USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 775 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 SER OG : rot 75:sc= 1.83 USER MOD Set 1.2: A 56 LYS NZ :NH3+ -178:sc= 1.08 (180deg=0.44) USER MOD Single : A 1 SER N :NH3+ 159:sc= -0.0649 (180deg=-0.384) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0696 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 GLN : amide:sc=-0.000293 X(o=-0.00029,f=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HE2:sc= 0.473 K(o=0.47,f=-1.7!) USER MOD Single : A 6 SER OG : rot 180:sc= -0.092 USER MOD Single : A 7 SER OG : rot -85:sc= 1.11 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= -0.0155 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 MET CE :methyl -164:sc= 0 (180deg=-0.314) USER MOD Single : A 31 ASN : amide:sc= -0.99 K(o=-0.99,f=-6!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 76:sc= 1.26 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.316 K(o=-0.32,f=-4.3!) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0404 USER MOD Single : A 64 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.15) USER MOD Single : A 65 GLN : amide:sc= -0.204 X(o=-0.2,f=-0.48) USER MOD Single : A 66 GLN : amide:sc= -0.0538 X(o=-0.054,f=0) USER MOD Single : A 73 GLN : amide:sc= 0.919 K(o=0.92,f=-0.69) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 155:sc= 0.92 (180deg=0.42) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 4.937 2.161 -3.006 1.00 25.00 N ATOM 2 CA SER A 1 3.878 2.001 -4.040 1.00 25.00 C ATOM 3 C SER A 1 4.365 1.360 -5.321 1.00 25.00 C ATOM 4 O SER A 1 3.805 1.491 -6.383 1.00 25.00 O ATOM 5 CB SER A 1 3.243 3.368 -4.327 1.00 25.00 C ATOM 6 OG SER A 1 2.882 3.961 -3.073 1.00 25.00 O ATOM 0 H1 SER A 1 4.652 2.896 -2.328 1.00 25.00 H new ATOM 0 H2 SER A 1 5.071 1.260 -2.504 1.00 25.00 H new ATOM 0 H3 SER A 1 5.829 2.439 -3.463 1.00 25.00 H new ATOM 0 HA SER A 1 3.136 1.313 -3.634 1.00 25.00 H new ATOM 0 HB2 SER A 1 3.943 4.008 -4.864 1.00 25.00 H new ATOM 0 HB3 SER A 1 2.364 3.254 -4.962 1.00 25.00 H new ATOM 0 HG SER A 1 2.475 4.838 -3.231 1.00 25.00 H new ATOM 14 N GLN A 2 5.476 0.617 -5.148 1.00 25.00 N ATOM 15 CA GLN A 2 6.149 -0.165 -6.204 1.00 25.00 C ATOM 16 C GLN A 2 6.507 0.695 -7.423 1.00 25.00 C ATOM 17 O GLN A 2 6.051 0.450 -8.536 1.00 25.00 O ATOM 18 CB GLN A 2 5.282 -1.357 -6.634 1.00 25.00 C ATOM 19 CG GLN A 2 4.954 -2.313 -5.491 1.00 25.00 C ATOM 20 CD GLN A 2 4.291 -3.583 -5.978 1.00 25.00 C ATOM 21 OE1 GLN A 2 4.806 -4.670 -5.789 1.00 25.00 O ATOM 22 NE2 GLN A 2 3.150 -3.451 -6.602 1.00 25.00 N ATOM 0 H GLN A 2 5.943 0.542 -4.244 1.00 25.00 H new ATOM 0 HA GLN A 2 7.081 -0.537 -5.778 1.00 25.00 H new ATOM 0 HB2 GLN A 2 4.352 -0.984 -7.064 1.00 25.00 H new ATOM 0 HB3 GLN A 2 5.798 -1.907 -7.421 1.00 25.00 H new ATOM 0 HG2 GLN A 2 5.870 -2.566 -4.957 1.00 25.00 H new ATOM 0 HG3 GLN A 2 4.298 -1.813 -4.779 1.00 25.00 H new ATOM 0 HE21 GLN A 2 2.749 -2.523 -6.742 1.00 25.00 H new ATOM 0 HE22 GLN A 2 2.660 -4.276 -6.949 1.00 25.00 H new ATOM 31 N GLN A 3 7.322 1.712 -7.193 1.00 25.00 N ATOM 32 CA GLN A 3 7.732 2.634 -8.248 1.00 25.00 C ATOM 33 C GLN A 3 9.148 2.310 -8.736 1.00 25.00 C ATOM 34 O GLN A 3 9.950 1.721 -8.004 1.00 25.00 O ATOM 35 CB GLN A 3 7.669 4.065 -7.712 1.00 25.00 C ATOM 36 CG GLN A 3 6.252 4.488 -7.313 1.00 25.00 C ATOM 37 CD GLN A 3 6.220 5.841 -6.646 1.00 25.00 C ATOM 38 OE1 GLN A 3 6.728 6.010 -5.552 1.00 25.00 O ATOM 39 NE2 GLN A 3 5.606 6.799 -7.286 1.00 25.00 N ATOM 0 H GLN A 3 7.718 1.924 -6.277 1.00 25.00 H new ATOM 0 HA GLN A 3 7.055 2.530 -9.096 1.00 25.00 H new ATOM 0 HB2 GLN A 3 8.327 4.153 -6.847 1.00 25.00 H new ATOM 0 HB3 GLN A 3 8.047 4.749 -8.471 1.00 25.00 H new ATOM 0 HG2 GLN A 3 5.619 4.509 -8.200 1.00 25.00 H new ATOM 0 HG3 GLN A 3 5.830 3.743 -6.638 1.00 25.00 H new ATOM 0 HE21 GLN A 3 5.193 6.618 -8.201 1.00 25.00 H new ATOM 0 HE22 GLN A 3 5.539 7.728 -6.871 1.00 25.00 H new ATOM 48 N SER A 4 9.443 2.688 -9.973 1.00 25.00 N ATOM 49 CA SER A 4 10.759 2.457 -10.567 1.00 25.00 C ATOM 50 C SER A 4 11.837 3.228 -9.817 1.00 25.00 C ATOM 51 O SER A 4 11.614 4.345 -9.378 1.00 25.00 O ATOM 52 CB SER A 4 10.754 2.903 -12.027 1.00 25.00 C ATOM 53 OG SER A 4 9.656 2.323 -12.713 1.00 25.00 O ATOM 0 H SER A 4 8.784 3.160 -10.592 1.00 25.00 H new ATOM 0 HA SER A 4 10.977 1.391 -10.503 1.00 25.00 H new ATOM 0 HB2 SER A 4 10.694 3.990 -12.083 1.00 25.00 H new ATOM 0 HB3 SER A 4 11.688 2.611 -12.507 1.00 25.00 H new ATOM 0 HG SER A 4 9.662 2.617 -13.648 1.00 25.00 H new ATOM 59 N HIS A 5 13.000 2.615 -9.670 1.00 25.00 N ATOM 60 CA HIS A 5 14.105 3.200 -8.915 1.00 25.00 C ATOM 61 C HIS A 5 15.417 2.875 -9.631 1.00 25.00 C ATOM 62 O HIS A 5 16.390 2.434 -9.025 1.00 25.00 O ATOM 63 CB HIS A 5 14.093 2.641 -7.486 1.00 25.00 C ATOM 64 CG HIS A 5 13.886 1.158 -7.421 1.00 25.00 C ATOM 65 ND1 HIS A 5 12.656 0.546 -7.394 1.00 25.00 N ATOM 66 CD2 HIS A 5 14.788 0.138 -7.377 1.00 25.00 C ATOM 67 CE1 HIS A 5 12.846 -0.768 -7.346 1.00 25.00 C ATOM 68 NE2 HIS A 5 14.126 -1.075 -7.337 1.00 25.00 N ATOM 0 H HIS A 5 13.208 1.699 -10.068 1.00 25.00 H new ATOM 0 HA HIS A 5 14.001 4.283 -8.855 1.00 25.00 H new ATOM 0 HB2 HIS A 5 15.037 2.889 -7.000 1.00 25.00 H new ATOM 0 HB3 HIS A 5 13.304 3.134 -6.919 1.00 25.00 H new ATOM 0 HD1 HIS A 5 11.753 1.019 -7.408 1.00 25.00 H new ATOM 0 HD2 HIS A 5 15.861 0.259 -7.374 1.00 25.00 H new ATOM 0 HE1 HIS A 5 12.048 -1.495 -7.318 1.00 25.00 H new ATOM 76 N SER A 6 15.418 3.044 -10.948 1.00 25.00 N ATOM 77 CA SER A 6 16.583 2.697 -11.770 1.00 25.00 C ATOM 78 C SER A 6 16.782 3.614 -12.980 1.00 25.00 C ATOM 79 O SER A 6 17.538 3.290 -13.885 1.00 25.00 O ATOM 80 CB SER A 6 16.437 1.257 -12.267 1.00 25.00 C ATOM 81 OG SER A 6 16.006 0.410 -11.214 1.00 25.00 O ATOM 0 H SER A 6 14.628 3.418 -11.474 1.00 25.00 H new ATOM 0 HA SER A 6 17.458 2.819 -11.131 1.00 25.00 H new ATOM 0 HB2 SER A 6 15.721 1.220 -13.088 1.00 25.00 H new ATOM 0 HB3 SER A 6 17.390 0.903 -12.660 1.00 25.00 H new ATOM 0 HG SER A 6 15.916 -0.507 -11.548 1.00 25.00 H new ATOM 87 N SER A 7 16.071 4.731 -13.021 1.00 25.00 N ATOM 88 CA SER A 7 16.134 5.632 -14.173 1.00 25.00 C ATOM 89 C SER A 7 17.295 6.631 -14.021 1.00 25.00 C ATOM 90 O SER A 7 17.499 7.185 -12.935 1.00 25.00 O ATOM 91 CB SER A 7 14.811 6.382 -14.297 1.00 25.00 C ATOM 92 OG SER A 7 14.667 6.951 -15.581 1.00 25.00 O ATOM 0 H SER A 7 15.445 5.038 -12.276 1.00 25.00 H new ATOM 0 HA SER A 7 16.308 5.044 -15.074 1.00 25.00 H new ATOM 0 HB2 SER A 7 13.983 5.700 -14.103 1.00 25.00 H new ATOM 0 HB3 SER A 7 14.762 7.166 -13.541 1.00 25.00 H new ATOM 0 HG SER A 7 15.115 7.822 -15.605 1.00 25.00 H new ATOM 98 N PRO A 8 18.087 6.865 -15.088 1.00 25.00 N ATOM 99 CA PRO A 8 19.237 7.778 -14.986 1.00 25.00 C ATOM 100 C PRO A 8 18.896 9.270 -15.112 1.00 25.00 C ATOM 101 O PRO A 8 19.458 10.008 -15.915 1.00 25.00 O ATOM 102 CB PRO A 8 20.105 7.330 -16.134 1.00 25.00 C ATOM 103 CG PRO A 8 19.137 6.949 -17.186 1.00 25.00 C ATOM 104 CD PRO A 8 18.011 6.271 -16.439 1.00 25.00 C ATOM 0 HA PRO A 8 19.699 7.720 -14.000 1.00 25.00 H new ATOM 0 HB2 PRO A 8 20.766 8.129 -16.470 1.00 25.00 H new ATOM 0 HB3 PRO A 8 20.739 6.489 -15.851 1.00 25.00 H new ATOM 0 HG2 PRO A 8 18.781 7.822 -17.733 1.00 25.00 H new ATOM 0 HG3 PRO A 8 19.589 6.278 -17.917 1.00 25.00 H new ATOM 0 HD2 PRO A 8 17.046 6.462 -16.908 1.00 25.00 H new ATOM 0 HD3 PRO A 8 18.143 5.189 -16.410 1.00 25.00 H new ATOM 112 N GLY A 9 17.981 9.696 -14.273 1.00 25.00 N ATOM 113 CA GLY A 9 17.486 11.068 -14.271 1.00 25.00 C ATOM 114 C GLY A 9 18.406 12.129 -13.692 1.00 25.00 C ATOM 115 O GLY A 9 17.951 13.013 -12.979 1.00 25.00 O ATOM 0 H GLY A 9 17.551 9.102 -13.564 1.00 25.00 H new ATOM 0 HA2 GLY A 9 17.252 11.346 -15.299 1.00 25.00 H new ATOM 0 HA3 GLY A 9 16.549 11.090 -13.714 1.00 25.00 H new ATOM 119 N GLU A 10 19.695 12.063 -13.998 1.00 25.00 N ATOM 120 CA GLU A 10 20.674 13.009 -13.448 1.00 25.00 C ATOM 121 C GLU A 10 20.992 14.135 -14.410 1.00 25.00 C ATOM 122 O GLU A 10 21.959 14.867 -14.271 1.00 25.00 O ATOM 123 CB GLU A 10 21.941 12.249 -13.037 1.00 25.00 C ATOM 124 CG GLU A 10 22.544 12.710 -11.696 1.00 25.00 C ATOM 125 CD GLU A 10 23.078 11.556 -10.838 1.00 25.00 C ATOM 126 OE1 GLU A 10 23.925 11.814 -9.962 1.00 25.00 O ATOM 127 OE2 GLU A 10 22.601 10.402 -10.984 1.00 25.00 O ATOM 0 H GLU A 10 20.094 11.365 -14.625 1.00 25.00 H new ATOM 0 HA GLU A 10 20.236 13.480 -12.568 1.00 25.00 H new ATOM 0 HB2 GLU A 10 21.709 11.186 -12.972 1.00 25.00 H new ATOM 0 HB3 GLU A 10 22.691 12.365 -13.819 1.00 25.00 H new ATOM 0 HG2 GLU A 10 23.355 13.412 -11.893 1.00 25.00 H new ATOM 0 HG3 GLU A 10 21.784 13.251 -11.132 1.00 25.00 H new ATOM 134 N ILE A 11 20.101 14.270 -15.365 1.00 25.00 N ATOM 135 CA ILE A 11 20.133 15.213 -16.425 1.00 25.00 C ATOM 136 C ILE A 11 19.661 16.617 -16.000 1.00 25.00 C ATOM 137 O ILE A 11 19.103 17.378 -16.788 1.00 25.00 O ATOM 138 CB ILE A 11 19.209 14.644 -17.538 1.00 25.00 C ATOM 139 CG1 ILE A 11 18.650 13.225 -17.206 1.00 25.00 C ATOM 140 CG2 ILE A 11 19.999 14.559 -18.785 1.00 25.00 C ATOM 141 CD1 ILE A 11 17.736 12.619 -18.272 1.00 25.00 C ATOM 0 H ILE A 11 19.277 13.670 -15.411 1.00 25.00 H new ATOM 0 HA ILE A 11 21.160 15.346 -16.766 1.00 25.00 H new ATOM 0 HB ILE A 11 18.353 15.312 -17.633 1.00 25.00 H new ATOM 0 HG12 ILE A 11 19.490 12.550 -17.044 1.00 25.00 H new ATOM 0 HG13 ILE A 11 18.100 13.280 -16.267 1.00 25.00 H new ATOM 0 HG21 ILE A 11 19.374 14.162 -19.585 1.00 25.00 H new ATOM 0 HG22 ILE A 11 20.353 15.553 -19.060 1.00 25.00 H new ATOM 0 HG23 ILE A 11 20.853 13.900 -18.630 1.00 25.00 H new ATOM 0 HD11 ILE A 11 17.401 11.634 -17.947 1.00 25.00 H new ATOM 0 HD12 ILE A 11 16.871 13.266 -18.420 1.00 25.00 H new ATOM 0 HD13 ILE A 11 18.283 12.525 -19.210 1.00 25.00 H new ATOM 153 N THR A 12 19.855 16.942 -14.734 1.00 25.00 N ATOM 154 CA THR A 12 19.431 18.235 -14.203 1.00 25.00 C ATOM 155 C THR A 12 20.451 19.311 -14.556 1.00 25.00 C ATOM 156 O THR A 12 21.653 19.067 -14.598 1.00 25.00 O ATOM 157 CB THR A 12 19.218 18.184 -12.657 1.00 25.00 C ATOM 158 OG1 THR A 12 18.780 19.463 -12.186 1.00 25.00 O ATOM 159 CG2 THR A 12 20.492 17.800 -11.902 1.00 25.00 C ATOM 0 H THR A 12 20.303 16.331 -14.051 1.00 25.00 H new ATOM 0 HA THR A 12 18.474 18.481 -14.662 1.00 25.00 H new ATOM 0 HB THR A 12 18.466 17.418 -12.467 1.00 25.00 H new ATOM 0 HG1 THR A 12 18.646 19.426 -11.216 1.00 25.00 H new ATOM 0 HG21 THR A 12 20.288 17.779 -10.831 1.00 25.00 H new ATOM 0 HG22 THR A 12 20.824 16.814 -12.227 1.00 25.00 H new ATOM 0 HG23 THR A 12 21.272 18.533 -12.109 1.00 25.00 H new ATOM 167 N SER A 13 19.963 20.517 -14.792 1.00 25.00 N ATOM 168 CA SER A 13 20.835 21.655 -15.039 1.00 25.00 C ATOM 169 C SER A 13 21.231 22.234 -13.681 1.00 25.00 C ATOM 170 O SER A 13 20.594 21.937 -12.664 1.00 25.00 O ATOM 171 CB SER A 13 20.103 22.697 -15.886 1.00 25.00 C ATOM 172 OG SER A 13 18.894 23.097 -15.263 1.00 25.00 O ATOM 0 H SER A 13 18.967 20.734 -14.818 1.00 25.00 H new ATOM 0 HA SER A 13 21.727 21.352 -15.588 1.00 25.00 H new ATOM 0 HB2 SER A 13 20.744 23.566 -16.035 1.00 25.00 H new ATOM 0 HB3 SER A 13 19.889 22.285 -16.872 1.00 25.00 H new ATOM 0 HG SER A 13 18.444 23.765 -15.821 1.00 25.00 H new ATOM 178 N SER A 14 22.264 23.069 -13.664 1.00 25.00 N ATOM 179 CA SER A 14 22.757 23.671 -12.417 1.00 25.00 C ATOM 180 C SER A 14 22.644 25.206 -12.348 1.00 25.00 C ATOM 181 O SER A 14 23.647 25.892 -12.146 1.00 25.00 O ATOM 182 CB SER A 14 24.221 23.275 -12.232 1.00 25.00 C ATOM 183 OG SER A 14 24.345 21.866 -12.205 1.00 25.00 O ATOM 0 H SER A 14 22.781 23.349 -14.498 1.00 