USER MOD reduce.3.24.130724 H: found=0, std=0, add=664, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 662 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 13 GLN : amide:sc= 0.477 K(o=1.1,f=-0.66) USER MOD Set 1.2: A 17 GLN : amide:sc= 0.636 K(o=1.1,f=-0.11) USER MOD Single : A 1 MET CE :methyl -170:sc= -0.0204 (180deg=-0.17) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 ASN : amide:sc= -0.429 X(o=-0.43,f=-0.03) USER MOD Single : A 6 GLN : amide:sc= -0.807 K(o=-0.81,f=-1.8) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -122:sc= 0.078 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -113:sc= 0.497 (180deg=-0.00679) USER MOD Single : A 21 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0118) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN : amide:sc= 0.478 X(o=0.48,f=0) USER MOD Single : A 27 SER OG : rot 22:sc= 1.28 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -57:sc= 0.0693 USER MOD Single : A 32 LYS NZ :NH3+ 170:sc=-0.00861 (180deg=-0.084) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0.0216 USER MOD Single : A 37 SER OG : rot 180:sc= 0.0103 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 42:sc= 0.277 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 1:sc= 0.35 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A3288 GLN : amide:sc= -0.751 K(o=-0.75,f=-1.8!) USER MOD Single : A3291 THR OG1 : rot -44:sc= 0.111 USER MOD Single : A3295 GLN : amide:sc= 0.727 K(o=0.73,f=-3.4!) USER MOD Single : A3299 SER OG : rot -41:sc= 1.31 USER MOD Single : A3301 GLN : amide:sc= -1.62! K(o=-1.6!,f=-0.077) USER MOD Single : A3302 LYS NZ :NH3+ -122:sc= 0.767 (180deg=-0.127) USER MOD Single : A3306 ASN : amide:sc= -0.163 X(o=-0.16,f=-0.57) USER MOD Single : A3308 SER OG : rot 180:sc= 0 USER MOD Single : A3315 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A3317 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A3320 GLN : amide:sc= -0.187 X(o=-0.19,f=0) USER MOD Single : A3321 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.623 10.880 1.591 1.00 0.00 N ATOM 2 CA MET A 1 -24.019 10.463 1.360 1.00 0.00 C ATOM 3 C MET A 1 -24.490 10.812 -0.050 1.00 0.00 C ATOM 4 O MET A 1 -24.986 9.933 -0.747 1.00 0.00 O ATOM 5 CB MET A 1 -24.986 10.945 2.454 1.00 0.00 C ATOM 6 CG MET A 1 -25.440 12.408 2.370 1.00 0.00 C ATOM 7 SD MET A 1 -26.446 12.976 3.766 1.00 0.00 S ATOM 8 CE MET A 1 -27.888 11.878 3.643 1.00 0.00 C ATOM 0 H1 MET A 1 -22.340 10.626 2.559 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.000 10.399 0.911 1.00 0.00 H new ATOM 0 H3 MET A 1 -22.543 11.909 1.466 1.00 0.00 H new ATOM 0 HA MET A 1 -24.031 9.376 1.433 1.00 0.00 H new ATOM 0 HB2 MET A 1 -25.872 10.311 2.430 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.510 10.791 3.422 1.00 0.00 H new ATOM 0 HG2 MET A 1 -24.557 13.043 2.295 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.010 12.544 1.451 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.668 12.224 4.321 1.00 0.00 H new ATOM 0 HE2 MET A 1 -28.266 11.887 2.621 1.00 0.00 H new ATOM 0 HE3 MET A 1 -27.597 10.863 3.913 1.00 0.00 H new ATOM 18 N ASN A 2 -24.334 12.066 -0.499 1.00 0.00 N ATOM 19 CA ASN A 2 -24.723 12.567 -1.826 1.00 0.00 C ATOM 20 C ASN A 2 -23.834 12.009 -2.942 1.00 0.00 C ATOM 21 O ASN A 2 -23.795 12.553 -4.048 1.00 0.00 O ATOM 22 CB ASN A 2 -24.683 14.109 -1.856 1.00 0.00 C ATOM 23 CG ASN A 2 -25.728 14.714 -0.941 1.00 0.00 C ATOM 24 OD1 ASN A 2 -26.897 14.831 -1.302 1.00 0.00 O ATOM 25 ND2 ASN A 2 -25.344 15.065 0.272 1.00 0.00 N ATOM 0 H ASN A 2 -23.913 12.793 0.080 1.00 0.00 H new ATOM 0 HA ASN A 2 -25.741 12.222 -2.007 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -23.693 14.453 -1.556 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -24.846 14.458 -2.876 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -26.023 15.443 0.933 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -24.368 14.959 0.549 1.00 0.00 H new ATOM 32 N ILE A 3 -23.040 10.989 -2.641 1.00 0.00 N ATOM 33 CA ILE A 3 -22.114 10.298 -3.507 1.00 0.00 C ATOM 34 C ILE A 3 -21.750 8.977 -2.815 1.00 0.00 C ATOM 35 O ILE A 3 -22.042 8.787 -1.628 1.00 0.00 O ATOM 36 CB ILE A 3 -20.902 11.231 -3.759 1.00 0.00 C ATOM 37 CG1 ILE A 3 -19.991 10.816 -4.923 1.00 0.00 C ATOM 38 CG2 ILE A 3 -20.057 11.410 -2.486 1.00 0.00 C ATOM 39 CD1 ILE A 3 -20.656 10.748 -6.296 1.00 0.00 C ATOM 0 H ILE A 3 -23.033 10.596 -1.700 1.00 0.00 H new ATOM 0 HA ILE A 3 -22.530 10.056 -4.485 1.00 0.00 H new ATOM 0 HB ILE A 3 -21.355 12.179 -4.050 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -19.160 11.519 -4.977 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -19.567 9.838 -4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -19.216 12.070 -2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -20.672 11.847 -1.700 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -19.684 10.440 -2.158 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -19.921 10.445 -7.042 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -21.468 10.021 -6.271 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -21.054 11.729 -6.556 1.00 0.00 H new ATOM 51 N ASN A 4 -21.097 8.093 -3.559 1.00 0.00 N ATOM 52 CA ASN A 4 -20.619 6.773 -3.155 1.00 0.00 C ATOM 53 C ASN A 4 -19.212 6.594 -3.726 1.00 0.00 C ATOM 54 O ASN A 4 -18.302 6.291 -2.970 1.00 0.00 O ATOM 55 CB ASN A 4 -21.599 5.660 -3.565 1.00 0.00 C ATOM 56 CG ASN A 4 -22.009 5.771 -5.022 1.00 0.00 C ATOM 57 OD1 ASN A 4 -22.948 6.488 -5.357 1.00 0.00 O ATOM 58 ND2 ASN A 4 -21.253 5.173 -5.911 1.00 0.00 N ATOM 0 H ASN A 4 -20.870 8.293 -4.533 1.00 0.00 H new ATOM 0 HA ASN A 4 -20.567 6.698 -2.069 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.137 4.688 -3.392 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -22.487 5.708 -2.934 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -21.439 5.299 -6.906 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -20.479 4.582 -5.608 1.00 0.00 H new ATOM 65 N GLU A 5 -18.980 6.947 -4.994 1.00 0.00 N ATOM 66 CA GLU A 5 -17.676 6.840 -5.667 1.00 0.00 C ATOM 67 C GLU A 5 -16.625 7.677 -4.932 1.00 0.00 C ATOM 68 O GLU A 5 -15.470 7.279 -4.781 1.00 0.00 O ATOM 69 CB GLU A 5 -17.777 7.272 -7.139 1.00 0.00 C ATOM 70 CG GLU A 5 -18.792 6.393 -7.877 1.00 0.00 C ATOM 71 CD GLU A 5 -18.894 6.650 -9.377 1.00 0.00 C ATOM 72 OE1 GLU A 5 -18.541 7.738 -9.867 1.00 0.00 O ATOM 73 OE2 GLU A 5 -19.434 5.757 -10.088 1.00 0.00 O ATOM 0 H GLU A 5 -19.710 7.325 -5.598 1.00 0.00 H new ATOM 0 HA GLU A 5 -17.368 5.795 -5.644 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.078 8.318 -7.199 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -16.801 7.193 -7.617 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -18.527 5.347 -7.720 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -19.774 6.544 -7.430 1.00 0.00 H new ATOM 80 N GLN A 6 -17.022 8.850 -4.447 1.00 0.00 N ATOM 81 CA GLN A 6 -16.103 9.706 -3.704 1.00 0.00 C ATOM 82 C GLN A 6 -15.934 9.153 -2.292 1.00 0.00 C ATOM 83 O GLN A 6 -14.867 9.347 -1.711 1.00 0.00 O ATOM 84 CB GLN A 6 -16.573 11.162 -3.631 1.00 0.00 C ATOM 85 CG GLN A 6 -16.121 12.048 -4.796 1.00 0.00 C ATOM 86 CD GLN A 6 -16.858 11.820 -6.109 1.00 0.00 C ATOM 87 OE1 GLN A 6 -16.844 10.738 -6.682 1.00 0.00 O ATOM 88 NE2 GLN A 6 -17.509 12.842 -6.634 1.00 0.00 N ATOM 0 H GLN A 6 -17.964 9.227 -4.553 1.00 0.00 H new ATOM 0 HA GLN A 6 -15.153 9.704 -4.238 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -17.662 11.175 -3.586 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -16.211 11.599 -2.700 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -16.243 13.092 -4.506 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -15.056 11.886 -4.963 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -17.518 13.742 -6.154 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -18.002 12.732 -7.520 1.00 0.00 H new ATOM 97 N THR A 7 -16.958 8.497 -1.727 1.00 0.00 N ATOM 98 CA THR A 7 -16.858 7.938 -0.389 1.00 0.00 C ATOM 99 C THR A 7 -15.740 6.906 -0.301 1.00 0.00 C ATOM 100 O THR A 7 -15.007 6.936 0.691 1.00 0.00 O ATOM 101 CB THR A 7 -18.140 7.239 0.061 1.00 0.00 C ATOM 102 OG1 THR A 7 -19.272 8.078 -0.070 1.00 0.00 O ATOM 103 CG2 THR A 7 -17.974 6.763 1.516 1.00 0.00 C ATOM 0 H THR A 7 -17.858 8.346 -2.182 1.00 0.00 H new ATOM 0 HA THR A 7 -16.660 8.792 0.258 1.00 0.00 H new ATOM 0 HB THR A 7 -18.310 6.379 -0.586 1.00 0.00 H new ATOM 0 HG1 THR A 7 -20.072 7.596 0.226 1.00 0.00 H new ATOM 0 HG21 THR A 7 -18.886 6.263 1.842 1.00 0.00 H new ATOM 0 HG22 THR A 7 -17.137 6.067 1.578 1.00 0.00 H new ATOM 0 HG23 THR A 7 -17.781 7.621 2.160 1.00 0.00 H new ATOM 111 N LEU A 8 -15.515 6.136 -1.376 1.00 0.00 N ATOM 112 CA LEU A 8 -14.521 5.071 -1.485 1.00 0.00 C ATOM 113 C LEU A 8 -13.161 5.612 -1.063 1.00 0.00 C ATOM 114 O LEU A 8 -12.358 4.844 -0.562 1.00 0.00 O ATOM 115 CB LEU A 8 -14.386 4.563 -2.929 1.00 0.00 C ATOM 116 CG LEU A 8 -15.672 4.304 -3.732 1.00 0.00 C ATOM 117 CD1 LEU A 8 -15.339 3.849 -5.154 1.00 0.00 C ATOM 118 CD2 LEU A 8 -16.580 3.296 -3.049 1.00 0.00 C ATOM 0 H LEU A 8 -16.053 6.250 -2.235 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.848 4.251 -0.845 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -13.788 5.287 -3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -13.817 3.634 -2.903 1.00 0.00 H new ATOM 0 HG LEU A 8 -16.215 5.248 -3.782 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -16.263 3.671 -5.705 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.760 4.623 -5.657 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -14.757 2.928 -5.114 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -17.475 3.145 -3.652 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -16.053 2.348 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -16.864 3.670 -2.066 1.00 0.00 H new ATOM 130 N ASP A 9 -12.884 6.909 -1.227 1.00 0.00 N ATOM 131 CA ASP A 9 -11.625 7.542 -0.846 1.00 0.00 C ATOM 132 C ASP A 9 -11.257 7.214 0.607 1.00 0.00 C ATOM 133 O ASP A 9 -10.112 6.844 0.880 1.00 0.00 O ATOM 134 CB ASP A 9 -11.786 9.054 -0.983 1.00 0.00 C ATOM 135 CG ASP A 9 -10.504 9.792 -0.614 1.00 0.00 C ATOM 136 OD1 ASP A 9 -10.416 10.324 0.510 1.00 0.00 O ATOM 137 OD2 ASP A 9 -9.610 9.862 -1.486 1.00 0.00 O ATOM 0 H ASP A 9 -13.550 7.562 -1.640 1.00 0.00 H new ATOM 0 HA ASP A 9 -10.833 7.169 -1.495 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.065 9.299 -2.008 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -12.599 9.393 -0.341 1.00 0.00 H new ATOM 142 N LYS A 10 -12.221 7.271 1.542 1.00 0.00 N ATOM 143 CA LYS A 10 -11.932 6.957 2.947 1.00 0.00 C ATOM 144 C LYS A 10 -11.646 5.463 3.120 1.00 0.00 C ATOM 145 O LYS A 10 -11.023 5.060 4.101 1.00 0.00 O ATOM 146 CB LYS A 10 -13.031 7.453 3.910 1.00 0.00 C ATOM 147 CG LYS A 10 -14.251 6.529 3.995 1.00 0.00 C ATOM 148 CD LYS A 10 -15.378 7.070 4.866 1.00 0.00 C ATOM 149 CE LYS A 10 -15.095 6.992 6.366 1.00 0.00 C ATOM 150 NZ LYS A 10 -16.076 7.793 7.129 1.00 0.00 N ATOM 0 H LYS A 10 -13.190 7.527 1.353 1.00 0.00 H new ATOM 0 HA LYS A 10 -11.031 7.506 3.221 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -12.603 7.565 4.906 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.359 8.442 3.591 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -14.634 6.356 2.989 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -13.935 5.562 4.386 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -15.566 8.109 4.595 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.290 6.514 4.649 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.133 5.953 6.694 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -14.087 7.353 6.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -15.864 7.725 8.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -16.020 8.787 6.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -17.034 7.431 6.950 1.00 0.00 H new ATOM 164 N LEU A 11 -12.226 4.626 2.263 1.00 0.00 N ATOM 165 CA LEU A 11 -12.079 3.184 2.262 1.00 0.00 C ATOM 166 C LEU A 11 -10.720 2.790 1.692 1.00 0.00 C ATOM 167 O LEU A 11 -9.963 2.079 2.338 1.00 0.00 O ATOM 168 CB LEU A 11 -13.224 2.484 1.491 1.00 0.00 C ATOM 169 CG LEU A 11 -14.649 2.510 2.081 1.00 0.00 C ATOM 170 CD1 LEU A 11 -14.699 2.127 3.558 1.00 0.00 C ATOM 171 CD2 LEU A 11 -15.408 3.822 1.858 1.00 0.00 C ATOM 0 H LEU A 11 -12.839 4.957 1.518 1.00 0.00 H new ATOM 0 HA LEU A 11 -12.138 2.846 3.297 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.271 2.929 0.497 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.941 1.440 1.359 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.166 1.741 1.507 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -15.730 2.166 3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -14.310 1.117 3.685 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.093 2.825 4.136 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -16.399 3.750 2.306 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -14.860 4.643 2.321 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -15.506 4.009 0.789 1.00 0.00 H new ATOM 183 N ARG A 12 -10.361 3.238 0.492 1.00 0.00 N ATOM 184 CA ARG A 12 -9.086 2.880 -0.134 1.00 0.00 C ATOM 185 C ARG A 12 -7.915 3.280 0.742 1.00 0.00 C ATOM 186 O ARG A 12 -7.026 2.463 0.973 1.00 0.00 O ATOM 187 CB ARG A 12 -9.001 3.350 -1.597 1.00 0.00 C ATOM 188 CG ARG A 12 -9.656 4.690 -1.935 1.00 0.00 C ATOM 189 CD ARG A 12 -8.869 5.525 -2.939 1.00 0.00 C ATOM 190 NE ARG A 12 -9.757 6.198 -3.903 1.00 0.00 N ATOM 191 CZ ARG A 12 -9.697 7.479 -4.288 1.00 0.00 C ATOM 192 NH1 ARG A 12 -8.788 8.309 -3.792 1.00 0.00 N ATOM 193 NH2 ARG A 12 -10.558 7.956 -5.173 1.00 0.00 N ATOM 0 H ARG A 12 -10.941 3.857 -0.074 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.029 1.794 -0.207 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -7.948 3.408 -1.873 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -9.454 2.583 -2.226 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.654 4.506 -2.333 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -9.780 5.265 -1.017 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -8.277 6.270 -2.408 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.169 4.885 -3.475 1.00 0.00 H new ATOM 0 HE ARG A 12 -10.494 5.629 -4.320 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -8.115 7.975 -3.102 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -8.762 9.281 -4.101 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -11.274 7.346 -5.567 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.505 8.933 -5.461 1.00 0.00 H new ATOM 207 N GLN A 13 -7.935 4.481 1.305 1.00 0.00 N ATOM 208 CA GLN A 13 -6.856 4.926 2.178 1.00 0.00 C ATOM 209 C GLN A 13 -6.755 4.013 3.419 1.00 0.00 C ATOM 210 O GLN A 13 -5.672 3.766 3.939 1.00 0.00 O ATOM 211 CB GLN A 13 -7.039 6.413 2.497 1.00 0.00 C ATOM 212 CG GLN A 13 -8.230 6.673 3.420 1.00 0.00 C ATOM 213 CD GLN A 13 -7.912 6.461 4.903 1.00 0.00 C ATOM 214 OE1 GLN A 13 -6.801 6.653 5.376 1.00 0.00 O ATOM 215 NE2 GLN A 13 -8.868 5.977 5.679 1.00 0.00 N ATOM 0 H GLN A 13 -8.683 5.162 1.174 1.00 0.00 H new ATOM 0 HA GLN A 13 -5.892 4.836 1.677 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -6.131 6.795 2.964 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -7.176 6.966 1.568 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -8.576 7.696 3.274 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -9.051 6.015 3.135 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -9.800 5.812 5.298 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -8.673 5.769 6.658 1.00 0.00 H new ATOM 224 N ALA A 14 -7.875 3.465 3.897 1.00 0.00 N ATOM 225 CA ALA A 14 -7.900 2.584 5.054 1.00 0.00 C ATOM 226 C ALA A 14 -7.306 1.221 4.708 1.00 0.00 C ATOM 227 O ALA A 14 -6.635 0.606 5.538 1.00 0.00 O ATOM 228 CB ALA A 14 -9.344 2.433 5.516 1.00 0.00 C ATOM 0 H ALA A 14 -8.794 3.625 3.485 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.297 3.014 5.854 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -9.381 1.775 6.384 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.744 3.411 5.785 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.941 2.005 4.710 1.00 0.00 H new ATOM 234 N VAL A 15 -7.534 0.736 3.488 1.00 0.00 N ATOM 235 CA VAL A 15 -7.008 -0.542 3.060 1.00 0.00 C ATOM 236 C VAL A 15 -5.506 -0.394 2.841 1.00 0.00 C ATOM 237 O VAL A 15 -4.738 -1.187 3.394 1.00 0.00 O ATOM 238 CB VAL A 15 -7.757 -1.037 1.822 1.00 0.00 C ATOM 239 CG1 VAL A 15 -7.203 -2.371 1.311 1.00 0.00 C ATOM 240 CG2 VAL A 15 -9.237 -1.204 2.151 1.00 0.00 C ATOM 0 H VAL A 15 -8.085 1.220 2.780 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.161 -1.305 3.823 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.622 -0.292 1.037 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.764 -2.685 0.431 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.152 -2.252 1.047 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.298 -3.127 2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -9.769 -1.557 1.267 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.351 -1.929 2.957 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -9.650 -0.245 2.465 1.00 0.00 H new ATOM 250 N LEU A 16 -5.065 0.626 2.087 1.00 0.00 N ATOM 251 CA LEU A 16 -3.635 0.818 1.854 1.00 0.00 C ATOM 252 C LEU A 16 -2.902 0.948 3.178 1.00 0.00 C ATOM 253 O LEU A 16 -1.814 0.406 3.284 1.00 0.00 O ATOM 254 CB LEU A 16 -3.287 1.926 0.847 1.00 0.00 C ATOM 255 CG LEU A 16 -3.609 3.363 1.271 1.00 0.00 C ATOM 256 CD1 LEU A 16 -2.440 4.034 1.990 1.00 0.00 C ATOM 257 CD2 LEU A 16 -4.020 4.199 0.045 1.00 0.00 C ATOM 0 H LEU A 16 -5.669 1.315 1.639 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.276 -0.081 1.353 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -2.221 1.866 0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.815 1.719 -0.084 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.439 3.311 1.976 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.719 5.050 2.269 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.190 3.467 2.887 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.575 4.065 1.328 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.246 5.218 0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.202 4.214 -0.676 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.903 3.757 -0.417 1.00 0.00 H new ATOM 269 N GLN A 17 -3.510 1.554 4.212 1.00 0.00 N ATOM 270 CA GLN A 17 -2.865 1.686 5.513 1.00 0.00 C ATOM 271 C GLN A 17 -2.388 0.321 5.999 1.00 0.00 C ATOM 272 O GLN A 17 -1.237 0.228 6.431 1.00 0.00 O ATOM 273 CB GLN A 17 -3.787 2.344 6.539 1.00 0.00 C ATOM 274 CG GLN A 17 -3.629 3.864 6.564 1.00 0.00 C ATOM 275 CD GLN A 17 -4.410 4.483 7.712 1.00 0.00 C ATOM 276 OE1 GLN A 17 -4.132 4.206 8.879 1.00 0.00 O ATOM 277 NE2 GLN A 17 -5.422 5.284 7.441 1.00 0.00 N ATOM 0 H GLN A 17 -4.446 1.957 4.164 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.001 2.340 5.398 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.822 2.091 6.310 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -3.572 1.942 7.529 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.574 4.120 6.660 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.974 4.283 5.619 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.648 5.510 6.472 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -5.979 5.677 8.200 1.00 0.00 H new ATOM 286 N LYS A 18 -3.228 -0.733 5.975 1.00 0.00 N ATOM 287 CA LYS A 18 -2.737 -2.041 6.419 1.00 0.00 C ATOM 288 C LYS A 18 -1.709 -2.582 5.422 1.00 0.00 C ATOM 289 O LYS A 18 -0.685 -3.095 5.862 1.00 0.00 O ATOM 290 CB LYS A 18 -3.840 -3.035 6.781 1.00 0.00 C ATOM 291 CG LYS A 18 -4.545 -3.729 5.621 1.00 0.00 C ATOM 292 CD LYS A 18 -6.055 -3.494 5.645 1.00 0.00 C ATOM 293 CE LYS A 18 -6.728 -4.835 5.403 1.00 0.00 C ATOM 294 NZ LYS A 18 -7.007 -5.636 6.611 1.00 0.00 N ATOM 0 H LYS A 18 -4.200 -0.706 5.669 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.226 -1.893 7.370 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -3.409 -3.802 7.425 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.591 -2.509 7.370 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.136 -3.365 4.678 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -4.344 -4.799 5.663 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -6.363 -3.077 6.604 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -6.344 -2.776 4.878 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.668 -4.660 4.880 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -6.097 -5.423 4.