USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 898 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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0779 X(o=-0.078,f=-0.13) USER MOD Single : A 10 ASN : amide:sc=-0.00537 X(o=-0.0054,f=-0.0054) USER MOD Single : A 11 SER OG : rot 48:sc= 0.0954 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 30:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -0.707 X(o=-0.71,f=-0.93) USER MOD Single : A 27 SER OG : rot 90:sc= 0.868 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= -6.51! C(o=-6.5!,f=-12!) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 48 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.1) USER MOD Single : A 51 TYR OH : rot 144:sc= 0.0559 USER MOD Single : A 57 THR OG1 : rot 180:sc= -0.255 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.0609 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.24) USER MOD Single : A 85 ASN : amide:sc= -0.596 K(o=-0.6,f=-2.1!) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 MET CE :methyl -163:sc= -0.0541 (180deg=-0.707) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 8:sc= 0.872 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.443 12.029 17.759 1.00 0.00 N ATOM 2 CA GLY A 1 12.209 10.805 17.619 1.00 0.00 C ATOM 3 C GLY A 1 13.703 11.058 17.571 1.00 0.00 C ATOM 4 O GLY A 1 14.456 10.520 18.382 1.00 0.00 O ATOM 0 H1 GLY A 1 10.428 11.802 17.787 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.715 12.510 18.640 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.636 12.654 16.950 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.983 10.141 18.453 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.901 10.290 16.709 1.00 0.00 H new ATOM 8 N SER A 2 14.132 11.878 16.617 1.00 0.00 N ATOM 9 CA SER A 2 15.547 12.197 16.464 1.00 0.00 C ATOM 10 C SER A 2 15.843 13.607 16.963 1.00 0.00 C ATOM 11 O SER A 2 16.635 13.797 17.886 1.00 0.00 O ATOM 12 CB SER A 2 15.965 12.064 14.998 1.00 0.00 C ATOM 13 OG SER A 2 17.341 12.359 14.831 1.00 0.00 O ATOM 0 H SER A 2 13.521 12.333 15.939 1.00 0.00 H new ATOM 0 HA SER A 2 16.121 11.491 17.064 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.762 11.051 14.649 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.368 12.738 14.384 1.00 0.00 H new ATOM 0 HG SER A 2 17.583 12.265 13.886 1.00 0.00 H new ATOM 19 N SER A 3 15.201 14.594 16.346 1.00 0.00 N ATOM 20 CA SER A 3 15.398 15.989 16.724 1.00 0.00 C ATOM 21 C SER A 3 14.607 16.326 17.984 1.00 0.00 C ATOM 22 O SER A 3 13.537 15.770 18.227 1.00 0.00 O ATOM 23 CB SER A 3 14.976 16.914 15.581 1.00 0.00 C ATOM 24 OG SER A 3 13.566 16.947 15.446 1.00 0.00 O ATOM 0 H SER A 3 14.540 14.454 15.582 1.00 0.00 H new ATOM 0 HA SER A 3 16.458 16.138 16.930 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.350 17.921 15.767 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.426 16.574 14.648 1.00 0.00 H new ATOM 0 HG SER A 3 13.322 17.546 14.710 1.00 0.00 H new ATOM 30 N GLY A 4 15.144 17.243 18.784 1.00 0.00 N ATOM 31 CA GLY A 4 14.476 17.640 20.010 1.00 0.00 C ATOM 32 C GLY A 4 13.003 17.928 19.801 1.00 0.00 C ATOM 33 O GLY A 4 12.151 17.089 20.092 1.00 0.00 O ATOM 0 H GLY A 4 16.029 17.718 18.605 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.587 16.850 20.753 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.963 18.528 20.414 1.00 0.00 H new ATOM 37 N SER A 5 12.701 19.120 19.296 1.00 0.00 N ATOM 38 CA SER A 5 11.320 19.520 19.053 1.00 0.00 C ATOM 39 C SER A 5 10.634 18.550 18.096 1.00 0.00 C ATOM 40 O SER A 5 11.241 18.073 17.138 1.00 0.00 O ATOM 41 CB SER A 5 11.270 20.938 18.482 1.00 0.00 C ATOM 42 OG SER A 5 12.127 21.067 17.361 1.00 0.00 O ATOM 0 H SER A 5 13.394 19.826 19.047 1.00 0.00 H new ATOM 0 HA SER A 5 10.790 19.501 20.005 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.248 21.181 18.192 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.562 21.653 19.251 1.00 0.00 H new ATOM 0 HG SER A 5 12.076 21.982 17.013 1.00 0.00 H new ATOM 48 N SER A 6 9.364 18.263 18.364 1.00 0.00 N ATOM 49 CA SER A 6 8.595 17.347 17.530 1.00 0.00 C ATOM 50 C SER A 6 7.340 18.026 16.991 1.00 0.00 C ATOM 51 O SER A 6 6.530 18.553 17.753 1.00 0.00 O ATOM 52 CB SER A 6 8.211 16.098 18.327 1.00 0.00 C ATOM 53 OG SER A 6 9.362 15.388 18.748 1.00 0.00 O ATOM 0 H SER A 6 8.846 18.652 19.152 1.00 0.00 H new ATOM 0 HA SER A 6 9.219 17.053 16.686 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.619 16.385 19.196 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.584 15.450 17.714 1.00 0.00 H new ATOM 0 HG SER A 6 9.090 14.596 19.256 1.00 0.00 H new ATOM 59 N GLY A 7 7.186 18.010 15.670 1.00 0.00 N ATOM 60 CA GLY A 7 6.028 18.627 15.051 1.00 0.00 C ATOM 61 C GLY A 7 6.172 18.751 13.547 1.00 0.00 C ATOM 62 O GLY A 7 7.125 19.355 13.056 1.00 0.00 O ATOM 0 H GLY A 7 7.843 17.581 15.018 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.140 18.038 15.281 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.874 19.617 15.481 1.00 0.00 H new ATOM 66 N ASN A 8 5.224 18.176 12.814 1.00 0.00 N ATOM 67 CA ASN A 8 5.251 18.223 11.356 1.00 0.00 C ATOM 68 C ASN A 8 5.063 19.652 10.855 1.00 0.00 C ATOM 69 O ASN A 8 4.168 20.366 11.306 1.00 0.00 O ATOM 70 CB ASN A 8 4.162 17.319 10.776 1.00 0.00 C ATOM 71 CG ASN A 8 4.167 15.936 11.398 1.00 0.00 C ATOM 72 OD1 ASN A 8 5.145 15.197 11.289 1.00 0.00 O ATOM 73 ND2 ASN A 8 3.069 15.579 12.055 1.00 0.00 N ATOM 0 H ASN A 8 4.428 17.672 13.205 1.00 0.00 H new ATOM 0 HA ASN A 8 6.225 17.865 11.023 1.00 0.00 H new ATOM 0 HB2 ASN A 8 3.188 17.782 10.933 1.00 0.00 H new ATOM 0 HB3 ASN A 8 4.303 17.230 9.699 1.00 0.00 H new ATOM 0 HD21 ASN A 8 3.014 14.660 12.494 1.00 0.00 H new ATOM 0 HD22 ASN A 8 2.281 16.224 12.120 1.00 0.00 H new ATOM 80 N ASP A 9 5.912 20.060 9.918 1.00 0.00 N ATOM 81 CA ASP A 9 5.838 21.403 9.353 1.00 0.00 C ATOM 82 C ASP A 9 5.964 21.360 7.833 1.00 0.00 C ATOM 83 O ASP A 9 7.068 21.319 7.293 1.00 0.00 O ATOM 84 CB ASP A 9 6.936 22.289 9.944 1.00 0.00 C ATOM 85 CG ASP A 9 6.608 22.759 11.347 1.00 0.00 C ATOM 86 OD1 ASP A 9 5.759 23.665 11.487 1.00 0.00 O ATOM 87 OD2 ASP A 9 7.199 22.221 12.306 1.00 0.00 O ATOM 0 H ASP A 9 6.659 19.481 9.534 1.00 0.00 H new ATOM 0 HA ASP A 9 4.866 21.825 9.607 1.00 0.00 H new ATOM 0 HB2 ASP A 9 7.876 21.737 9.959 1.00 0.00 H new ATOM 0 HB3 ASP A 9 7.086 23.155 9.300 1.00 0.00 H new ATOM 92 N ASN A 10 4.824 21.369 7.150 1.00 0.00 N ATOM 93 CA ASN A 10 4.807 21.330 5.692 1.00 0.00 C ATOM 94 C ASN A 10 5.726 20.231 5.166 1.00 0.00 C ATOM 95 O ASN A 10 6.383 20.397 4.139 1.00 0.00 O ATOM 96 CB ASN A 10 5.232 22.684 5.119 1.00 0.00 C ATOM 97 CG ASN A 10 4.819 23.842 6.006 1.00 0.00 C ATOM 98 OD1 ASN A 10 3.640 24.009 6.319 1.00 0.00 O ATOM 99 ND2 ASN A 10 5.790 24.649 6.416 1.00 0.00 N ATOM 0 H ASN A 10 3.901 21.403 7.582 1.00 0.00 H new ATOM 0 HA ASN A 10 3.788 21.111 5.372 1.00 0.00 H new ATOM 0 HB2 ASN A 10 6.314 22.697 4.989 1.00 0.00 H new ATOM 0 HB3 ASN A 10 4.791 22.812 4.130 1.00 0.00 H new ATOM 0 HD21 ASN A 10 5.572 25.445 7.015 1.00 0.00 H new ATOM 0 HD22 ASN A 10 6.754 24.473 6.132 1.00 0.00 H new ATOM 106 N SER A 11 5.767 19.110 5.879 1.00 0.00 N ATOM 107 CA SER A 11 6.608 17.985 5.487 1.00 0.00 C ATOM 108 C SER A 11 5.766 16.857 4.897 1.00 0.00 C ATOM 109 O SER A 11 4.600 16.671 5.246 1.00 0.00 O ATOM 110 CB SER A 11 7.400 17.470 6.689 1.00 0.00 C ATOM 111 OG SER A 11 8.395 18.400 7.081 1.00 0.00 O ATOM 0 H SER A 11 5.228 18.957 6.731 1.00 0.00 H new ATOM 0 HA SER A 11 7.305 18.332 4.724 1.00 0.00 H new ATOM 0 HB2 SER A 11 6.722 17.285 7.522 1.00 0.00 H new ATOM 0 HB3 SER A 11 7.867 16.517 6.440 1.00 0.00 H new ATOM 0 HG SER A 11 7.999 19.294 7.147 1.00 0.00 H new ATOM 117 N PRO A 12 6.370 16.086 3.981 1.00 0.00 N ATOM 118 CA PRO A 12 5.696 14.963 3.323 1.00 0.00 C ATOM 119 C PRO A 12 5.442 13.801 4.277 1.00 0.00 C ATOM 120 O PRO A 12 6.338 13.376 5.006 1.00 0.00 O ATOM 121 CB PRO A 12 6.682 14.550 2.227 1.00 0.00 C ATOM 122 CG PRO A 12 8.012 14.997 2.727 1.00 0.00 C ATOM 123 CD PRO A 12 7.758 16.251 3.517 1.00 0.00 C ATOM 0 HA PRO A 12 4.712 15.242 2.946 1.00 0.00 H new ATOM 0 HB2 PRO A 12 6.663 13.473 2.062 1.00 0.00 H new ATOM 0 HB3 PRO A 12 6.437 15.022 1.276 1.00 0.00 H new ATOM 0 HG2 PRO A 12 8.473 14.230 3.350 1.00 0.00 H new ATOM 0 HG3 PRO A 12 8.695 15.189 1.900 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.452 16.348 4.352 1.00 0.00 H new ATOM 0 HD3 PRO A 12 7.873 17.144 2.902 1.00 0.00 H new ATOM 131 N ARG A 13 4.215 13.290 4.266 1.00 0.00 N ATOM 132 CA ARG A 13 3.843 12.176 5.130 1.00 0.00 C ATOM 133 C ARG A 13 2.804 11.286 4.454 1.00 0.00 C ATOM 134 O ARG A 13 1.937 11.769 3.726 1.00 0.00 O ATOM 135 CB ARG A 13 3.296 12.697 6.461 1.00 0.00 C ATOM 136 CG ARG A 13 2.625 11.625 7.304 1.00 0.00 C ATOM 137 CD ARG A 13 3.648 10.756 8.018 1.00 0.00 C ATOM 138 NE ARG A 13 4.406 11.509 9.014 1.00 0.00 N ATOM 139 CZ ARG A 13 5.043 10.944 10.034 1.00 0.00 C ATOM 140 NH1 ARG A 13 5.015 9.628 10.190 1.00 0.00 N ATOM 141 NH2 ARG A 13 5.711 11.696 10.899 1.00 0.00 N ATOM 0 H ARG A 13 3.462 13.630 3.668 1.00 0.00 H new ATOM 0 HA ARG A 13 4.737 11.581 5.319 1.00 0.00 H new ATOM 0 HB2 ARG A 13 4.113 13.138 7.032 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.579 13.494 6.263 1.00 0.00 H new ATOM 0 HG2 ARG A 13 1.970 12.095 8.038 1.00 0.00 H new ATOM 0 HG3 ARG A 13 1.996 11.001 6.668 1.00 0.00 H new ATOM 0 HD2 ARG A 13 3.140 9.922 8.503 1.00 0.00 H new ATOM 0 HD3 ARG A 13 4.334 10.329 7.287 1.00 0.00 H new ATOM 0 HE ARG A 13 4.449 12.524 8.921 1.00 0.00 H new ATOM 0 HH11 ARG A 13 4.504 9.047 9.526 1.00 0.00 H new ATOM 0 HH12 ARG A 13 5.505 9.197 10.974 1.00 0.00 H new ATOM 0 HH21 ARG A 13 5.736 12.709 10.781 1.00 0.00 H new ATOM 0 HH22 ARG A 13 6.200 11.261 11.682 1.00 0.00 H new ATOM 155 N PHE A 14 2.900 9.983 4.700 1.00 0.00 N ATOM 156 CA PHE A 14 1.970 9.025 4.114 1.00 0.00 C ATOM 157 C PHE A 14 0.633 9.045 4.849 1.00 0.00 C ATOM 158 O PHE A 14 0.549 9.492 5.992 1.00 0.00 O ATOM 159 CB PHE A 14 2.565 7.616 4.152 1.00 0.00 C ATOM 160 CG PHE A 14 3.735 7.435 3.228 1.00 0.00 C ATOM 161 CD1 PHE A 14 3.540 7.088 1.901 1.00 0.00 C ATOM 162 CD2 PHE A 14 5.031 7.611 3.687 1.00 0.00 C ATOM 163 CE1 PHE A 14 4.616 6.919 1.049 1.00 0.00 C ATOM 164 CE2 PHE A 14 6.110 7.445 2.840 1.00 0.00 C ATOM 165 CZ PHE A 14 5.902 7.099 1.519 1.00 0.00 C ATOM 0 H PHE A 14 3.612 9.567 5.301 1.00 0.00 H new ATOM 0 HA PHE A 14 1.798 9.311 3.076 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.879 7.390 5.171 1.00 0.00 H new ATOM 0 HB3 PHE A 14 1.790 6.896 3.890 1.00 0.00 H new ATOM 0 HD1 PHE A 14 2.536 6.948 1.528 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.199 7.881 4.719 1.00 0.00 H new ATOM 0 HE1 PHE A 14 4.451 6.647 0.017 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.115 7.586 3.210 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.744 6.969 0.855 1.00 0.00 H new ATOM 175 N GLU A 15 -0.409 8.557 4.184 1.00 0.00 N ATOM 176 CA GLU A 15 -1.742 8.520 4.774 1.00 0.00 C ATOM 177 C GLU A 15 -1.817 7.475 5.883 1.00 0.00 C ATOM 178 O GLU A 15 -2.406 7.713 6.938 1.00 0.00 O ATOM 179 CB GLU A 15 -2.791 8.217 3.701 1.00 0.00 C ATOM 180 CG GLU A 15 -2.956 9.330 2.680 1.00 0.00 C ATOM 181 CD GLU A 15 -4.006 10.345 3.089 1.00 0.00 C ATOM 182 OE1 GLU A 15 -3.862 10.940 4.178 1.00 0.00 O ATOM 183 OE2 GLU A 15 -4.970 10.544 2.321 1.00 0.00 O ATOM 0 H GLU A 15 -0.356 8.182 3.237 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.947 9.499 5.206 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.514 7.299 3.183 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.751 8.034 4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.001 9.836 2.542 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.229 8.898 1.717 1.00 0.00 H new ATOM 190 N LYS A 16 -1.217 6.315 5.638 1.00 0.00 N ATOM 191 CA LYS A 16 -1.213 5.233 6.614 1.00 0.00 C ATOM 192 C LYS A 16 0.205 4.930 7.086 1.00 0.00 C ATOM 193 O LYS A 16 1.058 4.521 6.298 1.00 0.00 O ATOM 194 CB LYS A 16 -1.842 3.974 6.013 1.00 0.00 C ATOM 195 CG LYS A 16 -3.234 4.198 5.449 1.00 0.00 C ATOM 196 CD LYS A 16 -3.665 3.050 4.552 1.00 0.00 C ATOM 197 CE LYS A 16 -2.946 3.089 3.212 1.00 0.00 C ATOM 198 NZ LYS A 16 -3.741 2.434 2.137 1.00 0.00 N ATOM 0 H LYS A 16 -0.726 6.100 4.770 1.00 0.00 H new ATOM 0 HA LYS A 16 -1.802 5.551 7.474 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.195 3.598 5.221 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.890 3.201 6.780 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.945 4.308 6.267 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.252 5.129 4.883 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.460 2.102 5.049 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.742 3.098 4.390 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.747 4.125 2.937 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.980 2.592 3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -3.217 2.481 1.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.910 1.439 2.