USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 806 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 169:sc= 0 (180deg=-0.115) USER MOD Single : A 1 MET N :NH3+ 169:sc= 1.47 (180deg=1.36) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -83:sc= 1.33 USER MOD Single : A 16 SER OG : rot 64:sc= 1.28 USER MOD Single : A 33 LYS NZ :NH3+ 159:sc= 1.61 (180deg=1.1) USER MOD Single : A 34 MET CE :methyl -174:sc= 0 (180deg=-0.0773) USER MOD Single : A 44 GLN : amide:sc= 0.164 X(o=0.16,f=0) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -163:sc= 1.24 (180deg=1.17) USER MOD Single : A 51 LYS NZ :NH3+ -173:sc= 3.62 (180deg=3.51) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= 1.13 K(o=1.1,f=-4.5!) USER MOD Single : A 61 GLN : amide:sc= 1.13 K(o=1.1,f=-0.036) USER MOD Single : A 63 THR OG1 : rot -50:sc= 1.27 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot -145:sc= 0.164 USER MOD Single : A 70 MET CE :methyl 173:sc= 0 (180deg=-0.0407) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 129:sc= 1.25 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.0114 USER MOD Single : A 87 SER OG : rot -160:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -139:sc= 2.24 (180deg=0.32) USER MOD Single : A 93 LYS NZ :NH3+ 176:sc= 1.29 (180deg=1.22) USER MOD Single : A 97 GLN : amide:sc= 0.532 K(o=0.53,f=0) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 LYS NZ :NH3+ -173:sc= 1.18 (180deg=1.15) USER MOD Single : A 103 HIS : no HE2:sc= -0.0244 K(o=-0.024,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.307 -0.774 -0.399 1.00 0.00 N ATOM 2 CA MET A 1 0.547 0.041 0.497 1.00 0.00 C ATOM 3 C MET A 1 1.870 0.380 -0.212 1.00 0.00 C ATOM 4 O MET A 1 2.073 0.007 -1.371 1.00 0.00 O ATOM 5 CB MET A 1 0.786 -0.649 1.861 1.00 0.00 C ATOM 6 CG MET A 1 -0.477 -0.838 2.718 1.00 0.00 C ATOM 7 SD MET A 1 -1.610 -2.175 2.232 1.00 0.00 S ATOM 8 CE MET A 1 -0.611 -3.630 2.656 1.00 0.00 C ATOM 0 H1 MET A 1 -1.110 -1.156 0.140 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.662 -0.180 -1.175 1.00 0.00 H new ATOM 0 H3 MET A 1 0.251 -1.559 -0.791 1.00 0.00 H new ATOM 0 HA MET A 1 0.022 0.971 0.717 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.238 -1.625 1.684 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.508 -0.062 2.428 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.165 -1.015 3.747 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.035 0.098 2.711 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.231 -4.525 2.603 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.217 -3.720 1.953 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.219 -3.520 3.667 1.00 0.00 H new ATOM 20 N ALA A 2 2.761 1.124 0.453 1.00 0.00 N ATOM 21 CA ALA A 2 4.043 1.586 -0.074 1.00 0.00 C ATOM 22 C ALA A 2 5.040 1.713 1.089 1.00 0.00 C ATOM 23 O ALA A 2 4.719 1.348 2.227 1.00 0.00 O ATOM 24 CB ALA A 2 3.835 2.938 -0.774 1.00 0.00 C ATOM 0 H ALA A 2 2.599 1.431 1.412 1.00 0.00 H new ATOM 0 HA ALA A 2 4.442 0.877 -0.800 1.00 0.00 H new ATOM 0 HB1 ALA A 2 4.786 3.292 -1.171 1.00 0.00 H new ATOM 0 HB2 ALA A 2 3.122 2.819 -1.590 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.449 3.663 -0.058 1.00 0.00 H new ATOM 30 N ILE A 3 6.233 2.253 0.827 1.00 0.00 N ATOM 31 CA ILE A 3 7.148 2.670 1.886 1.00 0.00 C ATOM 32 C ILE A 3 6.586 3.980 2.458 1.00 0.00 C ATOM 33 O ILE A 3 6.035 4.809 1.726 1.00 0.00 O ATOM 34 CB ILE A 3 8.578 2.843 1.328 1.00 0.00 C ATOM 35 CG1 ILE A 3 9.126 1.508 0.770 1.00 0.00 C ATOM 36 CG2 ILE A 3 9.571 3.372 2.383 1.00 0.00 C ATOM 37 CD1 ILE A 3 9.860 1.726 -0.550 1.00 0.00 C ATOM 0 H ILE A 3 6.587 2.411 -0.116 1.00 0.00 H new ATOM 0 HA ILE A 3 7.222 1.920 2.674 1.00 0.00 H new ATOM 0 HB ILE A 3 8.494 