HEADER TRANSCRIPTION REGULATION 26-APR-98 1BBY TITLE DNA-BINDING DOMAIN FROM HUMAN RAP30, NMR, MINIMIZED AVERAGE COMPND MOL_ID: 1; COMPND 2 MOLECULE: RAP30; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: DNA-BINDING DOMAIN; COMPND 5 SYNONYM: TRANSCRIPTION INITIATION FACTOR RAP30; 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 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: HMS174 (DE3); SOURCE 8 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET11D KEYWDS AVERAGE STRUCTURE TRANSCRIPTION REGULATION, RAP30, NMR, DNA- KEYWDS 2 BINDING DOMAIN, TRANSCRIPTION EXPDTA SOLUTION NMR AUTHOR C.M.GROFT,S.N.ULJON,R.WANG,M.H.WERNER REVDAT 3 24-FEB-09 1BBY 1 VERSN REVDAT 2 13-JAN-99 1BBY 1 SOURCE COMPND REMARK TITLE REVDAT 2 2 1 EXPDTA KEYWDS HEADER REVDAT 1 25-NOV-98 1BBY 0 JRNL AUTH C.M.GROFT,S.N.ULJON,R.WANG,M.H.WERNER JRNL TITL STRUCTURAL HOMOLOGY BETWEEN THE RAP30 DNA-BINDING JRNL TITL 2 DOMAIN AND LINKER HISTONE H5: IMPLICATIONS FOR JRNL TITL 3 PREINITIATION COMPLEX ASSEMBLY. JRNL REF PROC.NATL.ACAD.SCI.USA V. 95 9117 1998 JRNL REFN ISSN 0027-8424 JRNL PMID 9689043 JRNL DOI 10.1073/PNAS.95.16.9117 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REFINEMENT DETAILS CAN BE FOUND IN REMARK 3 THE JRNL CITATION ABOVE. REMARK 4 REMARK 4 1BBY 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) : 297 REMARK 210 PH : 7.2 REMARK 210 IONIC STRENGTH : 10MM PHOSPHATE, 50MM NACL REMARK 210 PRESSURE : 1 ATM REMARK 210 SAMPLE CONTENTS : AQUEOUS REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D/4D HETERONUCLEAR NOESY/ REMARK 210 ROESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : DMX500, DMX600 REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR 3.851 REMARK 210 METHOD USED : DYNAMICAL SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 150 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : LEAST RESTRAINT AND ANGULAR REMARK 210 VIOLATION REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: STRUCTURE DETERMINED USING STANDARD MULTI-NUCLEAR 3D/4D 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 LYS A 207 30.16 -79.07 REMARK 500 LYS A 226 -166.65 -127.09 REMARK 500 ILE A 228 21.80 -78.70 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2BBY RELATED DB: PDB DBREF 1BBY A 175 243 UNP P13984 T2FB_HUMAN 175 243 SEQRES 1 A 69 ARG ALA ARG ALA ASP LYS GLN HIS VAL LEU ASP MET LEU SEQRES 2 A 69 PHE SER ALA PHE GLU LYS HIS GLN TYR TYR ASN LEU LYS SEQRES 3 A 69 ASP LEU VAL ASP ILE THR LYS GLN PRO VAL VAL TYR LEU SEQRES 4 A 69 LYS GLU ILE LEU LYS GLU ILE GLY VAL GLN ASN VAL LYS SEQRES 5 A 69 GLY ILE HIS LYS ASN THR TRP GLU LEU LYS PRO GLU TYR SEQRES 6 A 69 ARG HIS TYR GLN HELIX 1 1 ASP A 179 LYS A 193 1 15 HELIX 2 2 LEU A 199 ILE A 205 1 7 HELIX 3 3 VAL A 210 GLU A 219 1 10 SHEET 1 S1 1 TYR A 196 TYR A 197 0 SHEET 1 S2 1 ILE A 220 VAL A 225 0 SHEET 1 S3 1 ASN A 231 GLU A 234 0 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 ATOM 1 N ARG A 175 5.120 -12.648 -11.808 1.00 3.15 N ATOM 2 CA ARG A 175 4.200 -11.613 -12.353 1.00 2.43 C ATOM 3 C ARG A 175 4.395 -10.292 -11.604 1.00 1.41 C ATOM 4 O ARG A 175 5.474 -9.951 -11.162 1.00 1.70 O ATOM 5 CB ARG A 175 2.734 -12.101 -12.220 1.00 3.15 C ATOM 6 CG ARG A 175 2.188 -11.935 -10.763 1.00 3.31 C ATOM 7 CD ARG A 175 1.081 -10.847 -10.660 1.00 3.80 C ATOM 8 NE ARG A 175 -0.223 -11.575 -10.520 1.00 4.58 N ATOM 9 CZ ARG A 175 -1.177 -11.459 -11.381 1.00 5.23 C ATOM 10 NH1 ARG A 175 -1.143 -10.514 -12.287 1.00 5.33 N ATOM 11 NH2 ARG A 175 -2.201 -12.259 -11.317 1.00 6.09 N ATOM 12 H ARG A 175 5.256 -13.487 -12.302 1.00 3.57 H ATOM 13 HA ARG A 175 4.421 -11.458 -13.396 1.00 2.69 H ATOM 14 HB2 ARG A 175 2.116 -11.554 -12.916 1.00 3.53 H ATOM 15 HB3 ARG A 175 2.701 -13.148 -12.489 1.00 3.68 H ATOM 16 HG2 ARG A 175 1.763 -12.877 -10.442 1.00 3.28 H ATOM 17 HG3 ARG A 175 2.991 -11.695 -10.096 1.00 3.54 H ATOM 18 HD2 ARG A 175 1.196 -10.273 -9.778 1.00 3.79 H ATOM 19 HD3 ARG A 175 1.120 -10.165 -11.513 1.00 4.02 H ATOM 20 HE ARG A 175 -0.327 -12.210 -9.785 1.00 4.85 H ATOM 21 HH11 ARG A 175 -0.381 -9.871 -12.315 1.00 4.92 H ATOM 22 HH12 ARG A 175 -1.883 -10.436 -12.954 1.00 6.01 H ATOM 23 HH21 ARG A 175 -2.243 -12.956 -10.602 1.00 6.31 H ATOM 24 HH22 ARG A 175 -2.936 -12.184 -11.988 1.00 6.67 H ATOM 25 N ALA A 176 3.336 -9.560 -11.479 1.00 1.23 N ATOM 26 CA ALA A 176 3.357 -8.248 -10.782 1.00 1.29 C ATOM 27 C ALA A 176 3.198 -8.420 -9.262 1.00 0.97 C ATOM 28 O ALA A 176 3.028 -7.458 -8.548 1.00 0.90 O ATOM 29 CB ALA A 176 2.197 -7.406 -11.311 1.00 2.49 C ATOM 30 H ALA A 176 2.506 -9.878 -11.864 1.00 1.92 H ATOM 31 HA ALA A 176 4.287 -7.743 -10.992 1.00 1.50 H ATOM 32 HB1 ALA A 176 2.155 -7.488 -12.387 1.00 2.95 H ATOM 33 HB2 ALA A 176 1.269 -7.767 -10.888 1.00 2.98 H ATOM 34 HB3 ALA A 176 2.341 -6.375 -11.032 1.00 2.98 H ATOM 35 N ARG A 177 3.267 -9.615 -8.738 1.00 0.86 N ATOM 36 CA ARG A 177 3.136 -9.747 -7.258 1.00 0.63 C ATOM 37 C ARG A 177 4.394 -9.158 -6.667 1.00 0.50 C ATOM 38 O ARG A 177 4.411 -8.651 -5.562 1.00 0.42 O ATOM 39 CB ARG A 177 3.007 -11.210 -6.830 1.00 0.70 C ATOM 40 CG ARG A 177 2.820 -11.299 -5.280 1.00 0.69 C ATOM 41 CD ARG A 177 1.547 -12.073 -4.935 1.00 1.47 C ATOM 42 NE ARG A 177 1.605 -12.425 -3.469 1.00 2.14 N ATOM 43 CZ ARG A 177 1.270 -13.599 -3.030 1.00 2.75 C ATOM 44 NH1 ARG A 177 1.122 -14.592 -3.867 1.00 3.02 N ATOM 45 NH2 ARG A 177 1.133 -13.807 -1.749 1.00 3.62 N ATOM 46 H ARG A 177 3.422 -10.395 -9.295 1.00 0.98 H ATOM 47 HA ARG A 177 2.277 -9.185 -6.918 1.00 0.65 H ATOM 48 HB2 ARG A 177 2.162 -11.646 -7.343 1.00 1.10 H ATOM 49 HB3 ARG A 177 3.905 -11.740 -7.117 1.00 0.87 H ATOM 50 HG2 ARG A 177 3.668 -11.809 -4.842 1.00 1.00 H ATOM 51 HG3 ARG A 177 2.755 -10.306 -4.853 1.00 1.11 H ATOM 52 HD2 ARG A 177 0.694 -11.458 -5.067 1.00 2.03 H ATOM 53 HD3 ARG A 177 1.454 -12.930 -5.610 1.00 1.96 H ATOM 54 HE ARG A 177 1.827 -11.722 -2.823 1.00 2.62 H ATOM 55 HH11 ARG A 177 1.266 -14.452 -4.844 1.00 2.79 H ATOM 56 HH12 ARG A 177 0.862 -15.496 -3.528 1.00 3.79 H ATOM 57 HH21 ARG A 177 1.287 -13.062 -1.100 1.00 3.93 H ATOM 58 HH22 ARG A 177 0.870 -14.712 -1.417 1.00 4.21 H ATOM 59 N ALA A 178 5.443 -9.177 -7.434 1.00 0.57 N ATOM 60 CA ALA A 178 6.705 -8.576 -6.969 1.00 0.55 C ATOM 61 C ALA A 178 6.399 -7.109 -6.734 1.00 0.41 C ATOM 62 O ALA A 178 6.802 -6.520 -5.750 1.00 0.42 O ATOM 63 CB ALA A 178 7.764 -8.718 -8.061 1.00 0.71 C ATOM 64 H ALA A 178 5.384 -9.561 -8.334 1.00 0.69 H ATOM 65 HA ALA A 178 7.034 -9.047 -6.055 1.00 0.60 H ATOM 66 HB1 ALA A 178 7.376 -8.315 -8.987 1.00 1.32 H ATOM 67 HB2 ALA A 178 8.650 -8.176 -7.776 1.00 1.18 H ATOM 68 HB3 ALA A 178 8.003 -9.762 -8.197 1.00 1.25 H ATOM 69 N ASP A 179 5.642 -6.528 -7.624 1.00 0.36 N ATOM 70 CA ASP A 179 5.254 -5.113 -7.446 1.00 0.33 C ATOM 71 C ASP A 179 4.360 -5.019 -6.212 1.00 0.28 C ATOM 72 O ASP A 179 4.525 -4.166 -5.387 1.00 0.28 O ATOM 73 CB ASP A 179 4.483 -4.614 -8.672 1.00 0.44 C ATOM 74 CG ASP A 179 5.423 -4.529 -9.876 1.00 0.48 C ATOM 75 OD1 ASP A 179 6.592 -4.836 -9.712 1.00 1.17 O ATOM 76 OD2 ASP A 179 4.956 -4.162 -10.942 1.00 1.20 O ATOM 77 H ASP A 179 5.306 -7.039 -8.390 1.00 0.43 H ATOM 78 HA ASP A 179 6.136 -4.511 -7.303 1.00 0.36 H ATOM 79 HB2 ASP A 179 3.677 -5.291 -8.892 1.00 0.50 H ATOM 80 HB3 ASP A 179 4.080 -3.635 -8.465 1.00 0.53 H ATOM 81 N LYS A 180 3.410 -5.900 -6.076 1.00 0.29 N ATOM 82 CA LYS A 180 2.514 -5.844 -4.881 1.00 0.29 C ATOM 83 C LYS A 180 3.343 -5.774 -3.603 1.00 0.25 C ATOM 84 O LYS A 180 3.286 -4.815 -2.858 1.00 0.24 O ATOM 85 CB LYS A 180 1.633 -7.099 -4.840 1.00 0.35 C ATOM 86 CG LYS A 180 0.722 -7.064 -3.603 1.00 0.35 C ATOM 87 CD LYS A 180 -0.226 -8.267 -3.633 1.00 0.54 C ATOM 88 CE LYS A 180 -1.137 -8.244 -2.405 1.00 1.08 C ATOM 89 NZ LYS A 180 -2.287 -9.167 -2.626 1.00 1.50 N ATOM 90 H LYS A 180 3.287 -6.596 -6.753 1.00 0.33 H ATOM 91 HA LYS A 180 1.891 -4.969 -4.946 1.00 0.31 H ATOM 92 HB2 LYS A 180 1.023 -7.138 -5.731 1.00 0.41 H ATOM 93 HB3 LYS A 180 2.258 -7.975 -4.795 1.00 0.35 H ATOM 94 HG2 LYS A 180 1.325 -7.108 -2.707 1.00 0.37 H ATOM 95 HG3 LYS A 180 0.145 -6.153 -3.605 1.00 0.45 H ATOM 96 HD2 LYS A 180 -0.828 -8.226 -4.531 1.00 0.99 H ATOM 97 HD3 LYS A 180 0.353 -9.178 -3.633 1.00 0.72 H ATOM 98 HE2 LYS A 180 -0.581 -8.563 -1.536 1.00 1.48 H ATOM 99 HE3 LYS A 180 -1.506 -7.240 -2.247 1.00 1.77 H ATOM 100 HZ1 LYS A 180 -2.036 -9.869 -3.348 1.00 2.10 H ATOM 101 HZ2 LYS A 180 -2.518 -9.654 -1.736 1.00 1.93 H ATOM 102 HZ3 LYS A 180 -3.113 -8.620 -2.945 1.00 1.81 H ATOM 103 N GLN A 181 4.095 -6.798 -3.337 1.00 0.26 