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.535 -6.559 6.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.650 -5.135 7.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -8.033 -5.778 6.704 1.00 0.00 H new ATOM 308 N LYS A 19 -1.905 -2.398 4.107 1.00 0.00 N ATOM 309 CA LYS A 19 -0.991 -2.888 3.076 1.00 0.00 C ATOM 310 C LYS A 19 0.425 -2.385 3.313 1.00 0.00 C ATOM 311 O LYS A 19 1.360 -3.166 3.162 1.00 0.00 O ATOM 312 CB LYS A 19 -1.452 -2.500 1.655 1.00 0.00 C ATOM 313 CG LYS A 19 -2.665 -3.310 1.162 1.00 0.00 C ATOM 314 CD LYS A 19 -3.022 -3.012 -0.305 1.00 0.00 C ATOM 315 CE LYS A 19 -3.951 -4.083 -0.902 1.00 0.00 C ATOM 316 NZ LYS A 19 -3.220 -5.161 -1.599 1.00 0.00 N ATOM 0 H LYS A 19 -2.712 -1.900 3.731 1.00 0.00 H new ATOM 0 HA LYS A 19 -0.999 -3.976 3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -1.702 -1.439 1.640 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.624 -2.642 0.961 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.455 -4.374 1.272 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -3.526 -3.088 1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -3.505 -2.037 -0.370 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.108 -2.955 -0.896 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.554 -4.518 -0.105 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.640 -3.609 -1.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.425 -5.117 -2.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.198 -5.043 -1.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -3.522 -6.083 -1.225 1.00 0.00 H new ATOM 330 N ILE A 20 0.611 -1.132 3.755 1.00 0.00 N ATOM 331 CA ILE A 20 1.956 -0.618 3.994 1.00 0.00 C ATOM 332 C ILE A 20 2.664 -1.481 5.046 1.00 0.00 C ATOM 333 O ILE A 20 3.850 -1.763 4.910 1.00 0.00 O ATOM 334 CB ILE A 20 1.971 0.878 4.389 1.00 0.00 C ATOM 335 CG1 ILE A 20 1.050 1.790 3.553 1.00 0.00 C ATOM 336 CG2 ILE A 20 3.407 1.431 4.326 1.00 0.00 C ATOM 337 CD1 ILE A 20 1.055 1.561 2.038 1.00 0.00 C ATOM 0 H ILE A 20 -0.141 -0.471 3.949 1.00 0.00 H new ATOM 0 HA ILE A 20 2.501 -0.681 3.052 1.00 0.00 H new ATOM 0 HB ILE A 20 1.576 0.898 5.405 1.00 0.00 H new ATOM 0 HG12 ILE A 20 0.029 1.666 3.914 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.332 2.826 3.743 1.00 0.00 H new ATOM 0 HG21 ILE A 20 3.404 2.484 4.606 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.042 0.874 5.015 1.00 0.00 H new ATOM 0 HG23 ILE A 20 3.793 1.326 3.312 1.00 0.00 H new ATOM 0 HD11 ILE A 20 0.369 2.262 1.562 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.061 1.718 1.650 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.738 0.540 1.823 1.00 0.00 H new ATOM 349 N LYS A 21 1.940 -1.901 6.088 1.00 0.00 N ATOM 350 CA LYS A 21 2.438 -2.735 7.184 1.00 0.00 C ATOM 351 C LYS A 21 2.738 -4.140 6.693 1.00 0.00 C ATOM 352 O LYS A 21 3.639 -4.786 7.217 1.00 0.00 O ATOM 353 CB LYS A 21 1.402 -2.860 8.310 1.00 0.00 C ATOM 354 CG LYS A 21 0.739 -1.528 8.656 1.00 0.00 C ATOM 355 CD LYS A 21 -0.325 -1.681 9.729 1.00 0.00 C ATOM 356 CE LYS A 21 -1.256 -0.465 9.742 1.00 0.00 C ATOM 357 NZ LYS A 21 -0.564 0.813 10.026 1.00 0.00 N ATOM 0 H LYS A 21 0.955 -1.660 6.194 1.00 0.00 H new ATOM 0 HA LYS A 21 3.341 -2.252 7.558 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.635 -3.576 8.014 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.886 -3.261 9.200 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.498 -0.823 8.996 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.290 -1.103 7.758 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.904 -2.587 9.548 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.148 -1.794 10.704 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.755 -0.391 8.776 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.033 -0.621 10.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.265 1.578 10.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.040 0.733 10.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.099 1.028 9.254 1.00 0.00 H new ATOM 371 N GLU A 22 2.004 -4.617 5.694 1.00 0.00 N ATOM 372 CA GLU A 22 2.216 -5.949 5.167 1.00 0.00 C ATOM 373 C GLU A 22 3.478 -5.987 4.335 1.00 0.00 C ATOM 374 O GLU A 22 4.327 -6.832 4.593 1.00 0.00 O ATOM 375 CB GLU A 22 1.067 -6.405 4.275 1.00 0.00 C ATOM 376 CG GLU A 22 -0.243 -6.453 5.037 1.00 0.00 C ATOM 377 CD GLU A 22 -1.261 -7.255 4.231 1.00 0.00 C ATOM 378 OE1 GLU A 22 -1.846 -6.689 3.274 1.00 0.00 O ATOM 379 OE2 GLU A 22 -1.398 -8.463 4.541 1.00 0.00 O ATOM 0 H GLU A 22 1.257 -4.096 5.236 1.00 0.00 H new ATOM 0 HA GLU A 22 2.289 -6.614 6.028 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.971 -5.726 3.428 1.00 0.00 H new ATOM 0 HB3 GLU A 22 1.290 -7.392 3.869 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.093 -6.911 6.015 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.614 -5.443 5.212 1.00 0.00 H new ATOM 386 N ARG A 23 3.650 -5.059 3.393 1.00 0.00 N ATOM 387 CA ARG A 23 4.837 -5.044 2.544 1.00 0.00 C ATOM 388 C ARG A 23 6.110 -4.879 3.357 1.00 0.00 C ATOM 389 O ARG A 23 7.090 -5.547 3.063 1.00 0.00 O ATOM 390 CB ARG A 23 4.687 -4.039 1.392 1.00 0.00 C ATOM 391 CG ARG A 23 4.409 -2.576 1.777 1.00 0.00 C ATOM 392 CD ARG A 23 5.606 -1.688 2.164 1.00 0.00 C ATOM 393 NE ARG A 23 6.768 -1.824 1.278 1.00 0.00 N ATOM 394 CZ ARG A 23 6.843 -1.506 -0.017 1.00 0.00 C ATOM 395 NH1 ARG A 23 5.761 -1.104 -0.674 1.00 0.00 N ATOM 396 NH2 ARG A 23 8.013 -1.573 -0.630 1.00 0.00 N ATOM 0 H ARG A 23 2.984 -4.311 3.201 1.00 0.00 H new ATOM 0 HA ARG A 23 4.932 -6.020 2.068 1.00 0.00 H new ATOM 0 HB2 ARG A 23 5.600 -4.066 0.797 1.00 0.00 H new ATOM 0 HB3 ARG A 23 3.877 -4.380 0.747 1.00 0.00 H new ATOM 0 HG2 ARG A 23 3.899 -2.102 0.938 1.00 0.00 H new ATOM 0 HG3 ARG A 23 3.711 -2.578 2.614 1.00 0.00 H new ATOM 0 HD2 ARG A 23 5.285 -0.646 2.166 1.00 0.00 H new ATOM 0 HD3 ARG A 23 5.910 -1.931 3.182 1.00 0.00 H new ATOM 0 HE ARG A 23 7.615 -2.205 1.699 1.00 0.00 H new ATOM 0 HH11 ARG A 23 4.866 -1.037 -0.190 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.825 -0.863 -1.663 1.00 0.00 H new ATOM 0 HH21 ARG A 23 8.843 -1.865 -0.114 1.00 0.00 H new ATOM 0 HH22 ARG A 23 8.085 -1.333 -1.619 1.00 0.00 H new ATOM 410 N ILE A 24 6.104 -4.079 4.421 1.00 0.00 N ATOM 411 CA ILE A 24 7.290 -3.882 5.248 1.00 0.00 C ATOM 412 C ILE A 24 7.545 -5.100 6.148 1.00 0.00 C ATOM 413 O ILE A 24 8.673 -5.587 6.233 1.00 0.00 O ATOM 414 CB ILE A 24 7.150 -2.573 6.063 1.00 0.00 C ATOM 415 CG1 ILE A 24 8.419 -2.235 6.870 1.00 0.00 C ATOM 416 CG2 ILE A 24 5.930 -2.599 6.998 1.00 0.00 C ATOM 417 CD1 ILE A 24 8.181 -1.071 7.839 1.00 0.00 C ATOM 0 H ILE A 24 5.286 -3.555 4.731 1.00 0.00 H new ATOM 0 HA ILE A 24 8.163 -3.784 4.602 1.00 0.00 H new ATOM 0 HB ILE A 24 7.003 -1.787 5.323 1.00 0.00 H new ATOM 0 HG12 ILE A 24 8.740 -3.114 7.429 1.00 0.00 H new ATOM 0 HG13 ILE A 24 9.228 -1.979 6.186 1.00 0.00 H new ATOM 0 HG21 ILE A 24 5.873 -1.660 7.549 1.00 0.00 H new ATOM 0 HG22 ILE A 24 5.022 -2.729 6.408 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.028 -3.426 7.701 1.00 0.00 H new ATOM 0 HD11 ILE A 24 9.098 -0.863 8.390 1.00 0.00 H new ATOM 0 HD12 ILE A 24 7.886 -0.185 7.277 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.390 -1.337 8.540 1.00 0.00 H new ATOM 429 N GLN A 25 6.506 -5.621 6.810 1.00 0.00 N ATOM 430 CA GLN A 25 6.653 -6.741 7.728 1.00 0.00 C ATOM 431 C GLN A 25 6.922 -8.059 7.007 1.00 0.00 C ATOM 432 O GLN A 25 7.787 -8.819 7.431 1.00 0.00 O ATOM 433 CB GLN A 25 5.364 -6.826 8.558 1.00 0.00 C ATOM 434 CG GLN A 25 5.399 -7.772 9.756 1.00 0.00 C ATOM 435 CD GLN A 25 3.992 -7.886 10.344 1.00 0.00 C ATOM 436 OE1 GLN A 25 3.111 -8.519 9.770 1.00 0.00 O ATOM 437 NE2 GLN A 25 3.690 -7.202 11.437 1.00 0.00 N ATOM 0 H GLN A 25 5.550 -5.277 6.722 1.00 0.00 H new ATOM 0 HA GLN A 25 7.520 -6.571 8.366 1.00 0.00 H new ATOM 0 HB2 GLN A 25 5.120 -5.826 8.917 1.00 0.00 H new ATOM 0 HB3 GLN A 25 4.552 -7.135 7.900 1.00 0.00 H new ATOM 0 HG2 GLN A 25 5.759 -8.754 9.449 1.00 0.00 H new ATOM 0 HG3 GLN A 25 6.093 -7.399 10.510 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.413 -6.672 11.923 1.00 0.00 H new ATOM 0 HE22 GLN A 25 2.734 -7.205 11.793 1.00 0.00 H new ATOM 446 N ASN A 26 6.144 -8.364 5.969 1.00 0.00 N ATOM 447 CA ASN A 26 6.299 -9.594 5.209 1.00 0.00 C ATOM 448 C ASN A 26 7.455 -9.479 4.227 1.00 0.00 C ATOM 449 O ASN A 26 8.360 -10.306 4.252 1.00 0.00 O ATOM 450 CB ASN A 26 5.018 -9.943 4.428 1.00 0.00 C ATOM 451 CG ASN A 26 3.823 -10.238 5.314 1.00 0.00 C ATOM 452 OD1 ASN A 26 3.546 -11.381 5.664 1.00 0.00 O ATOM 453 ND2 ASN A 26 3.078 -9.215 5.681 1.00 0.00 N ATOM 0 H ASN A 26 5.391 -7.763 5.635 1.00 0.00 H new ATOM 0 HA ASN A 26 6.503 -10.387 5.928 1.00 0.00 H new ATOM 0 HB2 ASN A 26 4.771 -9.114 3.764 1.00 0.00 H new ATOM 0 HB3 ASN A 26 5.213 -10.810 3.796 1.00 0.00 H new ATOM 0 HD21 ASN A 26 2.256 -9.366 6.265 1.00 0.00 H new ATOM 0 HD22 ASN A 26 3.323 -8.272 5.381 1.00 0.00 H new ATOM 460 N SER A 27 7.458 -8.422 3.398 1.00 0.00 N ATOM 461 CA SER A 27 8.469 -8.171 2.361 1.00 0.00 C ATOM 462 C SER A 27 8.762 -9.457 1.569 1.00 0.00 C ATOM 463 O SER A 27 9.906 -9.825 1.314 1.00 0.00 O ATOM 464 CB SER A 27 9.696 -7.514 3.004 1.00 0.00 C ATOM 465 OG SER A 27 9.639 -6.102 2.914 1.00 0.00 O ATOM 0 H SER A 27 6.738 -7.700 