HEADER HYDROLASE/DNA 04-OCT-96 XXXX TITLE SUBSITE BINDING IN AN RNASE: STRUCTURE OF A BARNASE- TITLE 2 TETRANUCLEOTIDE COMPLEX AT 1.76 ANGSTROMS RESOLUTION COMPND BARNASE (E.C.3.1.27.-)/DNA COMPLEX KEYWDS PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR A.M.BUCKLE, A.R.FERSHT JRNL AUTH A.M.BUCKLE, A.R.FERSHT JRNL TITL SUBSITE BINDING IN AN RNASE: STRUCTURE OF A JRNL TITL 2 BARNASE-TETRANUCLEOTIDE COMPLEX AT 1.76-A JRNL TITL 3 RESOLUTION. JRNL REF BIOCHEMISTRY V. 33 1644 1994 JRNL REFN ASTM BICHAW US ISSN 0006-2960 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH Y.MAUGUEN, R.W.HARTLEY, E.J.DODSON, G.G.DODSON, REMARK 1 AUTH 2 G.BRICOGNE, C.CHOTHIA, A.JACK REMARK 1 TITL MOLECULAR STRUCTURES OF A NEW FAMILY OF REMARK 1 TITL 2 RIBONUCLEASES REMARK 1 REF NATURE V. 297 162 1982 REMARK 1 REFN ASTM NATUAS UK ISSN 0028-0836 SEQRES 1 A 4 DC DG DA DC SEQRES 1 B 4 DC DG DA DC SEQRES 1 L 110 ALA GLN VAL ILE ASN THR PHE ASP GLY VAL ALA ASP TYR SEQRES 2 L 110 LEU GLN THR TYR HIS LYS LEU PRO ASP ASN TYR ILE THR SEQRES 3 L 110 LYS SER GLU ALA GLN ALA LEU GLY TRP VAL ALA SER LYS SEQRES 4 L 110 GLY ASN LEU ALA ASP VAL ALA PRO GLY LYS SER ILE GLY SEQRES 5 L 110 GLY ASP ILE PHE SER ASN ARG GLU GLY LYS LEU PRO GLY SEQRES 6 L 110 LYS SER GLY ARG THR TRP ARG GLU ALA ASP ILE ASN TYR SEQRES 7 L 110 THR SER GLY PHE ARG ASN SER ASP ARG ILE LEU TYR SER SEQRES 8 L 110 SER ASP TRP LEU ILE TYR LYS THR THR ASP HIS TYR GLN SEQRES 9 L 110 THR PHE THR LYS ILE ARG SEQRES 1 M 110 ALA GLN VAL ILE ASN THR PHE ASP GLY VAL ALA ASP TYR SEQRES 2 M 110 LEU GLN THR TYR HIS LYS LEU PRO ASP ASN TYR ILE THR SEQRES 3 M 110 LYS SER GLU ALA GLN ALA LEU GLY TRP VAL ALA SER LYS SEQRES 4 M 110 GLY ASN LEU ALA ASP VAL ALA PRO GLY LYS SER ILE GLY SEQRES 5 M 110 GLY ASP ILE PHE SER ASN ARG GLU GLY LYS LEU PRO GLY SEQRES 6 M 110 LYS SER GLY ARG THR TRP ARG GLU ALA ASP ILE ASN TYR SEQRES 7 M 110 THR SER GLY PHE ARG ASN SER ASP ARG ILE LEU TYR SER SEQRES 8 M 110 SER ASP TRP LEU ILE TYR LYS THR THR ASP HIS TYR GLN SEQRES 9 M 110 THR PHE THR LYS ILE ARG FORMUL 5 HOH *229(H2 O) HELIX 1 1L THR L 6 HIS L 18 1 13 HELIX 2 2L THR L 26 GLY L 34 1 9 HELIX 3 3L ASN L 41 ALA L 46 5 6 HELIX 4 1M THR M 6 HIS M 18 1 13 HELIX 5 2M THR M 26 GLY M 34 1 9 HELIX 6 3M ASN M 41 ALA M 46 5 6 SHEET 1 1L 5 ILE L 51 PHE L 56 0 SHEET 2 1L 5 THR L 70 ILE L 76 1 SHEET 3 1L 5 ASP L 86 SER L 92 -1 SHEET 4 1L 5 LEU L 95 THR L 99 1 SHEET 5 1L 5 LYS L 108 ILE L 109 -1 SHEET 1 1M 5 ILE M 51 PHE M 56 0 SHEET 2 1M 5 THR M 70 ILE M 76 1 SHEET 3 1M 5 ASP M 86 SER M 92 -1 SHEET 4 1M 5 LEU M 95 THR M 99 1 SHEET 5 1M 5 LYS M 108 ILE M 109 -1 TURN 1 1L PRO L 21 TYR L 24 TURN 2 2L ALA L 46 LYS L 49 TURN 3 3L ASN L 58 GLY L 61 TURN 4 4L LYS L 66 ARG L 69 TURN 5 5L SER L 91 TRP L 94 TURN 6 1M PRO M 21 TYR M 24 TURN 7 2M ALA M 46 LYS M 49 TURN 8 3M ASN M 58 GLY M 61 TURN 9 4M LYS M 66 ARG M 69 TURN 10 5M SER M 91 TRP M 94 CRYST1 39.866 54.286 29.607 107.77 89.05 96.37 P 1 2 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 0.025084 0.002800 0.000461 0.00000 SCALE2 0.000000 0.018535 0.005942 0.00000 SCALE3 0.000000 0.000000 0.035474 0.00000 ATOM 1 O3' DC A 1 18.898 11.249 21.792 1.00 21.71 O ATOM 2 P DG A 2 19.169 12.885 21.720 1.00 21.09 P ATOM 3 N9 DG A 2 15.039 15.332 20.608 1.00 15.34 N ATOM 4 C8 DG A 2 14.841 13.969 20.874 1.00 14.54 C ATOM 5 N7 DG A 2 13.680 13.727 21.404 1.00 13.93 N ATOM 6 C5 DG A 2 13.084 15.021 21.533 1.00 15.41 C ATOM 7 C6 DG A 2 11.772 15.405 21.959 1.00 15.34 C ATOM 8 O6 DG A 2 10.883 14.703 22.461 1.00 15.87 O ATOM 9 N1 DG A 2 11.544 16.765 21.749 1.00 13.39 N ATOM 10 C2 DG A 2 12.508 17.685 21.471 1.00 15.14 C ATOM 11 N2 DG A 2 12.197 18.958 21.665 1.00 14.78 N ATOM 12 N3 DG A 2 13.710 17.355 21.020 1.00 13.35 N ATOM 13 C4 DG A 2 13.936 15.999 21.080 1.00 15.88 C ATOM 14 OP1 DG A 2 20.521 13.087 21.153 1.00 22.41 O ATOM 15 OP2 DG A 2 18.837 13.497 23.015 1.00 22.59 O ATOM 16 O5' DG A 2 18.058 13.313 20.627 1.00 20.38 O ATOM 17 C5' DG A 2 18.420 13.489 19.255 1.00 17.65 C ATOM 18 C4' DG A 2 18.001 14.922 18.854 1.00 17.48 C ATOM 19 O4' DG A 2 16.594 14.991 18.860 1.00 16.87 O ATOM 20 C3' DG A 2 18.438 16.108 19.850 1.00 16.15 C ATOM 21 O3' DG A 2 18.600 17.357 19.158 1.00 11.94 O ATOM 22 C2' DG A 2 17.240 16.315 20.722 1.00 16.98 C ATOM 23 C1' DG A 2 16.090 15.954 19.825 1.00 17.25 C ATOM 24 P DA A 3 19.656 17.371 18.011 1.00 11.60 P ATOM 25 N9 DA A 3 20.830 23.533 17.316 1.00 9.42 N ATOM 26 C8 DA A 3 20.534 24.181 16.150 1.00 8.43 C ATOM 27 N7 DA A 3 19.496 24.993 16.296 1.00 10.19 N ATOM 28 C5 DA A 3 19.136 24.924 17.610 1.00 9.34 C ATOM 29 C6 DA A 3 18.141 25.596 18.350 1.00 10.23 C ATOM 30 N6 DA A 3 17.311 26.474 17.825 1.00 11.69 N ATOM 31 N1 DA A 3 17.990 25.228 19.599 1.00 11.31 N ATOM 32 C2 DA A 3 18.816 24.328 20.133 1.00 12.99 C ATOM 33 N3 DA A 3 19.769 23.590 19.539 1.00 11.91 N ATOM 34 C4 DA A 3 19.887 23.974 18.253 1.00 11.01 C ATOM 35 OP1 DA A 3 18.978 17.325 16.710 1.00 11.94 O ATOM 36 OP2 DA A 3 20.752 16.452 18.359 1.00 13.75 O ATOM 37 O5' DA A 3 20.091 18.901 18.195 1.00 12.78 O ATOM 38 C5' DA A 3 21.222 19.369 18.924 1.00 9.72 C ATOM 39 C4' DA A 3 22.037 20.187 17.950 1.00 7.17 C ATOM 40 O4' DA A 3 21.162 21.157 17.291 1.00 10.14 O ATOM 41 C3' DA A 3 23.201 20.945 18.674 1.00 9.02 C ATOM 42 O3' DA A 3 24.327 21.115 17.777 1.00 11.57 O ATOM 43 C2' DA A 3 22.518 22.316 18.793 1.00 9.24 C ATOM 44 C1' DA A 3 21.814 22.454 17.457 1.00 11.24 C ATOM 45 P DC A 4 25.579 20.100 17.812 1.00 11.48 P ATOM 46 N1 DC A 4 23.432 22.635 22.496 1.00 22.26 N ATOM 47 C2 DC A 4 22.647 23.779 22.766 1.00 22.39 C ATOM 48 O2 DC A 4 23.144 24.890 22.846 1.00 21.54 O ATOM 49 N3 DC A 4 21.327 23.639 22.935 1.00 22.89 N ATOM 50 C4 DC A 4 20.733 22.465 22.760 1.00 21.41 C ATOM 51 N4 DC A 4 19.426 22.379 22.963 1.00 22.83 N ATOM 52 C5 DC A 4 21.496 21.292 22.425 1.00 22.99 C ATOM 53 C6 DC A 4 22.827 21.430 22.261 1.00 21.99 C ATOM 54 OP1 DC A 4 26.430 20.461 16.640 1.00 13.00 O ATOM 55 OP2 DC A 4 25.143 18.681 17.963 1.00 13.33 O ATOM 56 O5' DC A 4 26.260 20.488 19.222 1.00 14.98 O ATOM 57 C5' DC A 4 27.029 21.701 19.496 1.00 15.89 C ATOM 58 C4' DC A 4 26.653 22.265 20.860 1.00 18.65 C ATOM 59 O4' DC A 4 25.312 22.682 20.878 1.00 18.89 O ATOM 60 C3' DC A 4 26.660 21.222 21.953 1.00 20.51 C ATOM 61 O3' DC A 4 28.029 21.011 22.372 1.00 20.08 O ATOM 62 C2' DC A 4 25.780 21.836 23.016 1.00 20.06 C ATOM 63 C1' DC A 4 24.916 22.813 22.276 1.00 20.89 C TER 64 DC A 4 ATOM 65 N VAL L 3 25.785 12.054 -2.343 1.00 27.61 N ATOM 66 CA VAL L 3 25.222 12.549 -1.081 1.00 26.01 C ATOM 67 C VAL L 3 23.814 13.105 -1.307 1.00 24.75 C ATOM 68 O VAL L 3 23.594 13.840 -2.284 1.00 25.22 O ATOM 69 CB VAL L 3 26.112 13.633 -0.429 1.00 26.44 C ATOM 70 CG1 VAL L 3 25.970 14.990 -1.104 1.00 27.16 C ATOM 71 CG2 VAL L 3 25.795 13.799 1.043 1.00 27.92 C ATOM 72 N ILE L 4 22.903 12.745 -0.423 1.00 22.45 N ATOM 73 CA ILE L 4 21.526 13.253 -0.515 1.00 21.15 C ATOM 74 C ILE L 4 21.188 13.755 0.885 1.00 19.52 C ATOM 75 O ILE L 4 21.169 12.941 1.819 1.00 17.94 O ATOM 76 CB ILE L 4 20.507 12.248 -1.050 1.00 23.76 C ATOM 77 CG1 ILE L 4 19.084 12.722 -0.725 1.00 23.49 C ATOM 78 CG2 ILE L 4 20.768 10.847 -0.511 1.00 25.04 C ATOM 79 CD1 ILE L 4 18.229 11.613 -0.148 1.00 26.40 C ATOM 80 N ASN L 5 20.984 15.064 0.995 1.00 18.21 N ATOM 81 CA ASN L 5 20.687 15.642 2.305 1.00 16.30 C ATOM 82 C ASN L 5 19.746 16.839 2.273 1.00 16.32 C ATOM 83 O ASN L 5 19.809 17.646 3.211 1.00 16.59 O ATOM 84 CB ASN L 5 22.008 16.035 2.969 1.00 16.77 C ATOM 85 CG ASN L 5 22.721 17.201 2.313 1.00 18.74 C ATOM 86 OD1 ASN L 5 22.464 17.520 1.148 1.00 20.77 O ATOM 87 ND2 ASN L 5 23.628 17.856 3.024 1.00 20.07 N ATOM 88 N THR L 6 18.941 16.945 1.232 1.00 15.82 N ATOM 89 CA THR L 6 17.975 18.041 1.121 1.00 14.80 C ATOM 90 C THR L 6 16.628 17.486 1.588 1.00 13.81 C ATOM 91 O THR L 6 16.463 16.252 1.566 1.00 13.26 O ATOM 92 CB THR L 6 17.801 18.597 -0.292 1.00 16.17 C ATOM 93 OG1 THR L 6 17.297 17.557 -1.150 1.00 17.85 O ATOM 94 CG2 THR L 6 19.112 19.123 -0.847 1.00 17.54 C ATOM 95 N PHE L 7 15.707 18.348 1.959 1.00 11.66 N ATOM 96 CA PHE L 7 14.399 17.920 2.424 1.00 11.35 C ATOM 97 C PHE L 7 13.684 16.999 1.436 1.00 10.45 C ATOM 98 O PHE L 7 13.286 15.909 1.849 1.00 10.15 O ATOM 99 CB PHE L 7 13.486 