N ATOM 104 CA GLN A 181 4.912 -6.826 -2.098 1.00 0.26 C ATOM 105 C GLN A 181 5.795 -5.572 -2.073 1.00 0.23 C ATOM 106 O GLN A 181 5.837 -4.832 -1.112 1.00 0.24 O ATOM 107 CB GLN A 181 5.782 -8.093 -2.138 1.00 0.30 C ATOM 108 CG GLN A 181 6.143 -8.541 -0.722 1.00 0.39 C ATOM 109 CD GLN A 181 6.841 -7.430 0.048 1.00 1.27 C ATOM 110 OE1 GLN A 181 8.041 -7.458 0.225 1.00 2.24 O ATOM 111 NE2 GLN A 181 6.129 -6.460 0.537 1.00 1.52 N ATOM 112 H GLN A 181 4.107 -7.563 -3.947 1.00 0.29 H ATOM 113 HA GLN A 181 4.269 -6.842 -1.230 1.00 0.28 H ATOM 114 HB2 GLN A 181 5.236 -8.883 -2.631 1.00 0.35 H ATOM 115 HB3 GLN A 181 6.691 -7.894 -2.690 1.00 0.32 H ATOM 116 HG2 GLN A 181 5.235 -8.801 -0.205 1.00 1.12 H ATOM 117 HG3 GLN A 181 6.789 -9.402 -0.774 1.00 1.11 H ATOM 118 HE21 GLN A 181 5.158 -6.451 0.404 1.00 1.22 H ATOM 119 HE22 GLN A 181 6.561 -5.740 1.037 1.00 2.33 H ATOM 120 N HIS A 182 6.487 -5.327 -3.145 1.00 0.23 N ATOM 121 CA HIS A 182 7.368 -4.136 -3.223 1.00 0.24 C ATOM 122 C HIS A 182 6.532 -2.856 -3.130 1.00 0.20 C ATOM 123 O HIS A 182 6.959 -1.859 -2.581 1.00 0.20 O ATOM 124 CB HIS A 182 8.093 -4.189 -4.561 1.00 0.29 C ATOM 125 CG HIS A 182 9.001 -3.010 -4.705 1.00 0.32 C ATOM 126 ND1 HIS A 182 9.819 -2.568 -3.680 1.00 0.62 N ATOM 127 CD2 HIS A 182 9.238 -2.178 -5.764 1.00 0.48 C ATOM 128 CE1 HIS A 182 10.508 -1.509 -4.143 1.00 0.55 C ATOM 129 NE2 HIS A 182 10.191 -1.228 -5.410 1.00 0.42 N ATOM 130 H HIS A 182 6.424 -5.931 -3.914 1.00 0.25 H ATOM 131 HA HIS A 182 8.088 -4.160 -2.420 1.00 0.26 H ATOM 132 HB2 HIS A 182 8.672 -5.097 -4.617 1.00 0.33 H ATOM 133 HB3 HIS A 182 7.366 -4.179 -5.356 1.00 0.29 H ATOM 134 HD1 HIS A 182 9.883 -2.955 -2.782 1.00 0.94 H ATOM 135 HD2 HIS A 182 8.755 -2.253 -6.726 1.00 0.82 H ATOM 136 HE1 HIS A 182 11.230 -0.955 -3.561 1.00 0.79 H ATOM 137 N VAL A 183 5.346 -2.877 -3.663 1.00 0.19 N ATOM 138 CA VAL A 183 4.484 -1.672 -3.611 1.00 0.18 C ATOM 139 C VAL A 183 4.010 -1.460 -2.178 1.00 0.16 C ATOM 140 O VAL A 183 3.893 -0.337 -1.727 1.00 0.17 O ATOM 141 CB VAL A 183 3.277 -1.844 -4.555 1.00 0.22 C ATOM 142 CG1 VAL A 183 2.224 -0.741 -4.274 1.00 0.26 C ATOM 143 CG2 VAL A 183 3.755 -1.765 -6.033 1.00 0.28 C ATOM 144 H VAL A 183 5.020 -3.692 -4.099 1.00 0.20 H ATOM 145 HA VAL A 183 5.059 -0.813 -3.924 1.00 0.20 H ATOM 146 HB VAL A 183 2.829 -2.812 -4.375 1.00 0.24 H ATOM 147 HG11 VAL A 183 2.717 0.156 -3.923 1.00 1.04 H ATOM 148 HG12 VAL A 183 1.674 -0.516 -5.176 1.00 1.01 H ATOM 149 HG13 VAL A 183 1.535 -1.086 -3.518 1.00 1.04 H ATOM 150 HG21 VAL A 183 4.808 -2.005 -6.098 1.00 1.05 H ATOM 151 HG22 VAL A 183 3.195 -2.473 -6.630 1.00 1.07 H ATOM 152 HG23 VAL A 183 3.600 -0.770 -6.424 1.00 0.99 H ATOM 153 N LEU A 184 3.747 -2.507 -1.434 1.00 0.17 N ATOM 154 CA LEU A 184 3.306 -2.267 -0.039 1.00 0.18 C ATOM 155 C LEU A 184 4.410 -1.489 0.672 1.00 0.18 C ATOM 156 O LEU A 184 4.148 -0.551 1.397 1.00 0.19 O ATOM 157 CB LEU A 184 3.044 -3.592 0.693 1.00 0.23 C ATOM 158 CG LEU A 184 1.783 -4.294 0.149 1.00 0.25 C ATOM 159 CD1 LEU A 184 1.699 -5.716 0.755 1.00 0.30 C ATOM 160 CD2 LEU A 184 0.521 -3.495 0.530 1.00 0.31 C ATOM 161 H LEU A 184 3.853 -3.430 -1.782 1.00 0.18 H ATOM 162 HA LEU A 184 2.417 -1.666 -0.047 1.00 0.19 H ATOM 163 HB2 LEU A 184 3.894 -4.244 0.561 1.00 0.25 H ATOM 164 HB3 LEU A 184 2.910 -3.394 1.747 1.00 0.26 H ATOM 165 HG LEU A 184 1.851 -4.368 -0.928 1.00 0.26 H ATOM 166 HD11 LEU A 184 2.099 -5.712 1.762 1.00 1.10 H ATOM 167 HD12 LEU A 184 0.673 -6.056 0.789 1.00 1.02 H ATOM 168 HD13 LEU A 184 2.278 -6.395 0.146 1.00 1.07 H ATOM 169 HD21 LEU A 184 0.577 -3.207 1.571 1.00 1.06 H ATOM 170 HD22 LEU A 184 0.438 -2.615 -0.085 1.00 1.11 H ATOM 171 HD23 LEU A 184 -0.349 -4.104 0.370 1.00 0.97 H ATOM 172 N ASP A 185 5.645 -1.850 0.450 1.00 0.19 N ATOM 173 CA ASP A 185 6.759 -1.109 1.105 1.00 0.21 C ATOM 174 C ASP A 185 6.603 0.385 0.815 1.00 0.18 C ATOM 175 O ASP A 185 6.794 1.218 1.679 1.00 0.20 O ATOM 176 CB ASP A 185 8.103 -1.596 0.555 1.00 0.24 C ATOM 177 CG ASP A 185 8.373 -3.019 1.046 1.00 0.29 C ATOM 178 OD1 ASP A 185 7.416 -3.713 1.345 1.00 1.07 O ATOM 179 OD2 ASP A 185 9.534 -3.390 1.116 1.00 1.17 O ATOM 180 H ASP A 185 5.839 -2.597 -0.158 1.00 0.19 H ATOM 181 HA ASP A 185 6.723 -1.274 2.172 1.00 0.24 H ATOM 182 HB2 ASP A 185 8.075 -1.585 -0.525 1.00 0.23 H ATOM 183 HB3 ASP A 185 8.891 -0.944 0.900 1.00 0.26 H ATOM 184 N MET A 186 6.253 0.732 -0.396 1.00 0.16 N ATOM 185 CA MET A 186 6.082 2.175 -0.734 1.00 0.17 C ATOM 186 C MET A 186 4.940 2.766 0.091 1.00 0.15 C ATOM 187 O MET A 186 5.009 3.891 0.545 1.00 0.17 O ATOM 188 CB MET A 186 5.762 2.327 -2.227 1.00 0.18 C ATOM 189 CG MET A 186 6.959 1.876 -3.069 1.00 0.22 C ATOM 190 SD MET A 186 8.367 2.980 -2.763 1.00 0.28 S ATOM 191 CE MET A 186 9.396 2.524 -4.186 1.00 1.14 C ATOM 192 H MET A 186 6.102 0.044 -1.080 1.00 0.17 H ATOM 193 HA MET A 186 6.992 2.704 -0.504 1.00 0.19 H ATOM 194 HB2 MET A 186 4.902 1.721 -2.474 1.00 0.16 H ATOM 195 HB3 MET A 186 5.544 3.362 -2.444 1.00 0.20 H ATOM 196 HG2 MET A 186 7.228 0.865 -2.802 1.00 0.23 H ATOM 197 HG3 MET A 186 6.689 1.914 -4.114 1.00 0.25 H ATOM 198 HE1 MET A 186 8.884 1.794 -4.795 1.00 1.67 H ATOM 199 HE2 MET A 186 9.602 3.408 -4.774 1.00 1.75 H ATOM 200 HE3 MET A 186 10.326 2.105 -3.838 1.00 1.66 H ATOM 201 N LEU A 187 3.888 2.023 0.290 1.00 0.12 N ATOM 202 CA LEU A 187 2.749 2.557 1.086 1.00 0.12 C ATOM 203 C LEU A 187 3.210 2.809 2.520 1.00 0.12 C ATOM 204 O LEU A 187 2.949 3.850 3.088 1.00 0.12 O ATOM 205 CB LEU A 187 1.599 1.543 1.098 1.00 0.12 C ATOM 206 CG LEU A 187 1.159 1.192 -0.329 1.00 0.14 C ATOM 207 CD1 LEU A 187 -0.106 0.331 -0.253 1.00 0.16 C ATOM 208 CD2 LEU A 187 0.853 2.470 -1.124 1.00 0.18 C ATOM 209 H LEU A 187 3.847 1.119 -0.084 1.00 0.13 H ATOM 210 HA LEU A 187 2.412 3.490 0.662 1.00 0.13 H ATOM 211 HB2 LEU A 187 1.924 0.644 1.598 1.00 0.14 H ATOM 212 HB3 LEU A 187 0.760 1.959 1.629 1.00 0.14 H ATOM 213 HG LEU A 187 1.944 0.636 -0.821 1.00 0.17 H ATOM 214 HD11 LEU A 187 0.009 -0.414 0.519 1.00 0.99 H ATOM 215 HD12 LEU A 187 -0.954 0.958 -0.019 1.00 1.05 H ATOM 216 HD13 LEU A 187 -0.269 -0.155 -1.202 1.00 1.04 H ATOM 217 HD21 LEU A 187 0.331 3.173 -0.491 1.00 1.04 H ATOM 218 HD22 LEU A 187 1.777 2.911 -1.469 1.00 1.00 H ATOM 219 HD23 LEU A 187 0.235 2.226 -1.977 1.00 1.00 H ATOM 220 N PHE A 188 3.900 1.876 3.115 1.00 0.13 N ATOM 221 CA PHE A 188 4.362 2.099 4.508 1.00 0.14 C ATOM 222 C PHE A 188 5.184 3.381 4.558 1.00 0.14 C ATOM 223 O PHE A 188 5.002 4.201 5.429 1.00 0.15 O ATOM 224 CB PHE A 188 5.201 0.905 4.985 1.00 0.17 C ATOM 225 CG PHE A 188 4.272 -0.223 5.375 1.00 0.20 C ATOM 226 CD1 PHE A 188 3.621 -0.192 6.623 1.00 0.29 C ATOM 227 CD2 PHE A 188 4.036 -1.285 4.484 1.00 0.21 C ATOM 228 CE1 PHE A 188 2.738 -1.228 6.982 1.00 0.34 C ATOM 229 CE2 PHE A 188 3.149 -2.319 4.841 1.00 0.25 C ATOM 230 CZ PHE A 188 2.501 -2.291 6.090 1.00 0.30 C ATOM 231 H PHE A 188 4.112 1.040 2.648 1.00 0.14 H ATOM 232 HA PHE A 188 3.502 2.215 5.150 1.00 0.15 H ATOM 233 HB2 PHE A 188 5.852 0.579 4.186 1.00 0.18 H ATOM 234 HB3 PHE A 188 5.794 1.195 5.840 1.00 0.20 H ATOM 235 HD1 PHE A 188 3.804 0.624 7.306 1.00 0.36 H ATOM 236 HD2 PHE A 188 4.539 -1.311 3.533 1.00 0.25 H ATOM 237 HE1 PHE A 188 2.242 -1.206 7.940 1.00 0.44 H ATOM 238 HE2 PHE A 188 2.963 -3.131 4.155 1.00 0.29 H ATOM 239 HZ PHE A 188 1.821 -3.083 6.363 1.00 0.35 H ATOM 240 N SER A 189 6.065 3.582 3.619 1.00 0.14 N ATOM 241 CA SER A 189 6.867 4.837 3.628 1.00 0.16 C ATOM 242 C SER A 189 5.904 6.018 3.530 1.00 0.15 C ATOM 243 O SER A 189 5.983 6.977 4.278 1.00 0.17 O ATOM 244 CB SER A 189 7.818 4.850 2.429 1.00 0.18 C ATOM 245 OG SER A 189 7.075 5.108 1.244 1.00 0.20 O ATOM 246 H SER A 189 6.183 2.921 2.904 1.00 0.15 H ATOM 247 HA SER A 189 7.432 4.903 4.545 1.00 0.18 H ATOM 248 HB2 SER A 189 8.556 5.623 2.560 1.00 0.20 H ATOM 249 HB3 SER A 189 8.314 3.891 2.354 1.00 0.20 H ATOM 250 HG SER A 189 6.726 4.273 0.925 1.00 0.92 H ATOM 251 N ALA A 190 4.978 5.939 2.619 1.00 0.13 N ATOM 252 CA ALA A 190 3.987 7.032 2.463 1.00 0.14 C ATOM 253 C ALA A 190 3.199 7.165 3.766 1.00 0.13 C ATOM 254 O ALA A 190 3.101 8.228 4.338 1.00 0.15 O ATOM 255 CB ALA A 190 3.035 6.689 1.301 1.00 0.16 C ATOM 256 H ALA A 190 4.928 5.151 2.046 1.00 0.13 H ATOM 257 HA ALA A 190 4.501 7.959 2.254 1.00 0.17 H ATOM 258 HB1 ALA A 190 3.538 6.027 0.612 1.00 0.99 H ATOM 259 HB2 ALA A 190 2.146 6.200 1.679 1.00 1.00 H ATOM 260 HB3 ALA A 190 2.750 7.593 0.785 1.00 1.01 H ATOM 261 N PHE A 191 2.639 6.081 4.232 1.00 0.11 N ATOM 262 CA PHE A 191 1.845 6.128 