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.652 2.924 2.032 1.00 0.00 H new ATOM 212 N SER A 17 0.451 5.133 8.377 1.00 0.00 N ATOM 213 CA SER A 17 1.767 4.883 8.953 1.00 0.00 C ATOM 214 C SER A 17 2.312 3.533 8.498 1.00 0.00 C ATOM 215 O SER A 17 3.501 3.396 8.210 1.00 0.00 O ATOM 216 CB SER A 17 1.695 4.928 10.481 1.00 0.00 C ATOM 217 OG SER A 17 1.370 6.229 10.938 1.00 0.00 O ATOM 0 H SER A 17 -0.244 5.470 9.043 1.00 0.00 H new ATOM 0 HA SER A 17 2.443 5.664 8.605 1.00 0.00 H new ATOM 0 HB2 SER A 17 0.947 4.218 10.834 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.652 4.619 10.903 1.00 0.00 H new ATOM 0 HG SER A 17 1.328 6.231 11.917 1.00 0.00 H new ATOM 223 N VAL A 18 1.433 2.538 8.434 1.00 0.00 N ATOM 224 CA VAL A 18 1.825 1.198 8.013 1.00 0.00 C ATOM 225 C VAL A 18 0.883 0.662 6.941 1.00 0.00 C ATOM 226 O VAL A 18 -0.226 0.219 7.240 1.00 0.00 O ATOM 227 CB VAL A 18 1.842 0.219 9.202 1.00 0.00 C ATOM 228 CG1 VAL A 18 2.276 -1.166 8.747 1.00 0.00 C ATOM 229 CG2 VAL A 18 2.754 0.736 10.305 1.00 0.00 C ATOM 0 H VAL A 18 0.445 2.634 8.668 1.00 0.00 H new ATOM 0 HA VAL A 18 2.832 1.277 7.602 1.00 0.00 H new ATOM 0 HB VAL A 18 0.831 0.144 9.603 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.282 -1.844 9.600 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.580 -1.536 7.994 1.00 0.00 H new ATOM 0 HG13 VAL A 18 3.277 -1.111 8.320 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.754 0.032 11.137 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.768 0.842 9.919 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.394 1.705 10.650 1.00 0.00 H new ATOM 239 N TYR A 19 1.333 0.704 5.692 1.00 0.00 N ATOM 240 CA TYR A 19 0.529 0.224 4.574 1.00 0.00 C ATOM 241 C TYR A 19 0.384 -1.294 4.619 1.00 0.00 C ATOM 242 O TYR A 19 1.305 -2.027 4.259 1.00 0.00 O ATOM 243 CB TYR A 19 1.160 0.648 3.246 1.00 0.00 C ATOM 244 CG TYR A 19 0.799 2.054 2.826 1.00 0.00 C ATOM 245 CD1 TYR A 19 0.932 3.120 3.707 1.00 0.00 C ATOM 246 CD2 TYR A 19 0.325 2.318 1.546 1.00 0.00 C ATOM 247 CE1 TYR A 19 0.602 4.406 3.327 1.00 0.00 C ATOM 248 CE2 TYR A 19 -0.006 3.601 1.158 1.00 0.00 C ATOM 249 CZ TYR A 19 0.134 4.642 2.052 1.00 0.00 C ATOM 250 OH TYR A 19 -0.194 5.923 1.669 1.00 0.00 O ATOM 0 H TYR A 19 2.250 1.065 5.428 1.00 0.00 H new ATOM 0 HA TYR A 19 -0.463 0.668 4.656 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.244 0.569 3.327 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.847 -0.047 2.467 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.300 2.940 4.706 1.00 0.00 H new ATOM 0 HD2 TYR A 19 0.214 1.506 0.843 1.00 0.00 H new ATOM 0 HE1 TYR A 19 0.710 5.223 4.025 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -0.373 3.789 0.160 1.00 0.00 H new ATOM 0 HH TYR A 19 0.364 6.564 2.158 1.00 0.00 H new ATOM 260 N GLU A 20 -0.779 -1.758 5.064 1.00 0.00 N ATOM 261 CA GLU A 20 -1.045 -3.189 5.157 1.00 0.00 C ATOM 262 C GLU A 20 -1.988 -3.640 4.045 1.00 0.00 C ATOM 263 O GLU A 20 -3.168 -3.291 4.037 1.00 0.00 O ATOM 264 CB GLU A 20 -1.649 -3.530 6.521 1.00 0.00 C ATOM 265 CG GLU A 20 -1.460 -4.983 6.924 1.00 0.00 C ATOM 266 CD GLU A 20 -1.640 -5.204 8.413 1.00 0.00 C ATOM 267 OE1 GLU A 20 -2.797 -5.173 8.882 1.00 0.00 O ATOM 268 OE2 GLU A 20 -0.624 -5.409 9.109 1.00 0.00 O ATOM 0 H GLU A 20 -1.552 -1.165 5.366 1.00 0.00 H new ATOM 0 HA GLU A 20 -0.098 -3.717 5.044 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -1.198 -2.890 7.279 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -2.715 -3.302 6.504 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -2.173 -5.603 6.380 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -0.463 -5.311 6.630 1.00 0.00 H new ATOM 275 N ALA A 21 -1.457 -4.418 3.107 1.00 0.00 N ATOM 276 CA ALA A 21 -2.249 -4.918 1.991 1.00 0.00 C ATOM 277 C ALA A 21 -2.104 -6.429 1.849 1.00 0.00 C ATOM 278 O ALA A 21 -1.231 -7.040 2.467 1.00 0.00 O ATOM 279 CB ALA A 21 -1.841 -4.223 0.700 1.00 0.00 C ATOM 0 H ALA A 21 -0.481 -4.715 3.098 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.297 -4.697 2.194 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -2.441 -4.607 -0.125 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.003 -3.150 0.798 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.786 -4.414 0.501 1.00 0.00 H new ATOM 285 N ASP A 22 -2.963 -7.027 1.031 1.00 0.00 N ATOM 286 CA ASP A 22 -2.930 -8.468 0.807 1.00 0.00 C ATOM 287 C ASP A 22 -2.380 -8.790 -0.578 1.00 0.00 C ATOM 288 O ASP A 22 -2.970 -8.418 -1.594 1.00 0.00 O ATOM 289 CB ASP A 22 -4.331 -9.062 0.965 1.00 0.00 C ATOM 290 CG ASP A 22 -5.204 -8.815 -0.249 1.00 0.00 C ATOM 291 OD1 ASP A 22 -5.449 -7.634 -0.574 1.00 0.00 O ATOM 292 OD2 ASP A 22 -5.643 -9.803 -0.875 1.00 0.00 O ATOM 0 H ASP A 22 -3.691 -6.536 0.512 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.270 -8.912 1.552 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -4.250 -10.135 1.139 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -4.808 -8.632 1.846 1.00 0.00 H new ATOM 297 N LEU A 23 -1.247 -9.482 -0.613 1.00 0.00 N ATOM 298 CA LEU A 23 -0.616 -9.854 -1.875 1.00 0.00 C ATOM 299 C LEU A 23 -0.727 -11.356 -2.118 1.00 0.00 C ATOM 300 O LEU A 23 -0.356 -12.162 -1.265 1.00 0.00 O ATOM 301 CB LEU A 23 0.855 -9.434 -1.876 1.00 0.00 C ATOM 302 CG LEU A 23 1.531 -9.359 -3.245 1.00 0.00 C ATOM 303 CD1 LEU A 23 1.831 -10.755 -3.768 1.00 0.00 C ATOM 304 CD2 LEU A 23 0.659 -8.594 -4.230 1.00 0.00 C ATOM 0 H LEU A 23 -0.746 -9.797 0.218 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.137 -9.335 -2.679 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.933 -8.456 -1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 23 1.413 -10.136 -1.256 1.00 0.00 H new ATOM 0 HG LEU A 23 2.474 -8.824 -3.135 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.312 -10.683 -4.743 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.495 -11.269 -3.073 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.901 -11.316 -3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.156 -8.551 -5.199 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.300 -9.101 -4.337 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.495 -7.582 -3.861 1.00 0.00 H new ATOM 316 N ALA A 24 -1.239 -11.725 -3.287 1.00 0.00 N ATOM 317 CA ALA A 24 -1.395 -13.129 -3.644 1.00 0.00 C ATOM 318 C ALA A 24 -0.053 -13.756 -4.008 1.00 0.00 C ATOM 319 O ALA A 24 0.558 -13.394 -5.013 1.00 0.00 O ATOM 320 CB ALA A 24 -2.378 -13.275 -4.797 1.00 0.00 C ATOM 0 H ALA A 24 -1.553 -11.070 -4.003 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.789 -13.657 -2.776 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.485 -14.329 -5.053 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.347 -12.873 -4.502 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.007 -12.727 -5.663 1.00 0.00 H new ATOM 326 N GLU A 25 0.399 -14.695 -3.184 1.00 0.00 N ATOM 327 CA GLU A 25 1.670 -15.370 -3.420 1.00 0.00 C ATOM 328 C GLU A 25 1.874 -15.642 -4.908 1.00 0.00 C ATOM 329 O GLU A 25 2.977 -15.492 -5.431 1.00 0.00 O ATOM 330 CB GLU A 25 1.729 -16.684 -2.637 1.00 0.00 C ATOM 331 CG GLU A 25 0.828 -17.769 -3.202 1.00 0.00 C ATOM 332 CD GLU A 25 1.019 -19.104 -2.510 1.00 0.00 C ATOM 333 OE1 GLU A 25 2.065 -19.748 -2.741 1.00 0.00 O ATOM 334 OE2 GLU A 25 0.124 -19.507 -1.738 1.00 0.00 O ATOM 0 H GLU A 25 -0.095 -15.006 -2.348 1.00 0.00 H new ATOM 0 HA GLU A 25 2.469 -14.714 -3.075 1.00 0.00 H new ATOM 0 HB2 GLU A 25 2.757 -17.046 -2.627 1.00 0.00 H new ATOM 0 HB3 GLU A 25 1.448 -16.493 -1.601 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -0.213 -17.459 -3.105 1.00 0.00 H new ATOM 0 HG3 GLU A 25 1.028 -17.884 -4.267 1.00 0.00 H new ATOM 341 N ASN A 26 0.802 -16.044 -5.582 1.00 0.00 N ATOM 342 CA ASN A 26 0.862 -16.338 -7.009 1.00 0.00 C ATOM 343 C ASN A 26 0.506 -15.105 -7.834 1.00 0.00 C ATOM 344 O ASN A 26 -0.296 -15.180 -8.766 1.00 0.00 O ATOM 345 CB ASN A 26 -0.086 -17.488 -7.354 1.00 0.00 C ATOM 346 CG ASN A 26 0.370 -18.267 -8.573 1.00 0.00 C ATOM 347 OD1 ASN A 26 0.940 -17.703 -9.506 1.00 0.00 O ATOM 348 ND2 ASN A 26 0.118 -19.571 -8.569 1.00 0.00 N ATOM 0 H ASN A 26 -0.119 -16.174 -5.163 1.00 0.00 H new ATOM 0 HA ASN A 26 1.883 -16.633 -7.251 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -0.159 -18.163 -6.501 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.085 -17.091 -7.533 1.00 0.00 H new ATOM 0 HD21 ASN A 26 0.400 -20.147 -9.362 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -0.358 -19.996 -7.773 1.00 0.00 H new ATOM 355 N SER A 27 1.108 -13.973 -7.486 1.00 0.00 N ATOM 356 CA SER A 27 0.852 -12.723 -8.192 1.00 0.00 C ATOM 357 C SER A 27 1.790 -12.572 -9.386 1.00 0.00 C ATOM 358 O SER A 27 3.005 -12.461 -9.225 1.00 0.00 O ATOM 359 CB SER A 27 1.019 -11.534 -7.244 1.00 0.00 C ATOM 360 OG SER A 27 -0.124 -11.373 -6.421 1.00 0.00 O ATOM 0 H SER A 27 1.776 -13.895 -6.720 1.00 0.00 H new ATOM 0 HA SER A 27 -0.174 -12.745 -8.559 1.00 0.00 H new ATOM 0 HB2 SER A 27 1.901 -11.682 -6.621 1.00 0.00 H new ATOM 0 HB3 SER A 27 1.186 -10.625 -7.822 1.00 0.00 H new ATOM 0 HG SER A 27 -0.008 -11.889 -5.596 1.00 0.00 H new ATOM 366 N ALA A 28 1.216 -12.568 -10.585 1.00 0.00 N ATOM 367 CA ALA A 28 1.998 -12.429 -11.806 1.00 0.00 C ATOM 368 C ALA A 28 2.965 -11.253 -11.708 1.00 0.00 C ATOM 369 O ALA A 28 2.806 -10.355 -10.881 1.00 0.00 O ATOM 370 CB ALA A 28 1.079 -12.259 -13.006 1.00 0.00 C ATOM 0 H ALA A 28 0.211 -12.660 -10.736 1.00 0.00 H new ATOM 0 HA ALA A 28 2.584 -13.339 -11.937 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.678 -12.156 -13.911 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.432 -13.132 -13.096 1.00 0.00 H new ATOM 0 HB3 ALA A 28 0.467 -11.367 -12.872 1.00 0.00 H new ATOM 376 N PRO A 29 3.992 -11.257 -12.570 1.00 0.00 N ATOM 377 CA PRO A 29 5.005 -10.197 -12.600 1.00 0.00 C ATOM 378 C PRO A 29 4.446 -8.876 -13.118 1.00 0.00 C ATOM 379 O PRO A 29 4.627 -8.530 -14.285 1.00 0.00 O ATOM 380 CB PRO A 29 6.063 -10.744 -13.561 1.00 0.00 C ATOM 381 CG PRO A 29 5.322 -11.692 -14.440 1.00 0.00 C ATOM 382 CD PRO A 29 4.244 -12.295 -13.584 1.00 0.00 C ATOM 0 HA PRO A 29 5.389 -9.972 -11.605 1.00 0.00 H new ATOM 0 HB2 PRO A 29 6.523 -9.944 -14.141 1.00 0.00 H new ATOM 0 HB3 PRO A 29 6.865 -11.248 -13.022 1.00 0.00 H new ATOM 0 HG2 PRO A 29 4.894 -11.175 -15.299 1.00 0.00 H new ATOM 0 HG3 PRO A 29 5.987 -12.463 -14.831 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.348 -12.516 -14.163 1.00 0.00 H new ATOM 0 HD3 PRO A 29 4.569 -13.231 -13.129 1.00 0.00 H new ATOM 390 N GLY A 30 3.767 -8.141 -12.242 1.00 0.00 N ATOM 391 CA GLY A 30 3.194 -6.866 -12.631 1.00 0.00 C ATOM 392 C GLY A 30 1.919 -6.549 -11.874 1.00 0.00 C ATOM 393 O GLY A 30 1.463 -5.405 -11.861 1.00 0.00 O ATOM 0 H GLY A 30 3.604 -8.406 -11.271 1.00 0.00 H new ATOM 0 HA2 GLY A 30 3.923 -6.075 -12.456 1.00 0.00 H new ATOM 0 HA3 GLY A 30 2.985 -6.876 -13.701 1.00 0.00 H new ATOM 397 N THR A 31 1.339 -7.565 -11.243 1.00 0.00 N ATOM 398 CA THR A 31 0.108 -7.391 -10.483 1.00 0.00 C ATOM 399 C THR A 31 0.202 -6.187 -9.553 1.00 0.00 C ATOM 400 O THR A 31 1.126 -6.065 -8.748 1.00 0.00 O ATOM 401 CB THR A 31 -0.221 -8.644 -9.651 1.00 0.00 C ATOM 402 OG1 THR A 31 -0.534 -9.740 -10.518 1.00 0.00 O ATOM 403 CG2 THR A 31 -1.392 -8.381 -8.716 1.00 0.00 C ATOM 0 H THR A 31 1.703 -8.518 -11.243 1.00 0.00 H new ATOM 0 HA THR A 31 -0.690 -7.226 -11.207 1.00 0.00 H new ATOM 0 HB THR A 31 0.654 -8.894 -9.051 1.00 0.00 H new ATOM 0 HG1 THR A 31 -0.740 -10.533 -9.981 1.00 0.00 H new ATOM 0 HG21 THR A 31 -1.606 -9.281 -8.139 1.00 0.00 H new ATOM 0 HG22 THR A 31 -1.140 -7.566 -8.038 1.00 0.00 H new ATOM 0 HG23 THR A 31 -2.270 -8.108 -9.301 1.00 0.00 H new ATOM 411 N PRO A 32 -0.776 -5.276 -9.662 1.00 0.00 N ATOM 412 CA PRO A 32 -0.826 -4.065 -8.837 1.00 0.00 C ATOM 413 C PRO A 32 -1.141 -4.372 -7.376 1.00 0.00 C ATOM 414 O PRO A 32 -2.080 -5.109 -7.076 1.00 0.00 O ATOM 415 CB PRO A 32 -1.958 -3.251 -9.468 1.00 0.00 C ATOM 416 CG PRO A 32 -2.828 -4.263 -10.130 1.00 0.00 C ATOM 417 CD PRO A 32 -1.909 -5.357 -10.599 1.00 0.00 C ATOM 0 HA PRO A 32 0.132 -3.545 -8.819 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -2.508 -2.688 -8.714 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -1.573 -2.529 -10.188 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.573 -4.651 -9.436 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.370 -3.823 -10.967 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -2.393 -6.333 -10.560 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -1.590 -5.200 -11.629 1.00 0.00 H new ATOM 425 N ILE A 33 -0.351 -3.801 -6.473 1.00 0.00 N ATOM 426 CA ILE A 33 -0.548 -4.013 -5.044 1.00 0.00 C ATOM 427 C ILE A 33 -1.386 -2.896 -4.433 1.00 0.00 C ATOM 428 O ILE A 33 -2.552 -3.096 -4.090 1.00 0.00 O ATOM 429 CB ILE A 33 0.797 -4.098 -4.298 1.00 0.00 C ATOM 430 CG1 ILE A 33 1.638 -5.252 -4.846 1.00 0.00 C ATOM 431 CG2 ILE A 33 0.563 -4.269 -2.804 1.00 0.00 C ATOM 432 CD1 ILE A 33 3.128 -5.037 -4.698 1.00 0.00 C ATOM 0 H ILE A 33 0.431 -3.188 -6.705 1.00 0.00 H new ATOM 0 HA ILE A 33 -1.076 -4.960 -4.935 1.00 0.00 H new ATOM 0 HB ILE A 33 1.343 -3.168 -4.457 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.359 -6.171 -4.331 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.402 -5.394 -5.901 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.522 -4.328 -2.290 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -0.001 -3.417 -2.424 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.000 -5.185 -2.626 1.00 0.00 H new ATOM 0 HD11 ILE A 33 3.662 -5.894 -5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.421 -4.136 -5.237 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.376 -4.925 -3.643 1.00 0.00 