25.00 H new ATOM 0 HA SER A 14 22.117 23.289 -11.622 1.00 25.00 H new ATOM 0 HB2 SER A 14 24.822 23.685 -13.044 1.00 25.00 H new ATOM 0 HB3 SER A 14 24.606 23.699 -11.305 1.00 25.00 H new ATOM 0 HG SER A 14 25.287 21.623 -12.088 1.00 25.00 H new ATOM 189 N PRO A 15 21.421 25.769 -12.480 1.00 25.00 N ATOM 190 CA PRO A 15 21.328 27.238 -12.425 1.00 25.00 C ATOM 191 C PRO A 15 21.479 27.800 -11.022 1.00 25.00 C ATOM 192 O PRO A 15 21.636 28.993 -10.822 1.00 25.00 O ATOM 193 CB PRO A 15 19.918 27.497 -12.935 1.00 25.00 C ATOM 194 CG PRO A 15 19.146 26.327 -12.483 1.00 25.00 C ATOM 195 CD PRO A 15 20.086 25.169 -12.679 1.00 25.00 C ATOM 0 HA PRO A 15 22.123 27.714 -12.999 1.00 25.00 H new ATOM 0 HB2 PRO A 15 19.512 28.423 -12.528 1.00 25.00 H new ATOM 0 HB3 PRO A 15 19.899 27.591 -14.021 1.00 25.00 H new ATOM 0 HG2 PRO A 15 18.847 26.426 -11.439 1.00 25.00 H new ATOM 0 HG3 PRO A 15 18.233 26.202 -13.066 1.00 25.00 H new ATOM 0 HD2 PRO A 15 19.894 24.371 -11.962 1.00 25.00 H new ATOM 0 HD3 PRO A 15 19.986 24.735 -13.674 1.00 25.00 H new ATOM 203 N GLN A 16 21.417 26.901 -10.057 1.00 25.00 N ATOM 204 CA GLN A 16 21.496 27.220 -8.625 1.00 25.00 C ATOM 205 C GLN A 16 22.907 27.633 -8.150 1.00 25.00 C ATOM 206 O GLN A 16 23.256 27.432 -6.998 1.00 25.00 O ATOM 207 CB GLN A 16 21.026 25.995 -7.822 1.00 25.00 C ATOM 208 CG GLN A 16 19.602 25.545 -8.158 1.00 25.00 C ATOM 209 CD GLN A 16 19.204 24.266 -7.439 1.00 25.00 C ATOM 210 OE1 GLN A 16 19.858 23.827 -6.506 1.00 25.00 O ATOM 211 NE2 GLN A 16 18.139 23.655 -7.889 1.00 25.00 N ATOM 0 H GLN A 16 21.308 25.904 -10.241 1.00 25.00 H new ATOM 0 HA GLN A 16 20.854 28.085 -8.457 1.00 25.00 H new ATOM 0 HB2 GLN A 16 21.711 25.167 -8.005 1.00 25.00 H new ATOM 0 HB3 GLN A 16 21.083 26.226 -6.758 1.00 25.00 H new ATOM 0 HG2 GLN A 16 18.903 26.338 -7.893 1.00 25.00 H new ATOM 0 HG3 GLN A 16 19.518 25.393 -9.234 1.00 25.00 H new ATOM 0 HE21 GLN A 16 17.616 24.050 -8.671 1.00 25.00 H new ATOM 0 HE22 GLN A 16 17.831 22.783 -7.458 1.00 25.00 H new ATOM 220 N GLY A 17 23.713 28.191 -9.047 1.00 25.00 N ATOM 221 CA GLY A 17 25.048 28.658 -8.696 1.00 25.00 C ATOM 222 C GLY A 17 26.026 27.563 -8.314 1.00 25.00 C ATOM 223 O GLY A 17 27.051 27.831 -7.704 1.00 25.00 O ATOM 0 H GLY A 17 23.463 28.331 -10.026 1.00 25.00 H new ATOM 0 HA2 GLY A 17 25.457 29.213 -9.540 1.00 25.00 H new ATOM 0 HA3 GLY A 17 24.966 29.358 -7.865 1.00 25.00 H new ATOM 227 N LEU A 18 25.709 26.324 -8.662 1.00 25.00 N ATOM 228 CA LEU A 18 26.551 25.186 -8.283 1.00 25.00 C ATOM 229 C LEU A 18 27.860 25.203 -9.062 1.00 25.00 C ATOM 230 O LEU A 18 28.916 24.870 -8.540 1.00 25.00 O ATOM 231 CB LEU A 18 25.822 23.870 -8.557 1.00 25.00 C ATOM 232 CG LEU A 18 24.418 23.721 -7.951 1.00 25.00 C ATOM 233 CD1 LEU A 18 23.849 22.352 -8.309 1.00 25.00 C ATOM 234 CD2 LEU A 18 24.415 23.895 -6.427 1.00 25.00 C ATOM 0 H LEU A 18 24.881 26.076 -9.203 1.00 25.00 H new ATOM 0 HA LEU A 18 26.766 25.268 -7.218 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.742 23.744 -9.637 1.00 25.00 H new ATOM 0 HB3 LEU A 18 26.442 23.054 -8.185 1.00 25.00 H new ATOM 0 HG LEU A 18 23.797 24.513 -8.371 1.00 25.00 H new ATOM 0 HD11 LEU A 18 22.853 22.248 -7.878 1.00 25.00 H new ATOM 0 HD12 LEU A 18 23.787 22.256 -9.393 1.00 25.00 H new ATOM 0 HD13 LEU A 18 24.499 21.573 -7.912 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.399 23.780 -6.050 1.00 25.00 H new ATOM 0 HD22 LEU A 18 25.058 23.141 -5.973 1.00 25.00 H new ATOM 0 HD23 LEU A 18 24.786 24.888 -6.173 1.00 25.00 H new ATOM 246 N ASP A 19 27.762 25.625 -10.314 1.00 25.00 N ATOM 247 CA ASP A 19 28.920 25.750 -11.203 1.00 25.00 C ATOM 248 C ASP A 19 29.725 26.992 -10.836 1.00 25.00 C ATOM 249 O ASP A 19 30.911 27.106 -11.129 1.00 25.00 O ATOM 250 CB ASP A 19 28.423 25.886 -12.644 1.00 25.00 C ATOM 251 CG ASP A 19 29.557 25.822 -13.662 1.00 25.00 C ATOM 252 OD1 ASP A 19 29.662 26.738 -14.506 1.00 25.00 O ATOM 253 OD2 ASP A 19 30.313 24.830 -13.661 1.00 25.00 O ATOM 0 H ASP A 19 26.878 25.892 -10.748 1.00 25.00 H new ATOM 0 HA ASP A 19 29.553 24.868 -11.101 1.00 25.00 H new ATOM 0 HB2 ASP A 19 27.706 25.093 -12.854 1.00 25.00 H new ATOM 0 HB3 ASP A 19 27.893 26.832 -12.754 1.00 25.00 H new ATOM 258 N ASN A 20 29.055 27.938 -10.190 1.00 25.00 N ATOM 259 CA ASN A 20 29.654 29.208 -9.836 1.00 25.00 C ATOM 260 C ASN A 20 29.577 29.531 -8.347 1.00 25.00 C ATOM 261 O ASN A 20 28.820 30.419 -7.935 1.00 25.00 O ATOM 262 CB ASN A 20 28.919 30.313 -10.583 1.00 25.00 C ATOM 263 CG ASN A 20 29.110 30.250 -12.068 1.00 25.00 C ATOM 264 OD1 ASN A 20 28.175 30.003 -12.801 1.00 25.00 O ATOM 265 ND2 ASN A 20 30.296 30.551 -12.523 1.00 25.00 N ATOM 0 H ASN A 20 28.082 27.842 -9.899 1.00 25.00 H new ATOM 0 HA ASN A 20 30.708 29.141 -10.104 1.00 25.00 H new ATOM 0 HB2 ASN A 20 27.855 30.249 -10.357 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.265 31.281 -10.219 1.00 25.00 H new ATOM 0 HD21 ASN A 20 30.463 30.585 -13.529 1.00 25.00 H new ATOM 0 HD22 ASN A 20 31.056 30.752 -11.873 1.00 25.00 H new ATOM 272 N PRO A 21 30.437 28.903 -7.532 1.00 25.00 N ATOM 273 CA PRO A 21 30.481 29.265 -6.112 1.00 25.00 C ATOM 274 C PRO A 21 30.815 30.729 -5.885 1.00 25.00 C ATOM 275 O PRO A 21 30.343 31.322 -4.937 1.00 25.00 O ATOM 276 CB PRO A 21 31.609 28.384 -5.564 1.00 25.00 C ATOM 277 CG PRO A 21 32.392 28.019 -6.743 1.00 25.00 C ATOM 278 CD PRO A 21 31.437 27.874 -7.847 1.00 25.00 C ATOM 0 HA PRO A 21 29.515 29.117 -5.630 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.215 28.922 -4.836 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.215 27.501 -5.060 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.133 28.785 -6.969 1.00 25.00 H new ATOM 0 HG3 PRO A 21 32.936 27.089 -6.575 1.00 25.00 H new ATOM 0 HD2 PRO A 21 31.906 28.046 -8.816 1.00 25.00 H new ATOM 0 HD3 PRO A 21 30.999 26.876 -7.877 1.00 25.00 H new ATOM 286 N ALA A 22 31.617 31.320 -6.761 1.00 25.00 N ATOM 287 CA ALA A 22 31.985 32.723 -6.611 1.00 25.00 C ATOM 288 C ALA A 22 30.752 33.617 -6.698 1.00 25.00 C ATOM 289 O ALA A 22 30.558 34.495 -5.867 1.00 25.00 O ATOM 290 CB ALA A 22 33.012 33.112 -7.678 1.00 25.00 C ATOM 0 H ALA A 22 32.022 30.857 -7.575 1.00 25.00 H new ATOM 0 HA ALA A 22 32.433 32.863 -5.627 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.281 34.161 -7.558 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.903 32.494 -7.568 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.584 32.958 -8.668 1.00 25.00 H new ATOM 296 N LEU A 23 29.916 33.375 -7.699 1.00 25.00 N ATOM 297 CA LEU A 23 28.722 34.194 -7.904 1.00 25.00 C ATOM 298 C LEU A 23 27.701 33.902 -6.816 1.00 25.00 C ATOM 299 O LEU A 23 27.024 34.798 -6.332 1.00 25.00 O ATOM 300 CB LEU A 23 28.082 33.914 -9.271 1.00 25.00 C ATOM 301 CG LEU A 23 28.953 34.074 -10.534 1.00 25.00 C ATOM 302 CD1 LEU A 23 28.096 33.782 -11.768 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.578 35.449 -10.673 1.00 25.00 C ATOM 0 H LEU A 23 30.038 32.625 -8.379 1.00 25.00 H new ATOM 0 HA LEU A 23 29.026 35.240 -7.865 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.702 32.893 -9.257 1.00 25.00 H new ATOM 0 HB3 LEU A 23 27.220 34.573 -9.376 1.00 25.00 H new ATOM 0 HG LEU A 23 29.777 33.366 -10.443 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.703 33.892 -12.667 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.713 32.763 -11.712 1.00 25.00 H new ATOM 0 HD13 LEU A 23 27.261 34.482 -11.805 1.00 25.00 H new ATOM 0 HD21 LEU A 23 30.176 35.487 -11.584 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.792 36.203 -10.723 1.00 25.00 H new ATOM 0 HD23 LEU A 23 30.216 35.647 -9.812 1.00 25.00 H new ATOM 315 N LEU A 24 27.594 32.640 -6.428 1.00 25.00 N ATOM 316 CA LEU A 24 26.636 32.246 -5.405 1.00 25.00 C ATOM 317 C LEU A 24 27.006 32.828 -4.051 1.00 25.00 C ATOM 318 O LEU A 24 26.143 33.291 -3.321 1.00 25.00 O ATOM 319 CB LEU A 24 26.566 30.721 -5.314 1.00 25.00 C ATOM 320 CG LEU A 24 25.539 30.151 -4.320 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.156 30.788 -4.449 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.431 28.662 -4.517 1.00 25.00 C ATOM 0 H LEU A 24 28.155 31.875 -6.803 1.00 25.00 H new ATOM 0 HA LEU A 24 25.659 32.638 -5.688 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.340 30.328 -6.305 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.553 30.347 -5.040 1.00 25.00 H new ATOM 0 HG LEU A 24 25.899 30.385 -3.318 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.480 30.341 -3.720 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.231 31.860 -4.265 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.769 30.618 -5.454 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.704 28.254 -3.815 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.108 28.452 -5.537 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.403 28.200 -4.343 1.00 25.00 H new ATOM 334 N ARG A 25 28.293 32.844 -3.736 1.00 25.00 N ATOM 335 CA ARG A 25 28.775 33.417 -2.480 1.00 25.00 C ATOM 336 C ARG A 25 28.368 34.869 -2.457 1.00 25.00 C ATOM 337 O ARG A 25 27.872 35.374 -1.469 1.00 25.00 O ATOM 338 CB ARG A 25 30.305 33.318 -2.414 1.00 25.00 C ATOM 339 CG ARG A 25 30.922 33.833 -1.122 1.00 25.00 C ATOM 340 CD ARG A 25 32.297 34.425 -1.370 1.00 25.00 C ATOM 341 NE ARG A 25 32.213 35.716 -2.086 1.00 25.00 N ATOM 342 CZ ARG A 25 33.078 36.718 -1.970 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.130 36.658 -1.190 1.00 25.00 N ATOM 344 NH2 ARG A 25 32.879 37.815 -2.647 1.00 25.00 N ATOM 0 H ARG A 25 29.028 32.466 -4.334 1.00 25.00 H new ATOM 0 HA ARG A 25 28.353 32.880 -1.631 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.594 32.276 -2.548 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.728 33.876 -3.250 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.272 34.589 -0.681 1.00 25.00 H new ATOM 0 HG3 ARG A 25 30.998 33.018 -0.402 1.00 25.00 H new ATOM 0 HD2 ARG A 25 32.809 34.569 -0.418 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.896 33.724 -1.951 1.00 25.00 H new ATOM 0 HE ARG A 25 31.426 35.848 -2.721 1.00 25.00 H new ATOM 0 HH11 ARG A 25 34.311 35.817 -0.641 1.00 25.00 H new ATOM 0 HH12 ARG A 25 34.768 37.452 -1.132 1.00 25.00 H new ATOM 0 HH21 ARG A 25 32.066 37.897 -3.258 1.00 25.00 H new ATOM 0 HH22 ARG A 25 33.536 38.591 -2.566 1.00 25.00 H new ATOM 358 N ASP A 26 28.589 35.531 -3.572 1.00 25.00 N ATOM 359 CA ASP A 26 28.296 36.947 -3.689 1.00 25.00 C ATOM 360 C ASP A 26 26.795 37.239 -3.552 1.00 25.00 C ATOM 361 O ASP A 26 26.394 38.129 -2.806 1.00 25.00 O ATOM 362 CB ASP A 26 28.826 37.424 -5.029 1.00 25.00 C ATOM 363 CG ASP A 26 29.629 38.696 -4.907 1.00 25.00 C ATOM 364 OD1 ASP A 26 29.321 39.689 -5.588 1.00 25.00 O ATOM 365 OD2 ASP A 26 30.625 38.673 -4.140 1.00 25.00 O ATOM 0 H ASP A 26 28.973 35.109 -4.417 1.00 25.00 H new ATOM 0 HA ASP A 26 28.783 37.485 -2.876 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.448 36.645 -5.469 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.991 37.588 -5.710 1.00 25.00 H new ATOM 370 N MET A 27 25.967 36.439 -4.212 1.00 25.00 N ATOM 371 CA MET A 27 24.508 36.574 -4.114 1.00 25.00 C ATOM 372 C MET A 27 24.045 36.348 -2.687 1.00 25.00 C ATOM 373 O MET A 27 23.219 37.086 -2.172 1.00 25.00 O ATOM 374 CB MET A 27 23.821 35.545 -5.013 1.00 25.00 C ATOM 375 CG MET A 27 22.307 35.716 -5.081 1.00 25.00 C ATOM 376 SD MET A 27 21.505 34.341 -5.929 1.00 25.00 S ATOM 377 CE MET A 27 21.342 33.133 -4.572 1.00 25.00 C ATOM 0 H MET A 27 26.277 35.685 -4.825 1.00 25.00 H new ATOM 0 HA MET A 27 24.244 37.583 -4.430 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.233 