5.490 1.00 0.11 C ATOM 263 C PHE A 191 2.752 6.434 6.682 1.00 0.14 C ATOM 264 O PHE A 191 2.287 6.825 7.734 1.00 0.17 O ATOM 265 CB PHE A 191 1.131 4.785 5.698 1.00 0.12 C ATOM 266 CG PHE A 191 -0.112 4.743 4.838 1.00 0.12 C ATOM 267 CD1 PHE A 191 -1.224 5.532 5.182 1.00 0.14 C ATOM 268 CD2 PHE A 191 -0.155 3.923 3.700 1.00 0.13 C ATOM 269 CE1 PHE A 191 -2.382 5.502 4.385 1.00 0.16 C ATOM 270 CE2 PHE A 191 -1.312 3.889 2.896 1.00 0.15 C ATOM 271 CZ PHE A 191 -2.428 4.680 3.239 1.00 0.16 C ATOM 272 H PHE A 191 2.736 5.234 3.746 1.00 0.10 H ATOM 273 HA PHE A 191 1.110 6.910 5.405 1.00 0.12 H ATOM 274 HB2 PHE A 191 1.793 3.978 5.415 1.00 0.13 H ATOM 275 HB3 PHE A 191 0.852 4.675 6.735 1.00 0.14 H ATOM 276 HD1 PHE A 191 -1.189 6.161 6.058 1.00 0.16 H ATOM 277 HD2 PHE A 191 0.699 3.325 3.443 1.00 0.14 H ATOM 278 HE1 PHE A 191 -3.233 6.112 4.652 1.00 0.18 H ATOM 279 HE2 PHE A 191 -1.343 3.254 2.021 1.00 0.18 H ATOM 280 HZ PHE A 191 -3.317 4.655 2.626 1.00 0.18 H ATOM 281 N GLU A 192 4.037 6.277 6.538 1.00 0.16 N ATOM 282 CA GLU A 192 4.935 6.587 7.685 1.00 0.19 C ATOM 283 C GLU A 192 4.963 8.102 7.884 1.00 0.18 C ATOM 284 O GLU A 192 5.234 8.592 8.962 1.00 0.20 O ATOM 285 CB GLU A 192 6.355 6.090 7.397 1.00 0.25 C ATOM 286 CG GLU A 192 7.196 6.183 8.670 1.00 0.85 C ATOM 287 CD GLU A 192 8.598 5.641 8.391 1.00 1.47 C ATOM 288 OE1 GLU A 192 8.857 5.282 7.254 1.00 2.11 O ATOM 289 OE2 GLU A 192 9.389 5.595 9.318 1.00 2.13 O ATOM 290 H GLU A 192 4.409 5.971 5.685 1.00 0.17 H ATOM 291 HA GLU A 192 4.557 6.111 8.578 1.00 0.22 H ATOM 292 HB2 GLU A 192 6.322 5.065 7.070 1.00 0.49 H ATOM 293 HB3 GLU A 192 6.802 6.701 6.628 1.00 0.67 H ATOM 294 HG2 GLU A 192 7.262 7.214 8.985 1.00 1.43 H ATOM 295 HG3 GLU A 192 6.735 5.596 9.449 1.00 1.31 H ATOM 296 N LYS A 193 4.696 8.851 6.843 1.00 0.18 N ATOM 297 CA LYS A 193 4.723 10.343 6.967 1.00 0.21 C ATOM 298 C LYS A 193 3.336 10.883 7.326 1.00 0.22 C ATOM 299 O LYS A 193 3.210 11.928 7.933 1.00 0.36 O ATOM 300 CB LYS A 193 5.164 10.940 5.635 1.00 0.28 C ATOM 301 CG LYS A 193 6.554 10.403 5.298 1.00 0.37 C ATOM 302 CD LYS A 193 7.070 11.047 4.007 1.00 1.03 C ATOM 303 CE LYS A 193 8.465 10.484 3.644 1.00 1.11 C ATOM 304 NZ LYS A 193 9.436 11.607 3.551 1.00 1.69 N ATOM 305 H LYS A 193 4.494 8.430 5.973 1.00 0.18 H ATOM 306 HA LYS A 193 5.427 10.632 7.734 1.00 0.22 H ATOM 307 HB2 LYS A 193 4.462 10.657 4.863 1.00 0.33 H ATOM 308 HB3 LYS A 193 5.200 12.016 5.716 1.00 0.32 H ATOM 309 HG2 LYS A 193 7.231 10.630 6.108 1.00 1.04 H ATOM 310 HG3 LYS A 193 6.501 9.333 5.165 1.00 0.83 H ATOM 311 HD2 LYS A 193 6.373 10.842 3.205 1.00 1.58 H ATOM 312 HD3 LYS A 193 7.144 12.115 4.148 1.00 1.67 H ATOM 313 HE2 LYS A 193 8.803 9.789 4.402 1.00 1.70 H ATOM 314 HE3 LYS A 193 8.420 9.976 2.691 1.00 1.46 H ATOM 315 HZ1 LYS A 193 9.232 12.304 4.297 1.00 2.14 H ATOM 316 HZ2 LYS A 193 10.401 11.241 3.672 1.00 2.10 H ATOM 317 HZ3 LYS A 193 9.354 12.060 2.620 1.00 2.22 H ATOM 318 N HIS A 194 2.292 10.189 6.963 1.00 0.18 N ATOM 319 CA HIS A 194 0.923 10.680 7.294 1.00 0.21 C ATOM 320 C HIS A 194 -0.046 9.498 7.368 1.00 0.18 C ATOM 321 O HIS A 194 0.038 8.555 6.616 1.00 0.17 O ATOM 322 CB HIS A 194 0.466 11.681 6.227 1.00 0.28 C ATOM 323 CG HIS A 194 1.205 12.975 6.421 1.00 0.34 C ATOM 324 ND1 HIS A 194 2.101 13.473 5.488 1.00 1.08 N ATOM 325 CD2 HIS A 194 1.197 13.876 7.450 1.00 0.61 C ATOM 326 CE1 HIS A 194 2.588 14.630 5.974 1.00 0.89 C ATOM 327 NE2 HIS A 194 2.068 14.923 7.168 1.00 0.40 N ATOM 328 H HIS A 194 2.407 9.351 6.476 1.00 0.24 H ATOM 329 HA HIS A 194 0.944 11.170 8.257 1.00 0.25 H ATOM 330 HB2 HIS A 194 0.679 11.292 5.245 1.00 0.30 H ATOM 331 HB3 HIS A 194 -0.595 11.855 6.324 1.00 0.32 H ATOM 332 HD1 HIS A 194 2.341 13.055 4.635 1.00 1.70 H ATOM 333 HD2 HIS A 194 0.617 13.774 8.350 1.00 1.31 H ATOM 334 HE1 HIS A 194 3.313 15.245 5.462 1.00 1.40 H ATOM 335 N GLN A 195 -0.951 9.535 8.294 1.00 0.23 N ATOM 336 CA GLN A 195 -1.914 8.412 8.452 1.00 0.26 C ATOM 337 C GLN A 195 -2.863 8.319 7.246 1.00 0.20 C ATOM 338 O GLN A 195 -3.439 7.279 6.995 1.00 0.24 O ATOM 339 CB GLN A 195 -2.726 8.647 9.731 1.00 0.36 C ATOM 340 CG GLN A 195 -3.653 7.457 10.007 1.00 0.47 C ATOM 341 CD GLN A 195 -2.821 6.203 10.280 1.00 0.80 C ATOM 342 OE1 GLN A 195 -2.334 6.012 11.377 1.00 1.61 O ATOM 343 NE2 GLN A 195 -2.636 5.335 9.325 1.00 0.69 N ATOM 344 H GLN A 195 -0.989 10.299 8.906 1.00 0.28 H ATOM 345 HA GLN A 195 -1.368 7.488 8.545 1.00 0.27 H ATOM 346 HB2 GLN A 195 -2.049 8.772 10.564 1.00 0.39 H ATOM 347 HB3 GLN A 195 -3.320 9.542 9.618 1.00 0.42 H ATOM 348 HG2 GLN A 195 -4.263 7.676 10.871 1.00 0.93 H ATOM 349 HG3 GLN A 195 -4.291 7.287 9.156 1.00 0.81 H ATOM 350 HE21 GLN A 195 -3.027 5.489 8.439 1.00 0.68 H ATOM 351 HE22 GLN A 195 -2.107 4.527 9.493 1.00 1.12 H ATOM 352 N TYR A 196 -3.069 9.398 6.520 1.00 0.18 N ATOM 353 CA TYR A 196 -4.036 9.362 5.364 1.00 0.15 C ATOM 354 C TYR A 196 -3.370 9.698 4.021 1.00 0.14 C ATOM 355 O TYR A 196 -2.472 10.512 3.932 1.00 0.16 O ATOM 356 CB TYR A 196 -5.128 10.397 5.626 1.00 0.16 C ATOM 357 CG TYR A 196 -5.892 10.030 6.875 1.00 0.19 C ATOM 358 CD1 TYR A 196 -6.971 9.129 6.802 1.00 0.21 C ATOM 359 CD2 TYR A 196 -5.532 10.598 8.112 1.00 0.22 C ATOM 360 CE1 TYR A 196 -7.692 8.797 7.962 1.00 0.25 C ATOM 361 CE2 TYR A 196 -6.253 10.266 9.275 1.00 0.27 C ATOM 362 CZ TYR A 196 -7.334 9.366 9.200 1.00 0.28 C ATOM 363 OH TYR A 196 -8.041 9.040 10.339 1.00 0.33 O ATOM 364 H TYR A 196 -2.620 10.237 6.756 1.00 0.22 H ATOM 365 HA TYR A 196 -4.497 8.388 5.291 1.00 0.15 H ATOM 366 HB2 TYR A 196 -4.676 11.370 5.754 1.00 0.18 H ATOM 367 HB3 TYR A 196 -5.806 10.424 4.786 1.00 0.18 H ATOM 368 HD1 TYR A 196 -7.242 8.687 5.858 1.00 0.21 H ATOM 369 HD2 TYR A 196 -4.704 11.289 8.169 1.00 0.24 H ATOM 370 HE1 TYR A 196 -8.524 8.111 7.901 1.00 0.28 H ATOM 371 HE2 TYR A 196 -5.977 10.700 10.223 1.00 0.31 H ATOM 372 HH TYR A 196 -7.515 8.418 10.847 1.00 0.97 H ATOM 373 N TYR A 197 -3.862 9.086 2.969 1.00 0.14 N ATOM 374 CA TYR A 197 -3.346 9.351 1.588 1.00 0.14 C ATOM 375 C TYR A 197 -4.479 9.124 0.580 1.00 0.15 C ATOM 376 O TYR A 197 -5.124 8.094 0.585 1.00 0.17 O ATOM 377 CB TYR A 197 -2.174 8.410 1.251 1.00 0.13 C ATOM 378 CG TYR A 197 -0.880 8.970 1.789 1.00 0.13 C ATOM 379 CD1 TYR A 197 -0.502 8.744 3.123 1.00 0.13 C ATOM 380 CD2 TYR A 197 -0.045 9.720 0.937 1.00 0.17 C ATOM 381 CE1 TYR A 197 0.712 9.270 3.604 1.00 0.15 C ATOM 382 CE2 TYR A 197 1.167 10.245 1.419 1.00 0.19 C ATOM 383 CZ TYR A 197 1.546 10.020 2.753 1.00 0.18 C ATOM 384 OH TYR A 197 2.736 10.532 3.229 1.00 0.22 O ATOM 385 H TYR A 197 -4.610 8.460 3.088 1.00 0.14 H ATOM 386 HA TYR A 197 -3.018 10.379 1.522 1.00 0.14 H ATOM 387 HB2 TYR A 197 -2.355 7.444 1.697 1.00 0.14 H ATOM 388 HB3 TYR A 197 -2.092 8.298 0.178 1.00 0.14 H ATOM 389 HD1 TYR A 197 -1.141 8.170 3.777 1.00 0.14 H ATOM 390 HD2 TYR A 197 -0.337 9.891 -0.087 1.00 0.21 H ATOM 391 HE1 TYR A 197 1.002 9.099 4.622 1.00 0.18 H ATOM 392 HE2 TYR A 197 1.806 10.820 0.765 1.00 0.24 H ATOM 393 HH TYR A 197 2.611 11.471 3.391 1.00 0.90 H ATOM 394 N ASN A 198 -4.718 10.064 -0.301 1.00 0.14 N ATOM 395 CA ASN A 198 -5.798 9.874 -1.317 1.00 0.16 C ATOM 396 C ASN A 198 -5.202 9.176 -2.545 1.00 0.15 C ATOM 397 O ASN A 198 -4.000 9.103 -2.701 1.00 0.14 O ATOM 398 CB ASN A 198 -6.400 11.229 -1.708 1.00 0.18 C ATOM 399 CG ASN A 198 -5.416 12.045 -2.537 1.00 0.20 C ATOM 400 OD1 ASN A 198 -4.226 11.797 -2.523 1.00 0.23 O ATOM 401 ND2 ASN A 198 -5.878 13.023 -3.267 1.00 0.22 N ATOM 402 H ASN A 198 -4.180 10.883 -0.303 1.00 0.15 H ATOM 403 HA ASN A 198 -6.577 9.249 -0.899 1.00 0.17 H ATOM 404 HB2 ASN A 198 -7.295 11.066 -2.289 1.00 0.20 H ATOM 405 HB3 ASN A 198 -6.648 11.779 -0.813 1.00 0.20 H ATOM 406 HD21 ASN A 198 -6.842 13.213 -3.277 1.00 0.24 H ATOM 407 HD22 ASN A 198 -5.266 13.573 -3.796 1.00 0.24 H ATOM 408 N LEU A 199 -6.024 8.642 -3.408 1.00 0.19 N ATOM 409 CA LEU A 199 -5.481 7.933 -4.606 1.00 0.21 C ATOM 410 C LEU A 199 -4.519 8.854 -5.374 1.00 0.19 C ATOM 411 O LEU A 199 -3.482 8.427 -5.842 1.00 0.18 O ATOM 412 CB LEU A 199 -6.634 7.513 -5.540 1.00 0.27 C ATOM 413 CG LEU A 199 -7.621 6.559 -4.831 1.00 0.31 C ATOM 414 CD1 LEU A 199 -8.921 6.466 -5.659 1.00 0.41 C ATOM 415 CD2 LEU A 199 -7.023 5.146 -4.704 1.00 0.33 C ATOM 416 H LEU A 199 -6.992 8.694 -3.264 1.00 0.23 H ATOM 417 HA LEU A 199 -4.938 7.063 -4.285 1.00 0.21 H ATOM 418 HB2 LEU A 199 -7.168 8.396 -5.859 1.00 0.30 H ATOM 419 HB3 LEU A 199 -6.224 7.017 -6.407 1.00 0.29 H ATOM 420 HG LEU A 199 -7.852 6.946 -3.848 1.00 0.30 H ATOM 421 HD11 LEU