19.105 2.763 1.00 10.98 C ATOM 100 CG PHE L 7 13.809 19.764 4.078 1.00 11.56 C ATOM 101 CD1 PHE L 7 13.561 19.100 5.269 1.00 10.11 C ATOM 102 CD2 PHE L 7 14.332 21.048 4.104 1.00 12.42 C ATOM 103 CE1 PHE L 7 13.858 19.724 6.486 1.00 12.05 C ATOM 104 CE2 PHE L 7 14.614 21.681 5.304 1.00 12.27 C ATOM 105 CZ PHE L 7 14.379 21.011 6.495 1.00 11.35 C ATOM 106 N ASP L 8 13.522 17.443 0.203 1.00 11.11 N ATOM 107 CA ASP L 8 12.831 16.656 -0.811 1.00 12.19 C ATOM 108 C ASP L 8 13.557 15.360 -1.185 1.00 12.27 C ATOM 109 O ASP L 8 12.918 14.307 -1.350 1.00 12.30 O ATOM 110 CB ASP L 8 12.617 17.491 -2.078 1.00 13.55 C ATOM 111 CG ASP L 8 11.569 18.566 -1.827 1.00 16.44 C ATOM 112 OD1 ASP L 8 10.417 18.236 -1.473 1.00 18.30 O ATOM 113 OD2 ASP L 8 11.944 19.732 -2.009 1.00 18.21 O ATOM 114 N GLY L 9 14.872 15.520 -1.306 1.00 11.87 N ATOM 115 CA GLY L 9 15.741 14.395 -1.661 1.00 12.69 C ATOM 116 C GLY L 9 15.620 13.272 -0.636 1.00 12.31 C ATOM 117 O GLY L 9 15.419 12.109 -1.018 1.00 12.59 O ATOM 118 N VAL L 10 15.737 13.643 0.636 1.00 12.18 N ATOM 119 CA VAL L 10 15.653 12.650 1.716 1.00 11.61 C ATOM 120 C VAL L 10 14.226 12.151 1.879 1.00 12.17 C ATOM 121 O VAL L 10 14.043 10.947 2.108 1.00 11.48 O ATOM 122 CB VAL L 10 16.246 13.172 3.030 1.00 11.73 C ATOM 123 CG1 VAL L 10 16.032 12.186 4.176 1.00 10.96 C ATOM 124 CG2 VAL L 10 17.744 13.450 2.845 1.00 10.89 C ATOM 125 N ALA L 11 13.240 13.035 1.771 1.00 12.21 N ATOM 126 CA ALA L 11 11.830 12.639 1.874 1.00 12.80 C ATOM 127 C ALA L 11 11.486 11.615 0.773 1.00 12.96 C ATOM 128 O ALA L 11 10.781 10.609 1.010 1.00 13.57 O ATOM 129 CB ALA L 11 10.915 13.855 1.741 1.00 12.30 C ATOM 130 N ASP L 12 11.991 11.863 -0.434 1.00 13.13 N ATOM 131 CA ASP L 12 11.730 10.941 -1.554 1.00 13.99 C ATOM 132 C ASP L 12 12.393 9.587 -1.323 1.00 13.63 C ATOM 133 O ASP L 12 11.778 8.535 -1.529 1.00 15.03 O ATOM 134 CB ASP L 12 12.195 11.537 -2.886 1.00 16.78 C ATOM 135 CG ASP L 12 11.239 12.615 -3.375 1.00 20.26 C ATOM 136 OD1 ASP L 12 10.080 12.641 -2.890 1.00 22.29 O ATOM 137 OD2 ASP L 12 11.634 13.418 -4.244 1.00 20.97 O ATOM 138 N TYR L 13 13.650 9.625 -0.910 1.00 13.35 N ATOM 139 CA TYR L 13 14.418 8.402 -0.636 1.00 12.55 C ATOM 140 C TYR L 13 13.734 7.602 0.455 1.00 12.84 C ATOM 141 O TYR L 13 13.556 6.392 0.338 1.00 12.30 O ATOM 142 CB TYR L 13 15.872 8.724 -0.256 1.00 12.40 C ATOM 143 CG TYR L 13 16.754 7.484 -0.257 1.00 12.02 C ATOM 144 CD1 TYR L 13 16.828 6.656 0.861 1.00 11.92 C ATOM 145 CD2 TYR L 13 17.511 7.165 -1.383 1.00 12.77 C ATOM 146 CE1 TYR L 13 17.620 5.509 0.829 1.00 13.31 C ATOM 147 CE2 TYR L 13 18.314 6.029 -1.422 1.00 12.48 C ATOM 148 CZ TYR L 13 18.360 5.217 -0.306 1.00 13.54 C ATOM 149 OH TYR L 13 19.164 4.097 -0.303 1.00 12.94 O ATOM 150 N LEU L 14 13.340 8.269 1.530 1.00 12.86 N ATOM 151 CA LEU L 14 12.655 7.614 2.651 1.00 13.17 C ATOM 152 C LEU L 14 11.346 6.967 2.203 1.00 13.49 C ATOM 153 O LEU L 14 11.054 5.835 2.619 1.00 13.85 O ATOM 154 CB LEU L 14 12.396 8.622 3.768 1.00 13.55 C ATOM 155 CG LEU L 14 13.532 9.010 4.716 1.00 13.50 C ATOM 156 CD1 LEU L 14 13.127 10.226 5.536 1.00 12.69 C ATOM 157 CD2 LEU L 14 13.860 7.830 5.614 1.00 14.56 C ATOM 158 N GLN L 15 10.568 7.678 1.408 1.00 13.69 N ATOM 159 CA GLN L 15 9.305 7.134 0.911 1.00 16.48 C ATOM 160 C GLN L 15 9.516 5.890 0.019 1.00 16.58 C ATOM 161 O GLN L 15 8.790 4.892 0.129 1.00 16.98 O ATOM 162 CB GLN L 15 8.529 8.204 0.140 1.00 20.60 C ATOM 163 CG GLN L 15 7.971 9.335 0.985 1.00 27.62 C ATOM 164 CD GLN L 15 6.742 8.975 1.788 1.00 32.17 C ATOM 165 OE1 GLN L 15 5.820 9.773 2.001 1.00 35.21 O ATOM 166 NE2 GLN L 15 6.678 7.735 2.277 1.00 33.97 N ATOM 167 N THR L 16 10.514 5.945 -0.854 1.00 15.84 N ATOM 168 CA THR L 16 10.854 4.850 -1.757 1.00 14.55 C ATOM 169 C THR L 16 11.497 3.646 -1.091 1.00 14.04 C ATOM 170 O THR L 16 11.045 2.514 -1.285 1.00 14.16 O ATOM 171 CB THR L 16 11.802 5.346 -2.867 1.00 13.87 C ATOM 172 OG1 THR L 16 11.232 6.517 -3.464 1.00 13.56 O ATOM 173 CG2 THR L 16 11.991 4.321 -3.985 1.00 13.01 C ATOM 174 N TYR L 17 12.531 3.863 -0.297 1.00 12.51 N ATOM 175 CA TYR L 17 13.243 2.744 0.327 1.00 11.73 C ATOM 176 C TYR L 17 13.046 2.462 1.796 1.00 11.81 C ATOM 177 O TYR L 17 13.579 1.444 2.270 1.00 11.47 O ATOM 178 CB TYR L 17 14.738 2.925 -0.008 1.00 11.88 C ATOM 179 CG TYR L 17 15.021 3.011 -1.493 1.00 12.72 C ATOM 180 CD1 TYR L 17 14.839 1.892 -2.321 1.00 11.79 C ATOM 181 CD2 TYR L 17 15.489 4.186 -2.076 1.00 12.64 C ATOM 182 CE1 TYR L 17 15.115 1.945 -3.664 1.00 11.52 C ATOM 183 CE2 TYR L 17 15.768 4.256 -3.431 1.00 13.54 C ATOM 184 CZ TYR L 17 15.576 3.121 -4.225 1.00 13.72 C ATOM 185 OH TYR L 17 15.841 3.169 -5.586 1.00 15.71 O ATOM 186 N HIS L 18 12.301 3.313 2.504 1.00 10.87 N ATOM 187 CA HIS L 18 12.009 3.115 3.918 1.00 11.68 C ATOM 188 C HIS L 18 13.251 3.012 4.792 1.00 10.97 C ATOM 189 O HIS L 18 13.268 2.238 5.746 1.00 11.29 O ATOM 190 CB HIS L 18 11.100 1.887 4.093 1.00 12.97 C ATOM 191 CG HIS L 18 9.683 2.173 3.671 1.00 17.90 C ATOM 192 ND1 HIS L 18 8.646 1.284 3.881 1.00 19.63 N ATOM 193 CD2 HIS L 18 9.140 3.270 3.077 1.00 17.35 C ATOM 194 CE1 HIS L 18 7.528 1.812 3.414 1.00 20.48 C ATOM 195 NE2 HIS L 18 7.801 3.010 2.922 1.00 19.42 N ATOM 196 N LYS L 19 14.241 3.808 4.447 1.00 11.28 N ATOM 197 CA LYS L 19 15.502 3.884 5.168 1.00 11.80 C ATOM 198 C LYS L 19 16.179 5.183 4.748 1.00 10.93 C ATOM 199 O LYS L 19 15.799 5.759 3.726 1.00 11.05 O ATOM 200 CB LYS L 19 16.443 2.716 4.846 1.00 13.63 C ATOM 201 CG LYS L 19 16.920 2.719 3.395 1.00 14.80 C ATOM 202 CD LYS L 19 17.391 1.328 2.993 1.00 18.54 C ATOM 203 CE LYS L 19 18.073 1.375 1.636 1.00 20.06 C ATOM 204 NZ LYS L 19 19.490 1.834 1.712 1.00 21.95 N ATOM 205 N LEU L 20 17.154 5.601 5.531 1.00 11.22 N ATOM 206 CA LEU L 20 17.881 6.832 5.174 1.00 12.07 C ATOM 207 C LEU L 20 18.951 6.452 4.156 1.00 12.75 C ATOM 208 O LEU L 20 19.411 5.295 4.200 1.00 14.26 O ATOM 209 CB LEU L 20 18.601 7.406 6.385 1.00 10.47 C ATOM 210 CG LEU L 20 17.769 8.079 7.475 1.00 9.97 C ATOM 211 CD1 LEU L 20 18.635 8.282 8.713 1.00 10.43 C ATOM 212 CD2 LEU L 20 17.196 9.389 6.968 1.00 10.41 C ATOM 213 N PRO L 21 19.343 7.358 3.280 1.00 13.82 N ATOM 214 CA PRO L 21 20.398 7.058 2.312 1.00 13.93 C ATOM 215 C PRO L 21 21.722 6.847 3.053 1.00 14.76 C ATOM 216 O PRO L 21 21.894 7.210 4.217 1.00 14.10 O ATOM 217 CB PRO L 21 20.334 8.241 1.366 1.00 14.92 C ATOM 218 CG PRO L 21 19.759 9.379 2.167 1.00 15.13 C ATOM 219 CD PRO L 21 18.791 8.722 3.157 1.00 14.06 C ATOM 220 N ASP L 22 22.678 6.210 2.397 1.00 15.23 N ATOM 221 CA ASP L 22 23.992 5.837 2.884 1.00 15.67 C ATOM 222 C ASP L 22 24.840 6.903 3.537 1.00 15.45 C ATOM 223 O ASP L 22 25.724 6.530 4.321 1.00 16.53 O ATOM 224 CB ASP L 22 24.795 5.203 1.724 1.00 17.18 C ATOM 225 N ASN L 23 24.600 8.176 3.273 1.00 14.96 N ATOM 226 CA ASN L 23 25.416 9.224 3.894 1.00 13.77 C ATOM 227 C ASN L 23 25.023 9.593 5.321 1.00 13.37 C ATOM 228 O ASN L 23 25.567 10.570 5.861 1.00 13.16 O ATOM 229 CB ASN L 23 25.411 10.467 3.005 1.00 14.18 C ATOM 230 CG ASN L 23 23.994 10.928 2.728 1.00 14.18 C ATOM 231 OD1 ASN L 23 23.260 10.221 2.039 1.00 14.75 O ATOM 232 ND2 ASN L 23 23.646 12.098 3.274 1.00 14.56 N ATOM 233 N TYR L 24 24.130 8.819 5.927 1.00 12.03 N ATOM 234 CA TYR L 24 23.693 9.067 7.297 1.00 11.50 C ATOM 235 C TYR L 24 24.258 8.076 8.306 1.00 11.30 C ATOM 236 O TYR L 24 24.323 6.863 8.074 1.00 11.30 O ATOM 237 CB TYR L 24 22.143 9.014 7.426 1.00 10.98 C ATOM 238 CG TYR L 24 21.559 10.301 6.881 1.00 10.88 C ATOM 239 CD1 TYR L 24 21.408 11.391 7.742 1.00 10.40 C ATOM 240 CD2 TYR L 24 21.235 10.441 5.536 1.00 11.95 C ATOM 241 CE1 TYR L 24 20.906 12.575 7.246 1.00 10.58 C ATOM 242 CE2 TYR L 24 20.747 11.640 5.042 1.00 12.32 C ATOM 243 CZ TYR L 24 20.585 12.704 5.922 1.00 11.64 C ATOM 244 OH TYR L 24 20.090 13.901 5.459 1.00 11.51 O ATOM 245 N ILE L 25 24.666 8.594 9.433 1.00 10.46 N ATOM 246 CA ILE L 25 25.157 7.756 10.529 1.00 11.50 C ATOM 247 C ILE L 25 24.481 8.263 11.803 1.00 11.56 C ATOM 248 O ILE L 25 24.174 9.467 11.906 1.00 11.81 O ATOM 249 CB ILE L 25 26.683 7.741 10.696 1.00 11.75 C ATOM 250 CG1 ILE L 25 27.192 9.183 10.870 1.00 11.62 C ATOM 251 CG2 ILE L 25 27.319 7.016 9.524 1.00 12.25 C ATOM 252 CD1 ILE L 25 28.664 9.246 11.186 1.00 12.22 C ATOM 253 N THR L 26 24.242 