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3ds1_refine_001.pdb
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REMARK Date 2019-04-19 Time 09:19:31 CST +0800 (1555636771.57 s)
REMARK PHENIX refinement
REMARK
REMARK ****************** INPUT FILES AND LABELS ******************************
REMARK Reflections:
REMARK file name : 3ds1.mtz
REMARK labels : ['FOBS,SIGFOBS']
REMARK R-free flags:
REMARK file name : 3ds1.mtz
REMARK label : R-free-flags
REMARK test_flag_value: 0
REMARK Model file name(s):
REMARK 3ds1.pdb
REMARK
REMARK ******************** REFINEMENT SUMMARY: QUICK FACTS *******************
REMARK Start: r_work = 0.2268 r_free = 0.2789 bonds = 0.014 angles = 1.293
REMARK Final: r_work = 0.2172 r_free = 0.2508 bonds = 0.003 angles = 0.542
REMARK ************************************************************************
REMARK
REMARK ****************** REFINEMENT STATISTICS STEP BY STEP ******************
REMARK leading digit, like 1_, means number of macro-cycle
REMARK 0 : statistics at the very beginning when nothing is done yet
REMARK 1_bss: bulk solvent correction and/or (anisotropic) scaling
REMARK 1_xyz: refinement of coordinates
REMARK 1_adp: refinement of ADPs (Atomic Displacement Parameters)
REMARK 1_wat: ordered solvent update (add / remove)
REMARK 1_occ: refinement of occupancies
REMARK ------------------------------------------------------------------------
REMARK stage r-work r-free bonds angles b_min b_max b_ave n_water shift
REMARK 0 : 0.2749 0.3123 0.014 1.293 11.4 54.3 23.8 87 0.000
REMARK 1_bss: 0.2268 0.2789 0.014 1.293 12.6 55.4 24.9 87 0.000
REMARK 1_settarget: 0.2268 0.2789 0.014 1.293 12.6 55.4 24.9 87 0.000
REMARK 1_nqh: 0.2269 0.2789 0.014 1.293 12.6 55.4 24.9 87 0.006
REMARK 1_weight: 0.2269 0.2789 0.014 1.293 12.6 55.4 24.9 87 0.006
REMARK 1_xyzrec: 0.2298 0.2798 0.003 0.616 12.6 55.4 24.9 87 0.065
REMARK 1_adp: 0.2219 0.2708 0.003 0.616 14.4 65.9 26.9 87 0.065
REMARK 1_occ: 0.2218 0.2705 0.003 0.616 14.4 65.9 26.9 87 0.065
REMARK 2_bss: 0.2217 0.2703 0.003 0.616 14.3 65.8 26.8 87 0.065
REMARK 2_settarget: 0.2217 0.2703 0.003 0.616 14.3 65.8 26.8 87 0.065
REMARK 2_updatecdl: 0.2217 0.2703 0.003 0.621 14.3 65.8 26.8 87 0.065
REMARK 2_nqh: 0.2217 0.2703 0.003 0.621 14.3 65.8 26.8 87 0.065
REMARK 2_sol: 0.2197 0.2658 0.003 0.621 14.3 65.8 27.2 92 n/a
REMARK 2_realsrl: 0.2253 0.2641 0.003 0.688 14.3 65.8 27.2 92 n/a
REMARK 2_weight: 0.2253 0.2641 0.003 0.688 14.3 65.8 27.2 92 n/a
REMARK 2_xyzrec: 0.2164 0.2559 0.007 0.858 14.3 65.8 27.2 92 n/a
REMARK 2_realsrl2: 0.2164 0.2559 0.007 0.858 14.3 65.8 27.2 92 n/a
REMARK 2_adp: 0.2119 0.2543 0.007 0.858 13.7 60.8 27.4 92 n/a
REMARK 2_occ: 0.2119 0.2542 0.007 0.858 13.7 60.8 27.4 92 n/a
REMARK 3_bss: 0.2116 0.2546 0.007 0.858 13.6 60.7 27.3 92 n/a
REMARK 3_settarget: 0.2116 0.2546 0.007 0.858 13.6 60.7 27.3 92 n/a
REMARK 3_updatecdl: 0.2116 0.2546 0.007 0.864 13.6 60.7 27.3 92 n/a
REMARK 3_setrh: 0.2116 0.2546 0.007 0.864 13.6 60.7 27.3 92 n/a
REMARK 3_nqh: 0.2116 0.2546 0.007 0.864 13.6 60.7 27.3 92 n/a
REMARK 3_sol: 0.2103 0.2527 0.007 0.864 13.6 60.7 27.6 97 n/a
REMARK 3_realsrl: 0.2136 0.2520 0.007 0.868 13.6 60.7 27.6 97 n/a
REMARK 3_weight: 0.2136 0.2520 0.007 0.868 13.6 60.7 27.6 97 n/a
REMARK 3_xyzrec: 0.2174 0.2529 0.003 0.542 13.6 60.7 27.6 97 n/a
REMARK 3_realsrl2: 0.2174 0.2529 0.003 0.542 13.6 60.7 27.6 97 n/a
REMARK 3_adp: 0.2168 0.2538 0.003 0.542 13.3 59.3 27.8 97 n/a
REMARK 3_occ: 0.2168 0.2540 0.003 0.542 13.3 59.3 27.8 97 n/a
REMARK end: 0.2172 0.2508 0.003 0.542 13.2 59.1 27.6 92 n/a
REMARK ------------------------------------------------------------------------
REMARK MODEL CONTENT.
REMARK ELEMENT ATOM RECORD COUNT OCCUPANCY SUM
REMARK C 457 453.00
REMARK S 5 5.00
REMARK O 231 230.00
REMARK N 122 121.00
REMARK TOTAL 815 809.00
REMARK -----------------------------------------------------------------------
REMARK r_free_flags.md5.hexdigest f510c4bc7f89e3d54e7732eeb1728c99
REMARK
REMARK IF THIS FILE IS FOR PDB DEPOSITION: REMOVE ALL FROM THIS LINE UP.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : PHENIX (dev_svn: ???)
REMARK 3 AUTHORS : Adams,Afonine,Bunkoczi,Burnley,Chen,Dar,Davis,
REMARK 3 : Draizen,Echols,Gildea,Gros,Grosse-Kunstleve,Headd,
REMARK 3 : Hintze,Hung,Ioerger,Liebschner,McCoy,McKee,Moriarty,
REMARK 3 : Oeffner,Poon,Read,Richardson,Richardson,Sacchettini,
REMARK 3 : Sauter,Sobolev,Storoni,Terwilliger,Williams,Zwart
REMARK 3
REMARK 3 X-RAY DATA.
REMARK 3
REMARK 3 REFINEMENT TARGET : ML
REMARK 3
REMARK 3 DATA USED IN REFINEMENT.
REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.601
REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 28.768
REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.33
REMARK 3 COMPLETENESS FOR RANGE (%) : 99.66
REMARK 3 NUMBER OF REFLECTIONS : 11748
REMARK 3 NUMBER OF REFLECTIONS (NON-ANOMALOUS) : 11748
REMARK 3
REMARK 3 FIT TO DATA USED IN REFINEMENT.
REMARK 3 R VALUE (WORKING + TEST SET) : 0.2187
REMARK 3 R VALUE (WORKING SET) : 0.2172
REMARK 3 FREE R VALUE : 0.2508
REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.76
REMARK 3 FREE R VALUE TEST SET COUNT : 559
REMARK 3
REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS).
REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE CCWORK CCFREE
REMARK 3 1 28.7731 - 2.5413 0.99 2938 136 0.2039 0.2326 0.922 0.905
REMARK 3 2 2.5413 - 2.0173 1.00 2785 149 0.2329 0.2477 0.870 0.840
REMARK 3 3 2.0173 - 1.7623 1.00 2756 131 0.2321 0.2994 0.881 0.817
REMARK 3 4 1.7623 - 1.6012 1.00 2710 143 0.2511 0.3176 0.841 0.726
REMARK 3
REMARK 3 BULK SOLVENT MODELLING.
REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL
REMARK 3 SOLVENT RADIUS : 1.11
REMARK 3 SHRINKAGE RADIUS : 0.90
REMARK 3 GRID STEP FACTOR : 4.00
REMARK 3
REMARK 3 ERROR ESTIMATES.
REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.17
REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 26.09
REMARK 3
REMARK 3 STRUCTURE FACTORS CALCULATION ALGORITHM : FFT
REMARK 3
REMARK 3
REMARK 3 GEOMETRY RESTRAINTS LIBRARY: NONE
REMARK 3 DEVIATIONS FROM IDEAL VALUES.
REMARK 3 BOND : 0.003 0.024 737
REMARK 3 ANGLE : 0.542 4.904 997
REMARK 3 CHIRALITY : 0.035 0.115 110
REMARK 3 PLANARITY : 0.003 0.031 130
REMARK 3 DIHEDRAL : 1.829 14.072 600
REMARK 3 MIN NONBONDED DISTANCE : 1.977
REMARK 3
REMARK 3 MOLPROBITY STATISTICS.