3.580 0.529 1.00 0.00 H new ATOM 0 HG12 ILE A 3 9.802 1.057 1.496 1.00 0.00 H new ATOM 0 HG13 ILE A 3 8.304 0.807 0.622 1.00 0.00 H new ATOM 0 HG21 ILE A 3 10.559 3.474 1.934 1.00 0.00 H new ATOM 0 HG22 ILE A 3 9.235 4.344 2.744 1.00 0.00 H new ATOM 0 HG23 ILE A 3 9.622 2.673 3.218 1.00 0.00 H new ATOM 0 HD11 ILE A 3 10.235 0.772 -0.920 1.00 0.00 H new ATOM 0 HD12 ILE A 3 9.174 2.154 -1.281 1.00 0.00 H new ATOM 0 HD13 ILE A 3 10.696 2.408 -0.393 1.00 0.00 H new ATOM 49 N VAL A 4 6.750 4.173 3.763 1.00 0.00 N ATOM 50 CA VAL A 4 6.231 5.291 4.539 1.00 0.00 C ATOM 51 C VAL A 4 7.362 5.750 5.471 1.00 0.00 C ATOM 52 O VAL A 4 8.332 5.020 5.703 1.00 0.00 O ATOM 53 CB VAL A 4 4.950 4.834 5.293 1.00 0.00 C ATOM 54 CG1 VAL A 4 4.226 5.969 6.033 1.00 0.00 C ATOM 55 CG2 VAL A 4 3.916 4.180 4.356 1.00 0.00 C ATOM 0 H VAL A 4 7.278 3.516 4.338 1.00 0.00 H new ATOM 0 HA VAL A 4 5.933 6.137 3.919 1.00 0.00 H new ATOM 0 HB VAL A 4 5.328 4.113 6.018 1.00 0.00 H new ATOM 0 HG11 VAL A 4 3.343 5.572 6.534 1.00 0.00 H new ATOM 0 HG12 VAL A 4 4.896 6.407 6.772 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.924 6.735 5.318 1.00 0.00 H new ATOM 0 HG21 VAL A 4 3.041 3.879 4.933 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.617 4.894 3.589 1.00 0.00 H new ATOM 0 HG23 VAL A 4 4.357 3.303 3.883 1.00 0.00 H new ATOM 65 N LYS A 5 7.234 6.955 6.023 1.00 0.00 N ATOM 66 CA LYS A 5 8.132 7.528 7.023 1.00 0.00 C ATOM 67 C LYS A 5 7.282 7.756 8.266 1.00 0.00 C ATOM 68 O LYS A 5 6.118 8.143 8.145 1.00 0.00 O ATOM 69 CB LYS A 5 8.685 8.856 6.488 1.00 0.00 C ATOM 70 CG LYS A 5 9.735 9.555 7.372 1.00 0.00 C ATOM 71 CD LYS A 5 11.097 8.845 7.443 1.00 0.00 C ATOM 72 CE LYS A 5 11.727 8.552 6.069 1.00 0.00 C ATOM 73 NZ LYS A 5 12.008 9.781 5.276 1.00 0.00 N ATOM 0 H LYS A 5 6.470 7.584 5.775 1.00 0.00 H new ATOM 0 HA LYS A 5 8.978 6.879 7.249 1.00 0.00 H new ATOM 0 HB2 LYS A 5 9.127 8.674 5.508 1.00 0.00 H new ATOM 0 HB3 LYS A 5 7.850 9.541 6.339 1.00 0.00 H new ATOM 0 HG2 LYS A 5 9.888 10.567 6.998 1.00 0.00 H new ATOM 0 HG3 LYS A 5 9.336 9.646 8.382 1.00 0.00 H new ATOM 0 HD2 LYS A 5 11.785 9.460 8.022 1.00 0.00 H new ATOM 0 HD3 LYS A 5 10.977 7.906 7.983 1.00 0.00 H new ATOM 0 HE2 LYS A 5 12.656 8.001 6.213 1.00 0.00 H new ATOM 0 HE3 LYS A 5 11.058 7.906 5.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 12.431 9.516 4.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 11.121 10.297 5.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 12.669 10.389 5.800 1.00 0.00 H new ATOM 87 N ALA A 6 7.850 7.537 9.444 1.00 0.00 N ATOM 88 CA ALA A 6 7.136 7.660 10.709 1.00 0.00 C ATOM 89 C ALA A 6 8.048 8.210 11.801 1.00 0.00 C ATOM 90 O ALA A 6 9.274 8.217 11.671 1.00 0.00 O ATOM 91 CB ALA A 6 6.578 6.291 11.124 1.00 0.00 C ATOM 0 H ALA A 6 8.828 7.267 9.550 1.00 0.00 H new ATOM 0 HA ALA A 6 6.312 8.360 10.574 1.00 0.00 H new ATOM 0 HB1 ALA A 6 6.045 6.387 12.070 1.00 0.00 H new ATOM 0 HB2 ALA A 6 5.893 5.929 10.357 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.399 5.584 11.240 1.00 0.00 H new ATOM 97 N THR A 7 7.418 8.618 12.897 1.00 0.00 N ATOM 98 CA THR A 7 8.035 9.018 14.147 1.00 0.00 C ATOM 99 C THR A 7 7.270 8.340 15.281 1.00 0.00 C ATOM 100 O THR A 7 6.187 7.787 15.063 1.00 0.00 O ATOM 101 CB THR A 7 7.989 10.549 14.304 1.00 0.00 C ATOM 102 OG1 THR A 7 6.691 11.046 14.017 1.00 0.00 O ATOM 103 CG2 THR A 7 8.989 11.251 13.381 1.00 0.00 C ATOM 0 H THR A 7 6.401 8.680 12.934 1.00 0.00 H new ATOM 0 HA THR A 7 9.083 8.717 14.166 1.00 0.00 H new ATOM 0 HB THR A 7 8.254 10.761 15.340 1.00 0.00 H new ATOM 0 HG1 THR A 7 6.683 12.020 14.124 1.00 0.00 H new ATOM 0 HG21 THR A 7 8.922 12.329 13.525 1.00 0.00 H new ATOM 0 HG22 THR A 7 9.999 10.915 13.616 