USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 932 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 37:sc= 0.573 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot -93:sc= 0.0023 USER MOD Single : A 13 GLN : amide:sc= -0.116 K(o=-0.12,f=-2.3!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.0303 K(o=-0.03,f=-1.2) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 HIS : no HD1:sc= -0.19 X(o=-0.19,f=0.028) USER MOD Single : A 33 LYS NZ :NH3+ -125:sc= 0.097 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= -0.336 X(o=-0.34,f=-0.073) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0.8 K(o=0.8,f=-5.3!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl 177:sc= -3.44! (180deg=-3.46!) USER MOD Single : A 52 SER OG : rot 60:sc= 1.2 USER MOD Single : A 59 ASN : amide:sc= -5.01! C(o=-5!,f=-11!) USER MOD Single : A 70 MET CE :methyl 163:sc= -3.38! (180deg=-3.92!) USER MOD Single : A 80 ASN :FLIP amide:sc= -0.601 F(o=-1.4,f=-0.6) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 82 GLN : amide:sc= -0.093 K(o=-0.093,f=-1.3!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -0.695 X(o=-0.7,f=-0.26) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 91 ASN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -22:sc= 0.761 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.617 K(o=-0.62,f=-11!) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 117 MET CE :methyl -133:sc= -4.45! (180deg=-8.98!) USER MOD Single : A 119 SER OG : rot -56:sc= 0.0468 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.817 -25.814 26.240 1.00 0.00 N ATOM 2 CA GLY A 1 -8.322 -25.542 24.903 1.00 0.00 C ATOM 3 C GLY A 1 -6.962 -24.873 24.913 1.00 0.00 C ATOM 4 O GLY A 1 -6.866 -23.650 25.016 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.749 -26.271 26.179 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.154 -26.445 26.734 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.903 -24.921 26.766 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.260 -26.476 24.345 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.033 -24.904 24.378 1.00 0.00 H new ATOM 8 N SER A 2 -5.908 -25.676 24.808 1.00 0.00 N ATOM 9 CA SER A 2 -4.547 -25.154 24.811 1.00 0.00 C ATOM 10 C SER A 2 -4.087 -24.826 23.394 1.00 0.00 C ATOM 11 O SER A 2 -4.238 -25.635 22.478 1.00 0.00 O ATOM 12 CB SER A 2 -3.592 -26.166 25.448 1.00 0.00 C ATOM 13 OG SER A 2 -3.637 -26.090 26.862 1.00 0.00 O ATOM 0 H SER A 2 -5.971 -26.690 24.720 1.00 0.00 H new ATOM 0 HA SER A 2 -4.538 -24.236 25.398 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.857 -27.173 25.126 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.575 -25.978 25.103 1.00 0.00 H new ATOM 0 HG SER A 2 -3.019 -26.748 27.245 1.00 0.00 H new ATOM 19 N SER A 3 -3.526 -23.634 23.222 1.00 0.00 N ATOM 20 CA SER A 3 -3.047 -23.196 21.916 1.00 0.00 C ATOM 21 C SER A 3 -1.585 -22.765 21.989 1.00 0.00 C ATOM 22 O SER A 3 -1.258 -21.737 22.580 1.00 0.00 O ATOM 23 CB SER A 3 -3.905 -22.041 21.396 1.00 0.00 C ATOM 24 OG SER A 3 -5.252 -22.445 21.219 1.00 0.00 O ATOM 0 H SER A 3 -3.392 -22.954 23.970 1.00 0.00 H new ATOM 0 HA SER A 3 -3.126 -24.037 21.227 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.861 -21.207 22.097 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.502 -21.683 20.449 1.00 0.00 H new ATOM 0 HG SER A 3 -5.780 -21.688 20.888 1.00 0.00 H new ATOM 30 N GLY A 4 -0.709 -23.561 21.384 1.00 0.00 N ATOM 31 CA GLY A 4 0.708 -23.247 21.392 1.00 0.00 C ATOM 32 C GLY A 4 1.080 -22.220 20.340 1.00 0.00 C ATOM 33 O GLY A 4 1.781 -21.251 20.630 1.00 0.00 O ATOM 0 H GLY A 4 -0.955 -24.418 20.888 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.988 -22.872 22.376 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.280 -24.159 21.223 1.00 0.00 H new ATOM 37 N SER A 5 0.611 -22.434 19.115 1.00 0.00 N ATOM 38 CA SER A 5 0.903 -21.522 18.015 1.00 0.00 C ATOM 39 C SER A 5 -0.378 -21.112 17.294 1.00 0.00 C ATOM 40 O SER A 5 -1.025 -21.931 16.642 1.00 0.00 O ATOM 41 CB SER A 5 1.871 -22.175 17.027 1.00 0.00 C ATOM 42 OG SER A 5 1.332 -23.377 16.504 1.00 0.00 O ATOM 0 H SER A 5 0.027 -23.231 18.859 1.00 0.00 H new ATOM 0 HA SER A 5 1.367 -20.628 18.431 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.085 -21.484 16.212 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.818 -22.384 17.525 1.00 0.00 H new ATOM 0 HG SER A 5 0.367 -23.271 16.369 1.00 0.00 H new ATOM 48 N SER A 6 -0.736 -19.838 17.417 1.00 0.00 N ATOM 49 CA SER A 6 -1.942 -19.319 16.781 1.00 0.00 C ATOM 50 C SER A 6 -1.615 -18.689 15.430 1.00 0.00 C ATOM 51 O SER A 6 -2.236 -19.007 14.417 1.00 0.00 O ATOM 52 CB SER A 6 -2.618 -18.289 17.687 1.00 0.00 C ATOM 53 OG SER A 6 -3.792 -17.773 17.084 1.00 0.00 O ATOM 0 H SER A 6 -0.209 -19.147 17.951 1.00 0.00 H new ATOM 0 HA SER A 6 -2.625 -20.152 16.618 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.868 -18.749 18.643 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.925 -17.474 17.897 1.00 0.00 H new ATOM 0 HG SER A 6 -4.207 -17.118 17.683 1.00 0.00 H new ATOM 59 N GLY A 7 -0.633 -17.791 15.425 1.00 0.00 N ATOM 60 CA GLY A 7 -0.240 -17.130 14.195 1.00 0.00 C ATOM 61 C GLY A 7 -0.141 -15.625 14.352 1.00 0.00 C ATOM 62 O GLY A 7 -1.004 -14.887 13.878 1.00 0.00 O ATOM 0 H GLY A 7 -0.104 -17.510 16.251 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.723 -17.522 13.867 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.963 -17.364 13.413 1.00 0.00 H new ATOM 66 N ASP A 8 0.914 -15.170 15.020 1.00 0.00 N ATOM 67 CA ASP A 8 1.123 -13.744 15.239 1.00 0.00 C ATOM 68 C ASP A 8 2.180 -13.197 14.285 1.00 0.00 C ATOM 69 O ASP A 8 2.803 -12.171 14.555 1.00 0.00 O ATOM 70 CB ASP A 8 1.542 -13.484 16.687 1.00 0.00 C ATOM 71 CG ASP A 8 2.306 -14.649 17.286 1.00 0.00 C ATOM 72 OD1 ASP A 8 3.128 -15.252 16.565 1.00 0.00 O ATOM 73 OD2 ASP A 8 2.082 -14.957 18.475 1.00 0.00 O ATOM 0 H ASP A 8 1.637 -15.768 15.419 1.00 0.00 H new ATOM 0 HA ASP A 8 0.182 -13.230 15.044 1.00 0.00 H new ATOM 0 HB2 ASP A 8 2.161 -12.588 16.728 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.655 -13.287 17.289 1.00 0.00 H new ATOM 78 N ALA A 9 2.377 -13.889 13.167 1.00 0.00 N ATOM 79 CA ALA A 9 3.357 -13.472 12.173 1.00 0.00 C ATOM 80 C ALA A 9 2.863 -12.262 11.388 1.00 0.00 C ATOM 81 O ALA A 9 3.537 -11.784 10.475 1.00 0.00 O ATOM 82 CB ALA A 9 3.673 -14.623 11.229 1.00 0.00 C ATOM 0 H ALA A 9 1.870 -14.741 12.928 1.00 0.00 H new ATOM 0 HA ALA A 9 4.269 -13.184 12.696 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.407 -14.298 10.491 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.077 -15.460 11.798 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.762 -14.937 10.720 1.00 0.00 H new ATOM 88 N PHE A 10 1.682 -11.770 11.749 1.00 0.00 N ATOM 89 CA PHE A 10 1.097 -10.616 11.077 1.00 0.00 C ATOM 90 C PHE A 10 1.149 -9.382 11.973 1.00 0.00 C ATOM 91 O PHE A 10 0.408 -8.419 11.767 1.00 0.00 O ATOM 92 CB PHE A 10 -0.351 -10.911 10.680 1.00 0.00 C ATOM 93 CG PHE A 10 -0.473 -11.773 9.456 1.00 0.00 C ATOM 94 CD1 PHE A 10 -0.468 -13.155 9.562 1.00 0.00 C ATOM 95 CD2 PHE A 10 -0.591 -11.202 8.199 1.00 0.00 C ATOM 96 CE1 PHE A 10 -0.580 -13.951 8.438 1.00 0.00 C ATOM 97 CE2 PHE A 10 -0.704 -11.993 7.071 1.00 0.00 C ATOM 98 CZ PHE A 10 -0.697 -13.369 7.191 1.00 0.00 C ATOM 0 H PHE A 10 1.112 -12.153 12.503 1.00 0.00 H new ATOM 0 HA PHE A 10 1.680 -10.416 10.178 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.855 -11.402 11.512 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -0.870 -9.969 10.504 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -0.375 -13.615 10.535 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -0.595 -10.127 8.099 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -0.576 -15.027 8.535 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.798 -11.536 6.097 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.783 -13.989 6.311 1.00 0.00 H new ATOM 108 N THR A 11 2.029 -9.417 12.969 1.00 0.00 N ATOM 109 CA THR A 11 2.177 -8.303 13.897 1.00 0.00 C ATOM 110 C THR A 11 3.215 -7.305 13.397 1.00 0.00 C ATOM 111 O THR A 11 4.263 -7.692 12.880 1.00 0.00 O ATOM 112 CB THR A 11 2.585 -8.791 15.300 1.00 0.00 C ATOM 113 OG1 THR A 11 3.951 -9.223 15.290 1.00 0.00 O ATOM 114 CG2 THR A 11 1.690 -9.933 15.757 1.00 0.00 C ATOM 0 H THR A 11 2.650 -10.205 13.153 1.00 0.00 H new ATOM 0 HA THR A 11 1.206 -7.812 13.959 1.00 0.00 H new ATOM 0 HB THR A 11 2.472 -7.961 15.997 1.00 0.00 H new ATOM 0 HG1 THR A 11 3.988 -10.186 15.111 1.00 0.00 H new ATOM 0 HG21 THR A 11 1.997 -10.261 16.750 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.655 -9.593 15.791 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.776 -10.765 15.058 1.00 0.00 H new ATOM 122 N ASP A 12 2.917 -6.020 13.554 1.00 0.00 N ATOM 123 CA ASP A 12 3.826 -4.965 13.120 1.00 0.00 C ATOM 124 C ASP A 12 5.278 -5.364 13.367 1.00 0.00 C ATOM 125 O ASP A 12 6.154 -5.088 12.548 1.00 0.00 O ATOM 126 CB ASP A 12 3.511 -3.659 13.850 1.00 0.00 C ATOM 127 CG ASP A 12 4.577 -2.603 13.632 1.00 0.00 C ATOM 128 OD1 ASP A 12 5.102 -2.514 12.502 1.00 0.00 O ATOM 129 OD2 ASP A 12 4.887 -1.865 14.591 1.00 0.00 O ATOM 0 H ASP A 12 2.053 -5.683 13.979 1.00 0.00 H new ATOM 0 HA ASP A 12 3.686 -4.816 12.049 1.00 0.00 H new ATOM 0 HB2 ASP A 12 2.550 -3.277 13.507 1.00 0.00 H new ATOM 0 HB3 ASP A 12 3.413 -3.857 14.917 1.00 0.00 H new ATOM 134 N GLN A 13 5.524 -6.012 14.500 1.00 0.00 N ATOM 135 CA GLN A 13 6.870 -6.447 14.855 1.00 0.00 C ATOM 136 C GLN A 13 7.454 -7.347 13.772 1.00 0.00 C ATOM 137 O GLN A 13 8.597 -7.167 13.350 1.00 0.00 O ATOM 138 CB GLN A 13 6.853 -7.185 16.195 1.00 0.00 C ATOM 139 CG GLN A 13 8.189 -7.813 16.560 1.00 0.00 C ATOM 140 CD GLN A 13 9.079 -6.873 17.349 1.00 0.00 C ATOM 141 OE1 GLN A 13 8.631 -5.831 17.828 1.00 0.00 O ATOM 142 NE2 GLN A 13 10.348 -7.238 17.490 1.00 0.00 N ATOM 0 H GLN A 13 4.809 -6.248 15.188 1.00 0.00 H new ATOM 0 HA GLN A 13 7.500 -5.562 14.944 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.562 -6.488 16.981 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.092 -7.964 16.162 1.00 0.00 H new ATOM 0 HG2 GLN A 13 8.014 -8.717 17.143 1.00 0.00 H new ATOM 0 HG3 GLN A 13 8.705 -8.116 15.649 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.677 -8.110 17.076 1.00 0.00 H new ATOM 0 HE22 GLN A 13 10.994 -6.646 18.012 1.00 0.00 H new ATOM 151 N LYS A 14 6.664 -8.317 13.325 1.00 0.00 N ATOM 152 CA LYS A 14 7.102 -9.246 12.290 1.00 0.00 C ATOM 153 C LYS A 14 7.106 -8.573 10.922 1.00 0.00 C ATOM 154 O LYS A 14 7.904 -8.922 10.051 1.00 0.00 O ATOM 155 CB LYS A 14 6.192 -10.476 12.262 1.00 0.00 C ATOM 156 CG LYS A 14 6.423 -11.430 13.421 1.00 0.00 C ATOM 157 CD LYS A 14 7.448 -12.496 13.071 1.00 0.00 C ATOM 158 CE LYS A 14 8.857 -12.055 13.435 1.00 0.00 C ATOM 159 NZ LYS A 14 9.841 -13.163 13.285 1.00 0.00 N ATOM 0 H LYS A 14 5.716 -8.480 13.664 1.00 0.00 H new ATOM 0 HA LYS A 14 8.119 -9.559 12.525 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.152 -10.149 12.273 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.347 -11.011 11.325 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.763 -10.870 14.292 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.481 -11.906 13.695 1.00 0.00 H new ATOM 0 HD2 LYS A 14 7.208 -13.420 13.597 1.00 0.00 H new ATOM 0 HD3 LYS A 14 7.398 -12.714 12.004 1.00 0.00 H new ATOM 0 HE2 LYS A 14 9.151 -11.219 12.800 1.00 0.00 H new ATOM 0 HE3 LYS A 14 8.870 -11.694 14.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 10.789 -12.822 13.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 9.575 -13.951 13.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.847 -13.491 12.298 1.00 0.00 H new ATOM 173 N ILE A 15 6.213 -7.606 10.740 1.00 0.00 N ATOM 174 CA ILE A 15 6.117 -6.883 9.478 1.00 0.00 C ATOM 175 C ILE A 15 7.352 -6.019 9.244 1.00 0.00 C ATOM 176 O ILE A 15 8.005 -6.120 8.205 1.00 0.00 O ATOM 177 CB ILE A 15 4.864 -5.989 9.435 1.00 0.00 C ATOM 178 CG1 ILE A 15 3.598 -6.844 9.529 1.00 0.00 C ATOM 179 CG2 ILE A 15 4.852 -5.154 8.164 1.00 0.00 C ATOM 180 CD1 ILE A 15 2.335 -6.034 9.719 1.00 0.00 C ATOM 0 H ILE A 15 5.546 -7.305 11.450 1.00 0.00 H new ATOM 0 HA ILE A 15 6.046 -7.633 8.690 1.00 0.00 H new ATOM 0 HB ILE A 15 4.888 -5.313 10.290 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.504 -7.441 8.622 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.701 -7.542 10.360 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.960 -4.528 8.149 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.740 -4.522 8.135 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.848 -5.813 7.296 1.00 0.00 H new ATOM 0 HD11 ILE A 15 1.478 -6.705 9.777 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.408 -5.457 10.641 1.00 0.00 H new ATOM 0 HD13 ILE A 15 2.208 -5.355 8.876 1.00 0.00 H new ATOM 192 N ARG A 16 7.667 -5.171 10.218 1.00 0.00 N ATOM 193 CA ARG A 16 8.824 -4.290 10.118 1.00 0.00 C ATOM 194 C ARG A 16 10.101 -5.092 9.889 1.00 0.00 C ATOM 195 O ARG A 16 10.961 -4.697 9.103 1.00 0.00 O ATOM 196 CB ARG A 16 8.960 -3.446 11.388 1.00 0.00 C ATOM 197 CG ARG A 16 9.210 -4.269 12.641 1.00 0.00 C ATOM 198 CD ARG A 16 9.510 -3.381 13.839 1.00 0.00 C ATOM 199 NE ARG A 16 10.396 -4.037 14.798 1.00 0.00 N ATOM 200 CZ ARG A 16 10.890 -3.433 15.873 1.00 0.00 C ATOM 201 NH1 ARG A 16 10.588 -2.167 16.125 1.00 0.00 N ATOM 202 NH2 ARG A 16 11.690 -4.097 16.699 1.00 0.00 N ATOM 0 H ARG A 16 7.137 -5.076 11.085 1.00 0.00 H new ATOM 0 HA ARG A 16 8.673 -3.629 9.264 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.779 -2.739 11.258 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.051 -2.860 11.524 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.337 -4.886 12.853 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.046 -4.948 12.471 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.969 -2.453 13.497 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.577 -3.111 14.333 1.00 0.00 H new ATOM 0 HE ARG A 16 10.649 -5.011 14.633 1.00 0.00 H new ATOM 0 HH11 ARG A 16 9.974 -1.653 15.492 