H new ATOM 444 N LEU A 34 -0.787 -1.718 -4.302 1.00 0.00 N ATOM 445 CA LEU A 34 -1.479 -0.566 -3.734 1.00 0.00 C ATOM 446 C LEU A 34 -0.802 0.736 -4.151 1.00 0.00 C ATOM 447 O LEU A 34 0.316 0.728 -4.666 1.00 0.00 O ATOM 448 CB LEU A 34 -1.514 -0.669 -2.208 1.00 0.00 C ATOM 449 CG LEU A 34 -0.157 -0.749 -1.509 1.00 0.00 C ATOM 450 CD1 LEU A 34 0.507 0.619 -1.475 1.00 0.00 C ATOM 451 CD2 LEU A 34 -0.315 -1.303 -0.100 1.00 0.00 C ATOM 0 H LEU A 34 0.177 -1.535 -4.581 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.500 -0.562 -4.116 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.051 0.196 -1.818 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.092 -1.552 -1.937 1.00 0.00 H new ATOM 0 HG LEU A 34 0.483 -1.427 -2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.472 0.543 -0.974 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.655 0.977 -2.494 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.129 1.319 -0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.661 -1.353 0.383 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.972 -0.651 0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.748 -2.302 -0.148 1.00 0.00 H new ATOM 463 N GLN A 35 -1.487 1.852 -3.923 1.00 0.00 N ATOM 464 CA GLN A 35 -0.951 3.162 -4.274 1.00 0.00 C ATOM 465 C GLN A 35 -0.521 3.926 -3.027 1.00 0.00 C ATOM 466 O GLN A 35 -1.244 3.967 -2.031 1.00 0.00 O ATOM 467 CB GLN A 35 -1.992 3.971 -5.050 1.00 0.00 C ATOM 468 CG GLN A 35 -1.620 5.436 -5.220 1.00 0.00 C ATOM 469 CD GLN A 35 -0.695 5.670 -6.398 1.00 0.00 C ATOM 470 OE1 GLN A 35 0.024 4.767 -6.826 1.00 0.00 O ATOM 471 NE2 GLN A 35 -0.709 6.887 -6.929 1.00 0.00 N ATOM 0 H GLN A 35 -2.414 1.875 -3.497 1.00 0.00 H new ATOM 0 HA GLN A 35 -0.075 3.011 -4.905 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -2.129 3.523 -6.034 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -2.950 3.905 -4.534 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -2.528 6.024 -5.353 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -1.140 5.793 -4.309 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -1.321 7.605 -6.542 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -0.108 7.104 -7.724 1.00 0.00 H new ATOM 480 N LEU A 36 0.660 4.531 -3.088 1.00 0.00 N ATOM 481 CA LEU A 36 1.188 5.295 -1.962 1.00 0.00 C ATOM 482 C LEU A 36 0.950 6.789 -2.159 1.00 0.00 C ATOM 483 O LEU A 36 1.562 7.416 -3.023 1.00 0.00 O ATOM 484 CB LEU A 36 2.683 5.023 -1.792 1.00 0.00 C ATOM 485 CG LEU A 36 3.072 3.575 -1.490 1.00 0.00 C ATOM 486 CD1 LEU A 36 4.455 3.268 -2.044 1.00 0.00 C ATOM 487 CD2 LEU A 36 3.025 3.311 0.008 1.00 0.00 C ATOM 0 H LEU A 36 1.270 4.508 -3.905 1.00 0.00 H new ATOM 0 HA LEU A 36 0.663 4.978 -1.061 1.00 0.00 H new ATOM 0 HB2 LEU A 36 3.194 5.333 -2.703 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.057 5.654 -0.986 1.00 0.00 H new ATOM 0 HG LEU A 36 2.353 2.916 -1.977 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.715 2.234 -1.820 1.00 0.00 H new ATOM 0 HD12 LEU A 36 4.456 3.417 -3.124 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.186 3.934 -1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 36 3.305 2.276 0.204 1.00 0.00 H new ATOM 0 HD22 LEU A 36 3.721 3.978 0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.015 3.490 0.378 1.00 0.00 H new ATOM 499 N ARG A 37 0.059 7.352 -1.349 1.00 0.00 N ATOM 500 CA ARG A 37 -0.259 8.773 -1.433 1.00 0.00 C ATOM 501 C ARG A 37 0.446 9.554 -0.328 1.00 0.00 C ATOM 502 O ARG A 37 0.419 9.160 0.837 1.00 0.00 O ATOM 503 CB ARG A 37 -1.771 8.985 -1.339 1.00 0.00 C ATOM 504 CG ARG A 37 -2.475 8.959 -2.686 1.00 0.00 C ATOM 505 CD ARG A 37 -2.375 10.302 -3.392 1.00 0.00 C ATOM 506 NE ARG A 37 -2.983 11.377 -2.612 1.00 0.00 N ATOM 507 CZ ARG A 37 -2.753 12.667 -2.834 1.00 0.00 C ATOM 508 NH1 ARG A 37 -1.934 13.040 -3.808 1.00 0.00 N ATOM 509 NH2 ARG A 37 -3.344 13.586 -2.082 1.00 0.00 N ATOM 0 H ARG A 37 -0.455 6.846 -0.628 1.00 0.00 H new ATOM 0 HA ARG A 37 0.093 9.143 -2.396 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -2.199 8.212 -0.700 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -1.966 9.942 -0.855 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.035 8.183 -3.313 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.524 8.698 -2.545 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -1.327 10.537 -3.578 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -2.864 10.238 -4.364 1.00 0.00 H new ATOM 0 HE ARG A 37 -3.619 11.124 -1.856 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -1.479 12.336 -4.389 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -1.759 14.031 -3.976 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.975 13.303 -1.333 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -3.167 14.576 -2.253 1.00 0.00 H new ATOM 523 N ALA A 38 1.075 10.663 -0.703 1.00 0.00 N ATOM 524 CA ALA A 38 1.785 11.499 0.256 1.00 0.00 C ATOM 525 C ALA A 38 0.923 12.676 0.702 1.00 0.00 C ATOM 526 O ALA A 38 1.417 13.791 0.869 1.00 0.00 O ATOM 527 CB ALA A 38 3.092 11.998 -0.344 1.00 0.00 C ATOM 0 H ALA A 38 1.107 11.003 -1.664 1.00 0.00 H new ATOM 0 HA ALA A 38 2.009 10.892 1.133 1.00 0.00 H new ATOM 0 HB1 ALA A 38 3.612 12.621 0.384 1.00 0.00 H new ATOM 0 HB2 ALA A 38 3.720 11.147 -0.607 1.00 0.00 H new ATOM 0 HB3 ALA A 38 2.881 12.584 -1.239 1.00 0.00 H new ATOM 533 N ALA A 39 -0.367 12.420 0.892 1.00 0.00 N ATOM 534 CA ALA A 39 -1.297 13.457 1.320 1.00 0.00 C ATOM 535 C ALA A 39 -0.617 14.454 2.252 1.00 0.00 C ATOM 536 O ALA A 39 0.096 14.065 3.178 1.00 0.00 O ATOM 537 CB ALA A 39 -2.506 12.834 2.001 1.00 0.00 C ATOM 0 H ALA A 39 -0.792 11.503 0.756 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.632 13.998 0.435 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -3.192 13.621 2.315 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.013 12.168 1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -2.180 12.267 2.873 1.00 0.00 H new ATOM 543 N ASP A 40 -0.840 15.739 2.001 1.00 0.00 N ATOM 544 CA ASP A 40 -0.249 16.792 2.819 1.00 0.00 C ATOM 545 C ASP A 40 -1.331 17.653 3.463 1.00 0.00 C ATOM 546 O ASP A 40 -1.048 18.479 4.331 1.00 0.00 O ATOM 547 CB ASP A 40 0.678 17.665 1.972 1.00 0.00 C ATOM 548 CG ASP A 40 1.784 18.300 2.792 1.00 0.00 C ATOM 549 OD1 ASP A 40 2.133 17.740 3.852 1.00 0.00 O ATOM 550 OD2 ASP A 40 2.300 19.358 2.374 1.00 0.00 O ATOM 0 H ASP A 40 -1.426 16.077 1.237 1.00 0.00 H new ATOM 0 HA ASP A 40 0.332 16.319 3.611 1.00 0.00 H new ATOM 0 HB2 ASP A 40 1.119 17.060 1.180 1.00 0.00 H new ATOM 0 HB3 ASP A 40 0.094 18.447 1.488 1.00 0.00 H new ATOM 555 N LEU A 41 -2.572 17.455 3.031 1.00 0.00 N ATOM 556 CA LEU A 41 -3.698 18.214 3.564 1.00 0.00 C ATOM 557 C LEU A 41 -3.522 19.706 3.300 1.00 0.00 C ATOM 558 O LEU A 41 -4.071 20.542 4.018 1.00 0.00 O ATOM 559 CB LEU A 41 -3.842 17.963 5.066 1.00 0.00 C ATOM 560 CG LEU A 41 -4.340 16.575 5.470 1.00 0.00 C ATOM 561 CD1 LEU A 41 -3.961 16.270 6.911 1.00 0.00 C ATOM 562 CD2 LEU A 41 -5.846 16.473 5.280 1.00 0.00 C ATOM 0 H LEU A 41 -2.824 16.775 2.313 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.603 17.879 3.058 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -2.873 18.131 5.537 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -4.527 18.706 5.474 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.862 15.837 4.826 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.324 15.278 7.181 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.877 16.301 7.016 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -4.411 17.012 7.570 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.183 15.479 5.572 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.342 17.221 5.899 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.093 16.647 4.233 1.00 0.00 H new ATOM 574 N ASP A 42 -2.756 20.032 2.265 1.00 0.00 N ATOM 575 CA ASP A 42 -2.510 21.424 1.904 1.00 0.00 C ATOM 576 C ASP A 42 -3.415 21.855 0.754 1.00 0.00 C ATOM 577 O ASP A 42 -3.150 22.851 0.081 1.00 0.00 O ATOM 578 CB ASP A 42 -1.044 21.622 1.518 1.00 0.00 C ATOM 579 CG ASP A 42 -0.547 20.552 0.566 1.00 0.00 C ATOM 580 OD1 ASP A 42 -1.385 19.936 -0.124 1.00 0.00 O ATOM 581 OD2 ASP A 42 0.681 20.329 0.512 1.00 0.00 O ATOM 0 H ASP A 42 -2.295 19.352 1.661 1.00 0.00 H new ATOM 0 HA ASP A 42 -2.735 22.044 2.772 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.922 22.601 1.055 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.430 21.617 2.419 1.00 0.00 H new ATOM 586 N VAL A 43 -4.484 21.096 0.533 1.00 0.00 N ATOM 587 CA VAL A 43 -5.429 21.399 -0.536 1.00 0.00 C ATOM 588 C VAL A 43 -4.734 22.092 -1.702 1.00 0.00 C ATOM 589 O VAL A 43 -5.259 23.049 -2.271 1.00 0.00 O ATOM 590 CB VAL A 43 -6.578 22.292 -0.033 1.00 0.00 C ATOM 591 CG1 VAL A 43 -7.167 21.732 1.253 1.00 0.00 C ATOM 592 CG2 VAL A 43 -6.093 23.720 0.172 1.00 0.00 C ATOM 0 H VAL A 43 -4.717 20.267 1.080 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.840 20.448 -0.875 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.363 22.303 -0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.977 22.377 1.593 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.553 20.729 1.070 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.393 21.688 2.019 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.918 24.337 0.528 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.289 23.729 0.908 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.723 24.118 -0.773 1.00 0.00 H new ATOM 602 N GLY A 44 -3.550 21.602 -2.055 1.00 0.00 N ATOM 603 CA GLY A 44 -2.802 22.186 -3.153 1.00 0.00 C ATOM 604 C GLY A 44 -1.853 21.197 -3.800 1.00 0.00 C ATOM 605 O GLY A 44 -2.034 20.818 -4.957 1.00 0.00 O ATOM 0 H GLY A 44 -3.095 20.811 -1.600 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.498 22.561 -3.903 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -2.235 23.042 -2.787 1.00 0.00 H new ATOM 609 N VAL A 45 -0.838 20.777 -3.052 1.00 0.00 N ATOM 610 CA VAL A 45 0.144 19.826 -3.559 1.00 0.00 C ATOM 611 C VAL A 45 -0.527 18.535 -4.015 1.00 0.00 C ATOM 612 O VAL A 45 -1.222 17.879 -3.241 1.00 0.00 O ATOM 613 CB VAL A 45 1.205 19.493 -2.494 1.00 0.00 C ATOM 614 CG1 VAL A 45 2.099 18.356 -2.968 1.00 0.00 C ATOM 615 CG2 VAL A 45 2.030 20.726 -2.159 1.00 0.00 C ATOM 0 H VAL A 45 -0.674 21.081 -2.092 1.00 0.00 H new ATOM 0 HA VAL A 45 0.633 20.299 -4.411 1.00 0.00 H new ATOM 0 HB VAL A 45 0.694 19.169 -1.587 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.843 18.135 -2.202 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.493 17.469 -3.152 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.603 18.649 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.775 20.472 -1.405 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.532 21.083 -3.058 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.376 21.508 -1.774 1.00 0.00 H new ATOM 625 N ASN A 46 -0.312 18.176 -5.276 1.00 0.00 N ATOM 626 CA ASN A 46 -0.896 16.962 -5.836 1.00 0.00 C ATOM 627 C ASN A 46 -0.055 15.740 -5.479 1.00 0.00 C ATOM 628 O ASN A 46 0.181 14.870 -6.316 1.00 0.00 O ATOM 629 CB ASN A 46 -1.019 17.085 -7.356 1.00 0.00 C ATOM 630 CG ASN A 46 -2.321 17.737 -7.779 1.00 0.00 C ATOM 631 OD1 ASN A 46 -3.400 17.179 -7.582 1.00 0.00 O ATOM 632 ND2 ASN A 46 -2.224 18.924 -8.366 1.00 0.00 N ATOM 0 H ASN A 46 0.262 18.708 -5.930 1.00 0.00 H new ATOM 0 HA ASN A 46 -1.890 16.835 -5.407 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -0.182 17.669 -7.740 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.949 16.094 -7.805 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -3.066 19.411 -8.674 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -1.308 19.349 -8.509 1.00 0.00 H new ATOM 639 N GLY A 47 0.394 15.681 -4.229 1.00 0.00 N ATOM 640 CA GLY A 47 1.203 14.562 -3.783 1.00 0.00 C ATOM 641 C GLY A 47 2.376 14.292 -4.703 1.00 0.00 C ATOM 642 O GLY A 47 2.513 13.192 -5.238 1.00 0.00 O ATOM 0 H GLY A 47 0.212 16.388 -3.517 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.573 14.763 -2.777 1.00 0.00 H new ATOM 0 HA3 GLY A 47 0.581 13.669 -3.721 1.00 0.00 H new ATOM 646 N GLN A 48 3.225 15.298 -4.888 1.00 0.00 N ATOM 647 CA GLN A 48 4.391 15.163 -5.753 1.00 0.00 C ATOM 648 C GLN A 48 5.629 14.790 -4.943 1.00 0.00 C ATOM 649 O GLN A 48 6.508 15.622 -4.717 1.00 0.00 O ATOM 650 CB GLN A 48 4.640 16.466 -6.516 1.00 0.00 C ATOM 651 CG GLN A 48 3.638 16.718 -7.631 1.00 0.00 C ATOM 652 CD GLN A 48 3.764 15.721 -8.765 1.00 0.00 C ATOM 653 OE1 GLN A 48 4.709 15.776 -9.553 1.00 0.00 O ATOM 654 NE2 GLN A 48 2.810 14.802 -8.855 1.00 0.00 N ATOM 0 H GLN A 48 3.127 16.214 -4.451 1.00 0.00 H new ATOM 0 HA GLN A 48 4.192 14.364 -6.467 1.00 0.00 H new ATOM 0 HB2 GLN A 48 4.608 17.300 -5.815 1.00 0.00 H new ATOM 0 HB3 GLN A 48 5.644 16.443 -6.939 1.00 0.00 H new ATOM 0 HG2 GLN A 48 2.628 16.673 -7.224 1.00 0.00 H new ATOM 0 HG3 GLN A 48 3.780 17.726 -8.021 1.00 0.00 H new ATOM 0 HE21 GLN A 48 2.045 14.793 -8.180 1.00 0.00 H new ATOM 0 HE22 GLN A 48 2.842 14.105 -9.599 1.00 0.00 H new ATOM 663 N ILE A 49 5.690 13.536 -4.509 1.00 0.00 N ATOM 664 CA ILE A 49 6.820 13.054 -3.725 1.00 0.00 C ATOM 665 C ILE A 49 7.438 11.812 -4.358 1.00 0.00 C ATOM 666 O ILE A 49 6.752 11.034 -5.019 1.00 0.00 O ATOM 667 CB ILE A 49 6.403 12.725 -2.279 1.00 0.00 C ATOM 668 CG1 ILE A 49 5.928 13.991 -1.562 1.00 0.00 C ATOM 669 CG2 ILE A 49 7.560 12.086 -1.526 1.00 0.00 C ATOM 670 CD1 ILE A 49 6.947 15.109 -1.571 1.00 0.00 C ATOM 0 H ILE A 49 4.970 12.835 -4.687 1.00 0.00 H new ATOM 0 HA ILE A 49 7.557 13.857 -3.708 1.00 0.00 H new ATOM 0 HB ILE A 49 5.577 12.014 -2.307 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.010 14.343 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 49 5.682 13.743 -0.530 1.00 0.00 H new ATOM 0 HG21 ILE A 49 7.249 11.860 -0.506 1.00 0.00 H new ATOM 0 HG22 ILE A 49 7.856 11.165 -2.028 1.00 0.00 H new ATOM 0 HG23 ILE A 49 8.404 12.775 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 49 6.543 15.974 -1.045 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.858 14.775 -1.074 1.00 0.00 H new ATOM 0 HD13 ILE A 49 7.176 15.384 -2.600 1.00 0.00 H new ATOM 682 N GLU A 50 8.739 11.633 -4.149 1.00 0.00 N ATOM 683 CA GLU A 50 9.449 10.485 -4.699 1.00 0.00 C ATOM 684 C GLU A 50 9.334 9.278 -3.772 1.00 0.00 C ATOM 685 O GLU A 50 10.011 9.202 -2.747 1.00 0.00 O ATOM 686 CB GLU A 50 10.923 10.829 -4.925 1.00 0.00 C ATOM 687 CG GLU A 50 11.136 12.035 -5.823 1.00 0.00 C ATOM 688 CD GLU A 50 12.584 12.206 -6.238 1.00 0.00 C ATOM 689 OE1 GLU A 50 13.460 12.211 -5.347 1.00 0.00 O ATOM 690 OE2 GLU A 50 12.842 12.336 -7.453 1.00 0.00 O ATOM 0 H GLU A 50 9.322 12.268 -3.603 1.00 0.00 H new ATOM 0 HA GLU A 50 8.991 10.232 -5.655 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.395 11.017 -3.961 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.425 9.967 -5.364 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.516 11.934 -6.714 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.803 12.933 -5.303 1.00 0.00 H new ATOM 697 N TYR A 51 8.471 8.338 -4.140 1.00 0.00 N ATOM 698 CA TYR A 51 8.263 7.136 -3.341 1.00 0.00 C ATOM 699 C TYR A 51 9.305 6.073 -3.675 1.00 0.00 C ATOM 700 O TYR A 51 9.053 5.168 -4.471 1.00 0.00 O ATOM 701 CB TYR A 51 6.858 6.579 -3.574 1.00 0.00 C ATOM 702 CG TYR A 51 5.778 7.637 -3.562 1.00 0.00 C ATOM 703 CD1 TYR A 51 5.164 8.019 -2.375 1.00 0.00 C ATOM 704 CD2 TYR A 51 5.372 8.257 -4.738 1.00 0.00 C ATOM 705 CE1 TYR A 51 4.176 8.984 -2.360 1.00 0.00 C ATOM 706 CE2 TYR A 51 4.386 9.225 -4.732 1.00 0.00 C ATOM 707 CZ TYR A 51 3.791 9.585 -3.541 1.00 0.00 C ATOM 708 OH TYR A 51 2.808 10.548 -3.530 1.00 0.00 O ATOM 0 H TYR A 51 7.904 8.385 -4.987 1.00 0.00 H new ATOM 0 HA TYR A 51 8.369 7.407 -2.290 1.00 0.00 H new ATOM 0 HB2 TYR A 51 6.836 6.060 -4.532 1.00 0.00 H new ATOM 0 HB3 TYR A 51 6.638 5.838 -2.805 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.465 7.553 -1.448 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.835 7.977 -5.673 1.00 0.00 H new ATOM 0 HE1 TYR A 51 3.707 9.267 -1.429 1.00 0.00 H new ATOM 0 HE2 TYR A 51 4.083 9.697 -5.655 1.00 0.00 H new ATOM 0 HH TYR A 51 3.014 11.234 -4.199 1.00 0.00 H new ATOM 718 N VAL A 52 10.477 6.188 -3.059 1.00 0.00 N ATOM 719 CA VAL A 52 11.559 5.237 -3.288 1.00 0.00 C ATOM 720 C VAL A 52 11.612 4.190 -2.182 1.00 0.00 C ATOM 721 O VAL A 52 10.969 4.335 -1.143 1.00 0.00 O ATOM 722 CB VAL A 52 12.922 5.948 -3.374 1.00 0.00 C ATOM 723 CG1 VAL A 52 12.985 6.837 -4.607 1.00 0.00 C ATOM 724 CG2 VAL A 52 13.182 6.755 -2.111 1.00 0.00 C ATOM 0 H VAL A 52 10.702 6.931 -2.397 1.00 0.00 H new ATOM 0 HA VAL A 52 11.354 4.746 -4.239 1.00 0.00 H new ATOM 0 HB VAL A 52 13.702 5.191 -3.462 1.00 0.00 H new ATOM 0 HG11 VAL A 52 13.956 7.331 -4.650 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.847 6.229 -5.501 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.198 7.589 -4.554 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.150 7.251 -2.189 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.399 7.504 -1.990 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.184 6.089 -1.248 1.00 0.00 H new ATOM 734 N PHE A 53 12.385 3.133 -2.412 1.00 0.00 N ATOM 735 CA PHE A 53 12.523 2.060 -1.435 1.00 0.00 C ATOM 736 C PHE A 53 13.472 2.466 -0.311 1.00 0.00 C ATOM 737 O PHE A 53 14.662 2.681 -0.536 1.00 0.00 O ATOM 738 CB PHE A 53 13.034 0.787 -2.114 1.00 0.00 C ATOM 739 CG PHE A 53 11.937 -0.097 -2.634 1.00 0.00 C ATOM 740 CD1 PHE A 53 10.855 -0.425 -1.833 1.00 0.00 C ATOM 741 CD2 PHE A 53 11.987 -0.599 -3.925 1.00 0.00 C ATOM 742 CE1 PHE A 53 9.843 -1.238 -2.309 1.00 0.00 C ATOM 743 CE2 PHE A 53 10.978 -1.412 -4.406 1.00 0.00 C ATOM 744 CZ PHE A 53 9.906 -1.732 -3.597 1.00 0.00 C ATOM 0 H PHE A 53 12.925 2.997 -3.267 1.00 0.00 H new ATOM 0 HA PHE A 53 11.541 1.866 -1.005 1.00 0.00 H new ATOM 0 HB2 PHE A 53 13.689 1.063 -2.940 1.00 0.00 H new ATOM 0 HB3 PHE A 53 13.638 0.223 -1.403 1.00 0.00 H new ATOM 0 HD1 PHE A 53 10.802 -0.041 -0.825 1.00 0.00 H new ATOM 0 HD2 PHE A 53 12.823 -0.352 -4.562 1.00 0.00 H new ATOM 0 HE1 PHE A 53 9.005 -1.486 -1.675 1.00 0.00 H new ATOM 0 HE2 PHE A 53 11.028 -1.797 -5.414 1.00 0.00 H new ATOM 0 HZ PHE A 53 9.117 -2.368 -3.971 1.00 0.00 H new ATOM 754 N GLY A 54 12.934 2.570 0.901 1.00 0.00 N ATOM 755 CA GLY A 54 13.745 2.950 2.042 1.00 0.00 C ATOM 756 C GLY A 54 14.692 1.848 2.474 1.00 0.00 C ATOM 757 O GLY A 54 15.854 1.826 2.071 1.00 0.00 O ATOM 0 H GLY A 54 11.951 2.398 1.112 1.00 0.00 H new ATOM 0 HA2 GLY A 54 14.320 3.842 1.794 1.00 0.00 H new ATOM 0 HA3 GLY A 54 13.093 3.212 2.876 1.00 0.00 H new ATOM 761 N ALA A 55 14.194 0.932 3.298 1.00 0.00 N ATOM 762 CA ALA A 55 15.003 -0.178 3.785 1.00 0.00 C ATOM 763 C ALA A 55 14.469 -1.512 3.275 1.00 0.00 C ATOM 764 O ALA A 55 14.294 -2.456 4.044 1.00 0.00 O ATOM 765 CB ALA A 55 15.047 -0.172 5.306 1.00 0.00 C ATOM 0 H ALA A 55 13.234 0.937 3.642 1.00 0.00 H new ATOM 0 HA ALA A 55 16.016 -0.052 3.403 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.655 -1.007 5.656 1.00 0.00 H new ATOM 0 HB2 ALA A 55 15.483 0.765 5.654 1.00 0.00 H new ATOM 0 HB3 ALA A 55 14.035 -0.270 5.700 1.00 0.00 H new ATOM 771 N ALA A 56 14.213 -1.582 1.973 1.00 0.00 N ATOM 772 CA ALA A 56 13.700 -2.801 1.359 1.00 0.00 C ATOM 773 C ALA A 56 14.834 -3.762 1.017 1.00 0.00 C ATOM 774 O ALA A 56 15.892 -3.347 0.544 1.00 0.00 O ATOM 775 CB ALA A 56 12.894 -2.466 0.113 1.00 0.00 C ATOM 0 H ALA A 56 14.352 -0.809 1.323 1.00 0.00 H new ATOM 0 HA ALA A 56 13.046 -3.294 2.078 1.00 0.00 H new ATOM 0 HB1 ALA A 56 12.517 -3.386 -0.335 1.00 0.00 H new ATOM 0 HB2 ALA A 56 12.056 -1.824 0.384 1.00 0.00 H new ATOM 0 HB3 ALA A 56 13.531 -1.948 -0.604 1.00 0.00 H new ATOM 781 N THR A 57 14.606 -5.049 1.259 1.00 0.00 N ATOM 782 CA THR A 57 15.608 -6.068 0.978 1.00 0.00 C ATOM 783 C THR A 57 15.632 -6.423 -0.504 1.00 0.00 C ATOM 784 O THR A 57 14.786 -5.968 -1.273 1.00 0.00 O ATOM 785 CB THR A 57 15.353 -7.348 1.797 1.00 0.00 C ATOM 786 OG1 THR A 57 14.492 -8.231 1.069 1.00 0.00 O ATOM 787 CG2 THR A 57 14.725 -7.014 3.142 1.00 0.00 C ATOM 0 H THR A 57 13.735 -5.410 1.649 1.00 0.00 H new ATOM 0 HA THR A 57 16.573 -5.649 1.264 1.00 0.00 H new ATOM 0 HB THR A 57 16.311 -7.838 1.973 1.00 0.00 H new ATOM 0 HG1 THR A 57 14.336 -9.043 1.595 1.00 0.00 H new ATOM 0 HG21 THR A 57 14.554 -7.933 3.702 1.00 0.00 H new ATOM 0 HG22 THR A 57 15.395 -6.365 3.705 1.00 0.00 H new ATOM 0 HG23 THR A 57 13.775 -6.504 2.983 1.00 0.00 H new ATOM 795 N GLU A 58 16.605 -7.239 -0.898 1.00 0.00 N ATOM 796 CA GLU A 58 16.737 -7.654 -2.289 1.00 0.00 C ATOM 797 C GLU A 58 15.604 -8.596 -2.685 1.00 0.00 C ATOM 798 O GLU A 58 15.110 -8.551 -3.812 1.00 0.00 O ATOM 799 CB GLU A 58 18.087 -8.337 -2.515 1.00 0.00 C ATOM 800 CG GLU A 58 18.263 -9.616 -1.714 1.00 0.00 C ATOM 801 CD GLU A 58 19.473 -10.418 -2.153 1.00 0.00 C ATOM 802 OE1 GLU A 58 20.592 -10.101 -1.700 1.00 0.00 O ATOM 803 OE2 GLU A 58 19.299 -11.363 -2.951 1.00 0.00 O ATOM 0 H GLU A 58 17.313 -7.625 -0.273 1.00 0.00 H new ATOM 0 HA GLU A 58 16.681 -6.763 -2.914 1.00 0.00 H new ATOM 0 HB2 GLU A 58 18.197 -8.564 -3.575 1.00 0.00 H new ATOM 0 HB3 GLU A 58 18.885 -7.642 -2.254 1.00 0.00 H new ATOM 0 HG2 GLU A 58 18.360 -9.368 -0.657 1.00 0.00 H new ATOM 0 HG3 GLU A 58 17.368 -10.230 -1.816 1.00 0.00 H new ATOM 810 N SER A 59 15.199 -9.451 -1.751 1.00 0.00 N ATOM 811 CA SER A 59 14.128 -10.408 -2.003 1.00 0.00 C ATOM 812 C SER A 59 12.766 -9.721 -1.970 1.00 0.00 C ATOM 813 O SER A 59 11.734 -10.353 -2.191 1.00 0.00 O ATOM 814 CB SER A 59 14.169 -11.535 -0.969 1.00 0.00 C ATOM 815 OG SER A 59 15.215 -12.448 -1.251 1.00 0.00 O ATOM 0 H SER A 59 15.596 -9.500 -0.813 1.00 0.00 H new ATOM 0 HA SER A 59 14.278 -10.830 -2.997 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.308 -11.114 0.027 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.215 -12.061 -0.962 1.00 0.00 H new ATOM 0 HG SER A 59 15.221 -13.158 -0.575 1.00 0.00 H new ATOM 821 N VAL A 60 12.773 -8.421 -1.691 1.00 0.00 N ATOM 822 CA VAL A 60 11.540 -7.646 -1.629 1.00 0.00 C ATOM 823 C VAL A 60 11.411 -6.721 -2.834 1.00 0.00 C ATOM 824 O VAL A 60 10.309 -6.477 -3.327 1.00 0.00 O ATOM 825 CB VAL A 60 11.469 -6.805 -0.340 1.00 0.00 C ATOM 826 CG1 VAL A 60 10.359 -5.770 -0.438 1.00 0.00 C ATOM 827 CG2 VAL A 60 11.266 -7.703 0.871 1.00 0.00 C ATOM 0 H VAL A 60 13.619 -7.883 -1.504 1.00 0.00 H new ATOM 0 HA VAL A 60 10.717 -8.361 -1.633 1.00 0.00 H new ATOM 0 HB VAL A 60 12.415 -6.278 -0.218 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.324 -5.186 0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.553 -5.108 -1.282 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.404 -6.274 -0.584 1.00 0.00 H new ATOM 0 HG21 VAL A 60 11.218 -7.093 1.773 1.00 0.00 H new ATOM 0 HG22 VAL A 60 10.335 -8.259 0.760 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.099 -8.402 0.950 1.00 0.00 H new ATOM 837 N ARG A 61 12.544 -6.209 -3.304 1.00 0.00 N ATOM 838 CA ARG A 61 12.558 -5.310 -4.451 1.00 0.00 C ATOM 839 C ARG A 61 12.556 -6.097 -5.759 1.00 0.00 C ATOM 840 O ARG A 61 12.053 -5.625 -6.778 1.00 0.00 O ATOM 841 CB ARG A 61 13.783 -4.396 -4.395 1.00 0.00 C ATOM 842 CG ARG A 61 15.087 -5.105 -4.722 1.00 0.00 C ATOM 843 CD ARG A 61 16.264 -4.142 -4.703 1.00 0.00 C ATOM 844 NE ARG A 61 17.517 -4.802 -5.062 1.00 0.00 N ATOM 845 CZ ARG A 61 18.595 -4.152 -5.486 1.00 0.00 C ATOM 846 NH1 ARG A 61 18.573 -2.831 -5.603 1.00 0.00 N ATOM 847 NH2 ARG A 61 19.697 -4.823 -5.793 1.00 0.00 N ATOM 0 H ARG A 61 13.464 -6.402 -2.908 1.00 0.00 H new ATOM 0 HA ARG A 61 11.656 -4.699 -4.413 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.643 -3.571 -5.094 1.00 0.00 H new ATOM 0 HB3 ARG A 61 13.856 -3.961 -3.398 1.00 0.00 H new ATOM 0 HG2 ARG A 61 15.258 -5.905 -4.002 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.013 -5.571 -5.704 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.074 -3.323 -5.397 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.357 -3.703 -3.710 1.00 0.00 H new ATOM 0 HE ARG A 61 17.567 -5.818 -4.983 1.00 0.00 H new ATOM 0 HH11 ARG A 61 17.727 -2.312 -5.367 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.402 -2.334 -5.929 1.00 0.00 H new ATOM 0 HH21 ARG A 61 19.717 -5.839 -5.704 1.00 0.00 H new ATOM 0 HH22 ARG A 61 20.524 -4.323 -6.119 1.00 0.00 H new ATOM 861 N ARG A 62 13.123 -7.299 -5.721 1.00 0.00 N ATOM 862 CA ARG A 62 13.189 -8.150 -6.902 1.00 0.00 C ATOM 863 C ARG A 62 11.822 -8.751 -7.216 1.00 0.00 C ATOM 864 O ARG A 62 11.562 -9.175 -8.343 1.00 0.00 O ATOM 865 CB ARG A 62 14.214 -9.267 -6.696 1.00 0.00 C ATOM 866 CG ARG A 62 13.623 -10.533 -6.099 1.00 0.00 C ATOM 867 CD ARG A 62 14.671 -11.626 -5.962 1.00 0.00 C ATOM 868 NE ARG A 62 14.965 -12.266 -7.241 1.00 0.00 N ATOM 869 CZ ARG A 62 15.491 -13.481 -7.352 1.00 0.00 C ATOM 870 NH1 ARG A 62 15.779 -14.183 -6.265 1.00 0.00 N ATOM 871 NH2 ARG A 62 15.730 -13.996 -8.551 1.00 0.00 N ATOM 0 H ARG A 62 13.543 -7.705 -4.885 1.00 0.00 H new ATOM 0 HA ARG A 62 13.499 -7.534 -7.746 1.00 0.00 H new ATOM 0 HB2 ARG A 62 14.674 -9.508 -7.654 1.00 0.00 H new ATOM 0 HB3 ARG A 62 15.008 -8.904 -6.044 1.00 0.00 H new ATOM 0 HG2 ARG A 62 13.197 -10.311 -5.120 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.807 -10.887 -6.729 1.00 0.00 H new ATOM 0 HD2 ARG A 62 15.586 -11.201 -5.551 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.321 -12.377 -5.253 1.00 0.00 H new ATOM 0 HE ARG A 62 14.755 -11.752 -8.097 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.597 -13.791 -5.341 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.183 -15.116 -6.352 1.00 0.00 H new ATOM 0 HH21 ARG A 62 15.510 -13.459 -9.390 1.00 0.00 H new ATOM 0 HH22 ARG A 62 16.134 -14.929 -8.634 1.00 0.00 H new ATOM 885 N LEU A 63 10.952 -8.785 -6.213 1.00 0.00 N ATOM 886 CA LEU A 63 9.611 -9.335 -6.380 1.00 0.00 C ATOM 887 C LEU A 63 8.565 -8.225 -6.395 1.00 0.00 C ATOM 888 O LEU A 63 7.363 -8.491 -6.409 1.00 0.00 O ATOM 889 CB LEU A 63 9.302 -10.329 -5.259 1.00 0.00 C ATOM 890 CG LEU A 63 10.452 -11.244 -4.838 1.00 0.00 C ATOM 891 CD1 LEU A 63 10.035 -12.119 -3.666 1.00 0.00 C ATOM 892 CD2 LEU A 63 10.909 -12.101 -6.009 1.00 0.00 C ATOM 0 H LEU A 63 11.151 -8.438 -5.275 1.00 0.00 H new ATOM 0 HA LEU A 63 9.575 -9.855 -7.337 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.971 -9.769 -4.385 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.465 -10.952 -5.574 1.00 0.00 H new ATOM 0 HG LEU A 63 11.289 -10.621 -4.522 1.00 0.00 H new ATOM 0 HD11 LEU A 63 10.866 -12.764 -3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.758 -11.488 -2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.182 -12.733 -3.956 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.728 -12.746 -5.690 