1.00 0.00 H new ATOM 0 HG23 THR A 7 8.759 11.009 12.344 1.00 0.00 H new ATOM 111 N ASP A 8 7.786 8.432 16.505 1.00 0.00 N ATOM 112 CA ASP A 8 7.192 7.843 17.702 1.00 0.00 C ATOM 113 C ASP A 8 5.722 8.235 17.898 1.00 0.00 C ATOM 114 O ASP A 8 4.933 7.463 18.442 1.00 0.00 O ATOM 115 CB ASP A 8 7.995 8.271 18.935 1.00 0.00 C ATOM 116 CG ASP A 8 7.597 7.432 20.158 1.00 0.00 C ATOM 117 OD1 ASP A 8 7.971 6.238 20.204 1.00 0.00 O ATOM 118 OD2 ASP A 8 6.944 7.971 21.081 1.00 0.00 O ATOM 0 H ASP A 8 8.654 8.933 16.696 1.00 0.00 H new ATOM 0 HA ASP A 8 7.224 6.761 17.572 1.00 0.00 H new ATOM 0 HB2 ASP A 8 9.061 8.155 18.739 1.00 0.00 H new ATOM 0 HB3 ASP A 8 7.821 9.327 19.140 1.00 0.00 H new ATOM 123 N GLN A 9 5.352 9.428 17.415 1.00 0.00 N ATOM 124 CA GLN A 9 4.006 9.984 17.488 1.00 0.00 C ATOM 125 C GLN A 9 2.969 9.149 16.721 1.00 0.00 C ATOM 126 O GLN A 9 1.798 9.144 17.106 1.00 0.00 O ATOM 127 CB GLN A 9 4.017 11.413 16.920 1.00 0.00 C ATOM 128 CG GLN A 9 4.920 12.377 17.707 1.00 0.00 C ATOM 129 CD GLN A 9 4.861 13.789 17.123 1.00 0.00 C ATOM 130 OE1 GLN A 9 5.596 14.131 16.198 1.00 0.00 O ATOM 131 NE2 GLN A 9 3.987 14.643 17.634 1.00 0.00 N ATOM 0 H GLN A 9 6.010 10.051 16.947 1.00 0.00 H new ATOM 0 HA GLN A 9 3.714 9.979 18.538 1.00 0.00 H new ATOM 0 HB2 GLN A 9 4.350 11.381 15.883 1.00 0.00 H new ATOM 0 HB3 GLN A 9 2.999 11.802 16.916 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.610 12.399 18.752 1.00 0.00 H new ATOM 0 HG3 GLN A 9 5.948 12.015 17.687 1.00 0.00 H new ATOM 0 HE21 GLN A 9 3.380 14.354 18.401 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.921 15.590 17.260 1.00 0.00 H new ATOM 140 N SER A 10 3.385 8.448 15.660 1.00 0.00 N ATOM 141 CA SER A 10 2.476 7.800 14.709 1.00 0.00 C ATOM 142 C SER A 10 2.906 6.381 14.322 1.00 0.00 C ATOM 143 O SER A 10 2.144 5.682 13.652 1.00 0.00 O ATOM 144 CB SER A 10 2.350 8.680 13.455 1.00 0.00 C ATOM 145 OG SER A 10 2.020 10.023 13.790 1.00 0.00 O ATOM 0 H SER A 10 4.371 8.314 15.436 1.00 0.00 H new ATOM 0 HA SER A 10 1.511 7.696 15.204 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.289 8.662 12.901 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.584 8.270 12.797 1.00 0.00 H new ATOM 0 HG SER A 10 1.949 10.556 12.971 1.00 0.00 H new ATOM 151 N PHE A 11 4.087 5.926 14.751 1.00 0.00 N ATOM 152 CA PHE A 11 4.634 4.614 14.423 1.00 0.00 C ATOM 153 C PHE A 11 3.638 3.493 14.731 1.00 0.00 C ATOM 154 O PHE A 11 3.433 2.603 13.904 1.00 0.00 O ATOM 155 CB PHE A 11 5.946 4.425 15.197 1.00 0.00 C ATOM 156 CG PHE A 11 6.665 3.134 14.876 1.00 0.00 C ATOM 157 CD1 PHE A 11 7.488 3.064 13.738 1.00 0.00 C ATOM 158 CD2 PHE A 11 6.508 2.002 15.700 1.00 0.00 C ATOM 159 CE1 PHE A 11 8.161 1.873 13.430 1.00 0.00 C ATOM 160 CE2 PHE A 11 7.177 0.807 15.385 1.00 0.00 C ATOM 161 CZ PHE A 11 8.006 0.743 14.252 1.00 0.00 C ATOM 0 H PHE A 11 4.701 6.477 15.351 1.00 0.00 H new ATOM 0 HA PHE A 11 4.831 4.563 13.352 1.00 0.00 H new ATOM 0 HB2 PHE A 11 6.609 5.263 14.980 1.00 0.00 H new ATOM 0 HB3 PHE A 11 5.734 4.455 16.266 1.00 0.00 H new ATOM 0 HD1 PHE A 11 7.602 3.928 13.101 1.00 0.00 H new ATOM 0 HD2 PHE A 11 5.874 2.053 16.573 1.00 0.00 H new ATOM 0 HE1 PHE A 11 8.799 1.824 12.560 1.00 0.00 H new ATOM 0 HE2 PHE A 11 7.054 -0.062 16.014 1.00 0.00 H new ATOM 0 HZ PHE A 11 8.524 -0.174 14.013 1.00 0.00 H new ATOM 171 N SER A 12 2.977 3.553 15.889 1.00 0.00 N ATOM 172 CA SER A 12 2.019 2.541 16.310 1.00 0.00 C ATOM 173 C SER A 12 0.816 2.468 15.367 1.00 0.00 C ATOM 174 O SER A 12 0.342 1.378 15.048 1.00 0.00 O ATOM 175 CB SER A 12 1.577 2.830 17.750 1.00 0.00 C ATOM 176 OG SER A 12 2.700 3.128 18.571 1.00 0.00 O ATOM 0 H SER A 12 3.095 4.311 16.561 1.00 0.00 H new ATOM 0 HA SER A 12 2.505 1.566 