1.00 0.00 H new ATOM 0 HH12 ARG A 16 10.969 -1.707 16.951 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.925 -5.071 16.508 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.069 -3.633 17.524 1.00 0.00 H new ATOM 216 N GLN A 17 10.217 -6.221 10.581 1.00 0.00 N ATOM 217 CA GLN A 17 11.389 -7.078 10.454 1.00 0.00 C ATOM 218 C GLN A 17 11.345 -7.870 9.151 1.00 0.00 C ATOM 219 O GLN A 17 12.383 -8.167 8.559 1.00 0.00 O ATOM 220 CB GLN A 17 11.479 -8.036 11.643 1.00 0.00 C ATOM 221 CG GLN A 17 12.174 -7.436 12.855 1.00 0.00 C ATOM 222 CD GLN A 17 12.729 -8.492 13.791 1.00 0.00 C ATOM 223 OE1 GLN A 17 12.486 -9.686 13.613 1.00 0.00 O ATOM 224 NE2 GLN A 17 13.479 -8.056 14.797 1.00 0.00 N ATOM 0 H GLN A 17 9.513 -6.563 11.235 1.00 0.00 H new ATOM 0 HA GLN A 17 12.273 -6.441 10.442 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.473 -8.345 11.927 1.00 0.00 H new ATOM 0 HB3 GLN A 17 12.014 -8.935 11.336 1.00 0.00 H new ATOM 0 HG2 GLN A 17 12.985 -6.789 12.521 1.00 0.00 H new ATOM 0 HG3 GLN A 17 11.469 -6.808 13.399 1.00 0.00 H new ATOM 0 HE21 GLN A 17 13.655 -7.057 14.907 1.00 0.00 H new ATOM 0 HE22 GLN A 17 13.879 -8.720 15.460 1.00 0.00 H new ATOM 233 N ARG A 18 10.138 -8.209 8.711 1.00 0.00 N ATOM 234 CA ARG A 18 9.960 -8.968 7.479 1.00 0.00 C ATOM 235 C ARG A 18 10.400 -8.151 6.268 1.00 0.00 C ATOM 236 O ARG A 18 11.119 -8.646 5.400 1.00 0.00 O ATOM 237 CB ARG A 18 8.497 -9.386 7.320 1.00 0.00 C ATOM 238 CG ARG A 18 8.155 -9.891 5.927 1.00 0.00 C ATOM 239 CD ARG A 18 7.032 -10.915 5.966 1.00 0.00 C ATOM 240 NE ARG A 18 7.363 -12.059 6.811 1.00 0.00 N ATOM 241 CZ ARG A 18 6.576 -13.119 6.955 1.00 0.00 C ATOM 242 NH1 ARG A 18 5.417 -13.181 6.312 1.00 0.00 N ATOM 243 NH2 ARG A 18 6.947 -14.121 7.741 1.00 0.00 N ATOM 0 H ARG A 18 9.269 -7.970 9.189 1.00 0.00 H new ATOM 0 HA ARG A 18 10.582 -9.861 7.539 1.00 0.00 H new ATOM 0 HB2 ARG A 18 8.270 -10.167 8.046 1.00 0.00 H new ATOM 0 HB3 ARG A 18 7.857 -8.536 7.556 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.862 -9.052 5.296 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.040 -10.337 5.473 1.00 0.00 H new ATOM 0 HD2 ARG A 18 6.123 -10.442 6.337 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.822 -11.261 4.954 1.00 0.00 H new ATOM 0 HE ARG A 18 8.248 -12.043 7.319 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.129 -12.413 5.705 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.814 -13.996 6.424 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.838 -14.078 8.236 1.00 0.00 H new ATOM 0 HH22 ARG A 18 6.341 -14.934 7.851 1.00 0.00 H new ATOM 257 N TYR A 19 9.965 -6.897 6.217 1.00 0.00 N ATOM 258 CA TYR A 19 10.312 -6.012 5.111 1.00 0.00 C ATOM 259 C TYR A 19 11.453 -5.076 5.500 1.00 0.00 C ATOM 260 O TYR A 19 11.727 -4.094 4.811 1.00 0.00 O ATOM 261 CB TYR A 19 9.091 -5.195 4.682 1.00 0.00 C ATOM 262 CG TYR A 19 7.963 -6.037 4.130 1.00 0.00 C ATOM 263 CD1 TYR A 19 8.053 -6.614 2.870 1.00 0.00 C ATOM 264 CD2 TYR A 19 6.807 -6.255 4.870 1.00 0.00 C ATOM 265 CE1 TYR A 19 7.024 -7.383 2.361 1.00 0.00 C ATOM 266 CE2 TYR A 19 5.774 -7.024 4.370 1.00 0.00 C ATOM 267 CZ TYR A 19 5.887 -7.585 3.115 1.00 0.00 C ATOM 268 OH TYR A 19 4.860 -8.352 2.613 1.00 0.00 O ATOM 0 H TYR A 19 9.372 -6.470 6.928 1.00 0.00 H new ATOM 0 HA TYR A 19 10.641 -6.629 4.274 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.725 -4.628 5.538 1.00 0.00 H new ATOM 0 HB3 TYR A 19 9.396 -4.471 3.927 1.00 0.00 H new ATOM 0 HD1 TYR A 19 8.943 -6.459 2.278 1.00 0.00 H new ATOM 0 HD2 TYR A 19 6.715 -5.816 5.852 1.00 0.00 H new ATOM 0 HE1 TYR A 19 7.110 -7.823 1.379 1.00 0.00 H new ATOM 0 HE2 TYR A 19 4.883 -7.185 4.959 1.00 0.00 H new ATOM 0 HH TYR A 19 4.134 -8.396 3.269 1.00 0.00 H new ATOM 278 N ALA A 20 12.115 -5.390 6.609 1.00 0.00 N ATOM 279 CA ALA A 20 13.228 -4.581 7.089 1.00 0.00 C ATOM 280 C ALA A 20 14.389 -4.602 6.100 1.00 0.00 C ATOM 281 O ALA A 20 15.254 -3.727 6.125 1.00 0.00 O ATOM 282 CB ALA A 20 13.686 -5.071 8.454 1.00 0.00 C ATOM 0 H ALA A 20 11.899 -6.199 7.192 1.00 0.00 H new ATOM 0 HA ALA A 20 12.883 -3.551 7.182 1.00 0.00 H new ATOM 0 HB1 ALA A 20 14.518 -4.458 8.800 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.861 -4.997 9.163 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.008 -6.110 8.379 1.00 0.00 H new ATOM 288 N ASP A 21 14.401 -5.607 5.231 1.00 0.00 N ATOM 289 CA ASP A 21 15.456 -5.743 4.234 1.00 0.00 C ATOM 290 C ASP A 21 15.263 -4.741 3.100 1.00 0.00 C ATOM 291 O ASP A 21 16.181 -4.486 2.319 1.00 0.00 O ATOM 292 CB ASP A 21 15.480 -7.166 3.675 1.00 0.00 C ATOM 293 CG ASP A 21 15.817 -8.198 4.733 1.00 0.00 C ATOM 294 OD1 ASP A 21 15.131 -8.225 5.776 1.00 0.00 O ATOM 295 OD2 ASP A 21 16.768 -8.979 4.518 1.00 0.00 O ATOM 0 H ASP A 21 13.692 -6.339 5.197 1.00 0.00 H new ATOM 0 HA ASP A 21 16.410 -5.537 4.720 1.00 0.00 H new ATOM 0 HB2 ASP A 21 14.508 -7.399 3.241 1.00 0.00 H new ATOM 0 HB3 ASP A 21 16.211 -7.224 2.869 1.00 0.00 H new ATOM 300 N LEU A 22 14.064 -4.177 3.013 1.00 0.00 N ATOM 301 CA LEU A 22 13.749 -3.203 1.974 1.00 0.00 C ATOM 302 C LEU A 22 14.557 -1.923 2.163 1.00 0.00 C ATOM 303 O LEU A 22 14.949 -1.566 3.275 1.00 0.00 O ATOM 304 CB LEU A 22 12.254 -2.881 1.984 1.00 0.00 C ATOM 305 CG LEU A 22 11.310 -4.069 1.792 1.00 0.00 C ATOM 306 CD1 LEU A 22 9.878 -3.590 1.614 1.00 0.00 C ATOM 307 CD2 LEU A 22 11.746 -4.909 0.601 1.00 0.00 C ATOM 0 H LEU A 22 13.293 -4.378 3.650 1.00 0.00 H new ATOM 0 HA LEU A 22 14.014 -3.639 1.011 1.00 0.00 H new ATOM 0 HB2 LEU A 22 12.013 -2.400 2.932 1.00 0.00 H new ATOM 0 HB3 LEU A 22 12.054 -2.153 1.198 1.00 0.00 H new ATOM 0 HG LEU A 22 11.354 -4.692 2.686 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.221 -4.449 1.479 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.568 -3.032 2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.816 -2.945 0.738 1.00 0.00 H new ATOM 0 HD21 LEU A 22 11.063 -5.750 0.479 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.732 -4.297 -0.301 1.00 0.00 H new ATOM 0 HD23 LEU A 22 12.756 -5.283 0.770 1.00 0.00 H new ATOM 319 N PRO A 23 14.812 -1.214 1.054 1.00 0.00 N ATOM 320 CA PRO A 23 15.574 0.038 1.072 1.00 0.00 C ATOM 321 C PRO A 23 14.806 1.174 1.739 1.00 0.00 C ATOM 322 O PRO A 23 15.323 1.848 2.629 1.00 0.00 O ATOM 323 CB PRO A 23 15.795 0.341 -0.412 1.00 0.00 C ATOM 324 CG PRO A 23 14.671 -0.345 -1.110 1.00 0.00 C ATOM 325 CD PRO A 23 14.377 -1.580 -0.304 1.00 0.00 C ATOM 0 HA PRO A 23 16.497 -0.055 1.644 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.784 1.414 -0.603 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.760 -0.033 -0.753 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.795 0.301 -1.168 1.00 0.00 H new ATOM 0 HG3 PRO A 23 14.946 -0.602 -2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 23 13.318 -1.835 -0.331 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.923 -2.445 -0.681 1.00 0.00 H new ATOM 333 N GLY A 24 13.566 1.380 1.304 1.00 0.00 N ATOM 334 CA GLY A 24 12.747 2.435 1.871 1.00 0.00 C ATOM 335 C GLY A 24 12.430 2.200 3.334 1.00 0.00 C ATOM 336 O GLY A 24 12.920 1.246 3.936 1.00 0.00 O ATOM 0 H GLY A 24 13.115 0.835 0.569 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.263 3.389 1.763 1.00 0.00 H new ATOM 0 HA3 GLY A 24 11.816 2.510 1.308 1.00 0.00 H new ATOM 340 N GLU A 25 11.608 3.074 3.908 1.00 0.00 N ATOM 341 CA GLU A 25 11.228 2.957 5.311 1.00 0.00 C ATOM 342 C GLU A 25 9.769 2.531 5.447 1.00 0.00 C ATOM 343 O GLU A 25 8.872 3.161 4.886 1.00 0.00 O ATOM 344 CB GLU A 25 11.452 4.286 6.035 1.00 0.00 C ATOM 345 CG GLU A 25 11.553 4.147 7.545 1.00 0.00 C ATOM 346 CD GLU A 25 12.832 3.461 7.984 1.00 0.00 C ATOM 347 OE1 GLU A 25 13.882 3.707 7.354 1.00 0.00 O ATOM 348 OE2 GLU A 25 12.783 2.679 8.956 1.00 0.00 O ATOM 0 H GLU A 25 11.193 3.870 3.423 1.00 0.00 H new ATOM 0 HA GLU A 25 11.855 2.192 5.768 1.00 0.00 H new ATOM 0 HB2 GLU A 25 12.366 4.745 5.659 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.633 4.964 5.795 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.500 5.135 8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 25 10.697 3.581 7.912 1.00 0.00 H new ATOM 355 N LEU A 26 9.540 1.456 6.194 1.00 0.00 N ATOM 356 CA LEU A 26 8.190 0.944 6.403 1.00 0.00 C ATOM 357 C LEU A 26 7.324 1.972 7.124 1.00 0.00 C ATOM 358 O LEU A 26 7.695 2.481 8.182 1.00 0.00 O ATOM 359 CB LEU A 26 8.236 -0.355 7.209 1.00 0.00 C ATOM 360 CG LEU A 26 7.018 -1.270 7.077 1.00 0.00 C ATOM 361 CD1 LEU A 26 7.104 -2.092 5.800 1.00 0.00 C ATOM 362 CD2 LEU A 26 6.900 -2.180 8.291 1.00 0.00 C ATOM 0 H LEU A 26 10.271 0.923 6.665 1.00 0.00 H new ATOM 0 HA LEU A 26 7.748 0.744 5.427 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.121 -0.915 6.907 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.363 -0.102 8.262 1.00 0.00 H new ATOM 0 HG LEU A 26 6.124 -0.648 7.026 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.229 -2.737 5.723 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.139 -1.424 4.939 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.005 -2.704 5.822 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.028 -2.824 8.180 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.796 -2.794 8.374 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.791 -1.574 9.191 1.00 0.00 H new ATOM 374 N HIS A 27 6.166 2.272 6.545 1.00 0.00 N ATOM 375 CA HIS A 27 5.244 3.238 7.133 1.00 0.00 C ATOM 376 C HIS A 27 3.832 2.664 7.209 1.00 0.00 C ATOM 377 O HIS A 27 3.149 2.536 6.193 1.00 0.00 O ATOM 378 CB HIS A 27 5.238 4.531 6.318 1.00 0.00 C ATOM 379 CG HIS A 27 6.263 5.527 6.768 1.00 0.00 C ATOM 380 ND1 HIS A 27 6.010 6.487 7.725 1.00 0.00 N ATOM 381 CD2 HIS A 27 7.549 5.707 6.388 1.00 0.00 C ATOM 382 CE1 HIS A 27 7.096 7.216 7.913 1.00 0.00 C ATOM 383 NE2 HIS A 27 8.045 6.763 7.113 1.00 0.00 N ATOM 0 H HIS A 27 5.843 1.860 5.669 1.00 0.00 H new ATOM 0 HA HIS A 27 5.583 3.457 8.145 1.00 0.00 H new ATOM 0 HB2 HIS A 27 5.413 4.291 5.269 1.00 0.00 H new ATOM 0 HB3 HIS A 27 4.249 4.986 6.380 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.086 5.128 5.651 1.00 0.00 H new ATOM 0 HE1 HIS A 27 7.192 8.041 8.603 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.992 7.137 7.045 1.00 0.00 H new ATOM 392 N ILE A 28 3.403 2.321 8.419 1.00 0.00 N ATOM 393 CA ILE A 28 2.073 1.762 8.626 1.00 0.00 C ATOM 394 C ILE A 28 1.099 2.827 9.120 1.00 0.00 C ATOM 395 O ILE A 28 1.263 3.374 10.211 1.00 0.00 O ATOM 396 CB ILE A 28 2.102 0.601 9.638 1.00 0.00 C ATOM 397 CG1 ILE A 28 3.151 -0.435 9.229 1.00 0.00 C ATOM 398 CG2 ILE A 28 0.727 -0.042 9.746 1.00 0.00 C ATOM 399 CD1 ILE A 28 3.426 -1.470 10.297 1.00 0.00 C ATOM 0 H ILE A 28 3.957 2.420 9.270 1.00 0.00 H new ATOM 0 HA ILE A 28 1.736 1.384 7.661 1.00 0.00 H new ATOM 0 HB ILE A 28 2.373 0.998 10.616 1.00 0.00 H new ATOM 0 HG12 ILE A 28 2.817 -0.940 8.323 1.00 0.00 H new ATOM 0 HG13 ILE A 28 4.081 0.078 8.984 1.00 0.00 H new ATOM 0 HG21 ILE A 28 0.764 -0.861 10.465 1.00 0.00 H new ATOM 0 HG22 ILE A 28 0.003 0.701 10.079 1.00 0.00 H new ATOM 0 HG23 ILE A 28 0.428 -0.428 8.771 1.00 0.00 H new ATOM 0 HD11 ILE A 28 4.179 -2.172 9.938 1.00 0.00 H new ATOM 0 HD12 ILE A 28 3.790 -0.976 11.198 1.00 0.00 H new ATOM 0 HD13 ILE A 28 2.507 -2.010 10.526 1.00 0.00 H new ATOM 411 N ILE A 29 0.087 3.116 8.309 1.00 0.00 N ATOM 412 CA ILE A 29 -0.915 4.113 8.665 1.00 0.00 C ATOM 413 C ILE A 29 -2.326 3.566 8.479 1.00 0.00 C ATOM 414 O ILE A 29 -2.607 2.865 7.507 1.00 0.00 O ATOM 415 CB ILE A 29 -0.758 5.393 7.823 1.00 0.00 C ATOM 416 CG1 ILE A 29 -1.030 5.096 6.347 1.00 0.00 C ATOM 417 CG2 ILE A 29 0.635 5.978 8.003 1.00 0.00 C ATOM 418 CD1 ILE A 29 -0.866 6.301 5.448 1.00 0.00 C ATOM 0 H ILE A 29 -0.061 2.674 7.402 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.758 4.357 9.716 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.487 6.127 8.166 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.354 4.309 6.013 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.044 4.711 6.243 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.730 6.882 7.402 1.00 0.00 H new ATOM 0 HG22 ILE A 29 0.794 6.222 9.053 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.380 5.249 7.683 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.074 6.017 4.417 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.561 7.082 5.756 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.156 6.674 5.522 1.00 0.00 H new ATOM 430 N GLU A 30 -3.210 3.893 9.416 1.00 0.00 N ATOM 431 CA GLU A 30 -4.593 3.435 9.354 1.00 0.00 C ATOM 432 C GLU A 30 -5.506 4.532 8.815 1.00 0.00 C ATOM 433 O GLU A 30 -5.567 5.632 9.366 1.00 0.00 O ATOM 434 CB GLU A 30 -5.070 2.994 10.740 1.00 0.00 C ATOM 435 CG GLU A 30 -4.810 1.526 11.035 1.00 0.00 C ATOM 436 CD GLU A 30 -4.587 1.259 12.511 1.00 0.00 C ATOM 437 OE1 GLU A 30 -3.622 1.814 13.076 1.00 0.00 O ATOM 438 OE2 GLU A 30 -5.380 0.495 13.100 1.00 0.00 O ATOM 0 H GLU A 30 -2.993 4.473 10.227 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.637 2.584 8.675 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.573 3.601 11.496 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -6.139 3.189 10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.656 0.934 10.686 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.936 1.195 10.474 1.00 0.00 H new ATOM 445 N LEU A 31 -6.215 4.225 7.734 1.00 0.00 N ATOM 446 CA LEU A 31 -7.125 5.184 7.118 1.00 0.00 C ATOM 447 C LEU A 31 -8.548 4.637 7.080 1.00 0.00 C ATOM 448 O LEU A 31 -8.771 3.487 6.702 1.00 0.00 O ATOM 449 CB LEU A 31 -6.659 5.523 5.701 1.00 0.00 C ATOM 450 CG LEU A 31 -5.170 5.831 5.540 1.00 0.00 C ATOM 451 CD1 LEU A 31 -4.820 6.024 4.073 1.00 0.00 C ATOM 452 CD2 LEU A 31 -4.790 7.064 6.347 1.00 0.00 C ATOM 0 H LEU A 31 -6.177 3.319 7.266 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.120 6.091 7.722 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.909 4.687 5.048 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.228 6.384 5.349 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.600 4.983 5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.756 