35.620 -6.019 1.00 25.00 H new ATOM 0 HB3 MET A 27 24.050 34.544 -4.648 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.907 35.801 -4.071 1.00 25.00 H new ATOM 0 HG3 MET A 27 22.071 36.647 -5.597 1.00 25.00 H new ATOM 0 HE1 MET A 27 21.133 32.147 -4.986 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.271 33.098 -4.002 1.00 25.00 H new ATOM 0 HE3 MET A 27 20.525 33.431 -3.915 1.00 25.00 H new ATOM 387 N LEU A 28 24.572 35.315 -2.055 1.00 25.00 N ATOM 388 CA LEU A 28 24.195 34.971 -0.697 1.00 25.00 C ATOM 389 C LEU A 28 24.594 36.052 0.287 1.00 25.00 C ATOM 390 O LEU A 28 23.830 36.398 1.169 1.00 25.00 O ATOM 391 CB LEU A 28 24.853 33.679 -0.303 1.00 25.00 C ATOM 392 CG LEU A 28 24.011 32.473 -0.691 1.00 25.00 C ATOM 393 CD1 LEU A 28 24.890 31.293 -0.731 1.00 25.00 C ATOM 394 CD2 LEU A 28 22.894 32.274 0.308 1.00 25.00 C ATOM 0 H LEU A 28 25.269 34.694 -2.466 1.00 25.00 H new ATOM 0 HA LEU A 28 23.110 34.869 -0.669 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.830 33.609 -0.781 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.023 33.672 0.774 1.00 25.00 H new ATOM 0 HG LEU A 28 23.557 32.628 -1.670 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.307 30.414 -1.008 1.00 25.00 H new ATOM 0 HD12 LEU A 28 25.679 31.452 -1.467 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.336 31.138 0.251 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.298 31.408 0.020 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.317 32.110 1.299 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.260 33.161 0.326 1.00 25.00 H new ATOM 406 N LEU A 29 25.787 36.599 0.114 1.00 25.00 N ATOM 407 CA LEU A 29 26.276 37.666 0.995 1.00 25.00 C ATOM 408 C LEU A 29 25.372 38.885 0.892 1.00 25.00 C ATOM 409 O LEU A 29 25.109 39.567 1.880 1.00 25.00 O ATOM 410 CB LEU A 29 27.705 38.072 0.607 1.00 25.00 C ATOM 411 CG LEU A 29 28.838 37.165 1.109 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.123 37.470 0.342 1.00 25.00 C ATOM 413 CD2 LEU A 29 29.070 37.343 2.610 1.00 25.00 C ATOM 0 H LEU A 29 26.438 36.328 -0.623 1.00 25.00 H new ATOM 0 HA LEU A 29 26.272 37.290 2.018 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.762 38.119 -0.480 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.886 39.080 0.979 1.00 25.00 H new ATOM 0 HG LEU A 29 28.546 36.129 0.935 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.924 36.824 0.702 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.963 37.292 -0.721 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.401 38.513 0.497 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.878 36.687 2.934 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.339 38.379 2.816 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.159 37.090 3.152 1.00 25.00 H new ATOM 425 N ALA A 30 24.891 39.142 -0.312 1.00 25.00 N ATOM 426 CA ALA A 30 24.016 40.278 -0.569 1.00 25.00 C ATOM 427 C ALA A 30 22.564 40.011 -0.142 1.00 25.00 C ATOM 428 O ALA A 30 21.761 40.940 -0.061 1.00 25.00 O ATOM 429 CB ALA A 30 24.067 40.626 -2.064 1.00 25.00 C ATOM 0 H ALA A 30 25.093 38.575 -1.135 1.00 25.00 H new ATOM 0 HA ALA A 30 24.374 41.116 0.029 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.414 41.476 -2.262 1.00 25.00 H new ATOM 0 HB2 ALA A 30 25.089 40.881 -2.344 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.734 39.768 -2.649 1.00 25.00 H new ATOM 435 N ASN A 31 22.210 38.750 0.076 1.00 25.00 N ATOM 436 CA ASN A 31 20.824 38.384 0.361 1.00 25.00 C ATOM 437 C ASN A 31 20.609 38.026 1.833 1.00 25.00 C ATOM 438 O ASN A 31 20.924 36.918 2.265 1.00 25.00 O ATOM 439 CB ASN A 31 20.432 37.196 -0.506 1.00 25.00 C ATOM 440 CG ASN A 31 18.949 37.011 -0.581 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.242 37.058 0.423 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.462 36.813 -1.773 1.00 25.00 N ATOM 0 H ASN A 31 22.860 37.964 0.061 1.00 25.00 H new ATOM 0 HA ASN A 31 20.201 39.250 0.137 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.829 37.336 -1.511 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.889 36.291 -0.106 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.457 36.690 -1.899 1.00 25.00 H new ATOM 0 HD22 ASN A 31 19.085 36.781 -2.580 1.00 25.00 H new ATOM 449 N PRO A 32 20.027 38.943 2.622 1.00 25.00 N ATOM 450 CA PRO A 32 19.908 38.641 4.051 1.00 25.00 C ATOM 451 C PRO A 32 18.977 37.477 4.407 1.00 25.00 C ATOM 452 O PRO A 32 19.171 36.823 5.427 1.00 25.00 O ATOM 453 CB PRO A 32 19.398 39.962 4.634 1.00 25.00 C ATOM 454 CG PRO A 32 18.668 40.601 3.498 1.00 25.00 C ATOM 455 CD PRO A 32 19.505 40.287 2.310 1.00 25.00 C ATOM 0 HA PRO A 32 20.861 38.298 4.453 1.00 25.00 H new ATOM 0 HB2 PRO A 32 18.740 39.794 5.487 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.219 40.588 4.983 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.661 40.198 3.394 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.568 41.677 3.643 1.00 25.00 H new ATOM 0 HD2 PRO A 32 18.919 40.290 1.391 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.308 41.012 2.178 1.00 25.00 H new ATOM 463 N HIS A 33 17.975 37.202 3.587 1.00 25.00 N ATOM 464 CA HIS A 33 17.069 36.087 3.858 1.00 25.00 C ATOM 465 C HIS A 33 17.729 34.753 3.526 1.00 25.00 C ATOM 466 O HIS A 33 17.610 33.772 4.256 1.00 25.00 O ATOM 467 CB HIS A 33 15.791 36.233 3.031 1.00 25.00 C ATOM 468 CG HIS A 33 14.787 35.152 3.284 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.906 35.146 4.337 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.535 33.999 2.605 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.179 34.034 4.265 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.514 33.301 3.223 1.00 25.00 N ATOM 0 H HIS A 33 17.766 37.726 2.737 1.00 25.00 H new ATOM 0 HA HIS A 33 16.825 36.106 4.920 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.335 37.199 3.249 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.051 36.235 1.973 1.00 25.00 H new ATOM 0 HD2 HIS A 33 15.056 33.677 1.715 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.409 33.765 4.973 1.00 25.00 H new ATOM 0 HE2 HIS A 33 13.108 32.411 2.934 1.00 25.00 H new ATOM 480 N GLU A 34 18.414 34.726 2.398 1.00 25.00 N ATOM 481 CA GLU A 34 19.004 33.493 1.881 1.00 25.00 C ATOM 482 C GLU A 34 20.204 33.114 2.734 1.00 25.00 C ATOM 483 O GLU A 34 20.407 31.959 3.070 1.00 25.00 O ATOM 484 CB GLU A 34 19.409 33.709 0.425 1.00 25.00 C ATOM 485 CG GLU A 34 18.333 33.345 -0.589 1.00 25.00 C ATOM 486 CD GLU A 34 18.074 31.845 -0.671 1.00 25.00 C ATOM 487 OE1 GLU A 34 19.008 31.051 -0.419 1.00 25.00 O ATOM 488 OE2 GLU A 34 16.932 31.463 -1.000 1.00 25.00 O ATOM 0 H GLU A 34 18.579 35.546 1.815 1.00 25.00 H new ATOM 0 HA GLU A 34 18.282 32.677 1.924 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.681 34.756 0.288 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.301 33.118 0.217 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.406 33.854 -0.325 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.629 33.711 -1.572 1.00 25.00 H new ATOM 495 N LEU A 35 20.957 34.105 3.172 1.00 25.00 N ATOM 496 CA LEU A 35 22.081 33.846 4.059 1.00 25.00 C ATOM 497 C LEU A 35 21.599 33.292 5.398 1.00 25.00 C ATOM 498 O LEU A 35 22.299 32.530 6.054 1.00 25.00 O ATOM 499 CB LEU A 35 22.922 35.091 4.189 1.00 25.00 C ATOM 500 CG LEU A 35 22.664 36.236 5.159 1.00 25.00 C ATOM 501 CD1 LEU A 35 22.806 35.907 6.631 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.694 37.246 4.746 1.00 25.00 C ATOM 0 H LEU A 35 20.816 35.087 2.933 1.00 25.00 H new ATOM 0 HA LEU A 35 22.721 33.073 3.633 1.00 25.00 H new ATOM 0 HB2 LEU A 35 23.934 34.745 4.401 1.00 25.00 H new ATOM 0 HB3 LEU A 35 22.941 35.541 3.197 1.00 25.00 H new ATOM 0 HG LEU A 35 21.625 36.560 5.094 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.599 36.798 7.224 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.100 35.121 6.898 1.00 25.00 H new ATOM 0 HD13 LEU A 35 23.822 35.565 6.831 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.611 38.130 5.378 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.690 36.815 4.854 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.531 37.527 3.706 1.00 25.00 H new ATOM 514 N SER A 36 20.399 33.693 5.798 1.00 25.00 N ATOM 515 CA SER A 36 19.805 33.264 7.064 1.00 25.00 C ATOM 516 C SER A 36 19.314 31.829 6.994 1.00 25.00 C ATOM 517 O SER A 36 19.515 31.064 7.925 1.00 25.00 O ATOM 518 CB SER A 36 18.655 34.181 7.474 1.00 25.00 C ATOM 519 OG SER A 36 19.143 35.485 7.746 1.00 25.00 O ATOM 0 H SER A 36 19.808 34.324 5.257 1.00 25.00 H new ATOM 0 HA SER A 36 20.590 33.324 7.817 1.00 25.00 H new ATOM 0 HB2 SER A 36 17.911 34.222 6.679 1.00 25.00 H new ATOM 0 HB3 SER A 36 18.157 33.780 8.356 1.00 25.00 H new ATOM 0 HG SER A 36 19.335 35.945 6.902 1.00 25.00 H new ATOM 525 N LEU A 37 18.716 31.440 5.877 1.00 25.00 N ATOM 526 CA LEU A 37 18.278 30.055 5.708 1.00 25.00 C ATOM 527 C LEU A 37 19.470 29.182 5.639 1.00 25.00 C ATOM 528 O LEU A 37 19.457 28.046 6.052 1.00 25.00 O ATOM 529 CB LEU A 37 17.390 29.885 4.496 1.00 25.00 C ATOM 530 CG LEU A 37 17.807 29.874 3.019 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.525 28.608 2.609 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.536 30.028 2.184 1.00 25.00 C ATOM 0 H LEU A 37 18.523 32.051 5.083 1.00 25.00 H new ATOM 0 HA LEU A 37 17.671 29.769 6.567 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.871 28.939 4.653 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.644 30.675 4.576 1.00 25.00 H new ATOM 0 HG LEU A 37 18.511 30.691 2.857 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.791 28.666 1.554 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.430 28.493 3.206 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.872 27.750 2.772 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.794 30.025 1.125 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.859 29.200 2.395 1.00 25.00 H new ATOM 0 HD23 LEU A 37 16.047 30.969 2.435 1.00 25.00 H new ATOM 544 N LEU A 38 20.511 29.720 5.063 1.00 25.00 N ATOM 545 CA LEU A 38 21.728 28.985 4.910 1.00 25.00 C ATOM 546 C LEU A 38 22.340 28.638 6.253 1.00 25.00 C ATOM 547 O LEU A 38 22.661 27.494 6.497 1.00 25.00 O ATOM 548 CB LEU A 38 22.657 29.809 4.062 1.00 25.00 C ATOM 549 CG LEU A 38 23.906 29.056 3.600 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.510 27.945 2.675 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.892 29.980 2.928 1.00 25.00 C ATOM 0 H LEU A 38 20.536 30.670 4.692 1.00 25.00 H new ATOM 0 HA LEU A 38 21.533 28.032 4.419 1.00 25.00 H new ATOM 0 HB2 LEU A 38 22.114 30.165 3.186 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.964 30.690 4.626 1.00 25.00 H new ATOM 0 HG LEU A 38 24.399 28.637 4.477 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.401 27.410 2.347 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.845 27.257 3.197 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.996 28.359 1.808 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.767 29.411 2.613 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.425 30.440 2.057 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.198 30.757 3.628 1.00 25.00 H new ATOM 563 N LYS A 39 22.435 29.598 7.154 1.00 25.00 N ATOM 564 CA LYS A 39 22.917 29.290 8.516 1.00 25.00 C ATOM 565 C LYS A 39 21.921 28.462 9.324 1.00 25.00 C ATOM 566 O LYS A 39 22.325 27.714 10.200 1.00 25.00 O ATOM 567 CB LYS A 39 23.344 30.549 9.286 1.00 25.00 C ATOM 568 CG LYS A 39 22.318 31.681 9.300 1.00 25.00 C ATOM 569 CD LYS A 39 22.697 32.819 10.238 1.00 25.00 C ATOM 570 CE LYS A 39 23.876 33.621 9.688 1.00 25.00 C ATOM 571 NZ LYS A 39 24.191 34.802 10.559 1.00 25.00 N ATOM 0 H LYS A 39 22.196 30.576 6.989 1.00 25.00 H new ATOM 0 HA LYS A 39 23.806 28.674 8.378 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.566 30.268 10.316 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.270 30.925 8.851 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.205 32.073 8.289 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.348 31.281 9.597 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.840 33.478 10.379 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.954 32.416 11.218 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.753 32.977 9.615 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.646 33.963 8.679 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.996 35.325 10.158 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.362 35.428 10.609 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.434 34.473 11.515 1.00 25.00 H new ATOM 585 N GLU A 40 20.642 28.564 9.004 1.00 25.00 N ATOM 586 CA GLU A 40 19.619 27.749 9.663 1.00 25.00 C ATOM 587 C GLU A 40 19.736 26.284 9.216 1.00 25.00 C ATOM 588 O GLU A 40 19.728 25.367 10.031 1.00 25.00 O ATOM 589 CB GLU A 40 18.226 28.289 9.286 1.00 25.00 C ATOM 590 CG GLU A 40 17.032 27.556 9.912 1.00 25.00 C ATOM 591 CD GLU A 40 15.772 27.664 9.046 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.616 28.661 8.314 1.00 25.00 O ATOM 593 OE2 GLU A 40 14.978 26.696 9.020 1.00 25.00 O ATOM 0 H GLU A 40 20.281 29.201 8.293 1.00 25.00 H new ATOM 0 HA GLU A 40 19.761 27.800 10.743 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.175 29.339 9.574 1.00 25.00 H new ATOM 0 HB3 GLU A 40 18.124 28.250 8.202 1.00 25.00 H new ATOM 0 HG2 GLU A 40 17.285 26.505 10.053 1.00 25.00 H new ATOM 0 HG3 GLU A 40 16.830 27.971 10.900 1.00 25.00 H new ATOM 600 N ARG A 41 19.762 26.075 7.905 1.00 25.00 N ATOM 601 CA ARG A 41 19.639 24.723 7.328 1.00 25.00 C ATOM 602 C ARG A 41 20.921 24.047 6.868 1.00 25.00 C ATOM 603 O ARG A 41 20.992 22.826 6.799 1.00 25.00 O ATOM 604 CB ARG A 41 18.660 24.806 6.162 1.00 25.00 C ATOM 605 CG ARG A 41 17.349 25.388 6.637 1.00 25.00 C ATOM 606 CD ARG A 41 16.245 25.427 5.622 1.00 25.00 C ATOM 607 NE ARG A 41 15.120 26.133 6.247 1.00 25.00 N ATOM 608 CZ ARG A 41 14.011 26.537 5.655 1.00 25.00 C ATOM 609 NH1 ARG A 41 13.768 26.324 4.385 1.00 25.00 N ATOM 610 NH2 ARG A 41 13.135 27.174 6.374 1.00 25.00 N ATOM 0 H ARG A 41 19.867 26.818 7.214 1.00 25.00 H new ATOM 0 HA ARG A 41 19.296 24.087 8.144 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.077 25.425 5.368 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.497 23.814 5.740 1.00 25.00 H new ATOM 0 HG2 ARG A 41 17.007 24.810 7.496 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.530 26.404 6.988 1.00 25.00 H new ATOM 0 HD2 ARG A 41 16.570 25.941 4.717 1.00 25.00 H new ATOM 0 HD3 ARG A 41 15.954 24.418 5.329 1.00 25.00 H new ATOM 0 HE ARG A 41 15.204 26.333 7.244 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.450 25.828 3.812 1.00 25.00 H new ATOM 0 HH12 ARG A 41 12.897 26.655 3.970 1.00 25.00 H new ATOM 0 HH21 ARG A 41 13.316 27.347 7.363 1.00 25.00 H new ATOM 0 HH22 ARG A 41 12.267 27.501 5.949 1.00 25.00 H new ATOM 624 N ASN A 42 21.926 24.840 6.559 1.00 25.00 N ATOM 625 CA ASN A 42 23.244 24.320 6.143 1.00 25.00 C ATOM 626 C ASN A 42 24.408 24.998 6.874 1.00 25.00 C ATOM 627 O ASN A 42 25.195 25.726 6.254 1.00 25.00 O ATOM 628 CB ASN A 42 23.449 24.511 4.637 1.00 25.00 C ATOM 629 CG ASN A 42 24.544 23.630 4.091 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.267 22.989 4.828 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.672 23.596 2.801 1.00 25.00 N ATOM 0 H ASN A 42 21.869 25.858 6.584 1.00 25.00 H new ATOM 0 HA ASN A 42 23.243 23.261 6.402 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.517 24.293 4.115 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.691 25.554 4.435 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.397 23.018 2.375 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.048 24.147 2.212 1.00 25.00 H new ATOM 638 N PRO A 43 24.558 24.756 8.188 1.00 25.00 N ATOM 639 CA PRO A 43 25.662 25.454 8.861 1.00 25.00 C ATOM 640 C PRO A 43 27.092 25.302 8.281 1.00 25.00 C ATOM 641 O PRO A 43 27.825 26.290 8.270 1.00 25.00 O ATOM 642 CB PRO A 43 25.566 24.957 10.312 1.00 25.00 C ATOM 643 CG PRO A 43 24.742 23.712 10.256 1.00 25.00 C ATOM 644 CD PRO A 43 23.781 23.929 9.131 1.00 25.00 C ATOM 0 HA PRO A 43 25.532 26.528 8.727 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.555 24.754 10.723 1.00 25.00 H new ATOM 0 HB3 PRO A 43 25.101 25.706 10.953 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.365 22.835 10.079 1.00 25.00 H new ATOM 0 HG3 PRO A 43 24.217 23.545 11.196 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.468 22.987 8.680 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.877 24.438 9.465 1.00 25.00 H new ATOM 652 N PRO A 44 27.501 24.117 7.755 1.00 25.00 N ATOM 653 CA PRO A 44 28.872 24.184 7.218 1.00 25.00 C ATOM 654 C PRO A 44 29.051 25.033 5.944 1.00 25.00 C ATOM 655 O PRO A 44 30.104 25.640 5.760 1.00 25.00 O ATOM 656 CB PRO A 44 29.209 22.714 6.956 1.00 25.00 C ATOM 657 CG PRO A 44 27.918 22.096 6.652 1.00 25.00 C ATOM 658 CD PRO A 44 26.955 22.751 7.608 1.00 25.00 C ATOM 0 HA PRO A 44 29.532 24.690 7.922 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.906 22.608 6.125 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.676 22.252 7.826 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.629 22.269 5.615 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.950 21.016 6.798 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.940 22.764 7.211 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.917 22.227 8.563 1.00 25.00 H new ATOM 666 N LEU A 45 28.049 25.127 5.073 1.00 25.00 N ATOM 667 CA LEU A 45 28.184 26.012 3.908 1.00 25.00 C ATOM 668 C LEU A 45 28.019 27.447 4.376 1.00 25.00 C ATOM 669 O LEU A 45 28.620 28.374 3.840 1.00 25.00 O ATOM 670 CB LEU A 45 27.169 25.685 2.814 1.00 25.00 C ATOM 671 CG LEU A 45 27.261 26.510 1.507 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.650 26.489 0.864 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.256 25.960 0.500 1.00 25.00 C ATOM 0 H LEU A 45 27.164 24.624 5.141 1.00 25.00 H new ATOM 0 HA LEU A 45 29.171 25.865 3.469 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.273 24.631 2.558 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.169 25.815 3.228 1.00 25.00 H new ATOM 0 HG LEU A 45 27.045 27.544 1.776 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.638 27.088 -0.047 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.380 26.902 1.561 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.922 25.462 0.620 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.314 26.536 -0.424 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.485 24.915 0.291 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.250 26.036 0.912 1.00 25.00 H new ATOM 685 N ALA A 46 27.215 27.626 5.407 1.00 25.00 N ATOM 686 CA ALA A 46 27.002 28.949 5.951 1.00 25.00 C ATOM 687 C ALA A 46 28.258 29.537 6.562 1.00 25.00 C ATOM 688 O ALA A 46 28.585 30.663 6.257 1.00 25.00 O ATOM 689 CB ALA A 46 25.925 28.914 6.970 1.00 25.00 C ATOM 0 H ALA A 46 26.705 26.879 5.879 1.00 25.00 H new ATOM 0 HA ALA A 46 26.711 29.590 5.119 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.773 29.915 7.373 1.00 25.00 H new ATOM 0 HB2 ALA A 46 25.001 28.563 6.511 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.209 28.238 7.776 1.00 25.00 H new ATOM 695 N GLU A 47 28.956 28.799 7.420 1.00 25.00 N ATOM 696 CA GLU A 47 30.144 29.349 8.100 1.00 25.00 C ATOM 697 C GLU A 47 31.193 29.793 7.086 1.00 25.00 C ATOM 698 O GLU A 47 31.874 30.806 7.272 1.00 25.00 O ATOM 699 CB GLU A 47 30.740 28.391 9.128 1.00 25.00 C ATOM 700 CG GLU A 47 31.201 27.086 8.574 1.00 25.00 C ATOM 701 CD GLU A 47 32.617 26.724 9.005 1.00 25.00 C ATOM 702 OE1 GLU A 47 33.536 27.559 8.805 1.00 25.00 O ATOM 703 OE2 GLU A 47 32.829 25.599 9.489 1.00 25.00 O ATOM 0 H GLU A 47 28.732 27.834 7.664 1.00 25.00 H new ATOM 0 HA GLU A 47 29.808 30.223 8.657 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.583 28.881 9.614 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.995 28.199 9.900 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.517 26.300 8.894 1.00 25.00 H new ATOM 0 HG3 GLU A 47 31.157 27.123 7.486 1.00 25.00 H new ATOM 710 N ALA A 48 31.247 29.089 5.967 1.00 25.00 N ATOM 711 CA ALA A 48 32.080 29.461 4.863 1.00 25.00 C ATOM 712 C ALA A 48 31.740 30.827 4.312 1.00 25.00 C ATOM 713 O ALA A 48 32.618 31.659 4.082 1.00 25.00 O ATOM 714 CB ALA A 48 31.943 28.421 3.799 1.00 25.00 C ATOM 0 H ALA A 48 30.705 28.239 5.810 1.00 25.00 H new ATOM 0 HA ALA A 48 33.110 29.521 5.214 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.571 28.686 2.948 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.256 27.454 4.193 1.00 25.00 H new ATOM 0 HB3 ALA A 48 30.903 28.363 3.479 1.00 25.00 H new ATOM 720 N LEU A 49 30.457 31.059 4.121 1.00 25.00 N ATOM 721 CA LEU A 49 29.991 32.325 3.607 1.00 25.00 C ATOM 722 C LEU A 49 30.275 33.437 4.616 1.00 25.00 C ATOM 723 O LEU A 49 30.669 34.533 4.241 1.00 25.00 O ATOM 724 CB LEU A 49 28.482 32.250 3.368 1.00 25.00 C ATOM 725 CG LEU A 49 27.898 33.474 2.664 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.018 33.280 1.178 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.453 33.684 3.067 1.00 25.00 C ATOM 0 H LEU A 49 29.718 30.383 4.316 1.00 25.00 H new ATOM 0 HA LEU A 49 30.510 32.540 2.673 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.263 31.364 2.773 1.00 25.00 H new ATOM 0 HB3 LEU A 49 27.979 32.122 4.327 1.00 25.00 H new ATOM 0 HG LEU A 49 28.452 34.365 2.959 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.604 34.147 0.663 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.068 33.165 0.910 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.468 32.386 0.882 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.056 34.560 2.555 1.00 25.00 H new ATOM 0 HD22 LEU A 49 25.867 32.807 2.792 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.394 33.836 4.145 1.00 25.00 H new ATOM 739 N LEU A 50 30.078 33.143 5.899 1.00 25.00 N ATOM 740 CA LEU A 50 30.251 34.148 6.959 1.00 25.00 C ATOM 741 C LEU A 50 31.696 34.605 7.023 1.00 25.00 C ATOM 742 O LEU A 50 31.986 35.751 7.336 1.00 25.00 O ATOM 743 CB LEU A 50 29.877 33.595 8.346 1.00 25.00 C ATOM 744 CG LEU A 50 28.556 32.840 8.553 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.293 32.643 10.027 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.360 33.479 7.863 1.00 25.00 C ATOM 0 H LEU A 50 29.799 32.221 6.235 1.00 25.00 H new ATOM 0 HA LEU A 50 29.589 34.977 6.710 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.681 32.927 8.654 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.879 34.436 9.039 1.00 25.00 H new ATOM 0 HG LEU A 50 28.680 31.870 8.072 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.354 32.107 10.160 1.00 25.00 H new ATOM 0 HD12 LEU A 50 29.106 32.066 10.468 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.229 33.614 10.518 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.467 32.885 8.058 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.215 34.489 8.247 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.540 33.521 6.789 1.00 25.00 H new ATOM 758 N SER A 51 32.600 33.681 6.733 1.00 25.00 N ATOM 759 CA SER A 51 34.016 33.958 6.748 1.00 25.00 C ATOM 760 C SER A 51 34.423 34.826 5.560 1.00 25.00 C ATOM 761 O SER A 51 35.452 35.490 