REMARK 3 ALL-ATOM CLASHSCORE : 4.86
REMARK 3 RAMACHANDRAN PLOT:
REMARK 3 OUTLIERS : 0.00 %
REMARK 3 ALLOWED : 0.00 %
REMARK 3 FAVORED : 100.00 %
REMARK 3 ROTAMER OUTLIERS : 0.00 %
REMARK 3 CBETA DEVIATIONS : 0.00 %
REMARK 3 PEPTIDE PLANE:
REMARK 3 CIS-PROLINE : 20.00 %
REMARK 3 CIS-GENERAL : 0.00 %
REMARK 3 TWISTED PROLINE : 0.00 %
REMARK 3 TWISTED GENERAL : 0.00 %
REMARK 3
REMARK 3 min max mean <Bi,j> iso aniso
REMARK 3 Overall: 13.18 59.10 27.56 3.74 815 0
REMARK 3 Protein: 13.18 59.10 26.43 3.74 723 0
REMARK 3 Water: 20.32 55.15 36.41 N/A 92 0
REMARK 3 Chain A: 13.18 59.10 26.38 N/A 628 0
REMARK 3 Chain S: 20.32 55.15 36.41 N/A 92 0
REMARK 3 Chain T: 18.49 44.00 26.76 N/A 95 0
REMARK 3 Histogram:
REMARK 3 Values Number of atoms
REMARK 3 13.18 - 17.77 75
REMARK 3 17.77 - 22.36 203
REMARK 3 22.36 - 26.96 178
REMARK 3 26.96 - 31.55 143
REMARK 3 31.55 - 36.14 73
REMARK 3 36.14 - 40.73 68
REMARK 3 40.73 - 45.32 35
REMARK 3 45.32 - 49.91 23
REMARK 3 49.91 - 54.50 10
REMARK 3 54.50 - 59.10 7
REMARK 3
REMARK 3
HELIX 1 1 SER A 149 ILE A 153 5 5
HELIX 2 2 PRO A 160 GLU A 175 1 16
HELIX 3 3 SER A 178 ASN A 193 1 16
HELIX 4 4 ASN A 195 GLY A 206 1 12
HELIX 5 5 THR A 210 GLN A 219 1 10
HELIX 6 6 THR T 2 GLY T 11 1 10
CRYST1 42.894 42.894 90.813 90.00 90.00 90.00 P 41 21 2
SCALE1 0.023313 0.000000 0.000000 0.00000
SCALE2 0.000000 0.023313 0.000000 0.00000
SCALE3 0.000000 0.000000 0.011012 0.00000
ATOM 1 N THR A 148 4.120 2.779 32.261 1.00 44.75 N
ATOM 2 CA THR A 148 5.149 3.801 32.401 1.00 39.42 C
ATOM 3 C THR A 148 5.312 4.179 33.874 1.00 40.45 C
ATOM 4 O THR A 148 4.469 3.844 34.708 1.00 50.67 O
ATOM 5 CB THR A 148 4.810 5.065 31.573 1.00 44.50 C
ATOM 6 OG1 THR A 148 4.205 4.680 30.333 1.00 59.10 O
ATOM 7 CG2 THR A 148 6.071 5.864 31.264 1.00 34.58 C
ATOM 8 N SER A 149 6.405 4.872 34.184 1.00 29.85 N
ATOM 9 CA SER A 149 6.677 5.384 35.517 1.00 24.55 C
ATOM 10 C SER A 149 6.801 6.900 35.469 1.00 19.89 C
ATOM 11 O SER A 149 7.231 7.473 34.464 1.00 21.86 O
ATOM 12 CB SER A 149 7.961 4.770 36.088 1.00 24.64 C
ATOM 13 OG SER A 149 8.426 5.491 37.218 1.00 23.83 O
ATOM 14 N ILE A 150 6.406 7.550 36.566 1.00 19.85 N
ATOM 15 CA ILE A 150 6.562 8.998 36.664 1.00 17.57 C
ATOM 16 C ILE A 150 8.029 9.385 36.540 1.00 19.42 C
ATOM 17 O ILE A 150 8.354 10.491 36.092 1.00 18.80 O
ATOM 18 CB ILE A 150 5.937 9.512 37.979 1.00 16.07 C
ATOM 19 CG1 ILE A 150 5.900 11.045 38.001 1.00 17.05 C
ATOM 20 CG2 ILE A 150 6.687 8.971 39.189 1.00 18.29 C
ATOM 21 CD1 ILE A 150 5.144 11.662 36.843 1.00 16.98 C
ATOM 22 N LEU A 151 8.938 8.480 36.906 1.00 19.06 N
ATOM 23 CA LEU A 151 10.365 8.747 36.767 1.00 19.72 C
ATOM 24 C LEU A 151 10.799 8.846 35.309 1.00 23.29 C
ATOM 25 O LEU A 151 11.861 9.412 35.031 1.00 28.26 O
ATOM 26 CB LEU A 151 11.168 7.656 37.480 1.00 21.39 C
ATOM 27 CG LEU A 151 10.898 7.502 38.981 1.00 28.13 C
ATOM 28 CD1 LEU A 151 11.682 6.332 39.561 1.00 26.15 C
ATOM 29 CD2 LEU A 151 11.247 8.776 39.712 1.00 27.32 C
ATOM 30 N ASP A 152 10.003 8.324 34.377 1.00 23.12 N
ATOM 31 CA ASP A 152 10.345 8.345 32.961 1.00 25.66 C
ATOM 32 C ASP A 152 9.895 9.614 32.248 1.00 23.16 C
ATOM 33 O ASP A 152 10.270 9.818 31.090 1.00 26.20 O
ATOM 34 CB ASP A 152 9.735 7.130 32.251 1.00 29.12 C
ATOM 35 CG ASP A 152 10.216 5.814 32.833 1.00 41.76 C
ATOM 36 OD1 ASP A 152 11.357 5.767 33.343 1.00 41.05 O
ATOM 37 OD2 ASP A 152 9.451 4.826 32.785 1.00 37.77 O
ATOM 38 N ILE A 153 9.114 10.467 32.901 1.00 20.61 N
ATOM 39 CA ILE A 153 8.560 11.656 32.262 1.00 20.80 C
ATOM 40 C ILE A 153 9.565 12.793 32.376 1.00 20.49 C
ATOM 41 O ILE A 153 9.927 13.209 33.481 1.00 22.21 O
ATOM 42 CB ILE A 153 7.216 12.048 32.889 1.00 17.60 C
ATOM 43 CG1 ILE A 153 6.248 10.864 32.841 1.00 19.88 C
ATOM 44 CG2 ILE A 153 6.627 13.254 32.176 1.00 18.44 C
ATOM 45 CD1 ILE A 153 6.004 10.339 31.448 1.00 23.21 C
ATOM 46 N ARG A 154 10.008 13.306 31.235 1.00 17.54 N
ATOM 47 CA ARG A 154 10.909 14.445 31.221 1.00 17.47 C
ATOM 48 C ARG A 154 10.588 15.332 30.028 1.00 18.20 C
ATOM 49 O ARG A 154 10.152 14.859 28.975 1.00 19.68 O
ATOM 50 CB ARG A 154 12.378 13.998 31.205 1.00 25.49 C
ATOM 51 CG ARG A 154 12.752 12.986 30.135 1.00 35.23 C
ATOM 52 CD ARG A 154 14.189 12.489 30.324 1.00 41.39 C
ATOM 53 NE ARG A 154 15.044 13.497 30.950 1.00 42.91 N
ATOM 54 CZ ARG A 154 15.402 13.477 32.230 1.00 41.59 C
ATOM 55 NH1 ARG A 154 14.965 12.506 33.020 1.00 39.47 N
ATOM 56 NH2 ARG A 154 16.180 14.430 32.720 1.00 39.64 N
ATOM 57 N GLN A 155 10.793 16.632 30.217 1.00 17.27 N
ATOM 58 CA GLN A 155 10.432 17.617 29.208 1.00 16.29 C
ATOM 59 C GLN A 155 11.312 17.465 27.974 1.00 21.17 C
ATOM 60 O GLN A 155 12.534 17.323 28.083 1.00 21.55 O
ATOM 61 CB GLN A 155 10.566 19.024 29.791 1.00 17.02 C
ATOM 62 CG GLN A 155 10.070 20.136 28.891 1.00 13.18 C
ATOM 63 CD GLN A 155 10.155 21.497 29.558 1.00 15.03 C
ATOM 64 OE1 GLN A 155 10.794 21.652 30.601 1.00 17.08 O
ATOM 65 NE2 GLN A 155 9.509 22.490 28.962 1.00 17.68 N
ATOM 66 N GLY A 156 10.686 17.487 26.798 1.00 18.92 N
ATOM 67 CA GLY A 156 11.414 17.479 25.552 1.00 22.16 C
ATOM 68 C GLY A 156 12.319 18.690 25.433 1.00 21.86 C
ATOM 69 O GLY A 156 12.101 19.719 26.083 1.00 20.77 O
ATOM 70 N PRO A 157 13.351 18.593 24.591 1.00 25.87 N
ATOM 71 CA PRO A 157 14.317 19.702 24.488 1.00 26.09 C
ATOM 72 C PRO A 157 13.685 21.023 24.086 1.00 24.12 C
ATOM 73 O PRO A 157 14.147 22.081 24.529 1.00 26.87 O
ATOM 74 CB PRO A 157 15.312 19.200 23.430 1.00 26.93 C
ATOM 75 CG PRO A 157 14.556 18.167 22.652 1.00 29.96 C
ATOM 76 CD PRO A 157 13.658 17.501 23.653 1.00 26.54 C
ATOM 77 N LYS A 158 12.633 20.996 23.270 1.00 22.42 N
ATOM 78 CA LYS A 158 11.897 22.200 22.904 1.00 20.12 C
ATOM 79 C LYS A 158 10.414 22.088 23.231 1.00 21.83 C
ATOM 80 O LYS A 158 9.620 22.899 22.743 1.00 21.41 O
ATOM 81 CB LYS A 158 12.087 22.510 21.415 1.00 28.99 C
ATOM 82 CG LYS A 158 13.529 22.817 21.034 1.00 30.92 C
ATOM 83 CD LYS A 158 13.673 23.075 19.543 1.00 42.49 C
ATOM 84 CE LYS A 158 12.988 24.367 19.134 1.00 44.99 C
ATOM 85 NZ LYS A 158 13.686 25.557 19.691 1.00 41.54 N
ATOM 86 N GLU A 159 10.026 21.114 24.045 1.00 18.89 N
ATOM 87 CA GLU A 159 8.618 20.915 24.365 1.00 21.10 C
ATOM 88 C GLU A 159 8.109 22.079 25.215 1.00 20.16 C
ATOM 89 O GLU A 159 8.785 22.483 26.164 1.00 18.19 O
ATOM 90 CB GLU A 159 8.424 19.597 25.117 1.00 17.47 C
ATOM 91 CG GLU A 159 6.990 19.332 25.556 1.00 17.95 C
ATOM 92 CD GLU A 159 6.845 18.051 26.347 1.00 17.80 C
ATOM 93 OE1 GLU A 159 7.850 17.586 26.924 1.00 19.05 O
ATOM 94 OE2 GLU A 159 5.723 17.508 26.399 1.00 21.20 O
ATOM 95 N PRO A 160 6.938 22.633 24.896 1.00 20.46 N
ATOM 96 CA PRO A 160 6.361 23.664 25.773 1.00 21.17 C