6.242 3.978 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -5.054 5.114 3.520 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.398 6.854 3.667 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.727 7.268 6.221 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.368 7.920 5.998 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.003 6.888 7.402 1.00 0.00 H new ATOM 464 N GLU A 32 -9.508 5.470 7.472 1.00 0.00 N ATOM 465 CA GLU A 32 -10.910 5.069 7.480 1.00 0.00 C ATOM 466 C GLU A 32 -11.569 5.367 6.137 1.00 0.00 C ATOM 467 O GLU A 32 -11.739 6.527 5.759 1.00 0.00 O ATOM 468 CB GLU A 32 -11.662 5.788 8.602 1.00 0.00 C ATOM 469 CG GLU A 32 -12.828 4.991 9.162 1.00 0.00 C ATOM 470 CD GLU A 32 -13.831 5.861 9.895 1.00 0.00 C ATOM 471 OE1 GLU A 32 -14.741 6.403 9.232 1.00 0.00 O ATOM 472 OE2 GLU A 32 -13.706 6.000 11.129 1.00 0.00 O ATOM 0 H GLU A 32 -9.340 6.425 7.788 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.953 3.994 7.655 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.965 6.012 9.410 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.032 6.742 8.227 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -13.331 4.470 8.348 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.449 4.228 9.842 1.00 0.00 H new ATOM 479 N LYS A 33 -11.940 4.312 5.419 1.00 0.00 N ATOM 480 CA LYS A 33 -12.582 4.459 4.118 1.00 0.00 C ATOM 481 C LYS A 33 -13.534 5.650 4.113 1.00 0.00 C ATOM 482 O LYS A 33 -14.519 5.673 4.851 1.00 0.00 O ATOM 483 CB LYS A 33 -13.343 3.182 3.756 1.00 0.00 C ATOM 484 CG LYS A 33 -12.447 2.059 3.261 1.00 0.00 C ATOM 485 CD LYS A 33 -13.172 1.162 2.271 1.00 0.00 C ATOM 486 CE LYS A 33 -13.888 0.020 2.975 1.00 0.00 C ATOM 487 NZ LYS A 33 -15.099 -0.419 2.229 1.00 0.00 N ATOM 0 H LYS A 33 -11.807 3.345 5.716 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.805 4.635 3.374 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.894 2.837 4.631 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -14.080 3.414 2.987 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -11.560 2.481 2.789 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.105 1.465 4.108 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -13.893 1.751 1.705 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.458 0.758 1.554 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.205 -0.822 3.087 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.174 0.334 3.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -15.927 -0.380 2.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.252 0.210 1.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -14.965 -1.394 1.893 1.00 0.00 H new ATOM 501 N ASP A 34 -13.236 6.636 3.274 1.00 0.00 N ATOM 502 CA ASP A 34 -14.068 7.830 3.171 1.00 0.00 C ATOM 503 C ASP A 34 -15.353 7.532 2.405 1.00 0.00 C ATOM 504 O ASP A 34 -15.621 6.386 2.042 1.00 0.00 O ATOM 505 CB ASP A 34 -13.297 8.956 2.480 1.00 0.00 C ATOM 506 CG ASP A 34 -13.792 10.330 2.886 1.00 0.00 C ATOM 507 OD1 ASP A 34 -14.400 10.445 3.972 1.00 0.00 O ATOM 508 OD2 ASP A 34 -13.572 11.291 2.120 1.00 0.00 O ATOM 0 H ASP A 34 -12.425 6.632 2.655 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.333 8.147 4.180 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -12.238 8.869 2.722 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.388 8.845 1.399 1.00 0.00 H new ATOM 513 N LYS A 35 -16.145 8.570 2.162 1.00 0.00 N ATOM 514 CA LYS A 35 -17.402 8.422 1.439 1.00 0.00 C ATOM 515 C LYS A 35 -17.218 7.550 0.201 1.00 0.00 C ATOM 516 O LYS A 35 -18.169 6.940 -0.287 1.00 0.00 O ATOM 517 CB LYS A 35 -17.947 9.793 1.033 1.00 0.00 C ATOM 518 CG LYS A 35 -17.138 10.469 -0.061 1.00 0.00 C ATOM 519 CD LYS A 35 -17.767 11.785 -0.486 1.00 0.00 C ATOM 520 CE LYS A 35 -17.672 12.830 0.615 1.00 0.00 C ATOM 521 NZ LYS A 35 -17.914 14.205 0.097 1.00 0.00 N ATOM 0 H LYS A 35 -15.938 9.525 2.456 1.00 0.00 H new ATOM 0 HA LYS A 35 -18.118 7.936 2.102 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.977 9.680 0.694 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.969 10.440 1.910 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.123 10.647 0.293 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.063 9.805 -0.922 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.270 12.154 -1.383 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.813 11.622 -0.745 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -18.399 12.603 1.395 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -16.685 12.784 1.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -17.840 14.888 0.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.205 14.432 -0.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -18.866 14.257 -0.320 1.00 0.00 H new ATOM 535 N ASN A 36 -15.989 7.495 -0.301 1.00 0.00 N ATOM 536 CA ASN A 36 -15.680 6.697 -1.482 1.00 0.00 C ATOM 537 C ASN A 36 -14.692 5.584 -1.144 1.00 0.00 C ATOM 538 O ASN A 36 -14.580 4.598 -1.870 1.00 0.00 O ATOM 539 CB ASN A 36 -15.106 7.585 -2.588 1.00 0.00 C ATOM 540 CG ASN A 36 -14.790 6.805 -3.850 1.00 0.00 C ATOM 541 OD1 ASN A 36 -15.631 6.676 -4.740 1.00 0.00 O ATOM 542 ND2 ASN A 36 -13.573 6.281 -3.932 1.00 0.00 N ATOM 0 H ASN A 36 -15.190 7.994 0.092 1.00 0.00 H new ATOM 0 HA ASN A 36 -16.606 6.242 -1.834 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -15.819 8.376 -2.822 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -14.199 8.070 -2.227 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -13.303 5.746 -4.757 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -12.908 6.413 -3.170 1.00 0.00 H new ATOM 549 N GLY A 37 -13.978 5.751 -0.035 1.00 0.00 N ATOM 550 CA GLY A 37 -13.010 4.754 0.381 1.00 0.00 C ATOM 551 C GLY A 37 -11.585 5.163 0.065 1.00 0.00 C ATOM 552 O GLY A 37 -11.345 6.249 -0.464 1.00 0.00 O ATOM 0 H GLY A 37 -14.053 6.559 0.583 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -13.107 4.583 1.453 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -13.232 3.808 -0.114 1.00 0.00 H new ATOM 556 N LEU A 38 -10.635 4.292 0.390 1.00 0.00 N ATOM 557 CA LEU A 38 -9.225 4.569 0.139 1.00 0.00 C ATOM 558 C LEU A 38 -8.973 4.808 -1.346 1.00 0.00 C ATOM 559 O LEU A 38 -9.046 3.884 -2.155 1.00 0.00 O ATOM 560 CB LEU A 38 -8.361 3.407 0.634 1.00 0.00 C ATOM 561 CG LEU A 38 -8.730 2.832 2.002 1.00 0.00 C ATOM 562 CD1 LEU A 38 -7.811 1.674 2.360 1.00 0.00 C ATOM 563 CD2 LEU A 38 -8.668 3.914 3.070 1.00 0.00 C ATOM 0 H LEU A 38 -10.816 3.389 0.828 1.00 0.00 H new ATOM 0 HA LEU A 38 -8.955 5.473 0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.412 2.604 -0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -7.324 3.741 0.670 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.752 2.456 1.953 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.089 1.278 3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.906 0.889 1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.779 2.024 2.391 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -8.934 3.487 4.037 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.658 4.320 3.118 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.368 4.711 2.821 1.00 0.00 H new ATOM 575 N GLY A 39 -8.674 6.055 -1.697 1.00 0.00 N ATOM 576 CA GLY A 39 -8.413 6.393 -3.084 1.00 0.00 C ATOM 577 C GLY A 39 -6.932 6.511 -3.384 1.00 0.00 C ATOM 578 O GLY A 39 -6.270 7.442 -2.923 1.00 0.00 O ATOM 0 H GLY A 39 -8.608 6.837 -1.046 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.851 5.631 -3.729 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.905 7.336 -3.324 1.00 0.00 H new ATOM 582 N LEU A 40 -6.409 5.565 -4.156 1.00 0.00 N ATOM 583 CA LEU A 40 -4.995 5.565 -4.515 1.00 0.00 C ATOM 584 C LEU A 40 -4.787 4.986 -5.911 1.00 0.00 C ATOM 585 O LEU A 40 -5.395 3.978 -6.272 1.00 0.00 O ATOM 586 CB LEU A 40 -4.188 4.764 -3.492 1.00 0.00 C ATOM 587 CG LEU A 40 -4.346 5.187 -2.032 1.00 0.00 C ATOM 588 CD1 LEU A 40 -4.154 3.996 -1.106 1.00 0.00 C ATOM 589 CD2 LEU A 40 -3.361 6.296 -1.688 1.00 0.00 C ATOM 0 H LEU A 40 -6.943 4.788 -4.546 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.646 6.598 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.470 3.715 -3.578 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.133 4.833 -3.757 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.357 5.570 -1.893 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.270 4.317 -0.071 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.898 3.233 -1.335 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.155 3.582 -1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.488 6.585 -0.645 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.343 5.940 -1.845 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.546 7.159 -2.328 1.00 0.00 H new ATOM 601 N SER A 41 -3.924 5.628 -6.690 1.00 0.00 N ATOM 602 CA SER A 41 -3.637 5.177 -8.047 1.00 0.00 C ATOM 603 C SER A 41 -2.473 4.191 -8.057 1.00 0.00 C ATOM 604 O SER A 41 -1.311 4.582 -7.945 1.00 0.00 O ATOM 605 CB SER A 41 -3.315 6.372 -8.947 1.00 0.00 C ATOM 606 OG SER A 41 -4.485 7.112 -9.250 1.00 0.00 O ATOM 0 H SER A 41 -3.411 6.462 -6.405 1.00 0.00 H new ATOM 0 HA SER A 41 -4.523 4.671 -8.430 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.590 7.019 -8.453 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.853 6.022 -9.870 1.00 0.00 H new ATOM 0 HG SER A 41 -4.252 7.871 -9.825 1.00 0.00 H new ATOM 612 N LEU A 42 -2.794 2.909 -8.192 1.00 0.00 N ATOM 613 CA LEU A 42 -1.777 1.864 -8.217 1.00 0.00 C ATOM 614 C LEU A 42 -1.317 1.585 -9.645 1.00 0.00 C ATOM 615 O LEU A 42 -2.086 1.728 -10.594 1.00 0.00 O ATOM 616 CB LEU A 42 -2.320 0.581 -7.585 1.00 0.00 C ATOM 617 CG LEU A 42 -3.082 0.750 -6.270 1.00 0.00 C ATOM 618 CD1 LEU A 42 -3.684 -0.574 -5.828 1.00 0.00 C ATOM 619 CD2 LEU A 42 -2.165 1.309 -5.191 1.00 0.00 C ATOM 0 H LEU A 42 -3.751 2.568 -8.286 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.920 2.212 -7.640 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.980 0.097 -8.304 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.484 -0.097 -7.413 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.895 1.458 -6.431 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.222 -0.434 -4.891 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.373 -0.933 -6.592 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.889 -1.305 -5.684 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.724 1.423 -4.262 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.331 0.625 -5.032 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.783 2.280 -5.506 1.00 0.00 H new ATOM 631 N ALA A 43 -0.057 1.187 -9.788 1.00 0.00 N ATOM 632 CA ALA A 43 0.504 0.884 -11.099 1.00 0.00 C ATOM 633 C ALA A 43 1.576 -0.197 -11.001 1.00 0.00 C ATOM 634 O ALA A 43 2.480 -0.115 -10.171 1.00 0.00 O ATOM 635 CB ALA A 43 1.078 2.144 -11.730 1.00 0.00 C ATOM 0 H ALA A 43 0.594 1.067 -9.012 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.298 0.506 -11.733 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.494 1.904 -12.709 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.288 2.886 -11.844 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.864 2.546 -11.090 1.00 0.00 H new ATOM 641 N GLY A 44 1.467 -1.210 -11.855 1.00 0.00 N ATOM 642 CA GLY A 44 2.433 -2.293 -11.847 1.00 0.00 C ATOM 643 C GLY A 44 3.851 -1.807 -12.070 1.00 0.00 C ATOM 644 O GLY A 44 4.069 -0.651 -12.432 1.00 0.00 O ATOM 0 H GLY A 44 0.728 -1.300 -12.552 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.378 -2.818 -10.893 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.173 -3.013 -12.623 1.00 0.00 H new ATOM 648 N ASN A 45 4.820 -2.690 -11.850 1.00 0.00 N ATOM 649 CA ASN A 45 6.225 -2.344 -12.027 1.00 0.00 C ATOM 650 C ASN A 45 6.593 -2.301 -13.507 1.00 0.00 C ATOM 651 O ASN A 45 6.152 -3.141 -14.292 1.00 0.00 O ATOM 652 CB ASN A 45 7.116 -3.351 -11.297 1.00 0.00 C ATOM 653 CG ASN A 45 8.589 -3.137 -11.587 1.00 0.00 C ATOM 654 OD1 ASN A 45 9.109 -3.613 -12.597 1.00 0.00 O ATOM 655 ND2 ASN A 45 9.268 -2.419 -10.701 1.00 0.00 N ATOM 0 H ASN A 45 4.657 -3.651 -11.549 1.00 0.00 H new ATOM 0 HA ASN A 45 6.385 -1.353 -11.602 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.945 -3.272 -10.223 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.834 -4.362 -11.591 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.262 -2.242 -10.843 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.795 -2.044 -9.878 1.00 0.00 H new ATOM 662 N LYS A 46 7.405 -1.318 -13.881 1.00 0.00 N ATOM 663 CA LYS A 46 7.835 -1.166 -15.266 1.00 0.00 C ATOM 664 C LYS A 46 8.017 -2.526 -15.932 1.00 0.00 C ATOM 665 O LYS A 46 7.519 -2.760 -17.033 1.00 0.00 O ATOM 666 CB LYS A 46 9.143 -0.375 -15.331 1.00 0.00 C ATOM 667 CG LYS A 46 8.951 1.128 -15.225 1.00 0.00 C ATOM 668 CD LYS A 46 10.282 1.854 -15.112 1.00 0.00 C ATOM 669 CE LYS A 46 10.134 3.338 -15.413 1.00 0.00 C ATOM 670 NZ LYS A 46 11.440 3.966 -15.756 1.00 0.00 N ATOM 0 H LYS A 46 7.779 -0.614 -13.244 1.00 0.00 H new ATOM 0 HA LYS A 46 7.060 -0.620 -15.803 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.799 -0.707 -14.526 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.649 -0.603 -16.269 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.412 1.489 -16.101 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.336 1.357 -14.355 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.685 1.724 -14.108 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.999 1.411 -15.803 1.00 0.00 H new ATOM 0 HE2 LYS A 46 9.437 3.473 -16.240 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.704 3.843 -14.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.298 4.977 -15.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 12.097 3.859 -14.