5.593 1.00 25.00 O ATOM 762 CB SER A 51 34.757 32.645 6.670 1.00 25.00 C ATOM 763 OG SER A 51 34.410 31.793 7.752 1.00 25.00 O ATOM 0 H SER A 51 32.366 32.721 6.482 1.00 25.00 H new ATOM 0 HA SER A 51 34.260 34.496 7.664 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.527 32.150 5.726 1.00 25.00 H new ATOM 0 HB3 SER A 51 35.831 32.830 6.680 1.00 25.00 H new ATOM 0 HG SER A 51 33.518 31.417 7.599 1.00 25.00 H new ATOM 769 N GLY A 52 33.639 34.765 4.490 1.00 25.00 N ATOM 770 CA GLY A 52 33.928 35.527 3.284 1.00 25.00 C ATOM 771 C GLY A 52 34.895 34.802 2.368 1.00 25.00 C ATOM 772 O GLY A 52 35.032 35.150 1.191 1.00 25.00 O ATOM 0 H GLY A 52 32.796 34.193 4.434 1.00 25.00 H new ATOM 0 HA2 GLY A 52 32.999 35.722 2.748 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.347 36.495 3.559 1.00 25.00 H new ATOM 776 N ASP A 53 35.556 33.788 2.905 1.00 25.00 N ATOM 777 CA ASP A 53 36.531 33.003 2.152 1.00 25.00 C ATOM 778 C ASP A 53 35.855 32.242 1.020 1.00 25.00 C ATOM 779 O ASP A 53 35.076 31.313 1.261 1.00 25.00 O ATOM 780 CB ASP A 53 37.210 31.963 3.042 1.00 25.00 C ATOM 781 CG ASP A 53 38.319 31.254 2.334 1.00 25.00 C ATOM 782 OD1 ASP A 53 38.784 31.768 1.301 1.00 25.00 O ATOM 783 OD2 ASP A 53 38.674 30.144 2.760 1.00 25.00 O ATOM 0 H ASP A 53 35.435 33.484 3.871 1.00 25.00 H new ATOM 0 HA ASP A 53 37.264 33.710 1.763 1.00 25.00 H new ATOM 0 HB2 ASP A 53 37.604 32.451 3.934 1.00 25.00 H new ATOM 0 HB3 ASP A 53 36.471 31.235 3.377 1.00 25.00 H new ATOM 788 N LEU A 54 36.177 32.594 -0.212 1.00 25.00 N ATOM 789 CA LEU A 54 35.638 31.871 -1.351 1.00 25.00 C ATOM 790 C LEU A 54 36.178 30.455 -1.342 1.00 25.00 C ATOM 791 O LEU A 54 35.472 29.534 -1.683 1.00 25.00 O ATOM 792 CB LEU A 54 36.013 32.559 -2.668 1.00 25.00 C ATOM 793 CG LEU A 54 35.480 31.951 -3.987 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.404 30.870 -4.563 1.00 25.00 C ATOM 795 CD2 LEU A 54 34.039 31.416 -3.896 1.00 25.00 C ATOM 0 H LEU A 54 36.801 33.366 -0.448 1.00 25.00 H new ATOM 0 HA LEU A 54 34.551 31.857 -1.273 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.669 33.592 -2.614 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.101 32.589 -2.730 1.00 25.00 H new ATOM 0 HG LEU A 54 35.466 32.796 -4.675 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.977 30.481 -5.488 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.384 31.301 -4.769 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.508 30.059 -3.842 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.741 31.007 -4.861 1.00 25.00 H new ATOM 0 HD22 LEU A 54 33.989 30.633 -3.139 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.366 32.229 -3.623 1.00 25.00 H new ATOM 807 N GLU A 55 37.421 30.270 -0.945 1.00 25.00 N ATOM 808 CA GLU A 55 38.023 28.941 -0.985 1.00 25.00 C ATOM 809 C GLU A 55 37.241 27.970 -0.125 1.00 25.00 C ATOM 810 O GLU A 55 36.821 26.913 -0.594 1.00 25.00 O ATOM 811 CB GLU A 55 39.459 28.984 -0.488 1.00 25.00 C ATOM 812 CG GLU A 55 40.281 30.048 -1.138 1.00 25.00 C ATOM 813 CD GLU A 55 40.361 29.882 -2.649 1.00 25.00 C ATOM 814 OE1 GLU A 55 40.785 28.802 -3.115 1.00 25.00 O ATOM 815 OE2 GLU A 55 39.949 30.819 -3.370 1.00 25.00 O ATOM 0 H GLU A 55 38.032 31.008 -0.595 1.00 25.00 H new ATOM 0 HA GLU A 55 38.005 28.606 -2.022 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.458 29.144 0.590 1.00 25.00 H new ATOM 0 HB3 GLU A 55 39.926 28.015 -0.666 1.00 25.00 H new ATOM 0 HG2 GLU A 55 39.856 31.024 -0.905 1.00 25.00 H new ATOM 0 HG3 GLU A 55 41.288 30.031 -0.720 1.00 25.00 H new ATOM 822 N LYS A 56 37.002 28.337 1.126 1.00 25.00 N ATOM 823 CA LYS A 56 36.248 27.474 2.017 1.00 25.00 C ATOM 824 C LYS A 56 34.837 27.348 1.488 1.00 25.00 C ATOM 825 O LYS A 56 34.338 26.243 1.466 1.00 25.00 O ATOM 826 CB LYS A 56 36.331 27.908 3.507 1.00 25.00 C ATOM 827 CG LYS A 56 35.406 28.896 4.001 1.00 25.00 C ATOM 828 CD LYS A 56 35.911 29.450 5.353 1.00 25.00 C ATOM 829 CE LYS A 56 35.295 28.699 6.538 1.00 25.00 C ATOM 830 NZ LYS A 56 35.740 29.172 7.886 1.00 25.00 N ATOM 0 H LYS A 56 37.315 29.215 1.541 1.00 25.00 H new ATOM 0 HA LYS A 56 36.700 26.482 2.023 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.212 27.013 4.117 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.339 28.284 3.684 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.305 29.707 3.279 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.417 28.454 4.124 1.00 25.00 H new ATOM 0 HD2 LYS A 56 36.997 29.370 5.396 1.00 25.00 H new ATOM 0 HD3 LYS A 56 35.666 30.510 5.427 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.210 28.785 6.479 1.00 25.00 H new ATOM 0 HE3 LYS A 56 35.536 27.640 6.443 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 35.299 28.585 8.623 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 36.775 29.096 7.956 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 35.456 30.164 8.017 1.00 25.00 H new ATOM 844 N PHE A 57 34.237 28.424 0.976 1.00 25.00 N ATOM 845 CA PHE A 57 32.898 28.350 0.385 1.00 25.00 C ATOM 846 C PHE A 57 32.825 27.379 -0.788 1.00 25.00 C ATOM 847 O PHE A 57 31.978 26.518 -0.794 1.00 25.00 O ATOM 848 CB PHE A 57 32.424 29.745 -0.039 1.00 25.00 C ATOM 849 CG PHE A 57 31.005 29.772 -0.534 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.726 29.640 -1.907 1.00 25.00 C ATOM 851 CD2 PHE A 57 29.935 29.930 0.368 1.00 25.00 C ATOM 852 CE1 PHE A 57 29.393 29.664 -2.380 1.00 25.00 C ATOM 853 CE2 PHE A 57 28.596 29.954 -0.099 1.00 25.00 C ATOM 854 CZ PHE A 57 28.330 29.821 -1.477 1.00 25.00 C ATOM 0 H PHE A 57 34.655 29.354 0.958 1.00 25.00 H new ATOM 0 HA PHE A 57 32.231 27.962 1.155 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.518 30.425 0.808 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.081 30.120 -0.823 1.00 25.00 H new ATOM 0 HD1 PHE A 57 31.539 29.519 -2.608 1.00 25.00 H new ATOM 0 HD2 PHE A 57 30.136 30.034 1.424 1.00 25.00 H new ATOM 0 HE1 PHE A 57 29.193 29.561 -3.436 1.00 25.00 H new ATOM 0 HE2 PHE A 57 27.781 30.074 0.600 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.312 29.840 -1.837 1.00 25.00 H new ATOM 864 N SER A 58 33.720 27.485 -1.754 1.00 25.00 N ATOM 865 CA SER A 58 33.730 26.589 -2.906 1.00 25.00 C ATOM 866 C SER A 58 34.024 25.146 -2.510 1.00 25.00 C ATOM 867 O SER A 58 33.458 24.203 -3.064 1.00 25.00 O ATOM 868 CB SER A 58 34.794 27.054 -3.904 1.00 25.00 C ATOM 869 OG SER A 58 34.764 26.268 -5.081 1.00 25.00 O ATOM 0 H SER A 58 34.458 28.189 -1.766 1.00 25.00 H new ATOM 0 HA SER A 58 32.737 26.621 -3.354 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.627 28.101 -4.157 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.781 26.990 -3.445 1.00 25.00 H new ATOM 0 HG SER A 58 35.451 26.585 -5.704 1.00 25.00 H new ATOM 875 N ARG A 59 34.925 24.974 -1.556 1.00 25.00 N ATOM 876 CA ARG A 59 35.339 23.643 -1.117 1.00 25.00 C ATOM 877 C ARG A 59 34.180 22.954 -0.421 1.00 25.00 C ATOM 878 O ARG A 59 33.884 21.798 -0.683 1.00 25.00 O ATOM 879 CB ARG A 59 36.549 23.773 -0.183 1.00 25.00 C ATOM 880 CG ARG A 59 37.178 22.447 0.279 1.00 25.00 C ATOM 881 CD ARG A 59 36.545 21.888 1.554 1.00 25.00 C ATOM 882 NE ARG A 59 36.689 22.797 2.704 1.00 25.00 N ATOM 883 CZ ARG A 59 36.184 22.582 3.916 1.00 25.00 C ATOM 884 NH1 ARG A 59 35.502 21.508 4.216 1.00 25.00 N ATOM 885 NH2 ARG A 59 36.376 23.474 4.847 1.00 25.00 N ATOM 0 H ARG A 59 35.388 25.740 -1.067 1.00 25.00 H new ATOM 0 HA ARG A 59 35.628 23.037 -1.976 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.315 24.361 -0.689 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.246 24.337 0.699 1.00 25.00 H new ATOM 0 HG2 ARG A 59 37.082 21.710 -0.519 1.00 25.00 H new ATOM 0 HG3 ARG A 59 38.244 22.598 0.447 1.00 25.00 H new ATOM 0 HD2 ARG A 59 35.487 21.698 1.376 1.00 25.00 H new ATOM 0 HD3 ARG A 59 37.005 20.929 1.794 1.00 25.00 H new ATOM 0 HE ARG A 59 37.217 23.658 2.560 1.00 25.00 H new ATOM 0 HH11 ARG A 59 35.339 20.793 3.507 1.00 25.00 H new ATOM 0 HH12 ARG A 59 35.133 21.385 5.159 1.00 25.00 H new ATOM 0 HH21 ARG A 59 36.906 24.321 4.641 1.00 25.00 H new ATOM 0 HH22 ARG A 59 35.996 23.325 5.782 1.00 25.00 H new ATOM 899 N VAL A 60 33.503 23.677 0.451 1.00 25.00 N ATOM 900 CA VAL A 60 32.374 23.112 1.167 1.00 25.00 C ATOM 901 C VAL A 60 31.212 22.942 0.179 1.00 25.00 C ATOM 902 O VAL A 60 30.445 21.999 0.285 1.00 25.00 O ATOM 903 CB VAL A 60 32.025 23.920 2.462 1.00 25.00 C ATOM 904 CG1 VAL A 60 31.457 25.213 2.171 1.00 25.00 C ATOM 905 CG2 VAL A 60 31.111 23.106 3.372 1.00 25.00 C ATOM 0 H VAL A 60 33.712 24.649 0.680 1.00 25.00 H new ATOM 0 HA VAL A 60 32.625 22.124 1.553 1.00 25.00 H new ATOM 0 HB VAL A 60 32.962 24.106 2.988 1.00 25.00 H new ATOM 0 HG11 VAL A 60 31.234 25.731 3.104 1.00 25.00 H new ATOM 0 HG12 VAL A 60 32.169 25.801 1.591 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.539 25.086 1.598 1.00 25.00 H new ATOM 0 HG21 VAL A 60 30.880 23.684 4.267 1.00 25.00 H new ATOM 0 HG22 VAL A 60 30.187 22.870 2.843 1.00 25.00 H new ATOM 0 HG23 VAL A 60 31.612 22.181 3.657 1.00 25.00 H new ATOM 915 N LEU A 61 31.085 23.845 -0.787 1.00 25.00 N ATOM 916 CA LEU A 61 30.024 23.757 -1.794 1.00 25.00 C ATOM 917 C LEU A 61 30.078 22.427 -2.538 1.00 25.00 C ATOM 918 O LEU A 61 29.053 21.775 -2.702 1.00 25.00 O ATOM 919 CB LEU A 61 30.151 24.902 -2.811 1.00 25.00 C ATOM 920 CG LEU A 61 28.938 25.150 -3.718 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.131 26.277 -3.132 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.330 25.541 -5.142 1.00 25.00 C ATOM 0 H LEU A 61 31.703 24.649 -0.897 1.00 25.00 H new ATOM 0 HA LEU A 61 29.071 23.833 -1.271 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.362 25.821 -2.265 1.00 25.00 H new ATOM 0 HB3 LEU A 61 31.015 24.702 -3.444 1.00 25.00 H new ATOM 0 HG LEU A 61 28.374 24.219 -3.771 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.263 26.469 -3.763 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.798 26.004 -2.130 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.746 27.175 -3.078 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.430 25.703 -5.736 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.919 26.458 -5.118 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.920 24.741 -5.589 1.00 25.00 H new ATOM 934 N VAL A 62 31.254 22.010 -2.984 1.00 25.00 N ATOM 935 CA VAL A 62 31.359 20.754 -3.730 1.00 25.00 C ATOM 936 C VAL A 62 31.156 19.550 -2.807 1.00 25.00 C ATOM 937 O VAL A 62 30.520 18.575 -3.190 1.00 25.00 O ATOM 938 CB VAL A 62 32.690 20.658 -4.550 1.00 25.00 C ATOM 939 CG1 VAL A 62 33.934 20.594 -3.661 1.00 25.00 C ATOM 940 CG2 VAL A 62 32.648 19.452 -5.478 1.00 25.00 C ATOM 0 H VAL A 62 32.134 22.507 -2.849 1.00 25.00 H new ATOM 0 HA VAL A 62 30.554 20.742 -4.465 1.00 25.00 H new ATOM 0 HB VAL A 62 32.766 21.574 -5.136 1.00 25.00 H new ATOM 0 HG11 VAL A 62 34.825 20.529 -4.286 1.00 25.00 H new ATOM 0 HG12 VAL A 62 33.988 21.492 -3.045 1.00 25.00 H new ATOM 0 HG13 VAL A 62 33.877 19.716 -3.018 1.00 25.00 H new ATOM 0 HG21 VAL A 62 33.578 19.395 -6.043 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.525 18.543 -4.889 1.00 25.00 H new ATOM 0 HG23 VAL A 62 31.810 19.553 -6.168 1.00 25.00 H new ATOM 950 N GLU A 63 31.614 19.643 -1.571 1.00 25.00 N ATOM 951 CA GLU A 63 31.360 18.584 -0.577 1.00 25.00 C ATOM 952 C GLU A 63 29.855 18.423 -0.366 1.00 25.00 C ATOM 953 O GLU A 63 29.325 17.309 -0.351 1.00 25.00 O ATOM 954 CB GLU A 63 31.998 18.940 0.766 1.00 25.00 C ATOM 955 CG GLU A 63 33.510 18.807 0.806 1.00 25.00 C ATOM 956 CD GLU A 63 34.095 19.352 2.105 1.00 25.00 C ATOM 957 OE1 GLU A 63 35.291 19.118 2.373 1.00 25.00 O