A 199 -8.686 6.510 -6.716 1.00 1.11 H ATOM 422 HD12 LEU A 199 -9.429 5.534 -5.446 1.00 1.14 H ATOM 423 HD13 LEU A 199 -9.571 7.289 -5.403 1.00 1.07 H ATOM 424 HD21 LEU A 199 -6.027 5.193 -4.307 1.00 1.03 H ATOM 425 HD22 LEU A 199 -7.638 4.557 -4.041 1.00 1.11 H ATOM 426 HD23 LEU A 199 -7.000 4.681 -5.677 1.00 1.06 H ATOM 427 N LYS A 200 -4.859 10.105 -5.521 1.00 0.21 N ATOM 428 CA LYS A 200 -3.975 11.051 -6.275 1.00 0.22 C ATOM 429 C LYS A 200 -2.580 11.120 -5.655 1.00 0.19 C ATOM 430 O LYS A 200 -1.583 11.206 -6.345 1.00 0.19 O ATOM 431 CB LYS A 200 -4.584 12.455 -6.235 1.00 0.27 C ATOM 432 CG LYS A 200 -3.807 13.410 -7.175 1.00 0.33 C ATOM 433 CD LYS A 200 -4.522 13.518 -8.533 1.00 1.11 C ATOM 434 CE LYS A 200 -3.560 14.035 -9.631 1.00 1.41 C ATOM 435 NZ LYS A 200 -4.152 15.240 -10.267 1.00 2.23 N ATOM 436 H LYS A 200 -5.705 10.424 -5.145 1.00 0.23 H ATOM 437 HA LYS A 200 -3.890 10.723 -7.299 1.00 0.24 H ATOM 438 HB2 LYS A 200 -5.624 12.404 -6.530 1.00 0.33 H ATOM 439 HB3 LYS A 200 -4.522 12.827 -5.226 1.00 0.27 H ATOM 440 HG2 LYS A 200 -3.755 14.394 -6.727 1.00 0.98 H ATOM 441 HG3 LYS A 200 -2.804 13.042 -7.330 1.00 0.92 H ATOM 442 HD2 LYS A 200 -4.901 12.545 -8.813 1.00 1.87 H ATOM 443 HD3 LYS A 200 -5.351 14.206 -8.440 1.00 1.73 H ATOM 444 HE2 LYS A 200 -2.599 14.298 -9.211 1.00 1.80 H ATOM 445 HE3 LYS A 200 -3.422 13.272 -10.385 1.00 1.81 H ATOM 446 HZ1 LYS A 200 -5.139 15.345 -9.955 1.00 2.73 H ATOM 447 HZ2 LYS A 200 -3.607 16.082 -9.991 1.00 2.57 H ATOM 448 HZ3 LYS A 200 -4.122 15.135 -11.299 1.00 2.72 H ATOM 449 N ASP A 201 -2.486 11.129 -4.368 1.00 0.18 N ATOM 450 CA ASP A 201 -1.140 11.227 -3.753 1.00 0.17 C ATOM 451 C ASP A 201 -0.403 9.905 -3.940 1.00 0.15 C ATOM 452 O ASP A 201 0.795 9.876 -4.094 1.00 0.17 O ATOM 453 CB ASP A 201 -1.273 11.554 -2.267 1.00 0.18 C ATOM 454 CG ASP A 201 -1.792 12.985 -2.114 1.00 0.24 C ATOM 455 OD1 ASP A 201 -1.450 13.810 -2.945 1.00 1.08 O ATOM 456 OD2 ASP A 201 -2.526 13.231 -1.171 1.00 1.11 O ATOM 457 H ASP A 201 -3.290 11.092 -3.810 1.00 0.19 H ATOM 458 HA ASP A 201 -0.582 12.012 -4.244 1.00 0.19 H ATOM 459 HB2 ASP A 201 -1.963 10.865 -1.804 1.00 0.18 H ATOM 460 HB3 ASP A 201 -0.306 11.473 -1.794 1.00 0.19 H ATOM 461 N LEU A 202 -1.109 8.813 -3.926 1.00 0.14 N ATOM 462 CA LEU A 202 -0.440 7.493 -4.095 1.00 0.15 C ATOM 463 C LEU A 202 0.136 7.347 -5.508 1.00 0.15 C ATOM 464 O LEU A 202 1.212 6.809 -5.682 1.00 0.18 O ATOM 465 CB LEU A 202 -1.451 6.370 -3.842 1.00 0.17 C ATOM 466 CG LEU A 202 -1.872 6.339 -2.354 1.00 0.18 C ATOM 467 CD1 LEU A 202 -3.130 5.431 -2.169 1.00 0.30 C ATOM 468 CD2 LEU A 202 -0.703 5.816 -1.482 1.00 0.30 C ATOM 469 H LEU A 202 -2.079 8.858 -3.798 1.00 0.15 H ATOM 470 HA LEU A 202 0.365 7.415 -3.389 1.00 0.16 H ATOM 471 HB2 LEU A 202 -2.323 6.544 -4.457 1.00 0.19 H ATOM 472 HB3 LEU A 202 -1.009 5.422 -4.111 1.00 0.21 H ATOM 473 HG LEU A 202 -2.115 7.349 -2.045 1.00 0.18 H ATOM 474 HD11 LEU A 202 -3.471 5.061 -3.126 1.00 1.05 H ATOM 475 HD12 LEU A 202 -2.901 4.585 -1.535 1.00 1.08 H ATOM 476 HD13 LEU A 202 -3.925 6.005 -1.712 1.00 1.04 H ATOM 477 HD21 LEU A 202 -0.218 4.988 -1.979 1.00 1.14 H ATOM 478 HD22 LEU A 202 0.012 6.606 -1.318 1.00 1.01 H ATOM 479 HD23 LEU A 202 -1.081 5.486 -0.525 1.00 1.05 H ATOM 480 N VAL A 203 -0.553 7.795 -6.526 1.00 0.14 N ATOM 481 CA VAL A 203 0.012 7.630 -7.896 1.00 0.16 C ATOM 482 C VAL A 203 1.293 8.447 -8.029 1.00 0.18 C ATOM 483 O VAL A 203 2.251 8.009 -8.634 1.00 0.21 O ATOM 484 CB VAL A 203 -0.991 8.040 -8.988 1.00 0.17 C ATOM 485 CG1 VAL A 203 -2.120 7.005 -9.096 1.00 0.22 C ATOM 486 CG2 VAL A 203 -1.590 9.408 -8.676 1.00 0.22 C ATOM 487 H VAL A 203 -1.421 8.224 -6.392 1.00 0.14 H ATOM 488 HA VAL A 203 0.264 6.594 -8.025 1.00 0.17 H ATOM 489 HB VAL A 203 -0.473 8.091 -9.930 1.00 0.20 H ATOM 490 HG11 VAL A 203 -1.725 6.010 -8.955 1.00 1.08 H ATOM 491 HG12 VAL A 203 -2.870 7.200 -8.343 1.00 1.00 H ATOM 492 HG13 VAL A 203 -2.572 7.071 -10.076 1.00 1.06 H ATOM 493 HG21 VAL A 203 -1.916 9.424 -7.653 1.00 1.05 H ATOM 494 HG22 VAL A 203 -0.848 10.175 -8.836 1.00 1.07 H ATOM 495 HG23 VAL A 203 -2.436 9.586 -9.324 1.00 1.00 H ATOM 496 N ASP A 204 1.341 9.620 -7.462 1.00 0.19 N ATOM 497 CA ASP A 204 2.591 10.419 -7.569 1.00 0.23 C ATOM 498 C ASP A 204 3.738 9.577 -7.012 1.00 0.24 C ATOM 499 O ASP A 204 4.817 9.524 -7.567 1.00 0.28 O ATOM 500 CB ASP A 204 2.456 11.708 -6.756 1.00 0.25 C ATOM 501 CG ASP A 204 3.641 12.629 -7.057 1.00 0.32 C ATOM 502 OD1 ASP A 204 3.606 13.290 -8.082 1.00 1.12 O ATOM 503 OD2 ASP A 204 4.562 12.656 -6.258 1.00 1.14 O ATOM 504 H ASP A 204 0.568 9.965 -6.962 1.00 0.18 H ATOM 505 HA ASP A 204 2.784 10.656 -8.605 1.00 0.25 H ATOM 506 HB2 ASP A 204 1.535 12.206 -7.022 1.00 0.26 H ATOM 507 HB3 ASP A 204 2.446 11.470 -5.703 1.00 0.24 H ATOM 508 N ILE A 205 3.499 8.909 -5.919 1.00 0.21 N ATOM 509 CA ILE A 205 4.552 8.050 -5.312 1.00 0.25 C ATOM 510 C ILE A 205 4.763 6.803 -6.177 1.00 0.29 C ATOM 511 O ILE A 205 5.798 6.168 -6.123 1.00 0.38 O ATOM 512 CB ILE A 205 4.112 7.618 -3.911 1.00 0.23 C ATOM 513 CG1 ILE A 205 3.724 8.861 -3.097 1.00 0.20 C ATOM 514 CG2 ILE A 205 5.267 6.888 -3.221 1.00 0.28 C ATOM 515 CD1 ILE A 205 3.160 8.459 -1.713 1.00 0.26 C ATOM 516 H ILE A 205 2.615 8.966 -5.501 1.00 0.19 H ATOM 517 HA ILE A 205 5.476 8.605 -5.244 1.00 0.28 H ATOM 518 HB ILE A 205 3.261 6.956 -3.989 1.00 0.23 H ATOM 519 HG12 ILE A 205 4.596 9.486 -2.966 1.00 0.23 H ATOM 520 HG13 ILE A 205 2.975 9.414 -3.641 1.00 0.20 H ATOM 521 HG21 ILE A 205 6.128 7.539 -3.176 1.00 1.03 H ATOM 522 HG22 ILE A 205 4.975 6.610 -2.220 1.00 1.07 H ATOM 523 HG23 ILE A 205 5.516 6.000 -3.782 1.00 1.08 H ATOM 524 HD11 ILE A 205 2.856 7.421 -1.718 1.00 1.05 H ATOM 525 HD12 ILE A 205 3.919 8.604 -0.957 1.00 1.03 H ATOM 526 HD13 ILE A 205 2.304 9.077 -1.476 1.00 1.02 H ATOM 527 N THR A 206 3.777 6.430 -6.956 1.00 0.26 N ATOM 528 CA THR A 206 3.900 5.203 -7.804 1.00 0.31 C ATOM 529 C THR A 206 3.093 5.382 -9.093 1.00 0.25 C ATOM 530 O THR A 206 1.887 5.453 -9.075 1.00 0.23 O ATOM 531 CB THR A 206 3.331 4.007 -7.036 1.00 0.36 C ATOM 532 OG1 THR A 206 2.057 4.352 -6.509 1.00 0.35 O ATOM 533 CG2 THR A 206 4.270 3.614 -5.896 1.00 0.47 C ATOM 534 H THR A 206 2.945 6.943 -6.967 1.00 0.22 H ATOM 535 HA THR A 206 4.938 5.020 -8.046 1.00 0.39 H ATOM 536 HB THR A 206 3.221 3.171 -7.706 1.00 0.40 H ATOM 537 HG1 THR A 206 2.193 4.960 -5.781 1.00 0.94 H ATOM 538 HG21 THR A 206 4.391 4.446 -5.222 1.00 1.13 H ATOM 539 HG22 THR A 206 3.849 2.777 -5.359 1.00 1.21 H ATOM 540 HG23 THR A 206 5.231 3.335 -6.302 1.00 1.04 H ATOM 541 N LYS A 207 3.748 5.453 -10.211 1.00 0.27 N ATOM 542 CA LYS A 207 3.012 5.634 -11.496 1.00 0.26 C ATOM 543 C LYS A 207 2.423 4.305 -11.959 1.00 0.22 C ATOM 544 O LYS A 207 2.265 4.062 -13.139 1.00 0.21 O ATOM 545 CB LYS A 207 3.974 6.175 -12.548 1.00 0.37 C ATOM 546 CG LYS A 207 4.528 7.502 -12.040 1.00 0.46 C ATOM 547 CD LYS A 207 5.384 8.168 -13.119 1.00 0.98 C ATOM 548 CE LYS A 207 5.771 9.583 -12.664 1.00 1.54 C ATOM 549 NZ LYS A 207 7.054 9.974 -13.304 1.00 2.06 N ATOM 550 H LYS A 207 4.723 5.390 -10.209 1.00 0.33 H ATOM 551 HA LYS A 207 2.211 6.345 -11.351 1.00 0.26 H ATOM 552 HB2 LYS A 207 4.781 5.471 -12.699 1.00 0.41 H ATOM 553 HB3 LYS A 207 3.448 6.334 -13.477 1.00 0.39 H ATOM 554 HG2 LYS A 207 3.708 8.154 -11.779 1.00 0.75 H ATOM 555 HG3 LYS A 207 5.134 7.323 -11.164 1.00 0.72 H ATOM 556 HD2 LYS A 207 6.278 7.583 -13.281 1.00 1.43 H ATOM 557 HD3 LYS A 207 4.822 8.227 -14.039 1.00 1.55 H ATOM 558 HE2 LYS A 207 5.000 10.280 -12.956 1.00 2.16 H ATOM 559 HE3 LYS A 207 5.888 9.606 -11.589 1.00 2.03 H ATOM 560 HZ1 LYS A 207 7.264 9.324 -14.088 1.00 2.42 H ATOM 561 HZ2 LYS A 207 6.978 10.944 -13.666 1.00 2.47 H ATOM 562 HZ3 LYS A 207 7.819 9.928 -12.600 1.00 2.52 H ATOM 563 N GLN A 208 2.086 3.442 -11.040 1.00 0.22 N ATOM 564 CA GLN A 208 1.496 2.131 -11.430 1.00 0.20 C ATOM 565 C GLN A 208 -0.032 2.306 -11.574 1.00 0.19 C ATOM 566 O GLN A 208 -0.628 3.084 -10.856 1.00 0.22 O ATOM 567 CB GLN A 208 1.831 1.103 -10.342 1.00 0.24 C ATOM 568 CG GLN A 208 3.341 0.803 -10.384 1.00 0.32 C ATOM 569 CD GLN A 208 3.798 0.213 -9.049 1.00 0.74 C ATOM 570 OE1 GLN A 208 3.723 -0.981 -8.840 1.00 1.82 O ATOM 571 NE2 GLN A 208 4.282 1.007 -8.133 1.00 0.59 N ATOM 572 H GLN A 208 2.215 3.658 -10.093 1.00 0.24 H ATOM 573 HA GLN A 208 1.930 1.816 -12.365 1.00 0.21 H ATOM 574 HB2 GLN A 208 1.566 1.505 -9.374 1.00 0.24 H ATOM 575 HB3 GLN A 208 1.280 0.193 -10.521 1.00 0.25 H ATOM 576 HG2 GLN A 208 3.542 0.095 -11.174 1.00 0.75 H ATOM 577 HG3 