ATOM 97 C PRO A 160 6.166 23.126 27.180 1.00 18.93 C
ATOM 98 O PRO A 160 5.759 21.980 27.378 1.00 20.94 O
ATOM 99 CB PRO A 160 5.021 23.985 25.099 1.00 24.66 C
ATOM 100 CG PRO A 160 5.214 23.595 23.667 1.00 22.15 C
ATOM 101 CD PRO A 160 6.117 22.394 23.703 1.00 20.57 C
ATOM 102 N PHE A 161 6.488 23.968 28.166 1.00 20.32 N
ATOM 103 CA PHE A 161 6.376 23.560 29.564 1.00 17.54 C
ATOM 104 C PHE A 161 4.959 23.119 29.902 1.00 17.24 C
ATOM 105 O PHE A 161 4.762 22.159 30.657 1.00 18.97 O
ATOM 106 CB PHE A 161 6.818 24.708 30.476 1.00 17.72 C
ATOM 107 CG PHE A 161 6.749 24.384 31.941 1.00 20.37 C
ATOM 108 CD1 PHE A 161 7.665 23.522 32.517 1.00 19.43 C
ATOM 109 CD2 PHE A 161 5.782 24.959 32.743 1.00 18.61 C
ATOM 110 CE1 PHE A 161 7.605 23.221 33.861 1.00 21.36 C
ATOM 111 CE2 PHE A 161 5.715 24.668 34.092 1.00 22.21 C
ATOM 112 CZ PHE A 161 6.631 23.798 34.650 1.00 22.64 C
ATOM 113 N ARG A 162 3.957 23.800 29.341 1.00 17.96 N
ATOM 114 CA ARG A 162 2.568 23.422 29.584 1.00 20.82 C
ATOM 115 C ARG A 162 2.263 22.018 29.073 1.00 19.80 C
ATOM 116 O ARG A 162 1.452 21.302 29.671 1.00 20.60 O
ATOM 117 CB ARG A 162 1.633 24.445 28.939 1.00 23.01 C
ATOM 118 CG ARG A 162 1.868 24.640 27.453 1.00 25.34 C
ATOM 119 CD ARG A 162 0.691 24.143 26.637 1.00 28.82 C
ATOM 120 NE ARG A 162 0.931 24.255 25.201 1.00 29.41 N
ATOM 121 CZ ARG A 162 0.834 25.386 24.513 1.00 33.78 C
ATOM 122 NH1 ARG A 162 0.503 26.513 25.129 1.00 33.47 N
ATOM 123 NH2 ARG A 162 1.071 25.392 23.208 1.00 32.18 N
ATOM 124 N ASP A 163 2.895 21.607 27.974 1.00 20.77 N
ATOM 125 CA ASP A 163 2.744 20.235 27.503 1.00 19.35 C
ATOM 126 C ASP A 163 3.361 19.247 28.482 1.00 20.40 C
ATOM 127 O ASP A 163 2.766 18.206 28.786 1.00 20.17 O
ATOM 128 CB ASP A 163 3.406 20.075 26.138 1.00 20.87 C
ATOM 129 CG ASP A 163 2.565 20.605 25.012 1.00 23.41 C
ATOM 130 OD1 ASP A 163 1.478 21.164 25.269 1.00 22.64 O
ATOM 131 OD2 ASP A 163 3.013 20.456 23.860 1.00 22.55 O
ATOM 132 N TYR A 164 4.561 19.559 28.975 1.00 18.07 N
ATOM 133 CA TYR A 164 5.278 18.641 29.850 1.00 16.23 C
ATOM 134 C TYR A 164 4.536 18.438 31.167 1.00 17.01 C
ATOM 135 O TYR A 164 4.448 17.313 31.672 1.00 16.92 O
ATOM 136 CB TYR A 164 6.694 19.177 30.072 1.00 16.86 C
ATOM 137 CG TYR A 164 7.401 18.679 31.308 1.00 15.48 C
ATOM 138 CD1 TYR A 164 7.679 17.331 31.481 1.00 15.19 C
ATOM 139 CD2 TYR A 164 7.823 19.570 32.286 1.00 16.04 C
ATOM 140 CE1 TYR A 164 8.343 16.879 32.603 1.00 15.60 C
ATOM 141 CE2 TYR A 164 8.485 19.133 33.413 1.00 16.86 C
ATOM 142 CZ TYR A 164 8.739 17.782 33.568 1.00 15.99 C
ATOM 143 OH TYR A 164 9.402 17.333 34.685 1.00 16.87 O
ATOM 144 N VAL A 165 3.983 19.514 31.730 1.00 16.85 N
ATOM 145 CA VAL A 165 3.216 19.391 32.967 1.00 14.98 C
ATOM 146 C VAL A 165 2.001 18.502 32.753 1.00 16.18 C
ATOM 147 O VAL A 165 1.647 17.686 33.615 1.00 15.86 O
ATOM 148 CB VAL A 165 2.815 20.784 33.484 1.00 17.93 C
ATOM 149 CG1 VAL A 165 1.962 20.659 34.736 1.00 19.62 C
ATOM 150 CG2 VAL A 165 4.052 21.608 33.765 1.00 18.51 C
ATOM 151 N ASP A 166 1.341 18.641 31.599 1.00 19.42 N
ATOM 152 CA ASP A 166 0.176 17.819 31.293 1.00 20.04 C
ATOM 153 C ASP A 166 0.541 16.338 31.272 1.00 19.40 C
ATOM 154 O ASP A 166 -0.154 15.505 31.864 1.00 19.93 O
ATOM 155 CB ASP A 166 -0.424 18.251 29.953 1.00 25.60 C
ATOM 156 CG ASP A 166 -1.890 17.889 29.820 1.00 39.48 C
ATOM 157 OD1 ASP A 166 -2.249 16.732 30.118 1.00 38.05 O
ATOM 158 OD2 ASP A 166 -2.684 18.760 29.407 1.00 46.48 O
ATOM 159 N ARG A 167 1.639 15.995 30.595 1.00 17.74 N
ATOM 160 CA ARG A 167 2.073 14.602 30.549 1.00 17.94 C
ATOM 161 C ARG A 167 2.495 14.116 31.930 1.00 16.04 C
ATOM 162 O ARG A 167 2.205 12.976 32.310 1.00 17.55 O
ATOM 163 CB ARG A 167 3.219 14.447 29.551 1.00 18.07 C
ATOM 164 CG ARG A 167 2.863 14.850 28.124 1.00 17.57 C
ATOM 165 CD ARG A 167 3.893 14.330 27.132 1.00 19.17 C
ATOM 166 NE ARG A 167 5.204 14.941 27.335 1.00 17.78 N
ATOM 167 CZ ARG A 167 6.257 14.315 27.849 1.00 17.08 C
ATOM 168 NH1 ARG A 167 6.160 13.043 28.215 1.00 22.80 N
ATOM 169 NH2 ARG A 167 7.409 14.960 27.990 1.00 18.42 N
ATOM 170 N PHE A 168 3.190 14.967 32.688 1.00 15.21 N
ATOM 171 CA PHE A 168 3.576 14.622 34.053 1.00 14.48 C
ATOM 172 C PHE A 168 2.348 14.324 34.904 1.00 13.66 C
ATOM 173 O PHE A 168 2.309 13.329 35.637 1.00 17.12 O
ATOM 174 CB PHE A 168 4.398 15.772 34.651 1.00 16.28 C
ATOM 175 CG PHE A 168 4.967 15.491 36.018 1.00 15.87 C
ATOM 176 CD1 PHE A 168 6.278 15.064 36.160 1.00 15.96 C
ATOM 177 CD2 PHE A 168 4.205 15.686 37.159 1.00 14.42 C
ATOM 178 CE1 PHE A 168 6.810 14.816 37.409 1.00 15.77 C
ATOM 179 CE2 PHE A 168 4.731 15.438 38.412 1.00 15.46 C
ATOM 180 CZ PHE A 168 6.037 15.007 38.535 1.00 17.78 C
ATOM 181 N TYR A 169 1.327 15.177 34.805 1.00 14.76 N
ATOM 182 CA TYR A 169 0.107 14.987 35.583 1.00 17.89 C
ATOM 183 C TYR A 169 -0.594 13.686 35.210 1.00 17.69 C
ATOM 184 O TYR A 169 -1.008 12.919 36.086 1.00 19.28 O
ATOM 185 CB TYR A 169 -0.823 16.180 35.370 1.00 17.46 C
ATOM 186 CG TYR A 169 -2.227 15.986 35.891 1.00 19.66 C
ATOM 187 CD1 TYR A 169 -2.476 15.863 37.252 1.00 20.26 C
ATOM 188 CD2 TYR A 169 -3.307 15.930 35.019 1.00 22.90 C
ATOM 189 CE1 TYR A 169 -3.761 15.694 37.730 1.00 25.46 C
ATOM 190 CE2 TYR A 169 -4.595 15.759 35.491 1.00 28.78 C
ATOM 191 CZ TYR A 169 -4.816 15.643 36.845 1.00 27.99 C
ATOM 192 OH TYR A 169 -6.096 15.471 37.314 1.00 30.22 O
ATOM 193 N LYS A 170 -0.734 13.419 33.908 1.00 19.14 N
ATOM 194 CA LYS A 170 -1.447 12.221 33.474 1.00 20.92 C
ATOM 195 C LYS A 170 -0.731 10.956 33.928 1.00 20.63 C
ATOM 196 O LYS A 170 -1.374 9.971 34.310 1.00 22.15 O
ATOM 197 CB LYS A 170 -1.608 12.224 31.955 1.00 21.79 C
ATOM 198 CG LYS A 170 -2.552 13.292 31.436 1.00 26.90 C
ATOM 199 CD LYS A 170 -2.534 13.350 29.918 1.00 37.95 C
ATOM 200 CE LYS A 170 -3.833 13.925 29.381 1.00 46.77 C
ATOM 201 NZ LYS A 170 -4.140 15.241 30.010 1.00 45.71 N
ATOM 202 N THR A 171 0.603 10.966 33.899 1.00 19.20 N
ATOM 203 CA THR A 171 1.354 9.797 34.342 1.00 18.66 C
ATOM 204 C THR A 171 1.280 9.637 35.854 1.00 19.73 C
ATOM 205 O THR A 171 1.147 8.518 36.361 1.00 18.89 O
ATOM 206 CB THR A 171 2.809 9.900 33.883 1.00 18.01 C
ATOM 207 OG1 THR A 171 2.855 9.930 32.452 1.00 25.59 O
ATOM 208 CG2 THR A 171 3.621 8.710 34.385 1.00 20.12 C
ATOM 209 N LEU A 172 1.351 10.746 36.592 1.00 17.88 N
ATOM 210 CA LEU A 172 1.342 10.660 38.048 1.00 14.93 C
ATOM 211 C LEU A 172 -0.007 10.184 38.573 1.00 18.19 C
ATOM 212 O LEU A 172 -0.063 9.507 39.606 1.00 19.09 O
ATOM 213 CB LEU A 172 1.707 12.016 38.652 1.00 15.32 C
ATOM 214 CG LEU A 172 1.916 12.062 40.166 1.00 17.99 C
ATOM 215 CD1 LEU A 172 2.747 10.880 40.635 1.00 17.97 C
ATOM 216 CD2 LEU A 172 2.572 13.369 40.570 1.00 19.20 C
