USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 755 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 14 HIS : no HD1:sc= -6.43! C(o=-5.2!,f=-14!) USER MOD Set 1.2: A 16 SER OG : rot -166:sc= 1.23 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -1.66 K(o=-1.7,f=-3.7!) USER MOD Single : A 13 GLN : amide:sc= -0.0433 K(o=-0.043,f=-1.6!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 GLN : amide:sc= -0.0704 X(o=-0.07,f=-0.34) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.0903 X(o=-0.09,f=0) USER MOD Single : A 38 SER OG : rot 47:sc= 0.332 USER MOD Single : A 41 SER OG : rot 1:sc= 1.03 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -0.274 K(o=-0.27,f=0.94) USER MOD Single : A 46 TYR OH : rot 55:sc= 0.0689 USER MOD Single : A 47 LYS NZ :NH3+ -153:sc= -0.0305 (180deg=-1.09) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 138:sc= -0.604 (180deg=-3.06!) USER MOD Single : A 56 GLN : amide:sc= -2.76! K(o=-2.8!,f=-1.1) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= -0.0484 X(o=-0.048,f=-0.19) USER MOD Single : A 73 GLN : amide:sc= -0.183 K(o=-0.18,f=-1.2) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc=-0.00946 X(o=-0.0095,f=0) USER MOD Single : A 82 THR OG1 : rot 83:sc= -0.821 USER MOD Single : A 87 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0481) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 ASN : amide:sc= -3.01 K(o=-3,f=-2.1) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= -0.0203 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.657 -5.046 -15.587 1.00 0.00 N ATOM 2 CA GLY A 1 -10.838 -4.200 -15.622 1.00 0.00 C ATOM 3 C GLY A 1 -11.631 -4.312 -14.318 1.00 0.00 C ATOM 4 O GLY A 1 -11.779 -3.331 -13.591 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.136 -4.952 -16.482 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.045 -4.755 -14.798 1.00 0.00 H new ATOM 0 H3 GLY A 1 -9.944 -6.037 -15.455 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.543 -3.163 -15.784 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.470 -4.487 -16.462 1.00 0.00 H new ATOM 8 N SER A 2 -12.121 -5.517 -14.062 1.00 0.00 N ATOM 9 CA SER A 2 -12.895 -5.770 -12.859 1.00 0.00 C ATOM 10 C SER A 2 -12.827 -7.254 -12.495 1.00 0.00 C ATOM 11 O SER A 2 -13.543 -8.071 -13.071 1.00 0.00 O ATOM 12 CB SER A 2 -14.350 -5.334 -13.039 1.00 0.00 C ATOM 13 OG SER A 2 -14.931 -4.894 -11.814 1.00 0.00 O ATOM 0 H SER A 2 -11.997 -6.328 -14.668 1.00 0.00 H new ATOM 0 HA SER A 2 -12.466 -5.184 -12.047 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.399 -4.530 -13.773 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.931 -6.166 -13.438 1.00 0.00 H new ATOM 0 HG SER A 2 -15.859 -4.623 -11.971 1.00 0.00 H new ATOM 19 N SER A 3 -11.958 -7.557 -11.541 1.00 0.00 N ATOM 20 CA SER A 3 -11.787 -8.929 -11.094 1.00 0.00 C ATOM 21 C SER A 3 -12.815 -9.258 -10.009 1.00 0.00 C ATOM 22 O SER A 3 -12.622 -8.918 -8.843 1.00 0.00 O ATOM 23 CB SER A 3 -10.369 -9.165 -10.570 1.00 0.00 C ATOM 24 OG SER A 3 -9.381 -8.878 -11.557 1.00 0.00 O ATOM 0 H SER A 3 -11.365 -6.876 -11.066 1.00 0.00 H new ATOM 0 HA SER A 3 -11.945 -9.589 -11.947 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.198 -8.541 -9.693 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.269 -10.201 -10.248 1.00 0.00 H new ATOM 0 HG SER A 3 -8.489 -9.039 -11.184 1.00 0.00 H new ATOM 30 N GLY A 4 -13.885 -9.915 -10.431 1.00 0.00 N ATOM 31 CA GLY A 4 -14.943 -10.293 -9.510 1.00 0.00 C ATOM 32 C GLY A 4 -15.609 -11.600 -9.947 1.00 0.00 C ATOM 33 O GLY A 4 -16.741 -11.593 -10.429 1.00 0.00 O ATOM 0 H GLY A 4 -14.042 -10.195 -11.399 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.533 -10.407 -8.507 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.688 -9.499 -9.461 1.00 0.00 H new ATOM 37 N SER A 5 -14.878 -12.690 -9.764 1.00 0.00 N ATOM 38 CA SER A 5 -15.384 -14.001 -10.133 1.00 0.00 C ATOM 39 C SER A 5 -14.402 -15.085 -9.684 1.00 0.00 C ATOM 40 O SER A 5 -13.576 -15.544 -10.471 1.00 0.00 O ATOM 41 CB SER A 5 -15.625 -14.094 -11.641 1.00 0.00 C ATOM 42 OG SER A 5 -16.070 -15.390 -12.031 1.00 0.00 O ATOM 0 H SER A 5 -13.939 -12.692 -9.365 1.00 0.00 H new ATOM 0 HA SER A 5 -16.339 -14.154 -9.630 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.367 -13.352 -11.936 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.704 -13.852 -12.171 1.00 0.00 H new ATOM 0 HG SER A 5 -16.214 -15.408 -13.000 1.00 0.00 H new ATOM 48 N SER A 6 -14.526 -15.465 -8.421 1.00 0.00 N ATOM 49 CA SER A 6 -13.660 -16.487 -7.858 1.00 0.00 C ATOM 50 C SER A 6 -14.261 -17.024 -6.558 1.00 0.00 C ATOM 51 O SER A 6 -14.868 -16.275 -5.794 1.00 0.00 O ATOM 52 CB SER A 6 -12.254 -15.941 -7.607 1.00 0.00 C ATOM 53 OG SER A 6 -11.259 -16.956 -7.714 1.00 0.00 O ATOM 0 H SER A 6 -15.213 -15.083 -7.771 1.00 0.00 H new ATOM 0 HA SER A 6 -13.580 -17.302 -8.578 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.040 -15.147 -8.323 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.211 -15.494 -6.614 1.00 0.00 H new ATOM 0 HG SER A 6 -10.375 -16.566 -7.549 1.00 0.00 H new ATOM 59 N GLY A 7 -14.071 -18.318 -6.345 1.00 0.00 N ATOM 60 CA GLY A 7 -14.587 -18.964 -5.150 1.00 0.00 C ATOM 61 C GLY A 7 -13.524 -19.010 -4.050 1.00 0.00 C ATOM 62 O GLY A 7 -12.389 -18.585 -4.260 1.00 0.00 O ATOM 0 H GLY A 7 -13.567 -18.937 -6.980 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.464 -18.426 -4.791 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.911 -19.977 -5.390 1.00 0.00 H new ATOM 66 N MET A 8 -13.930 -19.529 -2.901 1.00 0.00 N ATOM 67 CA MET A 8 -13.028 -19.637 -1.767 1.00 0.00 C ATOM 68 C MET A 8 -13.617 -20.537 -0.680 1.00 0.00 C ATOM 69 O MET A 8 -14.528 -20.131 0.041 1.00 0.00 O ATOM 70 CB MET A 8 -12.764 -18.244 -1.191 1.00 0.00 C ATOM 71 CG MET A 8 -11.265 -17.945 -1.144 1.00 0.00 C ATOM 72 SD MET A 8 -10.924 -16.733 0.122 1.00 0.00 S ATOM 73 CE MET A 8 -9.141 -16.688 0.036 1.00 0.00 C ATOM 0 H MET A 8 -14.873 -19.880 -2.731 1.00 0.00 H new ATOM 0 HA MET A 8 -12.094 -20.081 -2.111 1.00 0.00 H new ATOM 0 HB2 MET A 8 -13.269 -17.494 -1.799 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.184 -18.176 -0.187 1.00 0.00 H new ATOM 0 HG2 MET A 8 -10.709 -18.861 -0.942 1.00 0.00 H new ATOM 0 HG3 MET A 8 -10.929 -17.576 -2.113 1.00 0.00 H new ATOM 0 HE1 MET A 8 -8.759 -15.975 0.767 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.741 -17.679 0.252 1.00 0.00 H new ATOM 0 HE3 MET A 8 -8.833 -16.383 -0.964 1.00 0.00 H new ATOM 83 N ASP A 9 -13.074 -21.742 -0.595 1.00 0.00 N ATOM 84 CA ASP A 9 -13.535 -22.703 0.393 1.00 0.00 C ATOM 85 C ASP A 9 -12.358 -23.572 0.840 1.00 0.00 C ATOM 86 O ASP A 9 -11.865 -24.398 0.074 1.00 0.00 O ATOM 87 CB ASP A 9 -14.607 -23.624 -0.193 1.00 0.00 C ATOM 88 CG ASP A 9 -15.859 -23.789 0.670 1.00 0.00 C ATOM 89 OD1 ASP A 9 -16.547 -22.766 0.874 1.00 0.00 O ATOM 90 OD2 ASP A 9 -16.101 -24.936 1.106 1.00 0.00 O ATOM 0 H ASP A 9 -12.319 -22.075 -1.194 1.00 0.00 H new ATOM 0 HA ASP A 9 -13.955 -22.149 1.232 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.904 -23.237 -1.168 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -14.168 -24.607 -0.361 1.00 0.00 H new ATOM 95 N MET A 10 -11.942 -23.357 2.080 1.00 0.00 N ATOM 96 CA MET A 10 -10.833 -24.110 2.638 1.00 0.00 C ATOM 97 C MET A 10 -10.521 -23.652 4.064 1.00 0.00 C ATOM 98 O MET A 10 -10.610 -22.464 4.372 1.00 0.00 O ATOM 99 CB MET A 10 -9.594 -23.923 1.760 1.00 0.00 C ATOM 100 CG MET A 10 -9.087 -25.267 1.233 1.00 0.00 C ATOM 101 SD MET A 10 -7.556 -25.701 2.041 1.00 0.00 S ATOM 102 CE MET A 10 -7.434 -27.419 1.573 1.00 0.00 C ATOM 0 H MET A 10 -12.354 -22.672 2.713 1.00 0.00 H new ATOM 0 HA MET A 10 -11.113 -25.163 2.667 1.00 0.00 H new ATOM 0 HB2 MET A 10 -9.833 -23.267 0.923 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.807 -23.434 2.334 1.00 0.00 H new ATOM 0 HG2 MET A 10 -9.833 -26.041 1.410 1.00 0.00 H new ATOM 0 HG3 MET A 10 -8.936 -25.211 0.155 1.00 0.00 H new ATOM 0 HE1 MET A 10 -6.526 -27.848 1.998 1.00 0.00 H new ATOM 0 HE2 MET A 10 -8.302 -27.961 1.949 1.00 0.00 H new ATOM 0 HE3 MET A 10 -7.399 -27.499 0.486 1.00 0.00 H new ATOM 112 N GLY A 11 -10.163 -24.618 4.897 1.00 0.00 N ATOM 113 CA GLY A 11 -9.838 -24.328 6.284 1.00 0.00 C ATOM 114 C GLY A 11 -8.347 -24.021 6.445 1.00 0.00 C ATOM 115 O GLY A 11 -7.571 -24.887 6.845 1.00 0.00 O ATOM 0 H GLY A 11 -10.091 -25.602 4.639 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.427 -23.479 6.629 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -10.108 -25.179 6.910 1.00 0.00 H new ATOM 119 N ASN A 12 -7.993 -22.785 6.125 1.00 0.00 N ATOM 120 CA ASN A 12 -6.610 -22.352 6.229 1.00 0.00 C ATOM 121 C ASN A 12 -6.463 -20.970 5.590 1.00 0.00 C ATOM 122 O ASN A 12 -6.736 -20.798 4.404 1.00 0.00 O ATOM 123 CB ASN A 12 -5.675 -23.315 5.494 1.00 0.00 C ATOM 124 CG ASN A 12 -4.955 -24.239 6.478 1.00 0.00 C ATOM 125 OD1 ASN A 12 -4.837 -23.959 7.660 1.00 0.00 O ATOM 126 ND2 ASN A 12 -4.482 -25.353 5.926 1.00 0.00 N ATOM 0 H ASN A 12 -8.640 -22.070 5.794 1.00 0.00 H new ATOM 0 HA ASN A 12 -6.343 -22.326 7.286 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -6.247 -23.911 4.782 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -4.942 -22.748 4.919 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -3.985 -26.035 6.499 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -4.616 -25.525 4.930 1.00 0.00 H new ATOM 133 N GLN A 13 -6.031 -20.019 6.406 1.00 0.00 N ATOM 134 CA GLN A 13 -5.844 -18.657 5.936 1.00 0.00 C ATOM 135 C GLN A 13 -4.391 -18.437 5.510 1.00 0.00 C ATOM 136 O GLN A 13 -3.509 -18.290 6.354 1.00 0.00 O ATOM 137 CB GLN A 13 -6.261 -17.646 7.005 1.00 0.00 C ATOM 138 CG GLN A 13 -6.378 -16.239 6.414 1.00 0.00 C ATOM 139 CD GLN A 13 -7.301 -15.363 7.263 1.00 0.00 C ATOM 140 OE1 GLN A 13 -7.848 -15.784 8.268 1.00 0.00 O ATOM 141 NE2 GLN A 13 -7.442 -14.123 6.804 1.00 0.00 N ATOM 0 H GLN A 13 -5.805 -20.165 7.390 1.00 0.00 H new ATOM 0 HA GLN A 13 -6.484 -18.502 5.067 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -7.216 -17.943 7.438 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -5.531 -17.645 7.814 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -5.390 -15.782 6.355 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -6.763 -16.299 5.396 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -6.955 -13.835 5.955 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -8.037 -13.460 7.301 1.00 0.00 H new ATOM 150 N HIS A 14 -4.188 -18.423 4.200 1.00 0.00 N ATOM 151 CA HIS A 14 -2.857 -18.224 3.652 1.00 0.00 C ATOM 152 C HIS A 14 -2.151 -17.101 4.415 1.00 0.00 C ATOM 153 O HIS A 14 -2.773 -16.103 4.776 1.00 0.00 O ATOM 154 CB HIS A 14 -2.923 -17.966 2.145 1.00 0.00 C ATOM 155 CG HIS A 14 -1.674 -18.368 1.398 1.00 0.00 C ATOM 156 ND1 HIS A 14 -0.611 -17.505 1.197 1.00 0.00 N ATOM 157 CD2 HIS A 14 -1.329 -19.548 0.808 1.00 0.00 C ATOM 158 CE1 HIS A 14 0.326 -18.147 0.514 1.00 0.00 C ATOM 159 NE2 HIS A 14 -0.121 -19.413 0.274 1.00 0.00 N ATOM 0 H HIS A 14 -4.923 -18.546 3.503 1.00 0.00 H new ATOM 0 HA HIS A 14 -2.267 -19.131 3.781 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -3.772 -18.509 1.731 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -3.110 -16.905 1.976 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -1.936 -20.441 0.780 1.00 0.00 H new ATOM 0 HE1 HIS A 14 1.276 -17.739 0.202 1.00 0.00 H new ATOM 0 HE2 HIS A 14 0.389 -20.137 -0.232 1.00 0.00 H new ATOM 167 N PRO A 15 -0.826 -17.307 4.643 1.00 0.00 N ATOM 168 CA PRO A 15 -0.028 -16.324 5.356 1.00 0.00 C ATOM 169 C PRO A 15 0.278 -15.116 4.467 1.00 0.00 C ATOM 170 O PRO A 15 0.855 -14.132 4.928 1.00 0.00 O ATOM 171 CB PRO A 15 1.222 -17.072 5.791 1.00 0.00 C ATOM 172 CG PRO A 15 1.293 -18.311 4.913 1.00 0.00 C ATOM 173 CD PRO A 15 -0.055 -18.476 4.230 1.00 0.00 C ATOM 0 HA PRO A 15 -0.548 -15.907 6.219 1.00 0.00 H new ATOM 0 HB2 PRO A 15 2.111 -16.453 5.666 1.00 0.00 H new ATOM 0 HB3 PRO A 15 1.168 -17.343 6.845 1.00 0.00 H new ATOM 0 HG2 PRO A 15 2.086 -18.209 4.172 1.00 0.00 H new ATOM 0 HG3 PRO A 15 1.528 -19.191 5.512 1.00 0.00 H new ATOM 0 HD2 PRO A 15 0.053 -18.516 3.146 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -0.544 -19.401 4.536 1.00 0.00 H new ATOM 181 N SER A 16 -0.123 -15.231 3.210 1.00 0.00 N ATOM 182 CA SER A 16 0.100 -14.161 2.252 1.00 0.00 C ATOM 183 C SER A 16 -1.172 -13.327 2.093 1.00 0.00 C ATOM 184 O SER A 16 -1.103 -12.116 1.888 1.00 0.00 O ATOM 185 CB SER A 16 0.543 -14.718 0.898 1.00 0.00 C ATOM 186 OG SER A 16 1.743 -15.480 1.000 1.00 0.00 O ATOM 0 H SER A 16 -0.601 -16.049 2.832 1.00 0.00 H new ATOM 0 HA SER A 16 0.899 -13.524 2.631 1.00 0.00 H new ATOM 0 HB2 SER A 16 -0.249 -15.343 0.487 1.00 0.00 H new ATOM 0 HB3 SER A 16 0.695 -13.895 0.200 1.00 0.00 H new ATOM 0 HG SER A 16 2.113 -15.629 0.105 1.00 0.00 H new ATOM 192 N ILE A 17 -2.304 -14.008 2.194 1.00 0.00 N ATOM 193 CA ILE A 17 -3.591 -13.345 2.064 1.00 0.00 C ATOM 194 C ILE A 17 -3.811 -12.428 3.268 1.00 0.00 C ATOM 195 O ILE A 17 -4.060 -11.234 3.107 1.00 0.00 O ATOM 196 CB ILE A 17 -4.706 -14.373 1.861 1.00 0.00 C ATOM 197 CG1 ILE A 17 -4.617 -15.012 0.474 1.00 0.00 C ATOM 198 CG2 ILE A 17 -6.079 -13.750 2.119 1.00 0.00 C ATOM 199 CD1 ILE A 17 -5.029 -14.019 -0.614 1.00 0.00 C ATOM 0 H ILE A 17 -2.357 -15.012 2.364 1.00 0.00 H new ATOM 0 HA ILE A 17 -3.606 -12.714 1.175 1.00 0.00 H new ATOM 0 HB ILE A 17 -4.572 -15.171 2.591 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -3.598 -15.354 0.292 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.261 -15.891 0.432 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.854 -14.502 1.968 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -6.125 -13.382 3.144 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -6.238 -12.921 1.429 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -4.957 -14.498 -1.590 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.056 -13.697 -0.443 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.368 -13.153 -0.585 1.00 0.00 H new ATOM 211 N SER A 18 -3.711 -13.021 4.449 1.00 0.00 N ATOM 212 CA SER A 18 -3.897 -12.272 5.681 1.00 0.00 C ATOM 213 C SER A 18 -2.982 -11.045 5.690 1.00 0.00 C ATOM 214 O SER A 18 -3.405 -9.955 6.070 1.00 0.00 O ATOM 215 CB SER A 18 -3.622 -13.148 6.904 1.00 0.00 C ATOM 216 OG SER A 18 -3.884 -12.459 8.124 1.00 0.00 O ATOM 0 H SER A 18 -3.504 -14.011 4.579 1.00 0.00 H new ATOM 0 HA SER A 18 -4.935 -11.944 5.729 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.240 -14.045 6.854 1.00 0.00 H new ATOM 0 HB3 SER A 18 -2.583 -13.476 6.889 1.00 0.00 H new ATOM 0 HG SER A 18 -3.698 -13.052 8.881 1.00 0.00 H new ATOM 222 N ARG A 19 -1.746 -11.265 5.266 1.00 0.00 N ATOM 223 CA ARG A 19 -0.769 -10.191 5.221 1.00 0.00 C ATOM 224 C ARG A 19 -1.293 -9.032 4.370 1.00 0.00 C ATOM 225 O ARG A 19 -1.480 -7.924 4.872 1.00 0.00 O ATOM 226 CB ARG A 19 0.560 -10.679 4.641 1.00 0.00 C ATOM 227 CG ARG A 19 1.679 -10.585 5.681 1.00 0.00 C ATOM 228 CD ARG A 19 1.338 -11.401 6.929 1.00 0.00 C ATOM 229 NE ARG A 19 2.580 -11.809 7.622 1.00 0.00 N ATOM 230 CZ ARG A 19 3.340 -12.849 7.253 1.00 0.00 C ATOM 231 NH1 ARG A 19 2.988 -13.594 6.196 1.00 0.00 N ATOM 232 NH2 ARG A 19 4.451 -13.145 7.942 1.00 0.00 N ATOM 0 H ARG A 19 -1.399 -12.171 4.951 1.00 0.00 H new ATOM 0 HA ARG A 19 -0.604 -9.851 6.243 1.00 0.00 H new ATOM 0 HB2 ARG A 19 0.457 -11.711 4.304 1.00 0.00 H new ATOM 0 HB3 ARG A 19 0.820 -10.083 3.766 1.00 0.00 H new ATOM 0 HG2 ARG A 19 2.612 -10.947 5.250 1.00 0.00 H new ATOM 0 HG3 ARG A 19 1.838 -9.542 5.956 1.00 0.00 H new ATOM 0 HD2 ARG A 19 0.714 -10.811 7.600 1.00 0.00 H new ATOM 0 HD3 ARG A 19 0.761 -12.283 6.651 1.00 0.00 H new ATOM 0 HE ARG A 19 2.876 -11.264 8.432 1.00 0.00 H new ATOM 0 HH11 ARG A 19 2.142 -13.369 5.673 1.00 0.00 H new ATOM 0 HH12 ARG A 19 3.566 -14.386 5.915 1.00 0.00 H new ATOM 0 HH21 ARG A 19 4.718 -12.579 8.747 1.00 0.00 H new ATOM 0 HH22 ARG A 19 5.030 -13.937 7.661 1.00 0.00 H new ATOM 246 N LEU A 20 -1.514 -9.327 3.098 1.00 0.00 N ATOM 247 CA LEU A 20 -2.013 -8.323 2.173 1.00 0.00 C ATOM 248 C LEU A 20 -3.244 -7.645 2.778 1.00 0.00 C ATOM 249 O LEU A 20 -3.444 -6.444 2.602 1.00 0.00 O ATOM 250 CB LEU A 20 -2.266 -8.941 0.796 1.00 0.00 C ATOM 251 CG LEU A 20 -1.022 -9.250 -0.039 1.00 0.00 C ATOM 252 CD1 LEU A 20 -1.336 -10.271 -1.134 1.00 0.00 C ATOM 253 CD2 LEU A 20 -0.412 -7.967 -0.609 1.00 0.00 C ATOM 0 H LEU A 20 -1.357 -10.247 2.686 1.00 0.00 H new ATOM 0 HA LEU A 20 -1.265 -7.546 2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -2.827 -9.866 0.932 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -2.902 -8.263 0.227 1.00 0.00 H new ATOM 0 HG LEU A 20 -0.275 -9.699 0.615 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.435 -10.473 -1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -1.689 -11.196 -0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -2.108 -9.873 -1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.471 -8.215 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.144 -7.467 -1.244 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -0.128 -7.305 0.209 1.00 0.00 H new ATOM 265 N GLN A 21 -4.036 -8.444 3.477 1.00 0.00 N ATOM 266 CA GLN A 21 -5.242 -7.936 4.109 1.00 0.00 C ATOM 267 C GLN A 21 -4.882 -7.050 5.304 1.00 0.00 C ATOM 268 O GLN A 21 -5.663 -6.184 5.696 1.00 0.00 O ATOM 269 CB GLN A 21 -6.163 -9.081 4.534 1.00 0.00 C ATOM 270 CG GLN A 21 -7.218 -9.362 3.462 1.00 0.00 C ATOM 271 CD GLN A 21 -8.553 -9.759 4.097 1.00 0.00 C ATOM 272 OE1 GLN A 21 -9.310 -8.933 4.578 1.00 0.00 O ATOM 273 NE2 GLN A 21 -8.797 -11.066 4.071 1.00 0.00 N ATOM 0 H GLN A 21 -3.866 -9.440 3.620 1.00 0.00 H new ATOM 0 HA GLN A 21 -5.782 -7.330 3.381 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -5.573 -9.980 4.713 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -6.653 -8.829 5.474 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -7.356 -8.477 2.841 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -6.871 -10.161 2.806 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -8.119 -11.703 3.652 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -9.662 -11.431 4.470 1.00 0.00 H new ATOM 282 N GLU A 22 -3.700 -7.297 5.849 1.00 0.00 N ATOM 283 CA GLU A 22 -3.228 -6.533 6.990 1.00 0.00 C ATOM 284 C GLU A 22 -2.392 -5.340 6.522 1.00 0.00 C ATOM 285 O GLU A 22 -2.140 -4.414 7.291 1.00 0.00 O ATOM 286 CB GLU A 22 -2.430 -7.418 7.950 1.00 0.00 C ATOM 287 CG GLU A 22 -3.353 -8.108 8.956 1.00 0.00 C ATOM 288 CD GLU A 22 -2.655 -8.293 10.305 1.00 0.00 C ATOM 289 OE1 GLU A 22 -1.688 -9.085 10.339 1.00 0.00 O ATOM 290 OE2 GLU A 22 -3.103 -7.638 11.270 1.00 0.00 O ATOM 0 H GLU A 22 -3.055 -8.016 5.521 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.095 -6.154 7.532 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -1.877 -8.168 7.384 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.695 -6.814 8.481 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.258 -7.516 9.089 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.661 -9.078 8.566 1.00 0.00 H new ATOM 297 N ILE A 23 -1.987 -5.401 5.262 1.00 0.00 N ATOM 298 CA ILE A 23 -1.186 -4.337 4.681 1.00 0.00 C ATOM 299 C ILE A 23 -2.080 -3.442 3.820 1.00 0.00 C ATOM 300 O ILE A 23 -1.823 -2.247 3.686 1.00 0.00 O ATOM 301 CB ILE A 23 0.011 -4.919 3.927 1.00 0.00 C ATOM 302 CG1 ILE A 23 1.103 -5.373 4.897 1.00 0.00 C ATOM 303 CG2 ILE A 23 0.542 -3.925 2.891 1.00 0.00 C ATOM 304 CD1 ILE A 23 1.505 -6.825 4.629 1.00 0.00 C ATOM 0 H ILE A 23 -2.199 -6.171 4.627 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.764 -3.707 5.464 1.00 0.00 H new ATOM 0 HB ILE A 23 -0.325 -5.803 3.384 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.975 -4.726 4.797 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.748 -5.274 5.923 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.393 -4.363 2.369 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.244 -3.693 2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.856 -3.010 3.393 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.283 -7.123 5.332 1.00 0.00 H new ATOM 0 HD12 ILE A 23 0.636 -7.472 4.753 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.883 -6.916 3.611 1.00 0.00 H new ATOM 316 N GLN A 24 -3.111 -4.056 3.259 1.00 0.00 N ATOM 317 CA GLN A 24 -4.045 -3.330 2.415 1.00 0.00 C ATOM 318 C GLN A 24 -4.865 -2.347 3.253 1.00 0.00 C ATOM 319 O GLN A 24 -4.929 -1.160 2.938 1.00 0.00 O ATOM 320 CB GLN A 24 -4.957 -4.293 1.652 1.00 0.00 C ATOM 321 CG GLN A 24 -4.263 -4.826 0.396 1.00 0.00 C ATOM 322 CD GLN A 24 -5.125 -4.594 -0.847 1.00 0.00 C ATOM 323 OE1 GLN A 24 -5.719 -3.546 -1.035 1.00 0.00 O ATOM 324 NE2 GLN A 24 -5.159 -5.629 -1.681 1.00 0.00 N ATOM 0 H GLN A 24 -3.320 -5.048 3.372 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.474 -2.762 1.680 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.236 -5.125 2.299 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.879 -3.783 1.374 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -3.299 -4.333 0.272 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -4.063 -5.891 0.511 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -4.637 -6.478 -1.462 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -5.707 -5.574 -2.540 1.00 0.00 H new ATOM 333 N ARG A 25 -5.471 -2.878 4.305 1.00 0.00 N ATOM 334 CA ARG A 25 -6.284 -2.062 5.191 1.00 0.00 C ATOM 335 C ARG A 25 -5.474 -0.874 5.711 1.00 0.00 C ATOM 336 O ARG A 25 -6.042 0.131 6.137 1.00 0.00 O ATOM 337 CB ARG A 25 -6.796 -2.881 6.378 1.00 0.00 C ATOM 338 CG ARG A 25 -5.639 -3.544 7.126 1.00 0.00 C ATOM 339 CD ARG A 25 -6.152 -4.379 8.301 1.00 0.00 C ATOM 340 NE ARG A 25 -5.577 -3.876 9.569 1.00 0.00 N ATOM 341 CZ ARG A 25 -6.088 -4.136 10.780 1.00 0.00 C ATOM 342 NH1 ARG A 25 -7.186 -4.894 10.896 1.00 0.00 N ATOM 343 NH2 ARG A 25 -5.499 -3.636 11.876 1.00 0.00 N ATOM 0 H ARG A 25 -5.415 -3.863 4.564 1.00 0.00 H new ATOM 0 HA ARG A 25 -7.138 -1.700 4.618 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -7.351 -2.235 7.058 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -7.491 -3.644 6.026 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.076 -4.179 6.442 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.952 -2.780 7.491 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -7.240 -4.334 8.342 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.882 -5.425 8.159 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.740 -3.295 9.518 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.634 -5.274 10.062 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -7.574 -5.091 11.818 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.663 -3.058 11.787 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.887 -3.833 12.798 1.00 0.00 H new ATOM 357 N GLU A 26 -4.159 -1.027 5.660 