2.710 1.00 0.82 N ATOM 269 CA ILE A2143 -8.233 13.853 3.844 1.00 0.92 C ATOM 270 C ILE A2143 -8.250 15.277 3.290 1.00 0.87 C ATOM 271 O ILE A2143 -7.236 15.809 2.883 1.00 0.89 O ATOM 272 CB ILE A2143 -7.075 13.689 4.826 1.00 1.02 C ATOM 273 CG1 ILE A2143 -7.150 12.297 5.458 1.00 1.11 C ATOM 274 CG2 ILE A2143 -7.175 14.753 5.920 1.00 1.21 C ATOM 275 CD1 ILE A2143 -6.510 11.272 4.518 1.00 1.35 C ATOM 0 H ILE A2143 -7.352 13.183 2.026 1.00 0.82 H new ATOM 0 HA ILE A2143 -9.168 13.649 4.365 1.00 0.92 H new ATOM 0 HB ILE A2143 -6.128 13.804 4.299 1.00 1.02 H new ATOM 0 HG12 ILE A2143 -6.636 12.295 6.419 1.00 1.11 H new ATOM 0 HG13 ILE A2143 -8.189 12.030 5.651 1.00 1.11 H new ATOM 0 HG21 ILE A2143 -6.348 14.634 6.620 1.00 1.21 H new ATOM 0 HG22 ILE A2143 -7.129 15.744 5.469 1.00 1.21 H new ATOM 0 HG23 ILE A2143 -8.119 14.640 6.452 1.00 1.21 H new ATOM 0 HD11 ILE A2143 -6.564 10.281 4.969 1.00 1.35 H new ATOM 0 HD12 ILE A2143 -7.043 11.267 3.567 1.00 1.35 H new ATOM 0 HD13 ILE A2143 -5.466 11.537 4.347 1.00 1.35 H new ATOM 287 N ASN A2144 -9.399 15.889 3.250 1.00 0.92 N ATOM 288 CA ASN A2144 -9.487 17.268 2.698 1.00 0.91 C ATOM 289 C ASN A2144 -8.623 18.224 3.519 1.00 0.92 C ATOM 290 O ASN A2144 -8.862 18.449 4.688 1.00 1.05 O ATOM 291 CB ASN A2144 -10.939 17.742 2.733 1.00 1.10 C ATOM 292 CG ASN A2144 -11.114 18.887 1.735 1.00 1.02 C ATOM 293 OD1 ASN A2144 -11.424 19.999 2.112 1.00 1.36 O ATOM 294 ND2 ASN A2144 -10.918 18.659 0.467 1.00 1.38 N ATOM 0 H ASN A2144 -10.281 15.494 3.576 1.00 0.92 H new ATOM 0 HA ASN A2144 -9.127 17.258 1.669 1.00 0.91 H new ATOM 0 HB2 ASN A2144 -11.609 16.920 2.484 1.00 1.10 H new ATOM 0 HB3 ASN A2144 -11.202 18.074 3.737 1.00 1.10 H new ATOM 0 HD21 ASN A2144 -11.025 19.415 -0.210 1.00 1.38 H new ATOM 0 HD22 ASN A2144 -10.658 17.725 0.151 1.00 1.38 H new ATOM 301 N THR A2145 -7.626 18.798 2.905 1.00 0.87 N ATOM 302 CA THR A2145 -6.749 19.754 3.635 1.00 0.97 C ATOM 303 C THR A2145 -7.096 21.179 3.198 1.00 1.07 C ATOM 304 O THR A2145 -7.989 21.391 2.400 1.00 1.07 O ATOM 305 CB THR A2145 -5.284 19.461 3.303 1.00 0.97 C ATOM 306 OG1 THR A2145 -5.089 19.567 1.900 1.00 1.14 O ATOM 307 CG2 THR A2145 -4.927 18.048 3.764 1.00 1.09 C ATOM 0 H THR A2145 -7.381 18.645 1.927 1.00 0.87 H new ATOM 0 HA THR A2145 -6.902 19.649 4.709 1.00 0.97 H new ATOM 0 HB THR A2145 -4.644 20.180 3.815 1.00 0.97 H new ATOM 0 HG1 THR A2145 -5.958 19.654 1.455 1.00 1.14 H new ATOM 0 HG21 THR A2145 -3.883 17.841 3.527 1.00 1.09 H new ATOM 0 HG22 THR A2145 -5.077 17.968 4.841 1.00 1.09 H new ATOM 0 HG23 THR A2145 -5.565 17.327 3.254 1.00 1.09 H new ATOM 315 N ASP A2146 -6.399 22.156 3.709 1.00 1.21 N ATOM 316 CA ASP A2146 -6.695 23.562 3.315 1.00 1.37 C ATOM 317 C ASP A2146 -6.743 23.666 1.789 1.00 1.45 C ATOM 318 O ASP A2146 -7.800 23.670 1.190 1.00 2.18 O ATOM 319 CB ASP A2146 -5.606 24.483 3.856 1.00 1.48 C ATOM 320 CG ASP A2146 -6.227 25.504 4.811 1.00 1.79 C ATOM 321 OD1 ASP A2146 -6.413 25.167 5.969 1.00 2.48 O ATOM 322 OD2 ASP A2146 -6.508 26.606 4.368 1.00 2.28 O ATOM 0 H ASP A2146 -5.640 22.042 4.380 1.00 1.21 H new ATOM 0 HA ASP A2146 -7.659 23.859 3.728 1.00 1.37 H new ATOM 0 HB2 ASP A2146 -4.846 23.899 4.375 1.00 1.48 H new ATOM 0 HB3 ASP A2146 -5.107 24.995 3.034 1.00 1.48 H new ATOM 327 N GLY A2147 -5.605 23.748 1.155 1.00 1.40 N ATOM 328 CA GLY A2147 -5.587 23.851 -0.332 1.00 1.41 C ATOM 329 C GLY A2147 -4.852 22.644 -0.920 1.00 1.29 C ATOM 330 O GLY A2147 -3.977 22.782 -1.751 1.00 1.60 O ATOM 0 H GLY A2147 -4.688 23.748 1.602 1.00 1.40 H new ATOM 0 HA2 GLY A2147 -6.606 23.892 -0.716 1.00 1.41 H new ATOM 0 HA3 GLY A2147 -5.094 24.774 -0.637 1.00 1.41 H new ATOM 334 N SER A2148 -5.202 21.462 -0.495 1.00 1.12 N ATOM 335 CA SER A2148 -4.527 20.244 -1.027 1.00 1.02 C ATOM 336 C SER A2148 -5.293 19.003 -0.572 1.00 0.89 C ATOM 337 O SER A2148 -6.440 19.081 -0.179 1.00 0.90 O ATOM 338 CB SER A2148 -3.095 20.179 -0.499 1.00 1.07 C ATOM 339 OG SER A2148 -2.197 20.045 -1.593 1.00 1.68 O ATOM 0 H SER A2148 -5.928 21.286 0.199 1.00 1.12 H new ATOM 0 HA SER A2148 -4.509 20.285 -2.116 1.00 1.02 H new ATOM 0 HB2 SER A2148 -2.863 21.080 0.069 1.00 1.07 H new ATOM 0 HB3 SER A2148 -2.984 19.336 0.183 1.00 1.07 H new ATOM 0 HG SER A2148 -1.277 20.005 -1.258 1.00 1.68 H new ATOM 345 N TYR A2149 -4.670 17.860 -0.617 1.00 0.84 N ATOM 346 CA TYR A2149 -5.370 16.619 -0.182 1.00 0.77 C ATOM 347 C TYR A2149 -4.365 15.477 -0.046 1.00 0.74 C ATOM 348 O TYR A2149 -3.174 15.657 -0.209 1.00 0.78 O ATOM 349 CB TYR A2149 -6.427 16.236 -1.217 1.00 0.78 C ATOM 350 CG TYR A2149 -5.773 16.067 -2.568 1.00 0.78 C ATOM 351 CD1 TYR A2149 -5.507 17.189 -3.363 1.00 1.42 C ATOM 352 CD2 TYR A2149 -5.433 14.789 -3.027 1.00 1.47 C ATOM 353 CE1 TYR A2149 -4.901 17.032 -4.615 1.00 1.42 C ATOM 354 CE2 TYR A2149 -4.827 14.632 -4.279 1.00 1.55 C ATOM 355 CZ TYR A2149 -4.561 15.754 -5.073 1.00 0.92 C ATOM 356 OH TYR A2149 -3.962 15.600 -6.307 1.00 1.04 O ATOM 0 H TYR A2149 -3.710 17.730 -0.935 1.00 0.84 H new ATOM 0 HA TYR A2149 -5.847 16.800 0.781 1.00 0.77 H new ATOM 0 HB2 TYR A2149 -6.921 15.310 -0.922 1.00 0.78 H new ATOM 0 HB3 TYR A2149 -7.197 17.006 -1.268 1.00 0.78 H new ATOM 0 HD1 TYR A2149 -5.769 18.175 -3.010 1.00 1.42 H new ATOM 0 HD2 TYR A2149 -5.638 13.923 -2.415 1.00 1.47 H new ATOM 0 HE1 TYR A2149 -4.696 17.897 -5.228 1.00 1.42 H new ATOM 0 HE2 TYR A2149 -4.565 13.646 -4.632 1.00 1.55 H new ATOM 0 HH TYR A2149 -3.791 14.649 -6.471 1.00 1.04 H new ATOM 366 N ARG A2150 -4.843 14.301 0.247 1.00 0.75 N ATOM 367 CA ARG A2150 -3.929 13.133 0.393 1.00 0.83 C ATOM 368 C ARG A2150 -4.695 11.853 0.062 1.00 0.84 C ATOM 369 O ARG A2150 -5.608 11.465 0.763 1.00 1.17 O ATOM 370 CB ARG A2150 -3.417 13.055 1.831 1.00 1.04 C ATOM 371 CG ARG A2150 -2.154 13.904 1.974 1.00 1.40 C ATOM 372 CD ARG A2150 -1.874 14.151 3.457 1.00 1.47 C ATOM 373 NE ARG A2150 -0.578 14.869 3.608 1.00 1.80 N ATOM 374 CZ ARG A2150 -0.280 15.447 4.739 1.00 2.35 C ATOM 375 NH1 ARG A2150 -0.243 14.746 5.840 1.00 2.86 N ATOM 376 NH2 ARG A2150 -0.023 16.725 4.771 1.00 3.04 N ATOM 0 H ARG A2150 -5.832 14.097 0.392 1.00 0.75 H new