ATOM 217 N ARG A 173 -1.098 10.524 37.880 1.00 20.20 N
ATOM 218 CA ARG A 173 -2.416 10.039 38.280 1.00 21.86 C
ATOM 219 C ARG A 173 -2.455 8.518 38.305 1.00 24.94 C
ATOM 220 O ARG A 173 -3.047 7.918 39.211 1.00 26.02 O
ATOM 221 CB ARG A 173 -3.487 10.577 37.332 1.00 27.10 C
ATOM 222 CG ARG A 173 -3.939 11.997 37.609 1.00 33.89 C
ATOM 223 CD ARG A 173 -5.226 12.286 36.851 1.00 42.36 C
ATOM 224 NE ARG A 173 -5.209 11.689 35.517 1.00 46.17 N
ATOM 225 CZ ARG A 173 -5.984 12.074 34.507 1.00 45.37 C
ATOM 226 NH1 ARG A 173 -6.853 13.065 34.669 1.00 45.75 N
ATOM 227 NH2 ARG A 173 -5.889 11.464 33.332 1.00 43.16 N
ATOM 228 N ALA A 174 -1.823 7.877 37.322 1.00 23.60 N
ATOM 229 CA ALA A 174 -1.819 6.425 37.225 1.00 20.86 C
ATOM 230 C ALA A 174 -0.752 5.768 38.088 1.00 25.70 C
ATOM 231 O ALA A 174 -0.810 4.551 38.297 1.00 27.75 O
ATOM 232 CB ALA A 174 -1.622 5.996 35.769 1.00 23.91 C
ATOM 233 N GLU A 175 0.213 6.535 38.591 1.00 20.30 N
ATOM 234 CA GLU A 175 1.263 5.974 39.432 1.00 21.47 C
ATOM 235 C GLU A 175 0.664 5.377 40.700 1.00 20.76 C
ATOM 236 O GLU A 175 -0.245 5.948 41.307 1.00 25.16 O
ATOM 237 CB GLU A 175 2.287 7.058 39.786 1.00 23.74 C
ATOM 238 CG GLU A 175 3.518 6.560 40.533 1.00 20.16 C
ATOM 239 CD GLU A 175 4.521 5.878 39.626 1.00 18.70 C
ATOM 240 OE1 GLU A 175 4.549 6.198 38.419 1.00 20.58 O
ATOM 241 OE2 GLU A 175 5.292 5.029 40.122 1.00 25.30 O
ATOM 242 N GLN A 176 1.163 4.207 41.093 1.00 22.85 N
ATOM 243 C GLN A 176 1.593 3.954 43.458 1.00 24.77 C
ATOM 244 O GLN A 176 2.651 3.369 43.692 1.00 26.87 O
ATOM 245 CA AGLN A 176 0.693 3.533 42.303 0.56 28.98 C
ATOM 246 CB AGLN A 176 0.688 2.021 42.119 0.56 29.57 C
ATOM 247 CG AGLN A 176 -0.419 1.505 41.217 0.56 33.19 C
ATOM 248 CD AGLN A 176 -0.501 -0.009 41.214 0.56 35.21 C
ATOM 249 OE1AGLN A 176 -1.162 -0.608 42.065 0.56 33.96 O
ATOM 250 NE2AGLN A 176 0.173 -0.638 40.258 0.56 33.87 N
ATOM 251 CA BGLN A 176 0.697 3.532 42.301 0.44 28.98 C
ATOM 252 CB BGLN A 176 0.688 2.020 42.112 0.44 29.59 C
ATOM 253 CG BGLN A 176 -0.220 1.560 40.987 0.44 32.89 C
ATOM 254 CD BGLN A 176 -1.634 2.091 41.134 0.44 32.12 C
ATOM 255 OE1BGLN A 176 -2.291 1.872 42.153 0.44 32.33 O
ATOM 256 NE2BGLN A 176 -2.107 2.800 40.118 0.44 30.38 N
ATOM 257 N ALA A 177 1.160 4.982 44.180 1.00 25.19 N
ATOM 258 CA ALA A 177 1.887 5.495 45.331 1.00 24.43 C
ATOM 259 C ALA A 177 0.904 6.254 46.209 1.00 26.36 C
ATOM 260 O ALA A 177 -0.199 6.601 45.780 1.00 24.59 O
ATOM 261 CB ALA A 177 3.054 6.394 44.908 1.00 26.00 C
ATOM 262 N SER A 178 1.317 6.498 47.449 1.00 25.27 N
ATOM 263 CA SER A 178 0.476 7.242 48.370 1.00 25.64 C
ATOM 264 C SER A 178 0.329 8.686 47.901 1.00 29.21 C
ATOM 265 O SER A 178 1.162 9.215 47.157 1.00 21.38 O
ATOM 266 CB SER A 178 1.056 7.202 49.785 1.00 23.13 C
ATOM 267 OG SER A 178 2.248 7.966 49.878 1.00 25.94 O
ATOM 268 N GLN A 179 -0.761 9.322 48.340 1.00 29.22 N
ATOM 269 CA GLN A 179 -0.960 10.732 48.023 1.00 27.97 C
ATOM 270 C GLN A 179 0.185 11.576 48.568 1.00 22.90 C
ATOM 271 O GLN A 179 0.641 12.521 47.914 1.00 23.73 O
ATOM 272 CB GLN A 179 -2.296 11.222 48.582 1.00 31.71 C
ATOM 273 CG GLN A 179 -2.595 12.661 48.217 1.00 39.36 C
ATOM 274 CD GLN A 179 -3.531 13.338 49.195 1.00 52.43 C
ATOM 275 OE1 GLN A 179 -3.557 13.008 50.381 1.00 52.23 O
ATOM 276 NE2 GLN A 179 -4.309 14.295 48.700 1.00 48.81 N
ATOM 277 N GLU A 180 0.663 11.237 49.769 1.00 23.99 N
ATOM 278 CA GLU A 180 1.816 11.913 50.355 1.00 21.41 C
ATOM 279 C GLU A 180 3.034 11.816 49.445 1.00 20.80 C
ATOM 280 O GLU A 180 3.758 12.799 49.249 1.00 20.19 O
ATOM 281 CB GLU A 180 2.105 11.300 51.727 1.00 27.80 C
ATOM 282 CG GLU A 180 3.086 12.047 52.599 1.00 30.01 C
ATOM 283 CD GLU A 180 3.402 11.276 53.870 1.00 34.16 C
ATOM 284 OE1 GLU A 180 2.686 10.289 54.156 1.00 33.97 O
ATOM 285 OE2 GLU A 180 4.363 11.648 54.575 1.00 43.82 O
ATOM 286 N VAL A 181 3.264 10.637 48.863 1.00 21.04 N
ATOM 287 CA VAL A 181 4.411 10.452 47.980 1.00 20.01 C
ATOM 288 C VAL A 181 4.188 11.166 46.651 1.00 18.29 C
ATOM 289 O VAL A 181 5.125 11.731 46.072 1.00 18.44 O
ATOM 290 CB VAL A 181 4.692 8.950 47.793 1.00 18.93 C
ATOM 291 CG1 VAL A 181 5.547 8.702 46.556 1.00 22.69 C
ATOM 292 CG2 VAL A 181 5.378 8.395 49.033 1.00 20.67 C
ATOM 293 N LYS A 182 2.950 11.166 46.148 1.00 17.62 N
ATOM 294 CA LYS A 182 2.673 11.874 44.901 1.00 16.52 C
ATOM 295 C LYS A 182 2.916 13.370 45.053 1.00 17.59 C
ATOM 296 O LYS A 182 3.394 14.027 44.120 1.00 17.41 O
ATOM 297 CB LYS A 182 1.239 11.606 44.448 1.00 19.24 C
ATOM 298 CG LYS A 182 0.995 10.171 44.022 1.00 18.01 C
ATOM 299 CD LYS A 182 -0.254 10.054 43.169 1.00 19.25 C
ATOM 300 CE LYS A 182 -0.521 8.613 42.803 1.00 23.09 C
ATOM 301 NZ LYS A 182 -1.654 8.457 41.846 1.00 26.45 N
ATOM 302 N ASN A 183 2.592 13.924 46.224 1.00 17.46 N
ATOM 303 CA ASN A 183 2.887 15.329 46.485 1.00 17.43 C
ATOM 304 C ASN A 183 4.389 15.582 46.474 1.00 19.24 C
ATOM 305 O ASN A 183 4.857 16.582 45.914 1.00 19.39 O
ATOM 306 CB ASN A 183 2.284 15.750 47.826 1.00 18.46 C
ATOM 307 CG ASN A 183 0.801 16.068 47.727 1.00 25.09 C
ATOM 308 OD1 ASN A 183 0.288 16.365 46.650 1.00 22.09 O
ATOM 309 ND2 ASN A 183 0.107 16.005 48.855 1.00 26.87 N
ATOM 310 N TRP A 184 5.159 14.681 47.087 1.00 20.20 N
ATOM 311 CA TRP A 184 6.612 14.811 47.082 1.00 22.25 C
ATOM 312 C TRP A 184 7.176 14.631 45.677 1.00 18.57 C
ATOM 313 O TRP A 184 8.125 15.325 45.288 1.00 19.95 O
ATOM 314 CB TRP A 184 7.220 13.800 48.058 1.00 19.79 C
ATOM 315 CG TRP A 184 8.698 13.621 47.913 1.00 22.06 C
ATOM 316 CD1 TRP A 184 9.662 14.576 48.064 1.00 27.90 C
ATOM 317 CD2 TRP A 184 9.385 12.404 47.596 1.00 24.62 C
ATOM 318 NE1 TRP A 184 10.906 14.030 47.852 1.00 26.51 N
ATOM 319 CE2 TRP A 184 10.763 12.698 47.565 1.00 26.33 C
ATOM 320 CE3 TRP A 184 8.969 11.095 47.333 1.00 27.19 C
ATOM 321 CZ2 TRP A 184 11.726 11.734 47.279 1.00 27.30 C
ATOM 322 CZ3 TRP A 184 9.929 10.138 47.057 1.00 30.27 C
ATOM 323 CH2 TRP A 184 11.291 10.463 47.032 1.00 28.67 C
ATOM 324 N MET A 185 6.598 13.713 44.897 1.00 17.35 N
ATOM 325 CA MET A 185 7.021 13.544 43.510 1.00 16.80 C
ATOM 326 C MET A 185 6.808 14.822 42.709 1.00 18.16 C
ATOM 327 O MET A 185 7.671 15.221 41.917 1.00 20.21 O
ATOM 328 CB MET A 185 6.262 12.385 42.868 1.00 16.90 C
ATOM 329 CG MET A 185 6.685 11.008 43.350 1.00 21.26 C
ATOM 330 SD MET A 185 5.516 9.751 42.805 1.00 19.56 S
ATOM 331 CE MET A 185 6.486 8.261 43.014 1.00 21.26 C
ATOM 332 N THR A 186 5.662 15.478 42.900 1.00 17.66 N
ATOM 333 CA THR A 186 5.408 16.730 42.196 1.00 13.96 C
ATOM 334 C THR A 186 6.358 17.826 42.662 1.00 16.03 C
ATOM 335 O THR A 186 6.889 18.590 41.846 1.00 20.83 O
ATOM 336 CB THR A 186 3.957 17.165 42.398 1.00 19.24 C
ATOM 337 OG1 THR A 186 3.083 16.119 41.961 1.00 18.36 O
ATOM 338 CG2 THR A 186 3.666 18.419 41.596 1.00 20.72 C
ATOM 339 N ALA A 187 6.591 17.910 43.973 1.00 19.60 N
ATOM 340 CA ALA A 187 7.423 18.967 44.529 1.00 22.17 C
ATOM 341 C ALA A 187 8.892 18.819 44.157 1.00 25.85 C
ATOM 342 O ALA A 187 9.654 19.779 44.314 1.00 24.53 O
ATOM 343 CB ALA A 187 7.269 19.001 46.050 1.00 19.37 C
ATOM 344 N THR A 188 9.306 17.654 43.661 1.00 18.48 N
ATOM 345 CA THR A 188 10.700 17.419 43.304 1.00 19.46 C
ATOM 346 C THR A 188 10.894 17.116 41.829 1.00 18.70 C
ATOM 347 O THR A 188 11.694 17.789 41.164 1.00 22.34 O
ATOM 348 CB THR A 188 11.269 16.269 44.150 1.00 22.46 C
ATOM 349 OG1 THR A 188 10.527 15.074 43.884 1.00 25.52 O
ATOM 350 CG2 THR A 188 11.178 16.606 45.630 1.00 22.19 C
ATOM 351 N LEU A 189 10.178 16.124 41.286 1.00 17.09 N
ATOM 352 CA LEU A 189 10.482 15.640 39.942 1.00 18.54 C
ATOM 353 C LEU A 189 10.056 16.614 38.851 1.00 18.09 C
ATOM 354 O LEU A 189 10.682 16.646 37.784 1.00 19.44 O
ATOM 355 CB LEU A 189 9.821 14.284 39.701 1.00 18.13 C
ATOM 356 CG LEU A 189 10.300 13.124 40.569 1.00 17.43 C
ATOM 357 CD1 LEU A 189 9.473 11.876 40.296 1.00 19.98 C
ATOM 358 CD2 LEU A 189 11.778 12.853 40.300 1.00 22.63 C
ATOM 359 N LEU A 190 8.993 17.391 39.074 1.00 16.81 N
ATOM 360 CA LEU A 190 8.490 18.263 38.014 1.00 16.05 C
ATOM 361 C LEU A 190 9.544 19.281 37.592 1.00 17.26 C
ATOM 362 O LEU A 190 9.826 19.443 36.399 1.00 18.52 O
ATOM 363 CB LEU A 190 7.208 18.961 38.467 1.00 16.78 C
ATOM 364 CG LEU A 190 6.541 19.826 37.402 1.00 19.07 C
ATOM 365 CD1 LEU A 190 6.094 18.976 36.233 1.00 18.55 C
ATOM 366 CD2 LEU A 190 5.364 20.601 37.993 1.00 21.87 C
ATOM 367 N VAL A 191 10.146 19.971 38.562 1.00 17.13 N
ATOM 368 CA VAL A 191 11.213 20.914 38.244 1.00 18.77 C
ATOM 369 C VAL A 191 12.488 20.168 37.862 1.00 18.26 C
ATOM 370 O VAL A 191 13.210 20.578 36.945 1.00 20.87 O
ATOM 371 CB VAL A 191 11.445 21.873 39.427 1.00 19.12 C
ATOM 372 CG1 VAL A 191 12.679 22.737 39.193 1.00 25.69 C
ATOM 373 CG2 VAL A 191 10.214 22.741 39.657 1.00 20.09 C
ATOM 374 N GLN A 192 12.774 19.056 38.546 1.00 18.70 N
ATOM 375 CA GLN A 192 14.015 18.322 38.312 1.00 19.77 C
ATOM 376 C GLN A 192 14.133 17.855 36.867 1.00 26.37 C
ATOM 377 O GLN A 192 15.211 17.942 36.266 1.00 25.74 O
ATOM 378 CB GLN A 192 14.099 17.124 39.256 1.00 22.80 C
ATOM 379 CG GLN A 192 15.380 16.317 39.115 1.00 32.50 C
ATOM 380 CD GLN A 192 15.382 15.071 39.972 1.00 41.60 C
ATOM 381 OE1 GLN A 192 15.109 15.129 41.172 1.00 38.45 O
ATOM 382 NE2 GLN A 192 15.693 13.933 39.360 1.00 45.44 N
ATOM 383 N ASN A 193 13.038 17.358 36.293 1.00 19.25 N
ATOM 384 CA ASN A 193 13.065 16.769 34.964 1.00 18.15 C
ATOM 385 C ASN A 193 12.574 17.718 33.879 1.00 15.74 C
ATOM 386 O ASN A 193 12.331 17.279 32.750 1.00 19.17 O
ATOM 387 CB ASN A 193 12.258 15.473 34.955 1.00 19.20 C
ATOM 388 CG ASN A 193 12.962 14.353 35.700 1.00 26.63 C
ATOM 389 OD1 ASN A 193 14.191 14.295 35.738 1.00 30.64 O
ATOM 390 ND2 ASN A 193 12.184 13.466 36.312 1.00 22.00 N
ATOM 391 N ALA A 194 12.424 19.002 34.190 1.00 18.18 N
ATOM 392 CA ALA A 194 12.258 19.994 33.144 1.00 15.26 C
ATOM 393 C ALA A 194 13.553 20.118 32.347 1.00 22.66 C
ATOM 394 O ALA A 194 14.634 19.732 32.803 1.00 22.32 O
ATOM 395 CB ALA A 194 11.871 21.347 33.740 1.00 17.76 C
ATOM 396 N ASN A 195 13.438 20.653 31.135 1.00 22.06 N
ATOM 397 CA ASN A 195 14.624 20.858 30.322 1.00 23.31 C
ATOM 398 C ASN A 195 15.456 22.004 30.905 1.00 25.35 C
ATOM 399 O ASN A 195 14.958 22.789 31.717 1.00 23.00 O
ATOM 400 CB ASN A 195 14.240 21.097 28.855 1.00 25.47 C
ATOM 401 CG ASN A 195 13.412 22.355 28.636 1.00 21.43 C
ATOM 402 OD1 ASN A 195 13.535 23.346 29.356 1.00 21.94 O
ATOM 403 ND2 ASN A 195 12.570 22.321 27.611 1.00 19.51 N
ATOM 404 N PRO A 196 16.741 22.097 30.533 1.00 29.14 N
ATOM 405 CA PRO A 196 17.626 23.072 31.203 1.00 26.80 C
ATOM 406 C PRO A 196 17.108 24.502 31.221 1.00 29.29 C
ATOM 407 O PRO A 196 17.255 25.187 32.243 1.00 30.23 O
ATOM 408 CB PRO A 196 18.929 22.955 30.401 1.00 28.66 C
ATOM 409 CG PRO A 196 18.940 21.547 29.935 1.00 30.00 C
ATOM 410 CD PRO A 196 17.500 21.186 29.654 1.00 33.10 C
ATOM 411 N ASP A 197 16.498 24.978 30.131 1.00 27.28 N
ATOM 412 CA ASP A 197 16.105 26.384 30.073 1.00 28.96 C
ATOM 413 C ASP A 197 14.900 26.677 30.968 1.00 31.63 C
ATOM 414 O ASP A 197 14.849 27.732 31.610 1.00 33.78 O
ATOM 415 CB ASP A 197 15.828 26.798 28.629 1.00 36.29 C
ATOM 416 CG ASP A 197 17.064 26.715 27.749 1.00 45.46 C
ATOM 417 OD1 ASP A 197 18.190 26.791 28.285 1.00 34.96 O
ATOM 418 OD2 ASP A 197 16.907 26.576 26.518 1.00 50.04 O
ATOM 419 N CYS A 198 13.920 25.769 31.028 1.00 26.66 N
ATOM 420 CA CYS A 198 12.829 25.962 31.984 1.00 24.54 C
ATOM 421 C CYS A 198 13.279 25.697 33.413 1.00 22.35 C
ATOM 422 O CYS A 198 12.795 26.346 34.347 1.00 26.99 O
ATOM 423 CB CYS A 198 11.630 25.079 31.646 1.00 25.44 C
ATOM 424 SG CYS A 198 10.856 25.418 30.076 1.00 21.99 S
ATOM 425 N LYS A 199 14.185 24.737 33.606 1.00 22.10 N
ATOM 426 CA LYS A 199 14.654 24.419 34.950 1.00 23.95 C
ATOM 427 C LYS A 199 15.263 25.646 35.616 1.00 28.04 C
ATOM 428 O LYS A 199 14.997 25.930 36.790 1.00 26.90 O
ATOM 429 CB LYS A 199 15.666 23.277 34.884 1.00 25.69 C
ATOM 430 CG LYS A 199 15.933 22.575 36.200 1.00 23.90 C
ATOM 431 CD LYS A 199 16.503 21.189 35.930 1.00 21.81 C
ATOM 432 CE LYS A 199 17.002 20.515 37.195 1.00 30.34 C
ATOM 433 NZ LYS A 199 17.496 19.142 36.899 1.00 31.20 N
ATOM 434 N THR A 200 16.073 26.398 34.867 1.00 30.34 N
ATOM 435 CA THR A 200 16.653 27.633 35.384 1.00 27.94 C
ATOM 436 C THR A 200 15.569 28.604 35.834 1.00 29.14 C
ATOM 437 O THR A 200 15.655 29.199 36.915 1.00 29.18 O
ATOM 438 CB THR A 200 17.535 28.276 34.310 1.00 30.16 C
ATOM 439 OG1 THR A 200 18.658 27.428 34.040 1.00 35.68 O
ATOM 440 CG2 THR A 200 18.030 29.645 34.761 1.00 42.76 C
ATOM 441 N ILE A 201 14.531 28.768 35.014 1.00 25.61 N
ATOM 442 CA ILE A 201 13.465 29.711 35.335 1.00 24.47 C
ATOM 443 C ILE A 201 12.692 29.250 36.565 1.00 30.94 C
ATOM 444 O ILE A 201 12.344 30.056 37.437 1.00 27.17 O
ATOM 445 CB ILE A 201 12.542 29.896 34.117 1.00 25.58 C
ATOM 446 CG1 ILE A 201 13.280 30.634 33.000 1.00 30.67 C
ATOM 447 CG2 ILE A 201 11.280 30.635 34.505 1.00 29.94 C
ATOM 448 CD1 ILE A 201 12.538 30.641 31.693 1.00 29.01 C
ATOM 449 N LEU A 202 12.424 27.947 36.662 1.00 24.22 N
ATOM 450 CA LEU A 202 11.608 27.444 37.763 1.00 25.00 C
ATOM 451 C LEU A 202 12.336 27.562 39.097 1.00 26.99 C
ATOM 452 O LEU A 202 11.724 27.916 40.112 1.00 29.22 O
ATOM 453 CB LEU A 202 11.208 25.995 37.495 1.00 23.02 C
ATOM 454 CG LEU A 202 10.345 25.798 36.248 1.00 25.78 C