1.00 0.00 N ATOM 358 CA GLU A 26 -3.264 0.021 6.121 1.00 0.00 C ATOM 359 C GLU A 26 -3.187 1.145 5.087 1.00 0.00 C ATOM 360 O GLU A 26 -3.482 2.299 5.395 1.00 0.00 O ATOM 361 CB GLU A 26 -1.874 -0.540 6.426 1.00 0.00 C ATOM 362 CG GLU A 26 -1.861 -1.272 7.770 1.00 0.00 C ATOM 363 CD GLU A 26 -1.083 -0.477 8.820 1.00 0.00 C ATOM 364 OE1 GLU A 26 -1.696 0.444 9.403 1.00 0.00 O ATOM 365 OE2 GLU A 26 0.106 -0.807 9.017 1.00 0.00 O ATOM 0 H GLU A 26 -3.691 -1.862 5.306 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.664 0.433 7.047 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.572 -1.224 5.633 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -1.146 0.271 6.443 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -2.884 -1.429 8.112 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.411 -2.257 7.647 1.00 0.00 H new ATOM 372 N VAL A 27 -2.788 0.770 3.880 1.00 0.00 N ATOM 373 CA VAL A 27 -2.668 1.733 2.799 1.00 0.00 C ATOM 374 C VAL A 27 -4.034 2.371 2.535 1.00 0.00 C ATOM 375 O VAL A 27 -4.114 3.530 2.132 1.00 0.00 O ATOM 376 CB VAL A 27 -2.075 1.058 1.560 1.00 0.00 C ATOM 377 CG1 VAL A 27 -0.739 0.387 1.889 1.00 0.00 C ATOM 378 CG2 VAL A 27 -3.060 0.053 0.959 1.00 0.00 C ATOM 0 H VAL A 27 -2.544 -0.188 3.627 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.983 2.534 3.076 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.888 1.830 0.814 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.338 -0.085 0.992 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.035 1.136 2.250 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.891 -0.369 2.660 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.614 -0.412 0.080 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -3.293 -0.714 1.697 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.976 0.569 0.671 1.00 0.00 H new ATOM 388 N LYS A 28 -5.074 1.585 2.774 1.00 0.00 N ATOM 389 CA LYS A 28 -6.432 2.059 2.568 1.00 0.00 C ATOM 390 C LYS A 28 -6.843 2.946 3.745 1.00 0.00 C ATOM 391 O LYS A 28 -7.474 3.984 3.554 1.00 0.00 O ATOM 392 CB LYS A 28 -7.379 0.882 2.326 1.00 0.00 C ATOM 393 CG LYS A 28 -8.674 1.348 1.659 1.00 0.00 C ATOM 394 CD LYS A 28 -9.041 0.445 0.480 1.00 0.00 C ATOM 395 CE LYS A 28 -9.102 1.243 -0.824 1.00 0.00 C ATOM 396 NZ LYS A 28 -9.910 0.524 -1.834 1.00 0.00 N ATOM 0 H LYS A 28 -5.003 0.624 3.108 1.00 0.00 H new ATOM 0 HA LYS A 28 -6.488 2.674 1.670 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.888 0.140 1.697 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.609 0.395 3.274 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.484 1.346 2.389 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.559 2.375 1.313 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.306 -0.354 0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -10.005 -0.028 0.666 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.535 2.226 -0.636 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.094 1.406 -1.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -9.941 1.079 -2.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -9.481 -0.404 -2.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.877 0.391 -1.474 1.00 0.00 H new ATOM 410 N ALA A 29 -6.467 2.504 4.937 1.00 0.00 N ATOM 411 CA ALA A 29 -6.789 3.245 6.145 1.00 0.00 C ATOM 412 C ALA A 29 -5.961 4.531 6.184 1.00 0.00 C ATOM 413 O ALA A 29 -6.236 5.426 6.983 1.00 0.00 O ATOM 414 CB ALA A 29 -6.546 2.358 7.368 1.00 0.00 C ATOM 0 H ALA A 29 -5.943 1.643 5.092 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.841 3.529 6.152 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -6.787 2.914 8.274 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.178 1.472 7.306 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -5.499 2.056 7.396 1.00 0.00 H new ATOM 420 N ILE A 30 -4.965 4.583 5.312 1.00 0.00 N ATOM 421 CA ILE A 30 -4.096 5.745 5.238 1.00 0.00 C ATOM 422 C ILE A 30 -4.275 6.424 3.878 1.00 0.00 C ATOM 423 O ILE A 30 -3.715 7.491 3.635 1.00 0.00 O ATOM 424 CB ILE A 30 -2.649 5.353 5.544 1.00 0.00 C ATOM 425 CG1 ILE A 30 -2.077 4.463 4.438 1.00 0.00 C ATOM 426 CG2 ILE A 30 -2.538 4.697 6.922 1.00 0.00 C ATOM 427 CD1 ILE A 30 -1.078 5.236 3.574 1.00 0.00 C ATOM 0 H ILE A 30 -4.740 3.839 4.651 1.00 0.00 H new ATOM 0 HA ILE A 30 -4.371 6.476 5.999 1.00 0.00 H new ATOM 0 HB ILE A 30 -2.047 6.261 5.571 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.586 3.597 4.881 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.887 4.086 3.814 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -1.499 4.428 7.114 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.880 5.395 7.686 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.156 3.799 6.949 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -0.687 4.581 2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.578 6.088 3.113 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -0.257 5.591 4.197 1.00 0.00 H new ATOM 439 N GLU A 31 -5.057 5.776 3.028 1.00 0.00 N ATOM 440 CA GLU A 31 -5.317 6.304 1.699 1.00 0.00 C ATOM 441 C GLU A 31 -5.804 7.751 1.788 1.00 0.00 C ATOM 442 O GLU A 31 -5.341 8.613 1.042 1.00 0.00 O ATOM 443 CB GLU A 31 -6.326 5.431 0.950 1.00 0.00 C ATOM 444 CG GLU A 31 -7.028 6.227 -0.152 1.00 0.00 C ATOM 445 CD GLU A 31 -8.109 5.385 -0.833 1.00 0.00 C ATOM 446 OE1 GLU A 31 -9.229 5.343 -0.279 1.00 0.00 O ATOM 447 OE2 GLU A 31 -7.792 4.803 -1.892 1.00 0.00 O ATOM 0 H GLU A 31 -5.519 4.890 3.233 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.384 6.290 1.135 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.816 4.572 0.514 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.066 5.042 1.650 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -7.476 7.126 0.272 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.297 6.554 -0.891 1.00 0.00 H new ATOM 454 N PRO A 32 -6.755 7.980 2.732 1.00 0.00 N ATOM 455 CA PRO A 32 -7.310 9.309 2.929 1.00 0.00 C ATOM 456 C PRO A 32 -6.317 10.215 3.660 1.00 0.00 C ATOM 457 O PRO A 32 -6.290 11.423 3.433 1.00 0.00 O ATOM 458 CB PRO A 32 -8.596 9.087 3.708 1.00 0.00 C ATOM 459 CG PRO A 32 -8.480 7.700 4.319 1.00 0.00 C ATOM 460 CD PRO A 32 -7.327 6.985 3.634 1.00 0.00 C ATOM 0 HA PRO A 32 -7.513 9.823 1.990 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -8.720 9.845 4.481 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -9.465 9.154 3.054 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -8.303 7.769 5.392 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -9.408 7.144 4.184 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -6.590 6.638 4.358 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -7.674 6.108 3.087 1.00 0.00 H new ATOM 468 N GLN A 33 -5.526 9.596 4.524 1.00 0.00 N ATOM 469 CA GLN A 33 -4.534 10.331 5.290 1.00 0.00 C ATOM 470 C GLN A 33 -3.579 11.071 4.351 1.00 0.00 C ATOM 471 O GLN A 33 -2.972 12.068 4.737 1.00 0.00 O ATOM 472 CB GLN A 33 -3.766 9.399 6.229 1.00 0.00 C ATOM 473 CG GLN A 33 -4.605 9.046 7.459 1.00 0.00 C ATOM 474 CD GLN A 33 -3.715 8.791 8.677 1.00 0.00 C ATOM 475 OE1 GLN A 33 -3.914 9.337 9.749 1.00 0.00 O ATOM 476 NE2 GLN A 33 -2.723 7.934 8.452 1.00 0.00 N ATOM 0 H GLN A 33 -5.552 8.594 4.711 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.051 11.068 5.905 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.492 8.488 5.698 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -2.838 9.877 6.543 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.299 9.858 7.675 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -5.206 8.160 7.252 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -2.613 7.512 7.530 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -2.072 7.699 9.202 1.00 0.00 H new ATOM 485 N VAL A 34 -3.477 10.554 3.135 1.00 0.00 N ATOM 486 CA VAL A 34 -2.607 11.153 2.138 1.00 0.00 C ATOM 487 C VAL A 34 -3.419 12.121 1.274 1.00 0.00 C ATOM 488 O VAL A 34 -3.016 13.265 1.072 1.00 0.00 O ATOM 489 CB VAL A 34 -1.915 10.059 1.322 1.00 0.00 C ATOM 490 CG1 VAL A 34 -1.043 10.666 0.221 1.00 0.00 C ATOM 491 CG2 VAL A 34 -1.095 9.137 2.226 1.00 0.00 C ATOM 0 H VAL A 34 -3.983 9.727 2.818 1.00 0.00 H new ATOM 0 HA VAL A 34 -1.817 11.730 2.618 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.688 9.457 0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.562 9.867 -0.344 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.664 11.261 -0.448 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -0.280 11.302 0.670 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -0.614 8.369 1.621 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.334 9.719 2.746 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.752 8.665 2.956 1.00 0.00 H new ATOM 501 N VAL A 35 -4.547 11.625 0.787 1.00 0.00 N ATOM 502 CA VAL A 35 -5.419 12.431 -0.050 1.00 0.00 C ATOM 503 C VAL A 35 -5.866 13.669 0.730 1.00 0.00 C ATOM 504 O VAL A 35 -6.052 14.738 0.150 1.00 0.00 O ATOM 505 CB VAL A 35 -6.591 11.585 -0.552 1.00 0.00 C ATOM 506 CG1 VAL A 35 -7.534 12.417 -1.423 1.00 0.00 C ATOM 507 CG2 VAL A 35 -6.093 10.351 -1.307 1.00 0.00 C ATOM 0 H VAL A 35 -4.877 10.675 0.956 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.885 12.779 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.153 11.242 0.317 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -8.358 11.792 -1.767 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.928 13.249 -0.840 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.988 12.803 -2.284 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.946 9.767 -1.653 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.497 10.665 -2.164 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.481 9.741 -0.643 1.00 0.00 H new ATOM 517 N GLY A 36 -6.026 13.483 2.032 1.00 0.00 N ATOM 518 CA GLY A 36 -6.447 14.572 2.897 1.00 0.00 C ATOM 519 C GLY A 36 -5.250 15.193 3.619 1.00 0.00 C ATOM 520 O GLY A 36 -5.416 15.872 4.632 1.00 0.00 O ATOM 0 H GLY A 36 -5.872 12.595 2.509 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.956 15.334 2.307 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.166 14.203 3.628 1.00 0.00 H new ATOM 524 N PHE A 37 -4.072 14.939 3.071 1.00 0.00 N ATOM 525 CA PHE A 37 -2.847 15.465 3.650 1.00 0.00 C ATOM 526 C PHE A 37 -2.718 16.967 3.388 1.00 0.00 C ATOM 527 O PHE A 37 -3.469 17.529 2.593 1.00 0.00 O ATOM 528 CB PHE A 37 -1.684 14.739 2.972 1.00 0.00 C ATOM 529 CG PHE A 37 -0.303 15.211 3.433 1.00 0.00 C ATOM 530 CD1 PHE A 37 0.033 15.148 4.749 1.00 0.00 C ATOM 531 CD2 PHE A 37 0.588 15.693 2.525 1.00 0.00 C ATOM 532 CE1 PHE A 37 1.315 15.587 5.176 1.00 0.00 C ATOM 533 CE2 PHE A 37 1.870 16.131 2.953 1.00 0.00 C ATOM 534 CZ PHE A 37 2.206 16.069 4.269 1.00 0.00 C ATOM 0 H PHE A 37 -3.939 14.375 2.231 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.849 15.310 4.729 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.774 13.670 3.165 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.762 14.876 1.894 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -0.674 14.764 5.469 1.00 0.00 H new ATOM 0 HD2 PHE A 37 0.321 15.743 1.480 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.582 15.538 6.221 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.578 16.513 2.233 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.180 16.403 4.594 1.00 0.00 H new ATOM 544 N SER A 38 -1.758 17.574 4.071 1.00 0.00 N ATOM 545 CA SER A 38 -1.520 19.000 3.922 1.00 0.00 