16.271 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.880 3.668 17.760 1.00 0.00 H new ATOM 0 HB3 SER A 12 1.045 1.968 18.152 1.00 0.00 H new ATOM 0 HG SER A 12 2.398 3.311 19.485 1.00 0.00 H new ATOM 182 N ALA A 13 0.337 3.617 14.884 1.00 0.00 N ATOM 183 CA ALA A 13 -0.767 3.667 13.942 1.00 0.00 C ATOM 184 C ALA A 13 -0.337 3.082 12.600 1.00 0.00 C ATOM 185 O ALA A 13 -1.062 2.276 12.014 1.00 0.00 O ATOM 186 CB ALA A 13 -1.271 5.107 13.783 1.00 0.00 C ATOM 0 H ALA A 13 0.707 4.533 15.138 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.590 3.066 14.328 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.098 5.127 13.074 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -1.612 5.482 14.748 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.462 5.737 13.414 1.00 0.00 H new ATOM 192 N GLU A 14 0.856 3.451 12.129 1.00 0.00 N ATOM 193 CA GLU A 14 1.368 2.984 10.849 1.00 0.00 C ATOM 194 C GLU A 14 1.561 1.467 10.858 1.00 0.00 C ATOM 195 O GLU A 14 1.294 0.813 9.849 1.00 0.00 O ATOM 196 CB GLU A 14 2.679 3.697 10.467 1.00 0.00 C ATOM 197 CG GLU A 14 2.488 5.163 10.037 1.00 0.00 C ATOM 198 CD GLU A 14 1.519 5.352 8.852 1.00 0.00 C ATOM 199 OE1 GLU A 14 1.325 4.407 8.053 1.00 0.00 O ATOM 200 OE2 GLU A 14 0.941 6.455 8.720 1.00 0.00 O ATOM 0 H GLU A 14 1.488 4.079 12.625 1.00 0.00 H new ATOM 0 HA GLU A 14 0.624 3.232 10.091 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.361 3.664 11.317 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.156 3.149 9.654 1.00 0.00 H new ATOM 0 HG2 GLU A 14 2.119 5.735 10.889 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.458 5.581 9.769 1.00 0.00 H new ATOM 207 N THR A 15 1.972 0.896 11.989 1.00 0.00 N ATOM 208 CA THR A 15 2.251 -0.522 12.129 1.00 0.00 C ATOM 209 C THR A 15 0.998 -1.365 12.405 1.00 0.00 C ATOM 210 O THR A 15 1.105 -2.588 12.512 1.00 0.00 O ATOM 211 CB THR A 15 3.377 -0.719 13.156 1.00 0.00 C ATOM 212 OG1 THR A 15 3.128 -0.034 14.362 1.00 0.00 O ATOM 213 CG2 THR A 15 4.721 -0.229 12.601 1.00 0.00 C ATOM 0 H THR A 15 2.122 1.423 12.849 1.00 0.00 H new ATOM 0 HA THR A 15 2.602 -0.904 11.170 1.00 0.00 H new ATOM 0 HB THR A 15 3.415 -1.790 13.356 1.00 0.00 H new ATOM 0 HG1 THR A 15 3.402 0.902 14.269 1.00 0.00 H new ATOM 0 HG21 THR A 15 5.500 -0.380 13.348 1.00 0.00 H new ATOM 0 HG22 THR A 15 4.969 -0.790 11.700 1.00 0.00 H new ATOM 0 HG23 THR A 15 4.650 0.832 12.360 1.00 0.00 H new ATOM 221 N SER A 16 -0.190 -0.752 12.461 1.00 0.00 N ATOM 222 CA SER A 16 -1.444 -1.423 12.786 1.00 0.00 C ATOM 223 C SER A 16 -2.284 -1.701 11.531 1.00 0.00 C ATOM 224 O SER A 16 -3.514 -1.710 11.587 1.00 0.00 O ATOM 225 CB SER A 16 -2.203 -0.617 13.851 1.00 0.00 C ATOM 226 OG SER A 16 -1.470 -0.553 15.060 1.00 0.00 O ATOM 0 H SER A 16 -0.304 0.245 12.277 1.00 0.00 H new ATOM 0 HA SER A 16 -1.223 -2.403 13.209 1.00 0.00 H new ATOM 0 HB2 SER A 16 -2.391 0.391 13.483 1.00 0.00 H new ATOM 0 HB3 SER A 16 -3.174 -1.076 14.035 1.00 0.00 H new ATOM 0 HG SER A 16 -0.630 -0.071 14.908 1.00 0.00 H new ATOM 232 N GLU A 17 -1.625 -1.924 10.389 1.00 0.00 N ATOM 233 CA GLU A 17 -2.275 -2.154 9.098 1.00 0.00 C ATOM 234 C GLU A 17 -1.657 -3.371 8.393 1.00 0.00 C ATOM 235 O GLU A 17 -1.137 -3.271 7.279 1.00 0.00 O ATOM 236 CB GLU A 17 -2.272 -0.870 8.243 1.00 0.00 C ATOM 237 CG GLU A 17 -3.112 0.256 8.867 1.00 0.00 C ATOM 238 CD GLU A 17 -3.365 1.399 7.873 1.00 0.00 C ATOM 239 OE1 GLU A 17 -2.392 2.063 7.454 1.00 0.00 O ATOM 240 OE2 GLU A 17 -4.538 1.651 7.510 1.00 0.00 O ATOM 0 H GLU A 17 -0.607 -1.950 10.337 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.325 -2.398 9.260 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.246 -0.525 8.115 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.658 -1.098 7.249 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.066 -0.148 9.206 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.600 0.646 9.747 1.00 0.00 H new ATOM 247 N GLY A 18 -1.697 -4.529 9.061 1.00 0.00 N ATOM 248 CA GLY A 18 -1.264 -5.807 8.504 1.00 0.00 C ATOM 249 C GLY A 18 0.147 -6.129 8.971 1.00 0.00 C ATOM 250 O GLY A 18 0.556 -5.702 10.056 1.00 0.00 O ATOM 0 H GLY A 18 -2.038 -4.601 10.020 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.947 -6.598 8.814 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -1.295 -5.767 7.415 1.00 0.00 H new ATOM 254 N VAL A 19 0.877 -6.914 8.178 1.00 0.00 N ATOM 255 CA VAL A 19 2.313 -7.084 8.373 1.00 0.00 C ATOM 256 C VAL A 19 2.950 -5.766 7.934 1.00 0.00 C ATOM 257 O VAL A 19 2.614 -5.223 6.876 1.00 0.00 O ATOM 258 CB VAL A 19 2.871 -8.277 7.564 1.00 0.00 C ATOM 259 CG1 VAL A 19 4.378 -8.477 7.818 1.00 0.00 C ATOM 260 CG2 VAL A 19 2.150 -9.585 7.925 1.00 0.00 C ATOM 0 H VAL A 19 0.494 -7.442 7.394 1.00 0.00 H new ATOM 0 HA VAL A 19 2.541 -7.312 9.414 1.00 0.00 H new ATOM 0 HB VAL A 19 2.703 -8.039 6.514 1.00 0.00 H new ATOM 0 HG11 VAL A 19 4.736 -9.324 7.233 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.919 -7.578 7.523 1.00 0.00 H new ATOM 0 HG13 VAL A 19 4.546 -8.671 8.877 1.00 0.00 H new ATOM 0 HG21 VAL A 19 2.566 -10.404 7.338 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.285 -9.794 8.986 1.00 0.00 H new ATOM 0 HG23 VAL A 19 1.087 -9.487 7.707 1.00 0.00 H new ATOM 270 N VAL A 20 3.887 -5.263 8.728 1.00 0.00 N ATOM 271 CA VAL A 20 4.606 -4.032 8.468 1.00 0.00 C ATOM 272 C VAL A 20 6.065 -4.318 8.816 1.00 0.00 C ATOM 273 O VAL A 20 6.342 -5.051 9.765 1.00 0.00 O ATOM 274 CB VAL A 20 3.983 -2.881 9.290 1.00 0.00 C ATOM 275 CG1 VAL A 20 4.668 -1.543 8.976 1.00 0.00 C ATOM 276 CG2 VAL A 20 2.472 -2.742 9.004 1.00 0.00 C ATOM 0 H VAL A 20 4.173 -5.718 9.595 1.00 0.00 H new ATOM 0 HA VAL A 20 4.544 -3.709 7.429 1.00 0.00 H new ATOM 0 HB VAL A 20 4.131 -3.128 10.341 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.209 -0.751 9.569 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.728 -1.611 9.220 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.553 -1.316 7.916 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.063 -1.924 9.597 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.320 -2.534 7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.965 -3.670 9.268 1.00 0.00 H new ATOM 286 N LEU A 21 7.003 -3.763 8.053 1.00 0.00 N ATOM 287 CA LEU A 21 8.430 -3.990 8.238 1.00 0.00 C ATOM 288 C LEU A 21 9.060 -2.611 8.382 1.00 0.00 C ATOM 289 O LEU A 21 9.182 -1.846 7.425 1.00 0.00 O ATOM 290 CB LEU A 21 8.963 -4.861 7.089 1.00 0.00 C ATOM 291 CG LEU A 21 10.369 -5.449 7.314 1.00 0.00 C ATOM 292 CD1 LEU A 21 10.714 -6.381 6.146 1.00 0.00 C ATOM 293 CD2 LEU A 21 11.473 -4.400 7.457 1.00 0.00 C ATOM 0 H LEU A 21 6.788 -3.135 7.279 1.00 0.00 H new ATOM 0 HA LEU A 21 8.682 -4.558 9.134 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.265 -5.682 6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.977 -4.264 6.177 1.00 0.00 H new ATOM 0 HG LEU A 21 10.329 -5.985 8.262 1.00 0.00 H new ATOM 0 HD11 LEU A 21 11.708 -6.802 6.298 1.00 0.00 H new ATOM 0 HD12 LEU A 21 9.983 -7.188 6.096 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.697 -5.817 5.213 1.00 0.00 H new ATOM 0 HD21 LEU A 21 12.430 -4.898 7.612 1.00 0.00 H new ATOM 0 HD22 LEU A 21 11.521 -3.796 6.551 1.00 0.00 H new ATOM 0 HD23 LEU A 21 11.256 -3.757 8.310 1.00 0.00 H new ATOM 305 N ALA A 22 9.350 -2.246 9.624 1.00 0.00 N ATOM 306 CA ALA A 22 9.941 -0.973 9.955 1.00 0.00 C ATOM 307 C ALA A 22 11.450 -1.051 9.753 1.00 0.00 C ATOM 308 O ALA A 22 12.062 -2.070 10.071 