7.353 12.731 1.00 11.43 N ATOM 254 CA THR L 26 23.613 7.722 14.003 1.00 11.24 C ATOM 255 C THR L 26 24.606 8.486 14.892 1.00 11.97 C ATOM 256 O THR L 26 25.804 8.532 14.583 1.00 11.36 O ATOM 257 CB THR L 26 23.150 6.487 14.779 1.00 9.87 C ATOM 258 OG1 THR L 26 24.297 5.735 15.189 1.00 10.62 O ATOM 259 CG2 THR L 26 22.268 5.607 13.900 1.00 8.79 C ATOM 260 N LYS L 27 24.092 9.055 15.976 1.00 12.51 N ATOM 261 CA LYS L 27 24.969 9.774 16.905 1.00 12.83 C ATOM 262 C LYS L 27 26.026 8.833 17.480 1.00 12.34 C ATOM 263 O LYS L 27 27.199 9.196 17.586 1.00 12.49 O ATOM 264 CB LYS L 27 24.174 10.415 18.045 1.00 13.50 C ATOM 265 CG LYS L 27 23.658 11.793 17.644 1.00 14.83 C ATOM 266 CD LYS L 27 23.070 12.480 18.871 1.00 15.36 C ATOM 267 CE LYS L 27 22.585 13.871 18.473 1.00 16.18 C ATOM 268 NZ LYS L 27 22.267 14.632 19.731 1.00 16.72 N ATOM 269 N SER L 28 25.582 7.644 17.853 1.00 12.52 N ATOM 270 CA SER L 28 26.485 6.642 18.417 1.00 12.50 C ATOM 271 C SER L 28 27.607 6.275 17.450 1.00 12.45 C ATOM 272 O SER L 28 28.777 6.109 17.832 1.00 12.94 O ATOM 273 CB ASER L 28 25.726 5.388 18.868 0.50 12.29 C ATOM 274 CB BSER L 28 25.681 5.394 18.816 0.50 12.32 C ATOM 275 OG ASER L 28 24.867 4.893 17.871 0.50 16.74 O ATOM 276 OG BSER L 28 26.509 4.337 19.297 0.50 17.74 O ATOM 277 N GLU L 29 27.226 6.153 16.184 1.00 11.86 N ATOM 278 CA GLU L 29 28.196 5.822 15.135 1.00 11.37 C ATOM 279 C GLU L 29 29.166 6.993 14.964 1.00 11.63 C ATOM 280 O GLU L 29 30.380 6.782 14.876 1.00 10.63 O ATOM 281 CB GLU L 29 27.512 5.445 13.824 1.00 11.12 C ATOM 282 CG GLU L 29 26.778 4.110 13.915 1.00 10.73 C ATOM 283 CD GLU L 29 25.908 3.837 12.702 1.00 14.41 C ATOM 284 OE1 GLU L 29 25.474 4.775 12.004 1.00 13.89 O ATOM 285 OE2 GLU L 29 25.660 2.648 12.421 1.00 14.24 O ATOM 286 N ALA L 30 28.614 8.204 14.928 1.00 11.71 N ATOM 287 CA ALA L 30 29.445 9.409 14.787 1.00 12.62 C ATOM 288 C ALA L 30 30.413 9.526 15.969 1.00 12.51 C ATOM 289 O ALA L 30 31.596 9.827 15.765 1.00 13.46 O ATOM 290 CB ALA L 30 28.610 10.680 14.672 1.00 11.00 C ATOM 291 N GLN L 31 29.891 9.288 17.163 1.00 12.87 N ATOM 292 CA GLN L 31 30.700 9.359 18.371 1.00 14.45 C ATOM 293 C GLN L 31 31.835 8.330 18.336 1.00 14.28 C ATOM 294 O GLN L 31 32.947 8.597 18.821 1.00 14.41 O ATOM 295 CB GLN L 31 29.824 9.151 19.608 1.00 17.39 C ATOM 296 CG GLN L 31 28.997 10.379 19.964 1.00 22.31 C ATOM 297 CD GLN L 31 27.868 10.079 20.927 1.00 25.67 C ATOM 298 OE1 GLN L 31 27.786 8.981 21.486 1.00 29.40 O ATOM 299 NE2 GLN L 31 26.989 11.061 21.117 1.00 27.37 N ATOM 300 N ALA L 32 31.527 7.177 17.767 1.00 13.59 N ATOM 301 CA ALA L 32 32.496 6.086 17.648 1.00 13.95 C ATOM 302 C ALA L 32 33.621 6.511 16.709 1.00 14.41 C ATOM 303 O ALA L 32 34.756 6.059 16.866 1.00 15.20 O ATOM 304 CB ALA L 32 31.853 4.819 17.095 1.00 12.62 C ATOM 305 N LEU L 33 33.274 7.364 15.752 1.00 14.00 N ATOM 306 CA LEU L 33 34.262 7.833 14.784 1.00 14.98 C ATOM 307 C LEU L 33 35.134 8.982 15.276 1.00 15.39 C ATOM 308 O LEU L 33 36.074 9.359 14.566 1.00 17.28 O ATOM 309 CB LEU L 33 33.552 8.232 13.485 1.00 15.61 C ATOM 310 CG LEU L 33 32.870 7.088 12.705 1.00 16.37 C ATOM 311 CD1 LEU L 33 32.345 7.638 11.401 1.00 15.38 C ATOM 312 CD2 LEU L 33 33.832 5.922 12.497 1.00 16.63 C ATOM 313 N GLY L 34 34.811 9.522 16.436 1.00 15.86 N ATOM 314 CA GLY L 34 35.566 10.624 17.012 1.00 16.39 C ATOM 315 C GLY L 34 34.850 11.964 17.011 1.00 16.50 C ATOM 316 O GLY L 34 35.502 12.976 17.321 1.00 15.77 O ATOM 317 N TRP L 35 33.565 11.952 16.684 1.00 15.89 N ATOM 318 CA TRP L 35 32.786 13.194 16.676 1.00 15.73 C ATOM 319 C TRP L 35 32.568 13.705 18.097 1.00 15.70 C ATOM 320 O TRP L 35 32.170 12.926 18.960 1.00 15.24 O ATOM 321 CB TRP L 35 31.423 13.022 15.986 1.00 15.49 C ATOM 322 CG TRP L 35 30.487 14.185 16.163 1.00 15.27 C ATOM 323 CD1 TRP L 35 30.675 15.471 15.726 1.00 16.36 C ATOM 324 CD2 TRP L 35 29.224 14.178 16.833 1.00 15.37 C ATOM 325 NE1 TRP L 35 29.596 16.256 16.084 1.00 16.61 N ATOM 326 CE2 TRP L 35 28.691 15.479 16.757 1.00 16.45 C ATOM 327 CE3 TRP L 35 28.490 13.183 17.493 1.00 15.92 C ATOM 328 CZ2 TRP L 35 27.460 15.817 17.322 1.00 16.87 C ATOM 329 CZ3 TRP L 35 27.266 13.518 18.049 1.00 18.28 C ATOM 330 CH2 TRP L 35 26.759 14.829 17.963 1.00 17.82 C ATOM 331 N VAL L 36 32.849 15.023 18.229 1.00 16.49 N ATOM 332 CA VAL L 36 32.625 15.607 19.595 1.00 16.57 C ATOM 333 C VAL L 36 31.777 16.849 19.410 1.00 15.94 C ATOM 334 O VAL L 36 32.314 17.746 18.746 1.00 16.22 O ATOM 335 CB AVAL L 36 33.986 15.878 20.275 0.50 17.58 C ATOM 336 CB BVAL L 36 33.879 15.770 20.423 0.50 17.58 C ATOM 337 CG1AVAL L 36 33.700 16.413 21.717 0.50 15.91 C ATOM 338 CG1BVAL L 36 34.551 14.436 20.766 0.50 15.85 C ATOM 339 CG2AVAL L 36 34.731 14.556 20.535 0.50 20.33 C ATOM 340 CG2BVAL L 36 34.863 16.627 19.660 0.50 20.42 C ATOM 341 N ALA L 37 30.532 16.829 19.823 1.00 14.94 N ATOM 342 CA ALA L 37 29.596 17.924 19.600 1.00 14.70 C ATOM 343 C ALA L 37 30.220 19.301 19.828 1.00 15.47 C ATOM 344 O ALA L 37 30.217 20.133 18.910 1.00 15.36 O ATOM 345 CB ALA L 37 28.387 17.723 20.492 1.00 13.48 C ATOM 346 N SER L 38 30.760 19.520 21.017 1.00 16.24 N ATOM 347 CA SER L 38 31.350 20.827 21.332 1.00 16.76 C ATOM 348 C SER L 38 32.503 21.208 20.414 1.00 16.86 C ATOM 349 O SER L 38 32.906 22.380 20.452 1.00 15.28 O ATOM 350 CB SER L 38 31.802 20.905 22.791 1.00 17.98 C ATOM 351 OG SER L 38 32.772 19.940 23.084 1.00 20.02 O ATOM 352 N LYS L 39 32.993 20.264 19.616 1.00 16.54 N ATOM 353 CA LYS L 39 34.112 20.611 18.728 1.00 16.72 C ATOM 354 C LYS L 39 33.690 20.870 17.296 1.00 15.87 C ATOM 355 O LYS L 39 34.508 21.342 16.492 1.00 16.68 O ATOM 356 CB LYS L 39 35.180 19.509 18.757 1.00 18.26 C ATOM 357 CG LYS L 39 35.751 19.238 20.145 1.00 20.05 C ATOM 358 N GLY L 40 32.450 20.543 16.964 1.00 14.96 N ATOM 359 CA GLY L 40 31.909 20.725 15.622 1.00 14.46 C ATOM 360 C GLY L 40 32.799 20.106 14.556 1.00 14.25 C ATOM 361 O GLY L 40 32.921 20.644 13.457 1.00 14.26 O ATOM 362 N ASN L 41 33.365 18.957 14.882 1.00 15.31 N ATOM 363 CA ASN L 41 34.270 18.227 14.001 1.00 15.17 C ATOM 364 C ASN L 41 33.692 17.092 13.164 1.00 16.00 C ATOM 365 O ASN L 41 34.467 16.314 12.569 1.00 14.70 O ATOM 366 CB ASN L 41 35.437 17.712 14.877 1.00 15.17 C ATOM 367 CG ASN L 41 35.016 16.614 15.841 1.00 16.17 C ATOM 368 OD1 ASN L 41 33.827 16.404 16.105 1.00 16.26 O ATOM 369 ND2 ASN L 41 35.982 15.890 16.400 1.00 16.14 N ATOM 370 N LEU L 42 32.372 17.008 13.049 1.00 15.59 N ATOM 371 CA LEU L 42 31.793 15.930 12.240 1.00 16.41 C ATOM 372 C LEU L 42 32.398 15.763 10.859 1.00 16.96 C ATOM 373 O LEU L 42 32.773 14.630 10.504 1.00 16.65 O ATOM 374 CB LEU L 42 30.272 16.105 12.098 1.00 16.62 C ATOM 375 CG LEU L 42 29.569 14.883 11.480 1.00 17.72 C ATOM 376 CD1 LEU L 42 29.829 13.646 12.338 1.00 16.01 C ATOM 377 CD2 LEU L 42 28.080 15.150 11.344 1.00 16.09 C ATOM 378 N ALA L 43 32.484 16.823 10.069 1.00 17.66 N ATOM 379 CA ALA L 43 33.029 16.696 8.719 1.00 19.63 C ATOM 380 C ALA L 43 34.481 16.252 8.663 1.00 21.16 C ATOM 381 O ALA L 43 34.973 15.820 7.602 1.00 20.86 O ATOM 382 CB ALA L 43 32.882 18.020 7.971 1.00 19.32 C ATOM 383 N ASP L 44 35.148 16.360 9.796 1.00 23.36 N ATOM 384 CA ASP L 44 36.556 15.954 9.801 1.00 25.08 C ATOM 385 C ASP L 44 36.691 14.492 10.196 1.00 24.48 C ATOM 386 O ASP L 44 37.614 13.839 9.687 1.00 25.92 O ATOM 387 CB ASP L 44 37.381 16.881 10.696 1.00 26.95 C ATOM 388 CG ASP L 44 37.004 16.656 12.148 1.00 30.87 C ATOM 389 N VAL L 45 35.821 14.032 11.079 1.00 24.25 N ATOM 390 CA VAL L 45 35.871 12.624 11.491 1.00 23.21 C ATOM 391 C VAL L 45 35.070 11.725 10.539 1.00 23.23 C ATOM 392 O VAL L 45 35.377 10.521 10.432 1.00 23.75 O ATOM 393 CB VAL L 45 35.366 12.420 12.929 1.00 22.79 C ATOM 394 CG1 VAL L 45 36.255 13.187 13.904 1.00 23.15 C ATOM 395 CG2 VAL L 45 33.905 12.799 13.062 1.00 21.27 C ATOM 396 N ALA L 46 34.071 12.267 9.861 1.00 21.49 N ATOM 397 CA ALA L 46 33.197 11.533 8.932 1.00 20.73 C ATOM 398 C ALA L 46 32.851 12.352 7.695 1.00 20.76 C ATOM 399 O ALA L 46 31.724 12.840 7.532 1.00 19.30 O ATOM 400 CB ALA L 46 31.921 11.107 9.657 1.00 19.43 C ATOM 401 N PRO L 47 33.812 12.480 6.784 1.00 20.85 N ATOM 402 CA PRO L 47 33.629 13.254 5.567 1.00 20.47 C ATOM 403 C PRO L 47 32.418 12.838 4.754 1.00 19.60 C ATOM 404 O PRO L 47 32.264 11.652 