C ATOM 546 C SER A 38 -0.161 19.369 4.519 1.00 0.00 C ATOM 547 O SER A 38 -0.081 19.800 5.668 1.00 0.00 O ATOM 548 CB SER A 38 -2.631 19.816 4.586 1.00 0.00 C ATOM 549 OG SER A 38 -3.598 20.268 3.642 1.00 0.00 O ATOM 0 H SER A 38 -1.136 17.104 4.729 1.00 0.00 H new ATOM 0 HA SER A 38 -1.518 19.237 2.858 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.122 19.208 5.346 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.195 20.674 5.097 1.00 0.00 H new ATOM 0 HG SER A 38 -3.858 19.525 3.058 1.00 0.00 H new ATOM 555 N GLY A 39 0.873 19.186 3.712 1.00 0.00 N ATOM 556 CA GLY A 39 2.225 19.494 4.146 1.00 0.00 C ATOM 557 C GLY A 39 3.198 19.478 2.965 1.00 0.00 C ATOM 558 O GLY A 39 3.066 18.657 2.059 1.00 0.00 O ATOM 0 H GLY A 39 0.802 18.828 2.759 1.00 0.00 H new ATOM 0 HA2 GLY A 39 2.243 20.474 4.623 1.00 0.00 H new ATOM 0 HA3 GLY A 39 2.544 18.769 4.895 1.00 0.00 H new ATOM 562 N LEU A 40 4.153 20.394 3.014 1.00 0.00 N ATOM 563 CA LEU A 40 5.148 20.495 1.960 1.00 0.00 C ATOM 564 C LEU A 40 5.890 19.163 1.835 1.00 0.00 C ATOM 565 O LEU A 40 5.818 18.322 2.729 1.00 0.00 O ATOM 566 CB LEU A 40 6.070 21.692 2.205 1.00 0.00 C ATOM 567 CG LEU A 40 5.709 22.980 1.463 1.00 0.00 C ATOM 568 CD1 LEU A 40 6.261 22.964 0.037 1.00 0.00 C ATOM 569 CD2 LEU A 40 4.198 23.223 1.490 1.00 0.00 C ATOM 0 H LEU A 40 4.259 21.073 3.767 1.00 0.00 H new ATOM 0 HA LEU A 40 4.667 20.684 1.000 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.082 21.903 3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.084 21.407 1.925 1.00 0.00 H new ATOM 0 HG LEU A 40 6.179 23.816 1.981 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.990 23.891 -0.468 1.00 0.00 H new ATOM 0 HD12 LEU A 40 7.347 22.871 0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.840 22.118 -0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.968 24.145 0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.687 22.388 1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.862 23.309 2.523 1.00 0.00 H new ATOM 581 N SER A 41 6.585 19.012 0.717 1.00 0.00 N ATOM 582 CA SER A 41 7.339 17.796 0.463 1.00 0.00 C ATOM 583 C SER A 41 8.424 17.621 1.528 1.00 0.00 C ATOM 584 O SER A 41 9.509 18.188 1.413 1.00 0.00 O ATOM 585 CB SER A 41 7.965 17.817 -0.933 1.00 0.00 C ATOM 586 OG SER A 41 9.163 18.588 -0.969 1.00 0.00 O ATOM 0 H SER A 41 6.642 19.712 -0.023 1.00 0.00 H new ATOM 0 HA SER A 41 6.652 16.951 0.511 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.181 16.796 -1.249 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.249 18.226 -1.645 1.00 0.00 H new ATOM 0 HG SER A 41 9.356 18.935 -0.073 1.00 0.00 H new ATOM 592 N ASP A 42 8.092 16.834 2.541 1.00 0.00 N ATOM 593 CA ASP A 42 9.024 16.578 3.626 1.00 0.00 C ATOM 594 C ASP A 42 9.004 17.758 4.600 1.00 0.00 C ATOM 595 O ASP A 42 9.920 18.579 4.604 1.00 0.00 O ATOM 596 CB ASP A 42 10.452 16.422 3.100 1.00 0.00 C ATOM 597 CG ASP A 42 10.573 15.688 1.763 1.00 0.00 C ATOM 598 OD1 ASP A 42 9.747 14.777 1.540 1.00 0.00 O ATOM 599 OD2 ASP A 42 11.488 16.056 0.995 1.00 0.00 O ATOM 0 H ASP A 42 7.191 16.365 2.633 1.00 0.00 H new ATOM 0 HA ASP A 42 8.720 15.656 4.121 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.894 17.413 2.995 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.041 15.887 3.845 1.00 0.00 H new ATOM 604 N ASP A 43 7.951 17.805 5.401 1.00 0.00 N ATOM 605 CA ASP A 43 7.800 18.871 6.377 1.00 0.00 C ATOM 606 C ASP A 43 8.089 18.321 7.776 1.00 0.00 C ATOM 607 O ASP A 43 8.993 18.798 8.459 1.00 0.00 O ATOM 608 CB ASP A 43 6.373 19.424 6.372 1.00 0.00 C ATOM 609 CG ASP A 43 5.273 18.373 6.213 1.00 0.00 C ATOM 610 OD1 ASP A 43 5.062 17.942 5.059 1.00 0.00 O ATOM 611 OD2 ASP A 43 4.667 18.025 7.250 1.00 0.00 O ATOM 0 H ASP A 43 7.193 17.122 5.395 1.00 0.00 H new ATOM 0 HA ASP A 43 8.497 19.668 6.117 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.206 19.965 7.303 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.283 20.148 5.562 1.00 0.00 H new ATOM 616 N LYS A 44 7.304 17.325 8.159 1.00 0.00 N ATOM 617 CA LYS A 44 7.464 16.705 9.463 1.00 0.00 C ATOM 618 C LYS A 44 6.504 15.519 9.581 1.00 0.00 C ATOM 619 O LYS A 44 6.863 14.478 10.129 1.00 0.00 O ATOM 620 CB LYS A 44 7.298 17.744 10.574 1.00 0.00 C ATOM 621 CG LYS A 44 8.038 17.314 11.842 1.00 0.00 C ATOM 622 CD LYS A 44 8.964 18.426 12.341 1.00 0.00 C ATOM 623 CE LYS A 44 9.754 17.972 13.570 1.00 0.00 C ATOM 624 NZ LYS A 44 10.824 18.944 13.886 1.00 0.00 N ATOM 0 H LYS A 44 6.555 16.932 7.589 1.00 0.00 H new ATOM 0 HA LYS A 44 8.474 16.310 9.576 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.679 18.708 10.235 1.00 0.00 H new ATOM 0 HB3 LYS A 44 6.239 17.879 10.795 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.317 17.060 12.619 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.620 16.415 11.640 1.00 0.00 H new ATOM 0 HD2 LYS A 44 9.653 18.714 11.547 1.00 0.00 H new ATOM 0 HD3 LYS A 44 8.376 19.310 12.588 1.00 0.00 H new ATOM 0 HE2 LYS A 44 9.084 17.870 14.423 1.00 0.00 H new ATOM 0 HE3 LYS A 44 10.189 16.990 13.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.351 18.621 14.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.473 19.021 13.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 10.402 19.874 14.081 1.00 0.00 H new ATOM 638 N ASN A 45 5.303 15.717 9.059 1.00 0.00 N ATOM 639 CA ASN A 45 4.289 14.677 9.099 1.00 0.00 C ATOM 640 C ASN A 45 4.300 13.910 7.776 1.00 0.00 C ATOM 641 O ASN A 45 3.760 12.808 7.689 1.00 0.00 O ATOM 642 CB ASN A 45 2.894 15.276 9.287 1.00 0.00 C ATOM 643 CG ASN A 45 1.924 14.237 9.854 1.00 0.00 C ATOM 644 OD1 ASN A 45 1.687 13.190 9.275 1.00 0.00 O ATOM 645 ND2 ASN A 45 1.378 14.585 11.016 1.00 0.00 N ATOM 0 H ASN A 45 5.009 16.582 8.606 1.00 0.00 H new ATOM 0 HA ASN A 45 4.514 14.017 9.937 1.00 0.00 H new ATOM 0 HB2 ASN A 45 2.949 16.132 9.959 1.00 0.00 H new ATOM 0 HB3 ASN A 45 2.521 15.644 8.332 1.00 0.00 H new ATOM 0 HD21 ASN A 45 0.717 13.960 11.476 1.00 0.00 H new ATOM 0 HD22 ASN A 45 1.621 15.477 11.447 1.00 0.00 H new ATOM 652 N TYR A 46 4.920 14.522 6.778 1.00 0.00 N ATOM 653 CA TYR A 46 5.008 13.910 5.463 1.00 0.00 C ATOM 654 C TYR A 46 5.815 12.611 5.516 1.00 0.00 C ATOM 655 O TYR A 46 5.582 11.699 4.724 1.00 0.00 O ATOM 656 CB TYR A 46 5.743 14.917 4.577 1.00 0.00 C ATOM 657 CG TYR A 46 6.140 14.367 3.206 1.00 0.00 C ATOM 658 CD1 TYR A 46 7.208 13.499 3.094 1.00 0.00 C ATOM 659 CD2 TYR A 46 5.431 14.737 2.082 1.00 0.00 C ATOM 660 CE1 TYR A 46 7.582 12.981 1.803 1.00 0.00 C ATOM 661 CE2 TYR A 46 5.805 14.219 0.791 1.00 0.00 C ATOM 662 CZ TYR A 46 6.862 13.367 0.716 1.00 0.00 C ATOM 663 OH TYR A 46 7.215 12.877 -0.503 1.00 0.00 O ATOM 0 H TYR A 46 5.367 15.436 6.854 1.00 0.00 H new ATOM 0 HA TYR A 46 4.015 13.668 5.085 1.00 0.00 H new ATOM 0 HB2 TYR A 46 5.109 15.792 4.436 1.00 0.00 H new ATOM 0 HB3 TYR A 46 6.641 15.254 5.095 1.00 0.00 H new ATOM 0 HD1 TYR A 46 7.763 13.209 3.974 1.00 0.00 H new ATOM 0 HD2 TYR A 46 4.595 15.415 2.170 1.00 0.00 H new ATOM 0 HE1 TYR A 46 8.415 12.302 1.701 1.00 0.00 H new ATOM 0 HE2 TYR A 46 5.258 14.501 -0.097 1.00 0.00 H new ATOM 0 HH TYR A 46 7.224 11.898 -0.472 1.00 0.00 H new ATOM 673 N LYS A 47 6.747 12.569 6.457 1.00 0.00 N ATOM 674 CA LYS A 47 7.590 11.397 6.623 1.00 0.00 C ATOM 675 C LYS A 47 6.724 10.207 7.041 1.00 0.00 C ATOM 676 O LYS A 47 6.685 9.190 6.349 1.00 0.00 O ATOM 677 CB LYS A 47 8.735 11.694 7.593 1.00 0.00 C ATOM 678 CG LYS A 47 9.505 12.946 7.166 1.00 0.00 C ATOM 679 CD LYS A 47 10.103 12.771 5.769 1.00 0.00 C ATOM 680 CE LYS A 47 11.517 13.351 5.702 1.00 0.00 C ATOM 681 NZ LYS A 47 11.535 14.736 6.224 1.00 0.00 N ATOM 0 H LYS A 47 6.937 13.327 7.112 1.00 0.00 H new ATOM 0 HA LYS A 47 8.064 11.131 5.678 1.00 0.00 H new ATOM 0 HB2 LYS A 47 8.338 11.832 8.599 1.00 0.00 H new ATOM 0 HB3 LYS A 47 9.413 10.842 7.633 1.00 0.00 H new ATOM 0 HG2 LYS A 47 8.838 13.808 7.175 1.00 0.00 H new ATOM 0 HG3 LYS A 47 10.300 13.151 7.883 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.127 11.713 5.510 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.468 13.265 5.033 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.199 12.729 6.281 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.872 13.340 4.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 12.314 15.264 5.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 10.632 15.202 6.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 11.672 14.717 7.255 1.00 0.00 H new ATOM 695 N ARG A 48 6.050 10.372 8.170 1.00 0.00 N ATOM 696 CA ARG A 48 5.187 9.324 8.687 1.00 0.00 C ATOM 697 C ARG A 48 4.365 8.706 7.555 1.00 0.00 C ATOM 698 O ARG A 48 4.491 7.516 7.269 1.00 0.00 O ATOM 699 CB ARG A 48 4.240 9.869 9.757 1.00 0.00 C ATOM 700 CG ARG A 48 3.980 8.824 10.844 1.00 0.00 C ATOM 701 CD ARG A 48 3.708 9.491 12.193 1.00 0.00 C ATOM 702 NE ARG A 48 4.968 10.027 12.756 1.00 0.00 N ATOM 703 CZ ARG A 48 5.037 10.767 13.871 1.00 0.00 C ATOM 704 NH1 ARG A 48 3.921 11.063 14.550 1.00 0.00 N ATOM 705 NH2 ARG A 48 6.224 11.211 14.308 1.00 0.00 N ATOM 0 H ARG A 48 6.084 11.216 8.741 1.00 0.00 H new ATOM 0 HA ARG A 48 5.824 8.562 9.136 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.669 10.765 10.205 1.00 0.00 H new ATOM 0 HB3 ARG A 48 3.296 10.163 9.297 1.00 0.00 H new ATOM 0 HG2 ARG A 48 3.128 8.205 10.562 1.00 0.00 H new ATOM 0 HG3 ARG A 48 4.841 8.161 10.929 1.00 0.00 H new ATOM 0 HD2 ARG A 48 2.983 10.296 12.070 1.00 0.00 H new ATOM 0 HD3 ARG A 48 3.270 8.770 12.883 1.00 0.00 H new ATOM 0 HE ARG A 48 5.838 9.820 12.265 1.00 0.00 H new ATOM 0 HH11 ARG A 48 3.018 10.725 14.218 1.00 0.00 H new ATOM 0 HH12 ARG A 48 3.975 11.626 15.399 1.00 0.00 H new ATOM 0 HH21 ARG A 48 7.074 10.986 13.792 1.00 0.00 H new ATOM 0 HH22 ARG A 48 6.277 11.774 15.157 1.00 0.00 H new ATOM 719 N LEU A 49 3.541 9.542 6.940 1.00 0.00 N ATOM 720 CA LEU A 49 2.698 9.093 5.845 1.00 0.00 C ATOM 721 C LEU A 49 3.519 8.206 4.907 1.00 0.00 C ATOM 722 O LEU A 49 3.260 7.008 4.795 1.00 0.00 O ATOM 723 CB LEU A 49 2.044 10.287 5.147 1.00 0.00 C ATOM 724 CG LEU A 49 0.931 10.992 5.925 1.00 0.00 C ATOM 725 CD1 LEU A 49 0.118 11.909 5.010 1.00 0.00 C ATOM 726 CD2 LEU A 49 0.046 9.979 6.655 1.00 0.00 C ATOM 0 H LEU A 49 3.439 10.528 7.179 1.00 0.00 H new ATOM 0 HA LEU A 49 1.876 8.485 6.222 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.819 11.018 4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.636 9.947 4.195 1.00 0.00 H new ATOM 0 HG LEU A 49 1.392 11.623 6.685 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.666 12.398 5.588 1.00 0.00 H new ATOM 0 HD12 LEU A 49 0.773 12.664 4.577 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.333 11.319 4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.737 10.506 7.200 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.408 9.304 5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.652 9.405 7.356 1.00 0.00 H new ATOM 738 N GLU A 50 4.491 8.828 4.256 1.00 0.00 N ATOM 739 CA GLU A 50 5.351 8.110 3.330 1.00 0.00 C ATOM 740 C GLU A 50 5.876 6.828 3.980 1.00 0.00 C ATOM 741 O GLU A 50 5.734 5.741 3.421 1.00 0.00 O ATOM 742 CB GLU A 50 6.504 8.995 2.854 1.00 0.00 C ATOM 743 CG GLU A 50 7.472 8.206 1.971 1.00 0.00 C ATOM 744 CD GLU A 50 7.861 9.009 0.728 1.00 0.00 C ATOM 745 OE1 GLU A 50 6.996 9.778 0.256 1.00 0.00 O ATOM 746 OE2 GLU A 50 9.014 8.836 0.279 1.00 0.00 O ATOM 0 H GLU A 50 4.702 9.821 4.351 1.00 0.00 H new ATOM 