GLN A 208 3.889 1.716 -10.574 1.00 0.93 H ATOM 578 HE21 GLN A 208 4.350 1.970 -8.305 1.00 0.94 H ATOM 579 HE22 GLN A 208 4.576 0.641 -7.273 1.00 1.03 H ATOM 580 N PRO A 209 -0.668 1.618 -12.505 1.00 0.19 N ATOM 581 CA PRO A 209 -2.143 1.751 -12.732 1.00 0.21 C ATOM 582 C PRO A 209 -2.953 1.826 -11.428 1.00 0.18 C ATOM 583 O PRO A 209 -2.796 1.008 -10.542 1.00 0.17 O ATOM 584 CB PRO A 209 -2.502 0.483 -13.518 1.00 0.26 C ATOM 585 CG PRO A 209 -1.251 0.102 -14.254 1.00 0.29 C ATOM 586 CD PRO A 209 -0.064 0.643 -13.437 1.00 0.22 C ATOM 587 HA PRO A 209 -2.345 2.617 -13.341 1.00 0.24 H ATOM 588 HB2 PRO A 209 -2.799 -0.310 -12.841 1.00 0.37 H ATOM 589 HB3 PRO A 209 -3.298 0.688 -14.221 1.00 0.36 H ATOM 590 HG2 PRO A 209 -1.186 -0.978 -14.341 1.00 0.47 H ATOM 591 HG3 PRO A 209 -1.247 0.548 -15.239 1.00 0.42 H ATOM 592 HD2 PRO A 209 0.417 -0.157 -12.889 1.00 0.25 H ATOM 593 HD3 PRO A 209 0.642 1.136 -14.088 1.00 0.25 H ATOM 594 N VAL A 210 -3.825 2.799 -11.305 1.00 0.19 N ATOM 595 CA VAL A 210 -4.639 2.914 -10.063 1.00 0.18 C ATOM 596 C VAL A 210 -5.410 1.623 -9.821 1.00 0.18 C ATOM 597 O VAL A 210 -5.508 1.151 -8.706 1.00 0.18 O ATOM 598 CB VAL A 210 -5.603 4.105 -10.155 1.00 0.21 C ATOM 599 CG1 VAL A 210 -4.782 5.382 -10.236 1.00 0.25 C ATOM 600 CG2 VAL A 210 -6.513 4.012 -11.390 1.00 0.26 C ATOM 601 H VAL A 210 -3.945 3.448 -12.027 1.00 0.21 H ATOM 602 HA VAL A 210 -3.971 3.071 -9.230 1.00 0.16 H ATOM 603 HB VAL A 210 -6.208 4.133 -9.263 1.00 0.22 H ATOM 604 HG11 VAL A 210 -4.086 5.402 -9.416 1.00 1.03 H ATOM 605 HG12 VAL A 210 -4.239 5.402 -11.169 1.00 1.04 H ATOM 606 HG13 VAL A 210 -5.436 6.238 -10.176 1.00 1.02 H ATOM 607 HG21 VAL A 210 -6.895 3.015 -11.493 1.00 1.06 H ATOM 608 HG22 VAL A 210 -7.342 4.694 -11.268 1.00 1.04 H ATOM 609 HG23 VAL A 210 -5.957 4.279 -12.276 1.00 1.02 H ATOM 610 N VAL A 211 -5.955 1.037 -10.846 1.00 0.20 N ATOM 611 CA VAL A 211 -6.706 -0.220 -10.649 1.00 0.21 C ATOM 612 C VAL A 211 -5.805 -1.202 -9.925 1.00 0.20 C ATOM 613 O VAL A 211 -6.236 -1.938 -9.077 1.00 0.21 O ATOM 614 CB VAL A 211 -7.125 -0.809 -12.004 1.00 0.26 C ATOM 615 CG1 VAL A 211 -8.328 -0.039 -12.562 1.00 1.32 C ATOM 616 CG2 VAL A 211 -5.953 -0.720 -12.988 1.00 1.40 C ATOM 617 H VAL A 211 -5.866 1.423 -11.739 1.00 0.21 H ATOM 618 HA VAL A 211 -7.581 -0.028 -10.049 1.00 0.22 H ATOM 619 HB VAL A 211 -7.399 -1.843 -11.871 1.00 1.03 H ATOM 620 HG11 VAL A 211 -8.207 1.016 -12.369 1.00 1.92 H ATOM 621 HG12 VAL A 211 -8.404 -0.204 -13.628 1.00 1.88 H ATOM 622 HG13 VAL A 211 -9.229 -0.391 -12.082 1.00 1.92 H ATOM 623 HG21 VAL A 211 -5.103 -1.249 -12.584 1.00 2.01 H ATOM 624 HG22 VAL A 211 -6.240 -1.167 -13.928 1.00 1.98 H ATOM 625 HG23 VAL A 211 -5.690 0.314 -13.148 1.00 1.96 H ATOM 626 N TYR A 212 -4.550 -1.205 -10.241 1.00 0.20 N ATOM 627 CA TYR A 212 -3.633 -2.156 -9.559 1.00 0.21 C ATOM 628 C TYR A 212 -3.445 -1.728 -8.109 1.00 0.18 C ATOM 629 O TYR A 212 -3.530 -2.530 -7.200 1.00 0.19 O ATOM 630 CB TYR A 212 -2.283 -2.172 -10.277 1.00 0.23 C ATOM 631 CG TYR A 212 -1.402 -3.230 -9.658 1.00 0.25 C ATOM 632 CD1 TYR A 212 -1.591 -4.586 -9.994 1.00 0.31 C ATOM 633 CD2 TYR A 212 -0.396 -2.865 -8.743 1.00 0.28 C ATOM 634 CE1 TYR A 212 -0.773 -5.575 -9.415 1.00 0.35 C ATOM 635 CE2 TYR A 212 0.422 -3.855 -8.165 1.00 0.33 C ATOM 636 CZ TYR A 212 0.233 -5.210 -8.501 1.00 0.35 C ATOM 637 OH TYR A 212 1.034 -6.179 -7.933 1.00 0.42 O ATOM 638 H TYR A 212 -4.212 -0.581 -10.918 1.00 0.20 H ATOM 639 HA TYR A 212 -4.065 -3.144 -9.582 1.00 0.22 H ATOM 640 HB2 TYR A 212 -2.434 -2.396 -11.323 1.00 0.26 H ATOM 641 HB3 TYR A 212 -1.809 -1.207 -10.178 1.00 0.25 H ATOM 642 HD1 TYR A 212 -2.363 -4.865 -10.695 1.00 0.35 H ATOM 643 HD2 TYR A 212 -0.251 -1.827 -8.486 1.00 0.31 H ATOM 644 HE1 TYR A 212 -0.918 -6.613 -9.672 1.00 0.42 H ATOM 645 HE2 TYR A 212 1.195 -3.576 -7.464 1.00 0.38 H ATOM 646 HH TYR A 212 1.212 -6.845 -8.601 1.00 0.99 H ATOM 647 N LEU A 213 -3.204 -0.473 -7.880 1.00 0.16 N ATOM 648 CA LEU A 213 -3.028 -0.003 -6.482 1.00 0.15 C ATOM 649 C LEU A 213 -4.342 -0.186 -5.729 1.00 0.14 C ATOM 650 O LEU A 213 -4.368 -0.627 -4.597 1.00 0.15 O ATOM 651 CB LEU A 213 -2.661 1.479 -6.477 1.00 0.17 C ATOM 652 CG LEU A 213 -1.301 1.681 -7.164 1.00 0.23 C ATOM 653 CD1 LEU A 213 -1.015 3.189 -7.308 1.00 0.52 C ATOM 654 CD2 LEU A 213 -0.173 0.998 -6.339 1.00 0.47 C ATOM 655 H LEU A 213 -3.149 0.161 -8.625 1.00 0.17 H ATOM 656 HA LEU A 213 -2.251 -0.574 -6.000 1.00 0.17 H ATOM 657 HB2 LEU A 213 -3.421 2.035 -7.005 1.00 0.17 H ATOM 658 HB3 LEU A 213 -2.603 1.831 -5.457 1.00 0.20 H ATOM 659 HG LEU A 213 -1.341 1.240 -8.151 1.00 0.52 H ATOM 660 HD11 LEU A 213 -1.930 3.718 -7.532 1.00 1.12 H ATOM 661 HD12 LEU A 213 -0.595 3.568 -6.388 1.00 1.23 H ATOM 662 HD13 LEU A 213 -0.310 3.343 -8.112 1.00 1.21 H ATOM 663 HD21 LEU A 213 -0.501 0.832 -5.322 1.00 1.08 H ATOM 664 HD22 LEU A 213 0.077 0.048 -6.790 1.00 1.19 H ATOM 665 HD23 LEU A 213 0.709 1.622 -6.326 1.00 1.17 H ATOM 666 N LYS A 214 -5.436 0.166 -6.348 1.00 0.13 N ATOM 667 CA LYS A 214 -6.747 0.032 -5.663 1.00 0.14 C ATOM 668 C LYS A 214 -6.986 -1.415 -5.243 1.00 0.13 C ATOM 669 O LYS A 214 -7.425 -1.665 -4.145 1.00 0.14 O ATOM 670 CB LYS A 214 -7.883 0.492 -6.590 1.00 0.16 C ATOM 671 CG LYS A 214 -7.859 2.031 -6.718 1.00 0.18 C ATOM 672 CD LYS A 214 -9.205 2.570 -7.261 1.00 0.26 C ATOM 673 CE LYS A 214 -9.185 2.609 -8.790 1.00 1.27 C ATOM 674 NZ LYS A 214 -10.517 3.046 -9.295 1.00 1.77 N ATOM 675 H LYS A 214 -5.392 0.529 -7.258 1.00 0.14 H ATOM 676 HA LYS A 214 -6.741 0.644 -4.777 1.00 0.15 H ATOM 677 HB2 LYS A 214 -7.752 0.042 -7.566 1.00 0.17 H ATOM 678 HB3 LYS A 214 -8.827 0.175 -6.173 1.00 0.17 H ATOM 679 HG2 LYS A 214 -7.675 2.466 -5.745 1.00 0.24 H ATOM 680 HG3 LYS A 214 -7.058 2.317 -7.388 1.00 0.22 H ATOM 681 HD2 LYS A 214 -10.017 1.939 -6.932 1.00 1.07 H ATOM 682 HD3 LYS A 214 -9.366 3.571 -6.886 1.00 0.98 H ATOM 683 HE2 LYS A 214 -8.430 3.305 -9.122 1.00 1.94 H ATOM 684 HE3 LYS A 214 -8.962 1.626 -9.172 1.00 1.97 H ATOM 685 HZ1 LYS A 214 -11.267 2.612 -8.720 1.00 2.12 H ATOM 686 HZ2 LYS A 214 -10.588 4.083 -9.234 1.00 2.16 H ATOM 687 HZ3 LYS A 214 -10.626 2.748 -10.284 1.00 2.30 H ATOM 688 N GLU A 215 -6.708 -2.370 -6.087 1.00 0.14 N ATOM 689 CA GLU A 215 -6.959 -3.784 -5.683 1.00 0.14 C ATOM 690 C GLU A 215 -6.126 -4.115 -4.441 1.00 0.13 C ATOM 691 O GLU A 215 -6.553 -4.866 -3.586 1.00 0.14 O ATOM 692 CB GLU A 215 -6.598 -4.744 -6.831 1.00 0.16 C ATOM 693 CG GLU A 215 -7.574 -4.548 -8.023 1.00 0.18 C ATOM 694 CD GLU A 215 -7.822 -5.868 -8.768 1.00 1.21 C ATOM 695 OE1 GLU A 215 -7.363 -6.898 -8.306 1.00 1.97 O ATOM 696 OE2 GLU A 215 -8.469 -5.818 -9.802 1.00 1.99 O ATOM 697 H GLU A 215 -6.352 -2.159 -6.978 1.00 0.15 H ATOM 698 HA GLU A 215 -8.005 -3.899 -5.439 1.00 0.15 H ATOM 699 HB2 GLU A 215 -5.585 -4.545 -7.155 1.00 0.16 H ATOM 700 HB3 GLU A 215 -6.663 -5.757 -6.467 1.00 0.18 H ATOM 701 HG2 GLU A 215 -8.518 -4.160 -7.673 1.00 0.92 H ATOM 702 HG3 GLU A 215 -7.150 -3.848 -8.712 1.00 0.86 H ATOM 703 N ILE A 216 -4.961 -3.546 -4.313 1.00 0.12 N ATOM 704 CA ILE A 216 -4.138 -3.819 -3.100 1.00 0.12 C ATOM 705 C ILE A 216 -4.773 -3.077 -1.927 1.00 0.12 C ATOM 706 O ILE A 216 -4.973 -3.623 -0.860 1.00 0.15 O ATOM 707 CB ILE A 216 -2.704 -3.319 -3.348 1.00 0.13 C ATOM 708 CG1 ILE A 216 -2.111 -4.129 -4.518 1.00 0.16 C ATOM 709 CG2 ILE A 216 -1.826 -3.484 -2.079 1.00 0.17 C ATOM 710 CD1 ILE A 216 -0.851 -3.444 -5.072 1.00 0.18 C ATOM 711 H ILE A 216 -4.637 -2.926 -4.999 1.00 0.12 H ATOM 712 HA ILE A 216 -4.128 -4.879 -2.896 1.00 0.14 H ATOM 713 HB ILE A 216 -2.738 -2.274 -3.621 1.00 0.14 H ATOM 714 HG12 ILE A 216 -1.861 -5.124 -4.179 1.00 0.18 H ATOM 715 HG13 ILE A 216 -2.847 -4.204 -5.307 1.00 0.17 H ATOM 716 HG21 ILE A 216 -2.414 -3.320 -1.193 1.00 1.02 H ATOM 717 HG22 ILE A 216 -1.408 -4.477 -2.043 1.00 1.00 H ATOM 718 HG23 ILE A 216 -1.022 -2.760 -2.102 1.00 1.05 H ATOM 719 HD11 ILE A 216 -0.344 -2.906 -4.287 1.00 1.00 H ATOM 720 HD12 ILE A 216 -0.190 -4.191 -5.477 1.00 1.09 H ATOM 721 HD13 ILE A 216 -1.129 -2.756 -5.856 1.00 0.98 H ATOM 722 N LEU A 217 -5.093 -1.835 -2.126 1.00 0.11 N ATOM 723 CA LEU A 217 -5.720 -1.040 -1.041 1.00 0.12 C ATOM 724 C LEU A 217 -7.091 -1.632 -0.706 1.00 0.12 C ATOM 725 O LEU A 217 -7.571 -1.541 0.397 1.00 0.14 O ATOM 726 CB LEU A 217 -5.898 0.401 -1.519 1.00 0.15 C ATOM 727 CG LEU A 217 -4.530 1.027 -1.819 1.00 0.17 C ATOM 728 CD1 LEU A 217 -4.739 2.342 -2.571 1.00 0.21 C ATOM 729 CD2 LEU A 217 -3.760 1.297 -0.512 1.00 0.20 C ATOM 730 H LEU A 217 -4.923 -1.422 -2.998 