ATOM 958 OE2 GLU A 63 33.376 20.062 2.840 1.00 25.00 O ATOM 0 H GLU A 63 32.161 20.430 -1.222 1.00 25.00 H new ATOM 0 HA GLU A 63 31.793 17.657 -0.952 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.730 19.966 1.019 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.570 18.299 1.537 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.785 17.758 0.696 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.944 19.341 -0.040 1.00 25.00 H new ATOM 965 N GLN A 64 29.162 19.544 -0.230 1.00 25.00 N ATOM 966 CA GLN A 64 27.718 19.536 -0.041 1.00 25.00 C ATOM 967 C GLN A 64 27.022 18.979 -1.269 1.00 25.00 C ATOM 968 O GLN A 64 26.070 18.226 -1.141 1.00 25.00 O ATOM 969 CB GLN A 64 27.207 20.949 0.252 1.00 25.00 C ATOM 970 CG GLN A 64 27.517 21.425 1.668 1.00 25.00 C ATOM 971 CD GLN A 64 26.781 20.620 2.711 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.565 20.502 2.665 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.503 20.054 3.640 1.00 25.00 N ATOM 0 H GLN A 64 29.578 20.475 -0.247 1.00 25.00 H new ATOM 0 HA GLN A 64 27.491 18.896 0.811 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.651 21.643 -0.462 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.129 20.977 0.095 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.590 21.355 1.847 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.246 22.476 1.764 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.516 20.176 3.644 1.00 25.00 H new ATOM 0 HE22 GLN A 64 27.054 19.490 4.361 1.00 25.00 H new ATOM 982 N GLN A 65 27.504 19.314 -2.458 1.00 25.00 N ATOM 983 CA GLN A 65 26.912 18.775 -3.683 1.00 25.00 C ATOM 984 C GLN A 65 27.068 17.260 -3.729 1.00 25.00 C ATOM 985 O GLN A 65 26.128 16.563 -4.084 1.00 25.00 O ATOM 986 CB GLN A 65 27.552 19.383 -4.933 1.00 25.00 C ATOM 987 CG GLN A 65 27.109 20.806 -5.225 1.00 25.00 C ATOM 988 CD GLN A 65 27.738 21.343 -6.488 1.00 25.00 C ATOM 989 OE1 GLN A 65 27.486 20.845 -7.568 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.545 22.361 -6.360 1.00 25.00 N ATOM 0 H GLN A 65 28.291 19.946 -2.604 1.00 25.00 H new ATOM 0 HA GLN A 65 25.854 19.037 -3.672 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.636 19.367 -4.818 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.314 18.756 -5.792 1.00 25.00 H new ATOM 0 HG2 GLN A 65 26.023 20.836 -5.319 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.375 21.448 -4.385 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.731 22.751 -5.436 1.00 25.00 H new ATOM 0 HE22 GLN A 65 28.989 22.766 -7.184 1.00 25.00 H new ATOM 999 N GLN A 66 28.226 16.747 -3.344 1.00 25.00 N ATOM 1000 CA GLN A 66 28.454 15.303 -3.347 1.00 25.00 C ATOM 1001 C GLN A 66 27.533 14.592 -2.359 1.00 25.00 C ATOM 1002 O GLN A 66 26.946 13.566 -2.683 1.00 25.00 O ATOM 1003 CB GLN A 66 29.907 14.988 -2.984 1.00 25.00 C ATOM 1004 CG GLN A 66 30.908 15.398 -4.048 1.00 25.00 C ATOM 1005 CD GLN A 66 32.331 15.238 -3.571 1.00 25.00 C ATOM 1006 OE1 GLN A 66 32.858 14.141 -3.511 1.00 25.00 O ATOM 1007 NE2 GLN A 66 32.951 16.329 -3.208 1.00 25.00 N ATOM 0 H GLN A 66 29.021 17.302 -3.027 1.00 25.00 H new ATOM 0 HA GLN A 66 28.238 14.944 -4.353 1.00 25.00 H new ATOM 0 HB2 GLN A 66 30.156 15.493 -2.051 1.00 25.00 H new ATOM 0 HB3 GLN A 66 30.002 13.917 -2.802 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.755 14.795 -4.943 1.00 25.00 H new ATOM 0 HG3 GLN A 66 30.734 16.436 -4.330 1.00 25.00 H new ATOM 0 HE21 GLN A 66 32.477 17.230 -3.272 1.00 25.00 H new ATOM 0 HE22 GLN A 66 33.909 16.280 -2.860 1.00 25.00 H new ATOM 1016 N ASP A 67 27.396 15.126 -1.154 1.00 25.00 N ATOM 1017 CA ASP A 67 26.560 14.479 -0.138 1.00 25.00 C ATOM 1018 C ASP A 67 25.078 14.593 -0.493 1.00 25.00 C ATOM 1019 O ASP A 67 24.277 13.679 -0.253 1.00 25.00 O ATOM 1020 CB ASP A 67 26.798 15.108 1.229 1.00 25.00 C ATOM 1021 CG ASP A 67 26.270 14.246 2.361 1.00 25.00 C ATOM 1022 OD1 ASP A 67 25.923 13.068 2.109 1.00 25.00 O ATOM 1023 OD2 ASP A 67 26.139 14.748 3.493 1.00 25.00 O ATOM 0 H ASP A 67 27.843 15.992 -0.853 1.00 25.00 H new ATOM 0 HA ASP A 67 26.836 13.425 -0.106 1.00 25.00 H new ATOM 0 HB2 ASP A 67 27.866 15.273 1.369 1.00 25.00 H new ATOM 0 HB3 ASP A 67 26.317 16.085 1.265 1.00 25.00 H new ATOM 1028 N ARG A 68 24.715 15.709 -1.106 1.00 25.00 N ATOM 1029 CA ARG A 68 23.348 15.894 -1.585 1.00 25.00 C ATOM 1030 C ARG A 68 23.068 14.898 -2.679 1.00 25.00 C ATOM 1031 O ARG A 68 22.027 14.275 -2.674 1.00 25.00 O ATOM 1032 CB ARG A 68 23.133 17.295 -2.144 1.00 25.00 C ATOM 1033 CG ARG A 68 22.797 18.330 -1.087 1.00 25.00 C ATOM 1034 CD ARG A 68 22.754 19.732 -1.695 1.00 25.00 C ATOM 1035 NE ARG A 68 21.856 19.795 -2.864 1.00 25.00 N ATOM 1036 CZ ARG A 68 20.530 19.879 -2.822 1.00 25.00 C ATOM 1037 NH1 ARG A 68 19.862 19.931 -1.695 1.00 25.00 N ATOM 1038 NH2 ARG A 68 19.865 19.915 -3.941 1.00 25.00 N ATOM 0 H ARG A 68 25.339 16.496 -1.284 1.00 25.00 H new ATOM 0 HA ARG A 68 22.675 15.749 -0.740 1.00 25.00 H new ATOM 0 HB2 ARG A 68 24.034 17.608 -2.672 1.00 25.00 H new ATOM 0 HB3 ARG A 68 22.328 17.264 -2.878 1.00 25.00 H new ATOM 0 HG2 ARG A 68 21.833 18.095 -0.635 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.540 18.297 -0.290 1.00 25.00 H new ATOM 0 HD2 ARG A 68 22.420 20.445 -0.941 1.00 25.00 H new ATOM 0 HD3 ARG A 68 23.759 20.030 -1.992 1.00 25.00 H new ATOM 0 HE ARG A 68 22.291 19.772 -3.786 1.00 25.00 H new ATOM 0 HH11 ARG A 68 20.360 19.907 -0.805 1.00 25.00 H new ATOM 0 HH12 ARG A 68 18.844 19.995 -1.708 1.00 25.00 H new ATOM 0 HH21 ARG A 68 20.362 19.879 -4.831 1.00 25.00 H new ATOM 0 HH22 ARG A 68 18.847 19.979 -3.928 1.00 25.00 H new ATOM 1052 N ALA A 69 24.006 14.724 -3.597 1.00 25.00 N ATOM 1053 CA ALA A 69 23.816 13.814 -4.717 1.00 25.00 C ATOM 1054 C ALA A 69 23.454 12.419 -4.228 1.00 25.00 C ATOM 1055 O ALA A 69 22.619 11.773 -4.816 1.00 25.00 O ATOM 1056 CB ALA A 69 25.076 13.771 -5.595 1.00 25.00 C ATOM 0 H ALA A 69 24.907 15.201 -3.589 1.00 25.00 H new ATOM 0 HA ALA A 69 22.988 14.185 -5.320 1.00 25.00 H new ATOM 0 HB1 ALA A 69 24.916 13.086 -6.427 1.00 25.00 H new ATOM 0 HB2 ALA A 69 25.285 14.769 -5.981 1.00 25.00 H new ATOM 0 HB3 ALA A 69 25.922 13.428 -5.000 1.00 25.00 H new ATOM 1062 N ARG A 70 24.025 11.978 -3.116 1.00 25.00 N ATOM 1063 CA ARG A 70 23.725 10.637 -2.597 1.00 25.00 C ATOM 1064 C ARG A 70 22.237 10.416 -2.345 1.00 25.00 C ATOM 1065 O ARG A 70 21.680 9.421 -2.780 1.00 25.00 O ATOM 1066 CB ARG A 70 24.506 10.390 -1.306 1.00 25.00 C ATOM 1067 CG ARG A 70 25.986 10.543 -1.510 1.00 25.00 C ATOM 1068 CD ARG A 70 26.804 9.841 -0.434 1.00 25.00 C ATOM 1069 NE ARG A 70 26.723 10.508 0.878 1.00 25.00 N ATOM 1070 CZ ARG A 70 27.289 10.066 1.997 1.00 25.00 C ATOM 1071 NH1 ARG A 70 27.984 8.956 2.040 1.00 25.00 N ATOM 1072 NH2 ARG A 70 27.162 10.762 3.087 1.00 25.00 N ATOM 0 H ARG A 70 24.690 12.514 -2.558 1.00 25.00 H new ATOM 0 HA ARG A 70 24.030 9.927 -3.366 1.00 25.00 H new ATOM 0 HB2 ARG A 70 24.171 11.089 -0.539 1.00 25.00 H new ATOM 0 HB3 ARG A 70 24.292 9.387 -0.938 1.00 25.00 H new ATOM 0 HG2 ARG A 70 26.257 10.142 -2.486 1.00 25.00 H new ATOM 0 HG3 ARG A 70 26.240 11.603 -1.519 1.00 25.00 H new ATOM 0 HD2 ARG A 70 26.457 8.813 -0.335 1.00 25.00 H new ATOM 0 HD3 ARG A 70 27.847 9.797 -0.749 1.00 25.00 H new ATOM 0 HE ARG A 70 26.191 11.377 0.932 1.00 25.00 H new ATOM 0 HH11 ARG A 70 28.106 8.398 1.195 1.00 25.00 H new ATOM 0 HH12 ARG A 70 28.403 8.650 2.918 1.00 25.00 H new ATOM 0 HH21 ARG A 70 26.634 11.634 3.076 1.00 25.00 H new ATOM 0 HH22 ARG A 70 27.591 10.436 3.953 1.00 25.00 H new ATOM 1086 N ARG A 71 21.596 11.347 -1.654 1.00 25.00 N ATOM 1087 CA ARG A 71 20.167 11.212 -1.343 1.00 25.00 C ATOM 1088 C ARG A 71 19.298 11.628 -2.513 1.00 25.00 C ATOM 1089 O ARG A 71 18.186 11.147 -2.697 1.00 25.00 O ATOM 1090 CB ARG A 71 19.822 12.022 -0.092 1.00 25.00 C ATOM 1091 CG ARG A 71 19.802 13.544 -0.257 1.00 25.00 C ATOM 1092 CD ARG A 71 20.081 14.251 1.055 1.00 25.00 C ATOM 1093 NE ARG A 71 21.493 14.086 1.447 1.00 25.00 N ATOM 1094 CZ ARG A 71 22.034 14.519 2.577 1.00 25.00 C ATOM 1095 NH1 ARG A 71 21.350 15.169 3.486 1.00 25.00 N ATOM 1096 NH2 ARG A 71 23.290 14.292 2.788 1.00 25.00 N ATOM 0 H ARG A 71 22.031 12.198 -1.298 1.00 25.00 H new ATOM 0 HA ARG A 71 19.962 10.159 -1.148 1.00 25.00 H new ATOM 0 HB2 ARG A 71 18.842 11.703 0.263 1.00 25.00 H new ATOM 0 HB3 ARG A 71 20.541 11.771 0.688 1.00 25.00 H new ATOM 0 HG2 ARG A 71 20.546 13.840 -0.996 1.00 25.00 H new ATOM 0 HG3 ARG A 71 18.830 13.856 -0.640 1.00 25.00 H new ATOM 0 HD2 ARG A 71 19.847 15.311 0.959 1.00 25.00 H new ATOM 0 HD3 ARG A 71 19.433 13.850 1.835 1.00 25.00 H new ATOM 0 HE ARG A 71 22.105 13.597 0.793 1.00 25.00 H new ATOM 0 HH11 ARG A 71 20.359 15.361 3.338 1.00 25.00 H new ATOM 0 HH12 ARG A 71 21.808 15.483 4.341 1.00 25.00 H new ATOM 0 HH21 ARG A 71 23.841 13.790 2.092 1.00 25.00 H new ATOM 0 HH22 ARG A 71 23.729 14.615 3.650 1.00 25.00 H new ATOM 1110 N GLU A 72 19.815 12.542 -3.305 1.00 25.00 N ATOM 1111 CA GLU A 72 19.070 13.049 -4.457 1.00 25.00 C ATOM 1112 C GLU A 72 18.987 11.987 -5.537 1.00 25.00 C ATOM 1113 O GLU A 72 17.972 11.876 -6.210 1.00 25.00 O ATOM 1114 CB GLU A 72 19.701 14.320 -5.030 1.00 25.00 C ATOM 1115 CG GLU A 72 18.865 15.577 -4.790 1.00 25.00 C ATOM 1116 CD GLU A 72 18.763 15.970 -3.315 1.00 25.00 C ATOM 1117 OE1 GLU A 72 17.776 15.553 -2.658 1.00 25.00 O ATOM 1118 OE2 GLU A 72 19.584 16.790 -2.845 1.00 25.00 O ATOM 0 H GLU A 72 20.741 12.952 -3.181 1.00 25.00 H new ATOM 0 HA GLU A 72 18.067 13.299 -4.111 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.687 14.459 -4.586 1.00 25.00 H new ATOM 0 HB3 GLU A 72 19.849 14.191 -6.102 1.00 25.00 H new ATOM 0 HG2 GLU A 72 19.300 16.405 -5.349 1.00 25.00 H new ATOM 0 HG3 GLU A 72 17.862 15.418 -5.185 1.00 25.00 H new ATOM 1125 N GLN A 73 20.029 11.178 -5.668 1.00 25.00 N ATOM 1126 CA GLN A 73 20.048 10.095 -6.646 1.00 25.00 C ATOM 1127 C GLN A 73 18.891 9.139 -6.417 1.00 25.00 C ATOM 1128 O GLN A 73 18.285 8.668 -7.367 1.00 25.00 O ATOM 1129 CB GLN A 73 21.369 9.329 -6.600 1.00 25.00 C ATOM 1130 CG GLN A 73 22.464 9.987 -7.442 1.00 25.00 C ATOM 1131 CD GLN A 73 23.760 9.204 -7.443 1.00 25.00 C ATOM 1132 OE1 GLN A 73 23.919 8.234 -6.714 1.00 25.00 O ATOM 1133 NE2 GLN A 73 24.677 9.604 -8.275 1.00 25.00 N ATOM 0 H GLN A 73 20.878 11.251 -5.107 1.00 25.00 H new ATOM 0 HA GLN A 73 19.944 10.546 -7.633 1.00 25.00 H new ATOM 0 HB2 GLN A 73 21.706 9.256 -5.566 1.00 25.00 H new ATOM 0 HB3 GLN A 73 21.206 8.311 -6.954 1.00 25.00 H new ATOM 0 HG2 GLN A 73 22.111 10.095 -8.467 1.00 25.00 H new ATOM 0 HG3 GLN A 73 22.653 10.991 -7.062 1.00 25.00 H new ATOM 0 HE21 GLN A 73 24.509 10.417 -8.867 1.00 25.00 H new ATOM 0 HE22 GLN A 73 25.564 9.104 -8.335 1.00 25.00 H new ATOM 1142 N GLU A 74 18.544 8.892 -5.164 1.00 25.00 N ATOM 1143 CA GLU A 74 17.422 8.010 -4.845 1.00 25.00 C ATOM 1144 C GLU A 74 16.112 8.607 -5.366 1.00 25.00 C ATOM 1145 O GLU A 74 15.247 7.903 -5.876 1.00 25.00 O ATOM 1146 CB GLU A 74 17.304 7.824 -3.329 1.00 25.00 C ATOM 1147 CG GLU A 74 18.569 7.301 -2.650 1.00 25.00 C ATOM 1148 CD GLU A 74 18.404 7.210 -1.135 1.00 25.00 C ATOM 1149 OE1 GLU A 74 17.552 6.420 -0.674 1.00 25.00 O ATOM 1150 OE2 GLU A 74 19.110 7.945 -0.408 1.00 25.00 O ATOM 0 H GLU A 74 19.018 9.286 -4.351 1.00 25.00 H new ATOM 0 HA GLU A 74 17.605 7.047 -5.321 1.00 25.00 H new ATOM 0 HB2 GLU A 74 17.035 8.780 -2.879 1.00 25.00 H new ATOM 0 HB3 GLU A 74 16.486 7.134 -3.124 1.00 25.00 H new ATOM 0 HG2 GLU A 74 18.815 6.317 -3.048 1.00 25.00 H new ATOM 0 HG3 GLU A 74 19.406 7.958 -2.885 1.00 25.00 H new ATOM 1157 N ARG A 75 15.976 