3.433 1.00 0.00 H new ATOM 0 HA SER A 27 8.099 -7.466 1.617 1.00 0.00 H new ATOM 0 HB2 SER A 27 9.761 -7.810 4.051 1.00 0.00 H new ATOM 0 HB3 SER A 27 10.601 -7.874 2.514 1.00 0.00 H new ATOM 0 HG SER A 27 8.710 -5.820 2.784 1.00 0.00 H new ATOM 471 N LEU A 28 7.703 -10.197 1.250 1.00 0.00 N ATOM 472 CA LEU A 28 7.740 -11.449 0.518 1.00 0.00 C ATOM 473 C LEU A 28 6.411 -11.616 -0.199 1.00 0.00 C ATOM 474 O LEU A 28 5.496 -10.807 -0.015 1.00 0.00 O ATOM 475 CB LEU A 28 8.045 -12.634 1.463 1.00 0.00 C ATOM 476 CG LEU A 28 7.096 -12.851 2.659 1.00 0.00 C ATOM 477 CD1 LEU A 28 5.744 -13.449 2.260 1.00 0.00 C ATOM 478 CD2 LEU A 28 7.802 -13.697 3.724 1.00 0.00 C ATOM 0 H LEU A 28 6.755 -9.923 1.509 1.00 0.00 H new ATOM 0 HA LEU A 28 8.544 -11.434 -0.218 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.050 -13.547 0.867 1.00 0.00 H new ATOM 0 HB3 LEU A 28 9.054 -12.502 1.853 1.00 0.00 H new ATOM 0 HG LEU A 28 6.860 -11.872 3.076 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.126 -13.575 3.149 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.242 -12.780 1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.900 -14.418 1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.132 -13.851 4.570 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.077 -14.662 3.299 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.700 -13.181 4.062 1.00 0.00 H new ATOM 490 N SER A 29 6.303 -12.695 -0.965 1.00 0.00 N ATOM 491 CA SER A 29 5.119 -13.047 -1.724 1.00 0.00 C ATOM 492 C SER A 29 4.491 -14.315 -1.154 1.00 0.00 C ATOM 493 O SER A 29 3.476 -14.253 -0.464 1.00 0.00 O ATOM 494 CB SER A 29 5.512 -13.205 -3.194 1.00 0.00 C ATOM 495 OG SER A 29 5.973 -11.971 -3.709 1.00 0.00 O ATOM 0 H SER A 29 7.063 -13.367 -1.075 1.00 0.00 H new ATOM 0 HA SER A 29 4.367 -12.261 -1.652 1.00 0.00 H new ATOM 0 HB2 SER A 29 6.290 -13.962 -3.291 1.00 0.00 H new ATOM 0 HB3 SER A 29 4.656 -13.552 -3.772 1.00 0.00 H new ATOM 0 HG SER A 29 6.224 -12.082 -4.650 1.00 0.00 H new ATOM 501 N THR A 30 5.166 -15.446 -1.351 1.00 0.00 N ATOM 502 CA THR A 30 4.742 -16.776 -0.939 1.00 0.00 C ATOM 503 C THR A 30 5.823 -17.450 -0.096 1.00 0.00 C ATOM 504 O THR A 30 6.319 -18.543 -0.377 1.00 0.00 O ATOM 505 CB THR A 30 4.358 -17.528 -2.218 1.00 0.00 C ATOM 506 OG1 THR A 30 3.842 -18.811 -1.922 1.00 0.00 O ATOM 507 CG2 THR A 30 5.566 -17.561 -3.178 1.00 0.00 C ATOM 0 H THR A 30 6.068 -15.456 -1.826 1.00 0.00 H new ATOM 0 HA THR A 30 3.873 -16.755 -0.282 1.00 0.00 H new ATOM 0 HB THR A 30 3.552 -17.000 -2.727 1.00 0.00 H new ATOM 0 HG1 THR A 30 4.504 -19.319 -1.408 1.00 0.00 H new ATOM 0 HG21 THR A 30 5.293 -18.096 -4.088 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.858 -16.542 -3.430 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.401 -18.069 -2.695 1.00 0.00 H new ATOM 515 N GLU A 31 6.256 -16.718 0.920 1.00 0.00 N ATOM 516 CA GLU A 31 7.273 -17.152 1.869 1.00 0.00 C ATOM 517 C GLU A 31 8.542 -17.572 1.121 1.00 0.00 C ATOM 518 O GLU A 31 9.126 -18.628 1.384 1.00 0.00 O ATOM 519 CB GLU A 31 6.692 -18.250 2.771 1.00 0.00 C ATOM 520 CG GLU A 31 5.454 -17.764 3.539 1.00 0.00 C ATOM 521 CD GLU A 31 4.861 -18.833 4.461 1.00 0.00 C ATOM 522 OE1 GLU A 31 3.862 -18.525 5.145 1.00 0.00 O ATOM 523 OE2 GLU A 31 5.363 -19.984 4.518 1.00 0.00 O ATOM 0 H GLU A 31 5.901 -15.781 1.113 1.00 0.00 H new ATOM 0 HA GLU A 31 7.567 -16.332 2.524 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.426 -19.116 2.164 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.453 -18.579 3.479 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.722 -16.889 4.132 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.694 -17.445 2.826 1.00 0.00 H new ATOM 530 N LYS A 32 8.937 -16.769 0.124 1.00 0.00 N ATOM 531 CA LYS A 32 10.116 -17.034 -0.688 1.00 0.00 C ATOM 532 C LYS A 32 11.391 -16.914 0.173 1.00 0.00 C ATOM 533 O LYS A 32 11.319 -16.625 1.375 1.00 0.00 O ATOM 534 CB LYS A 32 10.151 -16.097 -1.910 1.00 0.00 C ATOM 535 CG LYS A 32 10.834 -16.743 -3.133 1.00 0.00 C ATOM 536 CD LYS A 32 9.858 -17.451 -4.084 1.00 0.00 C ATOM 537 CE LYS A 32 9.026 -18.579 -3.453 1.00 0.00 C ATOM 538 NZ LYS A 32 9.827 -19.775 -3.123 1.00 0.00 N ATOM 0 H LYS A 32 8.441 -15.917 -0.137 1.00 0.00 H new ATOM 0 HA LYS A 32 10.070 -18.055 -1.067 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.132 -15.813 -2.175 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.679 -15.181 -1.646 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.372 -15.973 -3.686 1.00 0.00 H new ATOM 0 HG3 LYS A 32 11.575 -17.463 -2.786 1.00 0.00 H new ATOM 0 HD2 LYS A 32 9.177 -16.708 -4.498 1.00 0.00 H new ATOM 0 HD3 LYS A 32 10.425 -17.864 -4.919 1.00 0.00 H new ATOM 0 HE2 LYS A 32 8.549 -18.207 -2.546 1.00 0.00 H new ATOM 0 HE3 LYS A 32 8.228 -18.862 -4.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.255 -20.429 -2.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 10.122 -20.249 -4.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 10.670 -19.491 -2.584 1.00 0.00 H new ATOM 552 N TYR A 33 12.568 -17.135 -0.408 1.00 0.00 N ATOM 553 CA TYR A 33 13.841 -17.046 0.292 1.00 0.00 C ATOM 554 C TYR A 33 14.916 -16.514 -0.656 1.00 0.00 C ATOM 555 O TYR A 33 14.667 -16.367 -1.856 1.00 0.00 O ATOM 556 CB TYR A 33 14.186 -18.431 0.854 1.00 0.00 C ATOM 557 CG TYR A 33 15.193 -18.428 1.986 1.00 0.00 C ATOM 558 CD1 TYR A 33 16.396 -19.146 1.863 1.00 0.00 C ATOM 559 CD2 TYR A 33 14.902 -17.750 3.185 1.00 0.00 C ATOM 560 CE1 TYR A 33 17.297 -19.202 2.939 1.00 0.00 C ATOM 561 CE2 TYR A 33 15.804 -17.797 4.261 1.00 0.00 C ATOM 562 CZ TYR A 33 17.013 -18.519 4.142 1.00 0.00 C ATOM 563 OH TYR A 33 17.902 -18.567 5.175 1.00 0.00 O ATOM 0 H TYR A 33 12.662 -17.384 -1.393 1.00 0.00 H new ATOM 0 HA TYR A 33 13.780 -16.347 1.126 1.00 0.00 H new ATOM 0 HB2 TYR A 33 13.268 -18.903 1.205 1.00 0.00 H new ATOM 0 HB3 TYR A 33 14.573 -19.049 0.044 1.00 0.00 H new ATOM 0 HD1 TYR A 33 16.627 -19.655 0.939 1.00 0.00 H new ATOM 0 HD2 TYR A 33 13.982 -17.192 3.278 1.00 0.00 H new ATOM 0 HE1 TYR A 33 18.211 -19.770 2.846 1.00 0.00 H new ATOM 0 HE2 TYR A 33 15.573 -17.280 5.181 1.00 0.00 H new ATOM 0 HH TYR A 33 17.557 -18.044 5.928 1.00 0.00 H new ATOM 573 N GLY A 34 16.100 -16.235 -0.110 1.00 0.00 N ATOM 574 CA GLY A 34 17.256 -15.713 -0.821 1.00 0.00 C ATOM 575 C GLY A 34 17.896 -14.632 0.041 1.00 0.00 C ATOM 576 O GLY A 34 17.316 -13.557 0.197 1.00 0.00 O ATOM 0 H GLY A 34 16.282 -16.375 0.884 1.00 0.00 H new ATOM 0 HA2 GLY A 34 17.971 -16.511 -1.023 1.00 0.00 H new ATOM 0 HA3 GLY A 34 16.956 -15.302 -1.785 1.00 0.00 H new ATOM 580 N SER A 35 19.045 -14.929 0.640 1.00 0.00 N ATOM 581 CA SER A 35 19.822 -14.058 1.513 1.00 0.00 C ATOM 582 C SER A 35 21.280 -14.017 1.034 1.00 0.00 C ATOM 583 O SER A 35 21.630 -14.657 0.039 1.00 0.00 O ATOM 584 CB SER A 35 19.674 -14.569 2.952 1.00 0.00 C ATOM 585 OG SER A 35 20.238 -13.660 3.878 1.00 0.00 O ATOM 0 H SER A 35 19.485 -15.841 0.521 1.00 0.00 H new ATOM 0 HA SER A 35 19.458 -13.031 1.482 1.00 0.00 H new ATOM 0 HB2 SER A 35 18.619 -14.718 3.181 1.00 0.00 H new ATOM 0 HB3 SER A 35 20.161 -15.539 3.048 1.00 0.00 H new ATOM 0 HG SER A 35 20.129 -14.009 4.787 1.00 0.00 H new ATOM 591 N GLY A 36 22.138 -13.275 1.734 1.00 0.00 N ATOM 592 CA GLY A 36 23.551 -13.123 1.426 1.00 0.00 C ATOM 593 C GLY A 36 23.794 -11.824 0.669 1.00 0.00 C ATOM 594 O GLY A 36 23.037 -11.467 -0.240 1.00 0.00 O ATOM 0 H GLY A 36 21.854 -12.747 2.559 1.00 0.00 H new ATOM 0 HA2 GLY A 36 24.133 -13.128 2.348 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.892 -13.968 0.829 1.00 0.00 H new ATOM 598 N SER A 37 24.863 -11.123 1.032 1.00 0.00 N ATOM 599 CA SER A 37 25.311 -9.863 0.462 1.00 0.00 C ATOM 600 C SER A 37 26.844 -9.874 0.416 1.00 0.00 C ATOM 601 O SER A 37 27.487 -10.862 0.793 1.00 0.00 O ATOM 602 CB SER A 37 24.754 -8.707 1.313 1.00 0.00 C ATOM 603 OG SER A 37 24.884 -7.460 0.655 1.00 0.00 O ATOM 0 H SER A 37 25.477 -11.443 1.781 1.00 0.00 H new ATOM 0 HA SER A 37 24.944 -9.726 -0.555 1.00 0.00 H new ATOM 0 HB2 SER A 37 23.703 -8.893 1.535 1.00 0.00 H new ATOM 0 HB3 SER A 37 25.280 -8.671 2.267 1.00 0.00 H new ATOM 0 HG SER A 37 24.519 -6.750 1.224 1.00 0.00 H new ATOM 609 N GLY A 38 27.432 -8.792 -0.081 1.00 0.00 N ATOM 610 CA GLY A 38 28.863 -8.582 -0.202 1.00 0.00 C ATOM 611 C GLY A 38 29.205 -7.196 0.333 1.00 0.00 C ATOM 612 O GLY A 38 28.317 -6.413 0.681 1.00 0.00 O ATOM 0 H GLY A 38 26.892 -7.999 -0.427 1.00 0.00 H new ATOM 0 HA2 GLY A 38 29.405 -9.346 0.356 1.00 0.00 H new ATOM 0 HA3 GLY A 38 29.170 -8.670 -1.244 1.00 0.00 H new ATOM 616 N SER A 39 30.492 -6.898 0.429 1.00 0.00 N ATOM 617 CA SER A 39 31.029 -5.632 0.902 1.00 0.00 C ATOM 618 C SER A 39 32.347 -5.390 0.157 1.00 0.00 C ATOM 619 O SER A 39 32.789 -6.244 -0.618 1.00 0.00 O ATOM 620 CB SER A 39 31.169 -5.662 2.435 1.00 0.00 C ATOM 621 OG SER A 39 31.703 -6.887 2.906 1.00 0.00 O ATOM 0 H SER A 39 31.222 -7.561 0.168 1.00 0.00 H new ATOM 0 HA SER A 39 30.364 -4.794 0.691 1.00 0.00 H new ATOM 0 HB2 SER A 39 31.812 -4.842 2.754 1.00 0.00 H new ATOM 0 HB3 SER A 39 30.192 -5.496 2.889 1.00 0.00 H new ATOM 0 HG SER A 39 31.775 -6.858 3.883 1.00 0.00 H new ATOM 627 N GLY A 40 32.978 -4.236 0.356 1.00 0.00 N ATOM 628 CA GLY A 40 34.226 -3.879 -0.294 1.00 0.00 C ATOM 629 C GLY A 40 34.474 -2.389 -0.108 1.00 0.00 C ATOM 630 O GLY A 40 33.824 -1.750 0.719 1.00 0.00 O ATOM 0 H GLY A 40 32.627 -3.514 0.985 1.00 0.00 H new ATOM 0 HA2 GLY A 40 35.049 -4.453 0.131 1.00 0.00 H new ATOM 0 HA3 GLY A 40 34.181 -4.123 -1.355 1.00 0.00 H new ATOM 634 N SER A 41 35.448 -1.849 -0.833 1.00 0.00 N ATOM 635 CA SER A 41 35.818 -0.446 -0.801 1.00 0.00 C ATOM 636 C SER A 41 36.333 -0.091 -2.196 1.00 0.00 C ATOM 637 O SER A 41 36.834 -0.964 -2.911 1.00 0.00 O ATOM 638 CB SER A 41 36.879 -0.237 0.288 1.00 0.00 C ATOM 639 OG SER A 41 37.123 1.138 0.508 1.00 0.00 O ATOM 0 H SER A 41 36.017 -2.397 -1.478 1.00 0.00 H new ATOM 0 HA SER