1.00 0.11 H ATOM 731 HA LEU A 217 -5.091 -1.058 -0.164 1.00 0.14 H ATOM 732 HB2 LEU A 217 -6.496 0.405 -2.419 1.00 0.15 H ATOM 733 HB3 LEU A 217 -6.398 0.975 -0.756 1.00 0.17 H ATOM 734 HG LEU A 217 -3.958 0.351 -2.440 1.00 0.16 H ATOM 735 HD11 LEU A 217 -5.316 2.157 -3.464 1.00 1.06 H ATOM 736 HD12 LEU A 217 -5.269 3.039 -1.938 1.00 1.02 H ATOM 737 HD13 LEU A 217 -3.781 2.758 -2.842 1.00 1.01 H ATOM 738 HD21 LEU A 217 -4.442 1.633 0.255 1.00 0.97 H ATOM 739 HD22 LEU A 217 -3.274 0.389 -0.187 1.00 1.04 H ATOM 740 HD23 LEU A 217 -3.011 2.058 -0.681 1.00 1.01 H ATOM 741 N LYS A 218 -7.745 -2.224 -1.652 1.00 0.14 N ATOM 742 CA LYS A 218 -9.087 -2.789 -1.354 1.00 0.16 C ATOM 743 C LYS A 218 -8.969 -3.964 -0.372 1.00 0.15 C ATOM 744 O LYS A 218 -9.821 -4.162 0.471 1.00 0.17 O ATOM 745 CB LYS A 218 -9.753 -3.258 -2.668 1.00 0.21 C ATOM 746 CG LYS A 218 -11.157 -2.653 -2.808 1.00 1.09 C ATOM 747 CD LYS A 218 -11.713 -2.965 -4.211 1.00 1.26 C ATOM 748 CE LYS A 218 -13.242 -3.032 -4.174 1.00 1.90 C ATOM 749 NZ LYS A 218 -13.736 -3.536 -5.482 1.00 2.47 N ATOM 750 H LYS A 218 -7.367 -2.287 -2.555 1.00 0.15 H ATOM 751 HA LYS A 218 -9.687 -2.017 -0.893 1.00 0.19 H ATOM 752 HB2 LYS A 218 -9.154 -2.944 -3.500 1.00 0.71 H ATOM 753 HB3 LYS A 218 -9.832 -4.336 -2.683 1.00 0.87 H ATOM 754 HG2 LYS A 218 -11.798 -3.073 -2.047 1.00 1.88 H ATOM 755 HG3 LYS A 218 -11.099 -1.581 -2.677 1.00 1.69 H ATOM 756 HD2 LYS A 218 -11.408 -2.186 -4.896 1.00 1.56 H ATOM 757 HD3 LYS A 218 -11.326 -3.914 -4.557 1.00 1.82 H ATOM 758 HE2 LYS A 218 -13.558 -3.703 -3.388 1.00 2.38 H ATOM 759 HE3 LYS A 218 -13.642 -2.046 -3.991 1.00 2.40 H ATOM 760 HZ1 LYS A 218 -13.215 -3.070 -6.251 1.00 2.90 H ATOM 761 HZ2 LYS A 218 -13.585 -4.565 -5.533 1.00 2.81 H ATOM 762 HZ3 LYS A 218 -14.748 -3.327 -5.573 1.00 2.86 H ATOM 763 N GLU A 219 -7.948 -4.765 -0.495 1.00 0.14 N ATOM 764 CA GLU A 219 -7.827 -5.941 0.412 1.00 0.16 C ATOM 765 C GLU A 219 -7.339 -5.515 1.802 1.00 0.15 C ATOM 766 O GLU A 219 -7.845 -5.987 2.800 1.00 0.25 O ATOM 767 CB GLU A 219 -6.851 -6.950 -0.201 1.00 0.20 C ATOM 768 CG GLU A 219 -7.418 -7.464 -1.533 1.00 0.25 C ATOM 769 CD GLU A 219 -6.705 -8.754 -1.939 1.00 1.13 C ATOM 770 OE1 GLU A 219 -6.937 -9.764 -1.296 1.00 1.93 O ATOM 771 OE2 GLU A 219 -5.942 -8.711 -2.891 1.00 1.85 O ATOM 772 H GLU A 219 -7.279 -4.613 -1.199 1.00 0.15 H ATOM 773 HA GLU A 219 -8.796 -6.408 0.511 1.00 0.18 H ATOM 774 HB2 GLU A 219 -5.898 -6.471 -0.374 1.00 0.21 H ATOM 775 HB3 GLU A 219 -6.719 -7.781 0.477 1.00 0.22 H ATOM 776 HG2 GLU A 219 -8.476 -7.660 -1.427 1.00 0.91 H ATOM 777 HG3 GLU A 219 -7.266 -6.718 -2.298 1.00 0.88 H ATOM 778 N ILE A 220 -6.361 -4.642 1.883 1.00 0.13 N ATOM 779 CA ILE A 220 -5.836 -4.205 3.224 1.00 0.13 C ATOM 780 C ILE A 220 -6.087 -2.709 3.452 1.00 0.13 C ATOM 781 O ILE A 220 -5.906 -2.208 4.540 1.00 0.16 O ATOM 782 CB ILE A 220 -4.326 -4.470 3.281 1.00 0.15 C ATOM 783 CG1 ILE A 220 -3.617 -3.717 2.140 1.00 0.17 C ATOM 784 CG2 ILE A 220 -4.069 -5.972 3.132 1.00 0.18 C ATOM 785 CD1 ILE A 220 -2.111 -3.662 2.402 1.00 0.21 C ATOM 786 H ILE A 220 -5.962 -4.281 1.063 1.00 0.19 H ATOM 787 HA ILE A 220 -6.317 -4.765 4.015 1.00 0.14 H ATOM 788 HB ILE A 220 -3.946 -4.135 4.235 1.00 0.16 H ATOM 789 HG12 ILE A 220 -3.796 -4.230 1.208 1.00 0.20 H ATOM 790 HG13 ILE A 220 -3.996 -2.710 2.068 1.00 0.19 H ATOM 791 HG21 ILE A 220 -4.464 -6.313 2.187 1.00 1.01 H ATOM 792 HG22 ILE A 220 -3.008 -6.165 3.169 1.00 0.98 H ATOM 793 HG23 ILE A 220 -4.555 -6.500 3.936 1.00 1.03 H ATOM 794 HD11 ILE A 220 -1.923 -3.459 3.445 1.00 1.01 H ATOM 795 HD12 ILE A 220 -1.666 -4.605 2.133 1.00 1.04 H ATOM 796 HD13 ILE A 220 -1.682 -2.874 1.804 1.00 1.08 H ATOM 797 N GLY A 221 -6.464 -1.983 2.435 1.00 0.14 N ATOM 798 CA GLY A 221 -6.686 -0.512 2.611 1.00 0.15 C ATOM 799 C GLY A 221 -8.123 -0.226 3.052 1.00 0.15 C ATOM 800 O GLY A 221 -8.925 -1.119 3.239 1.00 0.17 O ATOM 801 H GLY A 221 -6.581 -2.395 1.552 1.00 0.17 H ATOM 802 HA2 GLY A 221 -6.010 -0.137 3.359 1.00 0.16 H ATOM 803 HA3 GLY A 221 -6.492 -0.001 1.681 1.00 0.17 H ATOM 804 N VAL A 222 -8.440 1.031 3.215 1.00 0.15 N ATOM 805 CA VAL A 222 -9.809 1.443 3.644 1.00 0.17 C ATOM 806 C VAL A 222 -10.161 2.719 2.873 1.00 0.16 C ATOM 807 O VAL A 222 -9.344 3.231 2.149 1.00 0.15 O ATOM 808 CB VAL A 222 -9.798 1.718 5.161 1.00 0.18 C ATOM 809 CG1 VAL A 222 -11.195 2.170 5.637 1.00 0.21 C ATOM 810 CG2 VAL A 222 -9.387 0.435 5.898 1.00 0.23 C ATOM 811 H VAL A 222 -7.762 1.720 3.053 1.00 0.16 H ATOM 812 HA VAL A 222 -10.524 0.665 3.412 1.00 0.19 H ATOM 813 HB VAL A 222 -9.077 2.498 5.378 1.00 0.18 H ATOM 814 HG11 VAL A 222 -11.958 1.707 5.030 1.00 1.05 H ATOM 815 HG12 VAL A 222 -11.342 1.885 6.670 1.00 1.01 H ATOM 816 HG13 VAL A 222 -11.273 3.245 5.553 1.00 1.05 H ATOM 817 HG21 VAL A 222 -10.077 -0.359 5.653 1.00 1.00 H ATOM 818 HG22 VAL A 222 -8.390 0.151 5.599 1.00 1.10 H ATOM 819 HG23 VAL A 222 -9.403 0.610 6.963 1.00 1.03 H ATOM 820 N GLN A 223 -11.357 3.234 3.005 1.00 0.17 N ATOM 821 CA GLN A 223 -11.732 4.482 2.255 1.00 0.17 C ATOM 822 C GLN A 223 -12.555 5.383 3.171 1.00 0.15 C ATOM 823 O GLN A 223 -13.184 4.927 4.105 1.00 0.17 O ATOM 824 CB GLN A 223 -12.565 4.110 1.018 1.00 0.19 C ATOM 825 CG GLN A 223 -13.044 5.377 0.287 1.00 0.19 C ATOM 826 CD GLN A 223 -11.845 6.246 -0.105 1.00 0.19 C ATOM 827 OE1 GLN A 223 -11.033 5.849 -0.916 1.00 0.22 O ATOM 828 NE2 GLN A 223 -11.701 7.427 0.437 1.00 0.20 N ATOM 829 H GLN A 223 -12.012 2.802 3.585 1.00 0.20 H ATOM 830 HA GLN A 223 -10.841 5.010 1.945 1.00 0.16 H ATOM 831 HB2 GLN A 223 -11.960 3.519 0.346 1.00 0.21 H ATOM 832 HB3 GLN A 223 -13.423 3.532 1.326 1.00 0.20 H ATOM 833 HG2 GLN A 223 -13.582 5.091 -0.605 1.00 0.22 H ATOM 834 HG3 GLN A 223 -13.701 5.943 0.930 1.00 0.18 H ATOM 835 HE21 GLN A 223 -12.358 7.750 1.090 1.00 0.22 H ATOM 836 HE22 GLN A 223 -10.936 7.988 0.194 1.00 0.21 H ATOM 837 N ASN A 224 -12.548 6.665 2.918 1.00 0.14 N ATOM 838 CA ASN A 224 -13.321 7.596 3.784 1.00 0.13 C ATOM 839 C ASN A 224 -13.691 8.844 2.988 1.00 0.13 C ATOM 840 O ASN A 224 -12.835 9.600 2.565 1.00 0.18 O ATOM 841 CB ASN A 224 -12.459 8.029 4.975 1.00 0.14 C ATOM 842 CG ASN A 224 -11.613 6.851 5.449 1.00 0.18 C ATOM 843 OD1 ASN A 224 -11.995 6.129 6.349 1.00 0.22 O ATOM 844 ND2 ASN A 224 -10.466 6.628 4.868 1.00 0.21 N ATOM 845 H ASN A 224 -12.028 7.014 2.169 1.00 0.14 H ATOM 846 HA ASN A 224 -14.219 7.112 4.140 1.00 0.15 H ATOM 847 HB2 ASN A 224 -11.811 8.843 4.681 1.00 0.14 H ATOM 848 HB3 ASN A 224 -13.101 8.356 5.779 1.00 0.16 H ATOM 849 HD21 ASN A 224 -10.163 7.215 4.139 1.00 0.24 H ATOM 850 HD22 ASN A 224 -9.906 5.877 5.157 1.00 0.25 H ATOM 851 N VAL A 225 -14.957 9.081 2.811 1.00 0.20 N ATOM 852 CA VAL A 225 -15.395 10.301 2.086 1.00 0.24 C ATOM 853 C VAL A 225 -15.651 11.378 3.139 1.00 0.28 C ATOM 854 O VAL A 225 -16.084 11.083 4.235 1.00 0.37 O ATOM 855 CB VAL A 225 -16.674 9.999 1.306 1.00 0.33 C ATOM 856 CG1 VAL A 225 -16.337 9.060 0.143 1.00 0.37 C ATOM 857 CG2 VAL A 225 -17.700 9.322 2.230 1.00 0.39 C ATOM 858 H VAL A 225 -15.624 8.469 3.184 1.00 0.27 H ATOM 859 HA VAL A 225 -14.616 10.634 1.405 1.00 0.22 H ATOM 860 HB VAL A 225 -17.085 10.920 0.918 1.00 0.38 H ATOM 861 HG11 VAL A 225 -15.774 8.216 0.515 1.00 1.03 H ATOM 862 HG12 VAL A 225 -17.250 8.710 -0.314 1.00 1.10 H ATOM 863 HG13 VAL A 225 -15.747 9.591 -0.590 1.00 1.06 H ATOM 864 HG21 VAL A 225 -17.649 9.754 3.218 1.00 1.02 H ATOM 865 HG22 VAL A 225 -18.690 9.466 1.830 1.00 1.10 H ATOM 866 HG23 VAL A 225 -17.488 8.265 2.296 1.00 1.11 H ATOM 867 N LYS A 226 -15.337 12.607 2.848 1.00 0.29 N ATOM 868 CA LYS A 226 -15.518 13.692 3.866 1.00 0.34 C ATOM 869 C LYS A 226 -16.341 14.850 3.301 1.00 0.38 C ATOM 870 O LYS A 226 -16.979 14.723 2.274 1.00 0.42 O ATOM 871 CB LYS A 226 -14.124 14.150 4.277 1.00 0.40 C ATOM 872 CG LYS A 226 -13.273 12.885 4.524 1.00 0.57 C ATOM 873 CD LYS A 226 -12.088 13.171 5.448 1.00 0.61 C ATOM 874 CE LYS A 226 -12.569 13.672 6.824 1.00 1.05 C ATOM 875 NZ LYS A 226 -11.654 13.173 7.886 1.00 1.82 N ATOM 876 H LYS A 226 -14.943 12.812 1.978 1.00 0.31 H ATOM 877 HA LYS A 226 -16.028 13.306 4.738 1.00 0.43 H ATOM 878 HB2 LYS A 226 -13.688 14.739 3.483 1.00 0.42 H ATOM 879 HB3 LYS A 226 -14.189 14.737 5.176 1.00 0.44 H ATOM 880 HG2 LYS A 226 -13.884 12.113 4.977 1.00 1.23 H ATOM 881 HG3 LYS A 226 -12.899 12.526 3.579 1.00 1.07 H ATOM 882 HD2 LYS A 226 -11.528 12.254 5.580 1.00 1.26 H ATOM 883 HD3 LYS A 226 -11.452 13.912 4.994 1.00 1.17 H ATOM 884 HE2 LYS A 226 -12.565 14.752 6.841 1.00 1.62 H ATOM 885 HE3 LYS A 