4.457 1.00 20.00 O ATOM 405 CB PRO L 47 34.942 13.062 4.802 1.00 21.03 C ATOM 406 CG PRO L 47 35.941 12.724 5.871 1.00 21.66 C ATOM 407 CD PRO L 47 35.169 11.904 6.893 1.00 21.71 C ATOM 408 N GLY L 48 31.583 13.807 4.425 1.00 18.02 N ATOM 409 CA GLY L 48 30.391 13.615 3.629 1.00 17.33 C ATOM 410 C GLY L 48 29.228 12.919 4.306 1.00 15.74 C ATOM 411 O GLY L 48 28.279 12.547 3.613 1.00 16.23 O ATOM 412 N LYS L 49 29.335 12.771 5.605 1.00 15.30 N ATOM 413 CA LYS L 49 28.313 12.139 6.420 1.00 15.63 C ATOM 414 C LYS L 49 27.496 13.166 7.202 1.00 15.88 C ATOM 415 O LYS L 49 27.970 14.273 7.503 1.00 16.23 O ATOM 416 CB LYS L 49 28.973 11.203 7.442 1.00 16.20 C ATOM 417 CG LYS L 49 29.773 10.082 6.782 1.00 19.05 C ATOM 418 CD LYS L 49 28.871 9.235 5.900 1.00 21.55 C ATOM 419 CE LYS L 49 27.822 8.523 6.751 1.00 25.76 C ATOM 420 NZ LYS L 49 27.302 9.365 7.855 1.00 29.55 N ATOM 421 N SER L 50 26.263 12.753 7.496 1.00 14.74 N ATOM 422 CA SER L 50 25.350 13.586 8.274 1.00 12.95 C ATOM 423 C SER L 50 24.794 12.719 9.385 1.00 12.00 C ATOM 424 O SER L 50 24.708 11.509 9.214 1.00 11.66 O ATOM 425 CB SER L 50 24.200 14.135 7.444 1.00 13.56 C ATOM 426 OG SER L 50 24.667 15.109 6.517 1.00 14.63 O ATOM 427 N ILE L 51 24.445 13.321 10.493 1.00 10.43 N ATOM 428 CA ILE L 51 23.862 12.616 11.620 1.00 10.35 C ATOM 429 C ILE L 51 22.387 12.361 11.282 1.00 8.84 C ATOM 430 O ILE L 51 21.694 13.277 10.815 1.00 9.86 O ATOM 431 CB ILE L 51 23.897 13.421 12.931 1.00 11.51 C ATOM 432 CG1 ILE L 51 25.321 13.852 13.277 1.00 14.94 C ATOM 433 CG2 ILE L 51 23.302 12.597 14.069 1.00 9.76 C ATOM 434 CD1 ILE L 51 26.237 12.688 13.595 1.00 17.66 C ATOM 435 N GLY L 52 21.918 11.160 11.532 1.00 8.82 N ATOM 436 CA GLY L 52 20.513 10.839 11.251 1.00 8.85 C ATOM 437 C GLY L 52 20.148 9.445 11.731 1.00 9.88 C ATOM 438 O GLY L 52 21.000 8.561 11.882 1.00 10.14 O ATOM 439 N GLY L 53 18.861 9.256 11.973 1.00 9.59 N ATOM 440 CA GLY L 53 18.369 7.946 12.384 1.00 10.69 C ATOM 441 C GLY L 53 18.071 7.738 13.843 1.00 10.60 C ATOM 442 O GLY L 53 17.600 6.645 14.198 1.00 10.96 O ATOM 443 N ASP L 54 18.305 8.747 14.678 1.00 8.93 N ATOM 444 CA ASP L 54 18.029 8.591 16.108 1.00 8.68 C ATOM 445 C ASP L 54 16.578 8.864 16.477 1.00 8.95 C ATOM 446 O ASP L 54 15.862 9.576 15.770 1.00 8.74 O ATOM 447 CB AASP L 54 18.971 9.475 16.946 0.50 5.93 C ATOM 448 CB BASP L 54 18.979 9.514 16.899 0.50 6.00 C ATOM 449 CG AASP L 54 20.401 8.992 16.832 0.50 4.63 C ATOM 450 CG BASP L 54 18.880 9.303 18.393 0.50 5.46 C ATOM 451 OD1AASP L 54 20.673 7.886 17.328 0.50 6.04 O ATOM 452 OD1BASP L 54 19.562 8.388 18.967 0.50 7.29 O ATOM 453 OD2AASP L 54 21.236 9.722 16.281 0.50 2.69 O ATOM 454 OD2BASP L 54 18.106 10.054 19.074 0.50 4.36 O ATOM 455 N ILE L 55 16.150 8.292 17.592 1.00 9.73 N ATOM 456 CA ILE L 55 14.784 8.458 18.077 1.00 10.63 C ATOM 457 C ILE L 55 14.464 9.887 18.524 1.00 11.20 C ATOM 458 O ILE L 55 15.263 10.582 19.168 1.00 11.39 O ATOM 459 CB ILE L 55 14.516 7.519 19.272 1.00 11.84 C ATOM 460 CG1 ILE L 55 14.607 6.055 18.809 1.00 12.87 C ATOM 461 CG2 ILE L 55 13.162 7.832 19.885 1.00 12.99 C ATOM 462 CD1 ILE L 55 13.316 5.588 18.145 1.00 15.39 C ATOM 463 N PHE L 56 13.273 10.293 18.117 1.00 10.86 N ATOM 464 CA PHE L 56 12.707 11.611 18.472 1.00 10.68 C ATOM 465 C PHE L 56 11.560 11.242 19.427 1.00 11.89 C ATOM 466 O PHE L 56 10.644 10.543 18.961 1.00 12.23 O ATOM 467 CB PHE L 56 12.235 12.381 17.266 1.00 11.76 C ATOM 468 CG PHE L 56 11.587 13.688 17.635 1.00 12.16 C ATOM 469 CD1 PHE L 56 12.388 14.760 17.997 1.00 12.21 C ATOM 470 CD2 PHE L 56 10.207 13.819 17.608 1.00 14.11 C ATOM 471 CE1 PHE L 56 11.794 15.965 18.340 1.00 12.33 C ATOM 472 CE2 PHE L 56 9.619 15.027 17.955 1.00 14.58 C ATOM 473 CZ PHE L 56 10.421 16.099 18.313 1.00 13.88 C ATOM 474 N SER L 57 11.620 11.643 20.683 1.00 11.38 N ATOM 475 CA SER L 57 10.575 11.250 21.636 1.00 12.96 C ATOM 476 C SER L 57 9.254 11.984 21.494 1.00 14.43 C ATOM 477 O SER L 57 8.262 11.475 22.081 1.00 16.83 O ATOM 478 CB ASER L 57 11.117 11.324 23.054 0.50 10.87 C ATOM 479 CB BSER L 57 11.133 11.434 23.060 0.50 10.86 C ATOM 480 OG ASER L 57 12.195 10.438 23.281 0.50 8.79 O ATOM 481 OG BSER L 57 10.194 10.925 24.000 0.50 9.71 O ATOM 482 N ASN L 58 9.159 13.071 20.770 1.00 14.94 N ATOM 483 CA ASN L 58 7.892 13.789 20.606 1.00 15.98 C ATOM 484 C ASN L 58 7.254 14.137 21.945 1.00 16.66 C ATOM 485 O ASN L 58 6.026 14.100 22.089 1.00 16.42 O ATOM 486 CB ASN L 58 6.953 12.912 19.775 1.00 16.21 C ATOM 487 CG ASN L 58 5.791 13.681 19.189 1.00 17.13 C ATOM 488 OD1 ASN L 58 5.890 14.892 18.945 1.00 17.00 O ATOM 489 ND2 ASN L 58 4.701 12.929 18.988 1.00 17.27 N ATOM 490 N ARG L 59 8.067 14.468 22.934 1.00 17.68 N ATOM 491 CA ARG L 59 7.579 14.826 24.274 1.00 19.16 C ATOM 492 C ARG L 59 6.595 15.995 24.285 1.00 19.42 C ATOM 493 O ARG L 59 5.670 16.001 25.119 1.00 19.91 O ATOM 494 CB ARG L 59 8.769 15.111 25.190 1.00 19.79 C ATOM 495 CG ARG L 59 9.668 13.933 25.474 1.00 20.69 C ATOM 496 CD ARG L 59 10.862 14.337 26.342 1.00 22.07 C ATOM 497 NE ARG L 59 11.663 15.388 25.714 1.00 22.66 N ATOM 498 CZ ARG L 59 12.862 15.128 25.181 1.00 21.56 C ATOM 499 NH1 ARG L 59 13.350 13.894 25.222 1.00 21.33 N ATOM 500 NH2 ARG L 59 13.583 16.069 24.592 1.00 21.02 N ATOM 501 N GLU L 60 6.708 16.957 23.386 1.00 20.42 N ATOM 502 CA GLU L 60 5.834 18.125 23.293 1.00 21.61 C ATOM 503 C GLU L 60 4.495 17.787 22.646 1.00 22.06 C ATOM 504 O GLU L 60 3.559 18.574 22.739 1.00 22.32 O ATOM 505 CB GLU L 60 6.410 19.304 22.506 1.00 22.26 C ATOM 506 CG GLU L 60 7.843 19.596 22.904 1.00 23.45 C ATOM 507 CD GLU L 60 8.777 18.503 22.427 1.00 24.68 C ATOM 508 OE1 GLU L 60 8.670 17.315 22.835 1.00 25.61 O ATOM 509 OE2 GLU L 60 9.658 18.812 21.589 1.00 26.11 O ATOM 510 N GLY L 61 4.492 16.632 22.001 1.00 21.70 N ATOM 511 CA GLY L 61 3.277 16.172 21.346 1.00 21.06 C ATOM 512 C GLY L 61 2.940 17.007 20.117 1.00 20.99 C ATOM 513 O GLY L 61 1.771 17.060 19.700 1.00 20.98 O ATOM 514 N LYS L 62 3.946 17.619 19.516 1.00 20.36 N ATOM 515 CA LYS L 62 3.740 18.443 18.329 1.00 20.00 C ATOM 516 C LYS L 62 3.479 17.599 17.083 1.00 20.25 C ATOM 517 O LYS L 62 2.877 18.092 16.115 1.00 20.95 O ATOM 518 CB LYS L 62 4.948 19.350 18.115 1.00 20.44 C ATOM 519 N LEU L 63 3.941 16.351 17.099 1.00 19.92 N ATOM 520 CA LEU L 63 3.711 15.458 15.946 1.00 19.77 C ATOM 521 C LEU L 63 2.604 14.480 16.341 1.00 20.01 C ATOM 522 O LEU L 63 2.441 14.217 17.542 1.00 19.01 O ATOM 523 CB LEU L 63 4.966 14.702 15.516 1.00 18.38 C ATOM 524 CG LEU L 63 6.085 15.590 14.960 1.00 17.45 C ATOM 525 CD1 LEU L 63 7.365 14.810 14.700 1.00 17.81 C ATOM 526 CD2 LEU L 63 5.591 16.287 13.707 1.00 17.79 C ATOM 527 N PRO L 64 1.889 14.000 15.334 1.00 20.90 N ATOM 528 CA PRO L 64 0.801 13.035 15.530 1.00 22.14 C ATOM 529 C PRO L 64 1.288 11.808 16.285 1.00 22.64 C ATOM 530 O PRO L 64 2.279 11.202 15.869 1.00 23.06 O ATOM 531 CB PRO L 64 0.346 12.656 14.118 1.00 21.79 C ATOM 532 CG PRO L 64 0.769 13.820 13.276 1.00 22.01 C ATOM 533 CD PRO L 64 2.079 14.299 13.904 1.00 21.16 C ATOM 534 N GLY L 65 0.622 11.468 17.374 1.00 23.26 N ATOM 535 CA GLY L 65 1.024 10.301 18.157 1.00 24.45 C ATOM 536 C GLY L 65 -0.006 9.184 18.095 1.00 25.88 C ATOM 537 O GLY L 65 -1.208 9.408 17.921 1.00 25.77 O ATOM 538 N LYS L 66 0.489 7.973 18.261 1.00 26.95 N ATOM 539 CA LYS L 66 -0.337 6.767 18.254 1.00 28.57 C ATOM 540 C LYS L 66 0.490 5.644 18.864 1.00 28.86 C ATOM 541 O LYS L 66 1.685 5.553 18.565 1.00 28.81 O ATOM 542 CB LYS L 66 -0.800 6.407 16.853 1.00 30.61 C ATOM 543 N SER L 67 -0.160 4.849 19.699 1.00 29.33 N ATOM 544 CA SER L 67 0.529 3.741 20.361 1.00 29.42 C ATOM 545 C SER L 67 1.341 2.934 19.364 1.00 28.81 C ATOM 546 O SER L 67 0.794 2.616 18.301 1.00 29.12 O ATOM 547 CB SER L 67 -0.487 2.839 21.059 1.00 30.93 C ATOM 548 OG SER L 67 0.156 1.821 21.800 1.00 33.59 O ATOM 549 N GLY L 68 2.576 2.654 19.738 1.00 28.17 N ATOM 550 CA GLY L 68 3.466 1.869 18.898 1.00 27.98 C ATOM 551 C GLY L 68 4.099 2.593 17.722 1.00 27.34 C ATOM 552 O GLY L 68 4.810 1.933 16.943 1.00 27.96 O ATOM 553 N ARG L 69 3.823 3.887 17.602 1.00 25.56 N ATOM 554 CA ARG L 69 4.422 4.642 16.497 1.00 23.99 C ATOM 555 C ARG L 69 5.717 5.238 17.059 1.00 22.99 C ATOM 556 O ARG L 69 5.679 5.813 18.145 1.00 23.41 O ATOM 557 CB ARG L 69 3.519 