A 41 34.978 0.204 -0.557 1.00 0.00 H new ATOM 0 HB2 SER A 41 36.548 -0.703 1.216 1.00 0.00 H new ATOM 0 HB3 SER A 41 37.806 -0.731 -0.004 1.00 0.00 H new ATOM 0 HG SER A 41 37.801 1.242 1.208 1.00 0.00 H new ATOM 645 N GLY A 42 36.227 1.179 -2.579 1.00 0.00 N ATOM 646 CA GLY A 42 36.660 1.693 -3.867 1.00 0.00 C ATOM 647 C GLY A 42 35.798 2.882 -4.280 1.00 0.00 C ATOM 648 O GLY A 42 34.735 3.134 -3.711 1.00 0.00 O ATOM 0 H GLY A 42 35.824 1.898 -1.979 1.00 0.00 H new ATOM 0 HA2 GLY A 42 37.706 1.995 -3.813 1.00 0.00 H new ATOM 0 HA3 GLY A 42 36.594 0.908 -4.620 1.00 0.00 H new ATOM 652 N SER A 43 36.262 3.636 -5.271 1.00 0.00 N ATOM 653 CA SER A 43 35.579 4.805 -5.796 1.00 0.00 C ATOM 654 C SER A 43 34.493 4.378 -6.785 1.00 0.00 C ATOM 655 O SER A 43 34.826 3.812 -7.828 1.00 0.00 O ATOM 656 CB SER A 43 36.624 5.689 -6.492 1.00 0.00 C ATOM 657 OG SER A 43 37.464 4.909 -7.328 1.00 0.00 O ATOM 0 H SER A 43 37.146 3.443 -5.741 1.00 0.00 H new ATOM 0 HA SER A 43 35.098 5.360 -4.990 1.00 0.00 H new ATOM 0 HB2 SER A 43 36.123 6.455 -7.084 1.00 0.00 H new ATOM 0 HB3 SER A 43 37.226 6.206 -5.745 1.00 0.00 H new ATOM 0 HG SER A 43 36.923 4.250 -7.811 1.00 0.00 H new ATOM 663 N GLY A 44 33.218 4.661 -6.502 1.00 0.00 N ATOM 664 CA GLY A 44 32.129 4.310 -7.402 1.00 0.00 C ATOM 665 C GLY A 44 30.823 4.140 -6.646 1.00 0.00 C ATOM 666 O GLY A 44 30.147 5.128 -6.370 1.00 0.00 O ATOM 0 H GLY A 44 32.919 5.135 -5.650 1.00 0.00 H new ATOM 0 HA2 GLY A 44 32.015 5.086 -8.159 1.00 0.00 H new ATOM 0 HA3 GLY A 44 32.371 3.386 -7.927 1.00 0.00 H new ATOM 670 N SER A 45 30.476 2.890 -6.325 1.00 0.00 N ATOM 671 CA SER A 45 29.262 2.480 -5.617 1.00 0.00 C ATOM 672 C SER A 45 27.941 2.781 -6.349 1.00 0.00 C ATOM 673 O SER A 45 26.875 2.425 -5.836 1.00 0.00 O ATOM 674 CB SER A 45 29.267 3.012 -4.171 1.00 0.00 C ATOM 675 OG SER A 45 29.441 1.933 -3.271 1.00 0.00 O ATOM 0 H SER A 45 31.067 2.095 -6.566 1.00 0.00 H new ATOM 0 HA SER A 45 29.296 1.391 -5.590 1.00 0.00 H new ATOM 0 HB2 SER A 45 30.069 3.739 -4.043 1.00 0.00 H new ATOM 0 HB3 SER A 45 28.331 3.529 -3.959 1.00 0.00 H new ATOM 0 HG SER A 45 29.446 2.272 -2.351 1.00 0.00 H new ATOM 681 N GLY A 46 27.977 3.383 -7.538 1.00 0.00 N ATOM 682 CA GLY A 46 26.784 3.696 -8.305 1.00 0.00 C ATOM 683 C GLY A 46 26.086 2.419 -8.770 1.00 0.00 C ATOM 684 O GLY A 46 26.731 1.398 -9.025 1.00 0.00 O ATOM 0 H GLY A 46 28.844 3.667 -7.994 1.00 0.00 H new ATOM 0 HA2 GLY A 46 26.100 4.288 -7.697 1.00 0.00 H new ATOM 0 HA3 GLY A 46 27.051 4.305 -9.169 1.00 0.00 H new ATOM 688 N SER A 47 24.762 2.493 -8.862 1.00 0.00 N ATOM 689 CA SER A 47 23.826 1.458 -9.282 1.00 0.00 C ATOM 690 C SER A 47 22.417 2.063 -9.198 1.00 0.00 C ATOM 691 O SER A 47 22.237 3.101 -8.548 1.00 0.00 O ATOM 692 CB SER A 47 23.973 0.184 -8.432 1.00 0.00 C ATOM 693 OG SER A 47 24.255 0.452 -7.066 1.00 0.00 O ATOM 0 H SER A 47 24.274 3.356 -8.623 1.00 0.00 H new ATOM 0 HA SER A 47 24.031 1.143 -10.305 1.00 0.00 H new ATOM 0 HB2 SER A 47 23.054 -0.398 -8.499 1.00 0.00 H new ATOM 0 HB3 SER A 47 24.771 -0.432 -8.847 1.00 0.00 H new ATOM 0 HG SER A 47 24.336 -0.393 -6.577 1.00 0.00 H new ATOM 699 N GLY A 48 21.413 1.429 -9.804 1.00 0.00 N ATOM 700 CA GLY A 48 20.042 1.913 -9.801 1.00 0.00 C ATOM 701 C GLY A 48 19.133 1.005 -10.626 1.00 0.00 C ATOM 702 O GLY A 48 19.544 -0.091 -11.022 1.00 0.00 O ATOM 0 H GLY A 48 21.536 0.555 -10.315 1.00 0.00 H new ATOM 0 HA2 GLY A 48 19.674 1.965 -8.776 1.00 0.00 H new ATOM 0 HA3 GLY A 48 20.010 2.926 -10.203 1.00 0.00 H new ATOM 706 N SER A 49 17.884 1.421 -10.840 1.00 0.00 N ATOM 707 CA SER A 49 16.891 0.676 -11.614 1.00 0.00 C ATOM 708 C SER A 49 15.857 1.624 -12.221 1.00 0.00 C ATOM 709 O SER A 49 15.706 1.671 -13.446 1.00 0.00 O ATOM 710 CB SER A 49 16.214 -0.402 -10.753 1.00 0.00 C ATOM 711 OG SER A 49 15.702 0.111 -9.536 1.00 0.00 O ATOM 0 H SER A 49 17.528 2.303 -10.473 1.00 0.00 H new ATOM 0 HA SER A 49 17.408 0.171 -12.430 1.00 0.00 H new ATOM 0 HB2 SER A 49 15.402 -0.857 -11.320 1.00 0.00 H new ATOM 0 HB3 SER A 49 16.933 -1.192 -10.536 1.00 0.00 H new ATOM 0 HG SER A 49 15.281 -0.613 -9.027 1.00 0.00 H new ATOM 717 N GLY A 50 15.181 2.414 -11.388 1.00 0.00 N ATOM 718 CA GLY A 50 14.153 3.379 -11.747 1.00 0.00 C ATOM 719 C GLY A 50 13.710 4.139 -10.498 1.00 0.00 C ATOM 720 O GLY A 50 14.226 3.891 -9.405 1.00 0.00 O ATOM 0 H GLY A 50 15.350 2.393 -10.382 1.00 0.00 H new ATOM 0 HA2 GLY A 50 14.537 4.075 -12.492 1.00 0.00 H new ATOM 0 HA3 GLY A 50 13.301 2.869 -12.197 1.00 0.00 H new ATOM 724 N SER A 51 12.804 5.094 -10.666 1.00 0.00 N ATOM 725 CA SER A 51 12.226 5.932 -9.622 1.00 0.00 C ATOM 726 C SER A 51 10.784 6.246 -10.043 1.00 0.00 C ATOM 727 O SER A 51 10.371 5.878 -11.147 1.00 0.00 O ATOM 728 CB SER A 51 13.093 7.185 -9.403 1.00 0.00 C ATOM 729 OG SER A 51 13.416 7.833 -10.622 1.00 0.00 O ATOM 0 H SER A 51 12.431 5.318 -11.589 1.00 0.00 H new ATOM 0 HA SER A 51 12.203 5.427 -8.657 1.00 0.00 H new ATOM 0 HB2 SER A 51 12.564 7.881 -8.752 1.00 0.00 H new ATOM 0 HB3 SER A 51 14.012 6.904 -8.889 1.00 0.00 H new ATOM 0 HG SER A 51 13.965 8.623 -10.437 1.00 0.00 H new ATOM 735 N GLY A 52 10.003 6.899 -9.189 1.00 0.00 N ATOM 736 CA GLY A 52 8.614 7.270 -9.427 1.00 0.00 C ATOM 737 C GLY A 52 8.235 8.409 -8.487 1.00 0.00 C ATOM 738 O GLY A 52 9.110 9.105 -7.959 1.00 0.00 O ATOM 0 H GLY A 52 10.336 7.197 -8.272 1.00 0.00 H new ATOM 0 HA2 GLY A 52 8.479 7.577 -10.464 1.00 0.00 H new ATOM 0 HA3 GLY A 52 7.962 6.413 -9.261 1.00 0.00 H new ATOM 742 N SER A 53 6.944 8.676 -8.304 1.00 0.00 N ATOM 743 CA SER A 53 6.463 9.730 -7.420 1.00 0.00 C ATOM 744 C SER A 53 5.071 9.373 -6.911 1.00 0.00 C ATOM 745 O SER A 53 4.227 8.911 -7.682 1.00 0.00 O ATOM 746 CB SER A 53 6.384 11.053 -8.185 1.00 0.00 C ATOM 747 OG SER A 53 7.660 11.502 -8.618 1.00 0.00 O ATOM 0 H SER A 53 6.197 8.161 -8.770 1.00 0.00 H new ATOM 0 HA SER A 53 7.152 9.831 -6.581 1.00 0.00 H new ATOM 0 HB2 SER A 53 5.731 10.932 -9.050 1.00 0.00 H new ATOM 0 HB3 SER A 53 5.931 11.812 -7.548 1.00 0.00 H new ATOM 0 HG SER A 53 8.345 10.858 -8.340 1.00 0.00 H new ATOM 753 N GLY A 54 4.806 9.661 -5.641 1.00 0.00 N ATOM 754 CA GLY A 54 3.540 9.417 -4.974 1.00 0.00 C ATOM 755 C GLY A 54 3.488 10.176 -3.656 1.00 0.00 C ATOM 756 O GLY A 54 4.527 10.615 -3.140 1.00 0.00 O ATOM 0 H GLY A 54 5.499 10.088 -5.026 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.716 9.730 -5.615 1.00 0.00 H new ATOM 0 HA3 GLY A 54 3.415 8.349 -4.793 1.00 0.00 H new ATOM 760 N SER A 55 2.279 10.336 -3.118 1.00 0.00 N ATOM 761 CA SER A 55 2.040 11.010 -1.853 1.00 0.00 C ATOM 762 C SER A 55 1.789 9.930 -0.809 1.00 0.00 C ATOM 763 O SER A 55 1.161 8.903 -1.087 1.00 0.00 O ATOM 764 CB SER A 55 0.827 11.947 -1.966 1.00 0.00 C ATOM 765 OG SER A 55 0.684 12.776 -0.819 1.00 0.00 O ATOM 0 H SER A 55 1.427 9.993 -3.561 1.00 0.00 H new ATOM 0 HA SER A 55 2.897 11.622 -1.572 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.933 12.571 -2.853 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.078 11.354 -2.100 1.00 0.00 H new ATOM 0 HG SER A 55 -0.097 13.357 -0.931 1.00 0.00 H new ATOM 771 N GLY A 56 2.243 10.185 0.406 1.00 0.00 N ATOM 772 CA GLY A 56 2.095 9.318 1.555 1.00 0.00 C ATOM 773 C GLY A 56 1.204 9.979 2.590 1.00 0.00 C ATOM 774 O GLY A 56 0.774 11.122 2.406 1.00 0.00 O ATOM 0 H GLY A 56 2.748 11.044 0.625 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.665 8.364 1.249 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.072 9.103 1.988 1.00 0.00 H new ATOM 778 N SER A 57 0.896 9.251 3.660 1.00 0.00 N ATOM 779 CA SER A 57 0.073 9.751 4.748 1.00 0.00 C ATOM 780 C SER A 57 0.398 8.960 6.011 1.00 0.00 C ATOM 781 O SER A 57 0.763 7.778 5.938 1.00 0.00 O ATOM 782 CB SER A 57 -1.414 9.682 4.362 1.00 0.00 C ATOM 783 OG SER A 57 -1.745 8.468 3.692 1.00 0.00 O ATOM 0 H SER A 57 1.215 8.291 3.794 1.00 0.00 H new ATOM 0 HA SER A 57 0.290 10.801 4.947 1.00 0.00 H new ATOM 0 HB2 SER A 57 -2.025 9.777 5.260 1.00 0.00 H new ATOM 0 HB3 SER A 57 -1.659 10.527 3.719 1.00 0.00 H new ATOM 0 HG SER A 57 -2.699 8.468 3.468 1.00 0.00 H new ATOM 789 N GLY A 58 0.223 9.592 7.168 1.00 0.00 N ATOM 790 CA GLY A 58 0.487 8.966 8.450 1.00 0.00 C ATOM 791 C GLY A 58 1.967 8.686 8.683 1.00 0.00 C ATOM 792 O GLY A 58 2.847 9.180 7.976 1.00 0.00 O ATOM 0 H GLY A 58 -0.107 10.555 7.238 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.115 9.611 9.246 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -0.068 8.030 8.512 1.00 0.00 H new ATOM 796 N TYR A 59 2.238 7.877 9.702 1.00 0.00 N ATOM 797 CA TYR A 59 3.550 7.447 10.171 1.00 0.00 C ATOM 798 C TYR A 59 4.304 6.498 9.209 1.00 0.00 C ATOM 799 O TYR A 59 4.999 5.580 9.665 1.00 0.00 O ATOM 800 CB TYR A 59 3.366 6.848 11.582 1.00 0.00 C ATOM 801 CG TYR A 59 2.539 7.693 12.541 1.00 0.00 C ATOM 802 CD1 TYR A 59 2.779 9.076 12.653 1.00 0.00 C ATOM 803 CD2 TYR A 59 1.511 7.105 13.306 1.00 0.00 C ATOM 804 CE1 TYR A 59 1.986 9.871 13.494 1.00 0.00 C ATOM 805 CE2 TYR A 59 0.705 7.900 14.142 1.00 0.00 C ATOM 806 CZ TYR A 59 0.938 9.289 14.238 1.00 0.00 C ATOM 807 OH TYR A 59 0.145 10.058 15.031 1.00 0.00 O ATOM 0 H TYR A 59 1.488 7.474 10.264 1.00 0.00 H new ATOM 0 HA TYR A 59 4.205 8.317 10.207 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.895 5.870 11.486 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.350 6.686 12.022 1.00 0.00 H new ATOM 0 HD1 TYR A 59 3.580 9.528 12.087 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.341 6.040 13.250 1.00 0.00 H new ATOM 0 HE1 TYR A 59 2.178 10.931 13.572 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -0.093 7.447 14.711 1.00 0.00 H new ATOM 0 HH TYR A 59 -0.526 9.493 15.469 1.00 0.00 H new ATOM 817 N GLN A3288 4.142 6.641 7.890 1.00 0.00 N ATOM 818 CA GLN A3288 4.816 5.810 6.893 1.00 0.00 C ATOM 819 C GLN A3288 6.283 6.242 6.706 1.00 0.00 C ATOM 820 O GLN A3288 6.782 7.120 7.414 1.00 0.00 O ATOM 821 CB GLN A3288 3.986 5.756 5.599 1.00 0.00 C ATOM 822 CG