1.00 0.00 O ATOM 309 CB ALA A 22 9.622 -0.636 11.405 1.00 0.00 C ATOM 0 H ALA A 22 9.176 -2.840 10.435 1.00 0.00 H new ATOM 0 HA ALA A 22 9.536 -0.194 9.309 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.066 0.326 11.661 1.00 0.00 H new ATOM 0 HB2 ALA A 22 8.541 -0.583 11.537 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.030 -1.409 12.056 1.00 0.00 H new ATOM 315 N ASP A 23 12.045 0.048 9.303 1.00 0.00 N ATOM 316 CA ASP A 23 13.463 0.193 9.010 1.00 0.00 C ATOM 317 C ASP A 23 13.990 1.323 9.886 1.00 0.00 C ATOM 318 O ASP A 23 13.838 2.508 9.578 1.00 0.00 O ATOM 319 CB ASP A 23 13.685 0.458 7.516 1.00 0.00 C ATOM 320 CG ASP A 23 15.138 0.868 7.213 1.00 0.00 C ATOM 321 OD1 ASP A 23 16.072 0.264 7.788 1.00 0.00 O ATOM 322 OD2 ASP A 23 15.338 1.764 6.362 1.00 0.00 O ATOM 0 H ASP A 23 11.522 0.906 9.124 1.00 0.00 H new ATOM 0 HA ASP A 23 14.008 -0.724 9.233 1.00 0.00 H new ATOM 0 HB2 ASP A 23 13.435 -0.438 6.948 1.00 0.00 H new ATOM 0 HB3 ASP A 23 13.009 1.246 7.183 1.00 0.00 H new ATOM 327 N PHE A 24 14.515 0.932 11.041 1.00 0.00 N ATOM 328 CA PHE A 24 15.183 1.805 11.984 1.00 0.00 C ATOM 329 C PHE A 24 16.523 2.147 11.350 1.00 0.00 C ATOM 330 O PHE A 24 17.379 1.269 11.170 1.00 0.00 O ATOM 331 CB PHE A 24 15.312 1.114 13.353 1.00 0.00 C ATOM 332 CG PHE A 24 13.996 1.046 14.117 1.00 0.00 C ATOM 333 CD1 PHE A 24 12.939 0.238 13.651 1.00 0.00 C ATOM 334 CD2 PHE A 24 13.798 1.845 15.260 1.00 0.00 C ATOM 335 CE1 PHE A 24 11.686 0.284 14.280 1.00 0.00 C ATOM 336 CE2 PHE A 24 12.539 1.897 15.882 1.00 0.00 C ATOM 337 CZ PHE A 24 11.475 1.136 15.374 1.00 0.00 C ATOM 0 H PHE A 24 14.483 -0.039 11.353 1.00 0.00 H new ATOM 0 HA PHE A 24 14.626 2.721 12.181 1.00 0.00 H new ATOM 0 HB2 PHE A 24 15.693 0.103 13.208 1.00 0.00 H new ATOM 0 HB3 PHE A 24 16.047 1.649 13.955 1.00 0.00 H new ATOM 0 HD1 PHE A 24 13.094 -0.418 12.807 1.00 0.00 H new ATOM 0 HD2 PHE A 24 14.619 2.421 15.661 1.00 0.00 H new ATOM 0 HE1 PHE A 24 10.881 -0.339 13.920 1.00 0.00 H new ATOM 0 HE2 PHE A 24 12.390 2.522 16.750 1.00 0.00 H new ATOM 0 HZ PHE A 24 10.496 1.206 15.824 1.00 0.00 H new ATOM 347 N TRP A 25 16.666 3.415 10.967 1.00 0.00 N ATOM 348 CA TRP A 25 17.776 3.935 10.190 1.00 0.00 C ATOM 349 C TRP A 25 18.039 5.376 10.638 1.00 0.00 C ATOM 350 O TRP A 25 17.396 5.858 11.568 1.00 0.00 O ATOM 351 CB TRP A 25 17.470 3.782 8.680 1.00 0.00 C ATOM 352 CG TRP A 25 17.364 5.024 7.839 1.00 0.00 C ATOM 353 CD1 TRP A 25 18.309 5.483 6.987 1.00 0.00 C ATOM 354 CD2 TRP A 25 16.329 6.054 7.859 1.00 0.00 C ATOM 355 NE1 TRP A 25 17.892 6.674 6.431 1.00 0.00 N ATOM 356 CE2 TRP A 25 16.727 7.121 7.003 1.00 0.00 C ATOM 357 CE3 TRP A 25 15.124 6.226 8.567 1.00 0.00 C ATOM 358 CZ2 TRP A 25 16.000 8.312 6.888 1.00 0.00 C ATOM 359 CZ3 TRP A 25 14.378 7.416 8.459 1.00 0.00 C ATOM 360 CH2 TRP A 25 14.830 8.470 7.644 1.00 0.00 C ATOM 0 H TRP A 25 15.980 4.133 11.202 1.00 0.00 H new ATOM 0 HA TRP A 25 18.694 3.373 10.361 1.00 0.00 H new ATOM 0 HB2 TRP A 25 18.248 3.154 8.246 1.00 0.00 H new ATOM 0 HB3 TRP A 25 16.531 3.237 8.586 1.00 0.00 H new ATOM 0 HD1 TRP A 25 19.247 4.992 6.775 1.00 0.00 H new ATOM 0 HE1 TRP A 25 18.388 7.163 5.686 1.00 0.00 H new ATOM 0 HE3 TRP A 25 14.765 5.431 9.204 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 16.336 9.097 6.