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 11.839 3.501 -16.596 1.00 0.00 H new ATOM 684 N ASP A 47 8.733 -3.419 -15.257 1.00 0.00 N ATOM 685 CA ASP A 47 8.978 -4.757 -15.782 1.00 0.00 C ATOM 686 C ASP A 47 7.855 -5.710 -15.387 1.00 0.00 C ATOM 687 O ASP A 47 7.690 -6.036 -14.211 1.00 0.00 O ATOM 688 CB ASP A 47 10.319 -5.289 -15.274 1.00 0.00 C ATOM 689 CG ASP A 47 11.474 -4.906 -16.178 1.00 0.00 C ATOM 690 OD1 ASP A 47 11.487 -5.351 -17.344 1.00 0.00 O ATOM 691 OD2 ASP A 47 12.366 -4.161 -15.719 1.00 0.00 O ATOM 0 H ASP A 47 9.154 -3.240 -14.345 1.00 0.00 H new ATOM 0 HA ASP A 47 9.010 -4.694 -16.870 1.00 0.00 H new ATOM 0 HB2 ASP A 47 10.503 -4.903 -14.271 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.269 -6.375 -15.194 1.00 0.00 H new ATOM 696 N ARG A 48 7.087 -6.154 -16.376 1.00 0.00 N ATOM 697 CA ARG A 48 5.978 -7.068 -16.131 1.00 0.00 C ATOM 698 C ARG A 48 6.425 -8.246 -15.270 1.00 0.00 C ATOM 699 O ARG A 48 5.788 -8.572 -14.268 1.00 0.00 O ATOM 700 CB ARG A 48 5.407 -7.578 -17.455 1.00 0.00 C ATOM 701 CG ARG A 48 4.132 -8.390 -17.297 1.00 0.00 C ATOM 702 CD ARG A 48 3.318 -8.405 -18.581 1.00 0.00 C ATOM 703 NE ARG A 48 2.109 -9.214 -18.453 1.00 0.00 N ATOM 704 CZ ARG A 48 1.304 -9.499 -19.471 1.00 0.00 C ATOM 705 NH1 ARG A 48 1.579 -9.043 -20.685 1.00 0.00 N ATOM 706 NH2 ARG A 48 0.222 -10.242 -19.275 1.00 0.00 N ATOM 0 H ARG A 48 7.212 -5.896 -17.355 1.00 0.00 H new ATOM 0 HA ARG A 48 5.202 -6.522 -15.595 1.00 0.00 H new ATOM 0 HB2 ARG A 48 5.207 -6.727 -18.106 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.158 -8.191 -17.953 1.00 0.00 H new ATOM 0 HG2 ARG A 48 4.383 -9.412 -17.012 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.531 -7.972 -16.489 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.045 -7.384 -18.849 1.00 0.00 H new ATOM 0 HD3 ARG A 48 3.931 -8.795 -19.394 1.00 0.00 H new ATOM 0 HE ARG A 48 1.869 -9.580 -17.532 1.00 0.00 H new ATOM 0 HH11 ARG A 48 2.410 -8.472 -20.839 1.00 0.00 H new ATOM 0 HH12 ARG A 48 0.960 -9.263 -21.465 1.00 0.00 H new ATOM 0 HH21 ARG A 48 0.008 -10.595 -18.342 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.395 -10.460 -20.057 1.00 0.00 H new ATOM 720 N SER A 49 7.523 -8.880 -15.668 1.00 0.00 N ATOM 721 CA SER A 49 8.053 -10.025 -14.935 1.00 0.00 C ATOM 722 C SER A 49 8.105 -9.735 -13.438 1.00 0.00 C ATOM 723 O SER A 49 7.913 -10.630 -12.615 1.00 0.00 O ATOM 724 CB SER A 49 9.450 -10.381 -15.446 1.00 0.00 C ATOM 725 OG SER A 49 9.383 -11.031 -16.703 1.00 0.00 O ATOM 0 H SER A 49 8.063 -8.621 -16.493 1.00 0.00 H new ATOM 0 HA SER A 49 7.386 -10.872 -15.100 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.050 -9.475 -15.533 1.00 0.00 H new ATOM 0 HB3 SER A 49 9.951 -11.027 -14.725 1.00 0.00 H new ATOM 0 HG SER A 49 10.289 -11.246 -17.009 1.00 0.00 H new ATOM 731 N ARG A 50 8.365 -8.478 -13.094 1.00 0.00 N ATOM 732 CA ARG A 50 8.444 -8.069 -11.697 1.00 0.00 C ATOM 733 C ARG A 50 7.074 -7.644 -11.177 1.00 0.00 C ATOM 734 O ARG A 50 6.433 -6.758 -11.742 1.00 0.00 O ATOM 735 CB ARG A 50 9.442 -6.921 -11.535 1.00 0.00 C ATOM 736 CG ARG A 50 10.871 -7.384 -11.308 1.00 0.00 C ATOM 737 CD ARG A 50 11.754 -6.248 -10.816 1.00 0.00 C ATOM 738 NE ARG A 50 12.839 -6.727 -9.964 1.00 0.00 N ATOM 739 CZ ARG A 50 13.668 -5.923 -9.307 1.00 0.00 C ATOM 740 NH1 ARG A 50 13.536 -4.607 -9.404 1.00 0.00 N ATOM 741 NH2 ARG A 50 14.631 -6.434 -8.552 1.00 0.00 N ATOM 0 H ARG A 50 8.525 -7.725 -13.764 1.00 0.00 H new ATOM 0 HA ARG A 50 8.786 -8.923 -11.113 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.409 -6.294 -12.426 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.133 -6.298 -10.696 1.00 0.00 H new ATOM 0 HG2 ARG A 50 10.880 -8.195 -10.580 1.00 0.00 H new ATOM 0 HG3 ARG A 50 11.276 -7.785 -12.237 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.172 -5.718 -11.671 1.00 0.00 H new ATOM 0 HD3 ARG A 50 11.148 -5.531 -10.262 1.00 0.00 H new ATOM 0 HE ARG A 50 12.968 -7.734 -9.868 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.797 -4.210 -9.984 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.174 -3.992 -8.899 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.736 -7.446 -8.475 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.267 -5.815 -8.048 1.00 0.00 H new ATOM 755 N MET A 51 6.632 -8.282 -10.098 1.00 0.00 N ATOM 756 CA MET A 51 5.338 -7.969 -9.502 1.00 0.00 C ATOM 757 C MET A 51 5.503 -7.050 -8.296 1.00 0.00 C ATOM 758 O MET A 51 6.301 -7.324 -7.400 1.00 0.00 O ATOM 759 CB MET A 51 4.621 -9.254 -9.085 1.00 0.00 C ATOM 760 CG MET A 51 3.735 -9.836 -10.174 1.00 0.00 C ATOM 761 SD MET A 51 2.487 -8.671 -10.752 1.00 0.00 S ATOM 762 CE MET A 51 0.983 -9.553 -10.342 1.00 0.00 C ATOM 0 H MET A 51 7.150 -9.018 -9.619 1.00 0.00 H new ATOM 0 HA MET A 51 4.737 -7.452 -10.250 1.00 0.00 H new ATOM 0 HB2 MET A 51 5.364 -9.998 -8.796 1.00 0.00 H new ATOM 0 HB3 MET A 51 4.013 -9.051 -8.203 1.00 0.00 H new ATOM 0 HG2 MET A 51 4.356 -10.144 -11.015 1.00 0.00 H new ATOM 0 HG3 MET A 51 3.242 -10.732 -9.796 1.00 0.00 H new ATOM 0 HE1 MET A 51 0.120 -8.936 -10.591 1.00 0.00 H new ATOM 0 HE2 MET A 51 0.940 -10.483 -10.910 1.00 0.00 H new ATOM 0 HE3 MET A 51 0.973 -9.778 -9.276 1.00 0.00 H new ATOM 772 N SER A 52 4.745 -5.958 -8.280 1.00 0.00 N ATOM 773 CA SER A 52 4.811 -4.997 -7.186 1.00 0.00 C ATOM 774 C SER A 52 3.755 -3.909 -7.355 1.00 0.00 C ATOM 775 O SER A 52 3.474 -3.469 -8.470 1.00 0.00 O ATOM 776 CB SER A 52 6.203 -4.367 -7.116 1.00 0.00 C ATOM 777 OG SER A 52 7.077 -5.147 -6.318 1.00 0.00 O ATOM 0 H SER A 52 4.078 -5.717 -9.013 1.00 0.00 H new ATOM 0 HA SER A 52 4.614 -5.529 -6.255 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.613 -4.270 -8.121 1.00 0.00 H new ATOM 0 HB3 SER A 52 6.130 -3.361 -6.704 1.00 0.00 H new ATOM 0 HG SER A 52 7.153 -6.047 -6.699 1.00 0.00 H new ATOM 783 N ILE A 53 3.174 -3.479 -6.240 1.00 0.00 N ATOM 784 CA ILE A 53 2.151 -2.441 -6.263 1.00 0.00 C ATOM 785 C ILE A 53 2.677 -1.136 -5.676 1.00 0.00 C ATOM 786 O ILE A 53 3.000 -1.062 -4.490 1.00 0.00 O ATOM 787 CB ILE A 53 0.894 -2.872 -5.483 1.00 0.00 C ATOM 788 CG1 ILE A 53 0.480 -4.289 -5.883 1.00 0.00 C ATOM 789 CG2 ILE A 53 -0.243 -1.892 -5.729 1.00 0.00 C ATOM 790 CD1 ILE A 53 -0.358 -4.992 -4.838 1.00 0.00 C ATOM 0 H ILE A 53 3.394 -3.833 -5.309 1.00 0.00 H new ATOM 0 HA ILE A 53 1.885 -2.284 -7.308 1.00 0.00 H new ATOM 0 HB ILE A 53 1.126 -2.869 -4.418 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.080 -4.245 -6.817 1.00 0.00 H new ATOM 0 HG13 ILE A 53 1.376 -4.879 -6.076 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.124 -2.210 -5.171 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.056 -0.897 -5.399 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.477 -1.866 -6.793 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.615 -5.991 -5.189 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.207 -5.068 -3.909 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -1.271 -4.424 -4.661 1.00 0.00 H new ATOM 802 N PHE A 54 2.759 -0.108 -6.513 1.00 0.00 N ATOM 803 CA PHE A 54 3.246 1.196 -6.077 1.00 0.00 C ATOM 804 C PHE A 54 2.120 2.226 -6.081 1.00 0.00 C ATOM 805 O PHE A 54 1.028 1.967 -6.587 1.00 0.00 O ATOM 806 CB PHE A 54 4.386 1.668 -6.983 1.00 0.00 C ATOM 807 CG PHE A 54 5.569 0.743 -6.988 1.00 0.00 C ATOM 808 CD1 PHE A 54 6.376 0.623 -5.868 1.00 0.00 C ATOM 809 CD2 PHE A 54 5.874 -0.007 -8.113 1.00 0.00 C ATOM 810 CE1 PHE A 54 7.465 -0.228 -5.869 1.00 0.00 C ATOM 811 CE2 PHE A 54 6.962 -0.859 -8.120 1.00 0.00 C ATOM 812 CZ PHE A 54 7.759 -0.969 -6.997 1.00 0.00 C ATOM 0 H PHE A 54 2.495 -0.152 -7.497 1.00 0.00 H new ATOM 0 HA PHE A 54 3.619 1.094 -5.058 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.011 1.771 -8.001 1.00 0.00 H new ATOM 0 HB3 PHE A 54 4.710 2.658 -6.661 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.151 1.201 -4.984 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.255 0.075 -8.994 1.00 0.00 H new ATOM 0 HE1 PHE A 54 8.085 -0.314 -4.989 1.00 0.00 H new ATOM 0 HE2 PHE A 54 7.189 -1.438 -9.003 1.00 0.00 H new ATOM 0 HZ PHE A 54 8.611 -1.633 -7.001 1.00 0.00 H new ATOM 822 N VAL A 55 2.393 3.395 -5.511 1.00 0.00 N ATOM 823 CA VAL A 55 1.405 4.465 -5.448 1.00 0.00 C ATOM 824 C VAL A 55 1.824 5.652 -6.308 1.00 0.00 C ATOM 825 O VAL A 55 2.594 6.508 -5.872 1.00 0.00 O ATOM 826 CB VAL A 55 1.188 4.945 -4.001 1.00 0.00 C ATOM 827 CG1 VAL A 55 0.225 6.121 -3.967 1.00 0.00 C ATOM 828 CG2 VAL A 55 0.681 3.804 -3.132 1.00 0.00 C ATOM 0 H VAL A 55 3.291 3.625 -5.086 1.00 0.00 H new ATOM 0 HA VAL A 55 0.470 4.055 -5.831 1.00 0.00 H new ATOM 0 HB VAL A 55 2.145 5.279 -3.600 1.00 0.00 H new ATOM 0 HG11 VAL A 55 0.084 6.446 -2.936 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.634 6.943 -4.554 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.734 5.818 -4.386 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.533 4.161 -2.113 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.266 3.437 -3.529 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.412 2.995 -3.131 1.00 0.00 H new ATOM 838 N VAL A 56 1.312 5.698 -7.534 1.00 0.00 N ATOM 839 CA VAL A 56 1.631 6.781 -8.456 1.00 0.00 C ATOM 840 C VAL A 56 0.556 7.862 -8.428 1.00 0.00 C ATOM 841 O VAL A 56 0.392 8.614 -9.388 1.00 0.00 O ATOM 842 CB VAL A 56 1.785 6.264 -9.899 1.00 0.00 C ATOM 843 CG1 VAL A 56 2.718 5.063 -9.938 1.00 0.00 C ATOM 844 CG2 VAL A 56 0.427 5.914 -10.487 1.00 0.00 C ATOM 0 H VAL A 56 0.674 4.997 -7.912 1.00 0.00 H new ATOM 0 HA VAL A 56 2.579 7.206 -8.127 1.00 0.00 H new ATOM 0 HB VAL A 56 2.224 7.056 -10.506 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.815 4.711 -10.965 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.698 5.351 -9.559 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.310 4.265 -9.318 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.555 5.551 -11.507 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.043 5.139 -9.882 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -0.206 6.801 -10.495 1.00 0.00 H new ATOM 854 N GLY A 57 -0.173 7.934 -7.319 1.00 0.00 N ATOM 855 CA GLY A 57 -1.224 8.927 -7.186 1.00 0.00 C ATOM 856 C GLY A 57 -2.084 8.699 -5.959 1.00 0.00 C ATOM 857 O GLY A 57 -2.273 7.561 -5.527 1.00 0.00 O ATOM 0 H GLY A 57 -0.055 7.323 -6.511 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.777 9.920 -7.134 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.853 8.907 -8.076 1.00 0.00 H new ATOM 861 N ILE A 58 -2.607 9.783 -5.395 1.00 0.00 N ATOM 862 CA ILE A 58 -3.451 9.696 -4.210 1.00 0.00 C ATOM 863 C ILE A 58 -4.733 10.503 -4.387 1.00 0.00 C ATOM 864 O ILE A 58 -4.740 11.721 -4.212 1.00 0.00 O ATOM 865 CB ILE A 58 -2.713 10.195 -2.954 1.00 0.00 C ATOM 866 CG1 ILE A 58 -1.482 9.328 -2.680 1.00 0.00 C ATOM 867 CG2 ILE A 58 -3.647 10.192 -1.754 1.00 0.00 C ATOM 868 CD1 ILE A 58 -0.557 9.905 -1.632 1.00 0.00 C ATOM 0 H ILE A 58 -2.461 10.732 -5.740 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.702 8.643 -4.079 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.381 11.219 -3.129 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.809 8.339 -2.359 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.927 9.195 -3.609 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.110 10.547 -0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -4.495 10.848 -1.951 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.006 9.179 -1.575 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.293 9.238 -1.490 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.201 10.882 -1.959 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.096 10.012 -0.690 1.00 0.00 H new ATOM 880 N ASN A 59 -5.815 9.815 -4.735 1.00 0.00 N ATOM 881 CA ASN A 59 -7.104 10.468 -4.935 1.00 0.00 C ATOM 882 C ASN A 59 -7.329 11.559 -3.892 1.00 0.00 C ATOM 883 O ASN A 59 -7.381 11.301 -2.689 1.00 0.00 O ATOM 884 CB ASN A 59 -8.236 9.441 -4.867 1.00 0.00 C ATOM 885 CG ASN A 59 -9.417 9.824 -5.737 1.00 0.00 C ATOM 886 OD1 ASN A 59 -9.571 10.984 -6.118 1.00 0.00 O ATOM 887 ND2 ASN A 59 -10.259 8.847 -6.055 1.00 0.00 N ATOM 0 H ASN A 59 -5.825 8.806 -4.884 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.100 10.929 -5.923 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.859 8.467 -5.179 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -8.568 9.338 -3.834 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -11.073 9.044 -6.638 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.092 7.899 -5.717 1.00 0.00 H new ATOM 894 N PRO A 60 -7.466 12.808 -4.362 1.00 0.00 N ATOM 895 CA PRO A 60 -7.688 13.963 -3.487 1.00 0.00 C ATOM 896 C PRO A 60 -9.072 13.947 -2.847 1.00 0.00 C ATOM 897 O PRO A 60 -9.393 14.800 -2.021 1.00 0.00 O ATOM 898 CB PRO A 60 -7.551 15.157 -4.434 1.00 0.00 C ATOM 899 CG PRO A 60 -7.890 14.615 -5.779 1.00 0.00 C ATOM 900 CD PRO A 60 -7.414 13.188 -5.783 1.00 0.00 C ATOM 0 HA PRO A 60 -6.988 13.982 -2.651 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -8.225 15.966 -4.152 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -6.540 15.564 -4.414 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.963 14.669 -5.962 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -7.403 15.191 -6.566 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -8.056 12.552 -6.393 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -6.405 13.102 -6.185 1.00 0.00 H new ATOM 908 N GLU A 61 -9.887 12.971 -3.234 1.00 0.00 N ATOM 909 CA GLU A 61 -11.237 12.846 -2.698 1.00 0.00 C ATOM 910 C GLU A 61 -11.299 11.759 -1.628 1.00 0.00 C ATOM 911 O GLU A 61 -12.181 11.766 -0.770 1.00 0.00 O ATOM 912 CB GLU A 61 -12.229 12.529 -3.819 1.00 0.00 C ATOM 913 CG GLU A 61 -12.035 11.153 -4.433 1.00 0.00 C ATOM 914 CD GLU A 61 -12.439 11.102 -5.893 1.00 0.00 C ATOM 915 OE1 GLU A 61 -11.953 11.949 -6.672 1.00 0.00 O ATOM 916 OE2 GLU A 61 -13.241 10.218 -6.258 1.00 0.00 O ATOM 0 H GLU A 61 -9.636 12.256 -3.916 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.508 13.798 -2.242 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -13.243 12.603 -3.427 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.134 13.283 -4.601 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -10.989 10.862 -4.339 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.620 10.424 -3.873 1.00 0.00 H new ATOM 923 N GLY A 62 -10.355 10.825 -1.687 1.00 0.00 N ATOM 924 CA GLY A 62 -10.320 9.744 -0.719 1.00 