ATOM 455 CD1 LEU A 202 10.279 24.327 35.857 1.00 26.68 C
ATOM 456 CD2 LEU A 202 8.960 26.366 36.457 1.00 24.32 C
ATOM 457 N LYS A 203 13.638 27.268 39.116 1.00 28.11 N
ATOM 458 CA LYS A 203 14.413 27.433 40.342 1.00 29.45 C
ATOM 459 C LYS A 203 14.403 28.884 40.804 1.00 31.54 C
ATOM 460 O LYS A 203 14.282 29.163 42.003 1.00 32.25 O
ATOM 461 CB LYS A 203 15.850 26.957 40.126 1.00 29.24 C
ATOM 462 CG LYS A 203 15.986 25.480 39.803 1.00 33.25 C
ATOM 463 CD LYS A 203 15.767 24.624 41.031 1.00 44.01 C
ATOM 464 CE LYS A 203 16.523 23.309 40.922 1.00 49.26 C
ATOM 465 NZ LYS A 203 16.381 22.483 42.154 1.00 50.73 N
ATOM 466 N ALA A 204 14.523 29.822 39.862 1.00 30.31 N
ATOM 467 CA ALA A 204 14.537 31.235 40.220 1.00 28.69 C
ATOM 468 C ALA A 204 13.205 31.668 40.820 1.00 35.36 C
ATOM 469 O ALA A 204 13.169 32.523 41.713 1.00 41.90 O
ATOM 470 CB ALA A 204 14.875 32.083 38.994 1.00 29.05 C
ATOM 471 N LEU A 205 12.098 31.086 40.344 1.00 28.73 N
ATOM 472 CA LEU A 205 10.789 31.457 40.873 1.00 29.56 C
ATOM 473 C LEU A 205 10.671 31.134 42.358 1.00 33.30 C
ATOM 474 O LEU A 205 9.993 31.857 43.096 1.00 29.39 O
ATOM 475 CB LEU A 205 9.678 30.756 40.089 1.00 28.83 C
ATOM 476 CG LEU A 205 9.279 31.346 38.737 1.00 35.19 C
ATOM 477 CD1 LEU A 205 8.096 30.582 38.156 1.00 31.60 C
ATOM 478 CD2 LEU A 205 8.952 32.830 38.862 1.00 30.22 C
ATOM 479 N GLY A 206 11.313 30.060 42.814 1.00 28.05 N
ATOM 480 CA GLY A 206 11.307 29.717 44.217 1.00 34.06 C
ATOM 481 C GLY A 206 10.236 28.707 44.575 1.00 30.87 C
ATOM 482 O GLY A 206 9.333 28.411 43.784 1.00 28.89 O
ATOM 483 N PRO A 207 10.308 28.168 45.796 1.00 31.26 N
ATOM 484 CA PRO A 207 9.386 27.086 46.176 1.00 28.50 C
ATOM 485 C PRO A 207 7.957 27.543 46.410 1.00 32.73 C
ATOM 486 O PRO A 207 7.055 26.697 46.426 1.00 28.53 O
ATOM 487 CB PRO A 207 10.011 26.534 47.463 1.00 28.11 C
ATOM 488 CG PRO A 207 10.706 27.706 48.056 1.00 27.37 C
ATOM 489 CD PRO A 207 11.216 28.534 46.897 1.00 29.81 C
ATOM 490 N GLY A 208 7.718 28.838 46.589 1.00 22.69 N
ATOM 491 CA GLY A 208 6.374 29.330 46.796 1.00 25.49 C
ATOM 492 C GLY A 208 5.591 29.613 45.538 1.00 24.60 C
ATOM 493 O GLY A 208 4.438 30.046 45.625 1.00 23.89 O
ATOM 494 N ALA A 209 6.179 29.380 44.365 1.00 23.58 N
ATOM 495 CA ALA A 209 5.504 29.690 43.113 1.00 25.61 C
ATOM 496 C ALA A 209 4.320 28.757 42.890 1.00 25.62 C
ATOM 497 O ALA A 209 4.341 27.583 43.268 1.00 23.53 O
ATOM 498 CB ALA A 209 6.479 29.581 41.940 1.00 26.58 C
ATOM 499 N THR A 210 3.278 29.294 42.266 1.00 21.61 N
ATOM 500 CA THR A 210 2.124 28.503 41.875 1.00 20.46 C
ATOM 501 C THR A 210 2.349 27.902 40.491 1.00 22.07 C
ATOM 502 O THR A 210 3.266 28.283 39.759 1.00 23.24 O
ATOM 503 CB THR A 210 0.858 29.359 41.887 1.00 28.36 C
ATOM 504 OG1 THR A 210 0.942 30.351 40.856 1.00 27.15 O
ATOM 505 CG2 THR A 210 0.702 30.049 43.229 1.00 26.26 C
ATOM 506 N LEU A 211 1.494 26.942 40.133 1.00 21.40 N
ATOM 507 CA LEU A 211 1.578 26.357 38.800 1.00 24.08 C
ATOM 508 C LEU A 211 1.309 27.404 37.726 1.00 22.69 C
ATOM 509 O LEU A 211 1.986 27.431 36.691 1.00 22.73 O
ATOM 510 CB LEU A 211 0.601 25.191 38.670 1.00 26.47 C
ATOM 511 CG LEU A 211 0.748 24.364 37.393 1.00 30.10 C
ATOM 512 CD1 LEU A 211 2.154 23.798 37.281 1.00 29.02 C
ATOM 513 CD2 LEU A 211 -0.283 23.247 37.358 1.00 27.47 C
ATOM 514 N GLU A 212 0.330 28.282 37.964 1.00 26.83 N
ATOM 515 CA GLU A 212 0.034 29.351 37.015 1.00 28.51 C
ATOM 516 C GLU A 212 1.236 30.268 36.829 1.00 25.38 C
ATOM 517 O GLU A 212 1.522 30.711 35.710 1.00 23.52 O
ATOM 518 CB GLU A 212 -1.183 30.160 37.481 1.00 29.33 C
ATOM 519 CG GLU A 212 -2.493 29.369 37.648 1.00 48.94 C
ATOM 520 CD GLU A 212 -2.480 28.385 38.811 1.00 58.04 C
ATOM 521 OE1 GLU A 212 -1.643 28.543 39.724 1.00 49.56 O
ATOM 522 OE2 GLU A 212 -3.314 27.459 38.819 1.00 58.04 O
ATOM 523 N GLU A 213 1.955 30.561 37.915 1.00 23.94 N
ATOM 524 CA GLU A 213 3.139 31.407 37.811 1.00 25.52 C
ATOM 525 C GLU A 213 4.264 30.692 37.070 1.00 25.51 C
ATOM 526 O GLU A 213 5.021 31.324 36.324 1.00 27.21 O
ATOM 527 CB GLU A 213 3.590 31.848 39.204 1.00 26.85 C
ATOM 528 CG GLU A 213 2.675 32.887 39.839 1.00 23.73 C
ATOM 529 CD GLU A 213 2.827 32.967 41.345 1.00 28.94 C
ATOM 530 OE1 GLU A 213 3.500 32.091 41.926 1.00 30.36 O
ATOM 531 OE2 GLU A 213 2.270 33.908 41.945 1.00 24.11 O
ATOM 532 N MET A 214 4.387 29.375 37.260 1.00 20.34 N
ATOM 533 CA MET A 214 5.371 28.611 36.497 1.00 21.24 C
ATOM 534 C MET A 214 5.036 28.617 35.012 1.00 20.05 C
ATOM 535 O MET A 214 5.922 28.806 34.168 1.00 24.78 O
ATOM 536 CB MET A 214 5.438 27.173 37.007 1.00 19.22 C
ATOM 537 CG MET A 214 5.962 27.008 38.415 1.00 22.12 C
ATOM 538 SD MET A 214 5.834 25.282 38.918 1.00 28.36 S
ATOM 539 CE MET A 214 6.701 25.309 40.480 1.00 34.14 C
ATOM 540 N MET A 215 3.764 28.390 34.676 1.00 21.20 N
ATOM 541 CA MET A 215 3.332 28.418 33.282 1.00 23.67 C
ATOM 542 C MET A 215 3.674 29.753 32.635 1.00 29.57 C
ATOM 543 O MET A 215 4.247 29.802 31.540 1.00 29.99 O
ATOM 544 CB MET A 215 1.826 28.158 33.195 1.00 27.18 C
ATOM 545 CG MET A 215 1.383 26.784 33.661 1.00 28.44 C
ATOM 546 SD MET A 215 1.833 25.468 32.518 1.00 33.15 S
ATOM 547 CE MET A 215 0.919 24.096 33.220 1.00 28.83 C
ATOM 548 N THR A 216 3.336 30.850 33.315 1.00 26.06 N
ATOM 549 CA THR A 216 3.600 32.181 32.778 1.00 26.89 C
ATOM 550 C THR A 216 5.093 32.413 32.578 1.00 29.80 C
ATOM 551 O THR A 216 5.509 33.027 31.588 1.00 36.98 O
ATOM 552 CB THR A 216 3.014 33.239 33.715 1.00 27.12 C
ATOM 553 OG1 THR A 216 1.589 33.093 33.771 1.00 30.97 O
ATOM 554 CG2 THR A 216 3.360 34.639 33.227 1.00 32.36 C
ATOM 555 N ALA A 217 5.916 31.920 33.505 1.00 24.78 N
ATOM 556 CA ALA A 217 7.347 32.191 33.447 1.00 24.40 C
ATOM 557 C ALA A 217 8.035 31.406 32.337 1.00 28.18 C
ATOM 558 O ALA A 217 9.038 31.871 31.786 1.00 30.63 O
ATOM 559 CB ALA A 217 7.990 31.878 34.797 1.00 29.49 C
ATOM 560 N CYS A 218 7.528 30.223 31.994 1.00 24.50 N
ATOM 561 CA CYS A 218 8.137 29.399 30.957 1.00 25.85 C
ATOM 562 C CYS A 218 7.459 29.549 29.603 1.00 29.45 C
ATOM 563 O CYS A 218 7.787 28.802 28.677 1.00 26.03 O
ATOM 564 CB CYS A 218 8.141 27.927 31.372 1.00 23.00 C
ATOM 565 SG CYS A 218 9.037 27.608 32.896 1.00 24.89 S
ATOM 566 N GLN A 219 6.528 30.490 29.467 1.00 30.48 N
ATOM 567 CA GLN A 219 5.886 30.730 28.180 1.00 33.19 C
ATOM 568 C GLN A 219 6.915 31.160 27.141 1.00 34.82 C
ATOM 569 O GLN A 219 7.657 32.125 27.346 1.00 38.92 O
ATOM 570 CB GLN A 219 4.805 31.800 28.331 1.00 34.35 C
ATOM 571 CG GLN A 219 3.733 31.763 27.257 1.00 40.70 C
ATOM 572 CD GLN A 219 2.735 32.902 27.388 1.00 55.14 C
ATOM 573 OE1 GLN A 219 2.469 33.385 28.490 1.00 57.36 O
ATOM 574 NE2 GLN A 219 2.171 33.332 26.261 1.00 58.67 N