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 13.452 7.520 9.006 1.00 0.00 H new ATOM 0 HH2 TRP A 25 14.278 9.397 7.601 1.00 0.00 H new ATOM 371 N ALA A 26 18.991 6.061 10.011 1.00 0.00 N ATOM 372 CA ALA A 26 19.197 7.495 10.140 1.00 0.00 C ATOM 373 C ALA A 26 19.916 7.944 8.868 1.00 0.00 C ATOM 374 O ALA A 26 20.695 7.160 8.320 1.00 0.00 O ATOM 375 CB ALA A 26 20.055 7.794 11.370 1.00 0.00 C ATOM 0 H ALA A 26 19.659 5.617 9.381 1.00 0.00 H new ATOM 0 HA ALA A 26 18.251 8.023 10.264 1.00 0.00 H new ATOM 0 HB1 ALA A 26 20.203 8.870 11.457 1.00 0.00 H new ATOM 0 HB2 ALA A 26 19.552 7.423 12.263 1.00 0.00 H new ATOM 0 HB3 ALA A 26 21.022 7.302 11.267 1.00 0.00 H new ATOM 381 N PRO A 27 19.730 9.178 8.380 1.00 0.00 N ATOM 382 CA PRO A 27 20.344 9.599 7.128 1.00 0.00 C ATOM 383 C PRO A 27 21.872 9.735 7.190 1.00 0.00 C ATOM 384 O PRO A 27 22.498 9.792 6.130 1.00 0.00 O ATOM 385 CB PRO A 27 19.632 10.890 6.724 1.00 0.00 C ATOM 386 CG PRO A 27 19.063 11.434 8.036 1.00 0.00 C ATOM 387 CD PRO A 27 18.805 10.184 8.878 1.00 0.00 C ATOM 0 HA PRO A 27 20.215 8.829 6.368 1.00 0.00 H new ATOM 0 HB2 PRO A 27 20.322 11.598 6.266 1.00 0.00 H new ATOM 0 HB3 PRO A 27 18.843 10.698 5.997 1.00 0.00 H new ATOM 0 HG2 PRO A 27 19.766 12.107 8.527 1.00 0.00 H new ATOM 0 HG3 PRO A 27 18.146 11.998 7.869 1.00 0.00 H new ATOM 0 HD2 PRO A 27 18.975 10.383 9.936 1.00 0.00 H new ATOM 0 HD3 PRO A 27 17.772 9.850 8.778 1.00 0.00 H new ATOM 395 N TRP A 28 22.503 9.723 8.372 1.00 0.00 N ATOM 396 CA TRP A 28 23.963 9.630 8.460 1.00 0.00 C ATOM 397 C TRP A 28 24.481 8.237 8.066 1.00 0.00 C ATOM 398 O TRP A 28 25.669 8.090 7.770 1.00 0.00 O ATOM 399 CB TRP A 28 24.454 10.008 9.867 1.00 0.00 C ATOM 400 CG TRP A 28 24.098 9.072 10.988 1.00 0.00 C ATOM 401 CD1 TRP A 28 23.064 9.234 11.841 1.00 0.00 C ATOM 402 CD2 TRP A 28 24.767 7.841 11.420 1.00 0.00 C ATOM 403 NE1 TRP A 28 23.046 8.211 12.765 1.00 0.00 N ATOM 404 CE2 TRP A 28 24.055 7.303 12.536 1.00 0.00 C ATOM 405 CE3 TRP A 28 25.900 7.119 10.984 1.00 0.00 C ATOM 406 CZ2 TRP A 28 24.429 6.104 13.163 1.00 0.00 C ATOM 407 CZ3 TRP A 28 26.283 5.913 11.601 1.00 0.00 C ATOM 408 CH2 TRP A 28 25.547 5.401 12.685 1.00 0.00 C ATOM 0 H TRP A 28 22.028 9.776 9.273 1.00 0.00 H new ATOM 0 HA TRP A 28 24.370 10.344 7.744 1.00 0.00 H new ATOM 0 HB2 TRP A 28 25.540 10.099 9.834 1.00 0.00 H new ATOM 0 HB3 TRP A 28 24.058 10.994 10.110 1.00 0.00 H new ATOM 0 HD1 TRP A 28 22.354 10.047 11.805 1.00 0.00 H new ATOM 0 HE1 TRP A 28 22.369 8.136 13.524 1.00 0.00 H new ATOM 0 HE3 TRP A 28 26.485 7.500 10.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 23.864 5.727 14.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 27.148 5.377 11.240 1.00 0.00 H new ATOM 0 HH2 TRP A 28 25.841 4.471 13.148 1.00 0.00 H new ATOM 419 N CYS A 29 23.614 7.217 8.097 1.00 0.00 N ATOM 420 CA CYS A 29 23.967 5.817 7.918 1.00 0.00 C ATOM 421 C CYS A 29 24.606 5.571 6.543 1.00 0.00 C ATOM 422 O CYS A 29 24.284 6.256 5.570 1.00 0.00 O ATOM 423 CB CYS A 29 22.692 4.982 8.085 1.00 0.00 C ATOM 424 SG CYS A 29 22.915 3.190 8.191 1.00 0.00 S ATOM 0 H CYS A 29 22.616 7.356 8.253 1.00 0.00 H new ATOM 0 HA CYS A 29 24.707 5.527 8.664 1.00 0.00 H new ATOM 0 HB2 CYS A 29 22.180 5.317 8.987 1.00 0.00 H new ATOM 0 HB3 CYS A 29 22.031 5.195 7.245 1.00 0.00 H new ATOM 429 N GLY A 30 25.443 4.538 6.450 1.00 0.00 N ATOM 430 CA GLY A 30 26.007 4.038 5.199 1.00 0.00 C ATOM 431 C GLY A 30 25.296 2.764 4.728 1.00 0.00 C ATOM 432 O GLY A 30 24.659 2.798 3.675 1.00 0.00 O ATOM 0 H GLY A 30 25.755 4.012 7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 30 25.926 4.806 4.430 1.00 0.00 H new ATOM 0 HA3 GLY A 30 27.069 3.834 5.334 1.00 0.00 H new ATOM 436 N PRO A 31 25.308 1.653 5.491 1.00 0.00 N ATOM 437 CA PRO A 31 24.743 0.384 5.029 1.00 0.00 C ATOM 438 C PRO A 31 23.220 0.440 4.863 1.00 0.00 C ATOM 439 O PRO A 31 22.670 -0.261 4.015 1.00 0.00 O ATOM 440 CB PRO A 31 25.194 -0.676 6.038 1.00 0.00 C ATOM 441 CG PRO A 31 25.550 0.115 7.297 1.00 0.00 C ATOM 442 CD PRO A 31 25.964 1.490 6.779 1.00 0.00 C ATOM 0 HA PRO A 31 25.104 0.140 4.030 1.00 0.00 H new ATOM 0 HB2 PRO A 31 24.402 -1.398 