0.00 C ATOM 925 C GLY A 62 -9.707 10.168 0.601 1.00 0.00 C ATOM 926 O GLY A 62 -9.325 11.323 0.791 1.00 0.00 O ATOM 0 H GLY A 62 -9.614 10.797 -2.387 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.334 9.382 -0.546 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -9.750 8.911 -1.130 1.00 0.00 H new ATOM 930 N PRO A 63 -9.609 9.219 1.544 1.00 0.00 N ATOM 931 CA PRO A 63 -9.040 9.477 2.871 1.00 0.00 C ATOM 932 C PRO A 63 -7.536 9.720 2.819 1.00 0.00 C ATOM 933 O PRO A 63 -7.034 10.685 3.394 1.00 0.00 O ATOM 934 CB PRO A 63 -9.348 8.192 3.644 1.00 0.00 C ATOM 935 CG PRO A 63 -9.467 7.139 2.598 1.00 0.00 C ATOM 936 CD PRO A 63 -10.044 7.821 1.388 1.00 0.00 C ATOM 0 HA PRO A 63 -9.457 10.375 3.326 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -8.554 7.957 4.353 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -10.270 8.286 4.217 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -8.495 6.701 2.373 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -10.112 6.327 2.933 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -9.668 7.384 0.463 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.131 7.739 1.361 1.00 0.00 H new ATOM 944 N ALA A 64 -6.822 8.839 2.126 1.00 0.00 N ATOM 945 CA ALA A 64 -5.375 8.959 1.998 1.00 0.00 C ATOM 946 C ALA A 64 -4.959 10.416 1.821 1.00 0.00 C ATOM 947 O ALA A 64 -3.971 10.864 2.402 1.00 0.00 O ATOM 948 CB ALA A 64 -4.877 8.121 0.830 1.00 0.00 C ATOM 0 H ALA A 64 -7.222 8.034 1.644 1.00 0.00 H new ATOM 0 HA ALA A 64 -4.922 8.587 2.917 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.795 8.220 0.746 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.134 7.075 0.997 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.345 8.467 -0.092 1.00 0.00 H new ATOM 954 N ALA A 65 -5.720 11.149 1.015 1.00 0.00 N ATOM 955 CA ALA A 65 -5.431 12.556 0.763 1.00 0.00 C ATOM 956 C ALA A 65 -5.763 13.411 1.980 1.00 0.00 C ATOM 957 O ALA A 65 -5.053 14.367 2.292 1.00 0.00 O ATOM 958 CB ALA A 65 -6.202 13.043 -0.455 1.00 0.00 C ATOM 0 H ALA A 65 -6.541 10.792 0.526 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.363 12.653 0.565 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.977 14.095 -0.632 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -5.911 12.458 -1.328 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.271 12.925 -0.280 1.00 0.00 H new ATOM 964 N ALA A 66 -6.848 13.063 2.664 1.00 0.00 N ATOM 965 CA ALA A 66 -7.274 13.798 3.848 1.00 0.00 C ATOM 966 C ALA A 66 -6.242 13.685 4.966 1.00 0.00 C ATOM 967 O ALA A 66 -5.851 14.686 5.566 1.00 0.00 O ATOM 968 CB ALA A 66 -8.628 13.294 4.324 1.00 0.00 C ATOM 0 H ALA A 66 -7.448 12.276 2.418 1.00 0.00 H new ATOM 0 HA ALA A 66 -7.365 14.850 3.578 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.933 13.852 5.209 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.366 13.433 3.534 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.556 12.235 4.570 1.00 0.00 H new ATOM 974 N ASP A 67 -5.806 12.461 5.239 1.00 0.00 N ATOM 975 CA ASP A 67 -4.819 12.217 6.285 1.00 0.00 C ATOM 976 C ASP A 67 -3.507 12.929 5.971 1.00 0.00 C ATOM 977 O ASP A 67 -2.861 13.483 6.859 1.00 0.00 O ATOM 978 CB ASP A 67 -4.573 10.715 6.443 1.00 0.00 C ATOM 979 CG ASP A 67 -4.154 10.343 7.852 1.00 0.00 C ATOM 980 OD1 ASP A 67 -3.451 11.150 8.494 1.00 0.00 O ATOM 981 OD2 ASP A 67 -4.530 9.244 8.312 1.00 0.00 O ATOM 0 H ASP A 67 -6.120 11.622 4.751 1.00 0.00 H new ATOM 0 HA ASP A 67 -5.212 12.614 7.221 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.481 10.171 6.181 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.800 10.400 5.742 1.00 0.00 H new ATOM 986 N GLY A 68 -3.118 12.910 4.699 1.00 0.00 N ATOM 987 CA GLY A 68 -1.885 13.556 4.290 1.00 0.00 C ATOM 988 C GLY A 68 -0.654 12.800 4.751 1.00 0.00 C ATOM 989 O GLY A 68 0.383 13.402 5.032 1.00 0.00 O ATOM 0 H GLY A 68 -3.635 12.458 3.945 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.868 13.644 3.204 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.858 14.569 4.693 1.00 0.00 H new ATOM 993 N ARG A 69 -0.769 11.479 4.831 1.00 0.00 N ATOM 994 CA ARG A 69 0.343 10.640 5.264 1.00 0.00 C ATOM 995 C ARG A 69 0.943 9.881 4.084 1.00 0.00 C ATOM 996 O ARG A 69 2.150 9.928 3.852 1.00 0.00 O ATOM 997 CB ARG A 69 -0.122 9.654 6.336 1.00 0.00 C ATOM 998 CG ARG A 69 -0.514 10.318 7.646 1.00 0.00 C ATOM 999 CD ARG A 69 0.682 10.468 8.574 1.00 0.00 C ATOM 1000 NE ARG A 69 1.502 11.626 8.227 1.00 0.00 N ATOM 1001 CZ ARG A 69 2.675 11.891 8.790 1.00 0.00 C ATOM 1002 NH1 ARG A 69 3.164 11.084 9.722 1.00 0.00 N ATOM 1003 NH2 ARG A 69 3.363 12.964 8.421 1.00 0.00 N ATOM 0 H ARG A 69 -1.620 10.966 4.602 1.00 0.00 H new ATOM 0 HA ARG A 69 1.112 11.288 5.685 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.974 9.091 5.955 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.675 8.936 6.527 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.944 11.299 7.444 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -1.286 9.727 8.138 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.333 10.566 9.602 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.292 9.565 8.529 1.00 0.00 H new ATOM 0 HE ARG A 69 1.154 12.266 7.513 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.639 10.258 10.008 1.00 0.00 H new ATOM 0 HH12 ARG A 69 4.065 11.290 10.153 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.991 13.587 7.704 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.264 13.166 8.855 1.00 0.00 H new ATOM 1017 N MET A 70 0.090 9.180 3.343 1.00 0.00 N ATOM 1018 CA MET A 70 0.536 8.411 2.187 1.00 0.00 C ATOM 1019 C MET A 70 1.127 9.327 1.120 1.00 0.00 C ATOM 1020 O MET A 70 0.586 10.396 0.837 1.00 0.00 O ATOM 1021 CB MET A 70 -0.628 7.610 1.601 1.00 0.00 C ATOM 1022 CG MET A 70 -0.774 6.221 2.201 1.00 0.00 C ATOM 1023 SD MET A 70 -1.490 5.037 1.046 1.00 0.00 S ATOM 1024 CE MET A 70 -0.012 4.365 0.290 1.00 0.00 C ATOM 0 H MET A 70 -0.913 9.129 3.523 1.00 0.00 H new ATOM 0 HA MET A 70 1.312 7.721 2.518 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.554 8.163 1.757 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.489 7.519 0.524 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.204 5.863 2.522 1.00 0.00 H new ATOM 0 HG3 MET A 70 -1.400 6.278 3.091 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.254 3.429 -0.213 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.381 5.077 -0.436 1.00 0.00 H new ATOM 0 HE3 MET A 70 0.738 4.180 1.059 1.00 0.00 H new ATOM 1034 N ARG A 71 2.240 8.901 0.532 1.00 0.00 N ATOM 1035 CA ARG A 71 2.905 9.684 -0.503 1.00 0.00 C ATOM 1036 C ARG A 71 3.071 8.867 -1.781 1.00 0.00 C ATOM 1037 O ARG A 71 2.859 7.654 -1.785 1.00 0.00 O ATOM 1038 CB ARG A 71 4.272 10.164 -0.011 1.00 0.00 C ATOM 1039 CG ARG A 71 4.193 11.123 1.165 1.00 0.00 C ATOM 1040 CD ARG A 71 3.786 12.519 0.719 1.00 0.00 C ATOM 1041 NE ARG A 71 4.931 13.304 0.265 1.00 0.00 N ATOM 1042 CZ ARG A 71 5.337 13.350 -0.999 1.00 0.00 C ATOM 1043 NH1 ARG A 71 4.693 12.659 -1.930 1.00 0.00 N ATOM 1044 NH2 ARG A 71 6.387 14.087 -1.334 1.00 0.00 N ATOM 0 H ARG A 71 2.700 8.018 0.754 1.00 0.00 H new ATOM 0 HA ARG A 71 2.281 10.550 -0.724 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.870 9.299 0.276 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.794 10.653 -0.834 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.474 10.749 1.894 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.160 11.167 1.665 1.00 0.00 H new ATOM 0 HD2 ARG A 71 3.056 12.444 -0.087 1.00 0.00 H new ATOM 0 HD3 ARG A 71 3.297 13.035 1.545 1.00 0.00 H new ATOM 0 HE ARG A 71 5.448 13.847 0.957 1.00 0.00 H new ATOM 0 HH11 ARG A 71 3.885 12.091 -1.676 1.00 0.00 H new ATOM 0 HH12 ARG A 71 5.006 12.695 -2.900 1.00 0.00 H new ATOM 0 HH21 ARG A 71 6.885 14.620 -0.621 1.00 0.00 H new ATOM 0 HH22 ARG A 71 6.697 14.121 -2.305 1.00 0.00 H new ATOM 1058 N ILE A 72 3.450 9.539 -2.862 1.00 0.00 N ATOM 1059 CA ILE A 72 3.644 8.876 -4.145 1.00 0.00 C ATOM 1060 C ILE A 72 4.957 8.100 -4.170 1.00 0.00 C ATOM 1061 O ILE A 72 6.030 8.670 -3.975 1.00 0.00 O ATOM 1062 CB ILE A 72 3.636 9.885 -5.308 1.00 0.00 C ATOM 1063 CG1 ILE A 72 2.451 10.844 -5.172 1.00 0.00 C ATOM 1064 CG2 ILE A 72 3.582 9.155 -6.642 1.00 0.00 C ATOM 1065 CD1 ILE A 72 1.153 10.153 -4.817 1.00 0.00 C ATOM 0 H ILE A 72 3.629 10.543 -2.875 1.00 0.00 H new ATOM 0 HA ILE A 72 2.812 8.183 -4.270 1.00 0.00 H new ATOM 0 HB ILE A 72 4.557 10.467 -5.271 1.00 0.00 H new ATOM 0 HG12 ILE A 72 2.680 11.585 -4.406 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.321 11.384 -6.110 1.00 0.00 H new ATOM 0 HG21 ILE A 72 3.577 9.882 -7.454 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.454 8.509 -6.739 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.676 8.551 -6.690 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.357 10.893 -4.737 1.00 0.00 H new ATOM 0 HD12 ILE A 72 0.901 9.431 -5.594 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.265 9.636 -3.864 1.00 0.00 H new ATOM 1077 N GLY A 73 4.864 6.796 -4.412 1.00 0.00 N ATOM 1078 CA GLY A 73 6.052 5.964 -4.460 1.00 0.00 C ATOM 1079 C GLY A 73 5.970 4.782 -3.514 1.00 0.00 C ATOM 1080 O GLY A 73 6.672 3.787 -3.691 1.00 0.00 O ATOM 0 H GLY A 73 3.987 6.301 -4.576 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.197 5.602 -5.478 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.925 6.567 -4.209 1.00 0.00 H new ATOM 1084 N ASP A 74 5.112 4.892 -2.505 1.00 0.00 N ATOM 1085 CA ASP A 74 4.941 3.825 -1.527 1.00 0.00 C ATOM 1086 C ASP A 74 4.621 2.502 -2.216 1.00 0.00 C ATOM 1087 O ASP A 74 3.964 2.477 -3.256 1.00 0.00 O ATOM 1088 CB ASP A 74 3.829 4.182 -0.539 1.00 0.00 C ATOM 1089 CG ASP A 74 4.233 5.292 0.411 1.00 0.00 C ATOM 1090 OD1 ASP A 74 5.430 5.371 0.756 1.00 0.00 O ATOM 1091 OD2 ASP A 74 3.351 6.082 0.809 1.00 0.00 O ATOM 0 H ASP A 74 4.524 5.710 -2.344 1.00 0.00 H new ATOM 0 HA ASP A 74 5.878 3.713 -0.982 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.940 4.486 -1.091 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.559 3.296 0.036 1.00 0.00 H new ATOM 1096 N GLU A 75 5.091 1.406 -1.629 1.00 0.00 N ATOM 1097 CA GLU A 75 4.856 0.080 -2.188 1.00 0.00 C ATOM 1098 C GLU A 75 4.028 -0.775 -1.233 1.00 0.00 C ATOM 1099 O GLU A 75 4.558 -1.361 -0.288 1.00 0.00 O ATOM 1100 CB GLU A 75 6.186 -0.615 -2.489 1.00 0.00 C ATOM 1101 CG GLU A 75 6.044 -2.097 -2.789 1.00 0.00 C ATOM 1102 CD GLU A 75 7.371 -2.756 -3.112 1.00 0.00 C ATOM 1103 OE1 GLU A 75 7.804 -2.674 -4.281 1.00 0.00 O ATOM 1104 OE2 GLU A 75 7.976 -3.354 -2.198 1.00 0.00 O ATOM 0 H GLU A 75 5.636 1.410 -0.767 1.00 0.00 H new ATOM 0 HA GLU A 75 4.299 0.200 -3.117 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.658 -0.124 -3.340 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.854 -0.488 -1.637 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.594 -2.596 -1.931 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.362 -2.230 -3.629 1.00 0.00 H new ATOM 1111 N LEU A 76 2.725 -0.840 -1.485 1.00 0.00 N ATOM 1112 CA LEU A 76 1.822 -1.622 -0.648 1.00 0.00 C ATOM 1113 C LEU A 76 2.353 -3.039 -0.450 1.00 0.00 C ATOM 1114 O LEU A 76 2.664 -3.738 -1.415 1.00 0.00 O ATOM 1115 CB LEU A 76 0.428 -1.672 -1.276 1.00 0.00 C ATOM 1116 CG LEU A 76 -0.351 -0.356 -1.286 1.00 0.00 C ATOM 1117 CD1 LEU A 76 -1.640 -0.504 -2.079 1.00 0.00 C ATOM 1118 CD2 LEU A 76 -0.646 0.100 0.136 1.00 0.00 C ATOM 0 H LEU A 76 2.270 -0.361 -2.262 1.00 0.00 H new ATOM 0 HA LEU A 76 1.758 -1.137 0.326 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.527 -2.020 -2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.163 -2.417 -0.742 1.00 0.00 H new ATOM 0 HG LEU A 76 0.263 0.404 -1.770 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.181 0.443 -2.075 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.405 -0.783 -3.106 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.260 -1.278 -1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.201 1.038 0.110 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.240 -0.659 0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.291 0.248 0.672 1.00 0.00 H new ATOM 1130 N LEU A 77 2.453 -3.456 0.808 1.00 0.00 N ATOM 1131 CA LEU A 77 2.944 -4.791 1.134 1.00 0.00 C ATOM 1132 C LEU A 77 1.813 -5.677 1.645 1.00 0.00 C ATOM 1133 O LEU A 77 1.674 -6.826 1.225 1.00 0.00 O ATOM 1134 CB LEU A 77 4.054 -4.705 2.183 1.00 0.00 C ATOM 1135 CG LEU A 77 5.249 -3.820 1.825 1.00 0.00 C ATOM 1136 CD1 LEU A 77 6.038 -3.458 3.073 1.00 0.00 C ATOM 1137 CD2 LEU A 77 6.143 -4.518 0.810 1.00 0.00 C ATOM 0 H LEU A 77 2.201 -2.890 1.618 1.00 0.00 H new ATOM 0 HA LEU A 77 3.346 -5.236 0.224 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.620 -4.337 3.113 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.420 -5.713 2.379 1.00 0.00 H new ATOM 0 HG LEU A 77 4.874 -2.899 1.378 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.884 -2.828 2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.394 -2.918 3.767 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.403 -4.368 3.550 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.988 -3.874 0.566 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.509 -5.454 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.572 -4.726 -0.095 1.00 0.00 H new ATOM 1149 N GLU A 78 1.006 -5.135 2.552 1.00 0.00 N ATOM 1150 CA GLU A 78 -0.113 -5.878 3.119 1.00 0.00 C ATOM 1151 C GLU A 78 -1.303 -4.957 3.375 1.00 0.00 C ATOM 1152 O GLU A 78 -1.141 -3.747 3.536 1.00 0.00 O ATOM 1153 CB GLU A 78 0.307 -6.561 4.422 1.00 0.00 C ATOM 1154 CG GLU A 78 1.636 -7.291 4.326 1.00 0.00 C ATOM 1155 CD GLU A 78 1.904 -8.175 5.528 1.00 0.00 C ATOM 1156 OE1 GLU A 78 0.943 -8.489 6.261 1.00 0.00 O ATOM 1157 OE2 GLU A 78 3.076 -8.554 5.735 1.00 0.00 O ATOM 0 H GLU A 78 1.106 -4.185 2.909 1.00 0.00 H new ATOM 0 HA GLU A 78 -0.413 -6.639 2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.370 -5.812 5.211 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.467 -7.270 4.717 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.647 -7.900 3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 