USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1027 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 50 SER OG : rot 104:sc= -0.0195 USER MOD Set 1.2: A 111 HIS : no HE2:sc= -1.5 K(o=-1.5,f=-5.9!) USER MOD Set 2.1: A 17 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.208) USER MOD Set 2.2: A 27 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 1 GLY N :NH3+ -115:sc= 0.0581 (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 25 GLN : amide:sc= -2.99 K(o=-3,f=-13!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.116 K(o=-0.12,f=-1.5!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 30:sc= 0.0861 USER MOD Single : A 48 ASN : amide:sc= -6.53! C(o=-6.5!,f=-9.7!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.0895 X(o=-0.09,f=0) USER MOD Single : A 59 CYS SG : rot 150:sc= -0.962 USER MOD Single : A 60 GLN : amide:sc= -3.47! K(o=-3.5!,f=-0.67) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 70 GLN : amide:sc= -0.807 K(o=-0.81,f=-2.3!) USER MOD Single : A 72 GLN : amide:sc= 0.0895 K(o=0.09,f=-1.1) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.508 K(o=-0.51,f=-4.4!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 41:sc= 0.0586 USER MOD Single : A 89 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.24) USER MOD Single : A 95 ASN : amide:sc= -3.09! C(o=-3.1!,f=-1.3!) USER MOD Single : A 97 ASN : amide:sc= -0.0122 X(o=-0.012,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 48:sc= 0.177 USER MOD Single : A 109 TYR OH : rot 150:sc=-0.00371 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 115 SER OG : rot 29:sc= 0.355 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.3) USER MOD Single : A 124 ASN : amide:sc= -3.39 K(o=-3.4,f=-9.1!) USER MOD Single : A 129 SER OG : rot -83:sc= 1.26 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=-0.00024) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.915 -26.228 4.933 1.00 0.00 N ATOM 2 CA GLY A 1 -14.870 -26.386 6.014 1.00 0.00 C ATOM 3 C GLY A 1 -14.218 -26.853 7.300 1.00 0.00 C ATOM 4 O GLY A 1 -13.113 -27.396 7.282 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.860 -25.225 4.662 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.978 -26.553 5.247 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.221 -26.792 4.114 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.375 -25.436 6.190 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.635 -27.103 5.717 1.00 0.00 H new ATOM 8 N SER A 2 -14.902 -26.640 8.420 1.00 0.00 N ATOM 9 CA SER A 2 -14.380 -27.038 9.722 1.00 0.00 C ATOM 10 C SER A 2 -15.411 -27.856 10.493 1.00 0.00 C ATOM 11 O SER A 2 -15.129 -28.969 10.939 1.00 0.00 O ATOM 12 CB SER A 2 -13.980 -25.805 10.534 1.00 0.00 C ATOM 13 OG SER A 2 -12.930 -25.095 9.900 1.00 0.00 O ATOM 0 H SER A 2 -15.819 -26.194 8.452 1.00 0.00 H new ATOM 0 HA SER A 2 -13.498 -27.658 9.558 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.843 -25.151 10.657 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.666 -26.109 11.532 1.00 0.00 H new ATOM 0 HG SER A 2 -12.694 -24.311 10.438 1.00 0.00 H new ATOM 19 N SER A 3 -16.607 -27.297 10.646 1.00 0.00 N ATOM 20 CA SER A 3 -17.680 -27.972 11.367 1.00 0.00 C ATOM 21 C SER A 3 -17.268 -28.262 12.807 1.00 0.00 C ATOM 22 O SER A 3 -17.515 -29.349 13.328 1.00 0.00 O ATOM 23 CB SER A 3 -18.057 -29.274 10.660 1.00 0.00 C ATOM 24 OG SER A 3 -18.959 -29.033 9.594 1.00 0.00 O ATOM 0 H SER A 3 -16.858 -26.378 10.280 1.00 0.00 H new ATOM 0 HA SER A 3 -18.547 -27.311 11.382 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.158 -29.757 10.278 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.509 -29.962 11.375 1.00 0.00 H new ATOM 0 HG SER A 3 -19.183 -29.881 9.157 1.00 0.00 H new ATOM 30 N GLY A 4 -16.638 -27.281 13.446 1.00 0.00 N ATOM 31 CA GLY A 4 -16.202 -27.450 14.819 1.00 0.00 C ATOM 32 C GLY A 4 -14.700 -27.315 14.971 1.00 0.00 C ATOM 33 O GLY A 4 -13.981 -27.157 13.984 1.00 0.00 O ATOM 0 H GLY A 4 -16.422 -26.372 13.037 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.696 -26.709 15.448 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.514 -28.431 15.178 1.00 0.00 H new ATOM 37 N SER A 5 -14.224 -27.374 16.211 1.00 0.00 N ATOM 38 CA SER A 5 -12.798 -27.252 16.489 1.00 0.00 C ATOM 39 C SER A 5 -12.011 -28.357 15.791 1.00 0.00 C ATOM 40 O SER A 5 -12.208 -29.542 16.064 1.00 0.00 O ATOM 41 CB SER A 5 -12.544 -27.304 17.997 1.00 0.00 C ATOM 42 OG SER A 5 -11.156 -27.319 18.281 1.00 0.00 O ATOM 0 H SER A 5 -14.805 -27.506 17.039 1.00 0.00 H new ATOM 0 HA SER A 5 -12.460 -26.290 16.104 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.007 -26.442 18.477 1.00 0.00 H new ATOM 0 HB3 SER A 5 -13.014 -28.193 18.417 1.00 0.00 H new ATOM 0 HG SER A 5 -11.021 -27.351 19.251 1.00 0.00 H new ATOM 48 N SER A 6 -11.119 -27.961 14.889 1.00 0.00 N ATOM 49 CA SER A 6 -10.304 -28.918 14.149 1.00 0.00 C ATOM 50 C SER A 6 -8.939 -29.093 14.807 1.00 0.00 C ATOM 51 O SER A 6 -8.394 -30.195 14.847 1.00 0.00 O ATOM 52 CB SER A 6 -10.129 -28.457 12.701 1.00 0.00 C ATOM 53 OG SER A 6 -9.116 -29.201 12.048 1.00 0.00 O ATOM 0 H SER A 6 -10.942 -26.985 14.653 1.00 0.00 H new ATOM 0 HA SER A 6 -10.818 -29.879 14.158 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.071 -28.570 12.164 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.876 -27.397 12.682 1.00 0.00 H new ATOM 0 HG SER A 6 -9.025 -28.888 11.124 1.00 0.00 H new ATOM 59 N GLY A 7 -8.393 -27.996 15.323 1.00 0.00 N ATOM 60 CA GLY A 7 -7.096 -28.049 15.973 1.00 0.00 C ATOM 61 C GLY A 7 -6.490 -26.674 16.171 1.00 0.00 C ATOM 62 O GLY A 7 -7.193 -25.664 16.225 1.00 0.00 O ATOM 0 H GLY A 7 -8.825 -27.072 15.303 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.198 -28.540 16.941 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.418 -28.659 15.375 1.00 0.00 H new ATOM 66 N PRO A 8 -5.155 -26.622 16.285 1.00 0.00 N ATOM 67 CA PRO A 8 -4.426 -25.365 16.481 1.00 0.00 C ATOM 68 C PRO A 8 -4.452 -24.479 15.240 1.00 0.00 C ATOM 69 O PRO A 8 -4.324 -24.950 14.109 1.00 0.00 O ATOM 70 CB PRO A 8 -2.997 -25.827 16.777 1.00 0.00 C ATOM 71 CG PRO A 8 -2.888 -27.164 16.129 1.00 0.00 C ATOM 72 CD PRO A 8 -4.254 -27.785 16.230 1.00 0.00 C ATOM 0 HA PRO A 8 -4.866 -24.758 17.272 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.264 -25.130 16.371 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.816 -25.891 17.850 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.578 -27.069 15.088 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.141 -27.780 16.629 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -4.471 -28.421 15.372 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.347 -28.408 17.120 1.00 0.00 H new ATOM 80 N PRO A 9 -4.623 -23.166 15.453 1.00 0.00 N ATOM 81 CA PRO A 9 -4.669 -22.187 14.363 1.00 0.00 C ATOM 82 C PRO A 9 -3.313 -22.002 13.692 1.00 0.00 C ATOM 83 O PRO A 9 -2.264 -22.045 14.335 1.00 0.00 O ATOM 84 CB PRO A 9 -5.100 -20.896 15.064 1.00 0.00 C ATOM 85 CG PRO A 9 -4.659 -21.067 16.477 1.00 0.00 C ATOM 86 CD PRO A 9 -4.783 -22.536 16.774 1.00 0.00 C ATOM 0 HA PRO A 9 -5.341 -22.499 13.563 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.634 -20.023 14.607 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.179 -20.752 15.001 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -3.632 -20.727 16.609 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.279 -20.478 17.153 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.017 -22.870 17.474 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.749 -22.776 17.219 1.00 0.00 H new ATOM 94 N PRO A 10 -3.331 -21.790 12.368 1.00 0.00 N ATOM 95 CA PRO A 10 -2.110 -21.593 11.581 1.00 0.00 C ATOM 96 C PRO A 10 -1.434 -20.260 11.883 1.00 0.00 C ATOM 97 O PRO A 10 -1.813 -19.560 12.822 1.00 0.00 O ATOM 98 CB PRO A 10 -2.611 -21.623 10.135 1.00 0.00 C ATOM 99 CG PRO A 10 -4.038 -21.205 10.220 1.00 0.00 C ATOM 100 CD PRO A 10 -4.545 -21.727 11.536 1.00 0.00 C ATOM 0 HA PRO A 10 -1.357 -22.350 11.801 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.037 -20.945 9.503 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.515 -22.619 9.703 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.131 -20.120 10.169 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -4.614 -21.614 9.390 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -5.295 -21.065 11.969 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -5.009 -22.707 11.428 1.00 0.00 H new ATOM 108 N ALA A 11 -0.432 -19.915 11.082 1.00 0.00 N ATOM 109 CA ALA A 11 0.295 -18.664 11.263 1.00 0.00 C ATOM 110 C ALA A 11 0.260 -17.820 9.993 1.00 0.00 C ATOM 111 O ALA A 11 1.043 -18.019 9.064 1.00 0.00 O ATOM 112 CB ALA A 11 1.733 -18.944 11.673 1.00 0.00 C ATOM 0 H ALA A 11 -0.105 -20.484 10.301 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.194 -18.100 12.057 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.264 -18.001 11.805 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.742 -19.500 12.611 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.224 -19.532 10.898 1.00 0.00 H new ATOM 118 N PRO A 12 -0.670 -16.854 9.949 1.00 0.00 N ATOM 119 CA PRO A 12 -0.830 -15.961 8.798 1.00 0.00 C ATOM 120 C PRO A 12 0.332 -14.984 8.658 1.00 0.00 C ATOM 121 O PRO A 12 1.313 -15.060 9.399 1.00 0.00 O ATOM 122 CB PRO A 12 -2.126 -15.209 9.110 1.00 0.00 C ATOM 123 CG PRO A 12 -2.240 -15.250 10.595 1.00 0.00 C ATOM 124 CD PRO A 12 -1.637 -16.560 11.020 1.00 0.00 C ATOM 0 HA PRO A 12 -0.856 -16.510 7.856 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -2.086 -14.183 8.744 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -2.984 -15.684 8.634 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -1.713 -14.412 11.050 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -3.282 -15.180 10.909 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.149 -16.481 11.991 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -2.392 -17.341 11.105 1.00 0.00 H new ATOM 132 N ILE A 13 0.216 -14.066 7.703 1.00 0.00 N ATOM 133 CA ILE A 13 1.257 -13.074 7.467 1.00 0.00 C ATOM 134 C ILE A 13 1.020 -11.820 8.303 1.00 0.00 C ATOM 135 O ILE A 13 0.026 -11.113 8.138 1.00 0.00 O ATOM 136 CB ILE A 13 1.332 -12.680 5.980 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.299 -13.928 5.097 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.590 -11.867 5.711 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.859 -13.652 3.677 1.00 0.00 C ATOM 0 H ILE A 13 -0.589 -13.989 7.081 1.00 0.00 H new ATOM 0 HA ILE A 13 2.202 -13.531 7.761 1.00 0.00 H new ATOM 0 HB ILE A 13 0.466 -12.064 5.738 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.292 -14.378 5.080 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.625 -14.660 5.542 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.629 -11.596 4.656 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.575 -10.962 6.318 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.468 -12.460 5.966 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.859 -14.582 3.109 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.146 -13.231 3.683 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.546 -12.944 3.214 1.00 0.00 H new ATOM 151 N PRO A 14 1.956 -11.535 9.221 1.00 0.00 N ATOM 152 CA PRO A 14 1.872 -10.364 10.099 1.00 0.00 C ATOM 153 C PRO A 14 2.077 -9.056 9.342 1.00 0.00 C ATOM 154 O PRO A 14 2.604 -9.048 8.229 1.00 0.00 O ATOM 155 CB PRO A 14 3.011 -10.588 11.097 1.00 0.00 C ATOM 156 CG PRO A 14 3.985 -11.452 10.373 1.00 0.00 C ATOM 157 CD PRO A 14 3.167 -12.334 9.472 1.00 0.00 C ATOM 0 HA PRO A 14 0.890 -10.272 10.564 1.00 0.00 H new ATOM 0 HB2 PRO A 14 3.466 -9.644 11.397 1.00 0.00 H new ATOM 0 HB3 PRO A 14 2.652 -11.072 12.005 1.00 0.00 H new ATOM 0 HG2 PRO A 14 4.687 -10.850 9.797 1.00 0.00 H new ATOM 0 HG3 PRO A 14 4.573 -12.047 11.072 1.00 0.00 H new ATOM 0 HD2 PRO A 14 3.696 -12.564 8.547 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.929 -13.285 9.948 1.00 0.00 H new ATOM 165 N ASP A 15 1.658 -7.953 9.952 1.00 0.00 N ATOM 166 CA ASP A 15 1.797 -6.639 9.336 1.00 0.00 C ATOM 167 C ASP A 15 3.262 -6.326 9.047 1.00 0.00 C ATOM 168 O ASP A 15 4.163 -6.896 9.664 1.00 0.00 O ATOM 169 CB ASP A 15 1.201 -5.561 10.243 1.00 0.00 C ATOM 170 CG ASP A 15 1.639 -5.713 11.687 1.00 0.00 C ATOM 171 OD1 ASP A 15 2.797 -5.361 11.996 1.00 0.00 O ATOM 172 OD2 ASP A 15 0.824 -6.183 12.507 1.00 0.00 O ATOM 0 H ASP A 15 1.219 -7.943 10.873 1.00 0.00 H new ATOM 0 HA ASP A 15 1.253 -6.649 8.391 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.498 -4.578 9.878 1.00 0.00 H new ATOM 0 HB3 ASP A 15 0.113 -5.606 10.190 1.00 0.00 H new ATOM 177 N LEU A 16 3.493 -5.418 8.106 1.00 0.00 N ATOM 178 CA LEU A 16 4.849 -5.029 7.735 1.00 0.00 C ATOM 179 C LEU A 16 4.958 -3.516 7.573 1.00 0.00 C ATOM 180 O LEU A 16 4.146 -2.894 6.888 1.00 0.00 O ATOM 181 CB LEU A 16 5.262 -5.723 6.435 1.00 0.00 C ATOM 182 CG LEU A 16 6.766 -5.875 6.203 1.00 0.00 C ATOM 183 CD1 LEU A 16 7.055 -7.117 5.375 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.328 -4.635 5.523 1.00 0.00 C ATOM 0 H LEU A 16 2.759 -4.937 7.586 1.00 0.00 H new ATOM 0 HA LEU A 16 5.521 -5.339 8.536 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.810 -6.715 6.417 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.840 -5.165 5.599 1.00 0.00 H new ATOM 0 HG LEU A 16 7.255 -5.987 7.171 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.130 -7.209 5.220 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.688 -7.998 5.901 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.555 -7.035 4.410 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.399 -4.760 5.366 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.834 -4.492 4.562 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.154 -3.763 6.154 1.00 0.00 H new ATOM 196 N LYS A 17 5.967 -2.930 8.208 1.00 0.00 N ATOM 197 CA LYS A 17 6.185 -1.490 8.133 1.00 0.00 C ATOM 198 C LYS A 17 6.927 -1.118 6.853 1.00 0.00 C ATOM 199 O LYS A 17 7.883 -1.788 6.461 1.00 0.00 O ATOM 200 CB LYS A 17 6.976 -1.009 9.352 1.00 0.00 C ATOM 201 CG LYS A 17 6.770 0.462 9.669 1.00 0.00 C ATOM 202 CD LYS A 17 6.961 0.746 11.149 1.00 0.00 C ATOM 203 CE LYS A 17 5.640 0.694 11.902 1.00 0.00 C ATOM 204 NZ LYS A 17 5.368 -0.663 12.452 1.00 0.00 N ATOM 0 H LYS A 17 6.647 -3.430 8.781 1.00 0.00 H new ATOM 0 HA LYS A 17 5.211 -1.000 8.123 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.687 -1.603 10.219 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.037 -1.190 9.181 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.472 1.062 9.089 1.00 0.00 H new ATOM 0 HG3 LYS A 17 5.767 0.763 9.366 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.652 0.018 11.574 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.415 1.729 11.276 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.657 1.419 12.716 1.00 0.00 H new ATOM 0 HE3 LYS A 17 4.829 0.984 11.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.585 -0.610 13.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.109 -1.306 11.