5.721 15.914 1.00 24.57 C ATOM 558 CG ARG L 69 4.291 6.835 15.211 1.00 25.13 C ATOM 559 CD ARG L 69 3.412 7.975 14.741 1.00 24.43 C ATOM 560 NE ARG L 69 2.475 7.551 13.704 1.00 24.29 N ATOM 561 CZ ARG L 69 1.270 8.061 13.509 1.00 23.61 C ATOM 562 NH1 ARG L 69 0.813 9.039 14.287 1.00 23.56 N ATOM 563 NH2 ARG L 69 0.498 7.587 12.539 1.00 22.92 N ATOM 564 N THR L 70 6.798 5.052 16.341 1.00 21.50 N ATOM 565 CA THR L 70 8.126 5.547 16.707 1.00 20.11 C ATOM 566 C THR L 70 8.524 6.646 15.731 1.00 17.62 C ATOM 567 O THR L 70 8.211 6.539 14.536 1.00 17.84 O ATOM 568 CB THR L 70 9.128 4.387 16.743 1.00 21.80 C ATOM 569 OG1 THR L 70 9.073 3.782 18.051 1.00 25.15 O ATOM 570 CG2 THR L 70 10.547 4.843 16.446 1.00 24.66 C ATOM 571 N TRP L 71 9.157 7.693 16.253 1.00 14.49 N ATOM 572 CA TRP L 71 9.580 8.802 15.420 1.00 12.20 C ATOM 573 C TRP L 71 11.105 8.866 15.421 1.00 10.66 C ATOM 574 O TRP L 71 11.689 8.645 16.484 1.00 10.81 O ATOM 575 CB TRP L 71 9.072 10.156 15.955 1.00 11.18 C ATOM 576 CG TRP L 71 7.636 10.425 15.639 1.00 10.48 C ATOM 577 CD1 TRP L 71 6.576 10.185 16.464 1.00 11.45 C ATOM 578 CD2 TRP L 71 7.101 10.947 14.421 1.00 9.06 C ATOM 579 NE1 TRP L 71 5.407 10.529 15.827 1.00 11.15 N ATOM 580 CE2 TRP L 71 5.697 11.006 14.578 1.00 10.72 C ATOM 581 CE3 TRP L 71 7.651 11.375 13.210 1.00 8.46 C ATOM 582 CZ2 TRP L 71 4.846 11.481 13.576 1.00 9.57 C ATOM 583 CZ3 TRP L 71 6.809 11.850 12.218 1.00 10.57 C ATOM 584 CH2 TRP L 71 5.412 11.903 12.400 1.00 10.14 C ATOM 585 N ARG L 72 11.683 9.184 14.284 1.00 10.06 N ATOM 586 CA ARG L 72 13.134 9.308 14.163 1.00 9.59 C ATOM 587 C ARG L 72 13.415 10.633 13.470 1.00 9.20 C ATOM 588 O ARG L 72 12.522 11.162 12.800 1.00 8.80 O ATOM 589 CB ARG L 72 13.751 8.129 13.401 1.00 10.11 C ATOM 590 CG ARG L 72 13.904 6.892 14.273 1.00 11.60 C ATOM 591 CD ARG L 72 14.306 5.653 13.453 1.00 14.21 C ATOM 592 NE ARG L 72 14.108 4.452 14.271 1.00 13.83 N ATOM 593 CZ ARG L 72 14.851 4.039 15.283 1.00 14.70 C ATOM 594 NH1 ARG L 72 15.931 4.705 15.677 1.00 17.09 N ATOM 595 NH2 ARG L 72 14.501 2.934 15.943 1.00 17.15 N ATOM 596 N GLU L 73 14.617 11.163 13.640 1.00 8.63 N ATOM 597 CA GLU L 73 14.927 12.449 13.005 1.00 9.43 C ATOM 598 C GLU L 73 16.280 12.341 12.356 1.00 9.55 C ATOM 599 O GLU L 73 17.078 11.490 12.767 1.00 11.05 O ATOM 600 CB GLU L 73 14.906 13.581 14.043 1.00 10.22 C ATOM 601 CG GLU L 73 15.658 13.259 15.326 1.00 13.04 C ATOM 602 CD GLU L 73 17.161 13.397 15.243 1.00 15.51 C ATOM 603 OE1 GLU L 73 17.669 14.109 14.335 1.00 14.81 O ATOM 604 OE2 GLU L 73 17.884 12.803 16.095 1.00 16.69 O ATOM 605 N ALA L 74 16.495 13.177 11.367 1.00 9.69 N ATOM 606 CA ALA L 74 17.761 13.223 10.643 1.00 10.10 C ATOM 607 C ALA L 74 18.120 14.636 10.202 1.00 10.20 C ATOM 608 O ALA L 74 17.232 15.423 9.837 1.00 9.58 O ATOM 609 CB ALA L 74 17.651 12.296 9.417 1.00 11.29 C ATOM 610 N ASP L 75 19.414 14.936 10.249 1.00 9.73 N ATOM 611 CA ASP L 75 19.898 16.241 9.818 1.00 9.16 C ATOM 612 C ASP L 75 19.675 16.459 8.334 1.00 9.72 C ATOM 613 O ASP L 75 19.806 15.564 7.494 1.00 10.25 O ATOM 614 CB ASP L 75 21.400 16.368 10.111 1.00 7.88 C ATOM 615 CG ASP L 75 21.700 16.637 11.566 1.00 7.96 C ATOM 616 OD1 ASP L 75 20.919 16.243 12.463 1.00 8.42 O ATOM 617 OD2 ASP L 75 22.765 17.252 11.835 1.00 10.12 O ATOM 618 N ILE L 76 19.352 17.681 7.967 1.00 8.94 N ATOM 619 CA ILE L 76 19.150 18.112 6.587 1.00 8.86 C ATOM 620 C ILE L 76 20.045 19.338 6.361 1.00 10.01 C ATOM 621 O ILE L 76 20.296 20.091 7.316 1.00 9.77 O ATOM 622 CB ILE L 76 17.666 18.441 6.366 1.00 8.29 C ATOM 623 CG1 ILE L 76 16.849 17.135 6.483 1.00 8.79 C ATOM 624 CG2 ILE L 76 17.428 19.135 5.031 1.00 10.58 C ATOM 625 CD1 ILE L 76 17.088 16.180 5.322 1.00 8.78 C ATOM 626 N ASN L 77 20.525 19.494 5.143 1.00 10.39 N ATOM 627 CA ASN L 77 21.371 20.606 4.731 1.00 12.71 C ATOM 628 C ASN L 77 22.726 20.713 5.424 1.00 12.70 C ATOM 629 O ASN L 77 23.390 21.766 5.355 1.00 12.61 O ATOM 630 CB ASN L 77 20.616 21.939 4.899 1.00 13.41 C ATOM 631 CG ASN L 77 19.419 22.070 3.985 1.00 15.74 C ATOM 632 OD1 ASN L 77 18.425 22.703 4.365 1.00 19.30 O ATOM 633 ND2 ASN L 77 19.486 21.513 2.795 1.00 15.86 N ATOM 634 N TYR L 78 23.164 19.657 6.090 1.00 13.31 N ATOM 635 CA TYR L 78 24.454 19.648 6.748 1.00 14.34 C ATOM 636 C TYR L 78 25.604 19.354 5.778 1.00 16.03 C ATOM 637 O TYR L 78 25.569 18.383 5.025 1.00 16.68 O ATOM 638 CB TYR L 78 24.544 18.593 7.862 1.00 12.03 C ATOM 639 CG TYR L 78 25.895 18.664 8.541 1.00 12.72 C ATOM 640 CD1 TYR L 78 26.159 19.649 9.503 1.00 13.13 C ATOM 641 CD2 TYR L 78 26.911 17.765 8.220 1.00 11.87 C ATOM 642 CE1 TYR L 78 27.388 19.720 10.111 1.00 12.49 C ATOM 643 CE2 TYR L 78 28.141 17.857 8.841 1.00 12.40 C ATOM 644 CZ TYR L 78 28.394 18.829 9.784 1.00 12.88 C ATOM 645 OH TYR L 78 29.625 18.906 10.412 1.00 11.96 O ATOM 646 N THR L 79 26.628 20.192 5.846 1.00 17.86 N ATOM 647 CA THR L 79 27.840 20.062 5.033 1.00 19.19 C ATOM 648 C THR L 79 29.039 20.074 5.995 1.00 19.37 C ATOM 649 O THR L 79 29.826 19.115 5.954 1.00 19.70 O ATOM 650 CB THR L 79 27.948 21.159 3.981 1.00 21.37 C ATOM 651 N SER L 80 29.099 21.155 6.810 1.00 18.94 N ATOM 652 CA SER L 80 30.236 21.204 7.751 1.00 18.67 C ATOM 653 C SER L 80 30.141 21.974 9.060 1.00 18.45 C ATOM 654 O SER L 80 29.163 22.746 9.054 1.00 18.81 O ATOM 655 CB ASER L 80 31.395 21.905 6.829 0.50 19.95 C ATOM 656 CB BSER L 80 31.612 21.299 7.104 0.50 19.98 C ATOM 657 OG ASER L 80 32.134 20.698 6.315 0.50 23.29 O ATOM 658 OG BSER L 80 31.627 22.582 6.433 0.50 22.64 O ATOM 659 N GLY L 81 31.045 21.785 9.991 1.00 16.82 N ATOM 660 CA GLY L 81 30.948 22.582 11.207 1.00 15.93 C ATOM 661 C GLY L 81 29.897 22.087 12.176 1.00 15.17 C ATOM 662 O GLY L 81 29.534 20.915 12.180 1.00 14.63 O ATOM 663 N PHE L 82 29.437 22.999 13.011 1.00 13.66 N ATOM 664 CA PHE L 82 28.416 22.712 14.031 1.00 12.68 C ATOM 665 C PHE L 82 27.101 22.427 13.318 1.00 11.82 C ATOM 666 O PHE L 82 26.873 22.930 12.217 1.00 11.95 O ATOM 667 CB PHE L 82 28.310 23.874 15.048 1.00 11.62 C ATOM 668 CG PHE L 82 29.526 23.923 15.943 1.00 11.66 C ATOM 669 CD1 PHE L 82 30.684 24.574 15.533 1.00 10.89 C ATOM 670 CD2 PHE L 82 29.511 23.289 17.174 1.00 12.23 C ATOM 671 CE1 PHE L 82 31.810 24.590 16.330 1.00 10.08 C ATOM 672 CE2 PHE L 82 30.631 23.317 17.988 1.00 13.37 C ATOM 673 CZ PHE L 82 31.785 23.969 17.565 1.00 11.20 C ATOM 674 N ARG L 83 26.245 21.638 13.944 1.00 11.88 N ATOM 675 CA ARG L 83 24.974 21.280 13.311 1.00 11.25 C ATOM 676 C ARG L 83 23.963 22.407 13.255 1.00 11.30 C ATOM 677 O ARG L 83 24.021 23.322 14.083 1.00 11.90 O ATOM 678 CB ARG L 83 24.434 20.039 14.028 1.00 11.12 C ATOM 679 CG ARG L 83 25.369 18.844 13.693 1.00 9.72 C ATOM 680 CD ARG L 83 25.053 17.749 14.702 1.00 10.40 C ATOM 681 NE ARG L 83 23.704 17.197 14.515 1.00 9.32 N ATOM 682 CZ ARG L 83 22.898 16.826 15.502 1.00 9.22 C ATOM 683 NH1 ARG L 83 23.255 16.933 16.773 1.00 9.90 N ATOM 684 NH2 ARG L 83 21.710 16.313 15.204 1.00 9.31 N ATOM 685 N ASN L 84 23.071 22.317 12.265 1.00 11.06 N ATOM 686 CA ASN L 84 22.062 23.378 12.079 1.00 10.54 C ATOM 687 C ASN L 84 20.732 23.087 12.751 1.00 9.35 C ATOM 688 O ASN L 84 20.646 22.271 13.669 1.00 9.04 O ATOM 689 CB ASN L 84 21.902 23.663 10.592 1.00 10.93 C ATOM 690 CG ASN L 84 21.420 22.439 9.821 1.00 11.14 C ATOM 691 OD1 ASN L 84 20.820 21.561 10.428 1.00 9.79 O ATOM 692 ND2 ASN L 84 21.683 22.412 8.530 1.00 12.17 N ATOM 693 N SER L 85 19.721 23.811 12.270 1.00 8.79 N ATOM 694 CA SER L 85 18.382 23.652 12.841 1.00 8.31 C ATOM 695 C SER L 85 17.378 22.846 12.034 1.00 8.40 C ATOM 696 O SER L 85 16.218 22.744 12.430 1.00 9.34 O ATOM 697 CB ASER L 85 17.787 25.082 13.039 0.50 5.93 C ATOM 698 CB BSER L 85 17.956 25.213 12.911 0.50 5.31 C ATOM 699 CB CSER L 85 17.827 25.103 13.036 0.50 5.83 C ATOM 700 OG ASER L 85 18.710 25.926 13.715 0.50 3.80 O ATOM 701 OG BSER L 85 17.426 25.685 11.685 0.50 5.02 O ATOM 702 OG CSER L 85 16.515 25.095 13.598 0.50 5.53 O ATOM 703 N ASP L 86 17.858 22.357 10.898 1.00 8.85 N ATOM 704 CA ASP L 86 17.080 21.630 9.901 1.00 9.02 C ATOM 705 C ASP L 86 17.050 20.107 10.116 1.00 8.90 C ATOM 706 O ASP L 86 18.111 19.489 10.164 1.00 7.36 O ATOM 707 CB ASP L 86 17.605 21.873 8.485 1.00 9.79 C ATOM 708 CG ASP L 86 17.519 23.317 8.037 1.00 13.25 C ATOM 709 OD1 ASP L 86 16.712 24.067 