78 2.441 -6.562 4.229 1.00 0.00 H new ATOM 1164 N ILE A 79 -2.497 -5.538 3.410 1.00 0.00 N ATOM 1165 CA ILE A 79 -3.713 -4.771 3.647 1.00 0.00 C ATOM 1166 C ILE A 79 -4.778 -5.624 4.328 1.00 0.00 C ATOM 1167 O ILE A 79 -4.963 -6.792 3.989 1.00 0.00 O ATOM 1168 CB ILE A 79 -4.287 -4.206 2.334 1.00 0.00 C ATOM 1169 CG1 ILE A 79 -3.271 -3.278 1.666 1.00 0.00 C ATOM 1170 CG2 ILE A 79 -5.591 -3.469 2.600 1.00 0.00 C ATOM 1171 CD1 ILE A 79 -3.754 -2.696 0.356 1.00 0.00 C ATOM 0 H ILE A 79 -2.648 -6.538 3.277 1.00 0.00 H new ATOM 0 HA ILE A 79 -3.441 -3.943 4.302 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.493 -5.036 1.658 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.031 -2.464 2.349 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.348 -3.830 1.491 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -5.984 -3.076 1.663 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.315 -4.157 3.037 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.409 -2.646 3.291 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.983 -2.048 -0.061 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.967 -3.504 -0.344 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.661 -2.116 0.528 1.00 0.00 H new ATOM 1183 N ASN A 80 -5.476 -5.031 5.291 1.00 0.00 N ATOM 1184 CA ASN A 80 -6.524 -5.736 6.020 1.00 0.00 C ATOM 1185 C ASN A 80 -6.150 -7.201 6.230 1.00 0.00 C ATOM 1186 O ASN A 80 -6.950 -8.099 5.971 1.00 0.00 O ATOM 1187 CB ASN A 80 -7.852 -5.641 5.266 1.00 0.00 C ATOM 1188 CG ASN A 80 -9.039 -6.002 6.137 1.00 0.00 C ATOM 1189 OD1 ASN A 80 -9.427 -5.088 7.019 1.00 0.00 O flip ATOM 1190 ND2 ASN A 80 -9.602 -7.091 6.018 1.00 0.00 N flip ATOM 0 H ASN A 80 -5.335 -4.064 5.585 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.633 -5.263 6.996 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -7.979 -4.627 4.886 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -7.824 -6.305 4.402 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -9.270 -7.764 5.327 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -10.400 -7.320 6.611 1.00 0.00 H new ATOM 1197 N ASN A 81 -4.929 -7.432 6.701 1.00 0.00 N ATOM 1198 CA ASN A 81 -4.448 -8.787 6.945 1.00 0.00 C ATOM 1199 C ASN A 81 -4.405 -9.591 5.649 1.00 0.00 C ATOM 1200 O ASN A 81 -4.989 -10.670 5.558 1.00 0.00 O ATOM 1201 CB ASN A 81 -5.344 -9.492 7.966 1.00 0.00 C ATOM 1202 CG ASN A 81 -5.274 -8.849 9.338 1.00 0.00 C ATOM 1203 OD1 ASN A 81 -4.193 -8.686 9.905 1.00 0.00 O ATOM 1204 ND2 ASN A 81 -6.430 -8.481 9.879 1.00 0.00 N ATOM 0 H ASN A 81 -4.255 -6.699 6.921 1.00 0.00 H new ATOM 0 HA ASN A 81 -3.436 -8.720 7.344 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -6.375 -9.476 7.613 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -5.049 -10.539 8.043 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -6.446 -8.044 10.800 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -7.302 -8.635 9.373 1.00 0.00 H new ATOM 1211 N GLN A 82 -3.709 -9.057 4.651 1.00 0.00 N ATOM 1212 CA GLN A 82 -3.589 -9.725 3.361 1.00 0.00 C ATOM 1213 C GLN A 82 -2.369 -9.220 2.597 1.00 0.00 C ATOM 1214 O GLN A 82 -2.306 -8.053 2.212 1.00 0.00 O ATOM 1215 CB GLN A 82 -4.854 -9.503 2.529 1.00 0.00 C ATOM 1216 CG GLN A 82 -6.053 -10.298 3.021 1.00 0.00 C ATOM 1217 CD GLN A 82 -7.088 -10.523 1.937 1.00 0.00 C ATOM 1218 OE1 GLN A 82 -6.751 -10.677 0.763 1.00 0.00 O ATOM 1219 NE2 GLN A 82 -8.358 -10.545 2.325 1.00 0.00 N ATOM 0 H GLN A 82 -3.220 -8.164 4.711 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.464 -10.792 3.543 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -5.103 -8.442 2.538 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -4.650 -9.773 1.493 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -5.714 -11.262 3.400 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.515 -9.772 3.856 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -8.593 -10.413 3.309 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -9.098 -10.694 1.639 1.00 0.00 H new ATOM 1228 N ILE A 83 -1.403 -10.107 2.383 1.00 0.00 N ATOM 1229 CA ILE A 83 -0.186 -9.751 1.665 1.00 0.00 C ATOM 1230 C ILE A 83 -0.455 -9.586 0.173 1.00 0.00 C ATOM 1231 O ILE A 83 -1.046 -10.461 -0.462 1.00 0.00 O ATOM 1232 CB ILE A 83 0.914 -10.811 1.862 1.00 0.00 C ATOM 1233 CG1 ILE A 83 1.205 -11.004 3.352 1.00 0.00 C ATOM 1234 CG2 ILE A 83 2.179 -10.406 1.119 1.00 0.00 C ATOM 1235 CD1 ILE A 83 2.323 -11.986 3.627 1.00 0.00 C ATOM 0 H ILE A 83 -1.440 -11.077 2.697 1.00 0.00 H new ATOM 0 HA ILE A 83 0.156 -8.802 2.077 1.00 0.00 H new ATOM 0 HB ILE A 83 0.563 -11.758 1.453 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.462 -10.040 3.791 1.00 0.00 H new ATOM 0 HG13 ILE A 83 0.299 -11.349 3.849 1.00 0.00 H new ATOM 0 HG21 ILE A 83 2.947 -11.165 1.268 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.962 -10.313 0.055 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.535 -9.449 1.501 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.474 -12.073 4.703 1.00 0.00 H new ATOM 0 HD12 ILE A 83 2.060 -12.961 3.218 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.242 -11.632 3.159 1.00 0.00 H new ATOM 1247 N LEU A 84 -0.018 -8.461 -0.381 1.00 0.00 N ATOM 1248 CA LEU A 84 -0.210 -8.182 -1.800 1.00 0.00 C ATOM 1249 C LEU A 84 1.060 -8.482 -2.590 1.00 0.00 C ATOM 1250 O LEU A 84 1.011 -8.704 -3.800 1.00 0.00 O ATOM 1251 CB LEU A 84 -0.617 -6.721 -2.001 1.00 0.00 C ATOM 1252 CG LEU A 84 -1.680 -6.182 -1.044 1.00 0.00 C ATOM 1253 CD1 LEU A 84 -1.876 -4.688 -1.251 1.00 0.00 C ATOM 1254 CD2 LEU A 84 -2.994 -6.926 -1.233 1.00 0.00 C ATOM 0 H LEU A 84 0.472 -7.727 0.131 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.006 -8.829 -2.169 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.274 -6.101 -1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.982 -6.604 -3.021 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.338 -6.344 -0.022 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.636 -4.322 -0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.936 -4.168 -1.064 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.196 -4.502 -2.276 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.739 -6.529 -0.544 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.342 -6.796 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.843 -7.987 -1.033 1.00 0.00 H new ATOM 1266 N TYR A 85 2.194 -8.489 -1.899 1.00 0.00 N ATOM 1267 CA TYR A 85 3.476 -8.761 -2.536 1.00 0.00 C ATOM 1268 C TYR A 85 3.370 -9.948 -3.489 1.00 0.00 C ATOM 1269 O TYR A 85 3.273 -11.097 -3.060 1.00 0.00 O ATOM 1270 CB TYR A 85 4.547 -9.037 -1.479 1.00 0.00 C ATOM 1271 CG TYR A 85 5.927 -9.254 -2.057 1.00 0.00 C ATOM 1272 CD1 TYR A 85 6.295 -10.487 -2.581 1.00 0.00 C ATOM 1273 CD2 TYR A 85 6.863 -8.228 -2.078 1.00 0.00 C ATOM 1274 CE1 TYR A 85 7.555 -10.691 -3.109 1.00 0.00 C ATOM 1275 CE2 TYR A 85 8.124 -8.422 -2.605 1.00 0.00 C ATOM 1276 CZ TYR A 85 8.466 -9.656 -3.120 1.00 0.00 C ATOM 1277 OH TYR A 85 9.722 -9.854 -3.645 1.00 0.00 O ATOM 0 H TYR A 85 2.251 -8.309 -0.897 1.00 0.00 H new ATOM 0 HA TYR A 85 3.761 -7.880 -3.111 1.00 0.00 H new ATOM 0 HB2 TYR A 85 4.582 -8.200 -0.782 1.00 0.00 H new ATOM 0 HB3 TYR A 85 4.260 -9.918 -0.905 1.00 0.00 H new ATOM 0 HD1 TYR A 85 5.584 -11.300 -2.575 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.600 -7.261 -1.675 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.825 -11.656 -3.511 1.00 0.00 H new ATOM 0 HE2 TYR A 85 8.839 -7.613 -2.614 1.00 0.00 H new ATOM 0 HH TYR A 85 10.240 -9.025 -3.577 1.00 0.00 H new ATOM 1287 N GLY A 86 3.389 -9.660 -4.787 1.00 0.00 N ATOM 1288 CA GLY A 86 3.294 -10.713 -5.782 1.00 0.00 C ATOM 1289 C GLY A 86 2.017 -10.629 -6.595 1.00 0.00 C ATOM 1290 O GLY A 86 2.023 -10.883 -7.800 1.00 0.00 O ATOM 0 H GLY A 86 3.468 -8.717 -5.167 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.152 -10.654 -6.452 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.342 -11.683 -5.286 1.00 0.00 H new ATOM 1294 N ARG A 87 0.920 -10.272 -5.936 1.00 0.00 N ATOM 1295 CA ARG A 87 -0.370 -10.159 -6.605 1.00 0.00 C ATOM 1296 C ARG A 87 -0.434 -8.890 -7.450 1.00 0.00 C ATOM 1297 O ARG A 87 0.503 -8.092 -7.461 1.00 0.00 O ATOM 1298 CB ARG A 87 -1.503 -10.157 -5.577 1.00 0.00 C ATOM 1299 CG ARG A 87 -1.689 -11.491 -4.873 1.00 0.00 C ATOM 1300 CD ARG A 87 -2.546 -11.348 -3.625 1.00 0.00 C ATOM 1301 NE ARG A 87 -3.207 -12.600 -3.268 1.00 0.00 N ATOM 1302 CZ ARG A 87 -3.819 -12.803 -2.106 1.00 0.00 C ATOM 1303 NH1 ARG A 87 -3.853 -11.841 -1.194 1.00 0.00 N ATOM 1304 NH2 ARG A 87 -4.398 -13.970 -1.855 1.00 0.00 N ATOM 0 H ARG A 87 0.899 -10.056 -4.939 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.487 -11.020 -7.263 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -1.304 -9.387 -4.832 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -2.434 -9.886 -6.075 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.154 -12.202 -5.556 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -0.715 -11.900 -4.602 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.923 -11.017 -2.794 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.297 -10.575 -3.788 1.00 0.00 H new ATOM 0 HE ARG A 87 -3.199 -13.360 -3.948 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -3.409 -10.943 -1.384 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -4.323 -11.999 -0.303 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -4.374 -14.712 -2.554 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -4.867 -14.125 -0.963 1.00 0.00 H new ATOM 1318 N SER A 88 -1.545 -8.712 -8.158 1.00 0.00 N ATOM 1319 CA SER A 88 -1.730 -7.543 -9.010 1.00 0.00 C ATOM 1320 C SER A 88 -2.316 -6.379 -8.216 1.00 0.00 C ATOM 1321 O SER A 88 -2.866 -6.568 -7.131 1.00 0.00 O ATOM 1322 CB SER A 88 -2.645 -7.884 -10.188 1.00 0.00 C ATOM 1323 OG SER A 88 -3.988 -8.034 -9.763 1.00 0.00 O ATOM 0 H SER A 88 -2.331 -9.363 -8.158 1.00 0.00 H new ATOM 0 HA SER A 88 -0.754 -7.244 -9.392 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.584 -7.097 -10.940 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.305 -8.805 -10.662 1.00 0.00 H new ATOM 0 HG SER A 88 -4.553 -8.250 -10.534 1.00 0.00 H new ATOM 1329 N HIS A 89 -2.193 -5.175 -8.766 1.00 0.00 N ATOM 1330 CA HIS A 89 -2.711 -3.979 -8.110 1.00 0.00 C ATOM 1331 C HIS A 89 -4.236 -4.002 -8.064 1.00 0.00 C ATOM 1332 O HIS A 89 -4.843 -3.529 -7.104 1.00 0.00 O ATOM 1333 CB HIS A 89 -2.230 -2.724 -8.839 1.00 0.00 C ATOM 1334 CG HIS A 89 -2.387 -2.797 -10.327 1.00 0.00 C ATOM 1335 ND1 HIS A 89 -3.528 -2.386 -10.983 1.00 0.00 N ATOM 1336 CD2 HIS A 89 -1.540 -3.236 -11.286 1.00 0.00 C ATOM 1337 CE1 HIS A 89 -3.376 -2.570 -12.283 1.00 0.00 C ATOM 1338 NE2 HIS A 89 -2.178 -3.084 -12.493 1.00 0.00 N ATOM 0 H HIS A 89 -1.740 -5.002 -9.663 1.00 0.00 H new ATOM 0 HA HIS A 89 -2.335 -3.963 -7.087 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -2.784 -1.863 -8.466 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -1.180 -2.556 -8.601 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -0.547 -3.632 -11.132 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -4.107 -2.339 -13.044 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -1.789 -3.329 -13.404 1.00 0.00 H new ATOM 1347 N GLN A 90 -4.846 -4.554 -9.108 1.00 0.00 N ATOM 1348 CA GLN A 90 -6.300 -4.636 -9.186 1.00 0.00 C ATOM 1349 C GLN A 90 -6.864 -5.429 -8.012 1.00 0.00 C ATOM 1350 O GLN A 90 -7.890 -5.065 -7.440 1.00 0.00 O ATOM 1351 CB GLN A 90 -6.725 -5.283 -10.505 1.00 0.00 C ATOM 1352 CG GLN A 90 -6.753 -4.314 -11.676 1.00 0.00 C ATOM 1353 CD GLN A 90 -7.499 -4.868 -12.874 1.00 0.00 C ATOM 1354 OE1 GLN A 90 -7.435 -6.063 -13.162 1.00 0.00 O ATOM 1355 NE2 GLN A 90 -8.213 -3.999 -13.580 1.00 0.00 N ATOM 0 H GLN A 90 -4.357 -4.951 -9.910 1.00 0.00 H new ATOM 0 HA GLN A 90 -6.699 -3.623 -9.141 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.041 -6.100 -10.736 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -7.716 -5.721 -10.383 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -7.222 -3.382 -11.360 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.731 -4.074 -11.969 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -8.238 -3.017 -13.305 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -8.737 -4.314 -14.397 1.00 0.00 H new ATOM 1364 N ASN A 91 -6.186 -6.517 -7.659 1.00 0.00 N ATOM 1365 CA ASN A 91 -6.621 -7.363 -6.553 1.00 0.00 C ATOM 1366 C ASN A 91 -6.634 -6.581 -5.243 1.00 0.00 C ATOM 1367 O ASN A 91 -7.561 -6.706 -4.443 1.00 0.00 O ATOM 1368 CB ASN A 91 -5.704 -8.580 -6.424 1.00 0.00 C ATOM 1369 CG ASN A 91 -5.954 -9.610 -7.509 1.00 0.00 C ATOM 1370 OD1 ASN A 91 -6.875 -9.469 -8.314 1.00 0.00 O ATOM 1371 ND2 ASN A 91 -5.132 -10.653 -7.536 1.00 0.00 N ATOM 0 H ASN A 91 -5.334 -6.833 -8.122 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.635 -7.701 -6.764 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -4.665 -8.255 -6.468 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -5.852 -9.041 -5.448 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -5.251 -11.378 -8.244 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -4.382 -10.729 -6.849 1.00 0.00 H new ATOM 1378 N ALA A 92 -5.599 -5.775 -5.030 1.00 0.00 N ATOM 1379 CA ALA A 92 -5.493 -4.971 -3.819 1.00 0.00 C ATOM 1380 C ALA A 92 -6.752 -4.140 -3.599 1.00 0.00 C ATOM 1381 O ALA A 92 -7.365 -4.194 -2.533 1.00 0.00 O ATOM 1382 CB ALA A 92 -4.269 -4.069 -3.890 1.00 0.00 C ATOM 0 H ALA A 92 -4.822 -5.662 -5.681 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.384 -5.648 -2.972 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.202 -3.474 -2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.372 -4.680 -3.991 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.355 -3.406 -4.751 1.00 0.00 H new ATOM 1388 N SER A 93 -7.133 -3.371 -4.615 1.00 0.00 N ATOM 1389 CA SER A 93 -8.318 -2.525 -4.530 1.00 0.00 C ATOM 1390 C SER A 93 -9.542 -3.343 -4.129 1.00 0.00 C ATOM 1391 O SER A 93 -10.419 -2.858 -3.415 1.00 0.00 O ATOM 1392 CB SER A 93 -8.571 -1.831 -5.870 1.00 0.00 C