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.220 -1.021 12.929 1.00 0.00 H new ATOM 218 N VAL A 18 6.482 -0.045 6.207 1.00 0.00 N ATOM 219 CA VAL A 18 7.106 0.418 4.973 1.00 0.00 C ATOM 220 C VAL A 18 7.639 1.838 5.126 1.00 0.00 C ATOM 221 O VAL A 18 8.692 2.179 4.587 1.00 0.00 O ATOM 222 CB VAL A 18 6.116 0.377 3.794 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.540 -1.021 3.629 1.00 0.00 C ATOM 224 CG2 VAL A 18 5.007 1.399 3.994 1.00 0.00 C ATOM 0 H VAL A 18 5.692 0.520 6.518 1.00 0.00 H new ATOM 0 HA VAL A 18 7.936 -0.258 4.765 1.00 0.00 H new ATOM 0 HB VAL A 18 6.654 0.633 2.881 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.843 -1.031 2.791 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.348 -1.727 3.437 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.016 -1.309 4.541 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.317 1.356 3.152 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.469 1.177 4.916 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.440 2.397 4.058 1.00 0.00 H new ATOM 234 N PHE A 19 6.905 2.663 5.865 1.00 0.00 N ATOM 235 CA PHE A 19 7.303 4.048 6.089 1.00 0.00 C ATOM 236 C PHE A 19 6.950 4.494 7.505 1.00 0.00 C ATOM 237 O PHE A 19 5.870 4.191 8.010 1.00 0.00 O ATOM 238 CB PHE A 19 6.626 4.967 5.069 1.00 0.00 C ATOM 239 CG PHE A 19 6.884 6.426 5.314 1.00 0.00 C ATOM 240 CD1 PHE A 19 8.023 7.036 4.813 1.00 0.00 C ATOM 241 CD2 PHE A 19 5.987 7.189 6.045 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.262 8.379 5.036 1.00 0.00 C ATOM 243 CE2 PHE A 19 6.221 8.532 6.271 1.00 0.00 C ATOM 244 CZ PHE A 19 7.361 9.127 5.767 1.00 0.00 C ATOM 0 H PHE A 19 6.031 2.397 6.319 1.00 0.00 H new ATOM 0 HA PHE A 19 8.384 4.113 5.966 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.975 4.707 4.070 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.551 4.788 5.088 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.732 6.455 4.242 1.00 0.00 H new ATOM 0 HD2 PHE A 19 5.095 6.728 6.443 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.153 8.843 4.639 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.513 9.116 6.841 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.547 10.176 5.945 1.00 0.00 H new ATOM 254 N GLU A 20 7.870 5.214 8.139 1.00 0.00 N ATOM 255 CA GLU A 20 7.656 5.700 9.497 1.00 0.00 C ATOM 256 C GLU A 20 8.181 7.124 9.654 1.00 0.00 C ATOM 257 O GLU A 20 9.357 7.395 9.410 1.00 0.00 O ATOM 258 CB GLU A 20 8.344 4.778 10.506 1.00 0.00 C ATOM 259 CG GLU A 20 8.188 5.230 11.948 1.00 0.00 C ATOM 260 CD GLU A 20 8.611 4.166 12.942 1.00 0.00 C ATOM 261 OE1 GLU A 20 9.401 3.278 12.560 1.00 0.00 O ATOM 262 OE2 GLU A 20 8.152 4.221 14.102 1.00 0.00 O ATOM 0 H GLU A 20 8.770 5.473 7.735 1.00 0.00 H new ATOM 0 HA GLU A 20 6.583 5.703 9.690 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.936 3.772 10.403 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.405 4.718 10.266 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.782 6.129 12.109 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.147 5.499 12.130 1.00 0.00 H new ATOM 269 N ARG A 21 7.299 8.031 10.063 1.00 0.00 N ATOM 270 CA ARG A 21 7.672 9.428 10.251 1.00 0.00 C ATOM 271 C ARG A 21 7.335 9.895 11.664 1.00 0.00 C ATOM 272 O ARG A 21 6.414 9.378 12.296 1.00 0.00 O ATOM 273 CB ARG A 21 6.956 10.311 9.227 1.00 0.00 C ATOM 274 CG ARG A 21 7.583 11.686 9.065 1.00 0.00 C ATOM 275 CD ARG A 21 6.789 12.550 8.098 1.00 0.00 C ATOM 276 NE ARG A 21 7.142 12.280 6.706 1.00 0.00 N ATOM 277 CZ ARG A 21 8.333 12.548 6.185 1.00 0.00 C ATOM 278 NH1 ARG A 21 9.282 13.091 6.935 1.00 0.00 N ATOM 279 NH2 ARG A 21 8.578 12.273 4.910 1.00 0.00 N ATOM 0 H ARG A 21 6.322 7.823 10.270 1.00 0.00 H new ATOM 0 HA ARG A 21 8.749 9.513 10.105 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.955 9.805 8.261 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.915 10.429 9.526 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.637 12.179 10.036 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.606 11.580 8.704 1.00 0.00 H new ATOM 0 HD2 ARG A 21 5.724 12.371 8.243 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.969 13.602 8.320 1.00 0.00 H new ATOM 0 HE ARG A 21 6.434 11.863 6.102 1.00 0.00 H new ATOM 0 HH11 ARG A 21 9.098 13.304 7.915 1.00 0.00 H new ATOM 0 HH12 ARG A 21 10.196 13.296 6.532 1.00 0.00 H new ATOM 0 HH21 ARG A 21 7.851 11.855 4.329 1.00 0.00 H new ATOM 0 HH22 ARG A 21 9.494 12.479 4.511 1.00 0.00 H new ATOM 293 N GLU A 22 8.089 10.875 12.153 1.00 0.00 N ATOM 294 CA GLU A 22 7.871 11.410 13.492 1.00 0.00 C ATOM 295 C GLU A 22 6.381 11.482 13.813 1.00 0.00 C ATOM 296 O GLU A 22 5.980 11.414 14.974 1.00 0.00 O ATOM 297 CB GLU A 22 8.500 12.799 13.620 1.00 0.00 C ATOM 298 CG GLU A 22 7.978 13.798 12.601 1.00 0.00 C ATOM 299 CD GLU A 22 8.264 15.235 12.993 1.00 0.00 C ATOM 300 OE1 GLU A 22 7.682 15.703 13.994 1.00 0.00 O ATOM 301 OE2 GLU A 22 9.070 15.891 12.301 1.00 0.00 O ATOM 0 H GLU A 22 8.855 11.314 11.643 1.00 0.00 H new ATOM 0 HA GLU A 22 8.347 10.737 14.206 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.312 13.183 14.623 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.581 12.711 13.510 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.432 13.593 11.631 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.903 13.664 12.485 1.00 0.00 H new ATOM 308 N GLY A 23 5.564 11.623 12.773 1.00 0.00 N ATOM 309 CA GLY A 23 4.127 11.703 12.964 1.00 0.00 C ATOM 310 C GLY A 23 3.361 10.863 11.962 1.00 0.00 C ATOM 311 O GLY A 23 2.375 10.214 12.310 1.00 0.00 O ATOM 0 H GLY A 23 5.871 11.683 11.802 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.879 11.375 13.973 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.810 12.742 12.880 1.00 0.00 H new ATOM 315 N VAL A 24 3.814 10.876 10.712 1.00 0.00 N ATOM 316 CA VAL A 24 3.164 10.110 9.655 1.00 0.00 C ATOM 317 C VAL A 24 3.700 8.684 9.601 1.00 0.00 C ATOM 318 O VAL A 24 4.886 8.466 9.358 1.00 0.00 O ATOM 319 CB VAL A 24 3.361 10.774 8.279 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.649 9.977 7.196 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.867 12.212 8.306 1.00 0.00 C ATOM 0 H VAL A 24 4.629 11.409 10.407 1.00 0.00 H new ATOM 0 HA VAL A 24 2.100 10.086 9.889 1.00 0.00 H new ATOM 0 HB VAL A 24 4.426 10.785 8.049 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.799 10.460 6.231 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.055 8.966 7.162 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.583 9.933 7.418 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.014 12.666 7.326 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.807 12.228 8.558 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.426 12.775 9.054 1.00 0.00 H new ATOM 331 N GLN A 25 2.817 7.717 9.829 1.00 0.00 N ATOM 332 CA GLN A 25 3.202 6.311 9.806 1.00 0.00 C ATOM 333 C GLN A 25 2.395 5.542 8.765 1.00 0.00 C ATOM 334 O GLN A 25 1.218 5.827 8.542 1.00 0.00 O ATOM 335 CB GLN A 25 3.004 5.684 11.187 1.00 0.00 C ATOM 336 CG GLN A 25 4.196 5.862 12.113 1.00 0.00 C ATOM 337 CD GLN A 25 4.110 7.131 12.938 1.00 0.00 C ATOM 338 OE1 GLN A 25 3.786 8.200 12.421 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.399 7.019 14.229 1.00 0.00 N ATOM 0 H GLN A 25 1.831 7.881 10.032 1.00 0.00 H new ATOM 0 HA GLN A 25 4.256 6.254 9.536 1.00 0.00 H new ATOM 0 HB2 GLN A 25 2.123 6.125 11.654 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.803 4.619 11.068 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.264 5.003 12.781 1.00 0.00 H new ATOM 0 HG3 GLN A 25 5.111 5.879 11.521 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.663 6.113 14.616 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.357 7.839 14.834 1.00 0.00 H new ATOM 348 N LEU A 26 3.036 4.568 8.129 1.00 0.00 N ATOM 349 CA LEU A 26 2.378 3.758 7.110 1.00 0.00 C ATOM 350 C LEU A 26 2.629 2.273 7.349 1.00 0.00 C ATOM 351 O LEU A 26 3.771 1.816 7.332 1.00 0.00 O ATOM 352 CB LEU A 26 2.874 4.153 5.717 1.00 0.00 C ATOM 353 CG LEU A 26 2.016 3.685 4.542 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.769 4.547 4.415 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.819 3.715 3.250 1.00 0.00 C ATOM 0 H LEU A 26 4.010 4.320 8.301 1.00 0.00 H new ATOM 0 HA LEU A 26 1.305 3.941 7.173 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.951 5.239 5.675 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.881 3.757 5.586 1.00 0.00 H new ATOM 0 HG LEU A 26 1.706 2.657 4.731 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.170 4.199 3.573 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.183 4.476 5.331 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.059 5.585 4.250 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.192 3.379 2.424 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.159 4.732 3.056 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.682 3.055 3.343 1.00 0.00 H new ATOM 367 N ASN A 27 1.554 1.524 7.569 1.00 0.00 N ATOM 368 CA ASN A 27 1.657 0.089 7.810 1.00 0.00 C ATOM 369 C ASN A 27 1.166 -0.702 6.602 1.00 0.00 C ATOM 370 O ASN A 27 0.421 -0.185 5.769 1.00 0.00 O ATOM 371 CB ASN A 27 0.851 -0.300 9.051 1.00 0.00 C ATOM 372 CG ASN A 27 1.530 0.126 10.339 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.332 -0.616 10.906 1.00 0.00 O ATOM 374 ND2 ASN A 27 1.210 1.327 10.807 1.00 0.00 N ATOM 0 H ASN A 27 0.601 1.887 7.585 1.00 0.00 H new ATOM 0 HA ASN A 27 2.707 -0.152 7.977 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.137 0.156 8.997 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.704 -1.380 9.061 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.634 1.668 11.670 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.540 1.909 10.304 1.00 0.00 H new ATOM 381 N LEU A 28 1.587 -1.959 6.514 1.00 0.00 N ATOM 382 CA LEU A 28 1.190 -2.823 5.408 1.00 0.00 C ATOM 383 C LEU A 28 0.551 -4.109 5.924 1.00 0.00 C ATOM 384 O LEU A 28 0.964 -4.651 6.949 1.00 0.00 O ATOM 385 CB LEU A 28 2.401 -3.157 4.535 1.00 0.00 C ATOM 386 CG LEU A 28 2.110 -3.426 3.058 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.329 -3.104 2.207 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.680 -4.871 2.854 1.00 0.00 C ATOM 0 H LEU A 28 2.203 -2.402 7.195 1.00 0.00 H new ATOM 0 HA LEU A 28 0.454 -2.288 4.808 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.110 -2.331 4.601 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.894 -4.034 4.953 1.00 0.00 H new ATOM 0 HG LEU A 28 1.292 -2.777 2.744 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.104 -3.301 1.159 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.591 -2.053 2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.167 -3.726 2.521 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.477 -5.044 1.797 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.476 -5.538 3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.778 -5.068 3.434 1.00 0.00 H new ATOM 400 N SER A 29 -0.457 -4.593 5.205 1.00 0.00 N ATOM 401 CA SER A 29 -1.154 -5.814 5.591 1.00 0.00 C ATOM 402 C SER A 29 -1.317 -6.747 4.396 1.00 0.00 C ATOM 403 O SER A 29 -1.717 -6.322 3.311 1.00 0.00 O ATOM 404 CB SER A 29 -2.525 -5.479 6.182 1.00 0.00 C ATOM 405 OG SER A 29 -2.423 -5.168 7.561 1.00 0.00 O ATOM 0 H SER A 29 -0.809 -4.158 4.352 1.00 0.00 H new ATOM 0 HA SER A 29 -0.555 -6.321 6.347 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.959 -4.635 5.647 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.200 -6.324 6.045 1.00 0.00 H new ATOM 0 HG SER A 29 -3.312 -4.956 7.915 1.00 0.00 H new ATOM 411 N PHE A 30 -1.005 -8.022 4.601 1.00 0.00 N ATOM 412 CA PHE A 30 -1.116 -9.017 3.541 1.00 0.00 C ATOM 413 C PHE A 30 -2.320 -9.926 3.771 1.00 0.00 C ATOM 414 O PHE A 30 -2.520 -10.442 4.871 1.00 0.00 O ATOM 415 CB PHE A 30 0.162 -9.855 3.463 1.00 0.00 C ATOM 416 CG PHE A 30 1.386 -9.052 3.127 1.00 0.00 C ATOM 417 CD1 PHE A 30 1.735 -8.817 1.807 1.00 0.00 C ATOM 418 CD2 PHE A 30 2.187 -8.533 4.131 1.00 0.00 C ATOM 419 CE1 PHE A 30 2.861 -8.079 1.495 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.315 -7.794 3.825 1.00 0.00 C ATOM 421 CZ PHE A 30 3.651 -7.566 2.505 1.00 0.00 C ATOM 0 H PHE A 30 -0.673 -8.391 5.492 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.256 -8.491 2.597 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.317 -10.356 4.418 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.031 -10.634 2.712 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.120 -9.215 1.013 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.927 -8.708 5.165 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.123 -7.904 0.462 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.932 -7.396 4.617 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.530 -6.987 2.263 1.00 0.00 H new ATOM 431 N ILE A 31 -3.119 -10.115 2.726 1.00 0.00 N ATOM 432 CA ILE A 31 -4.303 -10.961 2.813 1.00 0.00 C ATOM 433 C ILE A 31 -4.324 -11.994 1.692 1.00 0.00 C ATOM 434 O ILE A 31 -4.122 -11.662 0.524 1.00 0.00 O ATOM 435 CB ILE A 31 -5.596 -10.127 2.753 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.763 -9.312 4.037 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.799 -11.032 2.533 1.00 0.00 C ATOM 438 CD1 ILE A 31 -4.980 -8.018 4.038 1.00 0.00 C ATOM 0 H ILE A 31 -2.968 -9.694 1.809 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.255 -11.473 3.774 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.527 -9.436 1.913 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.820 -9.088 4.180 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.448 -9.918 4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.706 -10.428 2.493 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.681 -11.572 1.594 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.873 -11.744 3.355 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.146 -7.493 4.979 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.918 -8.235 3.926 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.311 -7.392 3.210 1.00 0.00 H new ATOM 450 N ARG A 32 -4.573 -13.248 2.055 1.00 0.00 N ATOM 451 CA ARG A 32 -4.622 -14.330 1.079 1.00 0.00 C ATOM 452 C ARG A 32 -5.890 -15.161 1.251 1.00 0.00 C ATOM 453 O ARG A 32 -6.011 -15.972 2.170 1.00 0.00 O ATOM 454 CB ARG A 32 -3.390 -15.227 1.218 1.00 0.00 C ATOM 455 CG ARG A 32 -2.124 -14.617 0.636 1.00 0.00 C ATOM 456 CD ARG A 32 -1.176 -15.688 0.121 1.00 0.00 C ATOM 457 NE ARG A 32 -0.068 -15.118 -0.641 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.153 -14.785 -1.924 1.00 0.00 C ATOM 459 NH1 ARG A 32 -1.288 -14.964 -2.585 1.00 0.00 N ATOM 460 NH2 ARG A 32 0.899 -14.271 -2.548 1.00 0.00 N ATOM 0 H ARG A 32 -4.744 -13.540 3.017 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.631 -13.887 0.083 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.226 -15.445 2.273 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.586 -16.178 0.723 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.386 -13.940 -0.177 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.622 -14.021 1.398 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -0.782 -16.258 0.962 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -1.727 -16.387 -0.508 1.00 0.00 H new ATOM 0 HE ARG A 32 0.820 -14.967 -0.162 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.099 -15.358 -2.108 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -1.350 -14.707 -3.570 1.00 0.00 H new ATOM 0 HH21 ARG A 32 1.774 -14.131 -2.042 1.00 0.00 H new ATOM 0 HH22 ARG A 32 0.833 -14.016 -3.533 1.00 0.00 H new ATOM 474 N PRO A 33 -6.860 -14.955 0.348 1.00 0.00 N ATOM 475 CA PRO A 33 -8.136 -15.675 0.379 1.00 0.00 C ATOM 476 C PRO A 33 -7.980 -17.149 0.020 1.00 0.00 C ATOM 477 O PRO A 33 -7.123 -17.530 -0.778 1.00 0.00 O ATOM 478 CB PRO A 33 -8.976 -14.953 -0.678 1.00 0.00 C ATOM 479 CG PRO A 33 -7.980 -14.360 -1.614 1.00 0.00 C ATOM 480 CD PRO A 33 -6.784 -14.004 -0.774 1.00 0.00 C ATOM 0 HA PRO A 33 -8.582 -15.671 1.374 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.642 -15.644 -1.195 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.603 -14.183 -0.227 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.710 -15.069 -2.397 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.386 -13.478 -2.109 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.854 -14.114 -1.332 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.828 -12.971 -0.429 1.00 0.00 H new ATOM 488 N PRO A 34 -8.826 -17.998 0.620 1.00 0.00 N ATOM 489 CA PRO A 34 -8.802 -19.444 0.378 1.00 0.00 C ATOM 490 C PRO A 34 -9.280 -19.805 -1.024 1.00 0.00 C ATOM 491 O PRO A 34 -8.711 -20.678 -1.678 1.00 0.00 O ATOM 492 CB PRO A 34 -9.766 -19.996 1.430 1.00 0.00 C ATOM 493 CG PRO A 34 -10.691 -18.866 1.727 1.00 0.00 C ATOM 494 CD PRO A 34 -9.873 -17.613 1.582 1.00 0.00 C ATOM 0 HA PRO A 34 -7.794 -19.852 0.448 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.309 -20.863 1.053 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.233 -20.317 2.325 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.536 -18.862 1.039 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -11.100 -18.951 2.734 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.473 -16.782 1.211 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.447 -17.299 2.535 1.00 0.00 H new ATOM 502 