ATOM 0 HA ARG A2150 -3.084 13.247 -0.286 1.00 0.83 H new ATOM 0 HB2 ARG A2150 -4.184 13.408 2.520 1.00 1.04 H new ATOM 0 HB3 ARG A2150 -3.203 12.019 2.096 1.00 1.04 H new ATOM 0 HG2 ARG A2150 -1.307 13.397 1.512 1.00 1.40 H new ATOM 0 HG3 ARG A2150 -2.280 14.853 1.453 1.00 1.40 H new ATOM 0 HD2 ARG A2150 -2.680 14.738 3.897 1.00 1.47 H new ATOM 0 HD3 ARG A2150 -1.841 13.203 3.994 1.00 1.47 H new ATOM 0 HE ARG A2150 0.077 14.909 2.827 1.00 1.80 H new ATOM 0 HH11 ARG A2150 -0.447 13.747 5.816 1.00 2.86 H new ATOM 0 HH12 ARG A2150 -0.010 15.197 6.724 1.00 2.86 H new ATOM 0 HH21 ARG A2150 -0.055 17.273 3.911 1.00 3.04 H new ATOM 0 HH22 ARG A2150 0.210 17.176 5.656 1.00 3.04 H new ATOM 390 N CYS A2151 -4.333 11.198 -1.003 1.00 0.92 N ATOM 391 CA CYS A2151 -5.043 9.947 -1.382 1.00 0.93 C ATOM 392 C CYS A2151 -4.425 8.757 -0.647 1.00 0.97 C ATOM 393 O CYS A2151 -3.556 8.080 -1.159 1.00 1.22 O ATOM 394 CB CYS A2151 -4.929 9.738 -2.892 1.00 1.02 C ATOM 395 SG CYS A2151 -6.238 10.675 -3.716 1.00 1.70 S ATOM 0 H CYS A2151 -3.576 11.475 -1.628 1.00 0.92 H new ATOM 0 HA CYS A2151 -6.094 10.028 -1.105 1.00 0.93 H new ATOM 0 HB2 CYS A2151 -3.951 10.067 -3.245 1.00 1.02 H new ATOM 0 HB3 CYS A2151 -5.015 8.679 -3.133 1.00 1.02 H new ATOM 400 N GLU A2152 -4.874 8.496 0.550 1.00 0.90 N ATOM 401 CA GLU A2152 -4.322 7.347 1.320 1.00 0.96 C ATOM 402 C GLU A2152 -5.216 6.126 1.106 1.00 0.96 C ATOM 403 O GLU A2152 -6.307 6.043 1.635 1.00 1.21 O ATOM 404 CB GLU A2152 -4.285 7.701 2.808 1.00 1.04 C ATOM 405 CG GLU A2152 -2.844 7.994 3.229 1.00 1.35 C ATOM 406 CD GLU A2152 -2.431 7.031 4.344 1.00 1.83 C ATOM 407 OE1 GLU A2152 -3.067 7.053 5.385 1.00 2.23 O ATOM 408 OE2 GLU A2152 -1.486 6.288 4.138 1.00 2.48 O ATOM 0 H GLU A2152 -5.600 9.030 1.028 1.00 0.90 H new ATOM 0 HA GLU A2152 -3.311 7.126 0.978 1.00 0.96 H new ATOM 0 HB2 GLU A2152 -4.915 8.569 3.002 1.00 1.04 H new ATOM 0 HB3 GLU A2152 -4.687 6.878 3.398 1.00 1.04 H new ATOM 0 HG2 GLU A2152 -2.175 7.886 2.375 1.00 1.35 H new ATOM 0 HG3 GLU A2152 -2.757 9.024 3.574 1.00 1.35 H new ATOM 415 N CYS A2153 -4.766 5.179 0.330 1.00 1.00 N ATOM 416 CA CYS A2153 -5.594 3.968 0.079 1.00 1.01 C ATOM 417 C CYS A2153 -5.631 3.098 1.340 1.00 1.07 C ATOM 418 O CYS A2153 -4.730 3.145 2.154 1.00 1.13 O ATOM 419 CB CYS A2153 -4.995 3.179 -1.086 1.00 1.02 C ATOM 420 SG CYS A2153 -6.205 3.082 -2.428 1.00 1.06 S ATOM 0 H CYS A2153 -3.861 5.192 -0.141 1.00 1.00 H new ATOM 0 HA CYS A2153 -6.612 4.265 -0.174 1.00 1.01 H new ATOM 0 HB2 CYS A2153 -4.083 3.663 -1.437 1.00 1.02 H new ATOM 0 HB3 CYS A2153 -4.718 2.177 -0.758 1.00 1.02 H new ATOM 425 N PRO A2154 -6.687 2.338 1.462 1.00 1.07 N ATOM 426 CA PRO A2154 -6.898 1.445 2.618 1.00 1.14 C ATOM 427 C PRO A2154 -5.819 0.368 2.680 1.00 1.16 C ATOM 428 O PRO A2154 -4.828 0.417 1.979 1.00 1.14 O ATOM 429 CB PRO A2154 -8.257 0.789 2.364 1.00 1.13 C ATOM 430 CG PRO A2154 -8.769 1.281 0.987 1.00 1.06 C ATOM 431 CD PRO A2154 -7.758 2.307 0.452 1.00 1.03 C ATOM 0 HA PRO A2154 -6.859 1.993 3.559 1.00 1.14 H new ATOM 0 HB2 PRO A2154 -8.165 -0.297 2.372 1.00 1.13 H new ATOM 0 HB3 PRO A2154 -8.963 1.054 3.151 1.00 1.13 H new ATOM 0 HG2 PRO A2154 -8.868 0.445 0.295 1.00 1.06 H new ATOM 0 HG3 PRO A2154 -9.756 1.732 1.085 1.00 1.06 H new ATOM 0 HD2 PRO A2154 -7.373 2.012 -0.524 1.00 1.03 H new ATOM 0 HD3 PRO A2154 -8.216 3.288 0.331 1.00 1.03 H new ATOM 439 N PHE A2155 -6.025 -0.620 3.505 1.00 1.20 N ATOM 440 CA PHE A2155 -5.034 -1.724 3.608 1.00 1.23 C ATOM 441 C PHE A2155 -5.419 -2.806 2.604 1.00 1.17 C ATOM 442 O PHE A2155 -6.332 -3.578 2.820 1.00 1.18 O ATOM 443 CB PHE A2155 -5.042 -2.300 5.027 1.00 1.33 C ATOM 444 CG PHE A2155 -3.880 -3.252 5.198 1.00 1.47 C ATOM 445 CD1 PHE A2155 -2.678 -3.027 4.514 1.00 2.12 C ATOM 446 CD2 PHE A2155 -4.005 -4.360 6.046 1.00 1.79 C ATOM 447 CE1 PHE A2155 -1.604 -3.910 4.677 1.00 2.29 C ATOM 448 CE2 PHE A2155 -2.930 -5.242 6.208 1.00 1.93 C ATOM 449 CZ PHE A2155 -1.730 -5.017 5.524 1.00 1.85 C ATOM 0 H PHE A2155 -6.839 -0.710 4.113 1.00 1.20 H new ATOM 0 HA PHE A2155 -4.032 -1.352 3.392 1.00 1.23 H new ATOM 0 HB2 PHE A2155 -4.974 -1.494 5.757 1.00 1.33 H new ATOM 0 HB3 PHE A2155 -5.981 -2.821 5.213 1.00 1.33 H new ATOM 0 HD1 PHE A2155 -2.580 -2.172 3.861 1.00 2.12 H new ATOM 0 HD2 PHE A2155 -4.931 -4.534 6.575 1.00 1.79 H new ATOM 0 HE1 PHE A2155 -0.678 -3.737 4.149 1.00 2.29 H new ATOM 0 HE2 PHE A2155 -3.027 -6.097 6.861 1.00 1.93 H new ATOM 0 HZ PHE A2155 -0.901 -5.698 5.650 1.00 1.85 H new ATOM 459 N GLY A2156 -4.744 -2.847 1.493 1.00 1.13 N ATOM 460 CA GLY A2156 -5.078 -3.851 0.449 1.00 1.09 C ATOM 461 C GLY A2156 -5.193 -3.126 -0.886 1.00 1.03 C ATOM 462 O GLY A2156 -5.234 -3.733 -1.937 1.00 1.00 O ATOM 0 H GLY A2156 -3.970 -2.224 1.261 1.00 1.13 H new ATOM 0 HA2 GLY A2156 -4.307 -4.619 0.399 1.00 1.09 H new ATOM 0 HA3 GLY A2156 -6.014 -4.354 0.691 1.00 1.09 H new ATOM 466 N TYR A2157 -5.246 -1.821 -0.847 1.00 1.03 N ATOM 467 CA TYR A2157 -5.358 -1.044 -2.108 1.00 0.98 C ATOM 468 C TYR A2157 -4.046 -0.312 -2.390 1.00 1.01 C ATOM 469 O TYR A2157 -3.045 -0.526 -1.736 1.00 1.08 O ATOM 470 CB TYR A2157 -6.477 -0.020 -1.968 1.00 0.98 C ATOM 471 CG TYR A2157 -7.805 -0.716 -2.080 1.00 0.96 C ATOM 472 CD1 TYR A2157 -8.141 -1.729 -1.177 1.00 1.57 C ATOM 473 CD2 TYR A2157 -8.697 -0.350 -3.090 1.00 1.50 C ATOM 474 CE1 TYR A2157 -9.374 -2.379 -1.284 1.00 1.58 C ATOM 475 CE2 TYR A2157 -9.929 -0.997 -3.200 1.00 1.50 C ATOM 476 CZ TYR A2157 -10.271 -2.013 -2.297 1.00 0.96 C ATOM 477 OH TYR A2157 -11.489 -2.651 -2.405 1.00 0.98 O ATOM 0 H TYR A2157 -5.216 -1.262 0.006 1.00 1.03 H new ATOM 0 HA TYR A2157 -5.574 -1.726 -2.930 1.00 0.98 H new ATOM 0 HB2 TYR A2157 -6.401 0.490 -1.008 1.00 0.98 H new ATOM 0 HB3 TYR A2157 -6.387 0.742 -2.742 1.00 0.98 H new ATOM 0 HD1 TYR A2157 -7.448 -2.009 -0.397 1.00 1.57 H new ATOM 0 HD2 TYR A2157 -8.434 0.433 -3.786 1.00 1.50 H new ATOM 0 HE1 TYR A2157 -9.635 -3.162 -0.587 1.00 1.58 H new ATOM 0 HE2 TYR A2157 -10.619 -0.715 -3.981 1.00 1.50 H new ATOM 0 HH TYR A2157 -11.891 -2.443 -3.274 1.00 0.98 H new ATOM 487 N ILE A2158 -4.052 0.554 -3.366 1.00 0.97 