8.612 1.00 13.82 O ATOM 710 OD2 ASP L 86 18.260 23.672 7.098 1.00 12.43 O ATOM 711 N ARG L 87 15.846 19.573 10.257 1.00 8.83 N ATOM 712 CA ARG L 87 15.659 18.150 10.497 1.00 8.98 C ATOM 713 C ARG L 87 14.411 17.660 9.778 1.00 9.27 C ATOM 714 O ARG L 87 13.408 18.353 9.610 1.00 9.74 O ATOM 715 CB ARG L 87 15.478 17.808 11.977 1.00 8.45 C ATOM 716 CG ARG L 87 16.493 18.360 12.959 1.00 8.67 C ATOM 717 CD ARG L 87 17.807 17.587 12.925 1.00 9.10 C ATOM 718 NE ARG L 87 18.735 18.067 13.949 1.00 9.95 N ATOM 719 CZ ARG L 87 19.604 19.052 13.749 1.00 9.23 C ATOM 720 NH1 ARG L 87 19.683 19.667 12.583 1.00 9.17 N ATOM 721 NH2 ARG L 87 20.390 19.422 14.743 1.00 8.12 N ATOM 722 N ILE L 88 14.527 16.404 9.374 1.00 8.92 N ATOM 723 CA ILE L 88 13.412 15.702 8.728 1.00 7.99 C ATOM 724 C ILE L 88 12.977 14.744 9.842 1.00 7.39 C ATOM 725 O ILE L 88 13.825 14.197 10.559 1.00 6.97 O ATOM 726 CB ILE L 88 13.764 14.948 7.442 1.00 9.03 C ATOM 727 CG1 ILE L 88 12.541 14.290 6.781 1.00 10.57 C ATOM 728 CG2 ILE L 88 14.826 13.873 7.709 1.00 8.82 C ATOM 729 CD1 ILE L 88 12.723 14.128 5.278 1.00 12.79 C ATOM 730 N LEU L 89 11.679 14.595 9.981 1.00 8.67 N ATOM 731 CA LEU L 89 11.124 13.707 11.005 1.00 8.65 C ATOM 732 C LEU L 89 10.358 12.622 10.259 1.00 9.11 C ATOM 733 O LEU L 89 9.652 13.003 9.325 1.00 9.53 O ATOM 734 CB LEU L 89 10.216 14.456 11.975 1.00 10.71 C ATOM 735 CG LEU L 89 10.782 15.362 13.075 1.00 9.80 C ATOM 736 CD1 LEU L 89 11.205 14.585 14.297 1.00 11.08 C ATOM 737 CD2 LEU L 89 11.942 16.179 12.548 1.00 11.61 C ATOM 738 N TYR L 90 10.534 11.372 10.652 1.00 9.80 N ATOM 739 CA TYR L 90 9.796 10.300 9.964 1.00 10.40 C ATOM 740 C TYR L 90 9.348 9.265 10.974 1.00 11.38 C ATOM 741 O TYR L 90 10.096 8.924 11.895 1.00 11.07 O ATOM 742 CB TYR L 90 10.637 9.697 8.866 1.00 11.66 C ATOM 743 CG TYR L 90 11.968 9.126 9.271 1.00 10.44 C ATOM 744 CD1 TYR L 90 13.051 9.952 9.501 1.00 10.50 C ATOM 745 CD2 TYR L 90 12.159 7.754 9.380 1.00 11.38 C ATOM 746 CE1 TYR L 90 14.285 9.438 9.870 1.00 10.77 C ATOM 747 CE2 TYR L 90 13.384 7.224 9.734 1.00 11.60 C ATOM 748 CZ TYR L 90 14.438 8.070 9.978 1.00 11.55 C ATOM 749 OH TYR L 90 15.669 7.567 10.332 1.00 13.06 O ATOM 750 N SER L 91 8.121 8.789 10.745 1.00 11.82 N ATOM 751 CA SER L 91 7.592 7.785 11.678 1.00 13.37 C ATOM 752 C SER L 91 7.759 6.379 11.105 1.00 14.53 C ATOM 753 O SER L 91 8.044 6.222 9.918 1.00 14.85 O ATOM 754 CB SER L 91 6.117 8.068 11.983 1.00 13.20 C ATOM 755 OG SER L 91 5.355 8.060 10.795 1.00 15.26 O ATOM 756 N SER L 92 7.557 5.409 11.981 1.00 17.12 N ATOM 757 CA SER L 92 7.652 3.999 11.582 1.00 19.72 C ATOM 758 C SER L 92 6.611 3.689 10.513 1.00 21.01 C ATOM 759 O SER L 92 6.819 2.751 9.724 1.00 22.55 O ATOM 760 CB SER L 92 7.507 3.103 12.808 1.00 20.69 C ATOM 761 OG SER L 92 6.590 3.631 13.750 1.00 20.92 O ATOM 762 N ASP L 93 5.532 4.474 10.472 1.00 21.32 N ATOM 763 CA ASP L 93 4.478 4.248 9.469 1.00 22.06 C ATOM 764 C ASP L 93 4.540 5.250 8.322 1.00 21.34 C ATOM 765 O ASP L 93 3.577 5.523 7.614 1.00 21.57 O ATOM 766 CB ASP L 93 3.081 4.194 10.071 1.00 24.02 C ATOM 767 CG ASP L 93 2.647 5.386 10.882 1.00 26.24 C ATOM 768 OD1 ASP L 93 3.444 6.314 11.147 1.00 25.41 O ATOM 769 OD2 ASP L 93 1.465 5.394 11.297 1.00 26.71 O ATOM 770 N TRP L 94 5.720 5.797 8.146 1.00 20.32 N ATOM 771 CA TRP L 94 6.146 6.716 7.124 1.00 19.15 C ATOM 772 C TRP L 94 5.486 8.048 6.870 1.00 17.84 C ATOM 773 O TRP L 94 5.378 8.536 5.745 1.00 17.60 O ATOM 774 CB TRP L 94 6.324 5.913 5.775 1.00 21.10 C ATOM 775 CG TRP L 94 7.174 4.729 6.181 1.00 22.33 C ATOM 776 CD1 TRP L 94 6.724 3.471 6.436 1.00 24.12 C ATOM 777 CD2 TRP L 94 8.572 4.707 6.462 1.00 22.86 C ATOM 778 NE1 TRP L 94 7.765 2.663 6.849 1.00 24.47 N ATOM 779 CE2 TRP L 94 8.906 3.410 6.874 1.00 23.46 C ATOM 780 CE3 TRP L 94 9.587 5.666 6.403 1.00 23.94 C ATOM 781 CZ2 TRP L 94 10.202 3.022 7.215 1.00 23.79 C ATOM 782 CZ3 TRP L 94 10.878 5.291 6.740 1.00 23.63 C ATOM 783 CH2 TRP L 94 11.173 3.981 7.139 1.00 22.97 C ATOM 784 N LEU L 95 5.128 8.672 7.986 1.00 16.99 N ATOM 785 CA LEU L 95 4.600 10.042 7.954 1.00 15.90 C ATOM 786 C LEU L 95 5.924 10.846 7.915 1.00 14.52 C ATOM 787 O LEU L 95 6.897 10.456 8.592 1.00 13.81 O ATOM 788 CB LEU L 95 3.809 10.428 9.173 1.00 17.22 C ATOM 789 CG LEU L 95 2.466 9.765 9.465 1.00 18.43 C ATOM 790 CD1 LEU L 95 1.832 10.407 10.705 1.00 17.53 C ATOM 791 CD2 LEU L 95 1.532 9.857 8.272 1.00 18.47 C ATOM 792 N ILE L 96 5.952 11.907 7.138 1.00 13.24 N ATOM 793 CA ILE L 96 7.200 12.681 7.039 1.00 12.12 C ATOM 794 C ILE L 96 6.936 14.168 7.271 1.00 13.03 C ATOM 795 O ILE L 96 6.094 14.773 6.605 1.00 12.77 O ATOM 796 CB AILE L 96 7.804 12.323 5.671 0.50 10.09 C ATOM 797 CB BILE L 96 7.872 12.539 5.680 0.50 9.97 C ATOM 798 CG1AILE L 96 8.046 10.797 5.484 0.50 9.28 C ATOM 799 CG1BILE L 96 8.221 11.087 5.305 0.50 9.29 C ATOM 800 CG2AILE L 96 9.132 13.025 5.471 0.50 8.96 C ATOM 801 CG2BILE L 96 9.169 13.347 5.589 0.50 8.81 C ATOM 802 CD1AILE L 96 9.501 10.417 5.207 0.50 9.48 C ATOM 803 CD1BILE L 96 9.179 10.427 6.302 0.50 9.33 C ATOM 804 N TYR L 97 7.684 14.713 8.215 1.00 12.51 N ATOM 805 CA TYR L 97 7.579 16.125 8.583 1.00 13.25 C ATOM 806 C TYR L 97 8.946 16.806 8.503 1.00 13.96 C ATOM 807 O TYR L 97 9.997 16.149 8.496 1.00 12.94 O ATOM 808 CB TYR L 97 7.070 16.271 10.023 1.00 12.89 C ATOM 809 CG TYR L 97 5.590 16.012 10.194 1.00 15.66 C ATOM 810 CD1 TYR L 97 5.070 14.720 10.173 1.00 15.69 C ATOM 811 CD2 TYR L 97 4.721 17.088 10.403 1.00 15.75 C ATOM 812 CE1 TYR L 97 3.714 14.506 10.335 1.00 18.41 C ATOM 813 CE2 TYR L 97 3.362 16.870 10.568 1.00 18.08 C ATOM 814 CZ TYR L 97 2.869 15.579 10.526 1.00 19.59 C ATOM 815 OH TYR L 97 1.509 15.401 10.693 1.00 21.41 O ATOM 816 N LYS L 98 8.893 18.129 8.444 1.00 13.06 N ATOM 817 CA LYS L 98 10.114 18.934 8.420 1.00 13.87 C ATOM 818 C LYS L 98 9.870 20.005 9.491 1.00 13.68 C ATOM 819 O LYS L 98 8.750 20.377 9.842 1.00 13.94 O ATOM 820 CB LYS L 98 10.381 19.572 7.061 1.00 15.93 C ATOM 821 CG LYS L 98 9.691 20.923 6.903 1.00 21.22 C ATOM 822 CD LYS L 98 9.434 21.309 5.460 1.00 26.08 C ATOM 823 CE LYS L 98 10.659 21.844 4.748 1.00 27.67 C ATOM 824 N THR L 99 10.790 20.709 10.079 1.00 12.56 N ATOM 825 CA THR L 99 11.023 21.705 11.008 1.00 10.37 C ATOM 826 C THR L 99 12.478 22.166 10.542 1.00 12.21 C ATOM 827 O THR L 99 13.512 21.602 10.167 1.00 12.97 O ATOM 828 CB ATHR L 99 10.977 21.230 12.359 0.50 6.90 C ATOM 829 CB BTHR L 99 11.481 20.926 12.442 0.50 6.92 C ATOM 830 OG1ATHR L 99 11.467 22.159 13.367 0.50 5.09 O ATOM 831 OG1BTHR L 99 10.303 20.241 12.765 0.50 5.63 O ATOM 832 CG2ATHR L 99 12.411 20.297 12.489 0.50 3.19 C ATOM 833 CG2BTHR L 99 11.673 22.088 13.431 0.50 3.78 C ATOM 834 N THR L 100 12.522 23.525 10.613 1.00 12.43 N ATOM 835 CA THR L 100 13.662 24.385 10.284 1.00 12.44 C ATOM 836 C THR L 100 14.050 25.237 11.500 1.00 12.64 C ATOM 837 O THR L 100 14.916 26.127 11.427 1.00 12.09 O ATOM 838 CB THR L 100 13.430 25.283 9.060 1.00 14.66 C ATOM 839 OG1 THR L 100 12.237 26.066 9.241 1.00 14.16 O ATOM 840 CG2 THR L 100 13.300 24.406 7.810 1.00 14.93 C ATOM 841 N ASP L 101 13.407 24.937 12.617 1.00 11.16 N ATOM 842 CA ASP L 101 13.680 25.664 13.858 1.00 12.25 C ATOM 843 C ASP L 101 13.944 24.729 15.022 1.00 11.76 C ATOM 844 O ASP L 101 13.530 24.945 16.173 1.00 11.79 O ATOM 845 CB ASP L 101 12.546 26.635 14.173 1.00 12.61 C ATOM 846 CG ASP L 101 11.181 25.991 14.294 1.00 14.91 C ATOM 847 OD1 ASP L 101 11.032 24.745 14.385 1.00 11.90 O ATOM 848 OD2 ASP L 101 10.208 26.797 14.280 1.00 13.90 O ATOM 849 N HIS L 102 14.659 23.646 14.731 1.00 11.11 N ATOM 850 CA HIS L 102 15.024 22.694 15.766 1.00 10.41 C ATOM 851 C HIS L 102 13.905 22.138 16.624 1.00 9.65 C ATOM 852 O HIS L 102 13.950 22.164 17.853 1.00 9.31 O ATOM 853 CB HIS L 102 16.136 23.353 16.609 1.00 11.62 C ATOM 854 CG HIS L 102 16.835 22.377 17.503 1.00 12.99 C ATOM 855 ND1 HIS L 102 16.520 22.237 18.843 1.00 14.18 N ATOM 856 CD2 HIS L 102 17.819 21.481 17.221 1.00 12.65 C ATOM 857 CE1 HIS L 102 17.294 21.295 19.365 1.00 14.71 C ATOM 858 NE2 HIS L 102 18.074 20.832 18.404 1.00 14.47 N ATOM 859 N TYR L 103 12.899 21.562 15.950 1.00 10.26 N ATOM 860 CA TYR L 103 11.739 20.905 16.532 1.00 10.67 C ATOM 861 C TYR L 103 10.743 21.798 17.268 1.00 11.27 C ATOM 862 O TYR L 103 9.996 21.313 