226 -13.570 13.314 7.024 1.00 1.60 H ATOM 886 HZ1 LYS A 226 -11.020 12.452 7.491 1.00 2.39 H ATOM 887 HZ2 LYS A 226 -11.089 13.964 8.256 1.00 2.27 H ATOM 888 HZ3 LYS A 226 -12.215 12.758 8.660 1.00 2.28 H ATOM 889 N GLY A 227 -16.344 15.971 3.989 1.00 0.45 N ATOM 890 CA GLY A 227 -17.138 17.161 3.538 1.00 0.58 C ATOM 891 C GLY A 227 -17.140 17.260 2.011 1.00 0.54 C ATOM 892 O GLY A 227 -18.101 16.900 1.360 1.00 0.59 O ATOM 893 H GLY A 227 -15.832 16.023 4.822 1.00 0.45 H ATOM 894 HA2 GLY A 227 -18.155 17.065 3.891 1.00 0.67 H ATOM 895 HA3 GLY A 227 -16.702 18.057 3.951 1.00 0.66 H ATOM 896 N ILE A 228 -16.073 17.733 1.435 1.00 0.52 N ATOM 897 CA ILE A 228 -16.019 17.837 -0.048 1.00 0.52 C ATOM 898 C ILE A 228 -15.721 16.453 -0.629 1.00 0.48 C ATOM 899 O ILE A 228 -15.241 16.323 -1.736 1.00 0.64 O ATOM 900 CB ILE A 228 -14.933 18.850 -0.453 1.00 0.56 C ATOM 901 CG1 ILE A 228 -13.557 18.362 0.052 1.00 0.52 C ATOM 902 CG2 ILE A 228 -15.269 20.236 0.160 1.00 0.65 C ATOM 903 CD1 ILE A 228 -12.425 19.278 -0.457 1.00 0.63 C ATOM 904 H ILE A 228 -15.305 18.010 1.976 1.00 0.55 H ATOM 905 HA ILE A 228 -16.978 18.176 -0.416 1.00 0.58 H ATOM 906 HB ILE A 228 -14.912 18.933 -1.532 1.00 0.60 H ATOM 907 HG12 ILE A 228 -13.562 18.362 1.129 1.00 0.54 H ATOM 908 HG13 ILE A 228 -13.378 17.356 -0.298 1.00 0.46 H ATOM 909 HG21 ILE A 228 -16.335 20.316 0.331 1.00 1.20 H ATOM 910 HG22 ILE A 228 -14.752 20.361 1.101 1.00 1.16 H ATOM 911 HG23 ILE A 228 -14.964 21.018 -0.520 1.00 1.26 H ATOM 912 HD11 ILE A 228 -12.792 20.281 -0.602 1.00 1.23 H ATOM 913 HD12 ILE A 228 -11.622 19.294 0.267 1.00 1.23 H ATOM 914 HD13 ILE A 228 -12.047 18.899 -1.396 1.00 1.14 H ATOM 915 N HIS A 229 -16.002 15.422 0.130 1.00 0.39 N ATOM 916 CA HIS A 229 -15.749 14.024 -0.334 1.00 0.36 C ATOM 917 C HIS A 229 -14.250 13.801 -0.540 1.00 0.29 C ATOM 918 O HIS A 229 -13.817 13.393 -1.599 1.00 0.35 O ATOM 919 CB HIS A 229 -16.489 13.759 -1.651 1.00 0.46 C ATOM 920 CG HIS A 229 -17.915 14.219 -1.527 1.00 0.56 C ATOM 921 ND1 HIS A 229 -18.912 13.406 -1.011 1.00 1.06 N ATOM 922 CD2 HIS A 229 -18.527 15.405 -1.847 1.00 0.98 C ATOM 923 CE1 HIS A 229 -20.060 14.107 -1.035 1.00 0.96 C ATOM 924 NE2 HIS A 229 -19.881 15.333 -1.535 1.00 0.83 N ATOM 925 H HIS A 229 -16.383 15.571 1.021 1.00 0.46 H ATOM 926 HA HIS A 229 -16.107 13.333 0.417 1.00 0.37 H ATOM 927 HB2 HIS A 229 -16.006 14.287 -2.457 1.00 0.48 H ATOM 928 HB3 HIS A 229 -16.475 12.700 -1.860 1.00 0.50 H ATOM 929 HD1 HIS A 229 -18.801 12.487 -0.689 1.00 1.64 H ATOM 930 HD2 HIS A 229 -18.032 16.265 -2.274 1.00 1.64 H ATOM 931 HE1 HIS A 229 -21.010 13.725 -0.692 1.00 1.41 H ATOM 932 N LYS A 230 -13.451 14.053 0.464 1.00 0.24 N ATOM 933 CA LYS A 230 -11.985 13.837 0.305 1.00 0.24 C ATOM 934 C LYS A 230 -11.701 12.339 0.299 1.00 0.19 C ATOM 935 O LYS A 230 -11.938 11.646 1.269 1.00 0.20 O ATOM 936 CB LYS A 230 -11.226 14.489 1.463 1.00 0.34 C ATOM 937 CG LYS A 230 -11.458 16.006 1.448 1.00 0.49 C ATOM 938 CD LYS A 230 -10.598 16.702 2.548 1.00 0.77 C ATOM 939 CE LYS A 230 -11.480 17.511 3.517 1.00 0.80 C ATOM 940 NZ LYS A 230 -10.648 18.530 4.212 1.00 1.31 N ATOM 941 H LYS A 230 -13.813 14.374 1.316 1.00 0.27 H ATOM 942 HA LYS A 230 -11.660 14.266 -0.629 1.00 0.29 H ATOM 943 HB2 LYS A 230 -11.578 14.079 2.399 1.00 0.41 H ATOM 944 HB3 LYS A 230 -10.170 14.288 1.357 1.00 0.39 H ATOM 945 HG2 LYS A 230 -11.181 16.389 0.473 1.00 0.69 H ATOM 946 HG3 LYS A 230 -12.506 16.197 1.615 1.00 0.87 H ATOM 947 HD2 LYS A 230 -10.053 15.959 3.116 1.00 1.52 H ATOM 948 HD3 LYS A 230 -9.889 17.371 2.080 1.00 1.34 H ATOM 949 HE2 LYS A 230 -12.263 18.010 2.974 1.00 1.31 H ATOM 950 HE3 LYS A 230 -11.915 16.846 4.247 1.00 1.42 H ATOM 951 HZ1 LYS A 230 -9.699 18.551 3.789 1.00 1.86 H ATOM 952 HZ2 LYS A 230 -11.091 19.465 4.109 1.00 1.74 H ATOM 953 HZ3 LYS A 230 -10.576 18.288 5.221 1.00 1.78 H ATOM 954 N ASN A 231 -11.198 11.831 -0.788 1.00 0.19 N ATOM 955 CA ASN A 231 -10.902 10.377 -0.861 1.00 0.19 C ATOM 956 C ASN A 231 -9.631 10.079 -0.065 1.00 0.18 C ATOM 957 O ASN A 231 -8.565 10.523 -0.425 1.00 0.24 O ATOM 958 CB ASN A 231 -10.680 9.988 -2.328 1.00 0.25 C ATOM 959 CG ASN A 231 -11.683 10.729 -3.209 1.00 0.27 C ATOM 960 OD1 ASN A 231 -12.865 10.447 -3.178 1.00 0.32 O ATOM 961 ND2 ASN A 231 -11.257 11.680 -3.997 1.00 0.30 N ATOM 962 H ASN A 231 -11.017 12.407 -1.560 1.00 0.23 H ATOM 963 HA ASN A 231 -11.729 9.813 -0.455 1.00 0.19 H ATOM 964 HB2 ASN A 231 -9.675 10.254 -2.629 1.00 0.28 H ATOM 965 HB3 ASN A 231 -10.820 8.924 -2.443 1.00 0.30 H ATOM 966 HD21 ASN A 231 -10.301 11.910 -4.016 1.00 0.33 H ATOM 967 HD22 ASN A 231 -11.889 12.165 -4.568 1.00 0.32 H ATOM 968 N THR A 232 -9.722 9.327 1.003 1.00 0.14 N ATOM 969 CA THR A 232 -8.492 9.001 1.799 1.00 0.15 C ATOM 970 C THR A 232 -8.426 7.498 2.035 1.00 0.17 C ATOM 971 O THR A 232 -9.423 6.859 2.318 1.00 0.30 O ATOM 972 CB THR A 232 -8.539 9.717 3.150 1.00 0.15 C ATOM 973 OG1 THR A 232 -9.716 9.329 3.835 1.00 0.18 O ATOM 974 CG2 THR A 232 -8.534 11.247 2.963 1.00 0.17 C ATOM 975 H THR A 232 -10.597 8.975 1.285 1.00 0.17 H ATOM 976 HA THR A 232 -7.602 9.310 1.265 1.00 0.16 H ATOM 977 HB THR A 232 -7.678 9.423 3.728 1.00 0.19 H ATOM 978 HG1 THR A 232 -9.632 9.604 4.750 1.00 0.92 H ATOM 979 HG21 THR A 232 -8.496 11.499 1.911 1.00 1.02 H ATOM 980 HG22 THR A 232 -9.434 11.657 3.393 1.00 1.01 H ATOM 981 HG23 THR A 232 -7.674 11.673 3.463 1.00 1.02 H ATOM 982 N TRP A 233 -7.248 6.931 1.909 1.00 0.15 N ATOM 983 CA TRP A 233 -7.072 5.461 2.113 1.00 0.15 C ATOM 984 C TRP A 233 -6.176 5.204 3.325 1.00 0.16 C ATOM 985 O TRP A 233 -5.323 6.004 3.655 1.00 0.19 O ATOM 986 CB TRP A 233 -6.447 4.845 0.855 1.00 0.17 C ATOM 987 CG TRP A 233 -7.471 4.818 -0.237 1.00 0.18 C ATOM 988 CD1 TRP A 233 -7.761 5.854 -1.059 1.00 0.20 C ATOM 989 CD2 TRP A 233 -8.351 3.725 -0.628 1.00 0.19 C ATOM 990 NE1 TRP A 233 -8.766 5.468 -1.931 1.00 0.22 N ATOM 991 CE2 TRP A 233 -9.164 4.165 -1.707 1.00 0.22 C ATOM 992 CE3 TRP A 233 -8.523 2.403 -0.158 1.00 0.20 C ATOM 993 CZ2 TRP A 233 -10.119 3.323 -2.297 1.00 0.26 C ATOM 994 CZ3 TRP A 233 -9.481 1.552 -0.747 1.00 0.24 C ATOM 995 CH2 TRP A 233 -10.277 2.012 -1.814 1.00 0.27 C ATOM 996 H TRP A 233 -6.472 7.481 1.674 1.00 0.24 H ATOM 997 HA TRP A 233 -8.026 5.006 2.292 1.00 0.14 H ATOM 998 HB2 TRP A 233 -5.601 5.440 0.544 1.00 0.19 H ATOM 999 HB3 TRP A 233 -6.122 3.837 1.069 1.00 0.18 H ATOM 1000 HD1 TRP A 233 -7.286 6.824 -1.038 1.00 0.21 H ATOM 1001 HE1 TRP A 233 -9.159 6.035 -2.627 1.00 0.24 H ATOM 1002 HE3 TRP A 233 -7.918 2.043 0.661 1.00 0.19 H ATOM 1003 HZ2 TRP A 233 -10.727 3.679 -3.115 1.00 0.29 H ATOM 1004 HZ3 TRP A 233 -9.605 0.545 -0.378 1.00 0.26 H ATOM 1005 HH2 TRP A 233 -11.011 1.358 -2.257 1.00 0.31 H ATOM 1006 N GLU A 234 -6.375 4.091 3.995 1.00 0.15 N ATOM 1007 CA GLU A 234 -5.542 3.765 5.202 1.00 0.15 C ATOM 1008 C GLU A 234 -5.250 2.263 5.238 1.00 0.16 C ATOM 1009 O GLU A 234 -6.138 1.456 5.055 1.00 0.19 O ATOM 1010 CB GLU A 234 -6.318 4.119 6.468 1.00 0.16 C ATOM 1011 CG GLU A 234 -6.532 5.626 6.552 1.00 0.25 C ATOM 1012 CD GLU A 234 -7.179 5.951 7.896 1.00 0.88 C ATOM 1013 OE1 GLU A 234 -8.331 5.593 8.078 1.00 1.53 O ATOM 1014 OE2 GLU A 234 -6.514 6.555 8.721 1.00 1.61 O ATOM 1015 H GLU A 234 -7.077 3.470 3.706 1.00 0.16 H ATOM 1016 HA GLU A 234 -4.616 4.318 5.177 1.00 0.17 H ATOM 1017 HB2 GLU A 234 -7.277 3.622 6.450 1.00 0.18 H ATOM 1018 HB3 GLU A 234 -5.761 3.790 7.332 1.00 0.19 H ATOM 1019 HG2 GLU A 234 -5.582 6.134 6.472 1.00 0.63 H ATOM 1020 HG3 GLU A 234 -7.185 5.946 5.753 1.00 0.42 H ATOM 1021 N LEU A 235 -4.026 1.869 5.494 1.00 0.16 N ATOM 1022 CA LEU A 235 -3.736 0.407 5.554 1.00 0.18 C ATOM 1023 C LEU A 235 -4.405 -0.187 6.786 1.00 0.16 C ATOM 1024 O LEU A 235 -4.040 0.094 7.908 1.00 0.21 O ATOM 1025 CB LEU A 235 -2.226 0.133 5.615 1.00 0.19 C ATOM 1026 CG LEU A 235 -1.498 0.732 4.400 1.00 0.24 C ATOM 1027 CD1 LEU A 235 0.009 0.653 4.652 1.00 0.27 C ATOM 1028 CD2 LEU A 235 -1.811 -0.046 3.105 1.00 0.32 C ATOM 1029 H LEU A 235 -3.317 2.525 5.659 1.00 0.17 H ATOM 1030 HA LEU A 235 -4.156 -0.067 4.694 1.00 0.21 H ATOM 1031 HB2 LEU A 235 -1.825 0.571 6.517 1.00 0.19 H ATOM 1032 HB3 LEU A 235 -2.061 -0.934 5.636 1.00 0.22 H ATOM 1033 HG LEU A 235 -1.789 1.764 4.286 1.00 0.25 H ATOM 1034 HD11 LEU A 235 0.291 -0.379 4.807 1.00 1.03 H ATOM 1035 HD12 LEU A 235 0.539 1.042 3.797 1.00 1.09 H ATOM 1036 HD13 LEU A 235 0.261 1.230 5.528 1.00 1.04 H ATOM 1037 HD21 LEU A 235 -2.861 -0.252 3.031 1.00 1.10 H ATOM 1038 HD22 LEU A 235 -1.512 0.548 2.256 1.00 1.06 H ATOM 1039 