ATOM 1393 OG SER A 93 -9.255 -0.603 -5.686 1.00 0.00 O ATOM 0 H SER A 93 -6.639 -3.317 -5.506 1.00 0.00 H new ATOM 0 HA SER A 93 -8.141 -1.769 -3.765 1.00 0.00 H new ATOM 0 HB2 SER A 93 -7.622 -1.650 -6.375 1.00 0.00 H new ATOM 0 HB3 SER A 93 -9.157 -2.484 -6.517 1.00 0.00 H new ATOM 0 HG SER A 93 -9.404 -0.178 -6.556 1.00 0.00 H new ATOM 1399 N ALA A 94 -9.593 -4.587 -4.595 1.00 0.00 N ATOM 1400 CA ALA A 94 -10.708 -5.474 -4.284 1.00 0.00 C ATOM 1401 C ALA A 94 -10.742 -5.811 -2.797 1.00 0.00 C ATOM 1402 O ALA A 94 -11.810 -5.852 -2.185 1.00 0.00 O ATOM 1403 CB ALA A 94 -10.618 -6.745 -5.114 1.00 0.00 C ATOM 0 H ALA A 94 -8.876 -5.003 -5.189 1.00 0.00 H new ATOM 0 HA ALA A 94 -11.634 -4.956 -4.533 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -11.456 -7.398 -4.872 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.650 -6.491 -6.173 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -9.682 -7.259 -4.893 1.00 0.00 H new ATOM 1409 N ILE A 95 -9.569 -6.054 -2.223 1.00 0.00 N ATOM 1410 CA ILE A 95 -9.466 -6.388 -0.808 1.00 0.00 C ATOM 1411 C ILE A 95 -9.970 -5.244 0.065 1.00 0.00 C ATOM 1412 O ILE A 95 -10.653 -5.467 1.065 1.00 0.00 O ATOM 1413 CB ILE A 95 -8.016 -6.721 -0.412 1.00 0.00 C ATOM 1414 CG1 ILE A 95 -7.505 -7.916 -1.219 1.00 0.00 C ATOM 1415 CG2 ILE A 95 -7.926 -7.005 1.080 1.00 0.00 C ATOM 1416 CD1 ILE A 95 -6.008 -8.113 -1.125 1.00 0.00 C ATOM 0 H ILE A 95 -8.676 -6.026 -2.716 1.00 0.00 H new ATOM 0 HA ILE A 95 -10.089 -7.267 -0.645 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.387 -5.860 -0.637 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -8.005 -8.820 -0.871 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -7.781 -7.782 -2.265 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.895 -7.239 1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.254 -6.128 1.638 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.565 -7.852 1.328 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.717 -8.978 -1.721 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -5.500 -7.225 -1.501 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.727 -8.279 -0.085 1.00 0.00 H new ATOM 1428 N ILE A 96 -9.631 -4.019 -0.321 1.00 0.00 N ATOM 1429 CA ILE A 96 -10.052 -2.839 0.425 1.00 0.00 C ATOM 1430 C ILE A 96 -11.569 -2.689 0.406 1.00 0.00 C ATOM 1431 O ILE A 96 -12.190 -2.415 1.433 1.00 0.00 O ATOM 1432 CB ILE A 96 -9.413 -1.557 -0.142 1.00 0.00 C ATOM 1433 CG1 ILE A 96 -7.906 -1.553 0.121 1.00 0.00 C ATOM 1434 CG2 ILE A 96 -10.067 -0.326 0.467 1.00 0.00 C ATOM 1435 CD1 ILE A 96 -7.150 -0.543 -0.714 1.00 0.00 C ATOM 0 H ILE A 96 -9.066 -3.817 -1.146 1.00 0.00 H new ATOM 0 HA ILE A 96 -9.716 -2.979 1.453 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.574 -1.534 -1.220 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.730 -1.345 1.176 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.508 -2.548 -0.078 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.605 0.572 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.131 -0.326 0.233 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.934 -0.341 1.549 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.088 -0.596 -0.475 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.296 -0.763 -1.772 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.521 0.459 -0.498 1.00 0.00 H new ATOM 1447 N LYS A 97 -12.161 -2.873 -0.769 1.00 0.00 N ATOM 1448 CA LYS A 97 -13.607 -2.761 -0.923 1.00 0.00 C ATOM 1449 C LYS A 97 -14.331 -3.659 0.075 1.00 0.00 C ATOM 1450 O LYS A 97 -15.295 -3.240 0.717 1.00 0.00 O ATOM 1451 CB LYS A 97 -14.019 -3.131 -2.350 1.00 0.00 C ATOM 1452 CG LYS A 97 -15.297 -2.451 -2.810 1.00 0.00 C ATOM 1453 CD LYS A 97 -15.496 -2.594 -4.309 1.00 0.00 C ATOM 1454 CE LYS A 97 -14.555 -1.687 -5.087 1.00 0.00 C ATOM 1455 NZ LYS A 97 -15.142 -0.336 -5.305 1.00 0.00 N ATOM 0 H LYS A 97 -11.662 -3.100 -1.629 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.889 -1.727 -0.726 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.211 -2.867 -3.032 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -14.149 -4.211 -2.413 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -16.149 -2.884 -2.286 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.263 -1.394 -2.546 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -15.328 -3.630 -4.602 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -16.528 -2.354 -4.564 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -13.613 -1.591 -4.546 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -14.325 -2.143 -6.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -14.471 0.252 -5.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -16.028 -0.425 -5.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -15.338 0.110 -4.386 1.00 0.00 H new ATOM 1469 N THR A 98 -13.861 -4.896 0.201 1.00 0.00 N ATOM 1470 CA THR A 98 -14.463 -5.852 1.121 1.00 0.00 C ATOM 1471 C THR A 98 -14.069 -5.552 2.563 1.00 0.00 C ATOM 1472 O THR A 98 -14.732 -5.991 3.502 1.00 0.00 O ATOM 1473 CB THR A 98 -14.051 -7.297 0.779 1.00 0.00 C ATOM 1474 OG1 THR A 98 -12.644 -7.466 0.982 1.00 0.00 O ATOM 1475 CG2 THR A 98 -14.405 -7.633 -0.662 1.00 0.00 C ATOM 0 H THR A 98 -13.065 -5.259 -0.323 1.00 0.00 H new ATOM 0 HA THR A 98 -15.543 -5.754 1.015 1.00 0.00 H new ATOM 0 HB THR A 98 -14.596 -7.973 1.438 1.00 0.00 H new ATOM 0 HG1 THR A 98 -12.201 -6.593 0.944 1.00 0.00 H new ATOM 0 HG21 THR A 98 -14.105 -8.658 -0.881 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.481 -7.531 -0.806 1.00 0.00 H new ATOM 0 HG23 THR A 98 -13.883 -6.951 -1.333 1.00 0.00 H new ATOM 1483 N ALA A 99 -12.987 -4.800 2.731 1.00 0.00 N ATOM 1484 CA ALA A 99 -12.506 -4.438 4.059 1.00 0.00 C ATOM 1485 C ALA A 99 -13.430 -3.420 4.718 1.00 0.00 C ATOM 1486 O ALA A 99 -14.104 -2.634 4.052 1.00 0.00 O ATOM 1487 CB ALA A 99 -11.089 -3.892 3.977 1.00 0.00 C ATOM 0 H ALA A 99 -12.426 -4.429 1.964 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.501 -5.338 4.674 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -10.743 -3.626 4.976 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.430 -4.651 3.555 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -11.076 -3.007 3.341 1.00 0.00 H new ATOM 1493 N PRO A 100 -13.464 -3.431 6.059 1.00 0.00 N ATOM 1494 CA PRO A 100 -14.302 -2.514 6.838 1.00 0.00 C ATOM 1495 C PRO A 100 -13.807 -1.073 6.765 1.00 0.00 C ATOM 1496 O PRO A 100 -12.746 -0.799 6.204 1.00 0.00 O ATOM 1497 CB PRO A 100 -14.180 -3.049 8.267 1.00 0.00 C ATOM 1498 CG PRO A 100 -12.873 -3.762 8.294 1.00 0.00 C ATOM 1499 CD PRO A 100 -12.686 -4.340 6.918 1.00 0.00 C ATOM 0 HA PRO A 100 -15.326 -2.482 6.466 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -14.204 -2.239 8.996 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -15.003 -3.721 8.510 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -12.061 -3.079 8.544 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -12.873 -4.547 9.050 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.635 -4.363 6.631 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.055 -5.364 6.858 1.00 0.00 H new ATOM 1507 N SER A 101 -14.582 -0.157 7.336 1.00 0.00 N ATOM 1508 CA SER A 101 -14.224 1.257 7.332 1.00 0.00 C ATOM 1509 C SER A 101 -12.739 1.441 7.630 1.00 0.00 C ATOM 1510 O SER A 101 -11.979 1.917 6.787 1.00 0.00 O ATOM 1511 CB SER A 101 -15.061 2.019 8.361 1.00 0.00 C ATOM 1512 OG SER A 101 -16.308 2.411 7.815 1.00 0.00 O ATOM 0 H SER A 101 -15.462 -0.368 7.807 1.00 0.00 H new ATOM 0 HA SER A 101 -14.430 1.657 6.339 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.225 1.392 9.237 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.515 2.900 8.698 1.00 0.00 H new ATOM 0 HG SER A 101 -16.824 2.895 8.493 1.00 0.00 H new ATOM 1518 N LYS A 102 -12.332 1.061 8.837 1.00 0.00 N ATOM 1519 CA LYS A 102 -10.939 1.183 9.249 1.00 0.00 C ATOM 1520 C LYS A 102 -10.090 0.077 8.630 1.00 0.00 C ATOM 1521 O LYS A 102 -10.221 -1.094 8.989 1.00 0.00 O ATOM 1522 CB LYS A 102 -10.830 1.131 10.774 1.00 0.00 C ATOM 1523 CG LYS A 102 -9.522 1.686 11.310 1.00 0.00 C ATOM 1524 CD LYS A 102 -9.685 2.237 12.717 1.00 0.00 C ATOM 1525 CE LYS A 102 -10.064 3.710 12.699 1.00 0.00 C ATOM 1526 NZ LYS A 102 -10.190 4.267 14.074 1.00 0.00 N ATOM 0 H LYS A 102 -12.948 0.666 9.547 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.565 2.144 8.897 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.658 1.692 11.208 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -10.938 0.097 11.102 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -8.766 0.901 11.311 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.162 2.474 10.649 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -10.452 1.669 13.244 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -8.755 2.106 13.270 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.311 4.272 12.147 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -11.008 3.836 12.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -10.449 5.273 14.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -10.927 3.748 14.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -9.282 4.170 14.572 1.00 0.00 H new ATOM 1540 N VAL A 103 -9.219 0.455 7.700 1.00 0.00 N ATOM 1541 CA VAL A 103 -8.347 -0.505 7.034 1.00 0.00 C ATOM 1542 C VAL A 103 -6.882 -0.227 7.349 1.00 0.00 C ATOM 1543 O VAL A 103 -6.461 0.927 7.436 1.00 0.00 O ATOM 1544 CB VAL A 103 -8.546 -0.478 5.507 1.00 0.00 C ATOM 1545 CG1 VAL A 103 -7.634 -1.491 4.831 1.00 0.00 C ATOM 1546 CG2 VAL A 103 -10.002 -0.741 5.155 1.00 0.00 C ATOM 0 H VAL A 103 -9.098 1.419 7.391 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.616 -1.492 7.411 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.281 0.514 5.141 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.789 -1.457 3.753 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.595 -1.252 5.056 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.864 -2.491 5.199 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.124 -0.718 4.072 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.297 -1.720 5.533 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.630 0.027 5.607 1.00 0.00 H new ATOM 1556 N LYS A 104 -6.107 -1.293 7.521 1.00 0.00 N ATOM 1557 CA LYS A 104 -4.687 -1.166 7.825 1.00 0.00 C ATOM 1558 C LYS A 104 -3.844 -1.319 6.563 1.00 0.00 C ATOM 1559 O LYS A 104 -3.956 -2.314 5.846 1.00 0.00 O ATOM 1560 CB LYS A 104 -4.270 -2.215 8.859 1.00 0.00 C ATOM 1561 CG LYS A 104 -2.831 -2.073 9.323 1.00 0.00 C ATOM 1562 CD LYS A 104 -2.317 -3.360 9.946 1.00 0.00 C ATOM 1563 CE LYS A 104 -1.184 -3.092 10.925 1.00 0.00 C ATOM 1564 NZ LYS A 104 -1.692 -2.767 12.286 1.00 0.00 N ATOM 0 H LYS A 104 -6.439 -2.255 7.455 1.00 0.00 H new ATOM 0 HA LYS A 104 -4.517 -0.171 8.236 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.930 -2.144 9.723 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -4.409 -3.209 8.433 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.200 -1.800 8.477 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -2.760 -1.263 10.049 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -3.133 -3.867 10.462 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -1.970 -4.032 9.161 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.536 -3.967 10.979 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -0.575 -2.266 10.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -0.889 -2.591 12.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -2.290 -1.917 12.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -2.252 -3.565 12.647 1.00 0.00 H new ATOM 1578 N LEU A 105 -3.000 -0.328 6.298 1.00 0.00 N ATOM 1579 CA LEU A 105 -2.136 -0.353 5.122 1.00 0.00 C ATOM 1580 C LEU A 105 -0.666 -0.366 5.527 1.00 0.00 C ATOM 1581 O LEU A 105 -0.220 0.470 6.313 1.00 0.00 O ATOM 1582 CB LEU A 105 -2.421 0.857 4.230 1.00 0.00 C ATOM 1583 CG LEU A 105 -3.883 1.076 3.843 1.00 0.00 C ATOM 1584 CD1 LEU A 105 -4.162 2.555 3.624 1.00 0.00 C ATOM 1585 CD2 LEU A 105 -4.230 0.276 2.595 1.00 0.00 C ATOM 0 H LEU A 105 -2.895 0.503 6.881 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.348 -1.265 4.565 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.063 1.751 4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.835 0.755 3.316 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.512 0.726 4.662 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.208 2.691 3.349 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.954 3.104 4.542 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.525 2.931 2.824 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.275 0.444 2.334 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -3.594 0.595 1.770 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.070 -0.785 2.787 1.00 0.00 H new ATOM 1597 N VAL A 106 0.084 -1.320 4.983 1.00 0.00 N ATOM 1598 CA VAL A 106 1.506 -1.440 5.285 1.00 0.00 C ATOM 1599 C VAL A 106 2.349 -1.307 4.022 1.00 0.00 C ATOM 1600 O VAL A 106 2.466 -2.250 3.239 1.00 0.00 O ATOM 1601 CB VAL A 106 1.824 -2.786 5.962 1.00 0.00 C ATOM 1602 CG1 VAL A 106 3.322 -2.934 6.180 1.00 0.00 C ATOM 1603 CG2 VAL A 106 1.070 -2.912 7.278 1.00 0.00 C ATOM 0 H VAL A 106 -0.269 -2.021 4.331 1.00 0.00 H new ATOM 0 HA VAL A 106 1.754 -0.630 5.971 1.00 0.00 H new ATOM 0 HB VAL A 106 1.496 -3.590 5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.527 -3.891 6.659 1.00 0.00 H new ATOM 0 HG12 VAL A 106 3.835 -2.892 5.219 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.679 -2.125 6.818 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.307 -3.869 7.743 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.365 -2.102 7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.002 -2.855 7.090 1.00 0.00 H new ATOM 1613 N PHE A 107 2.935 -0.130 3.830 1.00 0.00 N ATOM 1614 CA PHE A 107 3.768 0.127 2.661 1.00 0.00 C ATOM 1615 C PHE A 107 5.150 0.624 3.076 1.00 0.00 C ATOM 1616 O PHE A 107 5.426 0.802 4.263 1.00 0.00 O ATOM 1617 CB PHE A 107 3.097 1.155 1.747 1.00 0.00 C ATOM 1618 CG PHE A 107 2.858 2.481 2.410 1.00 0.00 