18.133 1.00 10.89 O ATOM 863 CB TYR L 103 12.199 19.825 17.534 1.00 10.61 C ATOM 864 CG TYR L 103 13.358 18.968 17.064 1.00 11.37 C ATOM 865 CD1 TYR L 103 13.182 17.959 16.112 1.00 10.18 C ATOM 866 CD2 TYR L 103 14.622 19.137 17.630 1.00 11.10 C ATOM 867 CE1 TYR L 103 14.254 17.170 15.728 1.00 9.28 C ATOM 868 CE2 TYR L 103 15.699 18.359 17.236 1.00 10.96 C ATOM 869 CZ TYR L 103 15.495 17.379 16.291 1.00 10.04 C ATOM 870 OH TYR L 103 16.560 16.597 15.910 1.00 9.59 O ATOM 871 N GLN L 104 10.737 23.088 16.953 1.00 11.67 N ATOM 872 CA GLN L 104 9.766 23.967 17.639 1.00 13.56 C ATOM 873 C GLN L 104 8.446 23.947 16.876 1.00 13.60 C ATOM 874 O GLN L 104 7.378 23.896 17.496 1.00 13.95 O ATOM 875 CB GLN L 104 10.335 25.367 17.822 1.00 15.28 C ATOM 876 CG GLN L 104 11.507 25.393 18.792 1.00 20.65 C ATOM 877 CD GLN L 104 11.172 24.904 20.181 1.00 25.25 C ATOM 878 OE1 GLN L 104 12.003 24.321 20.875 1.00 28.34 O ATOM 879 NE2 GLN L 104 9.940 25.110 20.625 1.00 27.63 N ATOM 880 N THR L 105 8.527 23.964 15.560 1.00 13.88 N ATOM 881 CA THR L 105 7.346 23.905 14.695 1.00 14.55 C ATOM 882 C THR L 105 7.611 22.879 13.592 1.00 14.61 C ATOM 883 O THR L 105 8.774 22.718 13.204 1.00 14.90 O ATOM 884 CB THR L 105 6.972 25.230 14.034 1.00 15.49 C ATOM 885 OG1 THR L 105 7.962 25.601 13.063 1.00 16.77 O ATOM 886 CG2 THR L 105 6.886 26.343 15.073 1.00 15.90 C ATOM 887 N PHE L 106 6.568 22.253 13.090 1.00 14.29 N ATOM 888 CA PHE L 106 6.726 21.254 12.029 1.00 14.83 C ATOM 889 C PHE L 106 5.710 21.437 10.913 1.00 15.54 C ATOM 890 O PHE L 106 4.603 21.937 11.156 1.00 15.30 O ATOM 891 CB PHE L 106 6.535 19.861 12.600 1.00 14.54 C ATOM 892 CG PHE L 106 7.385 19.494 13.776 1.00 14.11 C ATOM 893 CD1 PHE L 106 6.969 19.724 15.072 1.00 14.65 C ATOM 894 CD2 PHE L 106 8.604 18.873 13.556 1.00 14.16 C ATOM 895 CE1 PHE L 106 7.762 19.348 16.145 1.00 14.45 C ATOM 896 CE2 PHE L 106 9.403 18.508 14.621 1.00 13.24 C ATOM 897 CZ PHE L 106 8.985 18.742 15.917 1.00 14.90 C ATOM 898 N THR L 107 6.159 21.029 9.750 1.00 14.44 N ATOM 899 CA THR L 107 5.319 21.089 8.557 1.00 15.56 C ATOM 900 C THR L 107 5.251 19.678 7.949 1.00 16.78 C ATOM 901 O THR L 107 6.328 19.048 7.877 1.00 15.68 O ATOM 902 CB THR L 107 5.839 22.043 7.474 1.00 13.91 C ATOM 903 OG1 THR L 107 5.974 23.366 7.989 1.00 14.83 O ATOM 904 CG2 THR L 107 4.851 22.076 6.307 1.00 13.25 C ATOM 905 N LYS L 108 4.055 19.235 7.589 1.00 17.98 N ATOM 906 CA LYS L 108 3.902 17.909 6.984 1.00 20.05 C ATOM 907 C LYS L 108 4.360 18.016 5.533 1.00 21.07 C ATOM 908 O LYS L 108 3.960 18.996 4.879 1.00 21.26 O ATOM 909 CB LYS L 108 2.463 17.422 7.098 1.00 22.31 C ATOM 910 CG LYS L 108 2.258 16.044 6.481 1.00 24.98 C ATOM 911 CD LYS L 108 0.823 15.562 6.603 1.00 28.25 C ATOM 912 CE LYS L 108 0.730 14.095 6.165 1.00 31.52 C ATOM 913 NZ LYS L 108 -0.690 13.618 6.095 1.00 33.90 N ATOM 914 N ILE L 109 5.188 17.097 5.033 1.00 21.86 N ATOM 915 CA ILE L 109 5.633 17.232 3.642 1.00 23.83 C ATOM 916 C ILE L 109 5.468 15.997 2.771 1.00 25.51 C ATOM 917 O ILE L 109 5.701 16.106 1.563 1.00 25.16 O ATOM 918 CB ILE L 109 7.111 17.663 3.511 1.00 22.88 C ATOM 919 CG1 ILE L 109 8.033 16.660 4.206 1.00 20.96 C ATOM 920 CG2 ILE L 109 7.293 19.078 4.058 1.00 24.18 C ATOM 921 CD1 ILE L 109 9.509 16.892 3.918 1.00 19.98 C ATOM 922 N ARG L 110 5.094 14.896 3.380 1.00 27.71 N ATOM 923 CA ARG L 110 4.895 13.626 2.665 1.00 30.43 C ATOM 924 C ARG L 110 4.206 12.625 3.599 1.00 31.57 C ATOM 925 O ARG L 110 4.090 12.932 4.812 1.00 32.33 O ATOM 926 CB ARG L 110 6.203 13.067 2.110 1.00 31.55 C ATOM 927 CG ARG L 110 6.437 13.384 0.620 1.00 32.72 C ATOM 928 CD ARG L 110 7.856 12.984 0.267 1.00 32.95 C ATOM 929 NE ARG L 110 8.465 13.691 -0.840 1.00 33.18 N ATOM 930 CZ ARG L 110 8.503 14.986 -1.090 1.00 32.96 C ATOM 931 NH1 ARG L 110 7.904 15.854 -0.283 1.00 33.14 N ATOM 932 NH2 ARG L 110 9.151 15.479 -2.141 1.00 34.54 N TER 933 ARG L 110 HETATM 934 O HOH 1 15.001 38.732 17.146 1.00 10.11 O HETATM 935 O HOH 2 22.817 19.832 10.900 1.00 13.33 O HETATM 936 O HOH 3 22.397 16.778 6.252 1.00 9.63 O HETATM 937 O HOH 4 11.141 32.708 20.622 1.00 14.02 O HETATM 938 O HOH 5 17.416 40.480 13.079 1.00 10.79 O HETATM 939 O HOH 6 24.986 16.058 10.502 1.00 14.86 O HETATM 940 O HOH 7 23.952 48.544 22.304 1.00 16.27 O HETATM 941 O HOH 8 20.174 11.397 14.524 1.00 24.39 O HETATM 942 O HOH 9 30.049 18.781 14.069 1.00 13.45 O HETATM 943 O HOH 10 13.965 3.395 10.588 1.00 39.56 O HETATM 944 O HOH 11 10.986 44.814 7.005 1.00 45.12 O HETATM 945 O HOH 12 17.056 35.351 15.439 1.00 12.59 O HETATM 946 O HOH 13 9.006 8.340 19.122 1.00 19.66 O HETATM 947 O HOH 14 16.829 21.018 1.759 1.00 14.41 O HETATM 948 O HOH 15 22.175 50.170 20.938 1.00 16.83 O HETATM 949 O HOH 16 14.963 28.932 18.275 1.00 13.41 O HETATM 950 O HOH 17 6.973 35.420 15.823 1.00 14.93 O HETATM 951 O HOH 18 9.852 34.457 19.036 1.00 11.14 O HETATM 952 O HOH 19 28.816 19.491 16.424 1.00 16.34 O HETATM 953 O HOH 20 23.211 35.944 5.875 1.00 28.83 O HETATM 954 O HOH 21 31.053 31.938 22.647 1.00 19.89 O HETATM 955 O HOH 22 33.454 33.070 23.853 1.00 13.50 O HETATM 956 O HOH 23 9.519 40.816 15.325 1.00 17.96 O HETATM 957 O HOH 24 36.509 41.469 26.987 1.00 19.10 O HETATM 958 O HOH 25 10.035 24.581 11.006 1.00 18.86 O HETATM 959 O HOH 26 29.315 46.244 23.506 1.00 14.03 O HETATM 960 O HOH 27 19.859 39.116 20.910 1.00 18.79 O HETATM 961 O HOH 28 18.488 47.207 22.095 1.00 18.05 O HETATM 962 O HOH 29 26.600 26.914 7.123 1.00 55.65 O HETATM 963 O HOH 30 28.420 17.723 1.728 1.00 38.89 O HETATM 964 O HOH 31 18.747 53.533 17.358 1.00 33.50 O HETATM 965 O HOH 32 -1.591 13.170 18.084 1.00 25.77 O HETATM 966 O HOH 33 17.443 42.682 28.637 1.00 14.68 O HETATM 967 O HOH 34 6.824 17.124 19.956 1.00 16.63 O HETATM 968 O HOH 35 25.731 14.019 4.231 1.00 13.88 O HETATM 969 O HOH 36 9.824 27.231 10.718 1.00 39.10 O HETATM 970 O HOH 37 22.063 5.145 6.598 1.00 33.81 O HETATM 971 O HOH 38 29.956 31.302 12.614 1.00 17.13 O HETATM 972 O HOH 39 22.020 42.383 28.963 1.00 18.42 O HETATM 973 O HOH 40 2.815 18.770 26.035 1.00 41.30 O HETATM 974 O HOH 41 18.879 5.128 23.471 1.00 50.31 O HETATM 975 O HOH 42 21.793 16.591 -1.624 1.00 35.07 O HETATM 976 O HOH 43 10.857 6.153 12.579 1.00 15.29 O HETATM 977 O HOH 44 13.807 43.752 13.044 1.00 11.73 O HETATM 978 O HOH 45 17.495 49.715 19.304 1.00 29.13 O HETATM 979 O HOH 46 31.006 41.078 27.976 1.00 13.74 O HETATM 980 O HOH 47 23.446 4.261 10.535 1.00 17.55 O HETATM 981 O HOH 48 10.032 29.306 13.766 1.00 15.55 O HETATM 982 O HOH 49 16.497 48.946 23.113 1.00 21.80 O HETATM 983 O HOH 50 22.511 39.238 6.670 1.00 16.80 O HETATM 984 O HOH 51 17.758 44.889 6.508 1.00 29.89 O HETATM 985 O HOH 52 19.944 13.803 13.631 1.00 16.77 O HETATM 986 O HOH 53 17.643 4.069 7.986 1.00 17.39 O HETATM 987 O HOH 54 29.805 25.868 12.230 1.00 16.45 O HETATM 988 O HOH 55 22.744 6.967 18.356 1.00 19.57 O HETATM 989 O HOH 56 8.989 19.040 19.432 1.00 17.28 O HETATM 990 O HOH 57 26.583 22.555 7.453 1.00 20.49 O HETATM 991 O HOH 58 23.033 30.435 10.178 1.00 25.79 O HETATM 992 O HOH 59 20.333 30.486 11.559 1.00 18.33 O HETATM 993 O HOH 60 13.362 21.605 20.764 1.00 24.31 O HETATM 994 O HOH 61 42.368 43.478 22.410 1.00 18.93 O HETATM 995 O HOH 62 35.737 31.188 16.354 1.00 22.51 O HETATM 996 O HOH 63 32.978 19.880 10.822 1.00 17.85 O HETATM 997 O HOH 64 19.437 38.767 23.642 1.00 28.00 O HETATM 998 O HOH 65 11.159 7.842 23.482 1.00 18.62 O HETATM 999 O HOH 66 19.560 25.787 10.096 1.00 30.21 O HETATM 1000 O HOH 67 19.615 49.653 21.008 1.00 36.35 O HETATM 1001 O HOH 68 30.464 15.312 7.696 1.00 16.36 O HETATM 1002 O HOH 69 4.615 35.073 14.316 1.00 28.81 O HETATM 1003 O HOH 70 13.284 34.828 11.133 1.00 24.62 O HETATM 1004 O HOH 71 23.459 50.416 7.374 1.00 24.43 O HETATM 1005 O HOH 72 11.867 18.498 25.108 1.00 29.66 O HETATM 1006 O HOH 73 26.456 29.095 22.606 1.00 26.47 O HETATM 1007 O HOH 74 28.180 47.051 3.200 1.00 34.18 O HETATM 1008 O HOH 75 21.501 6.231 10.351 1.00 18.98 O HETATM 1009 O HOH 76 4.208 10.514 19.880 1.00 33.41 O HETATM 1010 O HOH 77 16.234 11.026 -3.436 1.00 22.13 O HETATM 1011 O HOH 78 29.031 48.810 22.434 1.00 18.12 O HETATM 1012 O HOH 79 22.084 5.697 -0.374 1.00 21.58 O HETATM 1013 O HOH 80 6.511 38.029 28.327 1.00 25.50 O HETATM 1014 O HOH 81 4.080 22.630 14.442 1.00 21.87 O HETATM 