N GLU A 35 -10.328 -19.126 -1.481 1.00 0.00 N ATOM 503 CA GLU A 35 -10.881 -19.377 -2.806 1.00 0.00 C ATOM 504 C GLU A 35 -9.812 -19.212 -3.882 1.00 0.00 C ATOM 505 O GLU A 35 -9.729 -20.008 -4.816 1.00 0.00 O ATOM 506 CB GLU A 35 -12.050 -18.428 -3.083 1.00 0.00 C ATOM 507 CG GLU A 35 -11.691 -16.960 -2.933 1.00 0.00 C ATOM 508 CD GLU A 35 -12.767 -16.038 -3.472 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.132 -16.180 -4.658 1.00 0.00 O ATOM 510 OE2 GLU A 35 -13.245 -15.174 -2.707 1.00 0.00 O ATOM 0 H GLU A 35 -10.810 -18.399 -0.953 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.242 -20.405 -2.832 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.416 -18.602 -4.095 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.868 -18.665 -2.403 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.521 -16.737 -1.880 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.755 -16.764 -3.455 1.00 0.00 H new ATOM 517 N ASN A 36 -8.997 -18.172 -3.743 1.00 0.00 N ATOM 518 CA ASN A 36 -7.933 -17.900 -4.704 1.00 0.00 C ATOM 519 C ASN A 36 -6.577 -17.833 -4.009 1.00 0.00 C ATOM 520 O ASN A 36 -6.160 -16.788 -3.507 1.00 0.00 O ATOM 521 CB ASN A 36 -8.207 -16.589 -5.442 1.00 0.00 C ATOM 522 CG ASN A 36 -9.020 -16.795 -6.705 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.476 -17.903 -6.989 1.00 0.00 O ATOM 524 ND2 ASN A 36 -9.206 -15.726 -7.471 1.00 0.00 N ATOM 0 H ASN A 36 -9.052 -17.503 -2.975 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.911 -18.717 -5.426 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.738 -15.906 -4.779 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.260 -16.114 -5.697 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.745 -15.804 -8.333 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.810 -14.827 -7.197 1.00 0.00 H new ATOM 531 N PRO A 37 -5.870 -18.972 -3.978 1.00 0.00 N ATOM 532 CA PRO A 37 -4.550 -19.068 -3.348 1.00 0.00 C ATOM 533 C PRO A 37 -3.480 -18.310 -4.127 1.00 0.00 C ATOM 534 O PRO A 37 -2.405 -18.020 -3.603 1.00 0.00 O ATOM 535 CB PRO A 37 -4.258 -20.570 -3.362 1.00 0.00 C ATOM 536 CG PRO A 37 -5.065 -21.102 -4.497 1.00 0.00 C ATOM 537 CD PRO A 37 -6.305 -20.255 -4.556 1.00 0.00 C ATOM 0 HA PRO A 37 -4.541 -18.628 -2.351 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.195 -20.765 -3.506 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.543 -21.038 -2.420 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.508 -21.044 -5.432 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -5.316 -22.151 -4.339 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.661 -20.135 -5.579 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.121 -20.697 -3.984 1.00 0.00 H new ATOM 545 N ALA A 38 -3.781 -17.993 -5.382 1.00 0.00 N ATOM 546 CA ALA A 38 -2.846 -17.266 -6.232 1.00 0.00 C ATOM 547 C ALA A 38 -3.094 -15.763 -6.162 1.00 0.00 C ATOM 548 O ALA A 38 -2.347 -14.973 -6.741 1.00 0.00 O ATOM 549 CB ALA A 38 -2.952 -17.754 -7.670 1.00 0.00 C ATOM 0 H ALA A 38 -4.665 -18.228 -5.833 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.837 -17.458 -5.867 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.248 -17.203 -8.294 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.718 -18.818 -7.711 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.966 -17.591 -8.036 1.00 0.00 H new ATOM 555 N LEU A 39 -4.145 -15.374 -5.450 1.00 0.00 N ATOM 556 CA LEU A 39 -4.492 -13.965 -5.304 1.00 0.00 C ATOM 557 C LEU A 39 -3.958 -13.406 -3.989 1.00 0.00 C ATOM 558 O LEU A 39 -4.063 -14.046 -2.942 1.00 0.00 O ATOM 559 CB LEU A 39 -6.009 -13.783 -5.370 1.00 0.00 C ATOM 560 CG LEU A 39 -6.524 -12.357 -5.167 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.397 -11.556 -6.454 1.00 0.00 C ATOM 562 CD2 LEU A 39 -7.968 -12.374 -4.688 1.00 0.00 C ATOM 0 H LEU A 39 -4.772 -16.015 -4.964 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.031 -13.416 -6.125 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.355 -14.138 -6.340 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.465 -14.423 -4.615 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.914 -11.877 -4.402 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.768 -10.544 -6.291 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.350 -11.514 -6.755 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.982 -12.035 -7.240 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.317 -11.351 -4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.592 -12.873 -5.430 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.031 -12.911 -3.741 1.00 0.00 H new ATOM 574 N LEU A 40 -3.387 -12.208 -4.050 1.00 0.00 N ATOM 575 CA LEU A 40 -2.838 -11.561 -2.863 1.00 0.00 C ATOM 576 C LEU A 40 -3.433 -10.168 -2.678 1.00 0.00 C ATOM 577 O LEU A 40 -3.068 -9.227 -3.384 1.00 0.00 O ATOM 578 CB LEU A 40 -1.315 -11.467 -2.968 1.00 0.00 C ATOM 579 CG LEU A 40 -0.616 -10.649 -1.881 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.678 -11.373 -0.545 1.00 0.00 C ATOM 581 CD2 LEU A 40 0.827 -10.366 -2.271 1.00 0.00 C ATOM 0 H LEU A 40 -3.292 -11.665 -4.908 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.100 -12.166 -1.995 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.907 -12.478 -2.953 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.064 -11.036 -3.937 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.136 -9.697 -1.779 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.176 -10.776 0.216 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.719 -11.522 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.183 -12.340 -0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.308 -9.783 -1.486 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.360 -11.308 -2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.848 -9.804 -3.205 1.00 0.00 H new ATOM 593 N LEU A 41 -4.348 -10.044 -1.724 1.00 0.00 N ATOM 594 CA LEU A 41 -4.992 -8.765 -1.444 1.00 0.00 C ATOM 595 C LEU A 41 -4.184 -7.958 -0.433 1.00 0.00 C ATOM 596 O LEU A 41 -4.022 -8.369 0.717 1.00 0.00 O ATOM 597 CB LEU A 41 -6.410 -8.991 -0.916 1.00 0.00 C ATOM 598 CG LEU A 41 -7.287 -9.942 -1.733 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.516 -10.351 -0.936 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.692 -9.296 -3.049 1.00 0.00 C ATOM 0 H LEU A 41 -4.661 -10.813 -1.131 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.043 -8.200 -2.375 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.340 -9.377 0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.913 -8.026 -0.857 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.709 -10.839 -1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.128 -11.027 -1.533 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.205 -10.855 -0.021 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.097 -9.464 -0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.315 -9.987 -3.617 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.252 -8.383 -2.849 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.799 -9.055 -3.626 1.00 0.00 H new ATOM 612 N ILE A 42 -3.681 -6.808 -0.869 1.00 0.00 N ATOM 613 CA ILE A 42 -2.893 -5.942 -0.001 1.00 0.00 C ATOM 614 C ILE A 42 -3.706 -4.736 0.457 1.00 0.00 C ATOM 615 O ILE A 42 -4.541 -4.218 -0.284 1.00 0.00 O ATOM 616 CB ILE A 42 -1.616 -5.449 -0.707 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.633 -6.605 -0.897 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.972 -4.324 0.089 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.615 -6.219 -1.660 1.00 0.00 C ATOM 0 H ILE A 42 -3.805 -6.455 -1.818 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.611 -6.538 0.867 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.888 -5.063 -1.690 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.346 -6.991 0.081 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -1.136 -7.415 -1.425 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.071 -3.986 -0.422 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.672 -3.493 0.177 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.711 -4.685 1.084 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.266 -7.088 -1.757 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.339 -5.860 -2.652 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.141 -5.430 -1.122 1.00 0.00 H new ATOM 631 N THR A 43 -3.454 -4.291 1.685 1.00 0.00 N ATOM 632 CA THR A 43 -4.161 -3.145 2.242 1.00 0.00 C ATOM 633 C THR A 43 -3.188 -2.139 2.845 1.00 0.00 C ATOM 634 O THR A 43 -2.107 -2.506 3.307 1.00 0.00 O ATOM 635 CB THR A 43 -5.169 -3.579 3.323 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.983 -4.649 2.833 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.052 -2.412 3.739 1.00 0.00 C ATOM 0 H THR A 43 -2.766 -4.707 2.312 1.00 0.00 H new ATOM 0 HA THR A 43 -4.701 -2.676 1.419 1.00 0.00 H new ATOM 0 HB THR A 43 -4.610 -3.919 4.194 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.620 -4.920 3.527 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.756 -2.742 4.503 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.431 -1.611 4.140 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.603 -2.046 2.873 1.00 0.00 H new ATOM 645 N ILE A 44 -3.578 -0.868 2.838 1.00 0.00 N ATOM 646 CA ILE A 44 -2.740 0.191 3.386 1.00 0.00 C ATOM 647 C ILE A 44 -3.382 0.817 4.619 1.00 0.00 C ATOM 648 O ILE A 44 -4.605 0.928 4.708 1.00 0.00 O ATOM 649 CB ILE A 44 -2.472 1.293 2.344 1.00 0.00 C ATOM 650 CG1 ILE A 44 -2.443 0.697 0.936 1.00 0.00 C ATOM 651 CG2 ILE A 44 -1.164 2.006 2.652 1.00 0.00 C ATOM 652 CD1 ILE A 44 -2.018 1.685 -0.129 1.00 0.00 C ATOM 0 H ILE A 44 -4.469 -0.547 2.459 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.793 -0.269 3.667 1.00 0.00 H new ATOM 0 HB ILE A 44 -3.280 2.023 2.392 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.762 -0.154 0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -3.434 0.315 0.691 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.988 2.782 1.907 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -1.221 2.459 3.642 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -0.344 1.288 2.628 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.020 1.194 -1.102 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.713 2.525 -0.145 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -1.014 2.049 0.092 1.00 0.00 H new ATOM 664 N THR A 45 -2.548 1.227 5.570 1.00 0.00 N ATOM 665 CA THR A 45 -3.033 1.843 6.799 1.00 0.00 C ATOM 666 C THR A 45 -2.272 3.127 7.108 1.00 0.00 C ATOM 667 O THR A 45 -1.330 3.126 7.900 1.00 0.00 O ATOM 668 CB THR A 45 -2.907 0.883 7.997 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.601 -0.339 7.721 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.469 1.518 9.260 1.00 0.00 C ATOM 0 H THR A 45 -1.533 1.143 5.512 1.00 0.00 H new ATOM 0 HA THR A 45 -4.086 2.077 6.641 1.00 0.00 H new ATOM 0 HB THR A 45 -1.850 0.671 8.155 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.515 -0.944 8.487 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.369 0.822 10.093 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.919 2.432 9.483 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.522 1.756 9.110 1.00 0.00 H new ATOM 678 N ALA A 46 -2.686 4.221 6.478 1.00 0.00 N ATOM 679 CA ALA A 46 -2.044 5.513 6.689 1.00 0.00 C ATOM 680 C ALA A 46 -2.625 6.223 7.907 1.00 0.00 C ATOM 681 O ALA A 46 -3.786 6.635 7.904 1.00 0.00 O ATOM 682 CB ALA A 46 -2.190 6.383 5.449 1.00 0.00 C ATOM 0 H ALA A 46 -3.463 4.239 5.817 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.984 5.338 6.875 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.706 7.345 5.620 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.721 5.887 4.599 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.248 6.541 5.238 1.00 0.00 H new ATOM 688 N THR A 47 -1.811 6.363 8.949 1.00 0.00 N ATOM 689 CA THR A 47 -2.245 7.021 10.175 1.00 0.00 C ATOM 690 C THR A 47 -1.426 8.278 10.443 1.00 0.00 C ATOM 691 O THR A 47 -0.197 8.234 10.472 1.00 0.00 O ATOM 692 CB THR A 47 -2.133 6.079 11.388 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.839 5.466 11.414 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.209 5.004 11.341 1.00 0.00 C ATOM 0 H THR A 47 -0.847 6.029 8.968 1.00 0.00 H new ATOM 0 HA THR A 47 -3.290 7.295 10.034 1.00 0.00 H new ATOM 0 HB THR A 47 -2.273 6.670 12.293 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.183 6.069 11.006 1.00 0.00 H new ATOM 0 HG21 THR A 47 -3.109 4.351 12.208 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.193 5.473 11.351 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.097 4.417 10.430 1.00 0.00 H new ATOM 702 N ASN A 48 -2.115 9.397 10.640 1.00 0.00 N ATOM 703 CA ASN A 48 -1.450 10.667 10.907 1.00 0.00 C ATOM 704 C ASN A 48 -1.895 11.243 12.248 1.00 0.00 C ATOM 705 O ASN A 48 -3.073 11.181 12.602 1.00 0.00 O ATOM 706 CB ASN A 48 -1.745 11.667 9.787 1.00 0.00 C ATOM 707 CG ASN A 48 -3.050 12.408 10.002 1.00 0.00 C ATOM 708 OD1 ASN A 48 -4.032 11.834 10.473 1.00 0.00 O ATOM 709 ND2 ASN A 48 -3.067 13.690 9.656 1.00 0.00 N ATOM 0 H ASN A 48 -3.133 9.450 10.620 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.376 10.484 10.948 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -0.929 12.386 9.722 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -1.783 11.140 8.834 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -3.918 14.240 9.777 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -2.229 14.125 9.269 1.00 0.00 H new ATOM 716 N PHE A 49 -0.946 11.804 12.990 1.00 0.00 N ATOM 717 CA PHE A 49 -1.239 12.392 14.292 1.00 0.00 C ATOM 718 C PHE A 49 -0.712 13.821 14.375 1.00 0.00 C ATOM 719 O PHE A 49 -1.327 14.686 14.999 1.00 0.00 O ATOM 720 CB PHE A 49 -0.626 11.543 15.407 1.00 0.00 C ATOM 721 CG PHE A 49 -0.928 10.078 15.281 1.00 0.00 C ATOM 722 CD1 PHE A 49 -2.238 9.626 15.263 1.00 0.00 C ATOM 723 CD2 PHE A 49 0.098 9.152 15.180 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.518 8.277 15.148 1.00 0.00 C ATOM 725 CE2 PHE A 49 -0.177 7.802 15.064 1.00 0.00 C ATOM 726 CZ PHE A 49 -1.487 7.364 15.047 1.00 0.00 C ATOM 0 H PHE A 49 0.033 11.864 12.712 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.322 12.416 14.417 1.00 0.00 H new ATOM 0 HB2 PHE A 49 0.455 11.684 15.407 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.994 11.900 16.369 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.049 10.335 15.340 1.00 0.00 H new ATOM 0 HD2 PHE A 49 1.124 9.489 15.192 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.543 7.937 15.137 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.632 7.090 14.987 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.704 6.310 14.955 1.00 0.00 H new ATOM 736 N SER A 50 0.432 14.061 13.743 1.00 0.00 N ATOM 737 CA SER A 50 1.046 15.384 13.748 1.00 0.00 C ATOM 738 C SER A 50 -0.018 16.477 13.722 1.00 0.00 C ATOM 739 O SER A 50 -1.039 16.347 13.047 1.00 0.00 O ATOM 740 CB SER A 50 1.983 15.540 12.549 1.00 0.00 C ATOM 741 OG SER A 50 1.344 15.145 11.348 1.00 0.00 O ATOM 0 H SER A 50 0.953 13.357 13.221 1.00 0.00 H new ATOM 0 HA SER A 50 1.624 15.485 14.667 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.306 16.578 12.468 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.879 14.938 12.703 1.00 0.00 H new ATOM 0 HG SER A 50 1.081 15.941 10.841 1.00 0.00 H new ATOM 747 N GLU A 51 0.229 17.553 14.461 1.00 0.00 N ATOM 748 CA GLU A 51 -0.708 18.669 14.523 1.00 0.00 C ATOM 749 C GLU A 51 -1.173 19.066 13.125 1.00 0.00 C ATOM 750 O GLU A 51 -2.232 19.671 12.961 1.00 0.00 O ATOM 751 CB GLU A 51 -0.061 19.869 15.218 1.00 0.00 C ATOM 752 CG GLU A 51 0.461 19.557 16.611 1.00 0.00 C ATOM 753 CD GLU A 51 0.441 20.767 17.525 1.00 0.00 C ATOM 754 OE1 GLU A 51 -0.636 21.379 17.677 1.00 0.00 O ATOM 755 OE2 GLU A 51 1.505 21.101 18.088 1.00 0.00 O ATOM 0 H GLU A 51 1.070 17.676 15.025 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.577 18.350 15.099 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.762 20.233 14.604 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.790 20.676 15.285 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.142 18.763 17.052 