ATOM 575 N GLY A 220 6.960 30.436 26.021 1.00 37.25 N
ATOM 576 CA GLY A 220 7.854 30.762 24.931 1.00 33.69 C
ATOM 577 C GLY A 220 9.237 30.153 25.020 1.00 33.07 C
ATOM 578 O GLY A 220 10.016 30.286 24.067 1.00 31.16 O
ATOM 579 N VAL A 221 9.575 29.500 26.130 1.00 23.52 N
ATOM 580 CA VAL A 221 10.875 28.853 26.240 1.00 29.93 C
ATOM 581 C VAL A 221 10.889 27.608 25.373 1.00 33.22 C
ATOM 582 O VAL A 221 10.039 26.715 25.518 1.00 28.89 O
ATOM 583 CB VAL A 221 11.192 28.529 27.706 1.00 27.33 C
ATOM 584 CG1 VAL A 221 12.514 27.796 27.801 1.00 28.41 C
ATOM 585 CG2 VAL A 221 11.229 29.809 28.516 1.00 29.83 C
ATOM 586 N GLY A 222 11.858 27.535 24.462 1.00 30.43 N
ATOM 587 CA GLY A 222 11.894 26.523 23.437 1.00 33.12 C
ATOM 588 C GLY A 222 11.090 26.857 22.198 1.00 29.26 C
ATOM 589 O GLY A 222 11.245 26.182 21.174 1.00 34.14 O
ATOM 590 N GLY A 223 10.246 27.884 22.263 1.00 36.16 N
ATOM 591 CA GLY A 223 9.374 28.243 21.171 1.00 40.07 C
ATOM 592 C GLY A 223 9.961 29.332 20.297 1.00 36.26 C
ATOM 593 O GLY A 223 11.169 29.366 20.041 1.00 40.00 O
ATOM 594 N PRO A 224 9.115 30.271 19.836 1.00 38.46 N
ATOM 595 CA PRO A 224 7.693 30.438 20.170 1.00 44.07 C
ATOM 596 C PRO A 224 6.750 29.419 19.520 1.00 42.55 C
ATOM 597 O PRO A 224 5.563 29.411 19.843 1.00 39.42 O
ATOM 598 CB PRO A 224 7.373 31.853 19.659 1.00 38.30 C
ATOM 599 CG PRO A 224 8.693 32.470 19.289 1.00 40.62 C
ATOM 600 CD PRO A 224 9.580 31.331 18.930 1.00 40.10 C
ATOM 601 N GLY A 225 7.261 28.584 18.617 1.00 34.45 N
ATOM 602 CA GLY A 225 6.453 27.510 18.069 1.00 37.33 C
ATOM 603 C GLY A 225 5.433 27.924 17.033 1.00 36.27 C
ATOM 604 O GLY A 225 4.479 27.180 16.786 1.00 30.29 O
ATOM 605 N HIS A 226 5.601 29.092 16.422 1.00 35.50 N
ATOM 606 CA HIS A 226 4.747 29.514 15.322 1.00 38.17 C
ATOM 607 C HIS A 226 5.282 28.957 14.007 1.00 34.27 C
ATOM 608 O HIS A 226 6.489 28.761 13.843 1.00 37.96 O
ATOM 609 CB HIS A 226 4.667 31.040 15.242 1.00 45.71 C
ATOM 610 CG HIS A 226 4.222 31.695 16.514 1.00 51.81 C
ATOM 611 ND1 HIS A 226 5.079 32.416 17.313 1.00 49.83 N
ATOM 612 CD2 HIS A 226 3.011 31.739 17.119 1.00 50.11 C
ATOM 613 CE1 HIS A 226 4.416 32.879 18.361 1.00 48.79 C
ATOM 614 NE2 HIS A 226 3.162 32.482 18.267 1.00 54.22 N
ATOM 615 N LYS A 227 4.369 28.688 13.073 1.00 28.16 N
ATOM 616 CA LYS A 227 4.788 28.251 11.747 1.00 30.02 C
ATOM 617 C LYS A 227 5.551 29.371 11.055 1.00 33.49 C
ATOM 618 O LYS A 227 5.116 30.526 11.056 1.00 37.72 O
ATOM 619 CB LYS A 227 3.584 27.837 10.900 1.00 29.84 C
ATOM 620 CG LYS A 227 3.971 27.355 9.503 1.00 38.22 C
ATOM 621 CD LYS A 227 2.777 26.850 8.708 1.00 31.38 C
ATOM 622 CE LYS A 227 3.191 26.511 7.281 1.00 39.24 C
ATOM 623 NZ LYS A 227 2.189 25.678 6.559 1.00 40.46 N
ATOM 624 N ALA A 228 6.692 29.027 10.468 1.00 36.11 N
ATOM 625 CA ALA A 228 7.525 30.012 9.794 1.00 44.30 C
ATOM 626 C ALA A 228 6.846 30.540 8.532 1.00 39.98 C
ATOM 627 O ALA A 228 6.434 29.764 7.670 1.00 46.02 O
ATOM 628 CB ALA A 228 8.879 29.413 9.461 1.00 40.40 C
TER
ATOM 629 N ILE T 1 5.293 22.969 43.818 1.00 28.39 N
ATOM 630 CA ILE T 1 3.866 22.683 43.874 1.00 23.07 C
ATOM 631 C ILE T 1 3.643 21.234 44.274 1.00 27.41 C
ATOM 632 O ILE T 1 4.577 20.432 44.279 1.00 26.07 O
ATOM 633 CB ILE T 1 3.177 22.988 42.534 1.00 29.73 C
ATOM 634 CG1 ILE T 1 3.692 22.048 41.446 1.00 27.84 C
ATOM 635 CG2 ILE T 1 3.400 24.437 42.136 1.00 34.40 C
ATOM 636 CD1 ILE T 1 2.714 21.818 40.322 1.00 37.81 C
ATOM 637 N THR T 2 2.402 20.900 44.607 1.00 24.56 N
ATOM 638 CA THR T 2 2.031 19.558 45.027 1.00 27.55 C
ATOM 639 C THR T 2 1.155 18.899 43.969 1.00 26.39 C
ATOM 640 O THR T 2 0.707 19.532 43.010 1.00 23.18 O
ATOM 641 CB THR T 2 1.296 19.591 46.371 1.00 26.85 C
ATOM 642 OG1 THR T 2 0.123 20.407 46.254 1.00 25.80 O
ATOM 643 CG2 THR T 2 2.197 20.158 47.456 1.00 28.35 C
ATOM 644 N PHE T 3 0.918 17.599 44.159 1.00 20.88 N
ATOM 645 CA PHE T 3 -0.004 16.885 43.281 1.00 21.28 C
ATOM 646 C PHE T 3 -1.412 17.455 43.394 1.00 23.36 C
ATOM 647 O PHE T 3 -2.167 17.461 42.415 1.00 22.16 O
ATOM 648 CB PHE T 3 0.002 15.391 43.615 1.00 21.83 C
ATOM 649 CG PHE T 3 -0.916 14.571 42.754 1.00 24.17 C
ATOM 650 CD1 PHE T 3 -0.801 14.595 41.375 1.00 22.37 C
ATOM 651 CD2 PHE T 3 -1.891 13.769 43.326 1.00 25.98 C
ATOM 652 CE1 PHE T 3 -1.645 13.842 40.579 1.00 24.32 C
ATOM 653 CE2 PHE T 3 -2.736 13.011 42.536 1.00 27.43 C
ATOM 654 CZ PHE T 3 -2.613 13.048 41.161 1.00 25.38 C
ATOM 655 N GLU T 4 -1.774 17.949 44.581 1.00 22.94 N
ATOM 656 CA GLU T 4 -3.086 18.558 44.770 1.00 22.85 C
ATOM 657 C GLU T 4 -3.244 19.824 43.938 1.00 22.07 C
ATOM 658 O GLU T 4 -4.354 20.136 43.494 1.00 23.27 O
ATOM 659 CB GLU T 4 -3.316 18.853 46.253 1.00 28.77 C
ATOM 660 CG GLU T 4 -3.283 17.616 47.139 1.00 29.12 C
ATOM 661 CD GLU T 4 -3.355 17.950 48.618 1.00 40.23 C
ATOM 662 OE1 GLU T 4 -4.318 18.633 49.033 1.00 39.98 O
ATOM 663 OE2 GLU T 4 -2.440 17.534 49.361 1.00 28.77 O
ATOM 664 N ASP T 5 -2.153 20.563 43.711 1.00 21.08 N
ATOM 665 CA ASP T 5 -2.215 21.708 42.806 1.00 19.57 C
ATOM 666 C ASP T 5 -2.523 21.259 41.387 1.00 21.14 C
ATOM 667 O ASP T 5 -3.304 21.905 40.677 1.00 22.86 O
ATOM 668 CB ASP T 5 -0.898 22.477 42.829 1.00 24.93 C
ATOM 669 CG ASP T 5 -0.550 22.999 44.197 1.00 27.06 C
ATOM 670 OD1 ASP T 5 -1.463 23.440 44.924 1.00 23.15 O
ATOM 671 OD2 ASP T 5 0.645 22.956 44.538 1.00 23.03 O
ATOM 672 N LEU T 6 -1.906 20.158 40.953 1.00 19.25 N
ATOM 673 CA LEU T 6 -2.189 19.622 39.626 1.00 19.62 C
ATOM 674 C LEU T 6 -3.646 19.197 39.511 1.00 21.92 C
ATOM 675 O LEU T 6 -4.295 19.449 38.489 1.00 24.01 O
ATOM 676 CB LEU T 6 -1.262 18.445 39.330 1.00 18.49 C
ATOM 677 CG LEU T 6 0.233 18.762 39.232 1.00 19.12 C
ATOM 678 CD1 LEU T 6 1.044 17.483 39.073 1.00 20.12 C
ATOM 679 CD2 LEU T 6 0.512 19.715 38.077 1.00 21.99 C
ATOM 680 N LEU T 7 -4.176 18.556 40.555 1.00 21.82 N
ATOM 681 CA LEU T 7 -5.580 18.161 40.548 1.00 23.18 C
ATOM 682 C LEU T 7 -6.491 19.380 40.474 1.00 28.14 C
ATOM 683 O LEU T 7 -7.490 19.376 39.745 1.00 26.64 O
ATOM 684 CB LEU T 7 -5.893 17.329 41.793 1.00 22.79 C
ATOM 685 CG LEU T 7 -5.231 15.952 41.873 1.00 23.84 C
ATOM 686 CD1 LEU T 7 -5.334 15.394 43.283 1.00 27.06 C
ATOM 687 CD2 LEU T 7 -5.842 14.991 40.865 1.00 26.73 C
ATOM 688 N ASP T 8 -6.158 20.437 41.219 1.00 24.50 N
ATOM 689 CA ASP T 8 -6.948 21.662 41.159 1.00 27.26 C
ATOM 690 C ASP T 8 -6.834 22.324 39.792 1.00 31.28 C
ATOM 691 O ASP T 8 -7.810 22.888 39.284 1.00 31.00 O
ATOM 692 CB ASP T 8 -6.503 22.630 42.255 1.00 29.43 C
ATOM 693 CG ASP T 8 -6.905 22.164 43.640 1.00 36.74 C
ATOM 694 OD1 ASP T 8 -7.722 21.224 43.741 1.00 34.22 O
ATOM 695 OD2 ASP T 8 -6.402 22.737 44.630 1.00 36.45 O