N ATOM 488 CA ILE A2158 -2.814 1.312 -3.707 1.00 1.00 C ATOM 489 C ILE A2158 -3.195 2.603 -4.430 1.00 0.95 C ATOM 490 O ILE A2158 -4.337 3.014 -4.427 1.00 0.92 O ATOM 491 CB ILE A2158 -1.929 0.464 -4.622 1.00 1.02 C ATOM 492 CG1 ILE A2158 -2.549 0.407 -6.021 1.00 0.97 C ATOM 493 CG2 ILE A2158 -1.818 -0.948 -4.055 1.00 1.08 C ATOM 494 CD1 ILE A2158 -3.971 -0.144 -5.930 1.00 0.96 C ATOM 0 H ILE A2158 -4.864 0.770 -3.944 1.00 0.97 H new ATOM 0 HA ILE A2158 -2.270 1.548 -2.792 1.00 1.00 H new ATOM 0 HB ILE A2158 -0.936 0.909 -4.683 1.00 1.02 H new ATOM 0 HG12 ILE A2158 -2.562 1.402 -6.465 1.00 0.97 H new ATOM 0 HG13 ILE A2158 -1.945 -0.225 -6.672 1.00 0.97 H new ATOM 0 HG21 ILE A2158 -1.187 -1.553 -4.706 1.00 1.08 H new ATOM 0 HG22 ILE A2158 -1.377 -0.907 -3.059 1.00 1.08 H new ATOM 0 HG23 ILE A2158 -2.810 -1.395 -3.994 1.00 1.08 H new ATOM 0 HD11 ILE A2158 -4.410 -0.184 -6.927 1.00 0.96 H new ATOM 0 HD12 ILE A2158 -3.946 -1.147 -5.504 1.00 0.96 H new ATOM 0 HD13 ILE A2158 -4.573 0.505 -5.294 1.00 0.96 H new ATOM 506 N LEU A2159 -2.247 3.242 -5.054 1.00 0.95 N ATOM 507 CA LEU A2159 -2.554 4.504 -5.782 1.00 0.92 C ATOM 508 C LEU A2159 -1.801 4.521 -7.114 1.00 0.94 C ATOM 509 O LEU A2159 -0.594 4.389 -7.159 1.00 1.00 O ATOM 510 CB LEU A2159 -2.124 5.703 -4.937 1.00 0.93 C ATOM 511 CG LEU A2159 -2.638 6.989 -5.585 1.00 0.89 C ATOM 512 CD1 LEU A2159 -4.161 7.055 -5.457 1.00 0.87 C ATOM 513 CD2 LEU A2159 -2.015 8.197 -4.883 1.00 0.92 C ATOM 0 H LEU A2159 -1.272 2.945 -5.092 1.00 0.95 H new ATOM 0 HA LEU A2159 -3.626 4.561 -5.969 1.00 0.92 H new ATOM 0 HB2 LEU A2159 -2.518 5.609 -3.925 1.00 0.93 H new ATOM 0 HB3 LEU A2159 -1.038 5.733 -4.854 1.00 0.93 H new ATOM 0 HG LEU A2159 -2.363 6.998 -6.640 1.00 0.89 H new ATOM 0 HD11 LEU A2159 -4.526 7.972 -5.919 1.00 0.87 H new ATOM 0 HD12 LEU A2159 -4.606 6.195 -5.957 1.00 0.87 H new ATOM 0 HD13 LEU A2159 -4.438 7.045 -4.403 1.00 0.87 H new ATOM 0 HD21 LEU A2159 -2.381 9.114 -5.344 1.00 0.92 H new ATOM 0 HD22 LEU A2159 -2.290 8.187 -3.828 1.00 0.92 H new ATOM 0 HD23 LEU A2159 -0.930 8.152 -4.976 1.00 0.92 H new ATOM 525 N ALA A2160 -2.507 4.682 -8.198 1.00 0.93 N ATOM 526 CA ALA A2160 -1.841 4.707 -9.530 1.00 0.97 C ATOM 527 C ALA A2160 -1.685 6.156 -9.994 1.00 0.97 C ATOM 528 O ALA A2160 -2.147 6.532 -11.053 1.00 1.13 O ATOM 529 CB ALA A2160 -2.699 3.940 -10.538 1.00 0.99 C ATOM 0 H ALA A2160 -3.520 4.798 -8.219 1.00 0.93 H new ATOM 0 HA ALA A2160 -0.858 4.241 -9.456 1.00 0.97 H new ATOM 0 HB1 ALA A2160 -2.215 3.956 -11.514 1.00 0.99 H new ATOM 0 HB2 ALA A2160 -2.814 2.908 -10.207 1.00 0.99 H new ATOM 0 HB3 ALA A2160 -3.680 4.409 -10.612 1.00 0.99 H new ATOM 535 N GLY A2161 -1.039 6.974 -9.209 1.00 1.02 N ATOM 536 CA GLY A2161 -0.857 8.398 -9.607 1.00 1.03 C ATOM 537 C GLY A2161 -2.079 9.208 -9.171 1.00 0.95 C ATOM 538 O GLY A2161 -2.093 10.420 -9.248 1.00 1.00 O ATOM 0 H GLY A2161 -0.630 6.718 -8.310 1.00 1.02 H new ATOM 0 HA2 GLY A2161 0.044 8.803 -9.147 1.00 1.03 H new ATOM 0 HA3 GLY A2161 -0.725 8.471 -10.686 1.00 1.03 H new ATOM 542 N ASN A2162 -3.106 8.546 -8.712 1.00 0.88 N ATOM 543 CA ASN A2162 -4.327 9.276 -8.271 1.00 0.83 C ATOM 544 C ASN A2162 -5.479 8.284 -8.095 1.00 0.80 C ATOM 545 O ASN A2162 -6.100 8.217 -7.052 1.00 0.81 O ATOM 546 CB ASN A2162 -4.705 10.319 -9.321 1.00 0.84 C ATOM 547 CG ASN A2162 -4.580 11.720 -8.719 1.00 1.46 C ATOM 548 OD1 ASN A2162 -4.365 11.866 -7.532 1.00 2.13 O ATOM 549 ND2 ASN A2162 -4.704 12.763 -9.493 1.00 2.04 N ATOM 0 H ASN A2162 -3.152 7.531 -8.624 1.00 0.88 H new ATOM 0 HA ASN A2162 -4.130 9.774 -7.322 1.00 0.83 H new ATOM 0 HB2 ASN A2162 -4.055 10.226 -10.191 1.00 0.84 H new ATOM 0 HB3 ASN A2162 -5.725 10.150 -9.666 1.00 0.84 H new ATOM 0 HD21 ASN A2162 -4.620 13.701 -9.102 1.00 2.04 H new ATOM 0 HD22 ASN A2162 -4.884 12.640 -10.489 1.00 2.04 H new ATOM 556 N GLU A2163 -5.768 7.510 -9.105 1.00 0.82 N ATOM 557 CA GLU A2163 -6.878 6.521 -8.995 1.00 0.82 C ATOM 558 C GLU A2163 -6.518 5.465 -7.948 1.00 0.82 C ATOM 559 O GLU A2163 -5.516 4.788 -8.054 1.00 0.92 O ATOM 560 CB GLU A2163 -7.093 5.843 -10.349 1.00 0.88 C ATOM 561 CG GLU A2163 -8.292 4.897 -10.260 1.00 0.93 C ATOM 562 CD GLU A2163 -8.599 4.328 -11.646 1.00 1.28 C ATOM 563 OE1 GLU A2163 -8.189 4.938 -12.620 1.00 1.86 O ATOM 564 OE2 GLU A2163 -9.238 3.290 -11.711 1.00 1.83 O ATOM 0 H GLU A2163 -5.283 7.520 -10.002 1.00 0.82 H new ATOM 0 HA GLU A2163 -7.792 7.033 -8.696 1.00 0.82 H new ATOM 0 HB2 GLU A2163 -7.265 6.594 -11.121 1.00 0.88 H new ATOM 0 HB3 GLU A2163 -6.199 5.289 -10.636 1.00 0.88 H new ATOM 0 HG2 GLU A2163 -8.078 4.087 -9.562 1.00 0.93 H new ATOM 0 HG3 GLU A2163 -9.161 5.430 -9.874 1.00 0.93 H new ATOM 571 N CYS A2164 -7.330 5.319 -6.938 1.00 0.81 N ATOM 572 CA CYS A2164 -7.036 4.309 -5.882 1.00 0.82 C ATOM 573 C CYS A2164 -7.825 3.027 -6.166 1.00 0.83 C ATOM 574 O CYS A2164 -8.986 3.067 -6.520 1.00 0.86 O ATOM 575 CB CYS A2164 -7.448 4.871 -4.520 1.00 0.85 C ATOM 576 SG CYS A2164 -6.031 4.846 -3.395 1.00 0.97 S ATOM 0 H CYS A2164 -8.186 5.856 -6.798 1.00 0.81 H new ATOM 0 HA CYS A2164 -5.970 4.083 -5.878 1.00 0.82 H new ATOM 0 HB2 CYS A2164 -7.817 5.891 -4.633 1.00 0.85 H new ATOM 0 HB3 CYS A2164 -8.265 4.281 -4.104 1.00 0.85 H new ATOM 581 N VAL A2165 -7.203 1.888 -6.014 1.00 0.82 N ATOM 582 CA VAL A2165 -7.918 0.605 -6.275 1.00 0.84 C ATOM 583 C VAL A2165 -7.229 -0.528 -5.509 1.00 0.81 C ATOM 584 O VAL A2165 -6.435 -0.294 -4.622 1.00 0.80 O ATOM 585 CB VAL A2165 -7.894 0.304 -7.774 1.00 0.85 C ATOM 586 CG1 VAL A2165 -9.026 1.067 -8.464 1.00 0.92 C ATOM 587 CG2 VAL A2165 -6.551 0.744 -8.361 1.00 0.83 C ATOM 0 H VAL A2165 -6.231 1.791 -5.720 1.00 0.82 H new ATOM 0 HA VAL A2165 -8.952 0.689 -5.941 1.00 0.84 H new ATOM 0 HB VAL A2165 -8.027 -0.766 -7.933 1.00 0.85 H new ATOM 0 HG11 VAL A2165 -9.010 0.853 -9.533 1.00 0.92 H new ATOM 0 HG12 VAL A2165 -9.983 0.755 -8.046 1.00 0.92 H new ATOM 0 HG13 VAL A2165 -8.893 2.137 -8.306 1.00 0.92 H new ATOM 0 HG21 VAL A2165 -6.533 0.530 -9.430 1.00 0.83 H new ATOM 0 HG22 VAL A2165 -6.418 1.814 -8.203 1.00 0.83 H new ATOM 0 HG23 VAL A2165 -5.744 0.202 -7.869 1.00 0.83 