0 HA GLU A 50 4.762 7.836 2.455 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.109 9.845 2.298 1.00 0.00 H new ATOM 0 HB3 GLU A 50 7.037 9.398 3.715 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.367 7.955 2.541 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.011 7.265 1.671 1.00 0.00 H new ATOM 753 N ARG A 51 6.471 6.997 5.151 1.00 0.00 N ATOM 754 CA ARG A 51 7.019 5.867 5.883 1.00 0.00 C ATOM 755 C ARG A 51 6.025 4.704 5.884 1.00 0.00 C ATOM 756 O ARG A 51 6.392 3.569 5.582 1.00 0.00 O ATOM 757 CB ARG A 51 7.344 6.252 7.327 1.00 0.00 C ATOM 758 CG ARG A 51 8.841 6.105 7.610 1.00 0.00 C ATOM 759 CD ARG A 51 9.411 7.383 8.227 1.00 0.00 C ATOM 760 NE ARG A 51 10.651 7.076 8.973 1.00 0.00 N ATOM 761 CZ ARG A 51 11.508 8.004 9.421 1.00 0.00 C ATOM 762 NH1 ARG A 51 11.265 9.303 9.200 1.00 0.00 N ATOM 763 NH2 ARG A 51 12.609 7.633 10.089 1.00 0.00 N ATOM 0 H ARG A 51 6.586 7.900 5.612 1.00 0.00 H new ATOM 0 HA ARG A 51 7.939 5.563 5.384 1.00 0.00 H new ATOM 0 HB2 ARG A 51 7.035 7.281 7.511 1.00 0.00 H new ATOM 0 HB3 ARG A 51 6.777 5.621 8.012 1.00 0.00 H new ATOM 0 HG2 ARG A 51 9.006 5.266 8.286 1.00 0.00 H new ATOM 0 HG3 ARG A 51 9.369 5.877 6.684 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.619 8.113 7.445 1.00 0.00 H new ATOM 0 HD3 ARG A 51 8.677 7.833 8.895 1.00 0.00 H new ATOM 0 HE ARG A 51 10.867 6.097 9.158 1.00 0.00 H new ATOM 0 HH11 ARG A 51 10.428 9.586 8.691 1.00 0.00 H new ATOM 0 HH12 ARG A 51 11.917 10.009 9.541 1.00 0.00 H new ATOM 0 HH21 ARG A 51 12.795 6.644 10.257 1.00 0.00 H new ATOM 0 HH22 ARG A 51 13.261 8.339 10.430 1.00 0.00 H new ATOM 777 N ILE A 52 4.786 5.026 6.226 1.00 0.00 N ATOM 778 CA ILE A 52 3.737 4.022 6.271 1.00 0.00 C ATOM 779 C ILE A 52 3.720 3.249 4.950 1.00 0.00 C ATOM 780 O ILE A 52 3.995 2.051 4.924 1.00 0.00 O ATOM 781 CB ILE A 52 2.394 4.665 6.624 1.00 0.00 C ATOM 782 CG1 ILE A 52 2.473 5.395 7.966 1.00 0.00 C ATOM 783 CG2 ILE A 52 1.268 3.630 6.599 1.00 0.00 C ATOM 784 CD1 ILE A 52 1.493 6.569 8.009 1.00 0.00 C ATOM 0 H ILE A 52 4.485 5.968 6.475 1.00 0.00 H new ATOM 0 HA ILE A 52 3.936 3.299 7.062 1.00 0.00 H new ATOM 0 HB ILE A 52 2.161 5.412 5.865 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.250 4.700 8.776 1.00 0.00 H new ATOM 0 HG13 ILE A 52 3.488 5.758 8.128 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.324 4.113 6.853 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.196 3.195 5.602 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.480 2.844 7.324 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.569 7.071 8.973 1.00 0.00 H new ATOM 0 HD12 ILE A 52 1.734 7.274 7.213 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.477 6.200 7.871 1.00 0.00 H new ATOM 796 N LEU A 53 3.396 3.968 3.885 1.00 0.00 N ATOM 797 CA LEU A 53 3.339 3.365 2.564 1.00 0.00 C ATOM 798 C LEU A 53 4.644 2.612 2.296 1.00 0.00 C ATOM 799 O LEU A 53 4.624 1.438 1.929 1.00 0.00 O ATOM 800 CB LEU A 53 3.010 4.421 1.507 1.00 0.00 C ATOM 801 CG LEU A 53 1.567 4.929 1.493 1.00 0.00 C ATOM 802 CD1 LEU A 53 1.461 6.259 0.744 1.00 0.00 C ATOM 803 CD2 LEU A 53 0.619 3.872 0.922 1.00 0.00 C ATOM 0 H LEU A 53 3.170 4.962 3.910 1.00 0.00 H new ATOM 0 HA LEU A 53 2.532 2.634 2.513 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.673 5.273 1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.238 4.007 0.525 1.00 0.00 H new ATOM 0 HG LEU A 53 1.260 5.114 2.522 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.425 6.598 0.749 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.089 7.003 1.234 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.794 6.125 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.400 4.259 0.923 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.915 3.632 -0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.666 2.972 1.535 1.00 0.00 H new ATOM 815 N THR A 54 5.748 3.319 2.489 1.00 0.00 N ATOM 816 CA THR A 54 7.060 2.732 2.273 1.00 0.00 C ATOM 817 C THR A 54 7.204 1.437 3.074 1.00 0.00 C ATOM 818 O THR A 54 7.791 0.468 2.595 1.00 0.00 O ATOM 819 CB THR A 54 8.113 3.785 2.625 1.00 0.00 C ATOM 820 OG1 THR A 54 9.028 3.740 1.534 1.00 0.00 O ATOM 821 CG2 THR A 54 8.957 3.386 3.837 1.00 0.00 C ATOM 0 H THR A 54 5.761 4.293 2.793 1.00 0.00 H new ATOM 0 HA THR A 54 7.199 2.448 1.230 1.00 0.00 H new ATOM 0 HB THR A 54 7.622 4.738 2.823 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.743 4.394 1.680 1.00 0.00 H new ATOM 0 HG21 THR A 54 9.688 4.167 4.044 1.00 0.00 H new ATOM 0 HG22 THR A 54 8.310 3.256 4.704 1.00 0.00 H new ATOM 0 HG23 THR A 54 9.475 2.450 3.627 1.00 0.00 H new ATOM 829 N LYS A 55 6.657 1.462 4.281 1.00 0.00 N ATOM 830 CA LYS A 55 6.718 0.302 5.154 1.00 0.00 C ATOM 831 C LYS A 55 5.769 -0.777 4.627 1.00 0.00 C ATOM 832 O LYS A 55 6.172 -1.922 4.433 1.00 0.00 O ATOM 833 CB LYS A 55 6.444 0.707 6.604 1.00 0.00 C ATOM 834 CG LYS A 55 7.741 0.755 7.414 1.00 0.00 C ATOM 835 CD LYS A 55 8.048 2.182 7.873 1.00 0.00 C ATOM 836 CE LYS A 55 8.492 2.203 9.337 1.00 0.00 C ATOM 837 NZ LYS A 55 8.296 3.550 9.919 1.00 0.00 N ATOM 0 H LYS A 55 6.170 2.267 4.675 1.00 0.00 H new ATOM 0 HA LYS A 55 7.721 -0.125 5.151 1.00 0.00 H new ATOM 0 HB2 LYS A 55 5.960 1.683 6.627 1.00 0.00 H new ATOM 0 HB3 LYS A 55 5.753 -0.002 7.059 1.00 0.00 H new ATOM 0 HG2 LYS A 55 7.657 0.100 8.281 1.00 0.00 H new ATOM 0 HG3 LYS A 55 8.566 0.378 6.809 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.830 2.609 7.246 1.00 0.00 H new ATOM 0 HD3 LYS A 55 7.163 2.806 7.749 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.923 1.468 9.906 1.00 0.00 H new ATOM 0 HE3 LYS A 55 9.542 1.919 9.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.906 3.460 10.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 9.209 4.046 9.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.635 4.092 9.326 1.00 0.00 H new ATOM 851 N GLN A 56 4.526 -0.372 4.411 1.00 0.00 N ATOM 852 CA GLN A 56 3.516 -1.289 3.911 1.00 0.00 C ATOM 853 C GLN A 56 3.982 -1.927 2.601 1.00 0.00 C ATOM 854 O GLN A 56 3.887 -3.142 2.430 1.00 0.00 O ATOM 855 CB GLN A 56 2.173 -0.580 3.729 1.00 0.00 C ATOM 856 CG GLN A 56 1.646 -0.053 5.065 1.00 0.00 C ATOM 857 CD GLN A 56 1.675 -1.145 6.136 1.00 0.00 C ATOM 858 OE1 GLN A 56 2.437 -1.096 7.088 1.00 0.00 O ATOM 859 NE2 GLN A 56 0.806 -2.130 5.928 1.00 0.00 N ATOM 0 H GLN A 56 4.195 0.579 4.573 1.00 0.00 H new ATOM 0 HA GLN A 56 3.374 -2.080 4.648 1.00 0.00 H new ATOM 0 HB2 GLN A 56 2.286 0.246 3.027 1.00 0.00 H new ATOM 0 HB3 GLN A 56 1.449 -1.270 3.295 1.00 0.00 H new ATOM 0 HG2 GLN A 56 2.250 0.795 5.389 1.00 0.00 H new ATOM 0 HG3 GLN A 56 0.626 0.311 4.939 1.00 0.00 H new ATOM 0 HE21 GLN A 56 0.197 -2.109 5.110 1.00 0.00 H new ATOM 0 HE22 GLN A 56 0.748 -2.907 6.586 1.00 0.00 H new ATOM 868 N LEU A 57 4.474 -1.080 1.709 1.00 0.00 N ATOM 869 CA LEU A 57 4.954 -1.546 0.419 1.00 0.00 C ATOM 870 C LEU A 57 6.009 -2.632 0.635 1.00 0.00 C ATOM 871 O LEU A 57 5.861 -3.752 0.147 1.00 0.00 O ATOM 872 CB LEU A 57 5.446 -0.369 -0.426 1.00 0.00 C ATOM 873 CG LEU A 57 6.191 -0.733 -1.712 1.00 0.00 C ATOM 874 CD1 LEU A 57 7.659 -1.054 -1.424 1.00 0.00 C ATOM 875 CD2 LEU A 57 5.489 -1.875 -2.448 1.00 0.00 C ATOM 0 H LEU A 57 4.551 -0.073 1.854 1.00 0.00 H new ATOM 0 HA LEU A 57 4.142 -1.999 -0.150 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.587 0.248 -0.689 1.00 0.00 H new ATOM 0 HB3 LEU A 57 6.103 0.245 0.190 1.00 0.00 H new ATOM 0 HG LEU A 57 6.175 0.134 -2.372 1.00 0.00 H new ATOM 0 HD11 LEU A 57 8.165 -1.309 -2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.140 -0.185 -0.976 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.719 -1.897 -0.736 1.00 0.00 H new ATOM 0 HD21 LEU A 57 6.039 -2.114 -3.358 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.453 -2.754 -1.805 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.474 -1.572 -2.706 1.00 0.00 H new ATOM 887 N PHE A 58 7.051 -2.264 1.366 1.00 0.00 N ATOM 888 CA PHE A 58 8.131 -3.193 1.652 1.00 0.00 C ATOM 889 C PHE A 58 7.583 -4.543 2.121 1.00 0.00 C ATOM 890 O PHE A 58 8.220 -5.577 1.928 1.00 0.00 O ATOM 891 CB PHE A 58 8.965 -2.577 2.777 1.00 0.00 C ATOM 892 CG PHE A 58 10.469 -2.819 2.640 1.00 0.00 C ATOM 893 CD1 PHE A 58 10.943 -4.084 2.482 1.00 0.00 C ATOM 894 CD2 PHE A 58 11.333 -1.769 2.676 1.00 0.00 C ATOM 895 CE1 PHE A 58 12.339 -4.309 2.355 1.00 0.00 C ATOM 896 CE2 PHE A 58 12.730 -1.994 2.549 1.00 0.00 C ATOM 897 CZ PHE A 58 13.203 -3.259 2.391 1.00 0.00 C ATOM 0 H PHE A 58 7.170 -1.335 1.769 1.00 0.00 H new ATOM 0 HA PHE A 58 8.723 -3.363 0.753 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.781 -1.503 2.805 1.00 0.00 H new ATOM 0 HB3 PHE A 58 8.627 -2.984 3.730 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.257 -4.918 2.453 1.00 0.00 H new ATOM 0 HD2 PHE A 58 10.957 -0.764 2.801 1.00 0.00 H new ATOM 0 HE1 PHE A 58 12.715 -5.314 2.230 1.00 0.00 H new ATOM 0 HE2 PHE A 58 13.416 -1.160 2.578 1.00 0.00 H new ATOM 0 HZ PHE A 58 14.265 -3.430 2.294 1.00 0.00 H new ATOM 907 N GLU A 59 6.406 -4.489 2.728 1.00 0.00 N ATOM 908 CA GLU A 59 5.765 -5.694 3.226 1.00 0.00 C ATOM 909 C GLU A 59 5.105 -6.458 2.076 1.00 0.00 C ATOM 910 O GLU A 59 5.035 -7.686 2.101 1.00 0.00 O ATOM 911 CB GLU A 59 4.748 -5.363 4.319 1.00 0.00 C ATOM 912 CG GLU A 59 5.378 -5.483 5.709 1.00 0.00 C ATOM 913 CD GLU A 59 5.306 -6.924 6.220 1.00 0.00 C ATOM 914 OE1 GLU A 59 4.234 -7.284 6.754 1.00 0.00 O ATOM 915 OE2 GLU A 59 6.324 -7.632 6.066 1.00 0.00 O ATOM 0 H GLU A 59 5.880 -3.630 2.886 1.00 0.00 H new ATOM 0 HA GLU A 59 6.530 -6.332 3.669 1.00 0.00 H new ATOM 0 HB2 GLU A 59 4.369 -4.351 4.174 1.00 0.00 H new ATOM 0 HB3 GLU A 59 3.895 -6.037 4.243 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.418 -5.158 5.670 1.00 0.00 H new ATOM 0 HG3 GLU A 59 4.863 -4.820 6.404 1.00 0.00 H new ATOM 922 N ILE A 60 4.637 -5.699 1.095 1.00 0.00 N ATOM 923 CA ILE A 60 3.985 -6.289 -0.061 1.00 0.00 C ATOM 924 C ILE A 60 4.981 -7.184 -0.801 1.00 0.00 C ATOM 925 O ILE A 60 4.670 -8.330 -1.124 1.00 0.00 O ATOM 926 CB ILE A 60 3.366 -5.200 -0.940 1.00 0.00 C ATOM 927 CG1 ILE A 60 2.334 -4.386 -0.158 1.00 0.00 C ATOM 928 CG2 ILE A 60 2.775 -5.798 -2.219 1.00 0.00 C ATOM 929 CD1 ILE A 60 1.655 -3.351 -1.059 1.00 0.00 C ATOM 0 H ILE A 60 4.697 -4.681 1.078 1.00 0.00 H new ATOM 0 HA ILE A 60 3.156 -6.924 0.252 1.00 0.00 H new ATOM 0 HB ILE A 60 4.157 -4.513 -1.241 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.583 -5.054 0.265 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.820 -3.883 0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 60 2.342 -5.003 -2.826 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.562 -6.298 -2.784 1.00 0.00 H new ATOM 0 HG23 ILE A 60 2.000 -6.519 -1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.926 -2.786 -0.479 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.405 -2.670 -1.461 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.150 -3.859 -1.880 1.00 0.00 H new ATOM 941 N ASP A 61 6.158 -6.628 -1.049 1.00 0.00 N ATOM 942 CA ASP A 61 7.201 -7.362 -1.745 1.00 0.00 C ATOM 943 C ASP A 61 7.638 -8.553 -0.890 1.00 0.00 C ATOM 944 O ASP A 61 8.137 -9.548 -1.413 1.00 0.00 O ATOM 945 CB ASP A 61 8.427 -6.479 -1.988 1.00 0.00 C ATOM 946 CG ASP A 61 9.354 -6.954 -3.108 1.00 0.00 C ATOM 947 OD1 ASP A 61 10.144 -7.884 -2.835 1.00 0.00 O ATOM 948 OD2 ASP A 61 9.251 -6.378 -4.212 1.00 0.00 O ATOM 0 H ASP A 61 6.412 -5.677 -0.780 1.00 0.00 H new ATOM 0 HA ASP A 61 6.799 -7.693 -2.703 1.00 0.00 H new ATOM 0 HB2 ASP A 61 8.088 -5.469 -2.221 1.00 0.00 H new ATOM 0 HB3 ASP A 61 9.001 -6.418 -1.063 1.00 0.00 H new ATOM 953 N SER A 62 7.434 -8.413 0.412 1.00 0.00 N ATOM 954 CA SER A 62 7.800 -9.465 1.345 1.00 0.00 C ATOM 955 C SER A 62 6.780 -10.603 1.277 1.00 0.00 C ATOM 956 O SER A 62 7.095 -11.745 1.607 1.00 0.00 O ATOM 957 CB SER A 62 7.900 -8.925 2.773 1.00 0.00 C ATOM 958 OG SER A 62 9.067 -9.396 3.441 1.00 0.00 O ATOM 0 H SER A 62 7.020 -7.586 0.843 1.00 0.00 H new ATOM 0 HA SER A 62 8.780 -9.848 1.061 1.00 0.00 H new ATOM 0 HB2 SER A 62 7.911 -7.835 2.749 1.00 0.00 H new ATOM 0 HB3 SER A 62 7.015 -9.222 3.336 1.00 0.00 H new ATOM 0 HG SER A 62 9.095 -9.028 4.349 1.00 0.00 H new ATOM 964 N VAL A 63 5.576 -10.251 0.848 1.00 0.00 N ATOM 965 CA VAL A 63 4.508 -11.229 0.733 1.00 0.00 C ATOM 966 C VAL A 63 4.805 -12.169 -0.436 1.00 0.00 C ATOM 967 O VAL A 63 4.833 -11.742 -1.589 1.00 0.00 O ATOM 968 CB VAL A 63 3.160 -10.517 0.600 1.00 0.00 C ATOM 969 CG1 VAL A 63 2.092 -11.464 0.048 1.00 0.00 C ATOM 970 CG2 VAL A 63 2.722 -9.916 1.937 1.00 0.00 C ATOM 0 H VAL A 63 5.317 -9.303 0.576 1.00 0.00 H new ATOM 0 HA VAL A 63 4.451 -11.840 1.634 1.00 0.00 H new ATOM 0 HB VAL A 63 3.282 -9.699 -0.110 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.144 -10.933 -0.037 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.396 -11.822 -0.935 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.974 -12.312 0.722 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.761 -9.416 1.814 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.626 -10.709 2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 63 3.466 -9.194 2.273 1.00 0.00 H new ATOM 980 N ASP A 64 5.021 -13.432 -0.098 1.00 0.00 N ATOM 981 CA ASP A 64 5.316 -14.436 -1.106 1.00 0.00 C ATOM 982 C ASP A 64 4.017 -14.857 -1.796 1.00 0.00 C ATOM 983 O ASP A 64 2.944 -14.801 -1.196 1.00 0.00 O ATOM 984 CB ASP A 64 5.941 -15.682 -0.475 1.00 0.00 C ATOM 985 CG ASP A 64 6.670 -16.606 -1.453 1.00 0.00 C ATOM 986 OD1 ASP A 64 7.356 -16.061 -2.344 1.00 0.00 O ATOM 987 OD2 ASP A 64 6.524 -17.836 -1.287 1.00 0.00 O ATOM 0 H ASP A 64 4.998 -13.783 0.860 1.00 0.00 H new ATOM 0 HA ASP A 64 6.017 -14.002 -1.819 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.644 -15.367 0.296 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.156 -16.251 0.023 1.00 0.00 H new ATOM 992 N THR A 65 4.156 -15.269 -3.048 1.00 0.00 N ATOM 993 CA THR A 65 3.007 -15.698 -3.826 1.00 0.00 C ATOM 994 C THR A 65 3.058 -17.209 -4.064 1.00 0.00 C ATOM 995 O THR A 65 2.084 -17.915 -3.811 1.00 0.00 O ATOM 996 CB THR A 65 2.978 -14.880 -5.118 1.00 0.00 C ATOM 997 OG1 THR A 65 4.204 -15.210 -5.765 1.00 0.00 O ATOM 998 CG2 THR A 65 3.086 -13.375 -4.861 1.00 0.00 C ATOM 0 H THR A 65 5.047 -15.315 -3.542 1.00 0.00 H new ATOM 0 HA THR A 65 2.076 -15.516 -3.289 1.00 0.00 H new ATOM 0 HB THR A 65 2.056 -15.090 -5.660 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.267 -14.724 -6.614 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.061 -12.841 -5.811 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.251 -13.051 -4.240 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.024 -13.160 -4.349 1.00 0.00 H new ATOM 1006 N GLU A 66 4.206 -17.660 -4.549 1.00 0.00 N ATOM 1007 CA GLU A 66 4.398 -19.074 -4.824 1.00 0.00 C ATOM 1008 C GLU A 66 3.595 -19.488 -6.059 1.00 0.00 C ATOM 1009 O GLU A 66 3.306 -20.668 -6.249 1.00 0.00 O ATOM 1010 CB GLU A 66 4.017 -19.925 -3.612 1.00 0.00 C ATOM 1011 CG GLU A 66 5.171 -20.842 -3.201 1.00 0.00 C ATOM 1012 CD GLU A 66 4.662 -22.242 -2.852 1.00 0.00 C ATOM 1013 OE1 GLU A 66 3.667 -22.312 -2.099 1.00 0.00 O ATOM 1014 OE2 GLU A 66 5.279 -23.210 -3.347 1.00 0.00 O ATOM 0 H GLU A 66 5.012 -17.071 -4.758 1.00 0.00 H new ATOM 0 HA GLU A 66 5.455 -19.244 -5.028 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.748 -19.277 -2.778 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.137 -20.524 -3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.896 -20.907 -4.013 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.691 -20.416 -2.343 1.00 0.00 H new ATOM 1021 N GLY A 67 3.257 -18.493 -6.867 1.00 0.00 N ATOM 1022 CA GLY A 67 2.493 -18.739 -8.078 1.00 0.00 C ATOM 1023 C GLY A 67 1.013 -18.956 -7.758 1.00 0.00 C ATOM 1024 O GLY A 67 0.430 -19.965 -8.153 1.00 0.00 O ATOM 0 H GLY A 67 3.498 -17.515 -6.706 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.602 -17.894 -8.759 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.890 -19.615 -8.591 1.00 0.00 H new ATOM 1028 N LYS A 68 0.447 -17.994 -7.045 1.00 0.00 N ATOM 1029 CA LYS A 68 -0.954 -18.067 -6.667 1.00 0.00 C ATOM 1030 C LYS A 68 -1.664 -16.784 -7.105 1.00 0.00 C ATOM 1031 O LYS A 68 -1.689 -15.802 -6.366 1.00 0.00 O ATOM 1032 CB LYS A 68 -1.091 -18.367 -5.173 1.00 0.00 C ATOM 1033 CG LYS A 68 -0.409 -19.688 -4.814 1.00 0.00 C ATOM 1034 CD LYS A 68 -0.670 -20.061 -3.353 1.00 0.00 C ATOM 1035 CE LYS A 68 0.075 -21.342 -2.973 1.00 0.00 C ATOM 1036 NZ LYS A 68 -0.818 -22.516 -3.092 1.00 0.00 N ATOM 0 H LYS A 68 0.934 -17.159 -6.719 1.00 0.00 H new ATOM 0 HA LYS A 68 -1.444 -18.894 -7.181 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -0.649 -17.556 -4.594 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -2.146 -18.413 -4.903 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.776 -20.480 -5.466 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.664 -19.606 -4.986 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.353 -19.245 -2.703 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -1.740 -20.197 -3.194 1.00 0.00 H new ATOM 0 HE2 LYS A 68 0.943 -21.471 -3.620 1.00 0.00 H new ATOM 0 HE3 LYS A 68 0.448 -21.263 -1.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.296 -23.377 -2.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -1.633 -22.398 -2.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -1.153 -22.599 -4.073 1.00 0.00 H new ATOM 1050 N GLY A 69 -2.223 -16.835 -8.305 1.00 0.00 N ATOM 1051 CA GLY A 69 -2.931 -15.689 -8.850 1.00 0.00 C ATOM 1052 C GLY A 69 -3.704 -14.951 -7.755 1.00 0.00 C ATOM 1053 O GLY A 69 -3.482 -13.762 -7.528 1.00 0.00 O ATOM 0 H GLY A 69 -2.200 -17.652 -8.915 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -2.221 -15.009 -9.321 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.620 -16.019 -9.627 1.00 0.00 H new ATOM 1057 N ASP A 70 -4.594 -15.686 -7.105 1.00 0.00 N ATOM 1058 CA ASP A 70 -5.400 -15.115 -6.039 1.00 0.00 C ATOM 1059 C ASP A 70 -4.540 -14.160 -5.210 1.00 0.00 C ATOM 1060 O ASP A 70 -4.978 -13.062 -4.868 1.00 0.00 O ATOM 1061 CB ASP A 70 -5.930 -16.205 -5.106 1.00 0.00 C ATOM 1062 CG ASP A 70 -6.458 -17.458 -5.808 1.00 0.00 C ATOM 1063 OD1 ASP A 70 -7.090 -17.287 -6.873 1.00 0.00 O ATOM 1064 OD2 ASP A 70 -6.217 -18.557 -5.264 1.00 0.00 O ATOM 0 H ASP A 70 -4.775 -16.672 -7.296 1.00 0.00 H new ATOM 0 HA ASP A 70 -6.240 -14.591 -6.495 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -5.132 -16.498 -4.424 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.730 -15.784 -4.497 1.00 0.00 H new ATOM 1069 N ILE A 71 -3.331 -14.612 -4.911 1.00 0.00 N ATOM 1070 CA ILE A 71 -2.405 -13.811 -4.129 1.00 0.00 C ATOM 1071 C ILE A 71 -1.655 -12.853 -5.057 1.00 0.00 C ATOM 1072 O ILE A 71 -1.704 -11.638 -4.872 1.00 0.00 O ATOM 1073 CB ILE A 71 -1.485 -14.710 -3.301 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -2.272 -15.451 -2.218 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -0.317 -13.912 -2.717 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -1.406 -16.515 -1.541 1.00 0.00 C ATOM 0 H ILE A 71 -2.971 -15.523 -5.196 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.947 -13.199 -3.409 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.059 -15.464 -3.963 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.630 -14.740 -1.473 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -3.152 -15.920 -2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.321 -14.575 -2.133 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.263 -13.471 -3.527 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -0.702 -13.121 -2.074 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.990 -17.026 -0.776 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.070 -17.238 -2.285 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.540 -16.040 -1.080 1.00 0.00 H new ATOM 1088 N GLN A 72 -0.979 -13.436 -6.035 1.00 0.00 N ATOM 1089 CA GLN A 72 -0.220 -12.649 -6.993 1.00 0.00 C ATOM 1090 C GLN A 72 -0.997 -11.390 -7.380 1.00 0.00 C ATOM 1091 O GLN A 72 -0.453 -10.287 -7.352 1.00 0.00 O ATOM 1092 CB GLN A 72 0.130 -13.479 -8.230 1.00 0.00 C ATOM 1093 CG GLN A 72 1.634 -13.441 -8.508 1.00 0.00 C ATOM 1094 CD GLN A 72 1.916 -12.951 -9.930 1.00 0.00 C ATOM 1095 OE1 GLN A 72 1.237 -13.301 -10.881 1.00 0.00 O ATOM 1096 NE2 GLN A 72 2.953 -12.123 -10.021 1.00 0.00 N ATOM 0 H GLN A 72 -0.941 -14.444 -6.185 1.00 0.00 H new ATOM 0 HA GLN A 72 0.715 -12.345 -6.523 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -0.190 -14.510 -8.083 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.413 -13.097 -9.094 1.00 0.00 H new ATOM 0 HG2 GLN A 72 2.124 -12.784 -7.789 1.00 0.00 H new ATOM 0 HG3 GLN A 72 2.058 -14.436 -8.371 1.00 0.00 H new ATOM 0 HE21 GLN A 72 3.479 -11.871 -9.184 1.00 0.00 H new ATOM 0 HE22 GLN A 72 3.222 -11.740 -10.927 1.00 0.00 H new ATOM 1105 N GLN A 73 -2.258 -11.596 -7.731 1.00 0.00 N ATOM 1106 CA GLN A 73 -3.116 -10.490 -8.122 1.00 0.00 C ATOM 1107 C GLN A 73 -3.159 -9.434 -7.016 1.00 0.00 C ATOM 1108 O GLN A 73 -2.762 -8.290 -7.230 1.00 0.00 O ATOM 1109 CB GLN A 73 -4.523 -10.983 -8.465 1.00 0.00 C ATOM 1110 CG GLN A 73 -4.769 -10.935 -9.975 1.00 0.00 C ATOM 1111 CD GLN A 73 -5.287 -12.279 -10.489 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -5.879 -13.063 -9.766 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -5.032 -12.501 -11.776 1.00 0.00 N ATOM 0 H GLN A 73 -2.706 -12.512 -7.753 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.699 -10.031 -9.018 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -4.652 -12.003 -8.104 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.263 -10.368 -7.953 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -5.491 -10.151 -10.205 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -3.844 -10.677 -10.490 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.531 -11.802 -12.325 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -5.337 -13.370 -12.214 1.00 0.00 H new ATOM 1122 N ALA A 74 -3.644 -9.856 -5.858 1.00 0.00 N ATOM 1123 CA ALA A 74 -3.745 -8.960 -4.718 1.00 0.00 C ATOM 1124 C ALA A 74 -2.411 -8.236 -4.525 1.00 0.00 C ATOM 1125 O ALA A 74 -2.349 -7.010 -4.611 1.00 0.00 O ATOM 1126 CB ALA A 74 -4.160 -9.756 -3.479 1.00 0.00 C ATOM 0 H ALA A 74 -3.971 -10.806 -5.684 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.510 -8.203 -4.891 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.236 -9.085 -2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -5.126 -10.228 -3.657 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.414 -10.523 -3.273 1.00 0.00 H new ATOM 1132 N ARG A 75 -1.377 -9.024 -4.269 1.00 0.00 N ATOM 1133 CA ARG A 75 -0.049 -8.472 -4.064 1.00 0.00 C ATOM 1134 C ARG A 75 0.233 -7.371 -5.088 1.00 0.00 C ATOM 1135 O ARG A 75 0.314 -6.196 -4.735 1.00 0.00 