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.481 19.179 16.537 1.00 0.00 H new ATOM 762 N GLY A 52 -0.373 18.722 12.121 1.00 0.00 N ATOM 763 CA GLY A 52 -0.719 19.052 10.751 1.00 0.00 C ATOM 764 C GLY A 52 -1.570 17.983 10.094 1.00 0.00 C ATOM 765 O GLY A 52 -1.223 16.802 10.118 1.00 0.00 O ATOM 0 H GLY A 52 0.508 18.221 12.232 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.255 20.001 10.734 1.00 0.00 H new ATOM 0 HA3 GLY A 52 0.194 19.191 10.172 1.00 0.00 H new ATOM 769 N ASP A 53 -2.688 18.396 9.509 1.00 0.00 N ATOM 770 CA ASP A 53 -3.592 17.465 8.843 1.00 0.00 C ATOM 771 C ASP A 53 -3.084 17.117 7.448 1.00 0.00 C ATOM 772 O ASP A 53 -2.307 17.866 6.854 1.00 0.00 O ATOM 773 CB ASP A 53 -4.998 18.062 8.753 1.00 0.00 C ATOM 774 CG ASP A 53 -5.427 18.729 10.046 1.00 0.00 C ATOM 775 OD1 ASP A 53 -4.946 19.847 10.325 1.00 0.00 O ATOM 776 OD2 ASP A 53 -6.245 18.133 10.777 1.00 0.00 O ATOM 0 H ASP A 53 -2.991 19.370 9.482 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.631 16.550 9.434 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.029 18.791 7.944 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.708 17.275 8.500 1.00 0.00 H new ATOM 781 N VAL A 54 -3.526 15.975 6.930 1.00 0.00 N ATOM 782 CA VAL A 54 -3.116 15.528 5.604 1.00 0.00 C ATOM 783 C VAL A 54 -4.314 15.409 4.669 1.00 0.00 C ATOM 784 O VAL A 54 -5.251 14.655 4.935 1.00 0.00 O ATOM 785 CB VAL A 54 -2.392 14.170 5.669 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.136 13.633 4.269 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.091 14.296 6.447 1.00 0.00 C ATOM 0 H VAL A 54 -4.168 15.343 7.408 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.429 16.280 5.215 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.034 13.461 6.192 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.624 12.673 4.336 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.086 13.502 3.750 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.515 14.338 3.717 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.593 13.327 6.483 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.441 15.020 5.955 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.305 14.632 7.462 1.00 0.00 H new ATOM 797 N THR A 55 -4.278 16.158 3.572 1.00 0.00 N ATOM 798 CA THR A 55 -5.361 16.137 2.597 1.00 0.00 C ATOM 799 C THR A 55 -4.840 15.808 1.202 1.00 0.00 C ATOM 800 O THR A 55 -3.632 15.691 0.992 1.00 0.00 O ATOM 801 CB THR A 55 -6.101 17.487 2.550 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.159 18.558 2.425 1.00 0.00 O ATOM 803 CG2 THR A 55 -6.941 17.687 3.803 1.00 0.00 C ATOM 0 H THR A 55 -3.510 16.787 3.336 1.00 0.00 H new ATOM 0 HA THR A 55 -6.056 15.360 2.915 1.00 0.00 H new ATOM 0 HB THR A 55 -6.763 17.484 1.684 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.638 19.413 2.394 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.454 18.647 3.748 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.676 16.886 3.880 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.295 17.671 4.681 1.00 0.00 H new ATOM 811 N HIS A 56 -5.757 15.661 0.252 1.00 0.00 N ATOM 812 CA HIS A 56 -5.389 15.347 -1.124 1.00 0.00 C ATOM 813 C HIS A 56 -4.252 14.329 -1.163 1.00 0.00 C ATOM 814 O HIS A 56 -3.251 14.528 -1.851 1.00 0.00 O ATOM 815 CB HIS A 56 -4.976 16.618 -1.867 1.00 0.00 C ATOM 816 CG HIS A 56 -5.086 16.504 -3.356 1.00 0.00 C ATOM 817 ND1 HIS A 56 -4.150 17.028 -4.222 1.00 0.00 N ATOM 818 CD2 HIS A 56 -6.028 15.919 -4.132 1.00 0.00 C ATOM 819 CE1 HIS A 56 -4.512 16.772 -5.467 1.00 0.00 C ATOM 820 NE2 HIS A 56 -5.649 16.100 -5.440 1.00 0.00 N ATOM 0 H HIS A 56 -6.760 15.754 0.409 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.259 14.914 -1.617 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.598 17.446 -1.527 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.947 16.864 -1.605 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -6.913 15.405 -3.787 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -3.971 17.063 -6.355 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -6.162 15.769 -6.257 1.00 0.00 H new ATOM 828 N PHE A 57 -4.415 13.239 -0.421 1.00 0.00 N ATOM 829 CA PHE A 57 -3.402 12.191 -0.370 1.00 0.00 C ATOM 830 C PHE A 57 -3.645 11.147 -1.456 1.00 0.00 C ATOM 831 O PHE A 57 -4.766 10.672 -1.636 1.00 0.00 O ATOM 832 CB PHE A 57 -3.401 11.521 1.006 1.00 0.00 C ATOM 833 CG PHE A 57 -2.697 10.194 1.025 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.456 10.044 0.428 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.278 9.097 1.641 1.00 0.00 C ATOM 836 CE1 PHE A 57 -0.806 8.824 0.444 1.00 0.00 C ATOM 837 CE2 PHE A 57 -2.632 7.875 1.661 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.395 7.738 1.061 1.00 0.00 C ATOM 0 H PHE A 57 -5.238 13.058 0.153 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.429 12.651 -0.544 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.924 12.187 1.725 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.431 11.382 1.335 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.991 10.890 -0.056 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.245 9.198 2.110 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.161 8.720 -0.025 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.094 7.028 2.146 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.890 6.784 1.075 1.00 0.00 H new ATOM 848 N ILE A 58 -2.585 10.796 -2.177 1.00 0.00 N ATOM 849 CA ILE A 58 -2.682 9.809 -3.245 1.00 0.00 C ATOM 850 C ILE A 58 -1.608 8.736 -3.101 1.00 0.00 C ATOM 851 O ILE A 58 -0.414 9.023 -3.194 1.00 0.00 O ATOM 852 CB ILE A 58 -2.554 10.465 -4.632 1.00 0.00 C ATOM 853 CG1 ILE A 58 -3.668 11.493 -4.839 1.00 0.00 C ATOM 854 CG2 ILE A 58 -2.593 9.407 -5.725 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.346 12.857 -4.268 1.00 0.00 C ATOM 0 H ILE A 58 -1.650 11.180 -2.041 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.666 9.348 -3.160 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.595 10.980 -4.686 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.866 11.592 -5.906 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.584 11.122 -4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.501 9.887 -6.699 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.768 8.709 -5.585 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.538 8.866 -5.674 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.180 13.534 -4.451 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.177 12.771 -3.195 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.448 13.249 -4.746 1.00 0.00 H new ATOM 867 N CYS A 59 -2.040 7.500 -2.876 1.00 0.00 N ATOM 868 CA CYS A 59 -1.114 6.383 -2.721 1.00 0.00 C ATOM 869 C CYS A 59 -1.032 5.563 -4.004 1.00 0.00 C ATOM 870 O CYS A 59 -1.923 4.769 -4.302 1.00 0.00 O ATOM 871 CB CYS A 59 -1.550 5.491 -1.558 1.00 0.00 C ATOM 872 SG CYS A 59 -0.246 4.409 -0.929 1.00 0.00 S ATOM 0 H CYS A 59 -3.025 7.246 -2.797 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.125 6.789 -2.507 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -1.908 6.122 -0.744 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.392 4.878 -1.880 1.00 0.00 H new ATOM 0 HG CYS A 59 -0.436 4.192 0.339 1.00 0.00 H new ATOM 878 N GLN A 60 0.043 5.763 -4.760 1.00 0.00 N ATOM 879 CA GLN A 60 0.240 5.043 -6.013 1.00 0.00 C ATOM 880 C GLN A 60 1.204 3.876 -5.824 1.00 0.00 C ATOM 881 O GLN A 60 1.960 3.833 -4.854 1.00 0.00 O ATOM 882 CB GLN A 60 0.771 5.989 -7.091 1.00 0.00 C ATOM 883 CG GLN A 60 -0.232 7.047 -7.520 1.00 0.00 C ATOM 884 CD GLN A 60 -1.555 6.452 -7.962 1.00 0.00 C ATOM 885 OE1 GLN A 60 -1.820 6.320 -9.157 1.00 0.00 O ATOM 886 NE2 GLN A 60 -2.393 6.090 -6.998 1.00 0.00 N ATOM 0 H GLN A 60 0.790 6.417 -4.527 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.724 4.646 -6.331 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.670 6.482 -6.720 1.00 0.00 H new ATOM 0 HB3 GLN A 60 1.065 5.404 -7.963 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -0.406 7.734 -6.692 1.00 0.00 H new ATOM 0 HG3 GLN A 60 0.190 7.632 -8.337 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -2.132 6.218 -6.020 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -3.298 5.684 -7.235 1.00 0.00 H new ATOM 895 N ALA A 61 1.170 2.931 -6.757 1.00 0.00 N ATOM 896 CA ALA A 61 2.041 1.764 -6.695 1.00 0.00 C ATOM 897 C ALA A 61 2.325 1.215 -8.089 1.00 0.00 C ATOM 898 O ALA A 61 1.654 1.574 -9.056 1.00 0.00 O ATOM 899 CB ALA A 61 1.419 0.687 -5.818 1.00 0.00 C ATOM 0 H ALA A 61 0.548 2.951 -7.565 1.00 0.00 H new ATOM 0 HA ALA A 61 2.989 2.073 -6.255 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.080 -0.179 -5.781 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.274 1.077 -4.810 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.456 0.390 -6.234 1.00 0.00 H new ATOM 905 N ALA A 62 3.324 0.344 -8.184 1.00 0.00 N ATOM 906 CA ALA A 62 3.695 -0.256 -9.460 1.00 0.00 C ATOM 907 C ALA A 62 4.156 -1.698 -9.276 1.00 0.00 C ATOM 908 O ALA A 62 4.882 -2.013 -8.334 1.00 0.00 O ATOM 909 CB ALA A 62 4.785 0.567 -10.132 1.00 0.00 C ATOM 0 H ALA A 62 3.891 0.038 -7.393 1.00 0.00 H new ATOM 0 HA ALA A 62 2.813 -0.264 -10.100 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.053 0.108 -11.084 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.421 1.579 -10.307 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.663 0.604 -9.487 1.00 0.00 H new ATOM 915 N VAL A 63 3.727 -2.571 -10.183 1.00 0.00 N ATOM 916 CA VAL A 63 4.096 -3.980 -10.120 1.00 0.00 C ATOM 917 C VAL A 63 4.562 -4.487 -11.481 1.00 0.00 C ATOM 918 O VAL A 63 4.121 -4.017 -12.530 1.00 0.00 O ATOM 919 CB VAL A 63 2.919 -4.848 -9.637 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.297 -4.253 -8.383 1.00 0.00 C ATOM 921 CG2 VAL A 63 1.880 -4.996 -10.738 1.00 0.00 C ATOM 0 H VAL A 63 3.124 -2.327 -10.969 1.00 0.00 H new ATOM 0 HA VAL A 63 4.915 -4.061 -9.405 1.00 0.00 H new ATOM 0 HB VAL A 63 3.298 -5.840 -9.391 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.467 -4.879 -8.056 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.047 -4.203 -7.593 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.931 -3.249 -8.600 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.055 -5.612 -10.380 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.503 -4.012 -11.017 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.336 -5.470 -11.607 1.00 0.00 H new ATOM 931 N PRO A 64 5.475 -5.470 -11.465 1.00 0.00 N ATOM 932 CA PRO A 64 6.020 -6.063 -12.690 1.00 0.00 C ATOM 933 C PRO A 64 4.988 -6.900 -13.437 1.00 0.00 C ATOM 934 O PRO A 64 4.109 -7.511 -12.828 1.00 0.00 O ATOM 935 CB PRO A 64 7.158 -6.949 -12.178 1.00 0.00 C ATOM 936 CG PRO A 64 6.780 -7.279 -10.775 1.00 0.00 C ATOM 937 CD PRO A 64 6.045 -6.077 -10.251 1.00 0.00 C ATOM 0 HA PRO A 64 6.340 -5.304 -13.404 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.261 -7.850 -12.783 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.114 -6.428 -12.218 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.150 -8.168 -10.739 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.663 -7.490 -10.172 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.268 -6.359 -9.540 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.715 -5.390 -9.735 1.00 0.00 H new ATOM 945 N LYS A 65 5.099 -6.925 -14.761 1.00 0.00 N ATOM 946 CA LYS A 65 4.177 -7.689 -15.593 1.00 0.00 C ATOM 947 C LYS A 65 3.832 -9.023 -14.939 1.00 0.00 C ATOM 948 O LYS A 65 2.679 -9.455 -14.958 1.00 0.00 O ATOM 949 CB LYS A 65 4.786 -7.930 -16.976 1.00 0.00 C ATOM 950 CG LYS A 65 4.644 -6.746 -17.918 1.00 0.00 C ATOM 951 CD LYS A 65 5.258 -7.038 -19.277 1.00 0.00 C ATOM 952 CE LYS A 65 6.767 -6.854 -19.257 1.00 0.00 C ATOM 953 NZ LYS A 65 7.157 -5.435 -19.482 1.00 0.00 N ATOM 0 H LYS A 65 5.819 -6.424 -15.281 1.00 0.00 H new ATOM 0 HA LYS A 65 3.260 -7.110 -15.702 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.844 -8.168 -16.862 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.310 -8.801 -17.426 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.589 -6.501 -18.039 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.126 -5.872 -17.480 1.00 0.00 H new ATOM 0 HD2 LYS A 65 5.019 -8.059 -19.574 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.820 -6.378 -20.025 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.161 -7.191 -18.298 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.219 -7.481 -20.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.193 -5.352 -19.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.803 -5.120 -20.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.747 -4.840 -18.734 1.00 0.00 H new ATOM 967 N SER A 66 4.837 -9.670 -14.359 1.00 0.00 N ATOM 968 CA SER A 66 4.640 -10.957 -13.700 1.00 0.00 C ATOM 969 C SER A 66 3.377 -10.940 -12.845 1.00 0.00 C ATOM 970 O SER A 66 2.546 -11.846 -12.926 1.00 0.00 O ATOM 971 CB SER A 66 5.853 -11.301 -12.834 1.00 0.00 C ATOM 972 OG SER A 66 7.050 -11.258 -13.591 1.00 0.00 O ATOM 0 H SER A 66 5.796 -9.325 -14.332 1.00 0.00 H new ATOM 0 HA SER A 66 4.526 -11.720 -14.470 1.00 0.00 H new ATOM 0 HB2 SER A 66 5.920 -10.600 -12.002 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.727 -12.295 -12.404 1.00 0.00 H new ATOM 0 HG SER A 66 7.810 -11.480 -13.014 1.00 0.00 H new ATOM 978 N LEU A 67 3.240 -9.905 -12.024 1.00 0.00 N ATOM 979 CA LEU A 67 2.078 -9.769 -11.151 1.00 0.00 C ATOM 980 C LEU A 67 1.099 -8.740 -11.705 1.00 0.00 C ATOM 981 O LEU A 67 1.370 -8.094 -12.717 1.00 0.00 O ATOM 982 CB LEU A 67 2.518 -9.366 -9.743 1.00 0.00 C ATOM 983 CG LEU A 67 3.742 -10.094 -9.187 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.306 -9.351 -7.986 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.387 -11.526 -8.812 1.00 0.00 C ATOM 0 H LEU A 67 3.918 -9.148 -11.944 1.00 0.00 H new ATOM 0 HA LEU A 67 1.574 -10.734 -11.105 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.725 -8.296 -9.741 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.683 -9.530 -9.062 1.00 0.00 H new ATOM 0 HG LEU A 67 4.507 -10.122 -9.963 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.177 -9.884 -7.604 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.599 -8.345 -8.286 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.547 -9.290 -7.206 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.270 -12.029 -8.418 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.604 -11.520 -8.053 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.032 -12.056 -9.696 1.00 0.00 H new ATOM 997 N GLN A 68 -0.038 -8.591 -11.033 1.00 0.00 N ATOM 998 CA GLN A 68 -1.057 -7.638 -11.458 1.00 0.00 C ATOM 999 C GLN A 68 -1.371 -6.644 -10.345 1.00 0.00 C ATOM 1000 O GLN A 68 -1.103 -6.906 -9.171 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.332 -8.374 -11.875 1.00 0.00 C ATOM 1002 CG GLN A 68 -3.126 -7.654 -12.953 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.572 -8.104 -13.011 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -5.321 -7.954 -12.046 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -4.973 -8.660 -14.148 1.00 0.00 N ATOM 0 H GLN A 68 -0.277 -9.117 -10.193 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.668 -7.086 -12.314 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -2.066 -9.368 -12.234 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.966 -8.510 -10.999 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -3.091 -6.580 -12.769 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.656 -7.827 -13.921 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -4.318 -8.765 -14.923 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.936 -8.982 -14.246 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.939 -5.503 -10.720 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.289 -4.469 -9.753 1.00 0.00 C ATOM 1016 C LEU A 69 -3.629 -3.829 -10.102 1.00 0.00 C ATOM 1017 O LEU A 69 -3.876 -3.474 -11.254 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.197 -3.399 -9.704 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.337 -2.347 -8.603 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -1.017 -2.951 -7.244 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.434 -1.155 -8.885 1.00 0.00 C ATOM 0 H LEU A 69 -2.167 -5.271 -11.687 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.375 -4.937 -8.772 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.234 -3.896 -9.584 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.174 -2.888 -10.666 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.370 -1.999 -8.589 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.122 -2.188 -6.473 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.705 -3.771 -7.039 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.006 -3.328 -7.245 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.547 -0.417 -8.091 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.604 -1.486 -8.927 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.711 -0.707 -9.839 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.488 -3.683 -9.098 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.802 -3.084 -9.299 1.00 0.00 C ATOM 1035 C GLN A 70 -6.112 -2.071 -8.201 1.00 0.00 C ATOM 1036 O GLN A 70 -6.222 -2.427 -7.027 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.881 -4.168 -9.329 1.00 0.00 C ATOM 1038 CG GLN A 70 -8.276 -3.631 -9.604 1.00 0.00 C ATOM 1039 CD GLN A 70 -9.018 -3.258 -8.335 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -8.783 -3.834 -7.273 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -9.922 -2.291 -8.440 1.00 0.00 N ATOM 0 H GLN A 70 -4.298 -3.971 -8.138 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.794 -2.563 -10.257 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.626 -4.902 -10.094 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.884 -4.692 -8.373 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.204 -2.755 -10.249 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.849 -4.381 -10.149 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.085 -1.840 -9.341 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -10.454 -1.999 -7.620 1.00 0.00 H new ATOM 1050 N LEU A 71 -6.253 -0.809 -8.591 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.550 0.256 -7.640 1.00 0.00 C ATOM 1052 C LEU A 71 -8.050 0.344 -7.372 1.00 0.00 C ATOM 1053 O LEU A 71 -8.825 0.717 -8.252 1.00 0.00 O ATOM 1054 CB LEU A 71 -6.035 1.596 -8.167 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.759 2.671 -7.114 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.657 3.608 -7.584 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -7.028 3.451 -6.803 1.00 0.00 C ATOM 0 H LEU A 71 -6.166 -0.498 -9.559 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.045 0.023 -6.702 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.115 1.416 -8.723 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.764 1.989 -8.876 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.425 2.180 -6.200 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.474 4.366 -6.822 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.744 3.038 -7.755 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.962 4.092 -8.512 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.813 4.211 -6.052 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.392 3.931 -7.711 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.789 2.770 -6.422 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.449 0.002 -6.152 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.855 0.044 -5.769 1.00 0.00 C ATOM 1071 C GLN A 72 -10.234 1.423 -5.240 1.00 0.00 C ATOM 1072 O GLN A 72 -9.390 2.154 -4.723 1.00 0.00 O ATOM 1073 CB GLN A 72 -10.150 -1.020 -4.710 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.585 -1.000 -4.209 1.00 0.00 C ATOM 1075 CD GLN A 72 -12.579 -1.428 -5.271 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -13.460 -0.660 -5.659 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -12.444 -2.660 -5.746 1.00 0.00 N ATOM 0 H GLN A 72 -7.819 -0.307 -5.412 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.453 -0.162 -6.657 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.933 -2.004 -5.126 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.477 -0.876 -3.865 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.674 -1.660 -3.346 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.833 0.005 -3.868 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.699 -3.263 -5.396 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -13.085 -3.004 -6.461 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.509 1.773 -5.374 1.00 0.00 N ATOM 1087 CA ALA A 73 -12.000 3.064 -4.908 1.00 0.00 C ATOM 1088 C ALA A 73 -11.733 3.248 -3.418 1.00 0.00 C ATOM 1089 O ALA A 73 -12.260 2.523 -2.574 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.488 3.200 -5.200 1.00 0.00 C ATOM 0 H ALA A 73 -12.221 1.180 -5.802 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.462 3.845 -5.446 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.841 4.169 -4.847 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.657 3.122 -6.274 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.033 2.407 -4.689 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.894 4.240 -3.085 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.538 4.542 -1.695 1.00 0.00 C ATOM 1098 C PRO A 74 -11.705 5.134 -0.913 1.00 0.00 C ATOM 1099 O PRO A 74 -12.802 5.300 -1.447 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.411 5.568 -1.833 1.00 0.00 C ATOM 1101 CG PRO A 74 -9.645 6.212 -3.156 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.230 5.144 -4.038 1.00 0.00 C ATOM 0 HA PRO A 74 -10.252 3.646 -1.143 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.441 6.300 -1.026 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.433 5.089 -1.793 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.326 7.058 -3.063 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -8.714 6.596 -3.573 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.936 5.559 -4.757 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.459 4.628 -4.610 1.00 0.00 H new ATOM 1110 N SER A 75 -11.462 5.450 0.355 1.00 0.00 N ATOM 1111 CA SER A 75 -12.495 6.021 1.212 1.00 0.00 C ATOM 1112 C SER A 75 -12.599 7.529 1.007 1.00 0.00 C ATOM 1113 O SER A 75 -13.694 8.074 0.871 1.00 0.00 O ATOM 1114 CB SER A 75 -12.196 5.714 2.681 1.00 0.00 C ATOM 1115 OG SER A 75 -12.910 6.586 3.540 1.00 0.00 O ATOM 0 H SER A 75 -10.559 5.320 0.812 1.00 0.00 H new ATOM 0 HA SER A 75 -13.449 5.568 0.940 1.00 0.00 H new ATOM 0 HB2 SER A 75 -12.464 4.681 2.902 1.00 0.00 H new ATOM 0 HB3 SER A 75 -11.126 5.812 2.866 1.00 0.00 H new ATOM 0 HG SER A 75 -12.703 6.368 4.473 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.450 8.198 0.985 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.433 9.636 0.796 1.00 0.00 C ATOM 1123 C GLY A 76 -10.027 10.202 0.775 1.00 0.00 C ATOM 1124 O GLY A 76 -9.094 9.582 1.284 1.00 0.00 O ATOM 0 H GLY A 76 -10.531 7.769 1.095 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.934 9.882 -0.140 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.001 10.111 1.596 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.874 11.382 0.183 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.570 12.030 0.096 1.00 0.00 C ATOM 1130 C ASN A 77 -8.361 12.990 1.263 1.00 0.00 C ATOM 1131 O ASN A 77 -7.838 14.092 1.089 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.439 12.783 -1.229 1.00 0.00 C ATOM 1133 CG ASN A 77 -8.737 11.902 -2.427 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -9.153 10.753 -2.278 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -8.526 12.438 -3.623 1.00 0.00 N ATOM 0 H ASN A 77 -10.636 11.909 -0.243 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.803 11.257 0.143 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.120 13.634 -1.229 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.429 13.183 -1.318 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.710 11.893 -4.466 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -8.180 13.395 -3.699 1.00 0.00 H new ATOM 1142 N THR A 78 -8.772 12.566 2.453 1.00 0.00 N ATOM 1143 CA THR A 78 -8.631 13.387 3.649 1.00 0.00 C ATOM 1144 C THR A 78 -8.326 12.530 4.872 1.00 0.00 C ATOM 1145 O THR A 78 -8.870 11.437 5.029 1.00 0.00 O ATOM 1146 CB THR A 78 -9.905 14.211 3.918 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.254 14.967 2.753 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.702 15.151 5.097 1.00 0.00 C ATOM 0 H THR A 78 -9.206 11.657 2.615 1.00 0.00 H new ATOM 0 HA THR A 78 -7.798 14.067 3.469 1.00 0.00 H new ATOM 0 HB THR A 78 -10.714 13.521 4.159 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.065 15.487 2.931 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.614 15.722 5.268 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.465 14.570 5.989 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.881 15.835 4.880 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.452 13.034 5.738 1.00 0.00 N ATOM 1157 CA VAL A 79 -7.075 12.315 6.949 1.00 0.00 C ATOM 1158 C VAL A 79 -6.983 13.259 8.143 1.00 0.00 C ATOM 1159 O VAL A 79 -6.234 14.236 8.136 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.727 11.590 6.776 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -5.324 10.895 8.067 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.800 10.597 5.626 1.00 0.00 C ATOM 0 H VAL A 79 -6.992 13.937 5.623 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.855 11.576 7.133 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.964 12.331 6.538 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.369 10.389 7.925 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.228 11.633 8.863 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -6.085 10.164 8.340 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.839 10.094 5.518 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.575 9.859 5.831 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.038 11.126 4.703 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.760 12.962 9.194 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.783 13.771 10.416 1.00 0.00 C ATOM 1174 C PRO A 80 -6.490 13.652 11.215 1.00 0.00 C ATOM 1175 O PRO A 80 -6.058 12.551 11.554 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.956 13.187 11.207 1.00 0.00 C ATOM 1177 CG PRO A 80 -9.080 11.784 10.720 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.677 11.812 9.272 1.00 0.00 C ATOM 0 HA PRO A 80 -7.885 14.834 10.198 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.765 13.218 12.280 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.872 13.750 11.030 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -8.437 11.114 11.291 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -10.101 11.420 10.834 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -8.186 10.886 8.974 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.539 11.941 8.618 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.876 14.793 11.512 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.634 14.817 12.273 1.00 0.00 C ATOM 1188 C ALA A 81 -4.896 14.596 13.759 1.00 0.00 C ATOM 1189 O ALA A 81 -3.965 14.556 14.564 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.905 16.134 12.054 1.00 0.00 C ATOM 0 H ALA A 81 -6.219 15.713 11.237 1.00 0.00 H new ATOM 0 HA ALA A 81 -4.004 14.002 11.917 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.979 16.137 12.629 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.675 16.251 10.995 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.538 16.959 12.381 1.00 0.00 H new ATOM 1196 N ARG A 82 -6.168 14.455 14.116 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.552 14.240 15.506 1.00 0.00 C ATOM 1198 C ARG A 82 -6.884 12.772 15.758 1.00 0.00 C ATOM 1199 O ARG A 82 -7.945 12.448 16.290 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.754 15.115 15.866 1.00 0.00 C ATOM 1201 CG ARG A 82 -9.012 14.773 15.085 1.00 0.00 C ATOM 1202 CD ARG A 82 -9.123 15.604 13.816 1.00 0.00 C ATOM 1203 NE ARG A 82 -10.513 15.858 13.447 1.00 0.00 N ATOM 1204 CZ ARG A 82 -10.898 16.880 12.692 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -10.002 17.740 12.227 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -12.182 17.044 12.399 1.00 0.00 N ATOM 0 H ARG A 82 -6.950 14.486 13.462 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.707 14.517 16.137 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.960 15.014 16.932 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.499 16.160 15.688 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -9.005 13.714 14.828 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -9.888 14.944 15.711 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.607 16.553 13.958 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.620 15.087 12.999 1.00 0.00 H new ATOM 0 HE ARG A 82 -11.227 15.215 13.788 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.014 17.617 12.449 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.301 18.524 11.647 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -12.874 16.384 12.754 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -12.476 17.830 11.819 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.969 11.889 15.371 1.00 0.00 N ATOM 1221 CA GLY A 83 -6.184 10.466 15.563 1.00 0.00 C ATOM 1222 C GLY A 83 -7.590 10.037 15.193 1.00 0.00 C ATOM 1223 O GLY A 83 -8.259 9.350 15.963 1.00 0.00 O ATOM 0 H GLY A 83 -5.083 12.133 14.928 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.467 9.909 14.960 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.992 10.210 16.605 1.00 0.00 H new ATOM 1227 N GLY A 84 -8.041 10.445 14.011 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.374 10.091 13.562 1.00 0.00 C ATOM 1229 C GLY A 84 -9.431 8.706 12.948 1.00 0.00 C ATOM 1230 O GLY A 84 -9.291 7.702 13.648 1.00 0.00 O ATOM 0 H GLY A 84 -7.506 11.015 13.356 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.063 10.140 14.405 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.714 10.824 12.830 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.638 8.650 11.637 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.714 7.377 10.929 1.00 0.00 C ATOM 1236 C LEU A 85 -8.808 7.382 9.702 1.00 0.00 C ATOM 1237 O LEU A 85 -8.926 8.229 8.816 1.00 0.00 O ATOM 1238 CB LEU A 85 -11.157 7.090 10.510 1.00 0.00 C ATOM 1239 CG LEU A 85 -12.184 7.028 11.641 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.726 8.415 11.947 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.318 6.078 11.279 1.00 0.00 C ATOM 0 H LEU A 85 -9.756 9.471 11.043 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.375 6.592 11.605 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.469 7.860 9.804 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.177 6.140 9.975 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.689 6.649 12.535 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.455 8.351 12.754 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.907 9.067 12.249 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -13.205 8.823 11.057 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -14.040 6.046 12.095 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.811 6.428 10.372 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.916 5.079 11.111 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.882 6.413 9.646 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.940 6.282 8.531 1.00 0.00 C ATOM 1255 C PRO A 86 -7.624 5.838 7.242 1.00 0.00 C ATOM 1256 O PRO A 86 -8.782 5.419 7.256 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.964 5.207 9.016 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.742 4.406 10.002 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.685 5.370 10.667 1.00 0.00 C ATOM 0 HA PRO A 86 -6.464 7.231 8.287 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.615 4.587 8.190 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -5.081 5.652 9.476 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -7.289 3.603 9.508 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.082 3.939 10.733 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.625 4.890 10.938 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -7.261 