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.078 -12.715 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.249 -11.457 -6.820 1.00 0.00 H new ATOM 904 N LEU A 64 9.031 -6.981 -6.392 1.00 0.00 N ATOM 905 CA LEU A 64 8.136 -5.829 -6.407 1.00 0.00 C ATOM 906 C LEU A 64 8.811 -4.623 -7.053 1.00 0.00 C ATOM 907 O LEU A 64 9.999 -4.380 -6.846 1.00 0.00 O ATOM 908 CB LEU A 64 7.697 -5.481 -4.984 1.00 0.00 C ATOM 909 CG LEU A 64 7.360 -6.665 -4.077 1.00 0.00 C ATOM 910 CD1 LEU A 64 7.426 -6.252 -2.614 1.00 0.00 C ATOM 911 CD2 LEU A 64 5.984 -7.220 -4.414 1.00 0.00 C ATOM 0 H LEU A 64 10.023 -6.744 -6.379 1.00 0.00 H new ATOM 0 HA LEU A 64 7.258 -6.090 -6.998 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.491 -4.902 -4.512 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.822 -4.834 -5.043 1.00 0.00 H new ATOM 0 HG LEU A 64 8.098 -7.449 -4.246 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.183 -7.107 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.431 -5.902 -2.380 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.711 -5.451 -2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.761 -8.062 -3.759 1.00 0.00 H new ATOM 0 HD22 LEU A 64 5.234 -6.442 -4.274 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.971 -7.554 -5.451 1.00 0.00 H new ATOM 923 N ARG A 65 8.043 -3.870 -7.834 1.00 0.00 N ATOM 924 CA ARG A 65 8.567 -2.689 -8.509 1.00 0.00 C ATOM 925 C ARG A 65 7.815 -1.435 -8.073 1.00 0.00 C ATOM 926 O ARG A 65 6.671 -1.213 -8.474 1.00 0.00 O ATOM 927 CB ARG A 65 8.465 -2.855 -10.027 1.00 0.00 C ATOM 928 CG ARG A 65 8.656 -1.558 -10.796 1.00 0.00 C ATOM 929 CD ARG A 65 9.274 -1.807 -12.163 1.00 0.00 C ATOM 930 NE ARG A 65 8.260 -2.030 -13.190 1.00 0.00 N ATOM 931 CZ ARG A 65 8.520 -2.028 -14.492 1.00 0.00 C ATOM 932 NH1 ARG A 65 9.756 -1.817 -14.924 1.00 0.00 N ATOM 933 NH2 ARG A 65 7.544 -2.239 -15.366 1.00 0.00 N ATOM 0 H ARG A 65 7.057 -4.057 -8.015 1.00 0.00 H new ATOM 0 HA ARG A 65 9.615 -2.579 -8.232 1.00 0.00 H new ATOM 0 HB2 ARG A 65 9.213 -3.576 -10.356 1.00 0.00 H new ATOM 0 HB3 ARG A 65 7.489 -3.273 -10.273 1.00 0.00 H new ATOM 0 HG2 ARG A 65 7.694 -1.060 -10.916 1.00 0.00 H new ATOM 0 HG3 ARG A 65 9.295 -0.885 -10.224 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.891 -0.953 -12.443 1.00 0.00 H new ATOM 0 HD3 ARG A 65 9.933 -2.673 -12.110 1.00 0.00 H new ATOM 0 HE ARG A 65 7.299 -2.196 -12.891 1.00 0.00 H new ATOM 0 HH11 ARG A 65 10.509 -1.656 -14.256 1.00 0.00 H new ATOM 0 HH12 ARG A 65 9.953 -1.816 -15.925 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.592 -2.403 -15.038 1.00 0.00 H new ATOM 0 HH22 ARG A 65 7.746 -2.237 -16.366 1.00 0.00 H new ATOM 947 N LEU A 66 8.463 -0.619 -7.249 1.00 0.00 N ATOM 948 CA LEU A 66 7.856 0.613 -6.757 1.00 0.00 C ATOM 949 C LEU A 66 8.151 1.778 -7.696 1.00 0.00 C ATOM 950 O LEU A 66 9.203 1.823 -8.334 1.00 0.00 O ATOM 951 CB LEU A 66 8.369 0.932 -5.352 1.00 0.00 C ATOM 952 CG LEU A 66 8.022 2.318 -4.809 1.00 0.00 C ATOM 953 CD1 LEU A 66 6.517 2.466 -4.647 1.00 0.00 C ATOM 954 CD2 LEU A 66 8.729 2.566 -3.485 1.00 0.00 C ATOM 0 H LEU A 66 9.409 -0.788 -6.907 1.00 0.00 H new ATOM 0 HA LEU A 66 6.777 0.467 -6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.973 0.185 -4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.454 0.824 -5.350 1.00 0.00 H new ATOM 0 HG LEU A 66 8.365 3.064 -5.526 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.289 3.459 -4.259 1.00 0.00 H new ATOM 0 HD12 LEU A 66 6.032 2.334 -5.614 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.150 1.712 -3.951 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.470 3.558 -3.114 1.00 0.00 H new ATOM 0 HD22 LEU A 66 8.417 1.814 -2.760 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.807 2.504 -3.631 1.00 0.00 H new ATOM 966 N ASP A 67 7.218 2.720 -7.773 1.00 0.00 N ATOM 967 CA ASP A 67 7.379 3.888 -8.631 1.00 0.00 C ATOM 968 C ASP A 67 7.549 5.155 -7.798 1.00 0.00 C ATOM 969 O ASP A 67 6.991 5.271 -6.707 1.00 0.00 O ATOM 970 CB ASP A 67 6.176 4.033 -9.563 1.00 0.00 C ATOM 971 CG ASP A 67 6.311 3.195 -10.819 1.00 0.00 C ATOM 972 OD1 ASP A 67 6.951 3.668 -11.782 1.00 0.00 O ATOM 973 OD2 ASP A 67 5.778 2.066 -10.839 1.00 0.00 O ATOM 0 H ASP A 67 6.342 2.698 -7.251 1.00 0.00 H new ATOM 0 HA ASP A 67 8.278 3.746 -9.231 1.00 0.00 H new ATOM 0 HB2 ASP A 67 5.271 3.741 -9.031 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.059 5.081 -9.840 1.00 0.00 H new ATOM 978 N GLU A 68 8.324 6.101 -8.319 1.00 0.00 N ATOM 979 CA GLU A 68 8.568 7.358 -7.622 1.00 0.00 C ATOM 980 C GLU A 68 7.926 8.526 -8.365 1.00 0.00 C ATOM 981 O GLU A 68 7.556 9.534 -7.762 1.00 0.00 O ATOM 982 CB GLU A 68 10.071 7.599 -7.471 1.00 0.00 C ATOM 983 CG GLU A 68 10.692 8.329 -8.651 1.00 0.00 C ATOM 984 CD GLU A 68 10.575 7.549 -9.946 1.00 0.00 C ATOM 985 OE1 GLU A 68 10.734 6.311 -9.911 1.00 0.00 O ATOM 986 OE2 GLU A 68 10.323 8.178 -10.995 1.00 0.00 O ATOM 0 H GLU A 68 8.793 6.021 -9.221 1.00 0.00 H new ATOM 0 HA GLU A 68 8.117 7.289 -6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 68 10.249 8.176 -6.563 1.00 0.00 H new ATOM 0 HB3 GLU A 68 10.573 6.640 -7.343 1.00 0.00 H new ATOM 0 HG2 GLU A 68 10.207 9.298 -8.770 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.744 8.522 -8.441 1.00 0.00 H new ATOM 993 N THR A 69 7.798 8.384 -9.681 1.00 0.00 N ATOM 994 CA THR A 69 7.203 9.426 -10.508 1.00 0.00 C ATOM 995 C THR A 69 5.692 9.483 -10.318 1.00 0.00 C ATOM 996 O THR A 69 5.073 10.532 -10.499 1.00 0.00 O ATOM 997 CB THR A 69 7.514 9.205 -12.000 1.00 0.00 C ATOM 998 OG1 THR A 69 6.911 10.239 -12.785 1.00 0.00 O ATOM 999 CG2 THR A 69 7.005 7.848 -12.463 1.00 0.00 C ATOM 0 H THR A 69 8.099 7.557 -10.197 1.00 0.00 H new ATOM 0 HA THR A 69 7.642 10.371 -10.189 1.00 0.00 H new ATOM 0 HB THR A 69 8.596 9.234 -12.131 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.115 10.092 -13.732 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.236 7.714 -13.520 1.00 0.00 H new ATOM 0 HG22 THR A 69 7.488 7.061 -11.883 1.00 0.00 H new ATOM 0 HG23 THR A 69 5.926 7.795 -12.318 1.00 0.00 H new ATOM 1007 N SER A 70 5.103 8.350 -9.952 1.00 0.00 N ATOM 1008 CA SER A 70 3.662 8.271 -9.740 1.00 0.00 C ATOM 1009 C SER A 70 3.346 7.885 -8.298 1.00 0.00 C ATOM 1010 O SER A 70 2.483 8.485 -7.658 1.00 0.00 O ATOM 1011 CB SER A 70 3.040 7.255 -10.700 1.00 0.00 C ATOM 1012 OG SER A 70 3.543 5.952 -10.461 1.00 0.00 O ATOM 0 H SER A 70 5.601 7.474 -9.796 1.00 0.00 H new ATOM 0 HA SER A 70 3.235 9.255 -9.936 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.956 7.257 -10.584 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.251 7.546 -11.729 1.00 0.00 H new ATOM 0 HG SER A 70 3.128 5.322 -11.086 1.00 0.00 H new ATOM 1018 N GLY A 71 4.051 6.878 -7.793 1.00 0.00 N ATOM 1019 CA GLY A 71 3.831 6.428 -6.430 1.00 0.00 C ATOM 1020 C GLY A 71 2.990 5.169 -6.364 1.00 0.00 C ATOM 1021 O GLY A 71 2.245 4.962 -5.405 1.00 0.00 O ATOM 0 H GLY A 71 4.771 6.365 -8.303 1.00 0.00 H new ATOM 0 HA2 GLY A 71 4.793 6.244 -5.952 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.340 7.220 -5.864 1.00 0.00 H new ATOM 1025 N TRP A 72 3.106 4.327 -7.384 1.00 0.00 N ATOM 1026 CA TRP A 72 2.348 3.083 -7.439 1.00 0.00 C ATOM 1027 C TRP A 72 3.219 1.897 -7.038 1.00 0.00 C ATOM 1028 O TRP A 72 4.447 1.968 -7.098 1.00 0.00 O ATOM 1029 CB TRP A 72 1.784 2.865 -8.844 1.00 0.00 C ATOM 1030 CG TRP A 72 0.414 3.443 -9.030 1.00 0.00 C ATOM 1031 CD1 TRP A 72 0.104 4.666 -9.553 1.00 0.00 C ATOM 1032 CD2 TRP A 72 -0.831 2.821 -8.692 1.00 0.00 C ATOM 1033 NE1 TRP A 72 -1.259 4.842 -9.561 1.00 0.00 N ATOM 1034 CE2 TRP A 72 -1.855 3.724 -9.039 1.00 0.00 C ATOM 1035 CE3 TRP A 72 -1.180 1.589 -8.133 1.00 0.00 C ATOM 1036 CZ2 TRP A 72 -3.202 3.433 -8.842 1.00 0.00 C ATOM 1037 CZ3 TRP A 72 -2.518 1.301 -7.939 1.00 0.00 C ATOM 1038 CH2 TRP A 72 -3.516 2.219 -8.293 1.00 0.00 C ATOM 0 H TRP A 72 3.718 4.483 -8.185 1.00 0.00 H new ATOM 0 HA TRP A 72 1.522 3.159 -6.732 1.00 0.00 H new ATOM 0 HB2 TRP A 72 2.461 3.311 -9.573 1.00 0.00 H new ATOM 0 HB3 TRP A 72 1.751 1.796 -9.053 1.00 0.00 H new ATOM 0 HD1 TRP A 72 0.824 5.388 -9.908 1.00 0.00 H new ATOM 0 HE1 TRP A 72 -1.748 5.670 -9.900 1.00 0.00 H new ATOM 0 HE3 TRP A 72 -0.418 0.875 -7.857 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 -3.972 4.140 -9.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 -2.799 0.352 -7.507 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -4.553 1.964 -8.130 1.00 0.00 H new ATOM 1049 N LEU A 73 2.577 0.808 -6.629 1.00 0.00 N ATOM 1050 CA LEU A 73 3.294 -0.394 -6.218 1.00 0.00 C ATOM 1051 C LEU A 73 2.696 -1.635 -6.875 1.00 0.00 C ATOM 1052 O LEU A 73 1.478 -1.805 -6.911 1.00 0.00 O ATOM 1053 CB LEU A 73 3.255 -0.540 -4.696 1.00 0.00 C ATOM 1054 CG LEU A 73 4.244 -1.537 -4.092 1.00 0.00 C ATOM 1055 CD1 LEU A 73 5.587 -0.871 -3.837 1.00 0.00 C ATOM 1056 CD2 LEU A 73 3.686 -2.128 -2.805 1.00 0.00 C ATOM 0 H LEU A 73 1.561 0.733 -6.573 1.00 0.00 H new ATOM 0 HA LEU A 73 4.331 -0.298 -6.541 1.00 0.00 H new ATOM 0 HB2 LEU A 73 3.440 0.438 -4.252 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.247 -0.837 -4.405 1.00 0.00 H new ATOM 0 HG LEU A 73 4.394 -2.347 -4.805 1.00 0.00 H new ATOM 0 HD11 LEU A 73 6.277 -1.597 -3.407 1.00 0.00 H new ATOM 0 HD12 LEU A 73 5.992 -0.498 -4.777 1.00 0.00 H new ATOM 0 HD13 LEU A 73 5.455 -0.040 -3.143 1.00 0.00 H new ATOM 0 HD21 LEU A 73 4.403 -2.836 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 73 3.505 -1.329 -2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 73 2.749 -2.643 -3.017 1.00 0.00 H new ATOM 1068 N SER A 74 3.563 -2.500 -7.390 1.00 0.00 N ATOM 1069 CA SER A 74 3.122 -3.725 -8.047 1.00 0.00 C ATOM 1070 C SER A 74 4.220 -4.784 -8.016 1.00 0.00 C ATOM 1071 O SER A 74 5.363 -4.499 -7.659 1.00 0.00 O ATOM 1072 CB SER A 74 2.717 -3.437 -9.493 1.00 0.00 C ATOM 1073 OG SER A 74 3.856 -3.226 -10.310 1.00 0.00 O ATOM 0 H SER A 74 4.575 -2.376 -7.365 1.00 0.00 H new ATOM 0 HA SER A 74 2.257 -4.107 -7.505 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.135 -4.272 -9.884 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.074 -2.557 -9.526 1.00 0.00 H new ATOM 0 HG SER A 74 3.570 -3.046 -11.230 1.00 0.00 H new ATOM 1079 N VAL A 75 3.864 -6.008 -8.393 1.00 0.00 N ATOM 1080 CA VAL A 75 4.817 -7.111 -8.410 1.00 0.00 C ATOM 1081 C VAL A 75 5.743 -7.018 -9.618 1.00 0.00 C ATOM 1082 O VAL A 75 5.333 -6.588 -10.697 1.00 0.00 O ATOM 1083 CB VAL A 75 4.100 -8.474 -8.430 1.00 0.00 C ATOM 1084 CG1 VAL A 75 5.108 -9.607 -8.545 1.00 0.00 C ATOM 1085 CG2 VAL A 75 3.237 -8.640 -7.189 1.00 0.00 C ATOM 0 H VAL A 75 2.922 -6.261 -8.691 1.00 0.00 H new ATOM 0 HA VAL A 75 5.406 -7.033 -7.496 1.00 0.00 H new ATOM 0 HB VAL A 75 3.450 -8.510 -9.304 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.582 -10.562 -8.558 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.678 -9.495 -9.467 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.787 -9.578 -7.693 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.738 -9.609 -7.220 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.864 -8.583 -6.299 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.489 -7.847 -7.157 1.00 0.00 H new ATOM 1095 N LEU A 76 6.994 -7.424 -9.430 1.00 0.00 N ATOM 1096 CA LEU A 76 7.980 -7.388 -10.505 1.00 0.00 C ATOM 1097 C LEU A 76 8.300 -8.795 -10.998 1.00 0.00 C ATOM 1098 O LEU A 76 8.502 -9.014 -12.193 1.00 0.00 O ATOM 1099 CB LEU A 76 9.259 -6.699 -10.027 1.00 0.00 C ATOM 1100 CG LEU A 76 10.393 -6.605 -11.049 1.00 0.00 C ATOM 1101 CD1 LEU A 76 9.997 -5.699 -12.204 1.00 0.00 C ATOM 1102 CD2 LEU A 76 11.667 -6.102 -10.386 1.00 0.00 C ATOM 0 H LEU A 76 7.350 -7.782 -8.544 1.00 0.00 H new ATOM 0 HA LEU A 76 7.557 -6.821 -11.334 1.00 0.00 H new ATOM 0 HB2 LEU A 76 9.005 -5.690 -9.702 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.629 -7.232 -9.151 1.00 0.00 H new ATOM 0 HG LEU A 76 10.583 -7.602 -11.446 1.00 0.00 H new ATOM 0 HD11 LEU A 76 10.816 -5.644 -12.921 1.00 0.00 H new ATOM 0 HD12 LEU A 76 9.111 -6.102 -12.695 1.00 0.00 H new ATOM 0 HD13 LEU A 76 9.779 -4.700 -11.825 1.00 0.00 H new ATOM 0 HD21 LEU A 76 12.464 -6.041 -11.128 1.00 0.00 H new ATOM 0 HD22 LEU A 76 11.490 -5.114 -9.961 1.00 0.00 H new ATOM 0 HD23 LEU A 76 11.961 -6.790 -9.594 1.00 0.00 H new ATOM 1114 N HIS A 77 8.342 -9.746 -10.070 1.00 0.00 N ATOM 1115 CA HIS A 77 8.635 -11.134 -10.411 1.00 0.00 C ATOM 1116 C HIS A 77 7.763 -12.088 -9.601 1.00 0.00 C ATOM 1117 O HIS A 77 7.252 -11.728 -8.540 1.00 0.00 O ATOM 1118 CB HIS A 77 10.112 -11.441 -10.165 1.00 0.00 C ATOM 1119 CG HIS A 77 10.997 -11.093 -11.322 1.00 0.00 C ATOM 1120 ND1 HIS A 77 10.721 -11.466 -12.620 1.00 0.00 N ATOM 1121 CD2 HIS A 77 12.159 -10.400 -11.370 1.00 0.00 C ATOM 1122 CE1 HIS A 77 11.675 -11.019 -13.417 1.00 0.00 C ATOM 1123 NE2 HIS A 77 12.560 -10.368 -12.683 1.00 0.00 N ATOM 0 H HIS A 77 8.177 -9.581 -9.077 1.00 0.00 H new ATOM 0 HA HIS A 77 8.414 -11.277 -11.469 1.00 0.00 H new ATOM 0 HB2 HIS A 77 10.447 -10.893 -9.284 1.00 0.00 H new ATOM 0 HB3 HIS A 77 10.222 -12.502 -9.941 1.00 0.00 H new ATOM 0 HD2 HIS A 77 12.675 -9.955 -10.532 1.00 0.00 H new ATOM 0 HE1 HIS A 77 11.723 -11.161 -14.486 1.00 0.00 H new ATOM 0 HE2 HIS A 77 13.404 -9.915 -13.034 1.00 0.00 H new ATOM 1132 N ARG A 78 7.595 -13.305 -10.109 1.00 0.00 N ATOM 1133 CA ARG A 78 6.783 -14.309 -9.433 1.00 0.00 C ATOM 1134 C