9.917 -5.217 1.00 25.00 N ATOM 1158 CA ARG A 75 14.750 10.623 -5.606 1.00 25.00 C ATOM 1159 C ARG A 75 14.567 10.706 -7.122 1.00 25.00 C ATOM 1160 O ARG A 75 13.471 10.518 -7.634 1.00 25.00 O ATOM 1161 CB ARG A 75 14.772 12.031 -5.030 1.00 25.00 C ATOM 1162 CG ARG A 75 14.829 12.055 -3.512 1.00 25.00 C ATOM 1163 CD ARG A 75 15.095 13.450 -3.036 1.00 25.00 C ATOM 1164 NE ARG A 75 13.965 14.345 -3.328 1.00 25.00 N ATOM 1165 CZ ARG A 75 13.994 15.670 -3.240 1.00 25.00 C ATOM 1166 NH1 ARG A 75 15.067 16.334 -2.892 1.00 25.00 N ATOM 1167 NH2 ARG A 75 12.913 16.344 -3.520 1.00 25.00 N ATOM 0 H ARG A 75 16.700 10.521 -4.828 1.00 25.00 H new ATOM 0 HA ARG A 75 13.912 10.051 -5.207 1.00 25.00 H new ATOM 0 HB2 ARG A 75 15.634 12.566 -5.428 1.00 25.00 H new ATOM 0 HB3 ARG A 75 13.883 12.567 -5.362 1.00 25.00 H new ATOM 0 HG2 ARG A 75 13.888 11.693 -3.098 1.00 25.00 H new ATOM 0 HG3 ARG A 75 15.612 11.385 -3.158 1.00 25.00 H new ATOM 0 HD2 ARG A 75 15.284 13.439 -1.963 1.00 25.00 H new ATOM 0 HD3 ARG A 75 15.997 13.833 -3.514 1.00 25.00 H new ATOM 0 HE ARG A 75 13.089 13.914 -3.622 1.00 25.00 H new ATOM 0 HH11 ARG A 75 15.929 15.833 -2.675 1.00 25.00 H new ATOM 0 HH12 ARG A 75 15.042 17.352 -2.838 1.00 25.00 H new ATOM 0 HH21 ARG A 75 12.064 15.853 -3.801 1.00 25.00 H new ATOM 0 HH22 ARG A 75 12.916 17.362 -3.458 1.00 25.00 H new ATOM 1181 N ILE A 76 15.645 11.035 -7.818 1.00 25.00 N ATOM 1182 CA ILE A 76 15.627 11.224 -9.278 1.00 25.00 C ATOM 1183 C ILE A 76 15.561 9.904 -10.030 1.00 25.00 C ATOM 1184 O ILE A 76 15.253 9.879 -11.225 1.00 25.00 O ATOM 1185 CB ILE A 76 16.824 12.072 -9.774 1.00 25.00 C ATOM 1186 CG1 ILE A 76 18.137 11.298 -9.588 1.00 25.00 C ATOM 1187 CG2 ILE A 76 16.827 13.445 -9.043 1.00 25.00 C ATOM 1188 CD1 ILE A 76 19.404 12.102 -9.854 1.00 25.00 C ATOM 0 H ILE A 76 16.562 11.181 -7.395 1.00 25.00 H new ATOM 0 HA ILE A 76 14.713 11.777 -9.496 1.00 25.00 H new ATOM 0 HB ILE A 76 16.726 12.270 -10.841 1.00 25.00 H new ATOM 0 HG12 ILE A 76 18.175 10.917 -8.568 1.00 25.00 H new ATOM 0 HG13 ILE A 76 18.128 10.433 -10.251 1.00 25.00 H new ATOM 0 HG21 ILE A 76 17.670 14.041 -9.392 1.00 25.00 H new ATOM 0 HG22 ILE A 76 15.897 13.972 -9.255 1.00 25.00 H new ATOM 0 HG23 ILE A 76 16.917 13.285 -7.969 1.00 25.00 H new ATOM 0 HD11 ILE A 76 20.277 11.468 -9.696 1.00 25.00 H new ATOM 0 HD12 ILE A 76 19.398 12.461 -10.883 1.00 25.00 H new ATOM 0 HD13 ILE A 76 19.445 12.952 -9.173 1.00 25.00 H new ATOM 1200 N ARG A 77 15.901 8.809 -9.370 1.00 25.00 N ATOM 1201 CA ARG A 77 15.858 7.458 -9.952 1.00 25.00 C ATOM 1202 C ARG A 77 14.480 7.036 -10.523 1.00 25.00 C ATOM 1203 O ARG A 77 14.361 5.940 -11.102 1.00 25.00 O ATOM 1204 CB ARG A 77 16.423 6.409 -8.981 1.00 25.00 C ATOM 1205 CG ARG A 77 17.609 5.596 -9.589 1.00 25.00 C ATOM 1206 CD ARG A 77 18.974 6.311 -9.538 1.00 25.00 C ATOM 1207 NE ARG A 77 19.110 7.371 -10.552 1.00 25.00 N ATOM 1208 CZ ARG A 77 20.173 8.147 -10.715 1.00 25.00 C ATOM 1209 NH1 ARG A 77 21.249 8.036 -9.987 1.00 25.00 N ATOM 1210 NH2 ARG A 77 20.158 9.058 -11.638 1.00 25.00 N ATOM 0 H ARG A 77 16.220 8.823 -8.401 1.00 25.00 H new ATOM 0 HA ARG A 77 16.510 7.507 -10.824 1.00 25.00 H new ATOM 0 HB2 ARG A 77 16.759 6.907 -8.071 1.00 25.00 H new ATOM 0 HB3 ARG A 77 15.627 5.722 -8.693 1.00 25.00 H new ATOM 0 HG2 ARG A 77 17.691 4.647 -9.058 1.00 25.00 H new ATOM 0 HG3 ARG A 77 17.376 5.361 -10.628 1.00 25.00 H new ATOM 0 HD2 ARG A 77 19.114 6.744 -8.548 1.00 25.00 H new ATOM 0 HD3 ARG A 77 19.767 5.577 -9.680 1.00 25.00 H new ATOM 0 HE ARG A 77 18.321 7.520 -11.181 1.00 25.00 H new ATOM 0 HH11 ARG A 77 21.298 7.328 -9.254 1.00 25.00 H new ATOM 0 HH12 ARG A 77 22.042 8.657 -10.151 1.00 25.00 H new ATOM 0 HH21 ARG A 77 19.335 9.172 -12.229 1.00 25.00 H new ATOM 0 HH22 ARG A 77 20.970 9.661 -11.773 1.00 25.00 H new ATOM 1224 N LEU A 78 13.428 7.803 -10.259 1.00 25.00 N ATOM 1225 CA LEU A 78 12.118 7.572 -10.844 1.00 25.00 C ATOM 1226 C LEU A 78 11.927 8.578 -11.988 1.00 25.00 C ATOM 1227 O LEU A 78 12.154 9.773 -11.830 1.00 25.00 O ATOM 1228 CB LEU A 78 11.059 7.760 -9.770 1.00 25.00 C ATOM 1229 CG LEU A 78 9.583 7.655 -10.162 1.00 25.00 C ATOM 1230 CD1 LEU A 78 9.223 6.319 -10.809 1.00 25.00 C ATOM 1231 CD2 LEU A 78 8.729 7.870 -8.917 1.00 25.00 C ATOM 0 H LEU A 78 13.463 8.605 -9.630 1.00 25.00 H new ATOM 0 HA LEU A 78 12.031 6.559 -11.237 1.00 25.00 H new ATOM 0 HB2 LEU A 78 11.246 7.023 -8.990 1.00 25.00 H new ATOM 0 HB3 LEU A 78 11.213 8.742 -9.324 1.00 25.00 H new ATOM 0 HG LEU A 78 9.388 8.423 -10.911 1.00 25.00 H new ATOM 0 HD11 LEU A 78 8.163 6.311 -11.062 1.00 25.00 H new ATOM 0 HD12 LEU A 78 9.813 6.183 -11.715 1.00 25.00 H new ATOM 0 HD13 LEU A 78 9.436 5.508 -10.112 1.00 25.00 H new ATOM 0 HD21 LEU A 78 7.674 7.798 -9.182 1.00 25.00 H new ATOM 0 HD22 LEU A 78 8.969 7.109 -8.175 1.00 25.00 H new ATOM 0 HD23 LEU A 78 8.932 8.857 -8.503 1.00 25.00 H new ATOM 1243 N PHE A 79 11.515 8.036 -13.124 1.00 25.00 N ATOM 1244 CA PHE A 79 11.385 8.717 -14.405 1.00 25.00 C ATOM 1245 C PHE A 79 12.665 9.432 -14.887 1.00 25.00 C ATOM 1246 O PHE A 79 13.697 9.353 -14.239 1.00 25.00 O ATOM 1247 CB PHE A 79 10.224 9.675 -14.332 1.00 25.00 C ATOM 1248 CG PHE A 79 8.917 9.027 -13.983 1.00 25.00 C ATOM 1249 CD1 PHE A 79 8.229 9.420 -12.828 1.00 25.00 C ATOM 1250 CD2 PHE A 79 8.359 8.033 -14.810 1.00 25.00 C ATOM 1251 CE1 PHE A 79 6.974 8.839 -12.494 1.00 25.00 C ATOM 1252 CE2 PHE A 79 7.117 7.431 -14.483 1.00 25.00 C ATOM 1253 CZ PHE A 79 6.420 7.839 -13.325 1.00 25.00 C ATOM 0 H PHE A 79 11.247 7.053 -13.181 1.00 25.00 H new ATOM 0 HA PHE A 79 11.204 7.947 -15.155 1.00 25.00 H new ATOM 0 HB2 PHE A 79 10.446 10.443 -13.591 1.00 25.00 H new ATOM 0 HB3 PHE A 79 10.122 10.180 -15.293 1.00 25.00 H new ATOM 0 HD1 PHE A 79 8.656 10.173 -12.183 1.00 25.00 H new ATOM 0 HD2 PHE A 79 8.883 7.726 -15.703 1.00 25.00 H new ATOM 0 HE1 PHE A 79 6.446 9.161 -11.608 1.00 25.00 H new ATOM 0 HE2 PHE A 79 6.705 6.661 -15.119 1.00 25.00 H new ATOM 0 HZ PHE A 79 5.470 7.390 -13.076 1.00 25.00 H new ATOM 1263 N SER A 80 12.570 10.084 -16.049 1.00 25.00 N ATOM 1264 CA SER A 80 13.688 10.805 -16.693 1.00 25.00 C ATOM 1265 C SER A 80 14.850 9.885 -17.104 1.00 25.00 C ATOM 1266 O SER A 80 15.634 9.425 -16.277 1.00 25.00 O ATOM 1267 CB SER A 80 14.188 11.937 -15.786 1.00 25.00 C ATOM 1268 OG SER A 80 15.008 12.837 -16.504 1.00 25.00 O ATOM 0 H SER A 80 11.702 10.131 -16.583 1.00 25.00 H new ATOM 0 HA SER A 80 13.293 11.228 -17.617 1.00 25.00 H new ATOM 0 HB2 SER A 80 13.337 12.472 -15.364 1.00 25.00 H new ATOM 0 HB3 SER A 80 14.748 11.518 -14.950 1.00 25.00 H new ATOM 0 HG SER A 80 15.313 13.550 -15.905 1.00 25.00 H new ATOM 1274 N ALA A 81 14.942 9.596 -18.394 1.00 25.00 N ATOM 1275 CA ALA A 81 15.980 8.699 -18.913 1.00 25.00 C ATOM 1276 C ALA A 81 16.466 9.215 -20.261 1.00 25.00 C ATOM 1277 O ALA A 81 16.945 8.454 -21.097 1.00 25.00 O ATOM 1278 CB ALA A 81 15.407 7.280 -19.063 1.00 25.00 C ATOM 0 H ALA A 81 14.313 9.967 -19.106 1.00 25.00 H new ATOM 0 HA ALA A 81 16.820 8.669 -18.219 1.00 25.00 H new ATOM 0 HB1 ALA A 81 16.179 6.615 -19.449 1.00 25.00 H new ATOM 0 HB2 ALA A 81 15.069 6.919 -18.091 1.00 25.00 H new ATOM 0 HB3 ALA A 81 14.565 7.299 -19.755 1.00 25.00 H new ATOM 1284 N ASP A 82 16.217 10.490 -20.494 1.00 25.00 N ATOM 1285 CA ASP A 82 16.329 11.080 -21.821 1.00 25.00 C ATOM 1286 C ASP A 82 17.517 12.050 -21.960 1.00 25.00 C ATOM 1287 O ASP A 82 17.413 13.223 -21.592 1.00 25.00 O ATOM 1288 CB ASP A 82 15.013 11.829 -22.094 1.00 25.00 C ATOM 1289 CG ASP A 82 13.780 10.985 -21.754 1.00 25.00 C ATOM 1290 OD1 ASP A 82 13.388 10.939 -20.549 1.00 25.00 O ATOM 1291 OD2 ASP A 82 13.208 10.361 -22.669 1.00 25.00 O ATOM 0 H ASP A 82 15.931 11.149 -19.770 1.00 25.00 H new ATOM 0 HA ASP A 82 16.509 10.283 -22.542 1.00 25.00 H new ATOM 0 HB2 ASP A 82 14.993 12.749 -21.509 1.00 25.00 H new ATOM 0 HB3 ASP A 82 14.974 12.118 -23.144 1.00 25.00 H new ATOM 1296 N PRO A 83 18.661 11.583 -22.498 1.00 25.00 N ATOM 1297 CA PRO A 83 19.759 12.535 -22.691 1.00 25.00 C ATOM 1298 C PRO A 83 19.606 13.324 -23.992 1.00 25.00 C ATOM 1299 O PRO A 83 18.906 12.893 -24.909 1.00 25.00 O ATOM 1300 CB PRO A 83 20.978 11.622 -22.768 1.00 25.00 C ATOM 1301 CG PRO A 83 20.464 10.427 -23.472 1.00 25.00 C ATOM 1302 CD PRO A 83 19.048 10.230 -22.948 1.00 25.00 C ATOM 0 HA PRO A 83 19.810 13.285 -21.902 1.00 25.00 H new ATOM 0 HB2 PRO A 83 21.797 12.090 -23.315 1.00 25.00 H new ATOM 0 HB3 PRO A 83 21.357 11.373 -21.777 1.00 25.00 H new ATOM 0 HG2 PRO A 83 20.467 10.575 -24.552 1.00 25.00 H new ATOM 0 HG3 PRO A 83 21.084 9.554 -23.269 1.00 25.00 H new ATOM 0 HD2 PRO A 83 18.380 9.858 -23.725 1.00 25.00 H new ATOM 0 HD3 PRO A 83 19.018 9.510 -22.130 1.00 25.00 H new ATOM 1310 N PHE A 84 20.292 14.454 -24.092 1.00 25.00 N ATOM 1311 CA PHE A 84 20.248 15.274 -25.310 1.00 25.00 C ATOM 1312 C PHE A 84 21.632 15.741 -25.723 1.00 25.00 C ATOM 1313 O PHE A 84 21.792 16.576 -26.600 1.00 25.00 O ATOM 1314 CB PHE A 84 19.320 16.475 -25.103 1.00 25.00 C ATOM 1315 CG PHE A 84 17.910 16.091 -24.742 1.00 25.00 C ATOM 1316 CD1 PHE A 84 17.014 15.652 -25.735 1.00 25.00 C ATOM 1317 CD2 PHE A 84 17.474 16.138 -23.403 1.00 25.00 C ATOM 1318 CE1 PHE A 84 15.692 15.264 -25.400 1.00 25.00 C ATOM 1319 CE2 PHE A 84 16.155 15.753 -23.056 1.00 25.00 C ATOM 1320 CZ PHE A 84 15.264 15.316 -24.057 1.00 25.00 C ATOM 0 H PHE A 84 20.885 14.829 -23.352 1.00 25.00 H new ATOM 0 HA PHE A 84 19.857 14.653 -26.116 1.00 25.00 H new ATOM 0 HB2 PHE A 84 19.729 17.108 -24.315 1.00 25.00 H new ATOM 0 HB3 PHE A 84 19.303 17.072 -26.015 1.00 25.00 H new ATOM 0 HD1 PHE A 84 17.337 15.610 -26.765 1.00 25.00 H new ATOM 0 HD2 PHE A 84 18.153 16.471 -22.632 1.00 25.00 H new ATOM 0 HE1 PHE A 84 15.014 14.929 -26.171 1.00 25.00 H new ATOM 0 HE2 PHE A 84 15.833 15.794 -22.026 1.00 25.00 H new ATOM 0 HZ PHE A 84 14.258 15.022 -23.797 1.00 25.00 H new ATOM 1330 N ASP A 85 22.625 15.156 -25.080 1.00 25.00 N ATOM 1331 CA ASP A 85 24.028 15.486 -25.308 1.00 25.00 C ATOM 1332 C ASP A 85 24.803 14.199 -25.126 1.00 25.00 C ATOM 1333 O ASP A 85 25.041 13.761 -24.007 1.00 25.00 O ATOM 1334 CB ASP A 85 24.515 16.530 -24.301 1.00 25.00 C ATOM 1335 CG ASP A 85 24.485 17.933 -24.862 1.00 25.00 C ATOM 1336 OD1 ASP A 85 25.109 18.152 -25.923 1.00 25.00 O ATOM 1337 OD2 ASP A 85 23.868 18.822 -24.235 1.00 25.00 O ATOM 0 H ASP A 85 22.484 14.431 -24.377 1.00 25.00 H new ATOM 0 HA ASP A 85 24.168 15.906 -26.304 1.00 25.00 H new ATOM 0 HB2 ASP A 85 23.893 16.486 -23.407 1.00 25.00 H new ATOM 0 HB3 ASP A 85 25.532 16.287 -23.993 1.00 25.00 H new ATOM 1342 N LEU A 86 25.129 13.550 -26.231 1.00 25.00 N ATOM 1343 CA LEU A 86 25.812 12.261 -26.176 1.00 25.00 C ATOM 1344 C LEU A 86 27.283 12.442 -25.818 1.00 25.00 C ATOM 1345 O LEU A 86 27.856 11.638 -25.094 1.00 25.00 O ATOM 1346 CB LEU A 86 25.700 11.552 -27.528 1.00 25.00 C ATOM 1347 CG LEU A 86 24.279 11.197 -28.001 1.00 25.00 C ATOM 1348 CD1 LEU A 86 24.349 10.620 -29.415 1.00 25.00 C ATOM 1349 CD2 LEU A 86 23.598 10.189 -27.064 1.00 25.00 C ATOM 0 H LEU A 86 24.935 13.889 -27.173 1.00 25.00 H new ATOM 0 HA LEU A 86 25.336 11.656 -25.405 1.00 25.00 H new ATOM 0 HB2 LEU A 86 26.163 12.185 -28.285 1.00 25.00 H new ATOM 0 HB3 LEU A 86 26.284 10.633 -27.481 1.00 25.00 H new ATOM 0 HG LEU A 86 23.682 12.109 -27.993 1.00 25.00 H new ATOM 0 HD11 LEU A 86 23.345 10.367 -29.755 1.00 25.00 H new ATOM 0 HD12 LEU A 86 24.784 11.358 -30.088 1.00 25.00 H new ATOM 0 HD13 LEU A 86 24.968 9.723 -29.412 1.00 25.00 H new ATOM 0 HD21 LEU A 86 22.597 9.966 -27.435 1.00 25.00 H new ATOM 0 HD22 