1015 O HOH 82 27.255 28.103 9.816 1.00 34.99 O HETATM 1016 O HOH 83 16.891 26.665 9.418 1.00 21.57 O HETATM 1017 O HOH 84 34.980 30.947 11.763 1.00 48.13 O HETATM 1018 O HOH 85 24.632 17.242 20.227 1.00 25.62 O HETATM 1019 O HOH 86 28.326 51.331 3.784 1.00 34.25 O HETATM 1020 O HOH 87 25.192 41.092 5.019 1.00 24.95 O HETATM 1021 O HOH 88 20.215 40.915 22.622 1.00 23.54 O HETATM 1022 O HOH 89 20.180 45.540 6.145 1.00 24.09 O HETATM 1023 O HOH 90 25.560 23.145 9.979 1.00 34.82 O HETATM 1024 O HOH 91 1.135 13.650 19.923 1.00 38.15 O HETATM 1025 O HOH 92 7.459 41.172 13.619 1.00 58.94 O HETATM 1026 O HOH 93 16.065 4.936 10.109 1.00 21.19 O HETATM 1027 O HOH 94 17.585 53.440 13.269 1.00 24.69 O HETATM 1028 O HOH 95 16.111 47.138 28.402 1.00 23.16 O HETATM 1029 O HOH 96 13.357 49.836 19.549 1.00 43.31 O HETATM 1030 O HOH 97 18.671 28.699 12.857 1.00 32.11 O HETATM 1031 O HOH 98 16.191 22.451 -0.819 1.00 44.72 O HETATM 1032 O HOH 99 14.737 12.262 28.008 1.00 19.54 O HETATM 1033 O HOH 100 18.565 20.010 21.604 1.00 25.27 O HETATM 1034 O HOH 101 18.235 6.563 18.818 1.00 24.97 O HETATM 1035 O HOH 102 0.436 41.989 16.203 1.00 34.95 O HETATM 1036 O HOH 103 9.304 30.633 27.215 1.00 26.93 O HETATM 1037 O HOH 104 33.638 10.938 20.281 1.00 23.24 O HETATM 1038 O HOH 105 10.966 4.452 10.293 1.00 22.64 O HETATM 1039 O HOH 106 36.180 49.017 25.684 1.00 33.72 O HETATM 1040 O HOH 107 24.918 23.697 16.925 1.00 18.03 O HETATM 1041 O HOH 108 14.360 -0.582 4.034 1.00 23.81 O HETATM 1042 O HOH 109 22.655 1.922 13.217 1.00 33.20 O HETATM 1043 O HOH 110 12.766 41.888 11.403 1.00 16.96 O HETATM 1044 O HOH 111 6.666 46.989 16.781 1.00 24.16 O HETATM 1045 O HOH 112 29.337 16.131 5.568 1.00 31.83 O HETATM 1046 O HOH 113 23.997 46.140 27.417 1.00 32.98 O HETATM 1047 O HOH 114 24.947 26.774 20.988 1.00 24.66 O HETATM 1048 O HOH 115 29.830 49.285 2.309 1.00 31.36 O HETATM 1049 O HOH 116 24.250 30.231 24.417 1.00 37.46 O HETATM 1050 O HOH 117 10.662 47.535 12.449 1.00 25.97 O HETATM 1051 O HOH 118 30.978 28.588 21.989 1.00 26.44 O HETATM 1052 O HOH 119 4.231 46.016 20.150 1.00 21.62 O HETATM 1053 O HOH 120 25.415 56.337 20.157 1.00 30.59 O HETATM 1054 O HOH 121 29.263 4.817 20.301 1.00 28.48 O HETATM 1055 O HOH 122 22.785 3.229 -1.628 1.00 31.59 O HETATM 1056 O HOH 123 17.386 4.206 12.445 1.00 27.50 O HETATM 1057 O HOH 124 18.074 39.868 6.571 1.00 32.00 O HETATM 1058 O HOH 125 1.892 20.646 8.128 1.00 30.75 O HETATM 1059 O HOH 126 20.643 18.263 22.095 1.00 29.14 O HETATM 1060 O HOH 127 21.489 47.723 24.855 1.00 26.87 O HETATM 1061 O HOH 128 25.501 2.410 9.884 1.00 44.82 O HETATM 1062 O HOH 129 14.272 51.141 23.944 1.00 38.67 O HETATM 1063 O HOH 130 29.858 56.796 20.754 1.00 44.51 O HETATM 1064 O HOH 131 10.921 25.913 24.596 1.00 30.76 O HETATM 1065 O HOH 132 8.581 23.913 8.499 1.00 30.82 O HETATM 1066 O HOH 133 10.369 41.211 12.667 1.00 34.87 O HETATM 1067 O HOH 134 15.938 28.000 15.384 1.00 42.89 O HETATM 1068 O HOH 135 30.809 33.322 10.890 1.00 36.08 O HETATM 1069 O HOH 136 22.667 41.526 31.695 1.00 30.05 O HETATM 1070 O HOH 137 3.274 8.218 18.652 1.00 31.41 O HETATM 1071 O HOH 138 29.490 14.616 21.208 1.00 41.68 O HETATM 1072 O HOH 139 37.523 34.455 15.249 1.00 38.73 O HETATM 1073 O HOH 140 32.092 27.995 11.180 1.00 56.86 O HETATM 1074 O HOH 141 37.115 47.791 14.502 1.00 33.57 O HETATM 1075 O HOH 142 6.272 25.683 21.988 1.00 32.50 O HETATM 1076 O HOH 143 15.246 24.430 20.185 1.00 29.34 O HETATM 1077 O HOH 144 16.302 33.331 10.105 1.00 38.00 O HETATM 1078 O HOH 145 25.122 29.122 8.917 1.00 35.84 O HETATM 1079 O HOH 146 21.356 26.882 12.232 1.00 34.36 O HETATM 1080 O HOH 147 10.285 43.413 31.150 1.00 34.77 O HETATM 1081 O HOH 148 21.332 57.073 8.325 1.00 32.63 O HETATM 1082 O HOH 149 19.510 5.208 16.657 1.00 28.60 O HETATM 1083 O HOH 150 13.525 3.250 -7.346 1.00 41.90 O HETATM 1084 O HOH 151 22.456 3.217 2.970 1.00 35.20 O HETATM 1085 O HOH 152 16.000 32.416 24.656 1.00 25.36 O HETATM 1086 O HOH 153 41.788 37.545 24.945 1.00 27.64 O HETATM 1087 O HOH 154 15.502 19.588 21.463 1.00 24.56 O HETATM 1088 O HOH 155 2.668 10.008 4.601 1.00 33.17 O HETATM 1089 O HOH 156 7.811 1.767 16.407 1.00 27.87 O HETATM 1090 O HOH 157 15.664 18.191 23.945 1.00 44.40 O HETATM 1091 O HOH 158 19.493 49.065 24.770 1.00 26.16 O HETATM 1092 O HOH 159 14.809 10.634 22.577 1.00 43.29 O HETATM 1093 O HOH 160 24.361 27.150 11.722 1.00 25.43 O HETATM 1094 O HOH 161 32.844 9.301 5.377 1.00 31.37 O HETATM 1095 O HOH 162 35.437 38.999 27.304 1.00 27.87 O HETATM 1096 O HOH 163 28.224 29.214 27.558 1.00 34.41 O HETATM 1097 O HOH 164 9.657 -1.440 3.336 1.00 43.25 O HETATM 1098 O HOH 165 35.485 20.366 8.989 1.00 41.17 O HETATM 1099 O HOH 166 38.379 10.519 15.314 1.00 38.18 O HETATM 1100 O HOH 167 29.902 29.490 10.792 1.00 34.46 O HETATM 1101 O HOH 168 0.761 35.219 22.967 1.00 33.36 O HETATM 1102 O HOH 170 19.731 0.804 6.103 1.00 39.28 O HETATM 1103 O HOH 172 39.244 48.411 28.193 1.00 35.81 O HETATM 1104 O HOH 173 21.763 20.388 0.826 1.00 37.46 O HETATM 1105 O HOH 174 32.130 24.545 8.884 1.00 43.77 O HETATM 1106 O HOH 175 17.957 8.835 20.710 1.00 41.13 O HETATM 1107 O HOH 176 40.793 35.897 20.840 1.00 40.13 O HETATM 1108 O HOH 177 10.908 34.795 26.972 1.00 32.50 O HETATM 1109 O HOH 178 17.262 4.139 17.932 1.00 37.17 O HETATM 1110 O HOH 179 16.996 6.707 22.217 1.00 30.53 O HETATM 1111 O HOH 180 -0.358 16.135 17.946 1.00 37.90 O HETATM 1112 O HOH 181 23.035 26.303 14.494 1.00 36.70 O HETATM 1113 O HOH 183 17.303 4.911 -6.508 1.00 32.84 O HETATM 1114 O HOH 184 23.679 3.349 16.069 1.00 30.99 O HETATM 1115 O HOH 185 33.078 27.488 20.987 1.00 29.05 O HETATM 1116 O HOH 186 33.121 39.357 29.236 1.00 36.19 O HETATM 1117 O HOH 187 17.227 1.405 7.863 1.00 28.25 O HETATM 1118 O HOH 188 14.373 12.956 -5.588 1.00 33.33 O HETATM 1119 O HOH 189 30.396 17.896 23.427 1.00 26.11 O HETATM 1120 O HOH 190 10.081 6.324 21.343 1.00 29.42 O HETATM 1121 O HOH 191 36.281 35.185 28.964 1.00 35.11 O HETATM 1122 O HOH 192 9.314 21.669 20.880 1.00 36.47 O HETATM 1123 O HOH 193 6.536 32.775 11.679 1.00 35.14 O HETATM 1124 O HOH 194 12.571 28.847 10.421 1.00 30.00 O HETATM 1125 O HOH 195 9.970 21.730 23.557 1.00 35.56 O HETATM 1126 O HOH 196 6.574 8.842 20.666 1.00 31.72 O HETATM 1127 O HOH 197 35.168 8.205 8.878 1.00 32.34 O HETATM 1128 O HOH 198 6.334 21.310 19.553 1.00 38.93 O HETATM 1129 O HOH 199 7.904 0.045 10.980 1.00 28.84 O HETATM 1130 O HOH 201 20.230 4.741 8.491 1.00 29.08 O HETATM 1131 O HOH 202 15.980 30.143 25.998 1.00 39.51 O HETATM 1132 O HOH 203 20.234 59.043 6.704 1.00 39.43 O HETATM 1133 O HOH 204 8.926 6.857 3.939 1.00 37.44 O HETATM 1134 O HOH 205 21.007 9.172 20.533 1.00 29.21 O HETATM 1135 O HOH 206 24.318 52.929 7.919 1.00 31.48 O HETATM 1136 O HOH 207 37.880 9.487 11.825 1.00 34.31 O HETATM 1137 O HOH 209 26.588 54.099 7.545 1.00 31.68 O HETATM 1138 O HOH 210 20.008 32.669 8.488 1.00 33.07 O HETATM 1139 O HOH 211 4.188 27.835 22.423 1.00 38.32 O HETATM 1140 O HOH 212 4.703 27.289 25.055 1.00 36.56 O HETATM 1141 O HOH 213 6.028 31.025 16.216 1.00 27.24 O HETATM 1142 O HOH 214 20.296 39.210 31.450 1.00 27.29 O HETATM 1143 O HOH 215 21.751 4.345 19.024 1.00 39.08 O HETATM 1144 O HOH 216 15.836 28.494 12.491 1.00 27.86 O HETATM 1145 O HOH 217 2.033 45.270 18.663 1.00 31.77 O HETATM 1146 O HOH 218 20.258 3.269 5.947 1.00 40.29 O HETATM 1147 O HOH 219 15.743 -0.762 6.430 1.00 30.41 O HETATM 1148 O HOH 220 19.253 16.011 -2.127 1.00 22.56 O HETATM 1149 O HOH 221 14.192 15.118 -5.064 1.00 22.29 O HETATM 1150 O HOH 222 15.473 8.572 -3.941 1.00 22.62 O HETATM 1151 O HOH 224 26.124 15.550 21.370 1.00 22.32 O HETATM 1152 O HOH 225 27.535 16.302 3.780 1.00 21.63 O HETATM 1153 O HOH 226 25.774 16.774 3.353 1.00 22.23 O HETATM 1154 O HOH 227 16.108 14.638 24.331 1.00 22.37 O HETATM 1155 O HOH 229 22.453 52.614 22.715 1.00 21.49 O HETATM 1156 O HOH 230 15.448 50.572 12.471 1.00 22.48 O HETATM 1157 O HOH 231 2.764 31.948 20.047 1.00 22.45 O HETATM 1158 O HOH 232 24.261 31.688 28.613 1.00 22.41 O HETATM 1159 O HOH 233 29.119 46.720 26.427 1.00 22.60 O HETATM 1160 O HOH 234 19.209 36.554 14.592 1.00 22.25 O HETATM 1161 O HOH 236 13.582 26.695 18.329 1.00 21.17 O HETATM 1162 O HOH 237 28.789 38.695 6.129 1.00 23.18 O MASTER 8 0 0 6 10 10 0 6 2083 4 0 20 END