GLN A3288 3.924 7.048 4.781 1.00 0.00 C ATOM 823 CD GLN A3288 3.235 6.757 3.450 1.00 0.00 C ATOM 824 OE1 GLN A3288 2.061 6.400 3.399 1.00 0.00 O ATOM 825 NE2 GLN A3288 3.943 6.868 2.344 1.00 0.00 N ATOM 0 H GLN A3288 3.530 7.347 7.481 1.00 0.00 H new ATOM 0 HA GLN A3288 4.877 4.781 7.248 1.00 0.00 H new ATOM 0 HB2 GLN A3288 4.392 4.968 4.964 1.00 0.00 H new ATOM 0 HB3 GLN A3288 2.968 5.465 5.857 1.00 0.00 H new ATOM 0 HG2 GLN A3288 3.377 7.815 5.329 1.00 0.00 H new ATOM 0 HG3 GLN A3288 4.929 7.434 4.609 1.00 0.00 H new ATOM 0 HE21 GLN A3288 4.918 7.165 2.390 1.00 0.00 H new ATOM 0 HE22 GLN A3288 3.516 6.657 1.442 1.00 0.00 H new ATOM 834 N ILE A3289 6.988 5.615 5.757 1.00 0.00 N ATOM 835 CA ILE A3289 8.389 5.871 5.437 1.00 0.00 C ATOM 836 C ILE A3289 8.445 6.382 3.992 1.00 0.00 C ATOM 837 O ILE A3289 8.608 5.625 3.036 1.00 0.00 O ATOM 838 CB ILE A3289 9.266 4.619 5.704 1.00 0.00 C ATOM 839 CG1 ILE A3289 8.925 3.923 7.044 1.00 0.00 C ATOM 840 CG2 ILE A3289 10.745 5.049 5.695 1.00 0.00 C ATOM 841 CD1 ILE A3289 9.650 2.589 7.257 1.00 0.00 C ATOM 0 H ILE A3289 6.578 4.888 5.171 1.00 0.00 H new ATOM 0 HA ILE A3289 8.812 6.637 6.087 1.00 0.00 H new ATOM 0 HB ILE A3289 9.066 3.891 4.918 1.00 0.00 H new ATOM 0 HG12 ILE A3289 9.175 4.595 7.865 1.00 0.00 H new ATOM 0 HG13 ILE A3289 7.850 3.751 7.089 1.00 0.00 H new ATOM 0 HG21 ILE A3289 11.377 4.181 5.881 1.00 0.00 H new ATOM 0 HG22 ILE A3289 10.993 5.477 4.724 1.00 0.00 H new ATOM 0 HG23 ILE A3289 10.912 5.793 6.473 1.00 0.00 H new ATOM 0 HD11 ILE A3289 9.358 2.165 8.218 1.00 0.00 H new ATOM 0 HD12 ILE A3289 9.381 1.897 6.459 1.00 0.00 H new ATOM 0 HD13 ILE A3289 10.727 2.755 7.246 1.00 0.00 H new ATOM 853 N GLU A3290 8.323 7.699 3.842 1.00 0.00 N ATOM 854 CA GLU A3290 8.324 8.413 2.563 1.00 0.00 C ATOM 855 C GLU A3290 9.625 8.305 1.754 1.00 0.00 C ATOM 856 O GLU A3290 9.688 8.667 0.581 1.00 0.00 O ATOM 857 CB GLU A3290 8.073 9.900 2.862 1.00 0.00 C ATOM 858 CG GLU A3290 7.281 10.547 1.727 1.00 0.00 C ATOM 859 CD GLU A3290 5.775 10.339 1.915 1.00 0.00 C ATOM 860 OE1 GLU A3290 5.367 9.244 2.366 1.00 0.00 O ATOM 861 OE2 GLU A3290 5.002 11.310 1.727 1.00 0.00 O ATOM 0 H GLU A3290 8.216 8.325 4.640 1.00 0.00 H new ATOM 0 HA GLU A3290 7.551 7.949 1.951 1.00 0.00 H new ATOM 0 HB2 GLU A3290 7.526 10.001 3.799 1.00 0.00 H new ATOM 0 HB3 GLU A3290 9.024 10.417 2.991 1.00 0.00 H new ATOM 0 HG2 GLU A3290 7.502 11.614 1.688 1.00 0.00 H new ATOM 0 HG3 GLU A3290 7.593 10.122 0.773 1.00 0.00 H new ATOM 868 N THR A3291 10.671 7.785 2.371 1.00 0.00 N ATOM 869 CA THR A3291 12.004 7.620 1.805 1.00 0.00 C ATOM 870 C THR A3291 12.446 6.152 1.841 1.00 0.00 C ATOM 871 O THR A3291 13.567 5.822 2.238 1.00 0.00 O ATOM 872 CB THR A3291 12.905 8.658 2.497 1.00 0.00 C ATOM 873 OG1 THR A3291 14.235 8.685 2.023 1.00 0.00 O ATOM 874 CG2 THR A3291 12.958 8.512 4.019 1.00 0.00 C ATOM 0 H THR A3291 10.613 7.448 3.332 1.00 0.00 H new ATOM 0 HA THR A3291 12.055 7.830 0.737 1.00 0.00 H new ATOM 0 HB THR A3291 12.416 9.596 2.235 1.00 0.00 H new ATOM 0 HG1 THR A3291 14.569 7.768 1.932 1.00 0.00 H new ATOM 0 HG21 THR A3291 13.612 9.278 4.435 1.00 0.00 H new ATOM 0 HG22 THR A3291 11.955 8.628 4.431 1.00 0.00 H new ATOM 0 HG23 THR A3291 13.344 7.526 4.277 1.00 0.00 H new ATOM 882 N PHE A3292 11.534 5.246 1.494 1.00 0.00 N ATOM 883 CA PHE A3292 11.789 3.818 1.463 1.00 0.00 C ATOM 884 C PHE A3292 10.917 3.142 0.414 1.00 0.00 C ATOM 885 O PHE A3292 11.449 2.488 -0.481 1.00 0.00 O ATOM 886 CB PHE A3292 11.544 3.223 2.857 1.00 0.00 C ATOM 887 CG PHE A3292 11.849 1.741 3.009 1.00 0.00 C ATOM 888 CD1 PHE A3292 12.966 1.158 2.379 1.00 0.00 C ATOM 889 CD2 PHE A3292 11.020 0.937 3.813 1.00 0.00 C ATOM 890 CE1 PHE A3292 13.231 -0.210 2.538 1.00 0.00 C ATOM 891 CE2 PHE A3292 11.280 -0.436 3.962 1.00 0.00 C ATOM 892 CZ PHE A3292 12.390 -1.013 3.325 1.00 0.00 C ATOM 0 H PHE A3292 10.582 5.494 1.223 1.00 0.00 H new ATOM 0 HA PHE A3292 12.829 3.643 1.188 1.00 0.00 H new ATOM 0 HB2 PHE A3292 12.148 3.774 3.578 1.00 0.00 H new ATOM 0 HB3 PHE A3292 10.500 3.389 3.123 1.00 0.00 H new ATOM 0 HD1 PHE A3292 13.620 1.766 1.772 1.00 0.00 H new ATOM 0 HD2 PHE A3292 10.176 1.379 4.321 1.00 0.00 H new ATOM 0 HE1 PHE A3292 14.089 -0.649 2.051 1.00 0.00 H new ATOM 0 HE2 PHE A3292 10.626 -1.047 4.566 1.00 0.00 H new ATOM 0 HZ PHE A3292 12.596 -2.067 3.439 1.00 0.00 H new ATOM 902 N PHE A3293 9.600 3.366 0.466 1.00 0.00 N ATOM 903 CA PHE A3293 8.655 2.741 -0.455 1.00 0.00 C ATOM 904 C PHE A3293 7.687 3.682 -1.165 1.00 0.00 C ATOM 905 O PHE A3293 6.776 3.201 -1.838 1.00 0.00 O ATOM 906 CB PHE A3293 7.925 1.628 0.319 1.00 0.00 C ATOM 907 CG PHE A3293 7.474 1.965 1.732 1.00 0.00 C ATOM 908 CD1 PHE A3293 7.828 1.117 2.798 1.00 0.00 C ATOM 909 CD2 PHE A3293 6.747 3.140 1.998 1.00 0.00 C ATOM 910 CE1 PHE A3293 7.446 1.437 4.111 1.00 0.00 C ATOM 911 CE2 PHE A3293 6.365 3.457 3.308 1.00 0.00 C ATOM 912 CZ PHE A3293 6.695 2.594 4.368 1.00 0.00 C ATOM 0 H PHE A3293 9.163 3.986 1.148 1.00 0.00 H new ATOM 0 HA PHE A3293 9.231 2.339 -1.289 1.00 0.00 H new ATOM 0 HB2 PHE A3293 7.048 1.331 -0.257 1.00 0.00 H new ATOM 0 HB3 PHE A3293 8.582 0.760 0.369 1.00 0.00 H new ATOM 0 HD1 PHE A3293 8.395 0.218 2.606 1.00 0.00 H new ATOM 0 HD2 PHE A3293 6.482 3.802 1.187 1.00 0.00 H new ATOM 0 HE1 PHE A3293 7.732 0.789 4.927 1.00 0.00 H new ATOM 0 HE2 PHE A3293 5.816 4.366 3.504 1.00 0.00 H new ATOM 0 HZ PHE A3293 6.372 2.820 5.374 1.00 0.00 H new ATOM 922 N ALA A3294 7.835 5.003 -1.044 1.00 0.00 N ATOM 923 CA ALA A3294 6.940 5.969 -1.682 1.00 0.00 C ATOM 924 C ALA A3294 6.763 5.725 -3.189 1.00 0.00 C ATOM 925 O ALA A3294 5.711 6.036 -3.744 1.00 0.00 O ATOM 926 CB ALA A3294 7.423 7.385 -1.401 1.00 0.00 C ATOM 0 H ALA A3294 8.582 5.434 -0.499 1.00 0.00 H new ATOM 0 HA ALA A3294 5.951 5.834 -1.244 1.00 0.00 H new ATOM 0 HB1 ALA A3294 6.753 8.100 -1.879 1.00 0.00 H new ATOM 0 HB2 ALA A3294 7.432 7.559 -0.325 1.00 0.00 H new ATOM 0 HB3 ALA A3294 8.430 7.511 -1.798 1.00 0.00 H new ATOM 932 N GLN A3295 7.780 5.152 -3.843 1.00 0.00 N ATOM 933 CA GLN A3295 7.746 4.853 -5.270 1.00 0.00 C ATOM 934 C GLN A3295 6.730 3.743 -5.577 1.00 0.00 C ATOM 935 O GLN A3295 6.152 3.742 -6.657 1.00 0.00 O ATOM 936 CB GLN A3295 9.143 4.454 -5.779 1.00 0.00 C ATOM 937 CG GLN A3295 10.332 5.285 -5.270 1.00 0.00 C ATOM 938 CD GLN A3295 10.343 6.717 -5.791 1.00 0.00 C ATOM 939 OE1 GLN A3295 11.176 7.071 -6.620 1.00 0.00 O ATOM 940 NE2 GLN A3295 9.431 7.572 -5.357 1.00 0.00 N ATOM 0 H GLN A3295 8.653 4.883 -3.389 1.00 0.00 H new ATOM 0 HA GLN A3295 7.433 5.757 -5.791 1.00 0.00 H new ATOM 0 HB2 GLN A3295 9.317 3.412 -5.510 1.00 0.00 H new ATOM 0 HB3 GLN A3295 9.135 4.505 -6.868 1.00 0.00 H new ATOM 0 HG2 GLN A3295 10.311 5.304 -4.180 1.00 0.00 H new ATOM 0 HG3 GLN A3295 11.260 4.794 -5.563 1.00 0.00 H new ATOM 0 HE21 GLN A3295 8.740 7.275 -4.668 1.00 0.00 H new ATOM 0 HE22 GLN A3295 9.419 8.528 -5.711 1.00 0.00 H new ATOM 949 N ASP A3296 6.655 2.698 -4.744 1.00 0.00 N ATOM 950 CA ASP A3296 5.702 1.584 -4.893 1.00 0.00 C ATOM 951 C ASP A3296 4.329 1.958 -4.330 1.00 0.00 C ATOM 952 O ASP A3296 3.296 1.466 -4.763 1.00 0.00 O ATOM 953 CB ASP A3296 6.240 0.320 -4.225 1.00 0.00 C ATOM 954 CG ASP A3296 5.279 -0.869 -4.321 1.00 0.00 C ATOM 955 OD1 ASP A3296 5.046 -1.501 -3.263 1.00 0.00 O ATOM 956 OD2 ASP A3296 4.890 -1.271 -5.437 1.00 0.00 O ATOM 0 H ASP A3296 7.264 2.598 -3.932 1.00 0.00 H new ATOM 0 HA ASP A3296 5.583 1.381 -5.957 1.00 0.00 H new ATOM 0 HB2 ASP A3296 7.190 0.049 -4.686 1.00 0.00 H new ATOM 0 HB3 ASP A3296 6.444 0.530 -3.175 1.00 0.00 H new ATOM 961 N ILE A3297 4.299 2.860 -3.350 1.00 0.00 N ATOM 962 CA ILE A3297 3.086 3.326 -2.688 1.00 0.00 C ATOM 963 C ILE A3297 2.084 3.879 -3.698 1.00 0.00 C ATOM 964 O ILE A3297 0.878 3.692 -3.511 1.00 0.00 O ATOM 965 CB ILE A3297 3.491 4.351 -1.605 1.00 0.00 C ATOM 966 CG1 ILE A3297 3.292 3.818 -0.178 1.00 0.00 C ATOM 967 CG2 ILE A3297 2.832 5.730 -1.783 1.00 0.00 C ATOM 968 CD1 ILE A3297 4.049 2.519 0.118 1.00 0.00 C ATOM 0 H ILE A3297 5.145 3.299 -2.985 1.00 0.00 H new ATOM 0 HA ILE A3297 2.572 2.497 -2.201 1.00 0.00 H new ATOM 0 HB ILE A3297 4.561 4.500 -1.752 1.00 0.00 H new ATOM 0 HG12 ILE A3297 3.612 4.582 0.531 1.00 0.00 H new ATOM 0 HG13 ILE A3297 2.228 3.652 -0.009 1.00 0.00 H new ATOM 0 HG21 ILE A3297 3.163 6.397 -0.987 1.00 0.00 H new ATOM 0 HG22 ILE A3297 3.118 6.148 -2.748 1.00 0.00 H new ATOM 0 HG23 ILE A3297 1.748 5.624 -1.740 1.00 0.00 H new ATOM 0 HD11 ILE A3297 3.855 2.211 1.145 1.00 0.00 H new ATOM 0 HD12 ILE A3297 3.713 1.738 -0.565 1.00 0.00 H new ATOM 0 HD13 ILE A3297 5.118 2.682 -0.016 1.00 0.00 H new ATOM 980 N GLU A3298 2.573 4.588 -4.721 1.00 0.00 N ATOM 981 CA GLU A3298 1.714 5.152 -5.753 1.00 0.00 C ATOM 982 C GLU A3298 1.032 4.004 -6.481 1.00 0.00 C ATOM 983 O GLU A3298 -0.137 4.085 -6.813 1.00 0.00 O ATOM 984 CB GLU A3298 2.498 6.070 -6.713 1.00 0.00 C ATOM 985 CG GLU A3298 3.540 5.403 -7.633 1.00 0.00 C ATOM 986 CD GLU A3298 3.042 5.084 -9.051 1.00 0.00 C ATOM 987 OE1 GLU A3298 2.813 6.006 -9.867 1.00 0.00 O ATOM 988 OE2 GLU A3298 2.915 3.886 -9.405 1.00 0.00 O ATOM 0 H GLU A3298 3.566 4.782 -4.851 1.00 0.00 H new ATOM 0 HA GLU A3298 0.957 5.789 -5.296 1.00 0.00 H new ATOM 0 HB2 GLU A3298 1.778 6.594 -7.342 1.00 0.00 H new ATOM 0 HB3 GLU A3298 3.009 6.825 -6.116 1.00 0.00 H new ATOM 0 HG2 GLU A3298 4.409 6.057 -7.707 1.00 0.00 H new ATOM 0 HG3 GLU A3298 3.877 4.478 -7.165 1.00 0.00 H new ATOM 995 N SER A3299 1.744 2.909 -6.688 1.00 0.00 N ATOM 996 CA SER A3299 1.283 1.727 -7.376 1.00 0.00 C ATOM 997 C SER A3299 0.223 1.010 -6.540 1.00 0.00 C ATOM 998 O SER A3299 -0.817 0.614 -7.069 1.00 0.00 O ATOM 999 CB SER A3299 2.509 0.864 -7.683 1.00 0.00 C ATOM 1000 OG SER A3299 3.604 1.655 -8.128 1.00 0.00 O ATOM 0 H SER A3299 2.707 2.822 -6.362 1.00 0.00 H new ATOM 0 HA SER A3299 0.794 1.972 -8.319 1.00 0.00 H new ATOM 0 HB2 SER A3299 2.798 0.310 -6.790 1.00 0.00 H new ATOM 0 HB3 SER A3299 