ARG A 78 7.184 -14.436 -7.966 1.00 0.00 C ATOM 1135 O ARG A 78 8.338 -14.201 -7.606 1.00 0.00 O ATOM 1136 CB ARG A 78 6.925 -15.664 -10.130 1.00 0.00 C ATOM 1137 CG ARG A 78 6.421 -15.666 -11.564 1.00 0.00 C ATOM 1138 CD ARG A 78 7.028 -16.807 -12.366 1.00 0.00 C ATOM 1139 NE ARG A 78 8.485 -16.717 -12.428 1.00 0.00 N ATOM 1140 CZ ARG A 78 9.277 -17.762 -12.640 1.00 0.00 C ATOM 1141 NH1 ARG A 78 8.756 -18.970 -12.810 1.00 0.00 N ATOM 1142 NH2 ARG A 78 10.593 -17.601 -12.682 1.00 0.00 N ATOM 0 H ARG A 78 8.010 -13.619 -10.986 1.00 0.00 H new ATOM 0 HA ARG A 78 5.742 -13.990 -9.481 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.974 -15.959 -10.122 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.378 -16.415 -9.560 1.00 0.00 H new ATOM 0 HG2 ARG A 78 5.335 -15.754 -11.569 1.00 0.00 H new ATOM 0 HG3 ARG A 78 6.666 -14.716 -12.038 1.00 0.00 H new ATOM 0 HD2 ARG A 78 6.742 -17.758 -11.917 1.00 0.00 H new ATOM 0 HD3 ARG A 78 6.621 -16.797 -13.377 1.00 0.00 H new ATOM 0 HE ARG A 78 8.917 -15.802 -12.302 1.00 0.00 H new ATOM 0 HH11 ARG A 78 7.745 -19.098 -12.778 1.00 0.00 H new ATOM 0 HH12 ARG A 78 9.367 -19.771 -12.973 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.998 -16.674 -12.551 1.00 0.00 H new ATOM 0 HH22 ARG A 78 11.200 -18.404 -12.845 1.00 0.00 H new ATOM 1156 N ILE A 79 6.224 -14.807 -7.126 1.00 0.00 N ATOM 1157 CA ILE A 79 6.477 -14.965 -5.699 1.00 0.00 C ATOM 1158 C ILE A 79 5.960 -16.308 -5.194 1.00 0.00 C ATOM 1159 O ILE A 79 5.020 -16.873 -5.753 1.00 0.00 O ATOM 1160 CB ILE A 79 5.822 -13.836 -4.883 1.00 0.00 C ATOM 1161 CG1 ILE A 79 6.444 -12.486 -5.248 1.00 0.00 C ATOM 1162 CG2 ILE A 79 5.967 -14.107 -3.393 1.00 0.00 C ATOM 1163 CD1 ILE A 79 5.565 -11.304 -4.905 1.00 0.00 C ATOM 0 H ILE A 79 5.264 -15.004 -7.409 1.00 0.00 H new ATOM 0 HA ILE A 79 7.558 -14.920 -5.564 1.00 0.00 H new ATOM 0 HB ILE A 79 4.760 -13.802 -5.125 1.00 0.00 H new ATOM 0 HG12 ILE A 79 7.397 -12.382 -4.730 1.00 0.00 H new ATOM 0 HG13 ILE A 79 6.659 -12.471 -6.317 1.00 0.00 H new ATOM 0 HG21 ILE A 79 5.499 -13.300 -2.829 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.482 -15.051 -3.146 1.00 0.00 H new ATOM 0 HG23 ILE A 79 7.024 -14.164 -3.135 1.00 0.00 H new ATOM 0 HD11 ILE A 79 6.069 -10.381 -5.191 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.621 -11.384 -5.444 1.00 0.00 H new ATOM 0 HD13 ILE A 79 5.371 -11.294 -3.832 1.00 0.00 H new ATOM 1175 N ASP A 80 6.580 -16.813 -4.134 1.00 0.00 N ATOM 1176 CA ASP A 80 6.181 -18.089 -3.551 1.00 0.00 C ATOM 1177 C ASP A 80 6.010 -17.966 -2.040 1.00 0.00 C ATOM 1178 O ASP A 80 6.925 -17.540 -1.334 1.00 0.00 O ATOM 1179 CB ASP A 80 7.216 -19.168 -3.873 1.00 0.00 C ATOM 1180 CG ASP A 80 6.610 -20.556 -3.922 1.00 0.00 C ATOM 1181 OD1 ASP A 80 5.529 -20.710 -4.528 1.00 0.00 O ATOM 1182 OD2 ASP A 80 7.215 -21.489 -3.353 1.00 0.00 O ATOM 0 H ASP A 80 7.361 -16.359 -3.661 1.00 0.00 H new ATOM 0 HA ASP A 80 5.223 -18.375 -3.985 1.00 0.00 H new ATOM 0 HB2 ASP A 80 7.683 -18.945 -4.832 1.00 0.00 H new ATOM 0 HB3 ASP A 80 8.005 -19.146 -3.122 1.00 0.00 H new ATOM 1187 N ARG A 81 4.833 -18.341 -1.550 1.00 0.00 N ATOM 1188 CA ARG A 81 4.541 -18.271 -0.124 1.00 0.00 C ATOM 1189 C ARG A 81 5.497 -19.156 0.671 1.00 0.00 C ATOM 1190 O ARG A 81 5.806 -18.870 1.827 1.00 0.00 O ATOM 1191 CB ARG A 81 3.096 -18.693 0.145 1.00 0.00 C ATOM 1192 CG ARG A 81 2.680 -18.552 1.600 1.00 0.00 C ATOM 1193 CD ARG A 81 2.991 -19.812 2.393 1.00 0.00 C ATOM 1194 NE ARG A 81 1.917 -20.796 2.300 1.00 0.00 N ATOM 1195 CZ ARG A 81 0.764 -20.691 2.953 1.00 0.00 C ATOM 1196 NH1 ARG A 81 0.538 -19.649 3.741 1.00 0.00 N ATOM 1197 NH2 ARG A 81 -0.165 -21.628 2.817 1.00 0.00 N ATOM 0 H ARG A 81 4.066 -18.697 -2.120 1.00 0.00 H new ATOM 0 HA ARG A 81 4.676 -17.238 0.198 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.430 -18.092 -0.474 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.967 -19.731 -0.162 1.00 0.00 H new ATOM 0 HG2 ARG A 81 3.197 -17.703 2.047 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.612 -18.340 1.655 1.00 0.00 H new ATOM 0 HD2 ARG A 81 3.918 -20.252 2.026 1.00 0.00 H new ATOM 0 HD3 ARG A 81 3.154 -19.551 3.439 1.00 0.00 H new ATOM 0 HE ARG A 81 2.059 -21.609 1.701 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.250 -18.926 3.847 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -0.347 -19.570 4.241 1.00 0.00 H new ATOM 0 HH21 ARG A 81 0.005 -22.430 2.211 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -1.049 -21.546 3.319 1.00 0.00 H new ATOM 1211 N GLU A 82 5.960 -20.232 0.042 1.00 0.00 N ATOM 1212 CA GLU A 82 6.879 -21.159 0.692 1.00 0.00 C ATOM 1213 C GLU A 82 8.160 -20.447 1.118 1.00 0.00 C ATOM 1214 O GLU A 82 8.483 -20.386 2.303 1.00 0.00 O ATOM 1215 CB GLU A 82 7.216 -22.320 -0.246 1.00 0.00 C ATOM 1216 CG GLU A 82 7.599 -23.598 0.480 1.00 0.00 C ATOM 1217 CD GLU A 82 8.505 -24.490 -0.347 1.00 0.00 C ATOM 1218 OE1 GLU A 82 9.338 -23.951 -1.104 1.00 0.00 O ATOM 1219 OE2 GLU A 82 8.379 -25.728 -0.236 1.00 0.00 O ATOM 0 H GLU A 82 5.714 -20.483 -0.916 1.00 0.00 H new ATOM 0 HA GLU A 82 6.388 -21.551 1.583 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.357 -22.520 -0.886 1.00 0.00 H new ATOM 0 HB3 GLU A 82 8.037 -22.023 -0.898 1.00 0.00 H new ATOM 0 HG2 GLU A 82 8.100 -23.344 1.414 1.00 0.00 H new ATOM 0 HG3 GLU A 82 6.695 -24.148 0.742 1.00 0.00 H new ATOM 1226 N GLU A 83 8.884 -19.910 0.141 1.00 0.00 N ATOM 1227 CA GLU A 83 10.130 -19.204 0.414 1.00 0.00 C ATOM 1228 C GLU A 83 9.905 -18.070 1.410 1.00 0.00 C ATOM 1229 O GLU A 83 10.768 -17.773 2.236 1.00 0.00 O ATOM 1230 CB GLU A 83 10.723 -18.648 -0.883 1.00 0.00 C ATOM 1231 CG GLU A 83 10.122 -17.319 -1.306 1.00 0.00 C ATOM 1232 CD GLU A 83 10.887 -16.668 -2.442 1.00 0.00 C ATOM 1233 OE1 GLU A 83 12.011 -16.181 -2.198 1.00 0.00 O ATOM 1234 OE2 GLU A 83 10.362 -16.645 -3.574 1.00 0.00 O ATOM 0 H GLU A 83 8.629 -19.950 -0.846 1.00 0.00 H new ATOM 0 HA GLU A 83 10.832 -19.915 0.850 1.00 0.00 H new ATOM 0 HB2 GLU A 83 11.799 -18.527 -0.758 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.574 -19.375 -1.681 1.00 0.00 H new ATOM 0 HG2 GLU A 83 9.087 -17.473 -1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 83 10.105 -16.644 -0.451 1.00 0.00 H new ATOM 1241 N VAL A 84 8.739 -17.438 1.325 1.00 0.00 N ATOM 1242 CA VAL A 84 8.399 -16.336 2.218 1.00 0.00 C ATOM 1243 C VAL A 84 6.916 -16.354 2.571 1.00 0.00 C ATOM 1244 O VAL A 84 6.060 -16.478 1.697 1.00 0.00 O ATOM 1245 CB VAL A 84 8.749 -14.975 1.588 1.00 0.00 C ATOM 1246 CG1 VAL A 84 10.256 -14.766 1.573 1.00 0.00 C ATOM 1247 CG2 VAL A 84 8.174 -14.874 0.184 1.00 0.00 C ATOM 0 H VAL A 84 8.013 -17.670 0.647 1.00 0.00 H new ATOM 0 HA VAL A 84 8.988 -16.470 3.126 1.00 0.00 H new ATOM 0 HB VAL A 84 8.303 -14.187 2.195 1.00 0.00 H new ATOM 0 HG11 VAL A 84 10.485 -13.799 1.124 1.00 0.00 H new ATOM 0 HG12 VAL A 84 10.637 -14.792 2.594 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.727 -15.557 0.990 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.431 -13.906 -0.246 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.588 -15.668 -0.437 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.090 -14.975 0.227 1.00 0.00 H new ATOM 1257 N ASN A 85 6.620 -16.228 3.861 1.00 0.00 N ATOM 1258 CA ASN A 85 5.239 -16.229 4.331 1.00 0.00 C ATOM 1259 C ASN A 85 4.746 -14.806 4.573 1.00 0.00 C ATOM 1260 O ASN A 85 3.542 -14.557 4.625 1.00 0.00 O ATOM 1261 CB ASN A 85 5.118 -17.048 5.618 1.00 0.00 C ATOM 1262 CG ASN A 85 5.358 -16.212 6.860 1.00 0.00 C ATOM 1263 OD1 ASN A 85 4.489 -15.451 7.288 1.00 0.00 O ATOM 1264 ND2 ASN A 85 6.541 -16.350 7.447 1.00 0.00 N ATOM 0 H ASN A 85 7.317 -16.124 4.599 1.00 0.00 H new ATOM 0 HA ASN A 85 4.618 -16.683 3.559 1.00 0.00 H new ATOM 0 HB2 ASN A 85 4.125 -17.494 5.670 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.835 -17.869 5.592 1.00 0.00 H new ATOM 0 HD21 ASN A 85 6.759 -15.814 8.287 1.00 0.00 H new ATOM 0 HD22 ASN A 85 7.231 -16.992 7.058 1.00 0.00 H new ATOM 1271 N GLN A 86 5.685 -13.876 4.719 1.00 0.00 N ATOM 1272 CA GLN A 86 5.345 -12.478 4.955 1.00 0.00 C ATOM 1273 C GLN A 86 6.454 -11.557 4.457 1.00 0.00 C ATOM 1274 O GLN A 86 7.638 -11.821 4.671 1.00 0.00 O ATOM 1275 CB GLN A 86 5.096 -12.237 6.445 1.00 0.00 C ATOM 1276 CG GLN A 86 4.320 -10.961 6.733 1.00 0.00 C ATOM 1277 CD GLN A 86 3.652 -10.979 8.094 1.00 0.00 C ATOM 1278 OE1 GLN A 86 4.124 -11.638 9.021 1.00 0.00 O ATOM 1279 NE2 GLN A 86 2.548 -10.253 8.221 1.00 0.00 N ATOM 0 H GLN A 86 6.686 -14.066 4.678 1.00 0.00 H new ATOM 0 HA GLN A 86 4.434 -12.252 4.400 1.00 0.00 H new ATOM 0 HB2 GLN A 86 4.549 -13.086 6.856 1.00 0.00 H new ATOM 0 HB3 GLN A 86 6.054 -12.195 6.963 1.00 0.00 H new ATOM 0 HG2 GLN A 86 4.996 -10.108 6.676 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.562 -10.819 5.962 1.00 0.00 H new ATOM 0 HE21 GLN A 86 2.192 -9.722 7.426 1.00 0.00 H new ATOM 0 HE22 GLN A 86 2.055 -10.226 9.114 1.00 0.00 H new ATOM 1288 N LEU A 87 6.063 -10.476 3.792 1.00 0.00 N ATOM 1289 CA LEU A 87 7.024 -9.514 3.262 1.00 0.00 C ATOM 1290 C LEU A 87 6.872 -8.159 3.946 1.00 0.00 C ATOM 1291 O LEU A 87 5.795 -7.563 3.932 1.00 0.00 O ATOM 1292 CB LEU A 87 6.841 -9.359 1.752 1.00 0.00 C ATOM 1293 CG LEU A 87 7.094 -10.612 0.913 1.00 0.00 C ATOM 1294 CD1 LEU A 87 6.504 -10.451 -0.480 1.00 0.00 C ATOM 1295 CD2 LEU A 87 8.584 -10.908 0.831 1.00 0.00 C ATOM 0 H LEU A 87 5.087 -10.243 3.607 1.00 0.00 H new ATOM 0 HA LEU A 87 8.027 -9.891 3.463 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.823 -9.019 1.563 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.510 -8.572 1.404 1.00 0.00 H new ATOM 0 HG LEU A 87 6.602 -11.455 1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 87 6.694 -11.353 -1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.429 -10.289 -0.403 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.966 -9.596 -0.974 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.745 -11.803 0.230 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.098 -10.064 0.370 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.979 -11.069 1.834 1.00 0.00 H new ATOM 1307 N ARG A 88 7.958 -7.678 4.543 1.00 0.00 N ATOM 1308 CA ARG A 88 7.945 -6.393 5.231 1.00 0.00 C ATOM 1309 C ARG A 88 9.079 -5.500 4.735 1.00 0.00 C ATOM 1310 O ARG A 88 10.216 -5.948 4.583 1.00 0.00 O ATOM 1311 CB ARG A 88 8.067 -6.599 6.742 1.00 0.00 C ATOM 1312 CG ARG A 88 6.728 -6.702 7.452 1.00 0.00 C ATOM 1313 CD ARG A 88 6.887 -7.240 8.866 1.00 0.00 C ATOM 1314 NE ARG A 88 7.052 -8.691 8.885 1.00 0.00 N ATOM 1315 CZ ARG A 88 8.233 -9.297 8.850 1.00 0.00 C ATOM 1316 NH1 ARG A 88 9.348 -8.581 8.795 1.00 0.00 N ATOM 1317 NH2 ARG A 88 8.302 -10.622 8.870 1.00 0.00 N ATOM 0 H ARG A 88 8.857 -8.159 4.564 1.00 0.00 H new ATOM 0 HA ARG A 88 6.997 -5.901 5.014 1.00 0.00 H new ATOM 0 HB2 ARG A 88 8.640 -7.507 6.931 1.00 0.00 H new ATOM 0 HB3 ARG A 88 8.632 -5.770 7.169 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.257 -5.720 7.486 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.064 -7.355 6.886 1.00 0.00 H new ATOM 0 HD2 ARG A 88 7.751 -6.771 9.337 1.00 0.00 H new ATOM 0 HD3 ARG A 88 6.013 -6.967 9.458 1.00 0.00 H new ATOM 0 HE ARG A 88 6.214 -9.271 8.927 1.00 0.00 H new ATOM 0 HH11 ARG A 88 9.300 -7.562 8.780 1.00 0.00 H new ATOM 0 HH12 ARG A 88 10.254 -9.049 8.768 1.00 0.00 H new ATOM 0 HH21 ARG A 88 7.447 -11.177 8.912 1.00 0.00 H new ATOM 0 HH22 ARG A 88 9.210 -11.086 8.843 1.00 0.00 H new ATOM 1331 N PHE A 89 8.762 -4.234 4.485 1.00 0.00 N ATOM 1332 CA PHE A 89 9.753 -3.278 4.005 1.00 0.00 C ATOM 1333 C PHE A 89 9.329 -1.848 4.326 1.00 0.00 C ATOM 1334 O PHE A 89 8.279 -1.619 4.929 1.00 0.00 O ATOM 1335 CB PHE A 89 9.955 -3.435 2.496 1.00 0.00 C ATOM 1336 CG PHE A 89 8.670 -3.543 1.727 1.00 0.00 C ATOM 1337 CD1 PHE A 89 8.083 -4.778 1.502 1.00 0.00 C ATOM 1338 CD2 PHE A 89 8.048 -2.410 1.228 1.00 0.00 C ATOM 1339 CE1 PHE A 89 6.901 -4.880 0.794 1.00 0.00 C ATOM 1340 CE2 PHE A 89 6.865 -2.505 0.519 1.00 0.00 C ATOM 1341 CZ PHE A 89 6.290 -3.742 0.303 1.00 0.00 C ATOM 0 H PHE A 89 7.826 -3.846 4.607 1.00 0.00 H new ATOM 0 HA PHE A 89 10.695 -3.482 4.514 1.00 0.00 H new ATOM 0 HB2 PHE A 89 10.522 -2.582 2.123 1.00 0.00 H new ATOM 0 HB3 PHE A 89 10.557 -4.324 2.309 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.555 -5.671 1.884 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.493 -1.440 1.395 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.455 -5.849 0.624 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.391 -1.614 0.135 1.00 0.00 H new ATOM 0 HZ PHE A 89 5.365 -3.820 -0.249 1.00 0.00 H new ATOM 1351 N THR A 90 10.153 -0.887 3.920 1.00 0.00 N ATOM 1352 CA THR A 90 9.866 0.521 4.165 1.00 0.00 C ATOM 1353 C THR A 90 10.050 1.348 2.898 1.00 0.00 C ATOM 1354 O THR A 90 10.884 1.029 2.051 1.00 0.00 O ATOM 1355 CB THR A 90 10.769 1.093 5.274 1.00 0.00 C ATOM 1356 OG1 THR A 90 10.889 0.149 6.344 1.00 0.00 O ATOM 1357 CG2 THR A 90 10.207 2.403 5.807 1.00 0.00 C ATOM 0 H THR A 90 11.025 -1.058 3.420 1.00 0.00 H new ATOM 0 HA THR A 90 8.826 0.581 4.486 1.00 0.00 H new ATOM 0 HB THR A 90 11.754 1.285 4.848 1.00 0.00 H new ATOM 0 HG1 THR A 90 11.466 0.520 7.044 1.00 0.00 H new ATOM 0 HG21 THR A 90 10.861 2.788 6.589 1.00 0.00 H new ATOM 0 HG22 THR A 90 10.144 3.129 4.996 1.00 0.00 H new ATOM 0 HG23 THR A 90 9.212 2.232 6.218 1.00 0.00 H new