ATOM 696 N TYR T 9 -5.652 22.256 39.179 1.00 28.29 N
ATOM 697 CA TYR T 9 -5.423 22.944 37.913 1.00 26.58 C
ATOM 698 C TYR T 9 -6.199 22.288 36.778 1.00 29.72 C
ATOM 699 O TYR T 9 -6.911 22.963 36.027 1.00 26.24 O
ATOM 700 CB TYR T 9 -3.926 22.965 37.607 1.00 22.71 C
ATOM 701 CG TYR T 9 -3.528 23.797 36.411 1.00 26.44 C
ATOM 702 CD1 TYR T 9 -3.434 25.180 36.501 1.00 28.25 C
ATOM 703 CD2 TYR T 9 -3.219 23.196 35.198 1.00 23.56 C
ATOM 704 CE1 TYR T 9 -3.061 25.943 35.410 1.00 33.57 C
ATOM 705 CE2 TYR T 9 -2.841 23.948 34.104 1.00 25.06 C
ATOM 706 CZ TYR T 9 -2.765 25.320 34.213 1.00 38.11 C
ATOM 707 OH TYR T 9 -2.392 26.072 33.122 1.00 36.33 O
ATOM 708 N TYR T 10 -6.079 20.968 36.640 1.00 25.20 N
ATOM 709 CA TYR T 10 -6.682 20.255 35.521 1.00 23.81 C
ATOM 710 C TYR T 10 -8.085 19.743 35.817 1.00 30.51 C
ATOM 711 O TYR T 10 -8.852 19.504 34.877 1.00 30.46 O
ATOM 712 CB TYR T 10 -5.786 19.084 35.104 1.00 26.14 C
ATOM 713 CG TYR T 10 -4.470 19.526 34.507 1.00 23.67 C
ATOM 714 CD1 TYR T 10 -3.276 19.327 35.186 1.00 22.96 C
ATOM 715 CD2 TYR T 10 -4.424 20.152 33.266 1.00 22.19 C
ATOM 716 CE1 TYR T 10 -2.073 19.735 34.647 1.00 25.48 C
ATOM 717 CE2 TYR T 10 -3.222 20.561 32.717 1.00 24.04 C
ATOM 718 CZ TYR T 10 -2.048 20.346 33.413 1.00 25.79 C
ATOM 719 OH TYR T 10 -0.844 20.749 32.878 1.00 26.69 O
ATOM 720 N GLY T 11 -8.440 19.572 37.087 1.00 36.48 N
ATOM 721 CA GLY T 11 -9.766 19.106 37.447 1.00 39.15 C
ATOM 722 C GLY T 11 -10.763 20.234 37.615 1.00 37.60 C
ATOM 723 O GLY T 11 -10.742 21.208 36.863 1.00 44.00 O
TER
HETATM 724 O HOH S 1 3.703 7.134 51.853 1.00 21.66 O
HETATM 725 O HOH S 2 8.986 20.044 41.289 1.00 22.20 O
HETATM 726 O HOH S 3 8.872 11.857 28.713 1.00 20.32 O
HETATM 727 O HOH S 4 2.840 32.247 44.904 1.00 25.68 O
HETATM 728 O HOH S 5 4.350 16.983 24.310 1.00 23.30 O
HETATM 729 O HOH S 6 5.348 3.950 42.648 1.00 23.58 O
HETATM 730 O HOH S 7 9.378 13.032 36.064 1.00 22.02 O
HETATM 731 O HOH S 8 6.126 25.603 43.944 1.00 21.86 O
HETATM 732 O HOH S 9 4.067 11.014 28.219 1.00 23.95 O
HETATM 733 O HOH S 10 14.049 17.363 30.411 1.00 28.33 O
HETATM 734 O HOH S 11 8.689 29.717 13.551 1.00 31.92 O
HETATM 735 O HOH S 12 0.136 25.898 42.743 1.00 27.05 O
HETATM 736 O HOH S 13 2.157 11.012 30.291 1.00 26.90 O
HETATM 737 O HOH S 14 7.958 26.348 27.585 1.00 26.35 O
HETATM 738 O HOH S 15 10.755 24.245 26.265 1.00 28.23 O
HETATM 739 O HOH S 16 9.285 27.266 41.175 1.00 32.00 O
HETATM 740 O HOH S 17 3.195 2.751 39.722 1.00 29.70 O
HETATM 741 O HOH S 18 3.650 24.881 17.956 1.00 34.07 O
HETATM 742 O HOH S 19 0.553 17.386 26.784 1.00 36.09 O
HETATM 743 O HOH S 20 4.596 26.481 28.094 1.00 28.56 O
HETATM 744 O HOH S 21 5.345 27.613 25.675 1.00 35.52 O
HETATM 745 O HOH S 22 13.881 29.147 24.057 1.00 35.46 O
HETATM 746 O HOH S 23 8.705 9.206 28.644 1.00 33.63 O
HETATM 747 O HOH S 24 2.496 6.087 36.263 1.00 33.55 O
HETATM 748 O HOH S 25 5.009 19.323 22.174 1.00 29.33 O
HETATM 749 O HOH S 26 -0.996 32.092 40.606 1.00 32.21 O
HETATM 750 O HOH S 27 -0.744 9.581 51.684 1.00 33.94 O
HETATM 751 O HOH S 28 0.913 34.372 36.411 1.00 38.24 O
HETATM 752 O HOH S 29 17.734 29.646 38.394 1.00 36.01 O
HETATM 753 O HOH S 30 8.302 24.557 20.997 1.00 31.64 O
HETATM 754 O HOH S 31 5.213 33.945 36.706 1.00 35.75 O
HETATM 755 O HOH S 32 4.642 15.028 50.778 1.00 27.39 O
HETATM 756 O HOH S 33 9.755 33.290 29.646 1.00 51.51 O
HETATM 757 O HOH S 34 15.653 20.375 40.916 1.00 41.38 O
HETATM 758 O HOH S 35 0.182 2.254 36.943 1.00 37.90 O
HETATM 759 O HOH S 36 5.670 23.604 20.245 1.00 28.86 O
HETATM 760 O HOH S 37 8.496 24.862 42.667 1.00 34.55 O
HETATM 761 O HOH S 38 17.219 19.104 32.421 1.00 32.78 O
HETATM 762 O HOH S 39 13.542 10.881 37.056 1.00 34.06 O
HETATM 763 O HOH S 40 -4.038 9.410 42.729 1.00 33.20 O
HETATM 764 O HOH S 41 13.532 19.649 42.296 1.00 35.05 O
HETATM 765 O HOH S 42 15.217 13.530 42.966 1.00 36.45 O
HETATM 766 O HOH S 43 -3.084 5.779 42.211 1.00 35.17 O
HETATM 767 O HOH S 44 9.068 31.519 45.940 1.00 37.76 O
HETATM 768 O HOH S 45 16.152 23.898 27.249 1.00 38.28 O
HETATM 769 O HOH S 46 10.908 34.037 32.691 1.00 37.00 O
HETATM 770 O HOH S 47 -0.559 33.863 38.555 1.00 42.70 O
HETATM 771 O HOH S 48 -2.398 7.693 50.434 1.00 37.28 O
HETATM 772 O HOH S 49 9.914 28.019 17.578 1.00 40.40 O
HETATM 773 O HOH S 50 13.185 9.395 30.750 1.00 50.96 O
HETATM 774 O HOH S 51 3.466 28.135 29.519 1.00 35.70 O
HETATM 775 O HOH S 52 0.937 35.777 40.442 1.00 38.94 O
HETATM 776 O HOH S 53 5.394 8.625 28.301 1.00 36.76 O
HETATM 777 O HOH S 54 16.985 17.019 34.338 1.00 37.02 O
HETATM 778 O HOH S 55 6.935 26.801 21.889 1.00 39.92 O
HETATM 779 O HOH S 56 2.781 35.437 36.981 1.00 39.55 O
HETATM 780 O HOH S 57 -5.731 7.120 39.567 1.00 39.95 O
HETATM 781 O HOH S 58 -2.629 21.153 28.622 1.00 38.41 O
HETATM 782 O HOH S 59 -5.923 11.331 41.280 1.00 43.16 O
HETATM 783 O HOH S 60 3.627 0.086 41.014 1.00 36.55 O
HETATM 784 O HOH S 61 12.717 27.519 18.207 1.00 44.48 O
HETATM 785 O HOH S 62 20.296 24.878 27.267 1.00 49.82 O
HETATM 786 O HOH S 63 11.246 13.654 26.636 1.00 42.44 O
HETATM 787 O HOH S 64 -0.913 22.233 30.711 1.00 27.40 O
HETATM 788 O HOH S 65 -1.448 25.110 30.731 1.00 32.01 O
HETATM 789 O HOH S 66 -4.869 19.475 51.431 1.00 38.09 O
HETATM 790 O HOH S 67 6.891 22.210 41.677 1.00 33.83 O
HETATM 791 O HOH S 68 1.695 16.847 24.312 1.00 35.84 O
HETATM 792 O HOH S 69 3.666 25.271 20.782 1.00 37.01 O
HETATM 793 O HOH S 70 16.852 17.396 30.096 1.00 39.30 O
HETATM 794 O HOH S 71 9.660 36.265 31.925 1.00 47.10 O
HETATM 795 O HOH S 72 1.835 6.290 53.547 1.00 39.48 O
HETATM 796 O HOH S 73 10.221 2.802 33.922 1.00 35.83 O
HETATM 797 O HOH S 74 9.183 30.056 15.915 1.00 44.63 O
HETATM 798 O HOH S 75 -3.884 9.282 33.644 1.00 36.93 O
HETATM 799 O HOH S 76 10.990 11.706 26.859 1.00 46.74 O
HETATM 800 O HOH S 77 17.919 30.210 41.207 1.00 38.50 O
HETATM 801 O HOH S 78 19.732 27.260 38.165 1.00 42.44 O
HETATM 802 O HOH S 79 -8.582 11.553 41.084 1.00 44.07 O
HETATM 803 O HOH S 80 -0.780 19.308 49.312 1.00 46.70 O
HETATM 804 O HOH S 81 9.966 34.525 35.257 1.00 40.55 O
HETATM 805 O HOH S 82 3.979 4.431 28.210 1.00 47.98 O
HETATM 806 O HOH S 83 -6.516 14.346 32.476 1.00 47.98 O
HETATM 807 O HOH S 84 -6.232 15.924 30.916 1.00 55.15 O
HETATM 808 O HOH S 85 -10.025 23.271 36.620 1.00 44.02 O
HETATM 809 O HOH S 86 -6.505 5.021 40.955 1.00 37.88 O
HETATM 810 O HOH S 87 2.993 0.232 43.897 1.00 43.00 O
HETATM 811 O HOH S 88 7.536 26.911 10.375 1.00 42.85 O
HETATM 812 O HOH S 89 -7.487 21.420 46.671 1.00 45.06 O
HETATM 813 O HOH S 90 16.140 29.946 30.707 1.00 43.51 O
HETATM 814 O HOH S 91 -2.613 28.467 33.138 1.00 44.25 O
HETATM 815 O HOH S 92 4.650 30.472 22.217 1.00 47.27 O
END