5.780 11.584 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.901 5.932 6.132 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.439 5.538 4.835 1.00 0.00 C ATOM 1269 C ILE A 87 -6.968 4.140 4.447 1.00 0.00 C ATOM 1270 O ILE A 87 -5.774 3.842 4.484 1.00 0.00 O ATOM 1271 CB ILE A 87 -7.030 6.531 3.731 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.495 7.944 4.088 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.607 6.099 2.391 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.800 9.027 3.294 1.00 0.00 C ATOM 0 H ILE A 87 -5.942 6.277 6.104 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.525 5.540 4.929 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.943 6.537 3.651 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.570 8.017 3.923 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.323 8.117 5.150 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.310 6.810 1.620 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.231 5.108 2.135 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.695 6.068 2.456 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.179 10.002 3.599 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.727 8.981 3.478 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.993 8.879 2.231 1.00 0.00 H new ATOM 1286 N THR A 88 -7.915 3.286 4.072 1.00 0.00 N ATOM 1287 CA THR A 88 -7.599 1.920 3.675 1.00 0.00 C ATOM 1288 C THR A 88 -7.929 1.683 2.206 1.00 0.00 C ATOM 1289 O THR A 88 -9.045 1.948 1.761 1.00 0.00 O ATOM 1290 CB THR A 88 -8.363 0.894 4.533 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.748 1.252 4.605 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.780 0.819 5.935 1.00 0.00 C ATOM 0 H THR A 88 -8.908 3.517 4.035 1.00 0.00 H new ATOM 0 HA THR A 88 -6.528 1.787 3.830 1.00 0.00 H new ATOM 0 HB THR A 88 -8.264 -0.085 4.064 1.00 0.00 H new ATOM 0 HG1 THR A 88 -10.052 1.560 3.726 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.336 0.088 6.522 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.734 0.519 5.878 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.851 1.797 6.412 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.951 1.183 1.457 1.00 0.00 N ATOM 1301 CA GLN A 89 -7.139 0.911 0.037 1.00 0.00 C ATOM 1302 C GLN A 89 -6.983 -0.577 -0.258 1.00 0.00 C ATOM 1303 O GLN A 89 -6.285 -1.293 0.461 1.00 0.00 O ATOM 1304 CB GLN A 89 -6.138 1.716 -0.795 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.465 3.198 -0.874 1.00 0.00 C ATOM 1306 CD GLN A 89 -5.944 3.843 -2.143 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -4.936 4.550 -2.125 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -6.630 3.603 -3.254 1.00 0.00 N ATOM 0 H GLN A 89 -6.021 0.958 1.810 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.151 1.212 -0.234 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -5.143 1.594 -0.368 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -6.104 1.306 -1.804 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.545 3.331 -0.820 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.038 3.707 -0.010 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.460 3.011 -3.223 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -6.327 4.011 -4.139 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.638 -1.036 -1.318 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.573 -2.441 -1.708 1.00 0.00 C ATOM 1319 C LEU A 90 -6.817 -2.606 -3.023 1.00 0.00 C ATOM 1320 O LEU A 90 -6.972 -1.805 -3.945 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.983 -3.019 -1.841 1.00 0.00 C ATOM 1322 CG LEU A 90 -9.098 -4.336 -2.610 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -8.394 -5.456 -1.861 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.559 -4.687 -2.849 1.00 0.00 C ATOM 0 H LEU A 90 -8.220 -0.457 -1.923 1.00 0.00 H new ATOM 0 HA LEU A 90 -7.036 -2.985 -0.931 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.389 -3.169 -0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.613 -2.278 -2.333 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.611 -4.213 -3.577 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.487 -6.385 -2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.339 -5.208 -1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.850 -5.580 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.622 -5.627 -3.397 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -11.070 -4.790 -1.892 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -11.033 -3.896 -3.430 1.00 0.00 H new ATOM 1336 N PHE A 91 -6.000 -3.651 -3.102 1.00 0.00 N ATOM 1337 CA PHE A 91 -5.221 -3.923 -4.305 1.00 0.00 C ATOM 1338 C PHE A 91 -5.179 -5.420 -4.599 1.00 0.00 C ATOM 1339 O PHE A 91 -4.736 -6.214 -3.769 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.798 -3.382 -4.149 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.746 -1.910 -3.854 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.891 -1.444 -2.557 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.551 -0.992 -4.874 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.843 -0.090 -2.284 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.502 0.363 -4.606 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.648 0.814 -3.309 1.00 0.00 C ATOM 0 H PHE A 91 -5.860 -4.323 -2.348 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.704 -3.420 -5.143 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.298 -3.923 -3.346 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.240 -3.581 -5.064 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -4.043 -2.146 -1.751 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.436 -1.340 -5.890 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.958 0.261 -1.269 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.350 1.068 -5.410 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.610 1.872 -3.097 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.643 -5.797 -5.785 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.660 -7.198 -6.189 1.00 0.00 C ATOM 1358 C ARG A 92 -4.408 -7.549 -6.986 1.00 0.00 C ATOM 1359 O ARG A 92 -4.154 -6.977 -8.047 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.908 -7.495 -7.022 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.168 -7.670 -6.190 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.248 -8.410 -6.964 1.00 0.00 C ATOM 1363 NE ARG A 92 -10.471 -8.567 -6.182 1.00 0.00 N ATOM 1364 CZ ARG A 92 -11.645 -8.896 -6.711 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.753 -9.101 -8.016 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -12.713 -9.020 -5.933 1.00 0.00 N ATOM 0 H ARG A 92 -6.012 -5.152 -6.484 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.679 -7.810 -5.287 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.062 -6.683 -7.733 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.739 -8.401 -7.605 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.930 -8.219 -5.279 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.542 -6.693 -5.885 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.472 -7.867 -7.882 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -8.876 -9.392 -7.257 1.00 0.00 H new ATOM 0 HE ARG A 92 -10.422 -8.416 -5.174 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -10.934 -9.006 -8.617 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -12.655 -9.353 -8.420 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.633 -8.863 -4.928 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -13.614 -9.273 -6.340 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.628 -8.492 -6.468 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.403 -8.920 -7.132 1.00 0.00 C ATOM 1382 C ILE A 93 -2.427 -10.417 -7.419 1.00 0.00 C ATOM 1383 O ILE A 93 -2.847 -11.215 -6.579 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.159 -8.590 -6.285 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -1.003 -7.075 -6.138 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.086 -9.198 -6.914 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.292 -6.662 -4.868 1.00 0.00 C ATOM 0 H ILE A 93 -3.823 -8.974 -5.590 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.347 -8.374 -8.073 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.288 -9.021 -5.292 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.451 -6.690 -6.996 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.990 -6.612 -6.160 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.957 -8.956 -6.304 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.027 -10.281 -6.972 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.222 -8.793 -7.917 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.217 -5.575 -4.830 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.854 -7.017 -4.004 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.708 -7.096 -4.853 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.971 -10.794 -8.608 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.937 -12.197 -9.006 1.00 0.00 C ATOM 1401 C LEU A 94 -0.507 -12.725 -9.019 1.00 0.00 C ATOM 1402 O LEU A 94 0.354 -12.196 -9.720 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.570 -12.371 -10.388 1.00 0.00 C ATOM 1404 CG LEU A 94 -4.080 -12.610 -10.409 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.408 -14.001 -9.889 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.800 -11.549 -9.590 1.00 0.00 C ATOM 0 H LEU A 94 -1.619 -10.147 -9.314 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.509 -12.770 -8.276 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.355 -11.481 -10.979 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.083 -13.209 -10.886 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.425 -12.540 -11.441 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.487 -14.153 -9.911 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.923 -14.748 -10.518 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.049 -14.101 -8.865 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.874 -11.735 -9.617 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.451 -11.587 -8.558 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.592 -10.564 -10.008 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.261 -13.773 -8.239 1.00 0.00 N ATOM 1419 CA ASN A 95 1.065 -14.375 -8.162 1.00 0.00 C ATOM 1420 C ASN A 95 1.012 -15.856 -8.525 1.00 0.00 C ATOM 1421 O ASN A 95 1.617 -16.704 -7.868 1.00 0.00 O ATOM 1422 CB ASN A 95 1.645 -14.203 -6.757 1.00 0.00 C ATOM 1423 CG ASN A 95 2.973 -14.915 -6.589 1.00 0.00 C ATOM 1424 OD1 ASN A 95 3.107 -15.814 -5.758 1.00 0.00 O ATOM 1425 ND2 ASN A 95 3.963 -14.515 -7.378 1.00 0.00 N ATOM 0 H ASN A 95 -0.963 -14.223 -7.651 1.00 0.00 H new ATOM 0 HA ASN A 95 1.710 -13.866 -8.879 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.776 -13.141 -6.548 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.935 -14.586 -6.024 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.880 -14.957 -7.310 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.807 -13.766 -8.053 1.00 0.00 H new ATOM 1432 N PRO A 96 0.273 -16.177 -9.598 1.00 0.00 N ATOM 1433 CA PRO A 96 0.125 -17.555 -10.073 1.00 0.00 C ATOM 1434 C PRO A 96 1.414 -18.102 -10.677 1.00 0.00 C ATOM 1435 O PRO A 96 1.618 -19.314 -10.734 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.963 -17.445 -11.145 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.884 -16.036 -11.621 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.474 -15.218 -10.428 1.00 0.00 C ATOM 0 HA PRO A 96 -0.122 -18.241 -9.263 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.789 -18.148 -11.959 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.947 -17.670 -10.735 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.160 -15.937 -12.429 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.845 -15.702 -12.012 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.145 -14.369 -10.717 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.339 -14.817 -9.899 1.00 0.00 H new ATOM 1446 N ASN A 97 2.281 -17.200 -11.125 1.00 0.00 N ATOM 1447 CA ASN A 97 3.551 -17.593 -11.724 1.00 0.00 C ATOM 1448 C ASN A 97 4.570 -17.960 -10.649 1.00 0.00 C ATOM 1449 O ASN A 97 5.745 -18.182 -10.941 1.00 0.00 O ATOM 1450 CB ASN A 97 4.099 -16.462 -12.597 1.00 0.00 C ATOM 1451 CG ASN A 97 3.604 -16.544 -14.028 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.372 -16.827 -14.947 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.314 -16.295 -14.222 1.00 0.00 N ATOM 0 H ASN A 97 2.127 -16.192 -11.085 1.00 0.00 H new ATOM 0 HA ASN A 97 3.374 -18.470 -12.346 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.808 -15.503 -12.169 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.188 -16.496 -12.590 1.00 0.00 H new ATOM 0 HD21 ASN A 97 1.923 -16.334 -15.163 1.00 0.00 H new ATOM 0 HD22 ASN A 97 1.714 -16.064 -13.430 1.00 0.00 H new ATOM 1460 N LYS A 98 4.111 -18.023 -9.404 1.00 0.00 N ATOM 1461 CA LYS A 98 4.980 -18.364 -8.284 1.00 0.00 C ATOM 1462 C LYS A 98 6.323 -17.652 -8.400 1.00 0.00 C ATOM 1463 O LYS A 98 7.379 -18.274 -8.285 1.00 0.00 O ATOM 1464 CB LYS A 98 5.197 -19.878 -8.223 1.00 0.00 C ATOM 1465 CG LYS A 98 3.944 -20.658 -7.863 1.00 0.00 C ATOM 1466 CD LYS A 98 4.283 -22.024 -7.290 1.00 0.00 C ATOM 1467 CE LYS A 98 3.167 -22.547 -6.398 1.00 0.00 C ATOM 1468 NZ LYS A 98 2.128 -23.272 -7.179 1.00 0.00 N ATOM 0 H LYS A 98 3.141 -17.842 -9.145 1.00 0.00 H new ATOM 0 HA LYS A 98 4.493 -18.035 -7.366 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.565 -20.223 -9.189 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.974 -20.096 -7.490 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.359 -20.093 -7.137 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.322 -20.779 -8.750 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.460 -22.727 -8.104 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.208 -21.960 -6.717 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.586 -23.214 -5.645 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.707 -21.714 -5.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 1.385 -23.613 -6.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 1.710 -22.629 -7.