2.256 0.129 -8.447 1.00 0.00 H new ATOM 0 HG SER A3299 3.280 2.344 -8.745 1.00 0.00 H new ATOM 1006 N VAL A3300 0.450 0.908 -5.231 1.00 0.00 N ATOM 1007 CA VAL A3300 -0.455 0.275 -4.284 1.00 0.00 C ATOM 1008 C VAL A3300 -1.745 1.094 -4.241 1.00 0.00 C ATOM 1009 O VAL A3300 -2.835 0.539 -4.366 1.00 0.00 O ATOM 1010 CB VAL A3300 0.238 0.184 -2.906 1.00 0.00 C ATOM 1011 CG1 VAL A3300 -0.728 -0.244 -1.792 1.00 0.00 C ATOM 1012 CG2 VAL A3300 1.407 -0.809 -2.962 1.00 0.00 C ATOM 0 H VAL A3300 1.294 1.275 -4.792 1.00 0.00 H new ATOM 0 HA VAL A3300 -0.708 -0.742 -4.584 1.00 0.00 H new ATOM 0 HB VAL A3300 0.603 1.184 -2.672 1.00 0.00 H new ATOM 0 HG11 VAL A3300 -0.192 -0.293 -0.844 1.00 0.00 H new ATOM 0 HG12 VAL A3300 -1.538 0.482 -1.714 1.00 0.00 H new ATOM 0 HG13 VAL A3300 -1.141 -1.225 -2.026 1.00 0.00 H new ATOM 0 HG21 VAL A3300 1.886 -0.863 -1.984 1.00 0.00 H new ATOM 0 HG22 VAL A3300 1.034 -1.795 -3.238 1.00 0.00 H new ATOM 0 HG23 VAL A3300 2.133 -0.475 -3.704 1.00 0.00 H new ATOM 1022 N GLN A3301 -1.654 2.418 -4.070 1.00 0.00 N ATOM 1023 CA GLN A3301 -2.861 3.237 -4.015 1.00 0.00 C ATOM 1024 C GLN A3301 -3.549 3.243 -5.378 1.00 0.00 C ATOM 1025 O GLN A3301 -4.776 3.302 -5.409 1.00 0.00 O ATOM 1026 CB GLN A3301 -2.605 4.623 -3.406 1.00 0.00 C ATOM 1027 CG GLN A3301 -1.891 5.627 -4.311 1.00 0.00 C ATOM 1028 CD GLN A3301 -2.806 6.622 -5.043 1.00 0.00 C ATOM 1029 OE1 GLN A3301 -2.443 7.783 -5.202 1.00 0.00 O ATOM 1030 NE2 GLN A3301 -3.988 6.228 -5.491 1.00 0.00 N ATOM 0 H GLN A3301 -0.778 2.931 -3.970 1.00 0.00 H new ATOM 0 HA GLN A3301 -3.569 2.787 -3.319 1.00 0.00 H new ATOM 0 HB2 GLN A3301 -3.562 5.050 -3.106 1.00 0.00 H new ATOM 0 HB3 GLN A3301 -2.014 4.497 -2.499 1.00 0.00 H new ATOM 0 HG2 GLN A3301 -1.178 6.190 -3.709 1.00 0.00 H new ATOM 0 HG3 GLN A3301 -1.315 5.075 -5.054 1.00 0.00 H new ATOM 0 HE21 GLN A3301 -4.288 5.262 -5.358 1.00 0.00 H new ATOM 0 HE22 GLN A3301 -4.599 6.890 -5.969 1.00 0.00 H new ATOM 1039 N LYS A3302 -2.796 3.176 -6.481 1.00 0.00 N ATOM 1040 CA LYS A3302 -3.331 3.141 -7.842 1.00 0.00 C ATOM 1041 C LYS A3302 -4.150 1.869 -8.015 1.00 0.00 C ATOM 1042 O LYS A3302 -5.058 1.842 -8.840 1.00 0.00 O ATOM 1043 CB LYS A3302 -2.207 3.252 -8.888 1.00 0.00 C ATOM 1044 CG LYS A3302 -1.900 4.727 -9.184 1.00 0.00 C ATOM 1045 CD LYS A3302 -0.535 4.998 -9.829 1.00 0.00 C ATOM 1046 CE LYS A3302 -0.235 4.199 -11.100 1.00 0.00 C ATOM 1047 NZ LYS A3302 1.106 4.532 -11.622 1.00 0.00 N ATOM 0 H LYS A3302 -1.777 3.144 -6.450 1.00 0.00 H new ATOM 0 HA LYS A3302 -3.981 4.002 -8.002 1.00 0.00 H new ATOM 0 HB2 LYS A3302 -1.310 2.753 -8.522 1.00 0.00 H new ATOM 0 HB3 LYS A3302 -2.503 2.744 -9.806 1.00 0.00 H new ATOM 0 HG2 LYS A3302 -2.677 5.118 -9.841 1.00 0.00 H new ATOM 0 HG3 LYS A3302 -1.960 5.287 -8.251 1.00 0.00 H new ATOM 0 HD2 LYS A3302 -0.469 6.060 -10.065 1.00 0.00 H new ATOM 0 HD3 LYS A3302 0.242 4.785 -9.095 1.00 0.00 H new ATOM 0 HE2 LYS A3302 -0.293 3.132 -10.887 1.00 0.00 H new ATOM 0 HE3 LYS A3302 -0.989 4.414 -11.857 1.00 0.00 H new ATOM 0 HZ1 LYS A3302 1.021 4.885 -12.597 1.00 0.00 H new ATOM 0 HZ2 LYS A3302 1.539 5.265 -11.025 1.00 0.00 H new ATOM 0 HZ3 LYS A3302 1.703 3.681 -11.612 1.00 0.00 H new ATOM 1061 N GLU A3303 -3.836 0.797 -7.289 1.00 0.00 N ATOM 1062 CA GLU A3303 -4.590 -0.445 -7.384 1.00 0.00 C ATOM 1063 C GLU A3303 -5.947 -0.211 -6.704 1.00 0.00 C ATOM 1064 O GLU A3303 -6.987 -0.597 -7.223 1.00 0.00 O ATOM 1065 CB GLU A3303 -3.793 -1.655 -6.802 1.00 0.00 C ATOM 1066 CG GLU A3303 -4.422 -2.293 -5.541 1.00 0.00 C ATOM 1067 CD GLU A3303 -3.853 -3.624 -5.046 1.00 0.00 C ATOM 1068 OE1 GLU A3303 -2.885 -4.179 -5.607 1.00 0.00 O ATOM 1069 OE2 GLU A3303 -4.437 -4.141 -4.056 1.00 0.00 O ATOM 0 H GLU A3303 -3.061 0.767 -6.627 1.00 0.00 H new ATOM 0 HA GLU A3303 -4.761 -0.717 -8.425 1.00 0.00 H new ATOM 0 HB2 GLU A3303 -3.703 -2.419 -7.574 1.00 0.00 H new ATOM 0 HB3 GLU A3303 -2.782 -1.325 -6.561 1.00 0.00 H new ATOM 0 HG2 GLU A3303 -4.341 -1.573 -4.727 1.00 0.00 H new ATOM 0 HG3 GLU A3303 -5.485 -2.436 -5.735 1.00 0.00 H new ATOM 1076 N LEU A3304 -5.962 0.481 -5.567 1.00 0.00 N ATOM 1077 CA LEU A3304 -7.163 0.730 -4.782 1.00 0.00 C ATOM 1078 C LEU A3304 -8.103 1.827 -5.245 1.00 0.00 C ATOM 1079 O LEU A3304 -9.298 1.738 -4.984 1.00 0.00 O ATOM 1080 CB LEU A3304 -6.730 1.119 -3.378 1.00 0.00 C ATOM 1081 CG LEU A3304 -5.926 0.066 -2.605 1.00 0.00 C ATOM 1082 CD1 LEU A3304 -5.932 0.516 -1.157 1.00 0.00 C ATOM 1083 CD2 LEU A3304 -6.494 -1.347 -2.667 1.00 0.00 C ATOM 0 H LEU A3304 -5.122 0.891 -5.160 1.00 0.00 H new ATOM 0 HA LEU A3304 -7.726 -0.199 -4.873 1.00 0.00 H new ATOM 0 HB2 LEU A3304 -6.132 2.028 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A3304 -7.621 1.364 -2.799 1.00 0.00 H new ATOM 0 HG LEU A3304 -4.936 0.004 -3.056 1.00 0.00 H new ATOM 0 HD11 LEU A3304 -5.372 -0.197 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU A3304 -5.469 1.500 -1.080 1.00 0.00 H new ATOM 0 HD13 LEU A3304 -6.959 0.569 -0.797 1.00 0.00 H new ATOM 0 HD21 LEU A3304 -5.858 -2.020 -2.092 1.00 0.00 H new ATOM 0 HD22 LEU A3304 -7.501 -1.353 -2.249 1.00 0.00 H new ATOM 0 HD23 LEU A3304 -6.530 -1.680 -3.704 1.00 0.00 H new ATOM 1095 N GLU A3305 -7.608 2.876 -5.882 1.00 0.00 N ATOM 1096 CA GLU A3305 -8.461 3.975 -6.350 1.00 0.00 C ATOM 1097 C GLU A3305 -9.471 3.536 -7.416 1.00 0.00 C ATOM 1098 O GLU A3305 -10.367 4.310 -7.762 1.00 0.00 O ATOM 1099 CB GLU A3305 -7.622 5.170 -6.807 1.00 0.00 C ATOM 1100 CG GLU A3305 -6.674 4.734 -7.921 1.00 0.00 C ATOM 1101 CD GLU A3305 -5.837 5.888 -8.491 1.00 0.00 C ATOM 1102 OE1 GLU A3305 -5.427 5.785 -9.669 1.00 0.00 O ATOM 1103 OE2 GLU A3305 -5.541 6.859 -7.752 1.00 0.00 O ATOM 0 H GLU A3305 -6.617 2.997 -6.091 1.00 0.00 H new ATOM 0 HA GLU A3305 -9.056 4.297 -5.495 1.00 0.00 H new ATOM 0 HB2 GLU A3305 -8.272 5.970 -7.161 1.00 0.00 H new ATOM 0 HB3 GLU A3305 -7.053 5.570 -5.968 1.00 0.00 H new ATOM 0 HG2 GLU A3305 -6.005 3.963 -7.539 1.00 0.00 H new ATOM 0 HG3 GLU A3305 -7.254 4.282 -8.726 1.00 0.00 H new ATOM 1110 N ASN A3306 -9.316 2.330 -7.967 1.00 0.00 N ATOM 1111 CA ASN A3306 -10.233 1.766 -8.951 1.00 0.00 C ATOM 1112 C ASN A3306 -11.120 0.715 -8.287 1.00 0.00 C ATOM 1113 O ASN A3306 -11.977 0.149 -8.969 1.00 0.00 O ATOM 1114 CB ASN A3306 -9.511 1.239 -10.197 1.00 0.00 C ATOM 1115 CG ASN A3306 -8.654 0.019 -9.920 1.00 0.00 C ATOM 1116 OD1 ASN A3306 -9.142 -1.076 -9.676 1.00 0.00 O ATOM 1117 ND2 ASN A3306 -7.343 0.175 -9.946 1.00 0.00 N ATOM 0 H ASN A3306 -8.538 1.712 -7.737 1.00 0.00 H new ATOM 0 HA ASN A3306 -10.876 2.566 -9.319 1.00 0.00 H new ATOM 0 HB2 ASN A3306 -10.250 0.991 -10.959 1.00 0.00 H new ATOM 0 HB3 ASN A3306 -8.883 2.030 -10.607 1.00 0.00 H new ATOM 0 HD21 ASN A3306 -6.731 -0.620 -9.762 1.00 0.00 H new ATOM 0 HD22 ASN A3306 -6.942 1.091 -10.150 1.00 0.00 H new ATOM 1124 N LEU A3307 -10.920 0.422 -6.991 1.00 0.00 N ATOM 1125 CA LEU A3307 -11.769 -0.557 -6.326 1.00 0.00 C ATOM 1126 C LEU A3307 -12.966 0.142 -5.691 1.00 0.00 C ATOM 1127 O LEU A3307 -12.906 1.320 -5.333 1.00 0.00 O ATOM 1128 CB LEU A3307 -11.002 -1.367 -5.270 1.00 0.00 C ATOM 1129 CG LEU A3307 -10.473 -2.756 -5.684 1.00 0.00 C ATOM 1130 CD1 LEU A3307 -11.099 -3.405 -6.919 1.00 0.00 C ATOM 1131 CD2 LEU A3307 -8.987 -2.736 -5.954 1.00 0.00 C ATOM 0 H LEU A3307 -10.198 0.840 -6.405 1.00 0.00 H new ATOM 0 HA LEU A3307 -12.116 -1.261 -7.082 1.00 0.00 H new ATOM 0 HB2 LEU A3307 -10.153 -0.769 -4.938 1.00 0.00 H new ATOM 0 HB3 LEU A3307 -11.655 -1.499 -4.408 1.00 0.00 H new ATOM 0 HG LEU A3307 -10.754 -3.349 -4.814 1.00 0.00 H new ATOM 0 HD11 LEU A3307 -10.635 -4.375 -7.095 1.00 0.00 H new ATOM 0 HD12 LEU A3307 -12.169 -3.539 -6.757 1.00 0.00 H new ATOM 0 HD13 LEU A3307 -10.941 -2.764 -7.786 1.00 0.00 H new ATOM 0 HD21 LEU A3307 -8.656 -3.734 -6.242 1.00 0.00 H new ATOM 0 HD22 LEU A3307 -8.773 -2.035 -6.761 1.00 0.00 H new ATOM 0 HD23 LEU A3307 -8.458 -2.424 -5.054 1.00 0.00 H new ATOM 1143 N SER A3308 -14.040 -0.633 -5.561 1.00 0.00 N ATOM 1144 CA SER A3308 -15.335 -0.281 -5.000 1.00 0.00 C ATOM 1145 C SER A3308 -15.340 -0.471 -3.483 1.00 0.00 C ATOM 1146 O SER A3308 -14.417 -1.073 -2.941 1.00 0.00 O ATOM 1147 CB SER A3308 -16.370 -1.166 -5.697 1.00 0.00 C ATOM 1148 OG SER A3308 -16.240 -1.016 -7.102 1.00 0.00 O ATOM 0 H SER A3308 -14.021 -1.604 -5.873 1.00 0.00 H new ATOM 0 HA SER A3308 -15.569 0.770 -5.168 1.00 0.00 H new ATOM 0 HB2 SER A3308 -16.224 -2.209 -5.415 1.00 0.00 H new ATOM 0 HB3 SER A3308 -17.376 -0.889 -5.381 1.00 0.00 H new ATOM 0 HG SER A3308 -16.900 -1.582 -7.554 1.00 0.00 H new ATOM 1154 N GLU A3309 -16.368 0.008 -2.772 1.00 0.00 N ATOM 1155 CA GLU A3309 -16.448 -0.129 -1.326 1.00 0.00 C ATOM 1156 C GLU A3309 -16.403 -1.595 -0.989 1.00 0.00 C ATOM 1157 O GLU A3309 -15.549 -2.022 -0.254 1.00 0.00 O ATOM 1158 CB GLU A3309 -17.775 0.478 -0.801 1.00 0.00 C ATOM 1159 CG GLU A3309 -17.540 1.766 -0.021 1.00 0.00 C ATOM 1160 CD GLU A3309 -18.791 2.628 0.216 1.00 0.00 C ATOM 1161 OE1 GLU A3309 -19.831 2.065 0.629 1.00 0.00 O ATOM 1162 OE2 GLU A3309 -18.720 3.875 0.104 1.00 0.00 O ATOM 0 H GLU A3309 -17.160 0.498 -3.187 1.00 0.00 H new ATOM 0 HA GLU A3309 -15.616 0.399 -0.860 1.00 0.00 H new ATOM 0 HB2 GLU A3309 -18.440 0.678 -1.641 1.00 0.00 H new ATOM 0 HB3 GLU A3309 -18.278 -0.247 -0.162 1.00 0.00 H new ATOM 0 HG2 GLU A3309 -17.106 1.512 0.946 1.00 0.00 H new ATOM 0 HG3 GLU A3309 -16.802 2.365 -0.554 1.00 0.00 H new ATOM 1169 N GLU A3310 -17.169 -2.396 -1.681 1.00 0.00 N ATOM 1170 CA GLU A3310 -17.338 -3.808 -1.527 1.00 0.00 C ATOM 1171 C GLU A3310 -15.981 -4.508 -1.530 1.00 0.00 C ATOM 1172 O GLU A3310 -15.852 -5.578 -0.946 1.00 0.00 O ATOM 1173 CB GLU A3310 -18.248 -4.249 -2.683 1.00 0.00 C ATOM 1174 CG GLU A3310 -19.610 -3.509 -2.653 1.00 0.00 C ATOM 1175 CD GLU A3310 -20.310 -3.487 -4.006 1.00 0.00 C ATOM 1176 OE1 GLU A3310 -21.518 -3.790 -4.113 1.00 0.00 O ATOM 1177 OE2 GLU A3310 -19.690 -3.000 -4.976 1.00 0.00 O ATOM 0 H GLU A3310 -17.745 -2.035 -2.441 1.00 0.00 H new ATOM 0 HA GLU A3310 -17.796 -4.075 -0.574 1.00 0.00 H new ATOM 0 HB2 GLU A3310 -17.750 -4.056 -3.633 1.00 0.00 H new ATOM 0 HB3 GLU A3310 -18.416 -5.324 -2.624 1.00 0.00 H new ATOM 0 HG2 GLU A3310 -20.261 -3.989 -1.922 1.00 0.00 H new ATOM 0 HG3 GLU A3310 -19.452 -2.485 -2.316 1.00 0.00 H new ATOM 1184 N GLU A3311 -15.013 -3.996 -2.288 1.00 0.00 N ATOM 1185 CA GLU A3311 -13.682 -4.544 -2.363 1.00 0.00 C ATOM 1186 C GLU A3311 -12.795 -4.110 -1.198 1.00 0.00 C ATOM 1187 O GLU A3311 -12.156 -4.939 -0.551 1.00 0.00 O ATOM 1188 CB GLU A3311 -13.074 -4.061 -3.673 1.00 0.00 C ATOM 1189 CG GLU A3311 -13.828 -4.588 -4.895 1.00 0.00 C ATOM 1190 CD GLU A3311 -13.201 -5.882 -5.433 1.00 0.00 C ATOM 1191 OE1 GLU A3311 -12.577 -6.645 -4.660 1.00 0.00 O ATOM 1192 OE2 GLU A3311 -13.271 -6.120 -6.659 1.00 0.00 O ATOM 0 H GLU A3311 -15.146 -3.172 -2.875 1.00 0.00 H new ATOM 0 HA GLU A3311 -13.745 -5.631 -2.313 1.00 0.00 H new ATOM 0 HB2 GLU A3311 -13.075 -2.971 -3.691 1.00 0.00 H new ATOM 0 HB3 GLU A3311 -12.033 -4.380 -3.727 1.00 0.00 H new ATOM 0 HG2 GLU A3311 -14.869 -4.771 -4.629 1.00 0.00 H new ATOM 0 HG3 GLU A3311 -13.827 -3.830 -5.678 1.00 0.00 H new ATOM 1199 N LEU A3312 -12.742 -2.793 -0.971 1.00 0.00 N ATOM 1200 CA LEU A3312 -11.933 -2.112 0.038 1.00 0.00 C ATOM 1201 C LEU A3312 -12.489 -2.245 1.449 1.00 0.00 C ATOM 1202 O LEU A3312 -11.801 -2.665 2.376 1.00 0.00 O ATOM 1203 CB LEU A3312 -11.847 -0.605 -0.285 1.00 0.00 C ATOM 1204 CG LEU A3312 -11.549 -0.236 -1.748 1.00 0.00 C ATOM 1205 CD1 LEU A3312 -12.173 1.121 -2.053 1.00 0.00 C ATOM 1206 CD2 LEU A3312 -10.059 -0.310 -2.075 1.00 0.00 C ATOM 0 H LEU A3312 -13.297 -2.138 -1.521 1.00 0.00 H new ATOM 0 HA LEU A3312 -10.955 -2.592 0.007 1.00 0.00 H new ATOM 0 HB2 LEU A3312 -12.791 -0.140 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A3312 -11.073 -0.164 0.343 1.00 0.00 H new ATOM 0 HG LEU A3312 -12.006 -0.974 -2.407 1.00 0.00 H new ATOM 0 HD11 LEU A3312 -11.967 1.392 -3.089 1.00 0.00 H new ATOM 0 HD12 LEU A3312 -13.251 1.069 -1.899 1.00 0.00 H new ATOM 0 HD13 LEU A3312 -11.748 1.874 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU A3312 -9.902 -0.040 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU A3312 -9.511 0.382 -1.435 1.00 0.00 H new ATOM 0 HD23 LEU A3312 -9.699 -1.324 -1.904 1.00 0.00 H new ATOM 1218 N LEU A3313 -13.755 -1.874 1.610 1.00 0.00 N ATOM 1219 CA LEU A3313 -14.544 -1.922 2.815 1.00 0.00 C ATOM 1220 C LEU A3313 -14.481 -3.365 3.320 1.00 0.00 C ATOM 1221 O LEU A3313 -14.331 -3.566 4.513 1.00 0.00 O ATOM 1222 CB LEU A3313 -15.980 -1.394 2.567 1.00 0.00 C ATOM 1223 CG LEU A3313 -16.785 -1.511 3.884 1.00 0.00 C ATOM 1224 CD1 LEU A3313 -17.337 -0.195 4.393 1.00 0.00 C ATOM 1225 CD2 LEU A3313 -17.888 -2.560 3.778 1.00 0.00 C ATOM 0 H LEU A3313 -14.292 -1.501 0.827 1.00 0.00 H new ATOM 0 HA LEU A3313 -14.152 -1.261 3.588 1.00 0.00 H new ATOM 0 HB2 LEU A3313 -15.949 -0.357 2.234 1.00 0.00 H new ATOM 0 HB3 LEU A3313 -16.463 -1.969 1.776 1.00 0.00 H new ATOM 0 HG LEU A3313 -16.061 -1.839 4.630 1.00 0.00 H new ATOM 0 HD11 LEU A3313 -17.887 -0.365 5.318 1.00 0.00 H new ATOM 0 HD12 LEU A3313 -16.515 0.496 4.581 1.00 0.00 H new ATOM 0 HD13 LEU A3313 -18.006 0.232 3.646 1.00 0.00 H new ATOM 0 HD21 LEU A3313 -18.431 -2.613 4.722 1.00 0.00 H new ATOM 0 HD22 LEU A3313 -18.576 -2.285 2.978 1.00 0.00 H new ATOM 0 HD23 LEU A3313 -17.446 -3.532 3.558 1.00 0.00 H new ATOM 1237 N ALA A3314 -14.485 -4.362 2.436 1.00 0.00 N ATOM 1238 CA ALA A3314 -14.404 -5.752 2.876 1.00 0.00 C ATOM 1239 C ALA A3314 -13.064 -6.064 3.565 1.00 0.00 C ATOM 1240 O ALA A3314 -12.982 -6.924 4.439 1.00 0.00 O ATOM 1241 CB ALA A3314 -14.618 -6.659 1.668 1.00 0.00 C ATOM 0 H ALA A3314 -14.543 -4.236 1.426 1.00 0.00 H new ATOM 0 HA ALA A3314 -15.181 -5.930 3.619 1.00 0.00 H new ATOM 0 HB1 ALA A3314 -14.560 -7.702 1.981 1.00 0.00 H new ATOM 0 HB2 ALA A3314 -15.599 -6.464 1.236 1.00 0.00 H new ATOM 0 HB3 ALA A3314 -13.847 -6.461 0.923 1.00 0.00 H new ATOM 1247 N MET A3315 -11.993 -5.361 3.201 1.00 0.00 N ATOM 1248 CA MET A3315 -10.660 -5.575 3.766 1.00 0.00 C ATOM 1249 C MET A3315 -10.556 -4.893 5.127 1.00 0.00 C ATOM 1250 O MET A3315 -10.192 -5.515 6.122 1.00 0.00 O ATOM 1251 CB MET A3315 -9.582 -5.011 2.833 1.00 0.00 C ATOM 1252 CG MET A3315 -9.756 -5.408 1.365 1.00 0.00 C ATOM 1253 SD MET A3315 -8.597 -6.664 0.743 1.00 0.00 S ATOM 1254 CE MET A3315 -7.024 -5.775 0.672 1.00 0.00 C ATOM 0 H MET A3315 -12.025 -4.621 2.500 1.00 0.00 H new ATOM 0 HA MET A3315 -10.504 -6.648 3.881 1.00 0.00 H new ATOM 0 HB2 MET A3315 -9.585 -3.924 2.907 1.00 0.00 H new ATOM 0 HB3 MET A3315 -8.605 -5.351 3.177 1.00 0.00 H new ATOM 0 HG2 MET A3315 -10.772 -5.778 1.226 1.00 0.00 H new ATOM 0 HG3 MET A3315 -9.656 -4.513 0.752 1.00 0.00 H new ATOM 0 HE1 MET A3315 -6.245 -6.443 0.306 1.00 0.00 H new ATOM 0 HE2 MET A3315 -7.117 -4.923 -0.002 1.00 0.00 H new ATOM 0 HE3 MET A3315 -6.760 -5.422 1.669 1.00 0.00 H new ATOM 1264 N LEU A3316 -10.835 -3.586 5.168 1.00 0.00 N ATOM 1265 CA LEU A3316 -10.776 -2.784 6.393 1.00 0.00 C ATOM 1266 C LEU A3316 -11.842 -3.207 7.397 1.00 0.00 C ATOM 1267 O LEU A3316 -11.559 -3.213 8.592 1.00 0.00 O ATOM 1268 CB LEU A3316 -10.857 -1.278 6.098 1.00 0.00 C ATOM 1269 CG LEU A3316 -12.104 -0.868 5.287 1.00 0.00 C ATOM 1270 CD1 LEU A3316 -13.283 -0.397 6.156 1.00 0.00 C ATOM 1271 CD2 LEU A3316 -11.780 0.276 4.328 1.00 0.00 C ATOM 0 H LEU A3316 -11.110 -3.051 4.344 1.00 0.00 H new ATOM 0 HA LEU A3316 -9.803 -2.975 6.846 1.00 0.00 H new ATOM 0 HB2 LEU A3316 -10.853 -0.732 7.041 1.00 0.00 H new ATOM 0 HB3 LEU A3316 -9.964 -0.976 5.551 1.00 0.00 H new ATOM 0 HG LEU A3316 -12.396 -1.774 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A3316 -14.122 -0.126 5.515 1.00 0.00 H new ATOM 0 HD12 LEU A3316 -13.584 -1.201 6.827 1.00 0.00 H new ATOM 0 HD13 LEU A3316 -12.979 0.470 6.742 1.00 0.00 H new ATOM 0 HD21 LEU A3316 -12.675 0.546 3.768 1.00 0.00 H new ATOM 0 HD22 LEU A3316 -11.433 1.139 4.896 1.00 0.00 H new ATOM 0 HD23 LEU A3316 -11.000 -0.040 3.635 1.00 0.00 H new ATOM 1283 N ASN A3317 -13.052 -3.555 6.946 1.00 0.00 N ATOM 1284 CA ASN A3317 -14.121 -3.982 7.848 1.00 0.00 C ATOM 1285 C ASN A3317 -14.004 -5.465 8.187 1.00 0.00 C ATOM 1286 O ASN A3317 -14.517 -5.889 9.220 1.00 0.00 O ATOM 1287 CB ASN A3317 -15.507 -3.705 7.249 1.00 0.00 C ATOM 1288 CG ASN A3317 -16.492 -3.405 8.362 1.00 0.00 C ATOM 1289 OD1 ASN A3317 -17.234 -4.263 8.826 1.00 0.00 O ATOM 1290 ND2 ASN A3317 -16.445 -2.192 8.882 1.00 0.00 N ATOM 0 H ASN A3317 -13.313 -3.548 5.960 1.00 0.00 H new ATOM 0 HA ASN A3317 -14.010 -3.400 8.763 1.00 0.00 H new ATOM 0 HB2 ASN A3317 -15.454 -2.862 6.559 1.00 0.00 H new ATOM 0 HB3 ASN A3317 -15.844 -4.567 6.674 1.00 0.00 H new ATOM 0 HD21 ASN A3317 -17.032 -1.957 9.682 1.00 0.00 H new ATOM 0 HD22 ASN A3317 -15.822 -1.490 8.483 1.00 0.00 H new ATOM 1297 N GLY A3318 -13.317 -6.231 7.334 1.00 0.00 N ATOM 1298 CA GLY A3318 -13.096 -7.666 7.496 1.00 0.00 C ATOM 1299 C GLY A3318 -14.290 -8.541 7.108 1.00 0.00 C ATOM 1300 O GLY A3318 -14.303 -9.737 7.430 1.00 0.00 O ATOM 0 H GLY A3318 -12.888 -5.856 6.488 1.00 0.00 H new ATOM 0 HA2 GLY A3318 -12.236 -7.959 6.893 1.00 0.00 H new ATOM 0 HA3 GLY A3318 -12.838 -7.866 8.536 1.00 0.00 H new ATOM 1304 N ASP A3319 -15.293 -7.950 6.465 1.00 0.00 N ATOM 1305 CA ASP A3319 -16.530 -8.585 6.004 1.00 0.00 C ATOM 1306 C ASP A3319 -16.436 -8.968 4.524 1.00 0.00 C ATOM 1307 O ASP A3319 -15.370 -8.869 3.915 1.00 0.00 O ATOM 1308 CB ASP A3319 -17.752 -7.701 6.343 1.00 0.00 C ATOM 1309 CG ASP A3319 -18.556 -8.172 7.559 1.00 0.00 C ATOM 1310 OD1 ASP A3319 -18.129 -9.086 8.308 1.00 0.00 O ATOM 1311 OD2 ASP A3319 -19.696 -7.685 7.734 1.00 0.00 O ATOM 0 H ASP A3319 -15.265 -6.956 6.237 1.00 0.00 H new ATOM 0 HA ASP A3319 -16.673 -9.523 6.541 1.00 0.00 H new ATOM 0 HB2 ASP A3319 -17.409 -6.682 6.522 1.00 0.00 H new ATOM 0 HB3 ASP A3319 -18.413 -7.668 5.477 1.00 0.00 H new ATOM 1316 N GLN A3320 -17.544 -9.444 3.951 1.00 0.00 N ATOM 1317 CA GLN A3320 -17.662 -9.895 2.572 1.00 0.00 C ATOM 1318 C GLN A3320 -18.854 -9.272 1.842 1.00 0.00 C ATOM 1319 O GLN A3320 -19.495 -9.951 1.033 1.00 0.00 O ATOM 1320 CB GLN A3320 -17.740 -11.435 2.545 1.00 0.00 C ATOM 1321 CG GLN A3320 -16.954 -12.185 3.631 1.00 0.00 C ATOM 1322 CD GLN A3320 -16.785 -13.681 3.337 1.00 0.00 C ATOM 1323 OE1 GLN A3320 -15.813 -14.305 3.765 1.00 0.00 O ATOM 1324 NE2 GLN A3320 -17.693 -14.310 2.608 1.00 0.00 N ATOM 0 H GLN A3320 -18.422 -9.527 4.464 1.00 0.00 H new ATOM 0 HA GLN A3320 -16.774 -9.561 2.035 1.00 0.00 H new ATOM 0 HB2 GLN A3320 -18.788 -11.724 2.623 1.00 0.00 H new ATOM 0 HB3 GLN A3320 -17.387 -11.777 1.572 1.00 0.00 H new ATOM 0 HG2 GLN A3320 -15.969 -11.729 3.736 1.00 0.00 H new ATOM 0 HG3 GLN A3320 -17.465 -12.065 4.587 1.00 0.00 H new ATOM 0 HE21 GLN A3320 -18.501 -13.801 2.250 1.00 0.00 H new ATOM 0 HE22 GLN A3320 -17.585 -15.304 2.405 1.00 0.00 H new ATOM 1333 N GLN A3321 -19.219 -8.032 2.180 1.00 0.00 N ATOM 1334 CA GLN A3321 -20.338 -7.392 1.500 1.00 0.00 C ATOM 1335 C GLN A3321 -19.971 -7.188 0.036 1.00 0.00 C ATOM 1336 O GLN A3321 -20.788 -7.468 -0.848 1.00 0.00 O ATOM 1337 CB GLN A3321 -20.786 -6.073 2.160 1.00 0.00 C ATOM 1338 CG GLN A3321 -21.089 -6.141 3.667 1.00 0.00 C ATOM 1339 CD GLN A3321 -22.059 -7.261 4.015 1.00 0.00 C ATOM 1340 OE1 GLN A3321 -23.269 -7.144 3.855 1.00 0.00 O ATOM 1341 NE2 GLN A3321 -21.568 -8.397 4.488 1.00 0.00 N ATOM 0 H GLN A3321 -18.768 -7.468 2.900 1.00 0.00 H new ATOM 0 HA GLN A3321 -21.201 -8.053 1.580 1.00 0.00 H new ATOM 0 HB2 GLN A3321 -20.008 -5.327 2.000 1.00 0.00 H new ATOM 0 HB3 GLN A3321 -21.679 -5.718 1.646 1.00 0.00 H new ATOM 0 HG2 GLN A3321 -20.158 -6.287 4.215 1.00 0.00 H new ATOM 0 HG3 GLN A3321 -21.506 -5.189 3.994 1.00 0.00 H new ATOM 0 HE21 GLN A3321 -20.562 -8.501 4.623 1.00 0.00 H new ATOM 0 HE22 GLN A3321 -22.196 -9.168 4.717 1.00 0.00 H new TER 1350 GLN A3321