H new ATOM 597 N ASP A2166 -7.528 -1.756 -5.836 1.00 0.82 N ATOM 598 CA ASP A2166 -6.888 -2.893 -5.113 1.00 0.80 C ATOM 599 C ASP A2166 -5.592 -3.297 -5.822 1.00 0.75 C ATOM 600 O ASP A2166 -5.419 -3.068 -7.003 1.00 0.80 O ATOM 601 CB ASP A2166 -7.845 -4.085 -5.083 1.00 0.87 C ATOM 602 CG ASP A2166 -7.668 -4.845 -3.768 1.00 1.06 C ATOM 603 OD1 ASP A2166 -7.787 -4.221 -2.726 1.00 1.33 O ATOM 604 OD2 ASP A2166 -7.415 -6.037 -3.824 1.00 1.20 O ATOM 0 H ASP A2166 -8.185 -2.021 -6.570 1.00 0.82 H new ATOM 0 HA ASP A2166 -6.659 -2.584 -4.093 1.00 0.80 H new ATOM 0 HB2 ASP A2166 -8.875 -3.741 -5.182 1.00 0.87 H new ATOM 0 HB3 ASP A2166 -7.647 -4.746 -5.927 1.00 0.87 H new ATOM 609 N THR A2167 -4.682 -3.902 -5.107 1.00 0.73 N ATOM 610 CA THR A2167 -3.397 -4.328 -5.730 1.00 0.69 C ATOM 611 C THR A2167 -3.455 -5.825 -6.043 1.00 0.61 C ATOM 612 O THR A2167 -4.457 -6.475 -5.820 1.00 0.65 O ATOM 613 CB THR A2167 -2.247 -4.067 -4.756 1.00 0.73 C ATOM 614 OG1 THR A2167 -1.009 -4.288 -5.415 1.00 0.75 O ATOM 615 CG2 THR A2167 -2.366 -5.010 -3.558 1.00 0.73 C ATOM 0 H THR A2167 -4.774 -4.120 -4.115 1.00 0.73 H new ATOM 0 HA THR A2167 -3.237 -3.764 -6.649 1.00 0.69 H new ATOM 0 HB THR A2167 -2.293 -3.035 -4.408 1.00 0.73 H new ATOM 0 HG1 THR A2167 -0.272 -4.119 -4.792 1.00 0.75 H new ATOM 0 HG21 THR A2167 -1.546 -4.823 -2.865 1.00 0.73 H new ATOM 0 HG22 THR A2167 -3.316 -4.837 -3.052 1.00 0.73 H new ATOM 0 HG23 THR A2167 -2.321 -6.043 -3.902 1.00 0.73 H new ATOM 623 N ASP A2168 -2.386 -6.380 -6.547 1.00 0.61 N ATOM 624 CA ASP A2168 -2.381 -7.837 -6.859 1.00 0.56 C ATOM 625 C ASP A2168 -1.670 -8.587 -5.733 1.00 0.54 C ATOM 626 O ASP A2168 -0.460 -8.693 -5.711 1.00 0.59 O ATOM 627 CB ASP A2168 -1.646 -8.084 -8.178 1.00 0.60 C ATOM 628 CG ASP A2168 -1.508 -9.590 -8.408 1.00 0.58 C ATOM 629 OD1 ASP A2168 -1.967 -10.344 -7.564 1.00 0.53 O ATOM 630 OD2 ASP A2168 -0.947 -9.966 -9.424 1.00 0.66 O ATOM 0 H ASP A2168 -1.517 -5.888 -6.756 1.00 0.61 H new ATOM 0 HA ASP A2168 -3.408 -8.192 -6.951 1.00 0.56 H new ATOM 0 HB2 ASP A2168 -2.193 -7.628 -9.003 1.00 0.60 H new ATOM 0 HB3 ASP A2168 -0.661 -7.617 -8.151 1.00 0.60 H new ATOM 635 N GLU A2169 -2.412 -9.105 -4.795 1.00 0.52 N ATOM 636 CA GLU A2169 -1.782 -9.843 -3.672 1.00 0.53 C ATOM 637 C GLU A2169 -1.184 -11.151 -4.196 1.00 0.51 C ATOM 638 O GLU A2169 -0.173 -11.622 -3.713 1.00 0.59 O ATOM 639 CB GLU A2169 -2.841 -10.132 -2.609 1.00 0.52 C ATOM 640 CG GLU A2169 -2.948 -8.931 -1.667 1.00 0.64 C ATOM 641 CD GLU A2169 -3.850 -7.870 -2.301 1.00 0.71 C ATOM 642 OE1 GLU A2169 -3.446 -7.298 -3.300 1.00 1.30 O ATOM 643 OE2 GLU A2169 -4.931 -7.649 -1.780 1.00 1.25 O ATOM 0 H GLU A2169 -3.430 -9.048 -4.760 1.00 0.52 H new ATOM 0 HA GLU A2169 -0.986 -9.244 -3.230 1.00 0.53 H new ATOM 0 HB2 GLU A2169 -3.804 -10.326 -3.081 1.00 0.52 H new ATOM 0 HB3 GLU A2169 -2.575 -11.028 -2.047 1.00 0.52 H new ATOM 0 HG2 GLU A2169 -3.355 -9.244 -0.705 1.00 0.64 H new ATOM 0 HG3 GLU A2169 -1.959 -8.516 -1.474 1.00 0.64 H new ATOM 650 N CYS A2170 -1.795 -11.735 -5.191 1.00 0.47 N ATOM 651 CA CYS A2170 -1.264 -12.998 -5.763 1.00 0.53 C ATOM 652 C CYS A2170 0.090 -12.720 -6.420 1.00 0.73 C ATOM 653 O CYS A2170 0.807 -13.624 -6.801 1.00 0.86 O ATOM 654 CB CYS A2170 -2.263 -13.518 -6.803 1.00 0.58 C ATOM 655 SG CYS A2170 -1.426 -14.548 -8.040 1.00 0.79 S ATOM 0 H CYS A2170 -2.645 -11.386 -5.633 1.00 0.47 H new ATOM 0 HA CYS A2170 -1.129 -13.747 -4.982 1.00 0.53 H new ATOM 0 HB2 CYS A2170 -3.042 -14.097 -6.308 1.00 0.58 H new ATOM 0 HB3 CYS A2170 -2.754 -12.678 -7.294 1.00 0.58 H new ATOM 660 N SER A2171 0.445 -11.472 -6.551 1.00 0.79 N ATOM 661 CA SER A2171 1.752 -11.132 -7.181 1.00 1.00 C ATOM 662 C SER A2171 2.890 -11.466 -6.216 1.00 1.08 C ATOM 663 O SER A2171 4.050 -11.441 -6.577 1.00 1.26 O ATOM 664 CB SER A2171 1.786 -9.643 -7.510 1.00 1.14 C ATOM 665 OG SER A2171 2.045 -9.474 -8.897 1.00 1.36 O ATOM 0 H SER A2171 -0.113 -10.673 -6.249 1.00 0.79 H new ATOM 0 HA SER A2171 1.873 -11.711 -8.097 1.00 1.00 H new ATOM 0 HB2 SER A2171 0.836 -9.179 -7.247 1.00 1.14 H new ATOM 0 HB3 SER A2171 2.557 -9.146 -6.921 1.00 1.14 H new ATOM 0 HG SER A2171 1.206 -9.550 -9.398 1.00 1.36 H new ATOM 671 N VAL A2172 2.569 -11.778 -4.990 1.00 0.99 N ATOM 672 CA VAL A2172 3.633 -12.112 -4.003 1.00 1.14 C ATOM 673 C VAL A2172 3.905 -13.616 -4.037 1.00 1.08 C ATOM 674 O VAL A2172 4.915 -14.064 -4.542 1.00 1.24 O ATOM 675 CB VAL A2172 3.173 -11.708 -2.600 1.00 1.23 C ATOM 676 CG1 VAL A2172 4.328 -11.884 -1.612 1.00 1.49 C ATOM 677 CG2 VAL A2172 2.732 -10.243 -2.611 1.00 1.33 C ATOM 0 H VAL A2172 1.615 -11.816 -4.630 1.00 0.99 H new ATOM 0 HA VAL A2172 4.545 -11.572 -4.255 1.00 1.14 H new ATOM 0 HB VAL A2172 2.337 -12.338 -2.297 1.00 1.23 H new ATOM 0 HG11 VAL A2172 4.000 -11.596 -0.613 1.00 1.49 H new ATOM 0 HG12 VAL A2172 4.644 -12.927 -1.603 1.00 1.49 H new ATOM 0 HG13 VAL A2172 5.165 -11.254 -1.914 1.00 1.49 H new ATOM 0 HG21 VAL A2172 2.404 -9.954 -1.612 1.00 1.33 H new ATOM 0 HG22 VAL A2172 3.568 -9.613 -2.915 1.00 1.33 H new ATOM 0 HG23 VAL A2172 1.909 -10.116 -3.314 1.00 1.33 H new ATOM 687 N GLY A2173 3.009 -14.396 -3.503 1.00 0.96 N ATOM 688 CA GLY A2173 3.211 -15.873 -3.501 1.00 1.02 C ATOM 689 C GLY A2173 1.892 -16.570 -3.160 1.00 1.01 C ATOM 690 O GLY A2173 1.156 -16.137 -2.298 1.00 1.81 O ATOM 0 H GLY A2173 2.144 -14.076 -3.067 1.00 0.96 H new ATOM 0 HA2 GLY A2173 3.567 -16.203 -4.477 1.00 1.02 H new ATOM 0 HA3 GLY A2173 3.976 -16.145 -2.774 1.00 1.02 H new ATOM 694 N ASN A2174 1.592 -17.650 -3.833 1.00 0.75 N ATOM 695 CA ASN A2174 0.323 -18.384 -3.554 1.00 0.62 C ATOM 696 C ASN A2174 0.047 -18.393 -2.047 1.00 0.57 C ATOM 697 O ASN A2174 0.613 -19.185 -1.320 1.00 0.66 O ATOM 698 CB ASN A2174 0.453 -19.824 -4.056 1.00 0.72 C ATOM 699 CG ASN A2174 1.543 -20.547 -3.267 1.00 1.25 C ATOM 700 OD1 ASN A2174 2.627 -20.027 -3.088 1.00 2.03 O ATOM 701 ND2 ASN A2174 1.300 -21.733 -2.783 1.00 1.72 N ATOM 0 H ASN A2174 2.173 -18.056 -4.566 1.00 0.75 H new ATOM 0 HA ASN A2174 -0.501 -17.887 -4.066 1.00 0.62 H new ATOM 0 HB2 ASN A2174 -0.497 -20.346 -3.944 1.00 0.72 H new ATOM 0 