O ATOM 1136 CB ARG A 75 1.023 -9.558 -4.184 1.00 0.00 C ATOM 1137 CG ARG A 75 2.224 -9.244 -3.290 1.00 0.00 C ATOM 1138 CD ARG A 75 3.529 -9.705 -3.942 1.00 0.00 C ATOM 1139 NE ARG A 75 4.424 -8.547 -4.157 1.00 0.00 N ATOM 1140 CZ ARG A 75 4.379 -7.753 -5.235 1.00 0.00 C ATOM 1141 NH1 ARG A 75 3.482 -7.987 -6.203 1.00 0.00 N ATOM 1142 NH2 ARG A 75 5.231 -6.724 -5.346 1.00 0.00 N ATOM 0 H ARG A 75 -1.432 -10.040 -4.199 1.00 0.00 H new ATOM 0 HA ARG A 75 -0.016 -8.054 -3.058 1.00 0.00 H new ATOM 0 HB2 ARG A 75 0.600 -10.523 -3.906 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.349 -9.640 -5.221 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.268 -8.172 -3.098 1.00 0.00 H new ATOM 0 HG3 ARG A 75 2.102 -9.736 -2.325 1.00 0.00 H new ATOM 0 HD2 ARG A 75 4.021 -10.443 -3.308 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.317 -10.193 -4.893 1.00 0.00 H new ATOM 0 HE ARG A 75 5.119 -8.340 -3.440 1.00 0.00 H new ATOM 0 HH11 ARG A 75 2.833 -8.770 -6.119 1.00 0.00 H new ATOM 0 HH12 ARG A 75 3.448 -7.382 -7.024 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.914 -6.545 -4.610 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.197 -6.120 -6.167 1.00 0.00 H new ATOM 1156 N LYS A 76 0.375 -7.791 -6.337 1.00 0.00 N ATOM 1157 CA LYS A 76 0.647 -6.855 -7.415 1.00 0.00 C ATOM 1158 C LYS A 76 -0.371 -5.714 -7.361 1.00 0.00 C ATOM 1159 O LYS A 76 -0.037 -4.566 -7.653 1.00 0.00 O ATOM 1160 CB LYS A 76 0.683 -7.584 -8.760 1.00 0.00 C ATOM 1161 CG LYS A 76 -0.731 -7.879 -9.262 1.00 0.00 C ATOM 1162 CD LYS A 76 -0.719 -8.254 -10.746 1.00 0.00 C ATOM 1163 CE LYS A 76 -0.015 -9.594 -10.967 1.00 0.00 C ATOM 1164 NZ LYS A 76 0.655 -9.616 -12.286 1.00 0.00 N ATOM 0 H LYS A 76 0.307 -8.767 -6.626 1.00 0.00 H new ATOM 0 HA LYS A 76 1.634 -6.409 -7.294 1.00 0.00 H new ATOM 0 HB2 LYS A 76 1.213 -6.976 -9.493 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.238 -8.516 -8.657 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.165 -8.693 -8.681 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -1.365 -7.005 -9.109 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -1.742 -8.311 -11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -0.214 -7.475 -11.318 1.00 0.00 H new ATOM 0 HE2 LYS A 76 0.718 -9.761 -10.178 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -0.739 -10.406 -10.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 1.128 -10.533 -12.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -0.052 -9.478 -13.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 1.360 -8.853 -12.330 1.00 0.00 H new ATOM 1178 N ARG A 77 -1.591 -6.068 -6.986 1.00 0.00 N ATOM 1179 CA ARG A 77 -2.659 -5.088 -6.890 1.00 0.00 C ATOM 1180 C ARG A 77 -2.405 -4.139 -5.716 1.00 0.00 C ATOM 1181 O ARG A 77 -2.904 -3.015 -5.703 1.00 0.00 O ATOM 1182 CB ARG A 77 -4.016 -5.768 -6.703 1.00 0.00 C ATOM 1183 CG ARG A 77 -4.667 -6.074 -8.053 1.00 0.00 C ATOM 1184 CD ARG A 77 -6.193 -6.015 -7.952 1.00 0.00 C ATOM 1185 NE ARG A 77 -6.743 -7.381 -7.805 1.00 0.00 N ATOM 1186 CZ ARG A 77 -7.945 -7.654 -7.280 1.00 0.00 C ATOM 1187 NH1 ARG A 77 -8.730 -6.657 -6.848 1.00 0.00 N ATOM 1188 NH2 ARG A 77 -8.363 -8.924 -7.186 1.00 0.00 N ATOM 0 H ARG A 77 -1.864 -7.021 -6.745 1.00 0.00 H new ATOM 0 HA ARG A 77 -2.675 -4.523 -7.822 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.889 -6.692 -6.139 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -4.672 -5.124 -6.117 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -4.320 -5.358 -8.798 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -4.359 -7.063 -8.393 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -6.486 -5.402 -7.099 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -6.607 -5.541 -8.842 1.00 0.00 H new ATOM 0 HE ARG A 77 -6.171 -8.163 -8.123 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -8.412 -5.690 -6.919 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -9.645 -6.865 -6.448 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -7.766 -9.683 -7.514 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -9.278 -9.131 -6.786 1.00 0.00 H new ATOM 1202 N ALA A 78 -1.630 -4.628 -4.759 1.00 0.00 N ATOM 1203 CA ALA A 78 -1.304 -3.838 -3.584 1.00 0.00 C ATOM 1204 C ALA A 78 0.017 -3.103 -3.819 1.00 0.00 C ATOM 1205 O ALA A 78 0.246 -2.034 -3.255 1.00 0.00 O ATOM 1206 CB ALA A 78 -1.255 -4.747 -2.355 1.00 0.00 C ATOM 0 H ALA A 78 -1.218 -5.561 -4.773 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.072 -3.086 -3.402 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -1.010 -4.154 -1.474 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -2.226 -5.222 -2.215 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.494 -5.513 -2.499 1.00 0.00 H new ATOM 1212 N ALA A 79 0.852 -3.705 -4.653 1.00 0.00 N ATOM 1213 CA ALA A 79 2.145 -3.122 -4.969 1.00 0.00 C ATOM 1214 C ALA A 79 1.935 -1.801 -5.713 1.00 0.00 C ATOM 1215 O ALA A 79 2.690 -0.850 -5.522 1.00 0.00 O ATOM 1216 CB ALA A 79 2.972 -4.122 -5.779 1.00 0.00 C ATOM 0 H ALA A 79 0.658 -4.591 -5.120 1.00 0.00 H new ATOM 0 HA ALA A 79 2.701 -2.903 -4.057 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.942 -3.685 -6.016 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.117 -5.031 -5.196 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.447 -4.364 -6.703 1.00 0.00 H new ATOM 1222 N GLN A 80 0.904 -1.786 -6.547 1.00 0.00 N ATOM 1223 CA GLN A 80 0.586 -0.598 -7.320 1.00 0.00 C ATOM 1224 C GLN A 80 -0.251 0.372 -6.483 1.00 0.00 C ATOM 1225 O GLN A 80 -0.050 1.584 -6.546 1.00 0.00 O ATOM 1226 CB GLN A 80 -0.137 -0.966 -8.618 1.00 0.00 C ATOM 1227 CG GLN A 80 0.799 -1.710 -9.574 1.00 0.00 C ATOM 1228 CD GLN A 80 0.104 -2.000 -10.906 1.00 0.00 C ATOM 1229 OE1 GLN A 80 -0.862 -2.741 -10.983 1.00 0.00 O ATOM 1230 NE2 GLN A 80 0.647 -1.376 -11.947 1.00 0.00 N ATOM 0 H GLN A 80 0.279 -2.577 -6.703 1.00 0.00 H new ATOM 0 HA GLN A 80 1.519 -0.103 -7.589 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -1.003 -1.589 -8.393 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -0.511 -0.062 -9.099 1.00 0.00 H new ATOM 0 HG2 GLN A 80 1.695 -1.114 -9.749 1.00 0.00 H new ATOM 0 HG3 GLN A 80 1.123 -2.645 -9.117 1.00 0.00 H new ATOM 0 HE21 GLN A 80 1.456 -0.769 -11.813 1.00 0.00 H new ATOM 0 HE22 GLN A 80 0.255 -1.504 -12.880 1.00 0.00 H new ATOM 1239 N GLU A 81 -1.172 -0.198 -5.720 1.00 0.00 N ATOM 1240 CA GLU A 81 -2.040 0.601 -4.871 1.00 0.00 C ATOM 1241 C GLU A 81 -1.206 1.446 -3.906 1.00 0.00 C ATOM 1242 O GLU A 81 -1.359 2.666 -3.853 1.00 0.00 O ATOM 1243 CB GLU A 81 -3.029 -0.285 -4.111 1.00 0.00 C ATOM 1244 CG GLU A 81 -4.450 -0.105 -4.648 1.00 0.00 C ATOM 1245 CD GLU A 81 -4.580 -0.680 -6.060 1.00 0.00 C ATOM 1246 OE1 GLU A 81 -4.069 -0.021 -6.990 1.00 0.00 O ATOM 1247 OE2 GLU A 81 -5.187 -1.767 -6.176 1.00 0.00 O ATOM 0 H GLU A 81 -1.336 -1.204 -5.672 1.00 0.00 H new ATOM 0 HA GLU A 81 -2.618 1.273 -5.505 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.731 -1.330 -4.202 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.003 -0.038 -3.050 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -5.159 -0.599 -3.984 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.707 0.954 -4.658 1.00 0.00 H new ATOM 1254 N THR A 82 -0.343 0.765 -3.167 1.00 0.00 N ATOM 1255 CA THR A 82 0.514 1.438 -2.206 1.00 0.00 C ATOM 1256 C THR A 82 1.242 2.609 -2.870 1.00 0.00 C ATOM 1257 O THR A 82 1.073 3.759 -2.468 1.00 0.00 O ATOM 1258 CB THR A 82 1.460 0.397 -1.605 1.00 0.00 C ATOM 1259 OG1 THR A 82 0.591 -0.528 -0.957 1.00 0.00 O ATOM 1260 CG2 THR A 82 2.312 0.966 -0.469 1.00 0.00 C ATOM 0 H THR A 82 -0.219 -0.246 -3.214 1.00 0.00 H new ATOM 0 HA THR A 82 -0.068 1.875 -1.395 1.00 0.00 H new ATOM 0 HB THR A 82 2.112 0.005 -2.386 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.253 -1.174 -1.612 1.00 0.00 H new ATOM 0 HG21 THR A 82 2.965 0.186 -0.078 1.00 0.00 H new ATOM 0 HG22 THR A 82 2.917 1.791 -0.846 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.662 1.327 0.328 1.00 0.00 H new ATOM 1268 N GLU A 83 2.038 2.275 -3.876 1.00 0.00 N ATOM 1269 CA GLU A 83 2.792 3.284 -4.599 1.00 0.00 C ATOM 1270 C GLU A 83 1.875 4.435 -5.018 1.00 0.00 C ATOM 1271 O GLU A 83 2.229 5.603 -4.866 1.00 0.00 O ATOM 1272 CB GLU A 83 3.497 2.676 -5.814 1.00 0.00 C ATOM 1273 CG GLU A 83 4.450 1.556 -5.390 1.00 0.00 C ATOM 1274 CD GLU A 83 5.895 2.056 -5.339 1.00 0.00 C ATOM 1275 OE1 GLU A 83 6.464 2.261 -6.433 1.00 0.00 O ATOM 1276 OE2 GLU A 83 6.398 2.222 -4.207 1.00 0.00 O ATOM 0 H GLU A 83 2.177 1.320 -4.207 1.00 0.00 H new ATOM 0 HA GLU A 83 3.560 3.680 -3.934 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.756 2.284 -6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 83 4.053 3.451 -6.342 1.00 0.00 H new ATOM 0 HG2 GLU A 83 4.158 1.176 -4.411 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.374 0.724 -6.090 1.00 0.00 H new ATOM 1283 N ARG A 84 0.713 4.065 -5.536 1.00 0.00 N ATOM 1284 CA ARG A 84 -0.258 5.052 -5.977 1.00 0.00 C ATOM 1285 C ARG A 84 -0.373 6.180 -4.949 1.00 0.00 C ATOM 1286 O ARG A 84 -0.071 7.333 -5.252 1.00 0.00 O ATOM 1287 CB ARG A 84 -1.635 4.416 -6.182 1.00 0.00 C ATOM 1288 CG ARG A 84 -2.196 4.758 -7.564 1.00 0.00 C ATOM 1289 CD ARG A 84 -3.231 3.722 -8.007 1.00 0.00 C ATOM 1290 NE ARG A 84 -3.192 3.565 -9.478 1.00 0.00 N ATOM 1291 CZ ARG A 84 -2.137 3.093 -10.156 1.00 0.00 C ATOM 1292 NH1 ARG A 84 -1.027 2.730 -9.499 1.00 0.00 N ATOM 1293 NH2 ARG A 84 -2.192 2.985 -11.491 1.00 0.00 N ATOM 0 H ARG A 84 0.422 3.095 -5.660 1.00 0.00 H new ATOM 0 HA ARG A 84 0.089 5.456 -6.928 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.560 3.334 -6.074 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.320 4.767 -5.410 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.653 5.747 -7.540 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -1.384 4.800 -8.290 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -3.029 2.765 -7.525 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.227 4.033 -7.692 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.020 3.833 -10.009 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -0.985 2.813 -8.483 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -0.224 2.371 -10.015 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -3.037 3.262 -11.991 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -1.389 2.626 -12.007 1.00 0.00 H new ATOM 1307 N LEU A 85 -0.810 5.807 -3.755 1.00 0.00 N ATOM 1308 CA LEU A 85 -0.969 6.773 -2.682 1.00 0.00 C ATOM 1309 C LEU A 85 0.327 7.572 -2.525 1.00 0.00 C ATOM 1310 O LEU A 85 0.306 8.802 -2.524 1.00 0.00 O ATOM 1311 CB LEU A 85 -1.421 6.077 -1.397 1.00 0.00 C ATOM 1312 CG LEU A 85 -2.931 6.044 -1.148 1.00 0.00 C ATOM 1313 CD1 LEU A 85 -3.445 7.419 -0.717 1.00 0.00 C ATOM 1314 CD2 LEU A 85 -3.677 5.510 -2.372 1.00 0.00 C ATOM 0 H LEU A 85 -1.059 4.849 -3.507 1.00 0.00 H new ATOM 0 HA LEU A 85 -1.757 7.486 -2.925 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.053 5.051 -1.414 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.944 6.573 -0.552 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.127 5.355 -0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.520 7.368 -0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -2.946 7.722 0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.236 8.148 -1.500 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -4.748 5.497 -2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.478 6.154 -3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.337 4.498 -2.592 1.00 0.00 H new ATOM 1326 N LEU A 86 1.424 6.840 -2.395 1.00 0.00 N ATOM 1327 CA LEU A 86 2.726 7.464 -2.238 1.00 0.00 C ATOM 1328 C LEU A 86 2.839 8.648 -3.201 1.00 0.00 C ATOM 1329 O LEU A 86 3.195 9.753 -2.793 1.00 0.00 O ATOM 1330 CB LEU A 86 3.840 6.429 -2.403 1.00 0.00 C ATOM 1331 CG LEU A 86 4.726 6.196 -1.177 1.00 0.00 C ATOM 1332 CD1 LEU A 86 5.600 4.953 -1.361 1.00 0.00 C ATOM 1333 CD2 LEU A 86 5.558 7.439 -0.857 1.00 0.00 C ATOM 0 H LEU A 86 1.437 5.820 -2.395 1.00 0.00 H new ATOM 0 HA LEU A 86 2.839 7.861 -1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.387 5.479 -2.685 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.476 6.738 -3.233 1.00 0.00 H new ATOM 0 HG LEU A 86 4.080 6.012 -0.319 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.220 4.810 -0.476 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.964 4.079 -1.504 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.239 5.084 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.178 7.246 0.018 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.196 7.679 -1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.894 8.279 -0.653 1.00 0.00 H new ATOM 1345 N LYS A 87 2.530 8.377 -4.460 1.00 0.00 N ATOM 1346 CA LYS A 87 2.592 9.405 -5.484 1.00 0.00 C ATOM 1347 C LYS A 87 1.708 10.584 -5.071 1.00 0.00 C ATOM 1348 O LYS A 87 2.159 11.729 -5.061 1.00 0.00 O ATOM 1349 CB LYS A 87 2.237 8.821 -6.853 1.00 0.00 C ATOM 1350 CG LYS A 87 3.280 7.793 -7.297 1.00 0.00 C ATOM 1351 CD LYS A 87 4.499 8.480 -7.915 1.00 0.00 C ATOM 1352 CE LYS A 87 4.268 8.775 -9.399 1.00 0.00 C ATOM 1353 NZ LYS A 87 4.421 7.542 -10.202 1.00 0.00 N ATOM 0 H LYS A 87 2.236 7.459 -4.794 1.00 0.00 H new ATOM 0 HA LYS A 87 3.609 9.786 -5.580 1.00 0.00 H new ATOM 0 HB2 LYS A 87 1.254 8.352 -6.808 1.00 0.00 H new ATOM 0 HB3 LYS A 87 2.174 9.622 -7.589 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.591 7.193 -6.442 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.837 7.110 -8.022 1.00 0.00 H new ATOM 0 HD2 LYS A 87 4.706 9.409 -7.384 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.377 7.844 -7.799 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.270 9.188 -9.543 1.00 0.00 H new ATOM 0 HE3 LYS A 87 4.977 9.529 -9.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 4.447 7.787 -11.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 5.306 7.064 -9.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.617 6.907 -10.020 1.00 0.00 H new ATOM 1367 N GLU A 88 0.466 10.264 -4.740 1.00 0.00 N ATOM 1368 CA GLU A 88 -0.485 11.282 -4.328 1.00 0.00 C ATOM 1369 C GLU A 88 0.159 12.229 -3.312 1.00 0.00 C ATOM 1370 O GLU A 88 0.171 13.443 -3.511 1.00 0.00 O ATOM 1371 CB GLU A 88 -1.755 10.648 -3.757 1.00 0.00 C ATOM 1372 CG GLU A 88 -2.432 9.750 -4.795 1.00 0.00 C ATOM 1373 CD GLU A 88 -3.576 10.488 -5.494 1.00 0.00 C ATOM 1374 OE1 GLU A 88 -3.260 11.387 -6.303 1.00 0.00 O ATOM 1375 OE2 GLU A 88 -4.740 10.135 -5.205 1.00 0.00 O ATOM 0 H GLU A 88 0.096 9.314 -4.749 1.00 0.00 H new ATOM 0 HA GLU A 88 -0.771 11.861 -5.206 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -1.508 10.064 -2.871 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -2.446 11.430 -3.441 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -1.699 9.425 -5.533 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -2.816 8.852 -4.310 1.00 0.00 H new ATOM 1382 N LEU A 89 0.678 11.638 -2.247 1.00 0.00 N ATOM 1383 CA LEU A 89 1.322 12.413 -1.200 1.00 0.00 C ATOM 1384 C LEU A 89 2.138 13.541 -1.835 1.00 0.00 C ATOM 1385 O LEU A 89 1.836 14.717 -1.639 1.00 0.00 O ATOM 1386 CB LEU A 89 2.142 11.501 -0.285 1.00 0.00 C ATOM 1387 CG LEU A 89 2.772 12.170 0.939 1.00 0.00 C ATOM 1388 CD1 LEU A 89 1.703 12.560 1.961 1.00 0.00 C ATOM 1389 CD2 LEU A 89 3.855 11.281 1.553 1.00 0.00 C ATOM 0 H LEU A 89 0.666 10.631 -2.086 1.00 0.00 H new ATOM 0 HA LEU A 89 0.575 12.881 -0.559 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.499 10.691 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.937 11.047 -0.876 1.00 0.00 H new ATOM 0 HG LEU A 89 3.257 13.090 0.614 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.177 13.033 2.821 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.000 13.257 1.505 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.169 11.668 2.287 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.286 11.780 2.421 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.416 10.332 1.861 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.636 11.097 0.815 1.00 0.00 H new ATOM 1401 N GLU A 90 3.156 13.143 -2.583 1.00 0.00 N ATOM 1402 CA GLU A 90 4.018 14.105 -3.249 1.00 0.00 C ATOM 1403 C GLU A 90 3.192 15.281 -3.776 1.00 0.00 C ATOM 1404 O GLU A 90 3.605 16.434 -3.662 1.00 0.00 O ATOM 1405 CB GLU A 90 4.811 13.443 -4.376 1.00 0.00 C ATOM 1406 CG GLU A 90 6.305 13.406 -4.047 1.00 0.00 C ATOM 1407 CD GLU A 90 7.145 13.308 -5.322 1.00 0.00 C ATOM 1408 OE1 GLU A 90 6.993 12.285 -6.025 1.00 0.00 O ATOM 1409 OE2 GLU A 90 7.920 14.258 -5.566 1.00 0.00 O ATOM 0 H GLU A 90 3.404 12.167 -2.743 1.00 0.00 H new ATOM 0 HA GLU A 90 4.735 14.486 -2.522 1.00 0.00 H new ATOM 0 HB2 GLU A 90 4.445 12.429 -4.536 1.00 0.00 H new ATOM 0 HB3 GLU A 90 4.653 13.989 -5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 90 6.581 14.303 -3.493 1.00 0.00 H new ATOM 0 HG3 GLU A 90 6.518 12.554 -3.401 1.00 0.00 H new ATOM 1416 N GLN A 91 2.041 14.948 -4.342 1.00 0.00 N ATOM 1417 CA GLN A 91 1.154 15.961 -4.887 1.00 0.00 C ATOM 1418 C GLN A 91 0.363 16.634 -3.763 1.00 0.00 C ATOM 1419 O GLN A 91 0.470 17.843 -3.562 1.00 0.00 O ATOM 1420 CB GLN A 91 0.216 15.362 -5.936 1.00 0.00 C ATOM 1421 CG GLN A 91 0.454 15.993 -7.309 1.00 0.00 C ATOM 1422 CD GLN A 91 -0.836 16.018 -8.132 1.00 0.00 C ATOM 1423 OE1 GLN A 91 -1.310 15.006 -8.622 1.00 0.00 O ATOM 1424 NE2 GLN A 91 -1.375 17.227 -8.256 1.00 0.00 N ATOM 0 H GLN A 91 1.702 13.990 -4.435 1.00 0.00 H new ATOM 0 HA GLN A 91 1.761 16.719 -5.382 1.00 0.00 H new ATOM 0 HB2 GLN A 91 0.371 14.285 -5.995 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.820 15.519 -5.635 1.00 0.00 H new ATOM 0 HG2 GLN A 91 0.831 17.008 -7.186 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.220 15.431 -7.844 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -0.926 18.033 -7.820 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -2.237 17.349 -8.787 1.00 0.00 H new ATOM 1433 N ASN A 92 -0.413 15.822 -3.061 1.00 0.00 N ATOM 1434 CA ASN A 92 -1.222 16.323 -1.964 1.00 0.00 C ATOM 1435 C ASN A 92 -0.381 17.273 -1.108 1.00 0.00 C ATOM 1436 O ASN A 92 -0.895 18.257 -0.579 1.00 0.00 O ATOM 1437 CB ASN A 92 -1.703 15.180 -1.067 1.00 0.00 C ATOM 1438 CG ASN A 92 -3.016 14.591 -1.587 1.00 0.00 C ATOM 1439 OD1 ASN A 92 -4.071 15.198 -1.514 1.00 0.00 O ATOM 1440 ND2 ASN A 92 -2.891 13.376 -2.116 1.00 0.00 N ATOM 0 H ASN A 92 -0.499 14.820 -3.231 1.00 0.00 H new ATOM 0 HA ASN A 92 -2.085 16.836 -2.389 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.942 14.401 -1.025 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.842 15.545 -0.049 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.709 12.897 -2.492 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -1.977 12.924 -2.146 1.00 0.00 H new ATOM 1447 N ALA A 93 0.898 16.944 -0.999 1.00 0.00 N ATOM 1448 CA ALA A 93 1.815 17.756 -0.217 1.00 0.00 C ATOM 1449 C ALA A 93 1.569 19.234 -0.523 1.00 0.00 C ATOM 1450 O ALA A 93 0.975 19.949 0.283 1.00 0.00 O ATOM 1451 CB ALA A 93 3.254 17.330 -0.515 1.00 0.00 C ATOM 0 H ALA A 93 1.321 16.127 -1.439 1.00 0.00 H new ATOM 0 HA ALA A 93 1.645 17.608 0.849 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.942 17.939 0.071 1.00 0.00 H new ATOM 0 HB2 ALA A 93 3.384 16.280 -0.253 1.00 0.00 H new ATOM 0 HB3 ALA A 93 3.462 17.467 -1.576 1.00 0.00 H new ATOM 1457 N SER A 94 2.038 19.650 -1.691 1.00 0.00 N ATOM 1458 CA SER A 94 1.877 21.031 -2.113 1.00 0.00 C ATOM 1459 C SER A 94 2.498 21.231 -3.497 1.00 0.00 C ATOM 1460 O SER A 94 1.958 21.963 -4.324 1.00 0.00 O ATOM 1461 CB SER A 94 2.506 21.993 -1.104 1.00 0.00 C ATOM 1462 OG SER A 94 1.808 23.234 -1.042 1.00 0.00 O ATOM 0 H SER A 94 2.529 19.055 -2.358 1.00 0.00 H new ATOM 0 HA SER A 94 0.811 21.250 -2.165 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.511 21.530 -0.117 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.546 22.175 -1.376 1.00 0.00 H new ATOM 0 HG SER A 94 2.240 23.820 -0.385 1.00 0.00 H new ATOM 1468 N GLY A 95 3.626 20.566 -3.706 1.00 0.00 N ATOM 1469 CA GLY A 95 4.327 20.661 -4.975 1.00 0.00 C ATOM 1470 C GLY A 95 3.705 19.728 -6.016 1.00 0.00 C ATOM 1471 O GLY A 95 3.009 18.777 -5.665 1.00 0.00 O ATOM 0 H GLY A 95 4.071 19.959 -3.017 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.294 21.689 -5.337 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.377 20.406 -4.834 1.00 0.00 H new ATOM 1475 N PRO A 96 3.987 20.042 -7.309 1.00 0.00 N ATOM 1476 CA PRO A 96 3.463 19.242 -8.404 1.00 0.00 C ATOM 1477 C PRO A 96 4.218 17.917 -8.524 1.00 0.00 C ATOM 1478 O PRO A 96 5.344 17.794 -8.045 1.00 0.00 O ATOM 1479 CB PRO A 96 3.605 20.121 -9.636 1.00 0.00 C ATOM 1480 CG PRO A 96 4.622 21.190 -9.270 1.00 0.00 C ATOM 1481 CD PRO A 96 4.807 21.161 -7.762 1.00 0.00 C ATOM 0 HA PRO A 96 2.422 18.954 -8.255 1.00 0.00 H new ATOM 0 HB2 PRO A 96 3.941 19.539 -10.494 1.00 0.00 H new ATOM 0 HB3 PRO A 96 2.649 20.568 -9.909 1.00 0.00 H new ATOM 0 HG2 PRO A 96 5.570 21.003 -9.774 1.00 0.00 H new ATOM 0 HG3 PRO A 96 4.277 22.172 -9.593 1.00 0.00 H new ATOM 0 HD2 PRO A 96 5.854 21.018 -7.494 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.486 22.097 -7.306 1.00 0.00 H new ATOM 1489 N SER A 97 3.568 16.958 -9.168 1.00 0.00 N ATOM 1490 CA SER A 97 4.163 15.647 -9.358 1.00 0.00 C ATOM 1491 C SER A 97 5.490 15.778 -10.109 1.00 0.00 C ATOM 1492 O SER A 97 6.534 15.364 -9.608 1.00 0.00 O ATOM 1493 CB SER A 97 3.215 14.715 -10.115 1.00 0.00 C ATOM 1494 OG SER A 97 3.791 13.431 -10.336 1.00 0.00 O ATOM 0 H SER A 97 2.634 17.064 -9.565 1.00 0.00 H new ATOM 0 HA SER A 97 4.349 15.212 -8.376 1.00 0.00 H new ATOM 0 HB2 SER A 97 2.289 14.604 -9.551 1.00 0.00 H new ATOM 0 HB3 SER A 97 2.953 15.164 -11.073 1.00 0.00 H new ATOM 0 HG SER A 97 3.154 12.866 -10.820 1.00 0.00 H new ATOM 1500 N SER A 98 5.405 16.357 -11.298 1.00 0.00 N ATOM 1501 CA SER A 98 6.586 16.548 -12.122 1.00 0.00 C ATOM 1502 C SER A 98 6.452 17.835 -12.938 1.00 0.00 C ATOM 1503 O SER A 98 7.329 18.696 -12.894 1.00 0.00 O ATOM 1504 CB SER A 98 6.809 15.352 -13.051 1.00 0.00 C ATOM 1505 OG SER A 98 5.643 15.039 -13.808 1.00 0.00 O ATOM 0 H SER A 98 4.537 16.700 -11.710 1.00 0.00 H new ATOM 0 HA SER A 98 7.452 16.630 -11.465 1.00 0.00 H new ATOM 0 HB2 SER A 98 7.634 15.569 -13.729 1.00 0.00 H new ATOM 0 HB3 SER A 98 7.102 14.484 -12.460 1.00 0.00 H new ATOM 0 HG SER A 98 5.827 14.272 -14.389 1.00 0.00 H new ATOM 1511 N GLY A 99 5.346 17.926 -13.663 1.00 0.00 N ATOM 1512 CA GLY A 99 5.086 19.094 -14.488 1.00 0.00 C ATOM 1513 C GLY A 99 5.014 18.715 -15.968 1.00 0.00 C ATOM 1514 O GLY A 99 6.038 18.650 -16.647 1.00 0.00 O ATOM 0 H GLY A 99 4.620 17.210 -13.696 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.149 19.558 -14.182 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.872 19.833 -14.336 1.00 0.00 H new TER 1518 GLY A 99