ATOM 1365 N VAL A 91 9.265 2.414 2.774 1.00 0.00 N ATOM 1366 CA VAL A 91 9.343 3.289 1.610 1.00 0.00 C ATOM 1367 C VAL A 91 9.596 4.734 2.025 1.00 0.00 C ATOM 1368 O VAL A 91 8.978 5.239 2.962 1.00 0.00 O ATOM 1369 CB VAL A 91 8.051 3.226 0.773 1.00 0.00 C ATOM 1370 CG1 VAL A 91 7.883 1.847 0.153 1.00 0.00 C ATOM 1371 CG2 VAL A 91 6.845 3.586 1.628 1.00 0.00 C ATOM 0 H VAL A 91 8.568 2.692 3.465 1.00 0.00 H new ATOM 0 HA VAL A 91 10.178 2.936 1.004 1.00 0.00 H new ATOM 0 HB VAL A 91 8.126 3.954 -0.035 1.00 0.00 H new ATOM 0 HG11 VAL A 91 6.965 1.822 -0.434 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.734 1.633 -0.494 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.829 1.097 0.942 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.941 3.537 1.021 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.764 2.883 2.457 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.965 4.596 2.019 1.00 0.00 H new ATOM 1381 N MET A 92 10.510 5.394 1.320 1.00 0.00 N ATOM 1382 CA MET A 92 10.844 6.783 1.615 1.00 0.00 C ATOM 1383 C MET A 92 10.124 7.730 0.660 1.00 0.00 C ATOM 1384 O MET A 92 9.816 7.365 -0.475 1.00 0.00 O ATOM 1385 CB MET A 92 12.356 6.997 1.521 1.00 0.00 C ATOM 1386 CG MET A 92 13.084 6.776 2.837 1.00 0.00 C ATOM 1387 SD MET A 92 14.699 7.576 2.879 1.00 0.00 S ATOM 1388 CE MET A 92 15.268 7.280 1.207 1.00 0.00 C ATOM 0 H MET A 92 11.032 4.990 0.542 1.00 0.00 H new ATOM 0 HA MET A 92 10.516 7.002 2.631 1.00 0.00 H new ATOM 0 HB2 MET A 92 12.765 6.320 0.771 1.00 0.00 H new ATOM 0 HB3 MET A 92 12.550 8.012 1.174 1.00 0.00 H new ATOM 0 HG2 MET A 92 12.472 7.157 3.655 1.00 0.00 H new ATOM 0 HG3 MET A 92 13.208 5.706 3.004 1.00 0.00 H new ATOM 0 HE1 MET A 92 16.345 7.437 1.156 1.00 0.00 H new ATOM 0 HE2 MET A 92 15.037 6.254 0.920 1.00 0.00 H new ATOM 0 HE3 MET A 92 14.768 7.968 0.525 1.00 0.00 H new ATOM 1398 N ALA A 93 9.860 8.946 1.126 1.00 0.00 N ATOM 1399 CA ALA A 93 9.178 9.944 0.313 1.00 0.00 C ATOM 1400 C ALA A 93 9.887 11.292 0.390 1.00 0.00 C ATOM 1401 O ALA A 93 9.679 12.060 1.330 1.00 0.00 O ATOM 1402 CB ALA A 93 7.728 10.082 0.751 1.00 0.00 C ATOM 0 H ALA A 93 10.108 9.263 2.063 1.00 0.00 H new ATOM 0 HA ALA A 93 9.201 9.609 -0.724 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.231 10.831 0.134 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.221 9.124 0.637 1.00 0.00 H new ATOM 0 HB3 ALA A 93 7.691 10.390 1.796 1.00 0.00 H new ATOM 1408 N ARG A 94 10.724 11.574 -0.603 1.00 0.00 N ATOM 1409 CA ARG A 94 11.465 12.829 -0.645 1.00 0.00 C ATOM 1410 C ARG A 94 11.027 13.678 -1.835 1.00 0.00 C ATOM 1411 O ARG A 94 10.628 13.151 -2.873 1.00 0.00 O ATOM 1412 CB ARG A 94 12.968 12.556 -0.725 1.00 0.00 C ATOM 1413 CG ARG A 94 13.330 11.406 -1.651 1.00 0.00 C ATOM 1414 CD ARG A 94 14.814 11.404 -1.984 1.00 0.00 C ATOM 1415 NE ARG A 94 15.080 10.815 -3.293 1.00 0.00 N ATOM 1416 CZ ARG A 94 16.303 10.594 -3.764 1.00 0.00 C ATOM 1417 NH1 ARG A 94 17.365 10.910 -3.036 1.00 0.00 N ATOM 1418 NH2 ARG A 94 16.464 10.054 -4.966 1.00 0.00 N ATOM 0 H ARG A 94 10.906 10.950 -1.389 1.00 0.00 H new ATOM 0 HA ARG A 94 11.251 13.380 0.271 1.00 0.00 H new ATOM 0 HB2 ARG A 94 13.475 13.459 -1.065 1.00 0.00 H new ATOM 0 HB3 ARG A 94 13.343 12.338 0.275 1.00 0.00 H new ATOM 0 HG2 ARG A 94 13.060 10.460 -1.181 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.750 11.482 -2.571 1.00 0.00 H new ATOM 0 HD2 ARG A 94 15.192 12.426 -1.963 1.00 0.00 H new ATOM 0 HD3 ARG A 94 15.356 10.848 -1.219 1.00 0.00 H new ATOM 0 HE ARG A 94 14.284 10.559 -3.878 1.00 0.00 H new ATOM 0 HH11 ARG A 94 17.245 11.324 -2.112 1.00 0.00 H new ATOM 0 HH12 ARG A 94 18.302 10.739 -3.400 1.00 0.00 H new ATOM 0 HH21 ARG A 94 15.649 9.809 -5.528 1.00 0.00 H new ATOM 0 HH22 ARG A 94 17.403 9.884 -5.327 1.00 0.00 H new ATOM 1432 N ASP A 95 11.105 14.995 -1.675 1.00 0.00 N ATOM 1433 CA ASP A 95 10.717 15.918 -2.735 1.00 0.00 C ATOM 1434 C ASP A 95 11.937 16.640 -3.300 1.00 0.00 C ATOM 1435 O ASP A 95 13.070 16.366 -2.905 1.00 0.00 O ATOM 1436 CB ASP A 95 9.705 16.936 -2.210 1.00 0.00 C ATOM 1437 CG ASP A 95 10.370 18.117 -1.532 1.00 0.00 C ATOM 1438 OD1 ASP A 95 11.132 17.896 -0.567 1.00 0.00 O ATOM 1439 OD2 ASP A 95 10.129 19.264 -1.964 1.00 0.00 O ATOM 0 H ASP A 95 11.433 15.447 -0.822 1.00 0.00 H new ATOM 0 HA ASP A 95 10.256 15.339 -3.535 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.092 17.294 -3.037 1.00 0.00 H new ATOM 0 HB3 ASP A 95 9.034 16.446 -1.504 1.00 0.00 H new ATOM 1444 N ARG A 96 11.696 17.562 -4.226 1.00 0.00 N ATOM 1445 CA ARG A 96 12.775 18.321 -4.847 1.00 0.00 C ATOM 1446 C ARG A 96 13.194 19.492 -3.963 1.00 0.00 C ATOM 1447 O ARG A 96 13.511 20.573 -4.457 1.00 0.00 O ATOM 1448 CB ARG A 96 12.341 18.835 -6.221 1.00 0.00 C ATOM 1449 CG ARG A 96 11.091 19.699 -6.181 1.00 0.00 C ATOM 1450 CD ARG A 96 11.438 21.174 -6.049 1.00 0.00 C ATOM 1451 NE ARG A 96 10.401 22.033 -6.616 1.00 0.00 N ATOM 1452 CZ ARG A 96 10.278 23.324 -6.328 1.00 0.00 C ATOM 1453 NH1 ARG A 96 11.122 23.902 -5.485 1.00 0.00 N ATOM 1454 NH2 ARG A 96 9.309 24.039 -6.885 1.00 0.00 N ATOM 0 H ARG A 96 10.763 17.802 -4.563 1.00 0.00 H new ATOM 0 HA ARG A 96 13.630 17.656 -4.969 1.00 0.00 H new ATOM 0 HB2 ARG A 96 13.157 19.411 -6.658 1.00 0.00 H new ATOM 0 HB3 ARG A 96 12.163 17.984 -6.878 1.00 0.00 H new ATOM 0 HG2 ARG A 96 10.509 19.541 -7.089 1.00 0.00 H new ATOM 0 HG3 ARG A 96 10.464 19.395 -5.343 1.00 0.00 H new ATOM 0 HD2 ARG A 96 11.578 21.421 -4.997 1.00 0.00 H new ATOM 0 HD3 ARG A 96 12.386 21.370 -6.551 1.00 0.00 H new ATOM 0 HE ARG A 96 9.735 21.619 -7.268 1.00 0.00 H new ATOM 0 HH11 ARG A 96 11.868 23.355 -5.056 1.00 0.00 H new ATOM 0 HH12 ARG A 96 11.025 24.893 -5.266 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.658 23.597 -7.535 1.00 0.00 H new ATOM 0 HH22 ARG A 96 9.215 25.030 -6.664 1.00 0.00 H new ATOM 1468 N GLY A 97 13.191 19.268 -2.652 1.00 0.00 N ATOM 1469 CA GLY A 97 13.572 20.314 -1.720 1.00 0.00 C ATOM 1470 C GLY A 97 14.891 20.025 -1.032 1.00 0.00 C ATOM 1471 O GLY A 97 15.516 18.995 -1.284 1.00 0.00 O ATOM 0 H GLY A 97 12.932 18.382 -2.219 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.644 21.262 -2.252 1.00 0.00 H new ATOM 0 HA3 GLY A 97 12.791 20.429 -0.968 1.00 0.00 H new ATOM 1475 N GLN A 98 15.316 20.937 -0.164 1.00 0.00 N ATOM 1476 CA GLN A 98 16.571 20.775 0.560 1.00 0.00 C ATOM 1477 C GLN A 98 16.528 21.512 1.895 1.00 0.00 C ATOM 1478 O GLN A 98 16.325 22.725 1.956 1.00 0.00 O ATOM 1479 CB GLN A 98 17.740 21.289 -0.282 1.00 0.00 C ATOM 1480 CG GLN A 98 17.453 22.608 -0.982 1.00 0.00 C ATOM 1481 CD GLN A 98 18.712 23.292 -1.476 1.00 0.00 C ATOM 1482 OE1 GLN A 98 19.785 22.691 -1.514 1.00 0.00 O ATOM 1483 NE2 GLN A 98 18.586 24.557 -1.860 1.00 0.00 N ATOM 0 H GLN A 98 14.810 21.795 0.055 1.00 0.00 H new ATOM 0 HA GLN A 98 16.714 19.712 0.756 1.00 0.00 H new ATOM 0 HB2 GLN A 98 18.613 21.410 0.359 1.00 0.00 H new ATOM 0 HB3 GLN A 98 17.996 20.538 -1.030 1.00 0.00 H new ATOM 0 HG2 GLN A 98 16.786 22.430 -1.825 1.00 0.00 H new ATOM 0 HG3 GLN A 98 16.928 23.273 -0.296 1.00 0.00 H new ATOM 0 HE21 GLN A 98 17.677 25.016 -1.812 1.00 0.00 H new ATOM 0 HE22 GLN A 98 19.399 25.069 -2.203 1.00 0.00 H new ATOM 1492 N PRO A 99 16.724 20.764 2.991 1.00 0.00 N ATOM 1493 CA PRO A 99 16.967 19.320 2.931 1.00 0.00 C ATOM 1494 C PRO A 99 15.728 18.541 2.501 1.00 0.00 C ATOM 1495 O PRO A 99 14.605 18.841 2.908 1.00 0.00 O ATOM 1496 CB PRO A 99 17.350 18.964 4.369 1.00 0.00 C ATOM 1497 CG PRO A 99 16.707 20.017 5.204 1.00 0.00 C ATOM 1498 CD PRO A 99 16.723 21.271 4.374 1.00 0.00 C ATOM 0 HA PRO A 99 17.732 19.066 2.197 1.00 0.00 H new ATOM 0 HB2 PRO A 99 16.992 17.971 4.640 1.00 0.00 H new ATOM 0 HB3 PRO A 99 18.432 18.960 4.501 1.00 0.00 H new ATOM 0 HG2 PRO A 99 15.687 19.737 5.468 1.00 0.00 H new ATOM 0 HG3 PRO A 99 17.250 20.160 6.138 1.00 0.00 H new ATOM 0 HD2 PRO A 99 15.852 21.896 4.573 1.00 0.00 H new ATOM 0 HD3 PRO A 99 17.604 21.878 4.580 1.00 0.00 H new ATOM 1506 N PRO A 100 15.933 17.518 1.659 1.00 0.00 N ATOM 1507 CA PRO A 100 14.844 16.674 1.158 1.00 0.00 C ATOM 1508 C PRO A 100 14.249 15.788 2.246 1.00 0.00 C ATOM 1509 O PRO A 100 14.759 14.703 2.526 1.00 0.00 O ATOM 1510 CB PRO A 100 15.523 15.820 0.084 1.00 0.00 C ATOM 1511 CG PRO A 100 16.957 15.778 0.484 1.00 0.00 C ATOM 1512 CD PRO A 100 17.245 17.104 1.133 1.00 0.00 C ATOM 0 HA PRO A 100 14.008 17.266 0.786 1.00 0.00 H new ATOM 0 HB2 PRO A 100 15.094 14.819 0.044 1.00 0.00 H new ATOM 0 HB3 PRO A 100 15.401 16.259 -0.906 1.00 0.00 H new ATOM 0 HG2 PRO A 100 17.146 14.956 1.175 1.00 0.00 H new ATOM 0 HG3 PRO A 100 17.599 15.620 -0.382 1.00 0.00 H new ATOM 0 HD2 PRO A 100 17.985 17.010 1.928 1.00 0.00 H new ATOM 0 HD3 PRO A 100 17.637 17.826 0.416 1.00 0.00 H new ATOM 1520 N LYS A 101 13.166 16.256 2.857 1.00 0.00 N ATOM 1521 CA LYS A 101 12.499 15.505 3.914 1.00 0.00 C ATOM 1522 C LYS A 101 12.047 14.139 3.409 1.00 0.00 C ATOM 1523 O LYS A 101 11.248 14.043 2.477 1.00 0.00 O ATOM 1524 CB LYS A 101 11.295 16.289 4.443 1.00 0.00 C ATOM 1525 CG LYS A 101 11.627 17.195 5.616 1.00 0.00 C ATOM 1526 CD LYS A 101 11.464 16.472 6.942 1.00 0.00 C ATOM 1527 CE LYS A 101 12.720 15.700 7.315 1.00 0.00 C ATOM 1528 NZ LYS A 101 12.825 15.487 8.785 1.00 0.00 N ATOM 0 H LYS A 101 12.731 17.152 2.638 1.00 0.00 H new ATOM 0 HA LYS A 101 13.212 15.355 4.724 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.881 16.892 3.635 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.519 15.586 4.746 1.00 0.00 H new ATOM 0 HG2 LYS A 101 12.651 17.555 5.520 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.978 18.071 5.596 1.00 0.00 H new ATOM 0 HD2 LYS A 101 11.234 17.194 7.725 1.00 0.00 H new ATOM 0 HD3 LYS A 101 10.619 15.786 6.882 1.00 0.00 H new ATOM 0 HE2 LYS A 101 12.717 14.735 6.808 1.00 0.00 H new ATOM 0 HE3 LYS A 101 13.597 16.243 6.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 13.694 14.957 8.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 12.853 16.408 9.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.001 14.947 9.117 1.00 0.00 H new ATOM 1542 N THR A 102 12.562 13.083 4.031 1.00 0.00 N ATOM 1543 CA THR A 102 12.211 11.722 3.645 1.00 0.00 C ATOM 1544 C THR A 102 11.426 11.022 4.749 1.00 0.00 C ATOM 1545 O THR A 102 11.924 10.845 5.861 1.00 0.00 O ATOM 1546 CB THR A 102 13.465 10.891 3.316 1.00 0.00 C ATOM 1547 OG1 THR A 102 14.172 10.573 4.520 1.00 0.00 O ATOM 1548 CG2 THR A 102 14.383 11.648 2.368 1.00 0.00 C ATOM 0 H THR A 102 13.224 13.144 4.805 1.00 0.00 H new ATOM 0 HA THR A 102 11.589 11.797 2.753 1.00 0.00 H new ATOM 0 HB THR A 102 13.145 9.970 2.829 1.00 0.00 H new ATOM 0 HG1 THR A 102 13.641 10.852 5.295 1.00 0.00 H new ATOM 0 HG21 THR A 102 15.262 11.041 2.150 1.00 0.00 H new ATOM 0 HG22 THR A 102 13.852 11.863 1.441 1.00 0.00 H new ATOM 0 HG23 THR A 102 14.694 12.584 2.833 1.00 0.00 H new ATOM 1556 N ASP A 103 10.198 10.626 4.435 1.00 0.00 N ATOM 1557 CA ASP A 103 9.344 9.944 5.401 1.00 0.00 C ATOM 1558 C ASP A 103 9.314 8.442 5.133 1.00 0.00 C ATOM 1559 O ASP A 103 9.128 8.007 3.996 1.00 0.00 O ATOM 1560 CB ASP A 103 7.925 10.512 5.351 1.00 0.00 C ATOM 1561 CG ASP A 103 7.736 11.679 6.301 1.00 0.00 C ATOM 1562 OD1 ASP A 103 8.600 12.580 6.313 1.00 0.00 O ATOM 1563 OD2 ASP A 103 6.723 11.691 7.032 1.00 0.00 O ATOM 0 H ASP A 103 9.771 10.765 3.519 1.00 0.00 H new ATOM 0 HA ASP A 103 9.758 10.110 6.396 1.00 0.00 H new ATOM 0 HB2 ASP A 103 7.701 10.835 4.334 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.213 9.725 5.600 1.00 0.00 H new ATOM 1568 N LYS A 104 9.498 7.654 6.187 1.00 0.00 N ATOM 1569 CA LYS A 104 9.491 6.201 6.067 1.00 0.00 C ATOM 1570 C LYS A 104 8.114 5.634 6.397 1.00 0.00 C ATOM 1571 O LYS A 104 7.452 6.091 7.328 1.00 0.00 O ATOM 1572 CB LYS A 104 10.543 5.588 6.994 1.00 0.00 C ATOM 1573 CG LYS A 104 11.939 5.559 6.395 1.00 0.00 C ATOM 1574 CD LYS A 104 13.000 5.360 7.465 1.00 0.00 C ATOM 1575 CE LYS A 104 14.399 5.354 6.867 1.00 0.00 C ATOM 1576 NZ LYS A 104 15.404 4.801 7.817 1.00 0.00 N ATOM 0 H LYS A 104 9.654 7.998 7.135 1.00 0.00 H new ATOM 0 HA LYS A 104 9.731 5.945 5.035 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.568 6.154 7.925 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.244 4.571 7.247 1.00 0.00 H new ATOM 0 HG2 LYS A 104 12.005 4.755 5.662 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.127 6.492 5.863 1.00 0.00 H new ATOM 0 HD2 LYS A 104 12.924 6.155 8.207 1.00 0.00 H new ATOM 0 HD3 LYS A 104 12.821 4.419 7.986 1.00 0.00 H new ATOM 0 HE2 LYS A 104 14.400 4.763 5.951 1.00 0.00 H new ATOM 0 HE3 LYS A 104 14.681 6.370 6.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 16.345 4.813 7.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.421 5.380 8.