HB3 ASN A2174 0.696 -19.829 -5.119 1.00 0.72 H new ATOM 0 HD21 ASN A2174 2.020 -22.225 -2.254 1.00 1.72 H new ATOM 0 HD22 ASN A2174 0.390 -22.169 -2.934 1.00 1.72 H new ATOM 708 N PRO A2175 -0.821 -17.509 -1.623 1.00 0.50 N ATOM 709 CA PRO A2175 -1.192 -17.397 -0.203 1.00 0.60 C ATOM 710 C PRO A2175 -1.864 -18.689 0.265 1.00 0.62 C ATOM 711 O PRO A2175 -1.870 -19.008 1.437 1.00 0.73 O ATOM 712 CB PRO A2175 -2.183 -16.228 -0.145 1.00 0.66 C ATOM 713 CG PRO A2175 -2.386 -15.711 -1.592 1.00 0.58 C ATOM 714 CD PRO A2175 -1.496 -16.552 -2.518 1.00 0.47 C ATOM 0 HA PRO A2175 -0.328 -17.233 0.441 1.00 0.60 H new ATOM 0 HB2 PRO A2175 -3.132 -16.552 0.282 1.00 0.66 H new ATOM 0 HB3 PRO A2175 -1.800 -15.433 0.495 1.00 0.66 H new ATOM 0 HG2 PRO A2175 -3.432 -15.797 -1.886 1.00 0.58 H new ATOM 0 HG3 PRO A2175 -2.121 -14.656 -1.662 1.00 0.58 H new ATOM 0 HD2 PRO A2175 -2.088 -17.067 -3.275 1.00 0.47 H new ATOM 0 HD3 PRO A2175 -0.775 -15.929 -3.047 1.00 0.47 H new ATOM 722 N CYS A2176 -2.432 -19.437 -0.644 1.00 0.58 N ATOM 723 CA CYS A2176 -3.102 -20.706 -0.248 1.00 0.67 C ATOM 724 C CYS A2176 -2.101 -21.602 0.484 1.00 0.77 C ATOM 725 O CYS A2176 -2.462 -22.581 1.105 1.00 0.99 O ATOM 726 CB CYS A2176 -3.618 -21.433 -1.491 1.00 0.69 C ATOM 727 SG CYS A2176 -5.423 -21.547 -1.413 1.00 0.77 S ATOM 0 H CYS A2176 -2.460 -19.223 -1.641 1.00 0.58 H new ATOM 0 HA CYS A2176 -3.941 -20.478 0.409 1.00 0.67 H new ATOM 0 HB2 CYS A2176 -3.315 -20.898 -2.391 1.00 0.69 H new ATOM 0 HB3 CYS A2176 -3.182 -22.430 -1.550 1.00 0.69 H new ATOM 732 N GLY A2177 -0.844 -21.282 0.415 1.00 0.78 N ATOM 733 CA GLY A2177 0.165 -22.122 1.109 1.00 0.91 C ATOM 734 C GLY A2177 0.803 -23.086 0.108 1.00 1.01 C ATOM 735 O GLY A2177 1.967 -23.419 0.208 1.00 1.15 O ATOM 0 H GLY A2177 -0.471 -20.478 -0.090 1.00 0.78 H new ATOM 0 HA2 GLY A2177 0.930 -21.491 1.560 1.00 0.91 H new ATOM 0 HA3 GLY A2177 -0.306 -22.680 1.918 1.00 0.91 H new ATOM 739 N ASN A2178 0.047 -23.544 -0.854 1.00 0.95 N ATOM 740 CA ASN A2178 0.612 -24.493 -1.856 1.00 1.06 C ATOM 741 C ASN A2178 -0.167 -24.400 -3.173 1.00 1.00 C ATOM 742 O ASN A2178 0.396 -24.518 -4.243 1.00 1.05 O ATOM 743 CB ASN A2178 0.519 -25.917 -1.313 1.00 1.18 C ATOM 744 CG ASN A2178 1.914 -26.544 -1.280 1.00 1.50 C ATOM 745 OD1 ASN A2178 2.146 -27.623 -1.976 1.00 1.91 O flip ATOM 746 ND2 ASN A2178 2.801 -26.048 -0.615 1.00 2.06 N flip ATOM 0 H ASN A2178 -0.935 -23.303 -0.989 1.00 0.95 H new ATOM 0 HA ASN A2178 1.654 -24.234 -2.041 1.00 1.06 H new ATOM 0 HB2 ASN A2178 0.089 -25.908 -0.311 1.00 1.18 H new ATOM 0 HB3 ASN A2178 -0.144 -26.513 -1.939 1.00 1.18 H new ATOM 0 HD21 ASN A2178 2.620 -25.204 -0.071 1.00 2.06 H new ATOM 0 HD22 ASN A2178 3.727 -26.475 -0.601 1.00 2.06 H new ATOM 753 N GLY A2179 -1.456 -24.200 -3.108 1.00 0.90 N ATOM 754 CA GLY A2179 -2.260 -24.112 -4.361 1.00 0.86 C ATOM 755 C GLY A2179 -1.728 -22.981 -5.246 1.00 0.82 C ATOM 756 O GLY A2179 -0.579 -22.975 -5.640 1.00 0.94 O ATOM 0 H GLY A2179 -1.986 -24.094 -2.243 1.00 0.90 H new ATOM 0 HA2 GLY A2179 -2.214 -25.059 -4.900 1.00 0.86 H new ATOM 0 HA3 GLY A2179 -3.308 -23.933 -4.119 1.00 0.86 H new ATOM 760 N THR A2180 -2.557 -22.024 -5.566 1.00 0.72 N ATOM 761 CA THR A2180 -2.098 -20.898 -6.429 1.00 0.69 C ATOM 762 C THR A2180 -2.721 -19.591 -5.936 1.00 0.57 C ATOM 763 O THR A2180 -3.765 -19.587 -5.314 1.00 0.54 O ATOM 764 CB THR A2180 -2.532 -21.154 -7.874 1.00 0.76 C ATOM 765 OG1 THR A2180 -3.771 -21.849 -7.880 1.00 0.77 O ATOM 766 CG2 THR A2180 -1.470 -21.995 -8.585 1.00 0.91 C ATOM 0 H THR A2180 -3.531 -21.973 -5.267 1.00 0.72 H new ATOM 0 HA THR A2180 -1.012 -20.824 -6.382 1.00 0.69 H new ATOM 0 HB THR A2180 -2.647 -20.202 -8.393 1.00 0.76 H new ATOM 0 HG1 THR A2180 -4.050 -22.012 -8.805 1.00 0.77 H new ATOM 0 HG21 THR A2180 -1.779 -22.177 -9.614 1.00 0.91 H new ATOM 0 HG22 THR A2180 -0.520 -21.461 -8.581 1.00 0.91 H new ATOM 0 HG23 THR A2180 -1.353 -22.947 -8.067 1.00 0.91 H new ATOM 774 N CYS A2181 -2.088 -18.480 -6.202 1.00 0.54 N ATOM 775 CA CYS A2181 -2.650 -17.183 -5.738 1.00 0.44 C ATOM 776 C CYS A2181 -3.585 -16.602 -6.796 1.00 0.42 C ATOM 777 O CYS A2181 -3.526 -16.942 -7.960 1.00 0.50 O ATOM 778 CB CYS A2181 -1.519 -16.184 -5.487 1.00 0.47 C ATOM 779 SG CYS A2181 -0.516 -16.010 -6.982 1.00 0.55 S ATOM 0 H CYS A2181 -1.210 -18.416 -6.718 1.00 0.54 H new ATOM 0 HA CYS A2181 -3.204 -17.360 -4.816 1.00 0.44 H new ATOM 0 HB2 CYS A2181 -1.932 -15.217 -5.200 1.00 0.47 H new ATOM 0 HB3 CYS A2181 -0.898 -16.524 -4.658 1.00 0.47 H new ATOM 784 N LYS A2182 -4.435 -15.708 -6.385 1.00 0.37 N ATOM 785 CA LYS A2182 -5.379 -15.058 -7.328 1.00 0.41 C ATOM 786 C LYS A2182 -5.536 -13.603 -6.887 1.00 0.38 C ATOM 787 O LYS A2182 -5.289 -13.271 -5.745 1.00 0.34 O ATOM 788 CB LYS A2182 -6.730 -15.774 -7.270 1.00 0.49 C ATOM 789 CG LYS A2182 -7.671 -15.200 -8.332 1.00 0.64 C ATOM 790 CD LYS A2182 -7.789 -16.184 -9.498 1.00 1.17 C ATOM 791 CE LYS A2182 -9.176 -16.063 -10.130 1.00 1.57 C ATOM 792 NZ LYS A2182 -9.116 -16.513 -11.550 1.00 2.05 N ATOM 0 H LYS A2182 -4.516 -15.395 -5.418 1.00 0.37 H new ATOM 0 HA LYS A2182 -5.007 -15.107 -8.351 1.00 0.41 H new ATOM 0 HB2 LYS A2182 -6.592 -16.843 -7.434 1.00 0.49 H new ATOM 0 HB3 LYS A2182 -7.171 -15.657 -6.280 1.00 0.49 H new ATOM 0 HG2 LYS A2182 -8.654 -15.014 -7.899 1.00 0.64 H new ATOM 0 HG3 LYS A2182 -7.293 -14.242 -8.688 1.00 0.64 H new ATOM 0 HD2 LYS A2182 -7.020 -15.977 -10.242 1.00 1.17 H new ATOM 0 HD3 LYS A2182 -7.626 -17.203 -9.146 1.00 1.17 H new ATOM 0 HE2 LYS A2182 -9.894 -16.668 -9.576 1.00 1.57 H new ATOM 0 HE3 LYS A2182 -9.522 -15.031 -10.079 1.00 1.57 H new ATOM 0 HZ1 LYS A2182 -10.059 -16.431 -11.980 1.00 2.05 H new ATOM 0 HZ2 LYS A2182 -8.443 -15.918 -12.075 1.00 2.05 H new ATOM 0 HZ3 LYS A2182 -8.804 -17.504 -11.587 1.00 2.05 H new ATOM 806 N ASN A2183 -5.933 -12.725 -7.761 1.00 0.44 N ATOM 807 CA ASN A2183 -6.079 -11.308 -7.339 1.00 0.46 C ATOM 808 C ASN A2183 -7.537 -11.030 -7.000 1.00 0.52 C ATOM 809 O ASN A2183 -8.442 -11.457 -7.689 1.00 0.59 O ATOM 810 CB ASN A2183 -5.622 -10.376 -8.462 1.00 0.51 C ATOM 811 CG ASN A2183 -5.532 -8.947 -7.929 1.00 0.55 C ATOM 812 OD1 ASN A2183 -5.413 -8.733 -6.738 1.00 0.54 O ATOM 813 ND2 ASN A2183 -5.587 -7.952 -8.769 1.00 0.64 N ATOM 0 H ASN A2183 -6.160 -12.923 -8.736 1.00 0.44 H new ATOM 0 HA ASN A2183 -5.460 -11.129 -6.460 1.00 0.46 H new ATOM 0 HB2 ASN A2183 -4.652 -10.696 -8.843 1.00 0.51 H new ATOM 0 HB3 ASN A2183 -6.323 -10.422 -9.296 1.00 0.51 H new ATOM 0 HD21 ASN A2183 -5.530 -6.993 -8.428 1.00 0.64 H new ATOM 0 HD22 ASN A2183 -5.687 -8.133 -9.768 1.00 0.64 H new ATOM 820 N VAL A2184 -7.772 -10.322 -5.935 1.00 0.56 N ATOM 821 CA VAL A2184 -9.168 -10.021 -5.540 1.00 0.64 C ATOM 822 C VAL A2184 -9.217 -8.646 -4.869 1.00 0.69 C ATOM 823 O VAL A2184 -8.253 -7.907 -4.881 1.00 0.64 O ATOM 824 CB VAL A2184 -9.655 -11.110 -4.580 1.00 0.65 C ATOM 825 CG1 VAL A2184 -9.395 -10.693 -3.132 1.00 0.65 C ATOM 826 CG2 VAL A2184 -11.150 -11.340 -4.795 1.00 0.74 C ATOM 0 H VAL A2184 -7.054 -9.938 -5.320 1.00 0.56 H new ATOM 0 HA VAL A2184 -9.817 -10.003 -6.416 1.00 0.64 H new ATOM 0 HB VAL A2184 -9.111 -12.034 -4.779 1.00 0.65 H new ATOM 0 HG11 VAL A2184 -9.746 -11.476 -2.459 1.00 0.65 H new ATOM 0 HG12 VAL A2184 -8.326 -10.539 -2.984 1.00 0.65 H new ATOM 0 HG13 VAL A2184 -9.928 -9.766 -2.919 1.00 0.65 H new ATOM 0 HG21 VAL A2184 -11.501 -12.115 -4.113 1.00 0.74 H new ATOM 0 HG22 VAL A2184 -11.692 -10.414 -4.602 1.00 0.74 H new ATOM 0 HG23 VAL A2184 -11.325 -11.655 -5.824 1.00 0.74 H new ATOM 836 N ILE A2185 -10.332 -8.291 -4.292 1.00 0.86 N ATOM 837 CA ILE A2185 -10.435 -6.958 -3.635 1.00 0.92 C ATOM 838 C ILE A2185 -10.349 -7.117 -2.115 1.00 0.93 C ATOM 839 O ILE A2185 -10.893 -8.043 -1.546 1.00 0.97 O ATOM 840 CB ILE A2185 -11.772 -6.315 -4.007 1.00 1.05 C ATOM 841 CG1 ILE A2185 -11.790 -6.012 -5.508 1.00 1.11 C ATOM 842 CG2 ILE A2185 -11.951 -5.014 -3.224 1.00 1.10 C ATOM 843 CD1 ILE A2185 -12.634 -7.063 -6.232 1.00 1.21 C ATOM 0 H ILE A2185 -11.174 -8.865 -4.247 1.00 0.86 H new ATOM 0 HA ILE A2185 -9.615 -6.325 -3.973 1.00 0.92 H new ATOM 0 HB ILE A2185 -12.584 -7.000 -3.762 1.00 1.05 H new ATOM 0 HG12 ILE A2185 -12.200 -5.017 -5.684 1.00 1.11 H new ATOM 0 HG13 ILE A2185 -10.774 -6.012 -5.902 1.00 1.11 H new ATOM 0 HG21 ILE A2185 -12.904 -4.557 -3.490 1.00 1.10 H new ATOM 0 HG22 ILE A2185 -11.937 -5.228 -2.155 1.00 1.10 H new ATOM 0 HG23 ILE A2185 -11.139 -4.328 -3.467 1.00 1.10 H new ATOM 0 HD11 ILE A2185 -12.646 -6.847 -7.300 1.00 1.21 H new ATOM 0 HD12 ILE A2185 -12.205 -8.051 -6.067 1.00 1.21 H new ATOM 0 HD13 ILE A2185 -13.653 -7.041 -5.845 1.00 1.21 H new ATOM 855 N GLY A2186 -9.673 -6.216 -1.454 1.00 0.94 N ATOM 856 CA GLY A2186 -9.553 -6.306 0.025 1.00 0.97 C ATOM 857 C GLY A2186 -8.690 -7.510 0.402 1.00 0.88 C ATOM 858 O GLY A2186 -8.641 -7.916 1.546 1.00 0.91 O ATOM 0 H GLY A2186 -9.198 -5.420 -1.879 1.00 0.94 H new ATOM 0 HA2 GLY A2186 -9.110 -5.392 0.419 1.00 0.97 H new ATOM 0 HA3 GLY A2186 -10.542 -6.401 0.474 1.00 0.97 H new ATOM 862 N GLY A2187 -8.005 -8.084 -0.549 1.00 0.79 N ATOM 863 CA GLY A2187 -7.143 -9.260 -0.239 1.00 0.71 C ATOM 864 C GLY A2187 -6.801 -9.997 -1.533 1.00 0.62 C ATOM 865 O GLY A2187 -6.213 -9.442 -2.440 1.00 0.66 O ATOM 0 H GLY A2187 -8.005 -7.790 -1.526 1.00 0.79 H new ATOM 0 HA2 GLY A2187 -6.230 -8.934 0.258 1.00 0.71 H new ATOM 0 HA3 GLY A2187 -7.658 -9.931 0.449 1.00 0.71 H new ATOM 869 N PHE A2188 -7.163 -11.246 -1.628 1.00 0.54 N ATOM 870 CA PHE A2188 -6.856 -12.017 -2.865 1.00 0.47 C ATOM 871 C PHE A2188 -7.594 -13.352 -2.828 1.00 0.45 C ATOM 872 O PHE A2188 -8.268 -13.678 -1.873 1.00 0.52 O ATOM 873 CB PHE A2188 -5.356 -12.292 -2.940 1.00 0.41 C ATOM 874 CG PHE A2188 -4.838 -12.550 -1.549 1.00 0.44 C ATOM 875 CD1 PHE A2188 -4.500 -11.477 -0.722 1.00 1.32 C ATOM 876 CD2 PHE A2188 -4.703 -13.863 -1.085 1.00 1.23 C ATOM 877 CE1 PHE A2188 -4.025 -11.713 0.574 1.00 1.35 C ATOM 878 CE2 PHE A2188 -4.228 -14.102 0.210 1.00 1.25 C ATOM 879 CZ PHE A2188 -3.889 -13.027 1.040 1.00 0.56 C ATOM 0 H PHE A2188 -7.658 -11.766 -0.903 1.00 0.54 H new ATOM 0 HA PHE A2188 -7.171 -11.438 -3.733 1.00 0.47 H new ATOM 0 HB2 PHE A2188 -5.162 -13.152 -3.580 1.00 0.41 H new ATOM 0 HB3 PHE A2188 -4.838 -11.441 -3.383 1.00 0.41 H new ATOM 0 HD1 PHE A2188 -4.605 -10.464 -1.082 1.00 1.32 H new ATOM 0 HD2 PHE A2188 -4.965 -14.692 -1.726 1.00 1.23 H new ATOM 0 HE1 PHE A2188 -3.764 -10.883 1.214 1.00 1.35 H new ATOM 0 HE2 PHE A2188 -4.123 -15.115 0.569 1.00 1.25 H new ATOM 0 HZ PHE A2188 -3.523 -13.211 2.039 1.00 0.56 H new ATOM 889 N GLU A2189 -7.451 -14.134 -3.856 1.00 0.40 N ATOM 890 CA GLU A2189 -8.122 -15.463 -3.881 1.00 0.44 C ATOM 891 C GLU A2189 -7.062 -16.541 -4.106 1.00 0.40 C ATOM 892 O GLU A2189 -6.039 -16.296 -4.707 1.00 0.65 O ATOM 893 CB GLU A2189 -9.150 -15.510 -5.012 1.00 0.53 C ATOM 894 CG GLU A2189 -10.369 -16.307 -4.549 1.00 0.62 C ATOM 895 CD GLU A2189 -11.646 -15.529 -4.872 1.00 0.94 C ATOM 896 OE1 GLU A2189 -11.538 -14.356 -5.188 1.00 1.56 O ATOM 897 OE2 GLU A2189 -12.711 -16.120 -4.796 1.00 1.52 O ATOM 0 H GLU A2189 -6.897 -13.912 -4.683 1.00 0.40 H new ATOM 0 HA GLU A2189 -8.635 -15.633 -2.935 1.00 0.44 H new ATOM 0 HB2 GLU A2189 -9.446 -14.499 -5.293 1.00 0.53 H new ATOM 0 HB3 GLU A2189 -8.713 -15.972 -5.898 1.00 0.53 H new ATOM 0 HG2 GLU A2189 -10.389 -17.279 -5.042 1.00 0.62 H new ATOM 0 HG3 GLU A2189 -10.307 -16.495 -3.477 1.00 0.62 H new ATOM 904 N CYS A2190 -7.286 -17.730 -3.625 1.00 0.51 N ATOM 905 CA CYS A2190 -6.271 -18.802 -3.821 1.00 0.53 C ATOM 906 C CYS A2190 -6.968 -20.160 -3.905 1.00 0.61 C ATOM 907 O CYS A2190 -7.938 -20.415 -3.219 1.00 0.72 O ATOM 908 CB CYS A2190 -5.290 -18.794 -2.644 1.00 0.54 C ATOM 909 SG CYS A2190 -6.031 -19.631 -1.220 1.00 0.82 S ATOM 0 H CYS A2190 -8.121 -18.006 -3.108 1.00 0.51 H new ATOM 0 HA CYS A2190 -5.726 -18.623 -4.748 1.00 0.53 H new ATOM 0 HB2 CYS A2190 -4.363 -19.292 -2.928 1.00 0.54 H new ATOM 0 HB3 CYS A2190 -5.033 -17.768 -2.381 1.00 0.54 H new ATOM 914 N THR A2191 -6.480 -21.035 -4.739 1.00 0.63 N ATOM 915 CA THR A2191 -7.112 -22.378 -4.866 1.00 0.75 C ATOM 916 C THR A2191 -6.102 -23.455 -4.464 1.00 0.78 C ATOM 917 O THR A2191 -5.354 -23.953 -5.281 1.00 0.84 O ATOM 