LEU A 86 24.185 9.271 -27.029 1.00 25.00 H new ATOM 0 HD23 LEU A 86 23.528 10.613 -26.062 1.00 25.00 H new ATOM 1361 N GLU A 87 27.883 13.499 -26.345 1.00 25.00 N ATOM 1362 CA GLU A 87 29.305 13.765 -26.120 1.00 25.00 C ATOM 1363 C GLU A 87 29.511 14.428 -24.761 1.00 25.00 C ATOM 1364 O GLU A 87 30.538 14.254 -24.113 1.00 25.00 O ATOM 1365 CB GLU A 87 29.849 14.686 -27.219 1.00 25.00 C ATOM 1366 CG GLU A 87 29.425 14.301 -28.643 1.00 25.00 C ATOM 1367 CD GLU A 87 29.694 12.837 -28.981 1.00 25.00 C ATOM 1368 OE1 GLU A 87 30.856 12.390 -28.878 1.00 25.00 O ATOM 1369 OE2 GLU A 87 28.732 12.143 -29.381 1.00 25.00 O ATOM 0 H GLU A 87 27.412 14.188 -26.931 1.00 25.00 H new ATOM 0 HA GLU A 87 29.841 12.816 -26.143 1.00 25.00 H new ATOM 0 HB2 GLU A 87 29.517 15.705 -27.018 1.00 25.00 H new ATOM 0 HB3 GLU A 87 30.938 14.689 -27.166 1.00 25.00 H new ATOM 0 HG2 GLU A 87 28.361 14.505 -28.765 1.00 25.00 H new ATOM 0 HG3 GLU A 87 29.954 14.934 -29.355 1.00 25.00 H new ATOM 1376 N ALA A 88 28.505 15.206 -24.365 1.00 25.00 N ATOM 1377 CA ALA A 88 28.459 15.927 -23.085 1.00 25.00 C ATOM 1378 C ALA A 88 29.674 16.837 -22.789 1.00 25.00 C ATOM 1379 O ALA A 88 29.924 17.197 -21.637 1.00 25.00 O ATOM 1380 CB ALA A 88 28.229 14.925 -21.937 1.00 25.00 C ATOM 0 H ALA A 88 27.675 15.359 -24.938 1.00 25.00 H new ATOM 0 HA ALA A 88 27.622 16.620 -23.167 1.00 25.00 H new ATOM 0 HB1 ALA A 88 28.195 15.460 -20.988 1.00 25.00 H new ATOM 0 HB2 ALA A 88 27.285 14.403 -22.093 1.00 25.00 H new ATOM 0 HB3 ALA A 88 29.044 14.202 -21.917 1.00 25.00 H new ATOM 1386 N GLN A 89 30.406 17.227 -23.822 1.00 25.00 N ATOM 1387 CA GLN A 89 31.544 18.128 -23.656 1.00 25.00 C ATOM 1388 C GLN A 89 31.050 19.577 -23.581 1.00 25.00 C ATOM 1389 O GLN A 89 30.092 19.949 -24.260 1.00 25.00 O ATOM 1390 CB GLN A 89 32.548 17.955 -24.809 1.00 25.00 C ATOM 1391 CG GLN A 89 31.984 18.245 -26.206 1.00 25.00 C ATOM 1392 CD GLN A 89 33.050 18.198 -27.279 1.00 25.00 C ATOM 1393 OE1 GLN A 89 33.776 17.229 -27.410 1.00 25.00 O ATOM 1394 NE2 GLN A 89 33.153 19.252 -28.043 1.00 25.00 N ATOM 0 H GLN A 89 30.235 16.936 -24.784 1.00 25.00 H new ATOM 0 HA GLN A 89 32.056 17.881 -22.726 1.00 25.00 H new ATOM 0 HB2 GLN A 89 33.398 18.614 -24.633 1.00 25.00 H new ATOM 0 HB3 GLN A 89 32.927 16.933 -24.791 1.00 25.00 H new ATOM 0 HG2 GLN A 89 31.206 17.518 -26.439 1.00 25.00 H new ATOM 0 HG3 GLN A 89 31.513 19.228 -26.208 1.00 25.00 H new ATOM 0 HE21 GLN A 89 32.527 20.046 -27.904 1.00 25.00 H new ATOM 0 HE22 GLN A 89 33.859 19.282 -28.779 1.00 25.00 H new ATOM 1403 N ALA A 90 31.703 20.389 -22.759 1.00 25.00 N ATOM 1404 CA ALA A 90 31.344 21.796 -22.603 1.00 25.00 C ATOM 1405 C ALA A 90 32.543 22.538 -22.014 1.00 25.00 C ATOM 1406 O ALA A 90 33.403 21.908 -21.392 1.00 25.00 O ATOM 1407 CB ALA A 90 30.122 21.929 -21.666 1.00 25.00 C ATOM 0 H ALA A 90 32.492 20.095 -22.184 1.00 25.00 H new ATOM 0 HA ALA A 90 31.082 22.224 -23.570 1.00 25.00 H new ATOM 0 HB1 ALA A 90 29.861 22.982 -21.555 1.00 25.00 H new ATOM 0 HB2 ALA A 90 29.277 21.389 -22.092 1.00 25.00 H new ATOM 0 HB3 ALA A 90 30.365 21.511 -20.689 1.00 25.00 H new ATOM 1413 N LYS A 91 32.532 23.868 -22.159 1.00 25.00 N ATOM 1414 CA LYS A 91 33.547 24.780 -21.621 1.00 25.00 C ATOM 1415 C LYS A 91 34.957 24.545 -22.197 1.00 25.00 C ATOM 1416 O LYS A 91 35.186 23.584 -22.914 1.00 25.00 O ATOM 1417 CB LYS A 91 33.527 24.648 -20.101 1.00 25.00 C ATOM 1418 CG LYS A 91 33.779 25.922 -19.320 1.00 25.00 C ATOM 1419 CD LYS A 91 33.538 25.648 -17.847 1.00 25.00 C ATOM 1420 CE LYS A 91 32.103 25.984 -17.418 1.00 25.00 C ATOM 1421 NZ LYS A 91 31.893 25.721 -15.948 1.00 25.00 N ATOM 0 H LYS A 91 31.794 24.354 -22.669 1.00 25.00 H new ATOM 0 HA LYS A 91 33.299 25.797 -21.923 1.00 25.00 H new ATOM 0 HB2 LYS A 91 32.557 24.249 -19.804 1.00 25.00 H new ATOM 0 HB3 LYS A 91 34.277 23.913 -19.810 1.00 25.00 H new ATOM 0 HG2 LYS A 91 34.801 26.265 -19.478 1.00 25.00 H new ATOM 0 HG3 LYS A 91 33.119 26.716 -19.669 1.00 25.00 H new ATOM 0 HD2 LYS A 91 33.741 24.598 -17.637 1.00 25.00 H new ATOM 0 HD3 LYS A 91 34.239 26.233 -17.252 1.00 25.00 H new ATOM 0 HE2 LYS A 91 31.892 27.031 -17.636 1.00 25.00 H new ATOM 0 HE3 LYS A 91 31.399 25.389 -18.000 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 31.118 26.318 -15.596 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 31.651 24.720 -15.806 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 32.765 25.944 -15.427 1.00 25.00 H new ATOM 1435 N ILE A 92 35.867 25.452 -21.847 1.00 25.00 N ATOM 1436 CA ILE A 92 37.276 25.433 -22.240 1.00 25.00 C ATOM 1437 C ILE A 92 37.439 25.609 -23.750 1.00 25.00 C ATOM 1438 O ILE A 92 37.388 24.676 -24.547 1.00 25.00 O ATOM 1439 CB ILE A 92 38.002 24.190 -21.702 1.00 25.00 C ATOM 1440 CG1 ILE A 92 37.813 24.101 -20.168 1.00 25.00 C ATOM 1441 CG2 ILE A 92 39.518 24.231 -22.078 1.00 25.00 C ATOM 1442 CD1 ILE A 92 38.420 22.849 -19.512 1.00 25.00 C ATOM 0 H ILE A 92 35.634 26.252 -21.259 1.00 25.00 H new ATOM 0 HA ILE A 92 37.760 26.292 -21.775 1.00 25.00 H new ATOM 0 HB ILE A 92 37.572 23.300 -22.160 1.00 25.00 H new ATOM 0 HG12 ILE A 92 38.257 24.985 -19.710 1.00 25.00 H new ATOM 0 HG13 ILE A 92 36.746 24.129 -19.946 1.00 25.00 H new ATOM 0 HG21 ILE A 92 40.014 23.342 -21.688 1.00 25.00 H new ATOM 0 HG22 ILE A 92 39.623 24.259 -23.163 1.00 25.00 H new ATOM 0 HG23 ILE A 92 39.976 25.121 -21.646 1.00 25.00 H new ATOM 0 HD11 ILE A 92 38.237 22.876 -18.438 1.00 25.00 H new ATOM 0 HD12 ILE A 92 37.960 21.957 -19.936 1.00 25.00 H new ATOM 0 HD13 ILE A 92 39.494 22.826 -19.697 1.00 25.00 H new ATOM 1454 N GLU A 93 37.622 26.863 -24.112 1.00 25.00 N ATOM 1455 CA GLU A 93 37.721 27.301 -25.492 1.00 25.00 C ATOM 1456 C GLU A 93 39.045 28.055 -25.666 1.00 25.00 C ATOM 1457 O GLU A 93 39.570 28.626 -24.712 1.00 25.00 O ATOM 1458 CB GLU A 93 36.513 28.196 -25.828 1.00 25.00 C ATOM 1459 CG GLU A 93 36.128 29.232 -24.732 1.00 25.00 C ATOM 1460 CD GLU A 93 35.405 28.607 -23.517 1.00 25.00 C ATOM 1461 OE1 GLU A 93 34.283 28.076 -23.679 1.00 25.00 O ATOM 1462 OE2 GLU A 93 35.977 28.636 -22.398 1.00 25.00 O ATOM 0 H GLU A 93 37.708 27.625 -23.439 1.00 25.00 H new ATOM 0 HA GLU A 93 37.709 26.451 -26.175 1.00 25.00 H new ATOM 0 HB2 GLU A 93 36.725 28.732 -26.753 1.00 25.00 H new ATOM 0 HB3 GLU A 93 35.651 27.557 -26.020 1.00 25.00 H new ATOM 0 HG2 GLU A 93 37.031 29.736 -24.387 1.00 25.00 H new ATOM 0 HG3 GLU A 93 35.486 29.994 -25.174 1.00 25.00 H new ATOM 1469 N GLU A 94 39.617 28.003 -26.862 1.00 25.00 N ATOM 1470 CA GLU A 94 40.931 28.606 -27.103 1.00 25.00 C ATOM 1471 C GLU A 94 40.878 30.071 -27.531 1.00 25.00 C ATOM 1472 O GLU A 94 40.282 30.416 -28.550 1.00 25.00 O ATOM 1473 CB GLU A 94 41.681 27.847 -28.202 1.00 25.00 C ATOM 1474 CG GLU A 94 42.061 26.421 -27.846 1.00 25.00 C ATOM 1475 CD GLU A 94 42.996 25.810 -28.886 1.00 25.00 C ATOM 1476 OE1 GLU A 94 44.128 25.422 -28.517 1.00 25.00 O ATOM 1477 OE2 GLU A 94 42.616 25.752 -30.077 1.00 25.00 O ATOM 0 H GLU A 94 39.200 27.554 -27.677 1.00 25.00 H new ATOM 0 HA GLU A 94 41.441 28.546 -26.141 1.00 25.00 H new ATOM 0 HB2 GLU A 94 41.062 27.830 -29.099 1.00 25.00 H new ATOM 0 HB3 GLU A 94 42.588 28.398 -28.451 1.00 25.00 H new ATOM 0 HG2 GLU A 94 42.544 26.406 -26.869 1.00 25.00 H new ATOM 0 HG3 GLU A 94 41.160 25.813 -27.765 1.00 25.00 H new ATOM 1484 N ASP A 95 41.624 30.902 -26.818 1.00 25.00 N ATOM 1485 CA ASP A 95 41.911 32.267 -27.257 1.00 25.00 C ATOM 1486 C ASP A 95 43.406 32.495 -27.086 1.00 25.00 C ATOM 1487 O ASP A 95 43.893 32.822 -26.006 1.00 25.00 O ATOM 1488 CB ASP A 95 41.126 33.329 -26.484 1.00 25.00 C ATOM 1489 CG ASP A 95 41.385 34.740 -27.023 1.00 25.00 C ATOM 1490 OD1 ASP A 95 42.209 34.880 -27.967 1.00 25.00 O ATOM 1491 OD2 ASP A 95 40.767 35.704 -26.528 1.00 25.00 O ATOM 0 H ASP A 95 42.047 30.655 -25.923 1.00 25.00 H new ATOM 0 HA ASP A 95 41.602 32.369 -28.297 1.00 25.00 H new ATOM 0 HB2 ASP A 95 40.060 33.108 -26.545 1.00 25.00 H new ATOM 0 HB3 ASP A 95 41.401 33.287 -25.430 1.00 25.00 H new ATOM 1496 N ILE A 96 44.135 32.283 -28.168 1.00 25.00 N ATOM 1497 CA ILE A 96 45.587 32.445 -28.175 1.00 25.00 C ATOM 1498 C ILE A 96 45.909 33.655 -29.058 1.00 25.00 C ATOM 1499 O ILE A 96 46.984 33.757 -29.660 1.00 25.00 O ATOM 1500 CB ILE A 96 46.325 31.149 -28.682 1.00 25.00 C ATOM 1501 CG1 ILE A 96 45.529 29.876 -28.291 1.00 25.00 C ATOM 1502 CG2 ILE A 96 47.762 31.086 -28.074 1.00 25.00 C ATOM 1503 CD1 ILE A 96 46.147 28.553 -28.779 1.00 25.00 C ATOM 0 H ILE A 96 43.744 31.995 -29.065 1.00 25.00 H new ATOM 0 HA ILE A 96 45.945 32.609 -27.159 1.00 25.00 H new ATOM 0 HB ILE A 96 46.394 31.192 -29.769 1.00 25.00 H new ATOM 0 HG12 ILE A 96 45.439 29.840 -27.205 1.00 25.00 H new ATOM 0 HG13 ILE A 96 44.519 29.959 -28.692 1.00 25.00 H new ATOM 0 HG21 ILE A 96 48.268 30.188 -28.428 1.00 25.00 H new ATOM 0 HG22 ILE A 96 48.327 31.966 -28.383 1.00 25.00 H new ATOM 0 HG23 ILE A 96 47.696 31.060 -26.986 1.00 25.00 H new ATOM 0 HD11 ILE A 96 45.522 27.719 -28.459 1.00 25.00 H new ATOM 0 HD12 ILE A 96 46.211 28.561 -29.867 1.00 25.00 H new ATOM 0 HD13 ILE A 96 47.146 28.441 -28.357 1.00 25.00 H new ATOM 1515 N ARG A 97 44.960 34.581 -29.151 1.00 25.00 N ATOM 1516 CA ARG A 97 45.108 35.770 -30.001 1.00 25.00 C ATOM 1517 C ARG A 97 45.909 36.867 -29.279 1.00 25.00 C ATOM 1518 O ARG A 97 45.468 38.007 -29.130 1.00 25.00 O ATOM 1519 CB ARG A 97 43.714 36.276 -30.403 1.00 25.00 C ATOM 1520 CG ARG A 97 43.709 37.318 -31.517 1.00 25.00 C ATOM 1521 CD ARG A 97 42.881 38.527 -31.094 1.00 25.00 C ATOM 1522 NE ARG A 97 43.201 39.719 -31.897 1.00 25.00 N ATOM 1523 CZ ARG A 97 44.193 40.570 -31.644 1.00 25.00 C ATOM 1524 NH1 ARG A 97 45.023 40.415 -30.642 1.00 25.00 N ATOM 1525 NH2 ARG A 97 44.358 41.599 -32.428 1.00 25.00 N ATOM 0 H ARG A 97 44.074 34.535 -28.648 1.00 25.00 H new ATOM 0 HA ARG A 97 45.665 35.504 -30.899 1.00 25.00 H new ATOM 0 HB2 ARG A 97 43.111 35.425 -30.718 1.00 25.00 H new ATOM 0 HB3 ARG A 97 43.230 36.702 -29.524 1.00 25.00 H new ATOM 0 HG2 ARG A 97 44.730 37.626 -31.743 1.00 25.00 H new ATOM 0 HG3 ARG A 97 43.298 36.886 -32.429 1.00 25.00 H new ATOM 0 HD2 ARG A 97 41.821 38.295 -31.196 1.00 25.00 H new ATOM 0 HD3 ARG A 97 43.061 38.740 -30.040 1.00 25.00 H new ATOM 0 HE ARG A 97 42.616 39.908 -32.711 1.00 25.00 H new ATOM 0 HH11 ARG A 97 44.924 39.616 -30.016 1.00 25.00 H new ATOM 0 HH12 ARG A 97 45.769 41.094 -30.488 1.00 25.00 H new ATOM 0 HH21 ARG A 97 43.732 41.742 -33.221 1.00 25.00 H new ATOM 0 HH22 ARG A 97 45.113 42.261 -32.249 1.00 25.00 H new ATOM 1539 N GLN A 98 47.136 36.502 -28.882 1.00 25.00 N ATOM 1540 CA GLN A 98 48.137 37.364 -28.210 1.00 25.00 C ATOM 1541 C GLN A 98 47.737 37.792 -26.788 1.00 25.00 C ATOM 1542 O GLN A 98 48.327 37.426 -25.800 1.00 25.00 O ATOM 1543 CB GLN A 98 48.573 38.557 -29.101 1.00 25.00 C ATOM 1544 CG GLN A 98 49.801 39.275 -28.514 1.00 25.00 C ATOM 1545 CD GLN A 98 50.279 40.352 -29.455 1.00 25.00 C ATOM 1546 OE1 GLN A 98 49.554 41.152 -29.992 1.00 25.00 O ATOM 1547 NE2 GLN A 98 51.581 40.369 -29.696 1.00 25.00 N ATOM 1548 OXT GLN A 98 46.753 38.626 -26.703 1.00 25.00 O ATOM 0 H GLN A 98 47.481 35.553 -29.025 1.00 25.00 H new ATOM 0 HA GLN A 98 49.018 36.737 -28.071 1.00 25.00 H new ATOM 0 HB2 GLN A 98 48.804 38.199 -30.104 1.00 25.00 H new ATOM 0 HB3 GLN A 98 47.748 39.263 -29.197 1.00 25.00 H new ATOM 0 HG2 GLN A 98 49.547 39.713 -27.549 1.00 25.00 H new ATOM 0 HG3 GLN A 98 50.601 38.556 -28.338 1.00 25.00 H new ATOM 0 HE21 GLN A 98 52.193 39.692 -29.241 1.00 25.00 H new ATOM 0 HE22 GLN A 98 51.972 41.060 -30.337 1.00 25.00 H new TER 1558 GLN A 98