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 15.149 3.823 8.061 1.00 0.00 H new ATOM 1590 N ALA A 105 7.690 4.636 5.629 1.00 0.00 N ATOM 1591 CA ALA A 105 6.394 4.005 5.842 1.00 0.00 C ATOM 1592 C ALA A 105 6.493 2.489 5.710 1.00 0.00 C ATOM 1593 O ALA A 105 6.842 1.969 4.650 1.00 0.00 O ATOM 1594 CB ALA A 105 5.370 4.556 4.861 1.00 0.00 C ATOM 0 H ALA A 105 8.226 4.247 4.853 1.00 0.00 H new ATOM 0 HA ALA A 105 6.069 4.235 6.857 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.407 4.075 5.032 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.270 5.632 5.006 1.00 0.00 H new ATOM 0 HB3 ALA A 105 5.699 4.356 3.841 1.00 0.00 H new ATOM 1600 N THR A 106 6.185 1.783 6.794 1.00 0.00 N ATOM 1601 CA THR A 106 6.242 0.327 6.800 1.00 0.00 C ATOM 1602 C THR A 106 5.107 -0.270 5.975 1.00 0.00 C ATOM 1603 O THR A 106 3.963 0.177 6.059 1.00 0.00 O ATOM 1604 CB THR A 106 6.169 -0.232 8.233 1.00 0.00 C ATOM 1605 OG1 THR A 106 7.133 0.424 9.064 1.00 0.00 O ATOM 1606 CG2 THR A 106 6.422 -1.733 8.242 1.00 0.00 C ATOM 0 H THR A 106 5.893 2.197 7.679 1.00 0.00 H new ATOM 0 HA THR A 106 7.197 0.046 6.357 1.00 0.00 H new ATOM 0 HB THR A 106 5.168 -0.046 8.622 1.00 0.00 H new ATOM 0 HG1 THR A 106 7.079 0.064 9.974 1.00 0.00 H new ATOM 0 HG21 THR A 106 6.365 -2.105 9.265 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.669 -2.232 7.632 1.00 0.00 H new ATOM 0 HG23 THR A 106 7.413 -1.937 7.836 1.00 0.00 H new ATOM 1614 N VAL A 107 5.430 -1.284 5.179 1.00 0.00 N ATOM 1615 CA VAL A 107 4.437 -1.945 4.341 1.00 0.00 C ATOM 1616 C VAL A 107 4.412 -3.447 4.597 1.00 0.00 C ATOM 1617 O VAL A 107 5.310 -4.175 4.174 1.00 0.00 O ATOM 1618 CB VAL A 107 4.709 -1.695 2.845 1.00 0.00 C ATOM 1619 CG1 VAL A 107 3.721 -2.469 1.986 1.00 0.00 C ATOM 1620 CG2 VAL A 107 4.647 -0.207 2.534 1.00 0.00 C ATOM 0 H VAL A 107 6.372 -1.666 5.097 1.00 0.00 H new ATOM 0 HA VAL A 107 3.469 -1.519 4.603 1.00 0.00 H new ATOM 0 HB VAL A 107 5.713 -2.050 2.612 1.00 0.00 H new ATOM 0 HG11 VAL A 107 3.929 -2.280 0.933 1.00 0.00 H new ATOM 0 HG12 VAL A 107 3.819 -3.535 2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 107 2.706 -2.147 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 107 4.841 -0.049 1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 107 3.657 0.176 2.783 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.398 0.319 3.123 1.00 0.00 H new ATOM 1630 N VAL A 108 3.377 -3.906 5.294 1.00 0.00 N ATOM 1631 CA VAL A 108 3.234 -5.323 5.606 1.00 0.00 C ATOM 1632 C VAL A 108 2.374 -6.031 4.565 1.00 0.00 C ATOM 1633 O VAL A 108 1.160 -5.828 4.504 1.00 0.00 O ATOM 1634 CB VAL A 108 2.609 -5.530 6.999 1.00 0.00 C ATOM 1635 CG1 VAL A 108 2.598 -7.007 7.365 1.00 0.00 C ATOM 1636 CG2 VAL A 108 3.360 -4.719 8.045 1.00 0.00 C ATOM 0 H VAL A 108 2.626 -3.317 5.653 1.00 0.00 H new ATOM 0 HA VAL A 108 4.236 -5.752 5.598 1.00 0.00 H new ATOM 0 HB VAL A 108 1.577 -5.179 6.972 1.00 0.00 H new ATOM 0 HG11 VAL A 108 2.153 -7.134 8.352 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.013 -7.560 6.630 1.00 0.00 H new ATOM 0 HG13 VAL A 108 3.620 -7.387 7.376 1.00 0.00 H new ATOM 0 HG21 VAL A 108 2.905 -4.877 9.023 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.402 -5.038 8.073 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.311 -3.661 7.789 1.00 0.00 H new ATOM 1646 N LEU A 109 3.009 -6.863 3.748 1.00 0.00 N ATOM 1647 CA LEU A 109 2.302 -7.603 2.708 1.00 0.00 C ATOM 1648 C LEU A 109 2.035 -9.039 3.148 1.00 0.00 C ATOM 1649 O LEU A 109 2.949 -9.859 3.214 1.00 0.00 O ATOM 1650 CB LEU A 109 3.112 -7.598 1.411 1.00 0.00 C ATOM 1651 CG LEU A 109 3.244 -6.246 0.708 1.00 0.00 C ATOM 1652 CD1 LEU A 109 3.923 -6.411 -0.643 1.00 0.00 C ATOM 1653 CD2 LEU A 109 1.879 -5.594 0.545 1.00 0.00 C ATOM 0 H LEU A 109 4.012 -7.043 3.785 1.00 0.00 H new ATOM 0 HA LEU A 109 1.345 -7.112 2.533 1.00 0.00 H new ATOM 0 HB2 LEU A 109 4.113 -7.971 1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.654 -8.303 0.717 1.00 0.00 H new ATOM 0 HG LEU A 109 3.863 -5.596 1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 109 4.008 -5.439 -1.129 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.917 -6.834 -0.501 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.331 -7.078 -1.269 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.992 -4.633 0.043 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.236 -6.241 -0.051 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.430 -5.440 1.526 1.00 0.00 H new ATOM 1665 N ASN A 110 0.774 -9.336 3.447 1.00 0.00 N ATOM 1666 CA ASN A 110 0.386 -10.674 3.879 1.00 0.00 C ATOM 1667 C ASN A 110 0.257 -11.615 2.685 1.00 0.00 C ATOM 1668 O ASN A 110 -0.652 -11.474 1.866 1.00 0.00 O ATOM 1669 CB ASN A 110 -0.937 -10.621 4.646 1.00 0.00 C ATOM 1670 CG ASN A 110 -0.803 -9.917 5.983 1.00 0.00 C ATOM 1671 OD1 ASN A 110 -0.210 -10.451 6.920 1.00 0.00 O ATOM 1672 ND2 ASN A 110 -1.354 -8.713 6.075 1.00 0.00 N ATOM 0 H ASN A 110 0.004 -8.669 3.398 1.00 0.00 H new ATOM 0 HA ASN A 110 1.165 -11.056 4.538 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -1.684 -10.107 4.041 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -1.301 -11.636 4.808 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -1.295 -8.191 6.949 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -1.836 -8.310 5.271 1.00 0.00 H new ATOM 1679 N ILE A 111 1.171 -12.575 2.594 1.00 0.00 N ATOM 1680 CA ILE A 111 1.159 -13.540 1.502 1.00 0.00 C ATOM 1681 C ILE A 111 -0.078 -14.430 1.569 1.00 0.00 C ATOM 1682 O ILE A 111 -0.167 -15.326 2.409 1.00 0.00 O ATOM 1683 CB ILE A 111 2.417 -14.427 1.520 1.00 0.00 C ATOM 1684 CG1 ILE A 111 3.676 -13.566 1.397 1.00 0.00 C ATOM 1685 CG2 ILE A 111 2.359 -15.453 0.398 1.00 0.00 C ATOM 1686 CD1 ILE A 111 3.732 -12.755 0.122 1.00 0.00 C ATOM 0 H ILE A 111 1.929 -12.705 3.264 1.00 0.00 H new ATOM 0 HA ILE A 111 1.142 -12.967 0.575 1.00 0.00 H new ATOM 0 HB ILE A 111 2.454 -14.959 2.470 1.00 0.00 H new ATOM 0 HG12 ILE A 111 3.729 -12.890 2.250 1.00 0.00 H new ATOM 0 HG13 ILE A 111 4.553 -14.211 1.447 1.00 0.00 H new ATOM 0 HG21 ILE A 111 3.256 -16.072 0.424 1.00 0.00 H new ATOM 0 HG22 ILE A 111 1.479 -16.083 0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.301 -14.940 -0.562 1.00 0.00 H new ATOM 0 HD11 ILE A 111 4.651 -12.170 0.103 1.00 0.00 H new ATOM 0 HD12 ILE A 111 3.711 -13.426 -0.737 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.874 -12.084 0.079 1.00 0.00 H new ATOM 1698 N LYS A 112 -1.030 -14.178 0.677 1.00 0.00 N ATOM 1699 CA LYS A 112 -2.262 -14.958 0.632 1.00 0.00 C ATOM 1700 C LYS A 112 -2.084 -16.205 -0.228 1.00 0.00 C ATOM 1701 O LYS A 112 -1.152 -16.292 -1.028 1.00 0.00 O ATOM 1702 CB LYS A 112 -3.408 -14.106 0.083 1.00 0.00 C ATOM 1703 CG LYS A 112 -3.755 -12.915 0.959 1.00 0.00 C ATOM 1704 CD LYS A 112 -4.691 -13.308 2.090 1.00 0.00 C ATOM 1705 CE LYS A 112 -6.132 -13.399 1.614 1.00 0.00 C ATOM 1706 NZ LYS A 112 -7.099 -13.174 2.724 1.00 0.00 N ATOM 0 H LYS A 112 -0.972 -13.440 -0.025 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.504 -15.270 1.648 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -3.140 -13.749 -0.911 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -4.293 -14.732 -0.031 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -2.841 -12.489 1.373 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -4.222 -12.140 0.352 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.382 -14.268 2.503 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.618 -12.577 2.895 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.302 -12.662 0.829 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.307 -14.380 1.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -8.070 -13.244 2.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.954 -13.893 3.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.949 -12.228 3.128 1.00 0.00 H new ATOM 1720 N ASP A 113 -2.984 -17.168 -0.059 1.00 0.00 N ATOM 1721 CA ASP A 113 -2.928 -18.410 -0.821 1.00 0.00 C ATOM 1722 C ASP A 113 -3.898 -18.369 -1.998 1.00 0.00 C ATOM 1723 O ASP A 113 -5.096 -18.595 -1.835 1.00 0.00 O ATOM 1724 CB ASP A 113 -3.251 -19.602 0.080 1.00 0.00 C ATOM 1725 CG ASP A 113 -4.660 -19.543 0.636 1.00 0.00 C ATOM 1726 OD1 ASP A 113 -4.991 -18.544 1.309 1.00 0.00 O ATOM 1727 OD2 ASP A 113 -5.433 -20.495 0.399 1.00 0.00 O ATOM 0 H ASP A 113 -3.761 -17.112 0.599 1.00 0.00 H new ATOM 0 HA ASP A 113 -1.916 -18.523 -1.210 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -3.125 -20.525 -0.485 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -2.539 -19.634 0.905 1.00 0.00 H new ATOM 1732 N GLU A 114 -3.371 -18.078 -3.183 1.00 0.00 N ATOM 1733 CA GLU A 114 -4.191 -18.005 -4.387 1.00 0.00 C ATOM 1734 C GLU A 114 -4.241 -19.357 -5.093 1.00 0.00 C ATOM 1735 O GLU A 114 -5.309 -19.826 -5.484 1.00 0.00 O ATOM 1736 CB GLU A 114 -3.645 -16.940 -5.339 1.00 0.00 C ATOM 1737 CG GLU A 114 -4.379 -16.879 -6.669 1.00 0.00 C ATOM 1738 CD GLU A 114 -5.780 -16.315 -6.537 1.00 0.00 C ATOM 1739 OE1 GLU A 114 -6.706 -17.093 -6.224 1.00 0.00 O ATOM 1740 OE2 GLU A 114 -5.951 -15.096 -6.746 1.00 0.00 O ATOM 0 H GLU A 114 -2.380 -17.889 -3.335 1.00 0.00 H new ATOM 0 HA GLU A 114 -5.204 -17.731 -4.090 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -3.707 -15.966 -4.854 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -2.589 -17.137 -5.525 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -3.809 -16.266 -7.367 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -4.433 -17.880 -7.096 1.00 0.00 H new ATOM 1747 N ASN A 115 -3.077 -19.978 -5.253 1.00 0.00 N ATOM 1748 CA ASN A 115 -2.987 -21.275 -5.913 1.00 0.00 C ATOM 1749 C ASN A 115 -3.894 -22.296 -5.232 1.00 0.00 C ATOM 1750 O ASN A 115 -4.659 -22.999 -5.891 1.00 0.00 O ATOM 1751 CB ASN A 115 -1.541 -21.776 -5.906 1.00 0.00 C ATOM 1752 CG ASN A 115 -1.362 -23.037 -6.729 1.00 0.00 C ATOM 1753 OD1 ASN A 115 -1.369 -24.146 -6.194 1.00 0.00 O ATOM 1754 ND2 ASN A 115 -1.199 -22.872 -8.036 1.00 0.00 N ATOM 0 H ASN A 115 -2.183 -19.604 -4.935 1.00 0.00 H new ATOM 0 HA ASN A 115 -3.317 -21.153 -6.945 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -0.887 -20.996 -6.295 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -1.231 -21.969 -4.879 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -1.073 -23.684 -8.641 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -1.200 -21.934 -8.436 1.00 0.00 H new ATOM 1761 N ASP A 116 -3.801 -22.371 -3.909 1.00 0.00 N ATOM 1762 CA ASP A 116 -4.614 -23.305 -3.137 1.00 0.00 C ATOM 1763 C ASP A 116 -6.100 -23.035 -3.350 1.00 0.00 C ATOM 1764 O ASP A 116 -6.621 -22.005 -2.925 1.00 0.00 O ATOM 1765 CB ASP A 116 -4.271 -23.203 -1.650 1.00 0.00 C ATOM 1766 CG ASP A 116 -5.414 -23.653 -0.761 1.00 0.00 C ATOM 1767 OD1 ASP A 116 -6.420 -22.919 -0.671 1.00 0.00 O ATOM 1768 OD2 ASP A 116 -5.302 -24.739 -0.154 1.00 0.00 O ATOM 0 H ASP A 116 -3.171 -21.797 -3.348 1.00 0.00 H new ATOM 0 HA ASP A 116 -4.394 -24.315 -3.484 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -3.391 -23.810 -1.441 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -4.012 -22.172 -1.410 1.00 0.00 H new ATOM 1773 N ASN A 117 -6.777 -23.969 -4.010 1.00 0.00 N ATOM 1774 CA ASN A 117 -8.203 -23.831 -4.281 1.00 0.00 C ATOM 1775 C ASN A 117 -9.032 -24.349 -3.109 1.00 0.00 C ATOM 1776 O ASN A 117 -9.084 -25.552 -2.855 1.00 0.00 O ATOM 1777 CB ASN A 117 -8.577 -24.588 -5.557 1.00 0.00 C ATOM 1778 CG ASN A 117 -9.753 -23.959 -6.279 1.00 0.00 C ATOM 1779 OD1 ASN A 117 -10.882 -24.439 -6.185 1.00 0.00 O ATOM 1780 ND2 ASN A 117 -9.492 -22.877 -7.004 1.00 0.00 N ATOM 0 H ASN A 117 -6.361 -24.829 -4.367 1.00 0.00 H new ATOM 0 HA ASN A 117 -8.420 -22.772 -4.418 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -7.716 -24.615 -6.225 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -8.819 -25.621 -5.306 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -10.243 -22.410 -7.511 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -8.540 -22.514 -7.053 1.00 0.00 H new ATOM 1787 N VAL A 118 -9.678 -23.431 -2.397 1.00 0.00 N ATOM 1788 CA VAL A 118 -10.505 -23.794 -1.252 1.00 0.00 C ATOM 1789 C VAL A 118 -11.737 -24.577 -1.691 1.00 0.00 C ATOM 1790 O VAL A 118 -12.400 -24.241 -2.672 1.00 0.00 O ATOM 1791 CB VAL A 118 -10.956 -22.547 -0.468 1.00 0.00 C ATOM 1792 CG1 VAL A 118 -11.772 -21.622 -1.358 1.00 0.00 C ATOM 1793 CG2 VAL A 118 -11.750 -22.952 0.765 1.00 0.00 C ATOM 0 H VAL A 118 -9.645 -22.431 -2.593 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.892 -24.420 -0.604 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.069 -22.005 -0.139 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -12.082 -20.747 -0.787 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -11.166 -21.305 -2.207 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -12.654 -22.150 -1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -12.061 -22.059 1.307 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -12.631 -23.517 0.461 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -11.128 -23.571 1.411 1.00 0.00 H new ATOM 1803 N PRO A 119 -12.052 -25.648 -0.948 1.00 0.00 N ATOM 1804 CA PRO A 119 -13.207 -26.502 -1.241 1.00 0.00 C ATOM 1805 C PRO A 119 -14.532 -25.800 -0.966 1.00 0.00 C ATOM 1806 O PRO A 119 -14.588 -24.837 -0.200 1.00 0.00 O ATOM 1807 CB PRO A 119 -13.023 -27.687 -0.288 1.00 0.00 C ATOM 1808 CG PRO A 119 -12.213 -27.144 0.839 1.00 0.00 C ATOM 1809 CD PRO A 119 -11.306 -26.108 0.235 1.00 0.00 C ATOM 0 HA PRO A 119 -13.248 -26.785 -2.293 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -13.983 -28.067 0.061 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -12.512 -28.515 -0.780 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -12.853 -26.704 1.603 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -11.637 -27.934 1.322 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -11.111 -25.291 0.930 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -10.340 -26.531 -0.039 1.00 0.00 H new TER 1817 PRO A 119