918 CB THR A2191 -7.547 -22.603 -6.317 1.00 0.84 C ATOM 919 OG1 THR A2191 -8.515 -21.626 -6.676 1.00 0.92 O ATOM 920 CG2 THR A2191 -8.153 -24.000 -6.459 1.00 0.94 C ATOM 0 H THR A2191 -5.670 -20.878 -5.339 1.00 0.63 H new ATOM 0 HA THR A2191 -7.983 -22.433 -4.213 1.00 0.75 H new ATOM 0 HB THR A2191 -6.682 -22.517 -6.974 1.00 0.84 H new ATOM 0 HG1 THR A2191 -8.793 -21.767 -7.605 1.00 0.92 H new ATOM 0 HG21 THR A2191 -8.462 -24.159 -7.492 1.00 0.94 H new ATOM 0 HG22 THR A2191 -7.410 -24.749 -6.183 1.00 0.94 H new ATOM 0 HG23 THR A2191 -9.019 -24.089 -5.803 1.00 0.94 H new ATOM 928 N CYS A2192 -6.074 -23.817 -3.209 1.00 0.78 N ATOM 929 CA CYS A2192 -5.111 -24.862 -2.759 1.00 0.85 C ATOM 930 C CYS A2192 -5.195 -26.066 -3.687 1.00 0.96 C ATOM 931 O CYS A2192 -5.927 -26.075 -4.657 1.00 0.99 O ATOM 932 CB CYS A2192 -5.455 -25.323 -1.341 1.00 0.86 C ATOM 933 SG CYS A2192 -4.313 -24.573 -0.159 1.00 0.83 S ATOM 0 H CYS A2192 -6.675 -23.435 -2.478 1.00 0.78 H new ATOM 0 HA CYS A2192 -4.107 -24.438 -2.776 1.00 0.85 H new ATOM 0 HB2 CYS A2192 -6.480 -25.044 -1.097 1.00 0.86 H new ATOM 0 HB3 CYS A2192 -5.396 -26.410 -1.278 1.00 0.86 H new ATOM 938 N GLU A2193 -4.463 -27.092 -3.378 1.00 1.03 N ATOM 939 CA GLU A2193 -4.504 -28.316 -4.220 1.00 1.15 C ATOM 940 C GLU A2193 -5.933 -28.860 -4.215 1.00 1.19 C ATOM 941 O GLU A2193 -6.390 -29.413 -3.235 1.00 1.20 O ATOM 942 CB GLU A2193 -3.545 -29.359 -3.642 1.00 1.24 C ATOM 943 CG GLU A2193 -3.910 -30.747 -4.174 1.00 1.38 C ATOM 944 CD GLU A2193 -2.980 -31.793 -3.556 1.00 1.96 C ATOM 945 OE1 GLU A2193 -1.880 -31.429 -3.176 1.00 2.52 O ATOM 946 OE2 GLU A2193 -3.385 -32.941 -3.472 1.00 2.43 O ATOM 0 H GLU A2193 -3.835 -27.138 -2.576 1.00 1.03 H new ATOM 0 HA GLU A2193 -4.202 -28.085 -5.242 1.00 1.15 H new ATOM 0 HB2 GLU A2193 -2.518 -29.113 -3.914 1.00 1.24 H new ATOM 0 HB3 GLU A2193 -3.597 -29.351 -2.553 1.00 1.24 H new ATOM 0 HG2 GLU A2193 -4.947 -30.979 -3.932 1.00 1.38 H new ATOM 0 HG3 GLU A2193 -3.824 -30.766 -5.260 1.00 1.38 H new ATOM 953 N GLU A2194 -6.641 -28.690 -5.301 1.00 1.24 N ATOM 954 CA GLU A2194 -8.054 -29.174 -5.382 1.00 1.32 C ATOM 955 C GLU A2194 -8.323 -30.244 -4.319 1.00 1.41 C ATOM 956 O GLU A2194 -7.598 -31.213 -4.199 1.00 1.49 O ATOM 957 CB GLU A2194 -8.306 -29.767 -6.771 1.00 1.45 C ATOM 958 CG GLU A2194 -9.302 -28.887 -7.529 1.00 1.52 C ATOM 959 CD GLU A2194 -9.269 -29.243 -9.017 1.00 2.05 C ATOM 960 OE1 GLU A2194 -8.469 -30.086 -9.387 1.00 2.44 O ATOM 961 OE2 GLU A2194 -10.046 -28.667 -9.761 1.00 2.73 O ATOM 0 H GLU A2194 -6.298 -28.232 -6.145 1.00 1.24 H new ATOM 0 HA GLU A2194 -8.722 -28.331 -5.206 1.00 1.32 H new ATOM 0 HB2 GLU A2194 -7.369 -29.834 -7.325 1.00 1.45 H new ATOM 0 HB3 GLU A2194 -8.696 -30.781 -6.680 1.00 1.45 H new ATOM 0 HG2 GLU A2194 -10.307 -29.032 -7.132 1.00 1.52 H new ATOM 0 HG3 GLU A2194 -9.053 -27.835 -7.390 1.00 1.52 H new ATOM 968 N GLY A2195 -9.362 -30.072 -3.545 1.00 1.40 N ATOM 969 CA GLY A2195 -9.687 -31.068 -2.488 1.00 1.49 C ATOM 970 C GLY A2195 -9.707 -30.372 -1.130 1.00 1.40 C ATOM 971 O GLY A2195 -9.869 -30.998 -0.101 1.00 1.48 O ATOM 0 H GLY A2195 -10.001 -29.279 -3.602 1.00 1.40 H new ATOM 0 HA2 GLY A2195 -10.655 -31.526 -2.689 1.00 1.49 H new ATOM 0 HA3 GLY A2195 -8.949 -31.870 -2.488 1.00 1.49 H new ATOM 975 N PHE A2196 -9.537 -29.078 -1.117 1.00 1.25 N ATOM 976 CA PHE A2196 -9.540 -28.342 0.162 1.00 1.16 C ATOM 977 C PHE A2196 -10.663 -27.305 0.173 1.00 1.11 C ATOM 978 O PHE A2196 -11.575 -27.348 -0.628 1.00 1.18 O ATOM 979 CB PHE A2196 -8.195 -27.653 0.319 1.00 1.06 C ATOM 980 CG PHE A2196 -8.237 -26.268 -0.275 1.00 0.93 C ATOM 981 CD1 PHE A2196 -8.408 -26.104 -1.654 1.00 1.52 C ATOM 982 CD2 PHE A2196 -8.091 -25.147 0.551 1.00 1.48 C ATOM 983 CE1 PHE A2196 -8.432 -24.820 -2.204 1.00 1.45 C ATOM 984 CE2 PHE A2196 -8.111 -23.866 0.000 1.00 1.45 C ATOM 985 CZ PHE A2196 -8.282 -23.702 -1.377 1.00 0.77 C ATOM 0 H PHE A2196 -9.396 -28.502 -1.947 1.00 1.25 H new ATOM 0 HA PHE A2196 -9.707 -29.033 0.988 1.00 1.16 H new ATOM 0 HB2 PHE A2196 -7.931 -27.594 1.375 1.00 1.06 H new ATOM 0 HB3 PHE A2196 -7.419 -28.242 -0.171 1.00 1.06 H new ATOM 0 HD1 PHE A2196 -8.521 -26.968 -2.292 1.00 1.52 H new ATOM 0 HD2 PHE A2196 -7.963 -25.274 1.616 1.00 1.48 H new ATOM 0 HE1 PHE A2196 -8.566 -24.691 -3.268 1.00 1.45 H new ATOM 0 HE2 PHE A2196 -7.994 -23.002 0.637 1.00 1.45 H new ATOM 0 HZ PHE A2196 -8.298 -22.710 -1.804 1.00 0.77 H new ATOM 995 N GLU A2197 -10.602 -26.378 1.087 1.00 1.02 N ATOM 996 CA GLU A2197 -11.656 -25.336 1.175 1.00 0.99 C ATOM 997 C GLU A2197 -11.018 -23.987 1.521 1.00 0.86 C ATOM 998 O GLU A2197 -10.792 -23.689 2.677 1.00 0.84 O ATOM 999 CB GLU A2197 -12.634 -25.725 2.277 1.00 1.08 C ATOM 1000 CG GLU A2197 -13.809 -26.482 1.665 1.00 1.40 C ATOM 1001 CD GLU A2197 -15.029 -26.364 2.580 1.00 1.90 C ATOM 1002 OE1 GLU A2197 -14.843 -26.363 3.786 1.00 2.57 O ATOM 1003 OE2 GLU A2197 -16.129 -26.276 2.059 1.00 2.28 O ATOM 0 H GLU A2197 -9.860 -26.299 1.782 1.00 1.02 H new ATOM 0 HA GLU A2197 -12.176 -25.254 0.220 1.00 0.99 H new ATOM 0 HB2 GLU A2197 -12.134 -26.346 3.020 1.00 1.08 H new ATOM 0 HB3 GLU A2197 -12.990 -24.834 2.794 1.00 1.08 H new ATOM 0 HG2 GLU A2197 -14.041 -26.078 0.679 1.00 1.40 H new ATOM 0 HG3 GLU A2197 -13.546 -27.531 1.526 1.00 1.40 H new ATOM 1010 N PRO A2198 -10.748 -23.212 0.505 1.00 0.80 N ATOM 1011 CA PRO A2198 -10.134 -21.882 0.670 1.00 0.69 C ATOM 1012 C PRO A2198 -11.092 -20.926 1.384 1.00 0.73 C ATOM 1013 O PRO A2198 -12.027 -21.335 2.043 1.00 0.81 O ATOM 1014 CB PRO A2198 -9.884 -21.394 -0.760 1.00 0.67 C ATOM 1015 CG PRO A2198 -10.589 -22.383 -1.722 1.00 0.80 C ATOM 1016 CD PRO A2198 -11.027 -23.598 -0.890 1.00 0.86 C ATOM 0 HA PRO A2198 -9.224 -21.925 1.269 1.00 0.69 H new ATOM 0 HB2 PRO A2198 -10.274 -20.385 -0.894 1.00 0.67 H new ATOM 0 HB3 PRO A2198 -8.815 -21.353 -0.969 1.00 0.67 H new ATOM 0 HG2 PRO A2198 -11.450 -21.911 -2.195 1.00 0.80 H new ATOM 0 HG3 PRO A2198 -9.914 -22.688 -2.521 1.00 0.80 H new ATOM 0 HD2 PRO A2198 -12.084 -23.819 -1.037 1.00 0.86 H new ATOM 0 HD3 PRO A2198 -10.472 -24.493 -1.172 1.00 0.86 H new ATOM 