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.562 -24.082 -7.666 1.00 0.00 H new ATOM 1482 N ALA A 99 6.276 -16.343 -8.628 1.00 0.00 N ATOM 1483 CA ALA A 99 7.490 -15.546 -8.757 1.00 0.00 C ATOM 1484 C ALA A 99 7.517 -14.419 -7.730 1.00 0.00 C ATOM 1485 O ALA A 99 6.756 -13.455 -7.810 1.00 0.00 O ATOM 1486 CB ALA A 99 7.604 -14.982 -10.165 1.00 0.00 C ATOM 0 H ALA A 99 5.411 -15.812 -8.727 1.00 0.00 H new ATOM 0 HA ALA A 99 8.344 -16.196 -8.568 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.515 -14.389 -10.247 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.638 -15.801 -10.883 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.740 -14.351 -10.375 1.00 0.00 H new ATOM 1492 N PRO A 100 8.415 -14.540 -6.741 1.00 0.00 N ATOM 1493 CA PRO A 100 8.562 -13.541 -5.679 1.00 0.00 C ATOM 1494 C PRO A 100 9.159 -12.234 -6.191 1.00 0.00 C ATOM 1495 O PRO A 100 10.376 -12.045 -6.170 1.00 0.00 O ATOM 1496 CB PRO A 100 9.518 -14.213 -4.689 1.00 0.00 C ATOM 1497 CG PRO A 100 10.294 -15.182 -5.511 1.00 0.00 C ATOM 1498 CD PRO A 100 9.354 -15.663 -6.582 1.00 0.00 C ATOM 0 HA PRO A 100 7.601 -13.264 -5.245 1.00 0.00 H new ATOM 0 HB2 PRO A 100 10.173 -13.483 -4.214 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.972 -14.718 -3.892 1.00 0.00 H new ATOM 0 HG2 PRO A 100 11.173 -14.707 -5.948 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.650 -16.013 -4.902 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.881 -15.881 -7.511 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.840 -16.577 -6.285 1.00 0.00 H new ATOM 1506 N LEU A 101 8.296 -11.336 -6.652 1.00 0.00 N ATOM 1507 CA LEU A 101 8.738 -10.046 -7.170 1.00 0.00 C ATOM 1508 C LEU A 101 8.668 -8.972 -6.089 1.00 0.00 C ATOM 1509 O LEU A 101 8.350 -9.259 -4.935 1.00 0.00 O ATOM 1510 CB LEU A 101 7.881 -9.635 -8.370 1.00 0.00 C ATOM 1511 CG LEU A 101 8.360 -10.126 -9.736 1.00 0.00 C ATOM 1512 CD1 LEU A 101 9.838 -9.820 -9.925 1.00 0.00 C ATOM 1513 CD2 LEU A 101 8.100 -11.618 -9.888 1.00 0.00 C ATOM 0 H LEU A 101 7.286 -11.477 -6.678 1.00 0.00 H new ATOM 0 HA LEU A 101 9.775 -10.147 -7.489 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.867 -10.002 -8.210 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.826 -8.547 -8.396 1.00 0.00 H new ATOM 0 HG LEU A 101 7.799 -9.599 -10.507 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.161 -10.177 -10.903 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.998 -8.744 -9.860 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.415 -10.320 -9.147 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.447 -11.950 -10.866 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.635 -12.162 -9.109 1.00 0.00 H new ATOM 0 HD23 LEU A 101 7.031 -11.812 -9.797 1.00 0.00 H new ATOM 1525 N ARG A 102 8.965 -7.734 -6.472 1.00 0.00 N ATOM 1526 CA ARG A 102 8.934 -6.617 -5.536 1.00 0.00 C ATOM 1527 C ARG A 102 7.789 -5.664 -5.864 1.00 0.00 C ATOM 1528 O ARG A 102 7.092 -5.835 -6.865 1.00 0.00 O ATOM 1529 CB ARG A 102 10.265 -5.863 -5.566 1.00 0.00 C ATOM 1530 CG ARG A 102 11.466 -6.733 -5.235 1.00 0.00 C ATOM 1531 CD ARG A 102 11.705 -6.806 -3.735 1.00 0.00 C ATOM 1532 NE ARG A 102 12.623 -7.884 -3.379 1.00 0.00 N ATOM 1533 CZ ARG A 102 12.254 -9.155 -3.261 1.00 0.00 C ATOM 1534 NH1 ARG A 102 10.993 -9.504 -3.469 1.00 0.00 N ATOM 1535 NH2 ARG A 102 13.149 -10.079 -2.933 1.00 0.00 N ATOM 0 H ARG A 102 9.230 -7.480 -7.424 1.00 0.00 H new ATOM 0 HA ARG A 102 8.774 -7.018 -4.535 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.404 -5.428 -6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.220 -5.036 -4.858 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.309 -7.737 -5.629 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.353 -6.333 -5.727 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.109 -5.856 -3.386 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.754 -6.956 -3.223 1.00 0.00 H new ATOM 0 HE ARG A 102 13.601 -7.649 -3.212 1.00 0.00 H new ATOM 0 HH11 ARG A 102 10.303 -8.796 -3.720 1.00 0.00 H new ATOM 0 HH12 ARG A 102 10.712 -10.480 -3.378 1.00 0.00 H new ATOM 0 HH21 ARG A 102 14.120 -9.813 -2.771 1.00 0.00 H new ATOM 0 HH22 ARG A 102 12.865 -11.055 -2.843 1.00 0.00 H new ATOM 1549 N LEU A 103 7.601 -4.659 -5.015 1.00 0.00 N ATOM 1550 CA LEU A 103 6.540 -3.678 -5.214 1.00 0.00 C ATOM 1551 C LEU A 103 7.053 -2.263 -4.967 1.00 0.00 C ATOM 1552 O LEU A 103 7.882 -2.037 -4.085 1.00 0.00 O ATOM 1553 CB LEU A 103 5.362 -3.975 -4.284 1.00 0.00 C ATOM 1554 CG LEU A 103 4.348 -2.845 -4.103 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.384 -2.799 -5.278 1.00 0.00 C ATOM 1556 CD2 LEU A 103 3.589 -3.014 -2.795 1.00 0.00 C ATOM 0 H LEU A 103 8.169 -4.502 -4.183 1.00 0.00 H new ATOM 0 HA LEU A 103 6.205 -3.748 -6.249 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.836 -4.850 -4.665 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.757 -4.242 -3.304 1.00 0.00 H new ATOM 0 HG LEU A 103 4.889 -1.900 -4.067 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.670 -1.989 -5.131 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.941 -2.629 -6.199 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.849 -3.746 -5.347 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.872 -2.201 -2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.059 -3.967 -2.802 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.291 -2.996 -1.962 1.00 0.00 H new ATOM 1568 N LYS A 104 6.554 -1.313 -5.750 1.00 0.00 N ATOM 1569 CA LYS A 104 6.959 0.082 -5.614 1.00 0.00 C ATOM 1570 C LYS A 104 5.832 0.919 -5.018 1.00 0.00 C ATOM 1571 O LYS A 104 4.682 0.830 -5.451 1.00 0.00 O ATOM 1572 CB LYS A 104 7.366 0.650 -6.976 1.00 0.00 C ATOM 1573 CG LYS A 104 7.935 2.056 -6.902 1.00 0.00 C ATOM 1574 CD LYS A 104 8.583 2.466 -8.214 1.00 0.00 C ATOM 1575 CE LYS A 104 9.994 1.912 -8.335 1.00 0.00 C ATOM 1576 NZ LYS A 104 10.563 2.134 -9.693 1.00 0.00 N ATOM 0 H LYS A 104 5.868 -1.483 -6.486 1.00 0.00 H new ATOM 0 HA LYS A 104 7.814 0.123 -4.939 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.106 -0.009 -7.429 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.497 0.653 -7.634 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.140 2.759 -6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.671 2.110 -6.100 1.00 0.00 H new ATOM 0 HD2 LYS A 104 7.978 2.109 -9.047 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.611 3.553 -8.283 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.635 2.385 -7.591 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.985 0.844 -8.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 11.525 1.742 -9.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 9.966 1.661 -10.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 10.596 3.154 -9.893 1.00 0.00 H new ATOM 1590 N LEU A 105 6.169 1.734 -4.025 1.00 0.00 N ATOM 1591 CA LEU A 105 5.186 2.590 -3.370 1.00 0.00 C ATOM 1592 C LEU A 105 5.550 4.062 -3.534 1.00 0.00 C ATOM 1593 O LEU A 105 6.682 4.465 -3.269 1.00 0.00 O ATOM 1594 CB LEU A 105 5.085 2.241 -1.884 1.00 0.00 C ATOM 1595 CG LEU A 105 4.346 0.945 -1.548 1.00 0.00 C ATOM 1596 CD1 LEU A 105 4.539 0.585 -0.083 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.865 1.075 -1.876 1.00 0.00 C ATOM 0 H LEU A 105 7.116 1.820 -3.655 1.00 0.00 H new ATOM 0 HA LEU A 105 4.219 2.418 -3.844 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.094 2.176 -1.477 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.587 3.064 -1.371 1.00 0.00 H new ATOM 0 HG LEU A 105 4.764 0.143 -2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.006 -0.340 0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.601 0.449 0.122 1.00 0.00 H new ATOM 0 HD13 LEU A 105 4.148 1.387 0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.355 0.144 -1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.434 1.889 -1.294 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.745 1.285 -2.939 1.00 0.00 H new ATOM 1609 N ARG A 106 4.581 4.861 -3.971 1.00 0.00 N ATOM 1610 CA ARG A 106 4.800 6.288 -4.170 1.00 0.00 C ATOM 1611 C ARG A 106 3.789 7.109 -3.374 1.00 0.00 C ATOM 1612 O ARG A 106 2.579 6.982 -3.569 1.00 0.00 O ATOM 1613 CB ARG A 106 4.701 6.639 -5.656 1.00 0.00 C ATOM 1614 CG ARG A 106 4.676 8.134 -5.928 1.00 0.00 C ATOM 1615 CD ARG A 106 5.150 8.452 -7.337 1.00 0.00 C ATOM 1616 NE ARG A 106 4.058 8.404 -8.306 1.00 0.00 N ATOM 1617 CZ ARG A 106 3.146 9.361 -8.434 1.00 0.00 C ATOM 1618 NH1 ARG A 106 3.195 10.436 -7.659 1.00 0.00 N ATOM 1619 NH2 ARG A 106 2.182 9.245 -9.339 1.00 0.00 N ATOM 0 H ARG A 106 3.637 4.544 -4.194 1.00 0.00 H new ATOM 0 HA ARG A 106 5.801 6.530 -3.813 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.547 6.197 -6.182 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.798 6.188 -6.068 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.664 8.513 -5.789 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.310 8.647 -5.205 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.604 9.443 -7.352 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.924 7.742 -7.628 1.00 0.00 H new ATOM 0 HE ARG A 106 3.992 7.591 -8.918 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.934 10.529 -6.963 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.493 11.169 -7.759 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.141 8.420 -9.937 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.482 9.981 -9.436 1.00 0.00 H new ATOM 1633 N LEU A 107 4.292 7.950 -2.477 1.00 0.00 N ATOM 1634 CA LEU A 107 3.434 8.791 -1.651 1.00 0.00 C ATOM 1635 C LEU A 107 3.549 10.256 -2.061 1.00 0.00 C ATOM 1636 O LEU A 107 4.649 10.800 -2.158 1.00 0.00 O ATOM 1637 CB LEU A 107 3.800 8.633 -0.174 1.00 0.00 C ATOM 1638 CG LEU A 107 3.741 7.210 0.383 1.00 0.00 C ATOM 1639 CD1 LEU A 107 4.142 7.195 1.850 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.348 6.624 0.203 1.00 0.00 C ATOM 0 H LEU A 107 5.290 8.067 -2.303 1.00 0.00 H new ATOM 0 HA LEU A 107 2.403 8.471 -1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.809 9.018 -0.027 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.131 9.260 0.415 1.00 0.00 H new ATOM 0 HG LEU A 107 4.447 6.593 -0.172 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.094 6.174 2.230 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.159 7.573 1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.460 7.826 2.420 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.325 5.611 0.605 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.622 7.241 0.732 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.098 6.599 -0.858 1.00 0.00 H new ATOM 1652 N THR A 108 2.405 10.890 -2.300 1.00 0.00 N ATOM 1653 CA THR A 108 2.377 12.292 -2.698 1.00 0.00 C ATOM 1654 C THR A 108 1.209 13.025 -2.049 1.00 0.00 C ATOM 1655 O THR A 108 0.051 12.807 -2.406 1.00 0.00 O ATOM 1656 CB THR A 108 2.274 12.439 -4.228 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.258 11.567 -4.737 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.604 12.119 -4.894 1.00 0.00 C ATOM 0 H THR A 108 1.486 10.455 -2.225 1.00 0.00 H new ATOM 0 HA THR A 108 3.313 12.735 -2.359 1.00 0.00 H new ATOM 0 HB THR A 108 2.012 13.473 -4.454 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.444 11.664 -4.200 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.506 12.230 -5.974 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.369 12.803 -4.527 1.00 0.00 H new ATOM 0 HG23 THR A 108 3.891 11.094 -4.659 1.00 0.00 H new ATOM 1666 N TYR A 109 1.520 13.894 -1.094 1.00 0.00 N ATOM 1667 CA TYR A 109 0.496 14.659 -0.393 1.00 0.00 C ATOM 1668 C TYR A 109 1.072 15.955 0.170 1.00 0.00 C ATOM 1669 O TYR A 109 2.257 16.243 0.005 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.109 13.824 0.737 1.00 0.00 C ATOM 1671 CG TYR A 109 0.891 13.427 1.799 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.801 12.401 1.574 1.00 0.00 C ATOM 1673 CD2 TYR A 109 0.925 14.076 3.027 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.716 12.034 2.542 1.00 0.00 C ATOM 1675 CE2 TYR A 109 1.838 13.716 3.999 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.731 12.695 3.752 1.00 0.00 C ATOM 1677 OH TYR A 109 3.641 12.333 4.719 1.00 0.00 O ATOM 0 H TYR A 109 2.474 14.086 -0.787 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.286 14.912 -1.109 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -0.916 14.389 1.203 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.554 12.923 0.314 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.793 11.882 0.627 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.226 14.875 3.225 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.416 11.234 2.352 1.00 0.00 H new ATOM 0 HE2 TYR A 109 1.852 14.232 4.948 1.00 0.00 H new ATOM 0 HH TYR A 109 3.866 13.115 5.266 1.00 0.00 H new ATOM 1687 N ASP A 110 0.224 16.732 0.835 1.00 0.00 N ATOM 1688 CA ASP A 110 0.648 17.997 1.424 1.00 0.00 C ATOM 1689 C ASP A 110 0.500 17.966 2.942 1.00 0.00 C ATOM 1690 O ASP A 110 -0.588 17.721 3.465 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.168 19.153 0.843 1.00 0.00 C ATOM 1692 CG ASP A 110 0.223 19.477 -0.585 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.288 18.541 -1.410 1.00 0.00 O ATOM 1694 OD2 ASP A 110 0.464 20.667 -0.879 1.00 0.00 O ATOM 0 H ASP A 110 -0.761 16.508 0.980 1.00 0.00 H new ATOM 0 HA ASP A 110 1.700 18.148 1.183 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.228 18.900 0.878 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.031 20.038 1.464 1.00 0.00 H new ATOM 1699 N HIS A 111 1.601 18.214 3.644 1.00 0.00 N ATOM 1700 CA HIS A 111 1.594 18.214 5.102 1.00 0.00 C ATOM 1701 C HIS A 111 2.054 19.563 5.648 1.00 0.00 C ATOM 1702 O HIS A 111 2.846 20.262 5.016 1.00 0.00 O ATOM 1703 CB HIS A 111 2.494 17.101 5.638 1.00 0.00 C ATOM 1704 CG HIS A 111 2.255 16.779 7.081 1.00 0.00 C ATOM 1705 ND1 HIS A 111 3.205 16.190 7.888 1.00 0.00 N ATOM 1706 CD2 HIS A 111 1.165 16.969 7.862 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.710 16.030 9.102 1.00 0.00 C ATOM 1708 NE2 HIS A 111 1.474 16.496 9.113 1.00 0.00 N ATOM 0 H HIS A 111 2.509 18.417 3.227 1.00 0.00 H new ATOM 0 HA HIS A 111 0.571 18.036 5.435 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.338 16.201 5.043 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.536 17.393 5.507 1.00 0.00 H new ATOM 0 HD1 HIS A 111 4.143 15.920 7.594 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.228 17.410 7.557 1.00 0.00 H new ATOM 0 HE1 HIS A 111 3.228 15.593 9.943 1.00 0.00 H new ATOM 1716 N PHE A 112 1.551 19.923 6.824 1.00 0.00 N ATOM 1717 CA PHE A 112 1.909 21.188 7.454 1.00 0.00 C ATOM 1718 C PHE A 112 2.106 22.280 6.406 1.00 0.00 C ATOM 1719 O PHE A 112 3.064 23.052 6.471 1.00 0.00 O ATOM 1720 CB PHE A 112 3.183 21.026 8.284 1.00 0.00 C ATOM 1721 CG PHE A 112 2.953 20.364 9.613 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.166 20.972 10.578 1.00 0.00 C ATOM 1723 CD2 PHE A 112 3.524 19.134 9.896 1.00 0.00 C ATOM 1724 CE1 PHE A 112 1.954 20.365 11.801 1.00 0.00 C ATOM 1725 CE2 PHE A 112 3.314 18.522 11.118 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.527 19.138 12.071 1.00 0.00 C ATOM 0 H PHE A 112 0.894 19.356 7.360 1.00 0.00 H new ATOM 0 HA PHE A 112 1.091 21.483 8.111 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.905 20.440 7.716 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.627 22.008 8.448 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.713 21.931 10.372 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.140 18.648 9.154 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.340 20.850 12.546 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.765 17.563 11.327 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.360 18.661 13.025 1.00 0.00 H new ATOM 1736 N HIS A 113 1.194 22.338 5.441 1.00 0.00 N ATOM 1737 CA HIS A 113 1.267 23.335 4.379 1.00 0.00 C ATOM 1738 C HIS A 113 2.586 23.225 3.620 1.00 0.00 C ATOM 1739 O HIS A 113 3.289 24.218 3.434 1.00 0.00 O ATOM 1740 CB HIS A 113 1.114 24.742 4.960 1.00 0.00 C ATOM 1741 CG HIS A 113 -0.311 25.176 5.112 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -0.843 26.260 4.447 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -1.317 24.663 5.858 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -2.114 26.397 4.778 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -2.427 25.440 5.634 1.00 0.00 N ATOM 0 H HIS A 113 0.396 21.707 5.373 1.00 0.00 H new ATOM 0 HA HIS A 113 0.451 23.148 3.681 1.00 0.00 H new ATOM 0 HB2 HIS A 113 1.602 24.779 5.934 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.634 25.451 4.316 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -1.258 23.803 6.508 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -2.784 27.161 4.412 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -3.344 25.301 6.059 1.00 0.00 H new ATOM 1753 N GLN A 114 2.914 22.013 3.186 1.00 0.00 N ATOM 1754 CA GLN A 114 4.149 21.774 2.449 1.00 0.00 C ATOM 1755 C GLN A 114 4.038 20.518 1.592 1.00 0.00 C ATOM 1756 O GLN A 114 3.424 19.531 1.997 1.00 0.00 O ATOM 1757 CB GLN A 114 5.327 21.643 3.416 1.00 0.00 C ATOM 1758 CG GLN A 114 5.846 22.978 3.927 1.00 0.00 C ATOM 1759 CD GLN A 114 7.245 22.878 4.502 1.00 0.00 C ATOM 1760 OE1 GLN A 114 7.602 21.879 5.128 1.00 0.00 O ATOM 1761 NE2 GLN A 114 8.047 23.916 4.294 1.00 0.00 N ATOM 0 H GLN A 114 2.342 21.181 3.332 1.00 0.00 H new ATOM 0 HA GLN A 114 4.320 22.626 1.791 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.023 21.032 4.266 1.00 0.00 H new ATOM 0 HB3 GLN A 114 6.139 21.114 2.917 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.843 23.701 3.111 1.00 0.00 H new ATOM 0 HG3 GLN A 114 5.169 23.358 4.692 1.00 0.00 H new ATOM 0 HE21 GLN A 114 7.710 24.724 3.770 1.00 0.00 H new ATOM 0 HE22 GLN A 114 9.000 23.906 4.658 1.00 0.00 H new ATOM 1770 N SER A 115 4.635 20.562 0.405 1.00 0.00 N ATOM 1771 CA SER A 115 4.599 19.428 -0.511 1.00 0.00 C ATOM 1772 C SER A 115 5.479 18.291 -0.003 1.00 0.00 C ATOM 1773 O SER A 115 6.662 18.485 0.280 1.00 0.00 O ATOM 1774 CB SER A 115 5.056 19.859 -1.906 1.00 0.00 C ATOM 1775 OG SER A 115 6.413 20.265 -1.895 1.00 0.00 O ATOM 0 H SER A 115 5.149 21.371 0.055 1.00 0.00 H new ATOM 0 HA SER A 115 3.571 19.070 -0.568 1.00 0.00 H new ATOM 0 HB2 SER A 115 4.926 19.034 -2.606 1.00 0.00 H new ATOM 0 HB3 SER A 115 4.431 20.679 -2.260 1.00 0.00 H new ATOM 0 HG SER A 115 6.892 19.787 -1.186 1.00 0.00 H new ATOM 1781 N VAL A 116 4.894 17.103 0.109 1.00 0.00 N ATOM 1782 CA VAL A 116 5.625 15.933 0.582 1.00 0.00 C ATOM 1783 C VAL A 116 5.658 14.840 -0.480 1.00 0.00 C ATOM 1784 O VAL A 116 4.658 14.164 -0.721 1.00 0.00 O ATOM 1785 CB VAL A 116 5.000 15.363 1.870 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.727 14.099 2.302 1.00 0.00 C ATOM 1787 CG2 VAL A 116 5.020 16.406 2.977 1.00 0.00 C ATOM 0 H VAL A 116 3.916 16.925 -0.121 1.00 0.00 H new ATOM 0 HA VAL A 116 6.643 16.260 0.795 1.00 0.00 H new ATOM 0 HB VAL A 116 3.961 15.103 1.666 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.272 13.711 3.213 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.655 13.350 1.513 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.776 14.329 2.490 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.575 15.987 3.880 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.050 16.699 3.182 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.450 17.280 2.663 1.00 0.00 H new ATOM 1797 N GLN A 117 6.815 14.672 -1.112 1.00 0.00 N ATOM 1798 CA GLN A 117 6.978 13.660 -2.150 1.00 0.00 C ATOM 1799 C GLN A 117 8.156 12.743 -1.836 1.00 0.00 C ATOM 1800 O GLN A 117 9.313 13.133 -1.981 1.00 0.00 O ATOM 1801 CB GLN A 117 7.183 14.325 -3.512 1.00 0.00 C ATOM 1802 CG GLN A 117 7.261 13.337 -4.665 1.00 0.00 C ATOM 1803 CD GLN A 117 8.090 13.856 -5.823 1.00 0.00 C ATOM 1804 OE1 GLN A 117 9.321 13.817 -5.786 1.00 0.00 O ATOM 1805 NE2 GLN A 117 7.420 14.345 -6.859 1.00 0.00 N ATOM 0 H GLN A 117 7.653 15.223 -0.924 1.00 0.00 H new ATOM 0 HA GLN A 117 6.070 13.057 -2.181 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.364 15.020 -3.695 1.00 0.00 H new ATOM 0 HB3 GLN A 117 8.100 14.913 -3.486 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.689 12.400 -4.308 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.253 13.114 -5.016 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.400 14.358 -6.847 1.00 0.00 H new ATOM 0 HE22 GLN A 117 7.925 14.708 -7.667 1.00 0.00 H new ATOM 1814 N GLU A 118 7.851 11.523 -1.404 1.00 0.00 N ATOM 1815 CA GLU A 118 8.886 10.552 -1.068 1.00 0.00 C ATOM 1816 C GLU A 118 8.582 9.195 -1.696 1.00 0.00 C ATOM 1817 O GLU A 118 7.580 8.558 -1.369 1.00 0.00 O ATOM 1818 CB GLU A 118 9.008 10.408 0.450 1.00 0.00 C ATOM 1819 CG GLU A 118 9.657 11.605 1.125 1.00 0.00 C ATOM 1820 CD GLU A 118 11.128 11.741 0.781 1.00 0.00 C ATOM 1821 OE1 GLU A 118 11.869 10.749 0.938 1.00 0.00 O ATOM 1822 OE2 GLU A 118 11.536 12.842 0.354 1.00 0.00 O ATOM 0 H GLU A 118 6.897 11.184 -1.279 1.00 0.00 H new ATOM 0 HA GLU A 118 9.833 10.915 -1.468 1.00 0.00 H new ATOM 0 HB2 GLU A 118 8.015 10.257 0.873 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.590 9.514 0.676 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.133 12.513 0.828 1.00 0.00 H new ATOM 0 HG3 GLU A 118 9.547 11.512 2.205 1.00 0.00 H new ATOM 1829 N ILE A 119 9.454 8.759 -2.599 1.00 0.00 N ATOM 1830 CA ILE A 119 9.279 7.478 -3.272 1.00 0.00 C ATOM 1831 C ILE A 119 10.309 6.461 -2.793 1.00 0.00 C ATOM 1832 O ILE A 119 11.514 6.709 -2.843 1.00 0.00 O ATOM 1833 CB ILE A 119 9.394 7.626 -4.801 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.278 8.528 -5.333 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.343 6.260 -5.470 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.614 10.002 -5.276 1.00 0.00 C ATOM 0 H ILE A 119 10.288 9.274 -2.881 1.00 0.00 H new ATOM 0 HA ILE A 119 8.279 7.124 -3.023 1.00 0.00 H new ATOM 0 HB ILE A 119 10.353 8.089 -5.036 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.060 8.253 -6.365 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.370 8.348 -4.757 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.425 6.381 -6.550 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.169 5.647 -5.109 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.398 5.773 -5.230 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.778 10.581 -5.669 1.00 0.00 H new ATOM 0 HD12 ILE A 119 8.803 10.292 -4.243 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.503 10.196 -5.876 1.00 0.00 H new ATOM 1848 N PHE A 120 9.826 5.312 -2.329 1.00 0.00 N ATOM 1849 CA PHE A 120 10.704 4.255 -1.841 1.00 0.00 C ATOM 1850 C PHE A 120 10.216 2.886 -2.304 1.00 0.00 C ATOM 1851 O PHE A 120 9.077 2.738 -2.745 1.00 0.00 O ATOM 1852 CB PHE A 120 10.781 4.292 -0.314 1.00 0.00 C ATOM 1853 CG PHE A 120 9.437 4.362 0.353 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.778 5.573 0.487 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.833 3.217 0.845 1.00 0.00 C ATOM 1856 CE1 PHE A 120 7.541 5.640 1.100 1.00 0.00 C ATOM 1857 CE2 PHE A 120 7.596 3.277 1.460 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.949 4.491 1.586 1.00 0.00 C ATOM 0 H PHE A 120 8.832 5.090 -2.281 1.00 0.00 H new ATOM 0 HA PHE A 120 11.699 4.424 -2.252 1.00 0.00 H new ATOM 0 HB2 PHE A 120 11.306 3.403 0.037 1.00 0.00 H new ATOM 0 HB3 PHE A 120 11.374 5.154 -0.009 1.00 0.00 H new ATOM 0 HD1 PHE A 120 9.236 6.475 0.108 1.00 0.00 H new ATOM 0 HD2 PHE A 120 9.334 2.265 0.747 1.00 0.00 H new ATOM 0 HE1 PHE A 120 7.038 6.590 1.199 1.00 0.00 H new ATOM 0 HE2 PHE A 120 7.137 2.377 1.841 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.982 4.541 2.064 1.00 0.00 H new ATOM 1868 N GLU A 121 11.088 1.888 -2.201 1.00 0.00 N ATOM 1869 CA GLU A 121 10.747 0.530 -2.610 1.00 0.00 C ATOM 1870 C GLU A 121 10.871 -0.439 -1.438 1.00 0.00 C ATOM 1871 O GLU A 121 11.861 -0.422 -0.706 1.00 0.00 O ATOM 1872 CB GLU A 121 11.650 0.078 -3.759 1.00 0.00 C ATOM 1873 CG GLU A 121 11.283 0.691 -5.100 1.00 0.00 C ATOM 1874 CD GLU A 121 11.972 0.005 -6.263 1.00 0.00 C ATOM 1875 OE1 GLU A 121 13.215 0.095 -6.352 1.00 0.00 O ATOM 1876 OE2 GLU A 121 11.271 -0.621 -7.085 1.00 0.00 O ATOM 0 H GLU A 121 12.035 1.994 -1.838 1.00 0.00 H new ATOM 0 HA GLU A 121 9.711 0.530 -2.950 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.682 0.336 -3.522 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.603 -1.008 -3.841 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.203 0.635 -5.238 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.549 1.748 -5.097 1.00 0.00 H new ATOM 1883 N VAL A 122 9.860 -1.284 -1.267 1.00 0.00 N ATOM 1884 CA VAL A 122 9.855 -2.262 -0.185 1.00 0.00 C ATOM 1885 C VAL A 122 10.592 -3.533 -0.590 1.00 0.00 C ATOM 1886 O VAL A 122 10.064 -4.357 -1.337 1.00 0.00 O ATOM 1887 CB VAL A 122 8.419 -2.625 0.237 1.00 0.00 C ATOM 1888 CG1 VAL A 122 8.423 -3.355 1.571 1.00 0.00 C ATOM 1889 CG2 VAL A 122 7.552 -1.377 0.305 1.00 0.00 C ATOM 0 H VAL A 122 9.033 -1.311 -1.864 1.00 0.00 H new ATOM 0 HA VAL A 122 10.368 -1.802 0.660 1.00 0.00 H new ATOM 0 HB VAL A 122 7.996 -3.293 -0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.400 -3.603 1.853 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.008 -4.271 1.483 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.865 -2.715 2.335 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.541 -1.652 0.605 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.970 -0.683 1.034 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.523 -0.900 -0.675 1.00 0.00 H new ATOM 1899 N ASN A 123 11.814 -3.687 -0.092 1.00 0.00 N ATOM 1900 CA ASN A 123 12.624 -4.859 -0.403 1.00 0.00 C ATOM 1901 C ASN A 123 12.585 -5.867 0.742 1.00 0.00 C ATOM 1902 O ASN A 123 13.192 -6.934 0.665 1.00 0.00 O ATOM 1903 CB ASN A 123 14.070 -4.446 -0.683 1.00 0.00 C ATOM 1904 CG ASN A 123 14.558 -3.368 0.265 1.00 0.00 C ATOM 1905 OD1 ASN A 123 14.524 -2.180 -0.057 1.00 0.00 O ATOM 1906 ND2 ASN A 123 15.015 -3.779 1.443 1.00 0.00 N ATOM 0 H ASN A 123 12.265 -3.015 0.529 1.00 0.00 H new ATOM 0 HA ASN A 123 12.208 -5.330 -1.294 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.717 -5.319 -0.599 1.00 0.00 H new ATOM 0 HB3 ASN A 123 14.150 -4.087 -1.709 1.00 0.00 H new ATOM 0 HD21 ASN A 123 15.356 -3.100 2.123 1.00 0.00 H new ATOM 0 HD22 ASN A 123 15.025 -4.774 1.667 1.00 0.00 H new ATOM 1913 N ASN A 124 11.864 -5.519 1.804 1.00 0.00 N ATOM 1914 CA ASN A 124 11.745 -6.393 2.966 1.00 0.00 C ATOM 1915 C ASN A 124 10.367 -7.047 3.016 1.00 0.00 C ATOM 1916 O ASN A 124 9.760 -7.161 4.081 1.00 0.00 O ATOM 1917 CB ASN A 124 11.994 -5.603 4.252 1.00 0.00 C ATOM 1918 CG ASN A 124 10.818 -4.720 4.625 1.00 0.00 C ATOM 1919 OD1 ASN A 124 9.976 -4.402 3.785 1.00 0.00 O ATOM 1920 ND2 ASN A 124 10.757 -4.320 5.890 1.00 0.00 N ATOM 0 H ASN A 124 11.354 -4.639 1.884 1.00 0.00 H new ATOM 0 HA ASN A 124 12.497 -7.177 2.878 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.197 -6.297 5.068 1.00 0.00 H new ATOM 0 HB3 ASN A 124 12.884 -4.986 4.129 1.00 0.00 H new ATOM 0 HD21 ASN A 124 9.989 -3.724 6.200 1.00 0.00 H new ATOM 0 HD22 ASN A 124 11.478 -4.609 6.551 1.00 0.00 H new ATOM 1927 N LEU A 125 9.879 -7.474 1.856 1.00 0.00 N ATOM 1928 CA LEU A 125 8.573 -8.117 1.767 1.00 0.00 C ATOM 1929 C LEU A 125 8.619 -9.527 2.349 1.00 0.00 C ATOM 1930 O LEU A 125 9.660 -10.183 2.368 1.00 0.00 O ATOM 1931 CB LEU A 125 8.107 -8.169 0.311 1.00 0.00 C ATOM 1932 CG LEU A 125 7.801 -6.822 -0.344 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.743 -6.965 -1.857 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.494 -6.254 0.189 1.00 0.00 C ATOM 0 H LEU A 125 10.368 -7.386 0.965 1.00 0.00 H new ATOM 0 HA LEU A 125 7.864 -7.527 2.348 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.875 -8.671 -0.278 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.211 -8.788 0.259 1.00 0.00 H new ATOM 0 HG LEU A 125 8.604 -6.128 -0.095 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.524 -5.996 -2.306 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.703 -7.327 -2.225 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.960 -7.674 -2.126 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.292 -5.295 -0.288 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.681 -6.946 -0.029 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.571 -6.113 1.267 1.00 0.00 H new ATOM 1946 N PRO A 126 7.463 -10.005 2.833 1.00 0.00 N ATOM 1947 CA PRO A 126 7.345 -11.342 3.422 1.00 0.00 C ATOM 1948 C PRO A 126 7.479 -12.448 2.381 1.00 0.00 C ATOM 1949 O PRO A 126 6.874 -12.384 1.311 1.00 0.00 O ATOM 1950 CB PRO A 126 5.937 -11.342 4.023 1.00 0.00 C ATOM 1951 CG PRO A 126 5.184 -10.335 3.224 1.00 0.00 C ATOM 1952 CD PRO A 126 6.183 -9.278 2.843 1.00 0.00 C ATOM 0 HA PRO A 126 8.134 -11.538 4.148 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.477 -12.328 3.953 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.957 -11.074 5.079 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.742 -10.791 2.338 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.366 -9.908 3.805 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.959 -8.846 1.868 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.193 -8.457 3.560 1.00 0.00 H new ATOM 1960 N VAL A 127 8.277 -13.462 2.701 1.00 0.00 N ATOM 1961 CA VAL A 127 8.489 -14.583 1.793 1.00 0.00 C ATOM 1962 C VAL A 127 7.230 -15.433 1.664 1.00 0.00 C ATOM 1963 O VAL A 127 6.895 -15.901 0.577 1.00 0.00 O ATOM 1964 CB VAL A 127 9.651 -15.477 2.267 1.00 0.00 C ATOM 1965 CG1 VAL A 127 10.971 -14.726 2.181 1.00 0.00 C ATOM 1966 CG2 VAL A 127 9.400 -15.970 3.684 1.00 0.00 C ATOM 0 H VAL A 127 8.787 -13.530 3.582 1.00 0.00 H new ATOM 0 HA VAL A 127 8.739 -14.159 0.820 1.00 0.00 H new ATOM 0 HB VAL A 127 9.710 -16.345 1.610 1.00 0.00 H new ATOM 0 HG11 VAL A 127 11.780 -15.373 2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 127 11.153 -14.427 1.149 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.927 -13.839 2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.231 -16.600 4.003 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.313 -15.116 4.356 1.00 0.00 H new ATOM 0 HG23 VAL A 127 8.476 -16.548 3.710 1.00 0.00 H new ATOM 1976 N GLU A 128 6.536 -15.626 2.781 1.00 0.00 N ATOM 1977 CA GLU A 128 5.313 -16.419 2.793 1.00 0.00 C ATOM 1978 C GLU A 128 4.484 -16.159 1.538 1.00 0.00 C ATOM 1979 O GLU A 128 3.911 -17.081 0.957 1.00 0.00 O ATOM 1980 CB GLU A 128 4.484 -16.102 4.039 1.00 0.00 C ATOM 1981 CG GLU A 128 4.818 -16.982 5.232 1.00 0.00 C ATOM 1982 CD GLU A 128 4.081 -18.307 5.205 1.00 0.00 C ATOM 1983 OE1 GLU A 128 4.489 -19.196 4.428 1.00 0.00 O ATOM 1984 OE2 GLU A 128 3.098 -18.455 5.960 1.00 0.00 O ATOM 0 H GLU A 128 6.800 -15.244 3.689 1.00 0.00 H new ATOM 0 HA GLU A 128 5.594 -17.472 2.811 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.640 -15.059 4.313 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.427 -16.214 3.800 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.892 -17.168 5.252 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.570 -16.451 6.151 1.00 0.00 H new ATOM 1991 N SER A 129 4.424 -14.896 1.127 1.00 0.00 N ATOM 1992 CA SER A 129 3.662 -14.513 -0.056 1.00 0.00 C ATOM 1993 C SER A 129 3.922 -15.480 -1.207 1.00 0.00 C ATOM 1994 O SER A 129 2.993 -15.924 -1.881 1.00 0.00 O ATOM 1995 CB SER A 129 4.023 -13.088 -0.481 1.00 0.00 C ATOM 1996 OG SER A 129 5.397 -12.987 -0.811 1.00 0.00 O ATOM 0 H SER A 129 4.894 -14.121 1.595 1.00 0.00 H new ATOM 0 HA SER A 129 2.602 -14.553 0.196 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.417 -12.797 -1.339 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.788 -12.394 0.326 1.00 0.00 H new ATOM 0 HG SER A 129 5.921 -12.858 0.007 1.00 0.00 H new ATOM 2002 N TRP A 130 5.192 -15.802 -1.425 1.00 0.00 N ATOM 2003 CA TRP A 130 5.576 -16.717 -2.494 1.00 0.00 C ATOM 2004 C TRP A 130 5.782 -18.128 -1.956 1.00 0.00 C ATOM 2005 O TRP A 130 5.296 -19.100 -2.535 1.00 0.00 O ATOM 2006 CB TRP A 130 6.853 -16.227 -3.178 1.00 0.00 C ATOM 2007 CG TRP A 130 8.051 -16.239 -2.278 1.00 0.00 C ATOM 2008 CD1 TRP A 130 8.588 -15.172 -1.615 1.00 0.00 C ATOM 2009 CD2 TRP A 130 8.861 -17.371 -1.943 1.00 0.00 C ATOM 2010 NE1 TRP A 130 9.683 -15.573 -0.889 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.871 -16.918 -1.072 1.00 0.00 C ATOM 2012 CE3 TRP A 130 8.830 -18.723 -2.293 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.840 -17.770 -0.549 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 9.793 -19.568 -1.773 1.00 0.00 C ATOM 2015 CH2 TRP A 130 10.786 -19.089 -0.908 1.00 0.00 C ATOM 0 H TRP A 130 5.973 -15.443 -0.876 1.00 0.00 H new ATOM 0 HA TRP A 130 4.767 -16.742 -3.224 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.054 -16.853 -4.047 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.694 -15.213 -3.545 1.00 0.00 H new ATOM 0 HD1 TRP A 130 8.208 -14.162 -1.656 1.00 0.00 H new ATOM 0 HE1 TRP A 130 10.262 -14.967 -0.308 1.00 0.00 H new ATOM 0 HE3 TRP A 130 8.068 -19.101 -2.958 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 11.607 -17.403 0.117 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 9.780 -20.615 -2.038 1.00 0.00 H new ATOM 0 HH2 TRP A 130 11.523 -19.775 -0.517 1.00 0.00 H new ATOM 2026 N GLN A 131 6.504 -18.234 -0.845 1.00 0.00 N ATOM 2027 CA GLN A 131 6.774 -19.528 -0.229 1.00 0.00 C ATOM 2028 C GLN A 131 5.525 -20.078 0.450 1.00 0.00 C ATOM 2029 O GLN A 131 4.992 -19.471 1.380 1.00 0.00 O ATOM 2030 CB GLN A 131 7.910 -19.405 0.788 1.00 0.00 C ATOM 2031 CG GLN A 131 8.433 -20.745 1.279 1.00 0.00 C ATOM 2032 CD GLN A 131 9.166 -20.636 2.602 1.00 0.00 C ATOM 2033 OE1 GLN A 131 8.569 -20.318 3.631 1.00 0.00 O ATOM 2034 NE2 GLN A 131 10.467 -20.900 2.582 1.00 0.00 N ATOM 0 H GLN A 131 6.913 -17.439 -0.353 1.00 0.00 H new ATOM 0 HA GLN A 131 7.073 -20.221 -1.015 1.00 0.00 H new ATOM 0 HB2 GLN A 131 8.731 -18.847 0.338 1.00 0.00 H new ATOM 0 HB3 GLN A 131 7.561 -18.825 1.642 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.599 -21.439 1.386 1.00 0.00 H new ATOM 0 HG3 GLN A 131 9.104 -21.166 0.530 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.921 -21.160 1.706 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.012 -20.843 3.442 1.00 0.00 H new TER 2043 GLN A 131