HD23 LEU A 235 -1.264 -0.975 3.098 1.00 1.03 H ATOM 1040 N LYS A 236 -5.385 -1.011 6.565 1.00 0.26 N ATOM 1041 CA LYS A 236 -6.117 -1.654 7.686 1.00 0.29 C ATOM 1042 C LYS A 236 -5.124 -2.474 8.550 1.00 0.21 C ATOM 1043 O LYS A 236 -4.605 -3.473 8.094 1.00 0.30 O ATOM 1044 CB LYS A 236 -7.166 -2.586 7.064 1.00 0.50 C ATOM 1045 CG LYS A 236 -8.318 -2.831 8.042 1.00 0.83 C ATOM 1046 CD LYS A 236 -9.364 -3.794 7.404 1.00 0.83 C ATOM 1047 CE LYS A 236 -10.635 -3.055 6.936 1.00 1.40 C ATOM 1048 NZ LYS A 236 -11.794 -3.982 7.049 1.00 1.94 N ATOM 1049 H LYS A 236 -5.646 -1.211 5.642 1.00 0.38 H ATOM 1050 HA LYS A 236 -6.613 -0.897 8.271 1.00 0.33 H ATOM 1051 HB2 LYS A 236 -7.558 -2.130 6.168 1.00 1.19 H ATOM 1052 HB3 LYS A 236 -6.707 -3.532 6.810 1.00 1.07 H ATOM 1053 HG2 LYS A 236 -7.918 -3.274 8.946 1.00 1.40 H ATOM 1054 HG3 LYS A 236 -8.776 -1.887 8.286 1.00 1.53 H ATOM 1055 HD2 LYS A 236 -8.927 -4.290 6.550 1.00 1.44 H ATOM 1056 HD3 LYS A 236 -9.646 -4.544 8.131 1.00 1.25 H ATOM 1057 HE2 LYS A 236 -10.817 -2.186 7.548 1.00 1.89 H ATOM 1058 HE3 LYS A 236 -10.521 -2.752 5.905 1.00 2.11 H ATOM 1059 HZ1 LYS A 236 -11.543 -4.777 7.671 1.00 2.38 H ATOM 1060 HZ2 LYS A 236 -12.608 -3.471 7.449 1.00 2.36 H ATOM 1061 HZ3 LYS A 236 -12.040 -4.345 6.108 1.00 2.33 H ATOM 1062 N PRO A 237 -4.855 -2.074 9.781 1.00 0.20 N ATOM 1063 CA PRO A 237 -3.912 -2.813 10.677 1.00 0.28 C ATOM 1064 C PRO A 237 -4.615 -3.947 11.434 1.00 0.26 C ATOM 1065 O PRO A 237 -4.025 -4.645 12.234 1.00 0.30 O ATOM 1066 CB PRO A 237 -3.450 -1.727 11.646 1.00 0.41 C ATOM 1067 CG PRO A 237 -4.637 -0.827 11.801 1.00 0.41 C ATOM 1068 CD PRO A 237 -5.410 -0.889 10.470 1.00 0.30 C ATOM 1069 HA PRO A 237 -3.070 -3.190 10.120 1.00 0.35 H ATOM 1070 HB2 PRO A 237 -3.171 -2.163 12.597 1.00 0.49 H ATOM 1071 HB3 PRO A 237 -2.621 -1.179 11.225 1.00 0.47 H ATOM 1072 HG2 PRO A 237 -5.262 -1.176 12.616 1.00 0.45 H ATOM 1073 HG3 PRO A 237 -4.316 0.189 11.991 1.00 0.52 H ATOM 1074 HD2 PRO A 237 -6.470 -1.019 10.652 1.00 0.35 H ATOM 1075 HD3 PRO A 237 -5.233 0.000 9.889 1.00 0.32 H ATOM 1076 N GLU A 238 -5.884 -4.091 11.203 1.00 0.23 N ATOM 1077 CA GLU A 238 -6.690 -5.128 11.912 1.00 0.25 C ATOM 1078 C GLU A 238 -6.038 -6.517 11.817 1.00 0.25 C ATOM 1079 O GLU A 238 -5.926 -7.212 12.808 1.00 0.28 O ATOM 1080 CB GLU A 238 -8.080 -5.173 11.271 1.00 0.30 C ATOM 1081 CG GLU A 238 -8.817 -3.842 11.515 1.00 0.35 C ATOM 1082 CD GLU A 238 -9.503 -3.843 12.886 1.00 0.99 C ATOM 1083 OE1 GLU A 238 -9.541 -4.886 13.516 1.00 1.66 O ATOM 1084 OE2 GLU A 238 -9.983 -2.793 13.280 1.00 1.79 O ATOM 1085 H GLU A 238 -6.325 -3.485 10.574 1.00 0.23 H ATOM 1086 HA GLU A 238 -6.788 -4.854 12.949 1.00 0.28 H ATOM 1087 HB2 GLU A 238 -7.973 -5.327 10.207 1.00 0.30 H ATOM 1088 HB3 GLU A 238 -8.648 -5.987 11.693 1.00 0.33 H ATOM 1089 HG2 GLU A 238 -8.110 -3.025 11.473 1.00 0.83 H ATOM 1090 HG3 GLU A 238 -9.563 -3.702 10.746 1.00 0.87 H ATOM 1091 N TYR A 239 -5.625 -6.938 10.644 1.00 0.25 N ATOM 1092 CA TYR A 239 -5.000 -8.300 10.499 1.00 0.30 C ATOM 1093 C TYR A 239 -3.678 -8.209 9.736 1.00 0.31 C ATOM 1094 O TYR A 239 -3.253 -9.161 9.111 1.00 0.38 O ATOM 1095 CB TYR A 239 -5.956 -9.217 9.735 1.00 0.34 C ATOM 1096 CG TYR A 239 -6.148 -8.691 8.336 1.00 0.32 C ATOM 1097 CD1 TYR A 239 -7.042 -7.632 8.113 1.00 0.31 C ATOM 1098 CD2 TYR A 239 -5.438 -9.254 7.256 1.00 0.37 C ATOM 1099 CE1 TYR A 239 -7.231 -7.132 6.815 1.00 0.32 C ATOM 1100 CE2 TYR A 239 -5.628 -8.752 5.953 1.00 0.37 C ATOM 1101 CZ TYR A 239 -6.525 -7.690 5.735 1.00 0.33 C ATOM 1102 OH TYR A 239 -6.715 -7.197 4.462 1.00 0.36 O ATOM 1103 H TYR A 239 -5.739 -6.369 9.858 1.00 0.24 H ATOM 1104 HA TYR A 239 -4.809 -8.727 11.474 1.00 0.32 H ATOM 1105 HB2 TYR A 239 -5.543 -10.214 9.692 1.00 0.39 H ATOM 1106 HB3 TYR A 239 -6.908 -9.242 10.242 1.00 0.35 H ATOM 1107 HD1 TYR A 239 -7.584 -7.205 8.939 1.00 0.33 H ATOM 1108 HD2 TYR A 239 -4.750 -10.069 7.427 1.00 0.43 H ATOM 1109 HE1 TYR A 239 -7.914 -6.320 6.650 1.00 0.35 H ATOM 1110 HE2 TYR A 239 -5.086 -9.180 5.124 1.00 0.43 H ATOM 1111 HH TYR A 239 -7.446 -7.676 4.065 1.00 0.93 H ATOM 1112 N ARG A 240 -3.008 -7.091 9.788 1.00 0.30 N ATOM 1113 CA ARG A 240 -1.707 -6.991 9.067 1.00 0.34 C ATOM 1114 C ARG A 240 -0.643 -7.782 9.836 1.00 0.41 C ATOM 1115 O ARG A 240 -0.040 -7.285 10.766 1.00 0.47 O ATOM 1116 CB ARG A 240 -1.269 -5.514 8.954 1.00 0.35 C ATOM 1117 CG ARG A 240 -1.967 -4.810 7.757 1.00 0.36 C ATOM 1118 CD ARG A 240 -1.068 -4.828 6.515 1.00 0.88 C ATOM 1119 NE ARG A 240 -0.972 -6.219 6.007 1.00 1.93 N ATOM 1120 CZ ARG A 240 -0.500 -6.448 4.821 1.00 2.64 C ATOM 1121 NH1 ARG A 240 -0.077 -5.458 4.087 1.00 2.59 N ATOM 1122 NH2 ARG A 240 -0.450 -7.670 4.373 1.00 3.68 N ATOM 1123 H ARG A 240 -3.349 -6.332 10.304 1.00 0.30 H ATOM 1124 HA ARG A 240 -1.819 -7.411 8.083 1.00 0.36 H ATOM 1125 HB2 ARG A 240 -1.537 -5.004 9.871 1.00 0.37 H ATOM 1126 HB3 ARG A 240 -0.196 -5.465 8.831 1.00 0.40 H ATOM 1127 HG2 ARG A 240 -2.890 -5.314 7.521 1.00 0.55 H ATOM 1128 HG3 ARG A 240 -2.179 -3.783 8.015 1.00 0.69 H ATOM 1129 HD2 ARG A 240 -1.502 -4.197 5.754 1.00 1.18 H ATOM 1130 HD3 ARG A 240 -0.082 -4.459 6.766 1.00 1.23 H ATOM 1131 HE ARG A 240 -1.277 -6.963 6.559 1.00 2.35 H ATOM 1132 HH11 ARG A 240 -0.116 -4.523 4.439 1.00 2.09 H ATOM 1133 HH12 ARG A 240 0.287 -5.634 3.173 1.00 3.29 H ATOM 1134 HH21 ARG A 240 -0.775 -8.425 4.944 1.00 3.99 H ATOM 1135 HH22 ARG A 240 -0.088 -7.854 3.460 1.00 4.27 H ATOM 1136 N HIS A 241 -0.391 -9.004 9.444 1.00 0.48 N ATOM 1137 CA HIS A 241 0.653 -9.803 10.147 1.00 0.57 C ATOM 1138 C HIS A 241 2.023 -9.305 9.691 1.00 0.60 C ATOM 1139 O HIS A 241 3.037 -9.600 10.292 1.00 0.71 O ATOM 1140 CB HIS A 241 0.522 -11.287 9.781 1.00 0.65 C ATOM 1141 CG HIS A 241 -0.831 -11.806 10.183 1.00 0.64 C ATOM 1142 ND1 HIS A 241 -1.076 -12.345 11.437 1.00 0.69 N ATOM 1143 CD2 HIS A 241 -2.019 -11.891 9.500 1.00 0.63 C ATOM 1144 CE1 HIS A 241 -2.365 -12.729 11.468 1.00 0.70 C ATOM 1145 NE2 HIS A 241 -2.986 -12.474 10.313 1.00 0.67 N ATOM 1146 H HIS A 241 -0.875 -9.387 8.683 1.00 0.50 H ATOM 1147 HA HIS A 241 0.553 -9.678 11.215 1.00 0.60 H ATOM 1148 HB2 HIS A 241 0.649 -11.406 8.716 1.00 0.66 H ATOM 1149 HB3 HIS A 241 1.287 -11.849 10.297 1.00 0.73 H ATOM 1150 HD1 HIS A 241 -0.427 -12.433 12.166 1.00 0.73 H ATOM 1151 HD2 HIS A 241 -2.177 -11.559 8.485 1.00 0.62 H ATOM 1152 HE1 HIS A 241 -2.840 -13.189 12.322 1.00 0.76 H ATOM 1153 N TYR A 242 2.053 -8.562 8.613 1.00 0.59 N ATOM 1154 CA TYR A 242 3.346 -8.041 8.073 1.00 0.64 C ATOM 1155 C TYR A 242 3.507 -6.547 8.390 1.00 0.71 C ATOM 1156 O TYR A 242 2.767 -5.715 7.903 1.00 0.98 O ATOM 1157 CB TYR A 242 3.359 -8.236 6.547 1.00 0.73 C ATOM 1158 CG TYR A 242 4.449 -7.383 5.940 1.00 0.71 C ATOM 1159 CD1 TYR A 242 5.766 -7.870 5.849 1.00 0.86 C ATOM 1160 CD2 TYR A 242 4.145 -6.083 5.495 1.00 0.74 C ATOM 1161 CE1 TYR A 242 6.780 -7.056 5.311 1.00 0.87 C ATOM 1162 CE2 TYR A 242 5.156 -5.271 4.953 1.00 0.76 C ATOM 1163 CZ TYR A 242 6.475 -5.755 4.862 1.00 0.74 C ATOM 1164 OH TYR A 242 7.467 -4.954 4.338 1.00 0.79 O ATOM 1165 H TYR A 242 1.216 -8.355 8.146 1.00 0.62 H ATOM 1166 HA TYR A 242 4.173 -8.588 8.504 1.00 0.78 H ATOM 1167 HB2 TYR A 242 3.542 -9.275 6.318 1.00 0.90 H ATOM 1168 HB3 TYR A 242 2.404 -7.940 6.139 1.00 0.82 H ATOM 1169 HD1 TYR A 242 5.997 -8.868 6.192 1.00 1.05 H ATOM 1170 HD2 TYR A 242 3.134 -5.712 5.565 1.00 0.88 H ATOM 1171 HE1 TYR A 242 7.790 -7.427 5.240 1.00 1.07 H ATOM 1172 HE2 TYR A 242 4.921 -4.277 4.611 1.00 0.90 H ATOM 1173 HH TYR A 242 7.925 -5.454 3.659 1.00 1.20 H ATOM 1174 N GLN A 243 4.502 -6.200 9.170 1.00 0.93 N ATOM 1175 CA GLN A 243 4.758 -4.757 9.482 1.00 1.13 C ATOM 1176 C GLN A 243 6.267 -4.577 9.706 1.00 1.63 C ATOM 1177 O GLN A 243 7.055 -4.656 8.783 1.00 2.15 O ATOM 1178 CB GLN A 243 3.968 -4.256 10.736 1.00 1.27 C ATOM 1179 CG GLN A 243 3.136 -5.371 11.402 1.00 1.19 C ATOM 1180 CD GLN A 243 2.017 -4.740 12.233 1.00 1.36 C ATOM 1181 OE1 GLN A 243 2.272 -3.962 13.131 1.00 1.93 O ATOM 1182 NE2 GLN A 243 0.777 -5.038 11.959 1.00 1.46 N ATOM 1183 H GLN A 243 5.106 -6.888 9.521 1.00 1.17 H ATOM 1184 HA GLN A 243 4.474 -4.164 8.619 1.00 1.23 H ATOM 1185 HB2 GLN A 243 4.659 -3.864 11.471 1.00 1.95 H ATOM 1186 HB3 GLN A 243 3.304 -3.456 10.433 1.00 1.68 H ATOM 1187 HG2 GLN A 243 2.694 -6.005 10.661 1.00 1.63 H ATOM 1188 HG3 GLN A 243 3.770 -5.956 12.050 1.00 1.79 H ATOM 1189 HE21 GLN A 243 0.574 -5.661 11.229 1.00 1.38 H ATOM 1190 HE22 GLN A 243 0.050 -4.636 12.477 1.00 1.92 H TER 1191 GLN A 243 MASTER 71 0 0 3 3 0 0 6 1190 1 0 6 END