C ATOM 1619 CD1 PHE A 107 3.844 3.455 2.417 1.00 0.00 C ATOM 1620 CD2 PHE A 107 1.648 2.755 3.026 1.00 0.00 C ATOM 1621 CE1 PHE A 107 3.627 4.676 3.027 1.00 0.00 C ATOM 1622 CE2 PHE A 107 1.424 3.974 3.637 1.00 0.00 C ATOM 1623 CZ PHE A 107 2.415 4.936 3.637 1.00 0.00 C ATOM 0 H PHE A 107 2.849 0.661 4.469 1.00 0.00 H new ATOM 0 HA PHE A 107 3.887 -0.810 2.117 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.719 1.306 0.865 1.00 0.00 H new ATOM 0 HB3 PHE A 107 2.144 0.754 1.400 1.00 0.00 H new ATOM 0 HD1 PHE A 107 4.793 3.258 1.940 1.00 0.00 H new ATOM 0 HD2 PHE A 107 0.870 2.006 3.029 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.404 5.426 3.027 1.00 0.00 H new ATOM 0 HE2 PHE A 107 0.476 4.174 4.114 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.243 5.890 4.113 1.00 0.00 H new ATOM 1633 N ILE A 108 6.013 0.846 2.091 1.00 0.00 N ATOM 1634 CA ILE A 108 7.365 1.322 2.353 1.00 0.00 C ATOM 1635 C ILE A 108 7.663 2.593 1.565 1.00 0.00 C ATOM 1636 O ILE A 108 7.550 2.616 0.339 1.00 0.00 O ATOM 1637 CB ILE A 108 8.417 0.254 2.000 1.00 0.00 C ATOM 1638 CG1 ILE A 108 9.825 0.779 2.286 1.00 0.00 C ATOM 1639 CG2 ILE A 108 8.285 -0.158 0.542 1.00 0.00 C ATOM 1640 CD1 ILE A 108 10.830 -0.313 2.580 1.00 0.00 C ATOM 0 H ILE A 108 5.800 0.704 1.104 1.00 0.00 H new ATOM 0 HA ILE A 108 7.422 1.537 3.420 1.00 0.00 H new ATOM 0 HB ILE A 108 8.244 -0.624 2.622 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.169 1.357 1.428 1.00 0.00 H new ATOM 0 HG13 ILE A 108 9.784 1.462 3.135 1.00 0.00 H new ATOM 0 HG21 ILE A 108 9.035 -0.913 0.308 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.290 -0.569 0.369 1.00 0.00 H new ATOM 0 HG23 ILE A 108 8.435 0.712 -0.097 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.806 0.133 2.773 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.509 -0.877 3.456 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.900 -0.983 1.723 1.00 0.00 H new ATOM 1652 N ARG A 109 8.046 3.648 2.276 1.00 0.00 N ATOM 1653 CA ARG A 109 8.362 4.923 1.642 1.00 0.00 C ATOM 1654 C ARG A 109 9.766 4.900 1.045 1.00 0.00 C ATOM 1655 O ARG A 109 10.759 4.884 1.770 1.00 0.00 O ATOM 1656 CB ARG A 109 8.245 6.063 2.656 1.00 0.00 C ATOM 1657 CG ARG A 109 8.395 7.444 2.039 1.00 0.00 C ATOM 1658 CD ARG A 109 8.058 8.539 3.038 1.00 0.00 C ATOM 1659 NE ARG A 109 6.638 8.881 3.016 1.00 0.00 N ATOM 1660 CZ ARG A 109 6.007 9.465 4.029 1.00 0.00 C ATOM 1661 NH1 ARG A 109 6.668 9.770 5.138 1.00 0.00 N ATOM 1662 NH2 ARG A 109 4.714 9.744 3.935 1.00 0.00 N ATOM 0 H ARG A 109 8.145 3.646 3.291 1.00 0.00 H new ATOM 0 HA ARG A 109 7.647 5.088 0.836 1.00 0.00 H new ATOM 0 HB2 ARG A 109 7.276 5.999 3.152 1.00 0.00 H new ATOM 0 HB3 ARG A 109 9.006 5.933 3.425 1.00 0.00 H new ATOM 0 HG2 ARG A 109 9.417 7.576 1.684 1.00 0.00 H new ATOM 0 HG3 ARG A 109 7.742 7.529 1.170 1.00 0.00 H new ATOM 0 HD2 ARG A 109 8.337 8.214 4.040 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.649 9.428 2.815 1.00 0.00 H new ATOM 0 HE ARG A 109 6.102 8.659 2.177 1.00 0.00 H new ATOM 0 HH11 ARG A 109 7.662 9.556 5.214 1.00 0.00 H new ATOM 0 HH12 ARG A 109 6.182 10.218 5.915 1.00 0.00 H new ATOM 0 HH21 ARG A 109 4.202 9.510 3.084 1.00 0.00 H new ATOM 0 HH22 ARG A 109 4.231 10.192 4.714 1.00 0.00 H new ATOM 1676 N ASN A 110 9.838 4.899 -0.282 1.00 0.00 N ATOM 1677 CA ASN A 110 11.120 4.878 -0.978 1.00 0.00 C ATOM 1678 C ASN A 110 11.142 5.899 -2.111 1.00 0.00 C ATOM 1679 O ASN A 110 10.508 5.703 -3.147 1.00 0.00 O ATOM 1680 CB ASN A 110 11.400 3.479 -1.531 1.00 0.00 C ATOM 1681 CG ASN A 110 12.757 3.384 -2.202 1.00 0.00 C ATOM 1682 OD1 ASN A 110 13.476 4.376 -2.316 1.00 0.00 O ATOM 1683 ND2 ASN A 110 13.112 2.185 -2.650 1.00 0.00 N ATOM 0 H ASN A 110 9.024 4.912 -0.897 1.00 0.00 H new ATOM 0 HA ASN A 110 11.898 5.141 -0.262 1.00 0.00 H new ATOM 0 HB2 ASN A 110 11.347 2.753 -0.720 1.00 0.00 H new ATOM 0 HB3 ASN A 110 10.624 3.212 -2.248 1.00 0.00 H new ATOM 0 HD21 ASN A 110 14.013 2.059 -3.111 1.00 0.00 H new ATOM 0 HD22 ASN A 110 12.483 1.390 -2.533 1.00 0.00 H new ATOM 1690 N GLU A 111 11.876 6.988 -1.904 1.00 0.00 N ATOM 1691 CA GLU A 111 11.979 8.040 -2.909 1.00 0.00 C ATOM 1692 C GLU A 111 12.415 7.467 -4.254 1.00 0.00 C ATOM 1693 O GLU A 111 12.169 8.062 -5.304 1.00 0.00 O ATOM 1694 CB GLU A 111 12.970 9.114 -2.455 1.00 0.00 C ATOM 1695 CG GLU A 111 12.985 10.345 -3.346 1.00 0.00 C ATOM 1696 CD GLU A 111 14.303 11.092 -3.286 1.00 0.00 C ATOM 1697 OE1 GLU A 111 15.276 10.632 -3.919 1.00 0.00 O ATOM 1698 OE2 GLU A 111 14.360 12.139 -2.607 1.00 0.00 O ATOM 0 H GLU A 111 12.407 7.165 -1.051 1.00 0.00 H new ATOM 0 HA GLU A 111 10.994 8.491 -3.028 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.724 9.416 -1.437 1.00 0.00 H new ATOM 0 HB3 GLU A 111 13.971 8.684 -2.427 1.00 0.00 H new ATOM 0 HG2 GLU A 111 12.787 10.046 -4.375 1.00 0.00 H new ATOM 0 HG3 GLU A 111 12.178 11.015 -3.048 1.00 0.00 H new ATOM 1705 N ASP A 112 13.064 6.308 -4.215 1.00 0.00 N ATOM 1706 CA ASP A 112 13.534 5.653 -5.430 1.00 0.00 C ATOM 1707 C ASP A 112 12.387 4.943 -6.143 1.00 0.00 C ATOM 1708 O ASP A 112 12.374 4.840 -7.369 1.00 0.00 O ATOM 1709 CB ASP A 112 14.642 4.653 -5.099 1.00 0.00 C ATOM 1710 CG ASP A 112 15.825 5.305 -4.411 1.00 0.00 C ATOM 1711 OD1 ASP A 112 16.061 6.507 -4.652 1.00 0.00 O ATOM 1712 OD2 ASP A 112 16.514 4.614 -3.632 1.00 0.00 O ATOM 0 H ASP A 112 13.276 5.803 -3.355 1.00 0.00 H new ATOM 0 HA ASP A 112 13.933 6.419 -6.095 1.00 0.00 H new ATOM 0 HB2 ASP A 112 14.240 3.869 -4.458 1.00 0.00 H new ATOM 0 HB3 ASP A 112 14.979 4.172 -6.017 1.00 0.00 H new ATOM 1717 N ALA A 113 11.426 4.455 -5.366 1.00 0.00 N ATOM 1718 CA ALA A 113 10.274 3.756 -5.923 1.00 0.00 C ATOM 1719 C ALA A 113 9.576 4.603 -6.981 1.00 0.00 C ATOM 1720 O ALA A 113 9.102 4.086 -7.992 1.00 0.00 O ATOM 1721 CB ALA A 113 9.299 3.380 -4.817 1.00 0.00 C ATOM 0 H ALA A 113 11.422 4.531 -4.349 1.00 0.00 H new ATOM 0 HA ALA A 113 10.631 2.845 -6.403 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.444 2.859 -5.247 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.797 2.729 -4.099 1.00 0.00 H new ATOM 0 HB3 ALA A 113 8.957 4.283 -4.311 1.00 0.00 H new ATOM 1727 N VAL A 114 9.517 5.910 -6.741 1.00 0.00 N ATOM 1728 CA VAL A 114 8.877 6.830 -7.674 1.00 0.00 C ATOM 1729 C VAL A 114 9.372 6.602 -9.097 1.00 0.00 C ATOM 1730 O VAL A 114 8.682 6.922 -10.064 1.00 0.00 O ATOM 1731 CB VAL A 114 9.134 8.296 -7.280 1.00 0.00 C ATOM 1732 CG1 VAL A 114 8.635 8.566 -5.869 1.00 0.00 C ATOM 1733 CG2 VAL A 114 10.613 8.630 -7.405 1.00 0.00 C ATOM 0 H VAL A 114 9.905 6.355 -5.909 1.00 0.00 H new ATOM 0 HA VAL A 114 7.806 6.632 -7.630 1.00 0.00 H new ATOM 0 HB VAL A 114 8.581 8.940 -7.964 1.00 0.00 H new ATOM 0 HG11 VAL A 114 8.826 9.607 -5.609 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.564 8.369 -5.818 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.157 7.915 -5.168 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.776 9.670 -7.123 1.00 0.00 H new ATOM 0 HG22 VAL A 114 11.190 7.980 -6.747 1.00 0.00 H new ATOM 0 HG23 VAL A 114 10.934 8.479 -8.436 1.00 0.00 H new ATOM 1743 N ASN A 115 10.574 6.047 -9.218 1.00 0.00 N ATOM 1744 CA ASN A 115 11.163 5.776 -10.525 1.00 0.00 C ATOM 1745 C ASN A 115 10.762 4.392 -11.026 1.00 0.00 C ATOM 1746 O ASN A 115 10.359 4.232 -12.178 1.00 0.00 O ATOM 1747 CB ASN A 115 12.687 5.883 -10.452 1.00 0.00 C ATOM 1748 CG ASN A 115 13.170 7.320 -10.498 1.00 0.00 C ATOM 1749 OD1 ASN A 115 12.971 8.021 -11.489 1.00 0.00 O ATOM 1750 ND2 ASN A 115 13.808 7.764 -9.421 1.00 0.00 N ATOM 0 H ASN A 115 11.159 5.776 -8.427 1.00 0.00 H new ATOM 0 HA ASN A 115 10.786 6.520 -11.227 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.037 5.414 -9.532 1.00 0.00 H new ATOM 0 HB3 ASN A 115 13.127 5.328 -11.280 1.00 0.00 H new ATOM 0 HD21 ASN A 115 14.156 8.723 -9.393 1.00 0.00 H new ATOM 0 HD22 ASN A 115 13.950 7.146 -8.622 1.00 0.00 H new ATOM 1757 N GLN A 116 10.874 3.397 -10.153 1.00 0.00 N ATOM 1758 CA GLN A 116 10.523 2.027 -10.507 1.00 0.00 C ATOM 1759 C GLN A 116 9.097 1.952 -11.043 1.00 0.00 C ATOM 1760 O GLN A 116 8.879 1.628 -12.210 1.00 0.00 O ATOM 1761 CB GLN A 116 10.673 1.109 -9.293 1.00 0.00 C ATOM 1762 CG GLN A 116 12.079 1.090 -8.715 1.00 0.00 C ATOM 1763 CD GLN A 116 12.175 0.275 -7.440 1.00 0.00 C ATOM 1764 OE1 GLN A 116 11.538 -0.771 -7.309 1.00 0.00 O ATOM 1765 NE2 GLN A 116 12.974 0.750 -6.492 1.00 0.00 N ATOM 0 H GLN A 116 11.205 3.514 -9.195 1.00 0.00 H new ATOM 0 HA GLN A 116 11.204 1.695 -11.290 1.00 0.00 H new ATOM 0 HB2 GLN A 116 9.975 1.427 -8.519 1.00 0.00 H new ATOM 0 HB3 GLN A 116 10.392 0.095 -9.578 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.767 0.681 -9.455 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.399 2.112 -8.513 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.483 1.621 -6.643 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.079 0.244 -5.613 1.00 0.00 H new ATOM 1774 N MET A 117 8.130 2.253 -10.183 1.00 0.00 N ATOM 1775 CA MET A 117 6.725 2.220 -10.571 1.00 0.00 C ATOM 1776 C MET A 117 6.527 2.839 -11.951 1.00 0.00 C ATOM 1777 O MET A 117 6.978 3.954 -12.211 1.00 0.00 O ATOM 1778 CB MET A 117 5.871 2.960 -9.540 1.00 0.00 C ATOM 1779 CG MET A 117 6.212 4.437 -9.417 1.00 0.00 C ATOM 1780 SD MET A 117 5.499 5.193 -7.944 1.00 0.00 S ATOM 1781 CE MET A 117 5.515 6.923 -8.410 1.00 0.00 C ATOM 0 H MET A 117 8.294 2.522 -9.213 1.00 0.00 H new ATOM 0 HA MET A 117 6.410 1.177 -10.612 1.00 0.00 H new ATOM 0 HB2 MET A 117 4.820 2.859 -9.811 1.00 0.00 H new ATOM 0 HB3 MET A 117 5.996 2.484 -8.567 1.00 0.00 H new ATOM 0 HG2 MET A 117 7.295 4.555 -9.393 1.00 0.00 H new ATOM 0 HG3 MET A 117 5.853 4.964 -10.301 1.00 0.00 H new ATOM 0 HE1 MET A 117 5.922 7.517 -7.591 1.00 0.00 H new ATOM 0 HE2 MET A 117 6.134 7.055 -9.297 1.00 0.00 H new ATOM 0 HE3 MET A 117 4.498 7.251 -8.625 1.00 0.00 H new ATOM 1791 N ALA A 118 5.852 2.108 -12.832 1.00 0.00 N ATOM 1792 CA ALA A 118 5.594 2.587 -14.184 1.00 0.00 C ATOM 1793 C ALA A 118 5.156 4.048 -14.175 1.00 0.00 C ATOM 1794 O ALA A 118 5.652 4.859 -14.957 1.00 0.00 O ATOM 1795 CB ALA A 118 4.539 1.722 -14.858 1.00 0.00 C ATOM 0 H ALA A 118 5.474 1.182 -12.633 1.00 0.00 H new ATOM 0 HA ALA A 118 6.522 2.517 -14.751 1.00 0.00 H new ATOM 0 HB1 ALA A 118 4.356 2.091 -15.867 1.00 0.00 H new ATOM 0 HB2 ALA A 118 4.890 0.691 -14.907 1.00 0.00 H new ATOM 0 HB3 ALA A 118 3.614 1.763 -14.284 1.00 0.00 H new ATOM 1801 N SER A 119 4.224 4.376 -13.286 1.00 0.00 N ATOM 1802 CA SER A 119 3.717 5.739 -13.178 1.00 0.00 C ATOM 1803 C SER A 119 2.831 6.084 -14.371 1.00 0.00 C ATOM 1804 O SER A 119 2.869 7.202 -14.885 1.00 0.00 O ATOM 1805 CB SER A 119 4.877 6.732 -13.086 1.00 0.00 C ATOM 1806 OG SER A 119 4.447 7.970 -12.546 1.00 0.00 O ATOM 0 H SER A 119 3.805 3.717 -12.630 1.00 0.00 H new ATOM 0 HA SER A 119 3.118 5.807 -12.270 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.668 6.315 -12.463 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.302 6.892 -14.077 1.00 0.00 H new ATOM 0 HG SER A 119 3.711 8.325 -13.087 1.00 0.00 H new ATOM 1812 N GLY A 120 2.032 5.115 -14.808 1.00 0.00 N ATOM 1813 CA GLY A 120 1.147 5.334 -15.937 1.00 0.00 C ATOM 1814 C GLY A 120 0.060 4.283 -16.035 1.00 0.00 C ATOM 1815 O GLY A 120 0.176 3.305 -16.772 1.00 0.00 O ATOM 0 H GLY A 120 1.982 4.182 -14.400 1.00 0.00 H new ATOM 0 HA2 GLY A 120 0.689 6.319 -15.849 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.731 5.335 -16.857 1.00 0.00 H new ATOM 1819 N PRO A 121 -1.028 4.480 -15.274 1.00 0.00 N ATOM 1820 CA PRO A 121 -2.162 3.550 -15.260 1.00 0.00 C ATOM 1821 C PRO A 121 -2.949 3.576 -16.566 1.00 0.00 C ATOM 1822 O PRO A 121 -2.997 4.597 -17.252 1.00 0.00 O ATOM 1823 CB PRO A 121 -3.025 4.063 -14.105 1.00 0.00 C ATOM 1824 CG PRO A 121 -2.685 5.508 -13.989 1.00 0.00 C ATOM 1825 CD PRO A 121 -1.235 5.624 -14.371 1.00 0.00 C ATOM 0 HA PRO A 121 -1.840 2.515 -15.143 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.086 3.922 -14.311 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -2.806 3.530 -13.180 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.311 6.110 -14.647 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -2.851 5.868 -12.974 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.025 6.571 -14.868 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -0.584 5.570 -13.498 1.00 0.00 H new ATOM 1833 N SER A 122 -3.565 2.448 -16.902 1.00 0.00 N ATOM 1834 CA SER A 122 -4.348 2.340 -18.128 1.00 0.00 C ATOM 1835 C SER A 122 -5.819 2.644 -17.861 1.00 0.00 C ATOM 1836 O SER A 122 -6.296 2.517 -16.734 1.00 0.00 O ATOM 1837 CB SER A 122 -4.205 0.940 -18.728 1.00 0.00 C ATOM 1838 OG SER A 122 -4.984 -0.003 -18.012 1.00 0.00 O ATOM 0 H SER A 122 -3.537 1.595 -16.343 1.00 0.00 H new ATOM 0 HA SER A 122 -3.967 3.073 -18.839 1.00 0.00 H new ATOM 0 HB2 SER A 122 -4.516 0.955 -19.773 1.00 0.00 H new ATOM 0 HB3 SER A 122 -3.158 0.639 -18.711 1.00 0.00 H new ATOM 0 HG SER A 122 -4.877 -0.890 -18.416 1.00 0.00 H new ATOM 1844 N SER A 123 -6.533 3.046 -18.908 1.00 0.00 N ATOM 1845 CA SER A 123 -7.949 3.372 -18.787 1.00 0.00 C ATOM 1846 C SER A 123 -8.815 2.257 -19.366 1.00 0.00 C ATOM 1847 O SER A 123 -8.576 1.782 -20.475 1.00 0.00 O ATOM 1848 CB SER A 123 -8.253 4.691 -19.501 1.00 0.00 C ATOM 1849 OG SER A 123 -8.017 4.583 -20.894 1.00 0.00 O ATOM 0 H SER A 123 -6.154 3.154 -19.849 1.00 0.00 H new ATOM 0 HA SER A 123 -8.183 3.477 -17.728 1.00 0.00 H new ATOM 0 HB2 SER A 123 -9.291 4.972 -19.326 1.00 0.00 H new ATOM 0 HB3 SER A 123 -7.633 5.485 -19.084 1.00 0.00 H new ATOM 0 HG SER A 123 -8.220 5.438 -21.327 1.00 0.00 H new ATOM 1855 N GLY A 124 -9.823 1.843 -18.604 1.00 0.00 N ATOM 1856 CA GLY A 124 -10.709 0.787 -19.056 1.00 0.00 C ATOM 1857 C GLY A 124 -10.686 -0.421 -18.141 1.00 0.00 C ATOM 1858 O GLY A 124 -9.813 -0.541 -17.282 1.00 0.00 O ATOM 0 H GLY A 124 -10.041 2.220 -17.682 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -11.727 1.173 -19.118 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -10.422 0.482 -20.062 1.00 0.00 H new TER 1862 GLY A 124