1024 N GLY A2199 -10.862 -19.648 1.245 1.00 0.69 N ATOM 1025 CA GLY A2199 -11.749 -18.647 1.900 1.00 0.76 C ATOM 1026 C GLY A2199 -11.924 -17.447 0.966 1.00 0.75 C ATOM 1027 O GLY A2199 -11.504 -17.485 -0.174 1.00 0.70 O ATOM 0 H GLY A2199 -10.093 -19.254 0.703 1.00 0.69 H new ATOM 0 HA2 GLY A2199 -12.718 -19.093 2.125 1.00 0.76 H new ATOM 0 HA3 GLY A2199 -11.318 -18.326 2.848 1.00 0.76 H new ATOM 1031 N PRO A2200 -12.541 -16.417 1.480 1.00 0.81 N ATOM 1032 CA PRO A2200 -12.789 -15.184 0.712 1.00 0.83 C ATOM 1033 C PRO A2200 -11.467 -14.533 0.300 1.00 0.75 C ATOM 1034 O PRO A2200 -11.019 -14.670 -0.821 1.00 0.76 O ATOM 1035 CB PRO A2200 -13.562 -14.273 1.673 1.00 0.94 C ATOM 1036 CG PRO A2200 -13.703 -15.022 3.023 1.00 0.97 C ATOM 1037 CD PRO A2200 -13.040 -16.400 2.864 1.00 0.89 C ATOM 0 HA PRO A2200 -13.342 -15.375 -0.208 1.00 0.83 H new ATOM 0 HB2 PRO A2200 -13.035 -13.329 1.813 1.00 0.94 H new ATOM 0 HB3 PRO A2200 -14.544 -14.032 1.265 1.00 0.94 H new ATOM 0 HG2 PRO A2200 -13.226 -14.458 3.825 1.00 0.97 H new ATOM 0 HG3 PRO A2200 -14.754 -15.132 3.292 1.00 0.97 H new ATOM 0 HD2 PRO A2200 -12.228 -16.534 3.579 1.00 0.89 H new ATOM 0 HD3 PRO A2200 -13.754 -17.205 3.038 1.00 0.89 H new ATOM 1045 N MET A2201 -10.844 -13.818 1.195 1.00 0.76 N ATOM 1046 CA MET A2201 -9.557 -13.152 0.849 1.00 0.72 C ATOM 1047 C MET A2201 -8.577 -13.270 2.018 1.00 0.71 C ATOM 1048 O MET A2201 -7.989 -12.296 2.445 1.00 0.77 O ATOM 1049 CB MET A2201 -9.813 -11.673 0.549 1.00 0.79 C ATOM 1050 CG MET A2201 -11.067 -11.206 1.292 1.00 1.18 C ATOM 1051 SD MET A2201 -10.997 -9.412 1.522 1.00 1.57 S ATOM 1052 CE MET A2201 -12.772 -9.142 1.748 1.00 2.25 C ATOM 0 H MET A2201 -11.170 -13.666 2.150 1.00 0.76 H new ATOM 0 HA MET A2201 -9.129 -13.637 -0.028 1.00 0.72 H new ATOM 0 HB2 MET A2201 -8.954 -11.076 0.855 1.00 0.79 H new ATOM 0 HB3 MET A2201 -9.938 -11.526 -0.524 1.00 0.79 H new ATOM 0 HG2 MET A2201 -11.959 -11.477 0.728 1.00 1.18 H new ATOM 0 HG3 MET A2201 -11.137 -11.705 2.258 1.00 1.18 H new ATOM 0 HE1 MET A2201 -12.961 -8.081 1.909 1.00 2.25 H new ATOM 0 HE2 MET A2201 -13.307 -9.475 0.859 1.00 2.25 H new ATOM 0 HE3 MET A2201 -13.119 -9.707 2.613 1.00 2.25 H new ATOM 1062 N MET A2202 -8.395 -14.450 2.542 1.00 0.70 N ATOM 1063 CA MET A2202 -7.456 -14.619 3.679 1.00 0.72 C ATOM 1064 C MET A2202 -6.327 -15.569 3.281 1.00 0.65 C ATOM 1065 O MET A2202 -5.217 -15.153 3.013 1.00 0.69 O ATOM 1066 CB MET A2202 -8.218 -15.198 4.866 1.00 0.79 C ATOM 1067 CG MET A2202 -8.787 -14.052 5.701 1.00 0.93 C ATOM 1068 SD MET A2202 -7.643 -13.658 7.047 1.00 1.15 S ATOM 1069 CE MET A2202 -8.819 -13.841 8.410 1.00 1.66 C ATOM 0 H MET A2202 -8.858 -15.304 2.230 1.00 0.70 H new ATOM 0 HA MET A2202 -7.028 -13.654 3.949 1.00 0.72 H new ATOM 0 HB2 MET A2202 -9.023 -15.845 4.517 1.00 0.79 H new ATOM 0 HB3 MET A2202 -7.555 -15.814 5.474 1.00 0.79 H new ATOM 0 HG2 MET A2202 -8.943 -13.174 5.074 1.00 0.93 H new ATOM 0 HG3 MET A2202 -9.759 -14.332 6.106 1.00 0.93 H new ATOM 0 HE1 MET A2202 -8.315 -13.639 9.355 1.00 1.66 H new ATOM 0 HE2 MET A2202 -9.640 -13.137 8.279 1.00 1.66 H new ATOM 0 HE3 MET A2202 -9.211 -14.858 8.418 1.00 1.66 H new ATOM 1079 N THR A2203 -6.601 -16.842 3.240 1.00 0.61 N ATOM 1080 CA THR A2203 -5.547 -17.820 2.860 1.00 0.59 C ATOM 1081 C THR A2203 -6.160 -19.217 2.746 1.00 0.60 C ATOM 1082 O THR A2203 -7.364 -19.378 2.716 1.00 0.63 O ATOM 1083 CB THR A2203 -4.452 -17.830 3.929 1.00 0.65 C ATOM 1084 OG1 THR A2203 -3.335 -18.571 3.459 1.00 0.69 O ATOM 1085 CG2 THR A2203 -4.992 -18.469 5.208 1.00 0.68 C ATOM 0 H THR A2203 -7.512 -17.248 3.454 1.00 0.61 H new ATOM 0 HA THR A2203 -5.117 -17.534 1.900 1.00 0.59 H new ATOM 0 HB THR A2203 -4.142 -16.807 4.140 1.00 0.65 H new ATOM 0 HG1 THR A2203 -3.169 -18.352 2.518 1.00 0.69 H new ATOM 0 HG21 THR A2203 -4.212 -18.476 5.969 1.00 0.68 H new ATOM 0 HG22 THR A2203 -5.846 -17.895 5.569 1.00 0.68 H new ATOM 0 HG23 THR A2203 -5.304 -19.492 5.000 1.00 0.68 H new ATOM 1093 N CYS A2204 -5.338 -20.227 2.680 1.00 0.63 N ATOM 1094 CA CYS A2204 -5.867 -21.615 2.565 1.00 0.69 C ATOM 1095 C CYS A2204 -6.256 -22.136 3.949 1.00 0.71 C ATOM 1096 O CYS A2204 -5.692 -21.745 4.951 1.00 0.92 O ATOM 1097 CB CYS A2204 -4.778 -22.506 1.977 1.00 1.03 C ATOM 1098 SG CYS A2204 -5.491 -24.061 1.400 1.00 0.82 S ATOM 0 H CYS A2204 -4.321 -20.151 2.701 1.00 0.63 H new ATOM 0 HA CYS A2204 -6.746 -21.622 1.921 1.00 0.69 H new ATOM 0 HB2 CYS A2204 -4.286 -21.994 1.150 1.00 1.03 H new ATOM 0 HB3 CYS A2204 -4.014 -22.704 2.729 1.00 1.03 H new ATOM 1103 N GLU A2205 -7.213 -23.021 4.012 1.00 0.78 N ATOM 1104 CA GLU A2205 -7.633 -23.571 5.331 1.00 1.09 C ATOM 1105 C GLU A2205 -8.377 -24.891 5.118 1.00 1.31 C ATOM 1106 O GLU A2205 -8.172 -25.798 5.908 1.00 1.80 O ATOM 1107 CB GLU A2205 -8.554 -22.571 6.034 1.00 1.31 C ATOM 1108 CG GLU A2205 -9.761 -22.277 5.143 1.00 1.39 C ATOM 1109 CD GLU A2205 -10.836 -21.554 5.958 1.00 1.85 C ATOM 1110 OE1 GLU A2205 -10.531 -21.131 7.061 1.00 2.41 O ATOM 1111 OE2 GLU A2205 -11.945 -21.436 5.464 1.00 2.26 O ATOM 1112 OXT GLU A2205 -9.138 -24.973 4.168 1.00 1.67 O ATOM 0 H GLU A2205 -7.722 -23.387 3.207 1.00 0.78 H new ATOM 0 HA GLU A2205 -6.752 -23.746 5.949 1.00 1.09 H new ATOM 0 HB2 GLU A2205 -8.885 -22.975 6.991 1.00 1.31 H new ATOM 0 HB3 GLU A2205 -8.013 -21.649 6.247 1.00 1.31 H new ATOM 0 HG2 GLU A2205 -9.459 -21.663 4.295 1.00 1.39 H new ATOM 0 HG3 GLU A2205 -10.161 -23.206 4.737 1.00 1.39 H new TER 1119 GLU A2205 HETATM 1120 CA CA A2224 -9.613 20.865 0.401 1.00 1.00 CA HETATM 1121 CA CA A2225 -5.719 -7.904 -4.269 1.00 0.76 CA CONECT 46 1120 CONECT 47 1120 CONECT 55 1120 CONECT 88 1120 CONECT 89 1120 CONECT 101 263 CONECT 190 395 CONECT 263 101 CONECT 293 1120 CONECT 294 1120 CONECT 304 1120 CONECT 395 190 CONECT 420 576 CONECT 576 420 CONECT 604 1121 CONECT 612 1121 CONECT 642 1121 CONECT 643 1121 CONECT 655 779 CONECT 727 909 CONECT 779 655 CONECT 812 1121 CONECT 823 1121 CONECT 865 1121 CONECT 909 727 CONECT 933 1098 CONECT 1098 933 CONECT 1120 46 47 55 88 CONECT 1120 89 293 294 304 CONECT 1121 604 612 642 643 CONECT 1121 812 823 865 END