6.235 1.00 0.00 H new ATOM 0 HB3 PRO A 31 26.052 -1.237 5.667 1.00 0.00 H new ATOM 0 HG2 PRO A 31 24.700 0.186 7.975 1.00 0.00 H new ATOM 0 HG3 PRO A 31 26.360 -0.361 7.850 1.00 0.00 H new ATOM 0 HD2 PRO A 31 25.661 2.275 7.472 1.00 0.00 H new ATOM 0 HD3 PRO A 31 27.047 1.557 6.676 1.00 0.00 H new ATOM 450 N CYS A 32 22.526 1.325 5.588 1.00 0.00 N ATOM 451 CA CYS A 32 21.100 1.560 5.378 1.00 0.00 C ATOM 452 C CYS A 32 20.816 1.962 3.922 1.00 0.00 C ATOM 453 O CYS A 32 19.799 1.569 3.352 1.00 0.00 O ATOM 454 CB CYS A 32 20.579 2.650 6.320 1.00 0.00 C ATOM 455 SG CYS A 32 21.004 2.507 8.081 1.00 0.00 S ATOM 0 H CYS A 32 22.936 1.892 6.330 1.00 0.00 H new ATOM 0 HA CYS A 32 20.581 0.626 5.595 1.00 0.00 H new ATOM 0 HB2 CYS A 32 20.949 3.610 5.961 1.00 0.00 H new ATOM 0 HB3 CYS A 32 19.492 2.676 6.237 1.00 0.00 H new ATOM 460 N LYS A 33 21.724 2.718 3.293 1.00 0.00 N ATOM 461 CA LYS A 33 21.559 3.185 1.922 1.00 0.00 C ATOM 462 C LYS A 33 21.657 2.029 0.926 1.00 0.00 C ATOM 463 O LYS A 33 21.080 2.129 -0.152 1.00 0.00 O ATOM 464 CB LYS A 33 22.602 4.268 1.579 1.00 0.00 C ATOM 465 CG LYS A 33 22.792 5.374 2.634 1.00 0.00 C ATOM 466 CD LYS A 33 21.535 6.211 2.925 1.00 0.00 C ATOM 467 CE LYS A 33 21.738 7.154 4.125 1.00 0.00 C ATOM 468 NZ LYS A 33 22.874 8.090 3.942 1.00 0.00 N ATOM 0 H LYS A 33 22.596 3.021 3.727 1.00 0.00 H new ATOM 0 HA LYS A 33 20.563 3.621 1.844 1.00 0.00 H new ATOM 0 HB2 LYS A 33 23.563 3.781 1.414 1.00 0.00 H new ATOM 0 HB3 LYS A 33 22.316 4.736 0.637 1.00 0.00 H new ATOM 0 HG2 LYS A 33 23.129 4.916 3.564 1.00 0.00 H new ATOM 0 HG3 LYS A 33 23.587 6.042 2.301 1.00 0.00 H new ATOM 0 HD2 LYS A 33 21.277 6.797 2.043 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.694 5.546 3.124 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.825 7.727 4.288 1.00 0.00 H new ATOM 0 HE3 LYS A 33 21.906 6.559 5.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.756 8.907 4.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 23.765 7.603 4.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 22.898 8.418 2.955 1.00 0.00 H new ATOM 482 N MET A 34 22.364 0.941 1.262 1.00 0.00 N ATOM 483 CA MET A 34 22.562 -0.178 0.349 1.00 0.00 C ATOM 484 C MET A 34 21.401 -1.169 0.421 1.00 0.00 C ATOM 485 O MET A 34 21.053 -1.761 -0.597 1.00 0.00 O ATOM 486 CB MET A 34 23.947 -0.816 0.552 1.00 0.00 C ATOM 487 CG MET A 34 24.044 -1.996 1.526 1.00 0.00 C ATOM 488 SD MET A 34 25.749 -2.385 2.003 1.00 0.00 S ATOM 489 CE MET A 34 25.435 -3.658 3.252 1.00 0.00 C ATOM 0 H MET A 34 22.810 0.818 2.171 1.00 0.00 H new ATOM 0 HA MET A 34 22.556 0.198 -0.674 1.00 0.00 H new ATOM 0 HB2 MET A 34 24.309 -1.151 -0.420 1.00 0.00 H new ATOM 0 HB3 MET A 34 24.629 -0.038 0.896 1.00 0.00 H new ATOM 0 HG2 MET A 34 23.465 -1.769 2.421 1.00 0.00 H new ATOM 0 HG3 MET A 34 23.591 -2.876 1.068 1.00 0.00 H new ATOM 0 HE1 MET A 34 26.374 -3.937 3.731 1.00 0.00 H new ATOM 0 HE2 MET A 34 24.746 -3.270 4.002 1.00 0.00 H new ATOM 0 HE3 MET A 34 24.996 -4.535 2.776 1.00 0.00 H new ATOM 499 N ILE A 35 20.764 -1.321 1.589 1.00 0.00 N ATOM 500 CA ILE A 35 19.517 -2.079 1.707 1.00 0.00 C ATOM 501 C ILE A 35 18.312 -1.266 1.203 1.00 0.00 C ATOM 502 O ILE A 35 17.343 -1.869 0.757 1.00 0.00 O ATOM 503 CB ILE A 35 19.328 -2.668 3.129 1.00 0.00 C ATOM 504 CG1 ILE A 35 18.187 -3.714 3.143 1.00 0.00 C ATOM 505 CG2 ILE A 35 19.130 -1.576 4.189 1.00 0.00 C ATOM 506 CD1 ILE A 35 18.050 -4.491 4.456 1.00 0.00 C ATOM 0 H ILE A 35 21.096 -0.926 2.469 1.00 0.00 H new ATOM 0 HA ILE A 35 19.586 -2.944 1.047 1.00 0.00 H new ATOM 0 HB ILE A 35 20.250 -3.183 3.398 1.00 0.00 H new ATOM 0 HG12 ILE A 35 17.245 -3.207 2.936 1.00 0.00 H new ATOM 0 HG13 ILE A 35 18.352 -4.423 2.332 1.00 0.00 H new ATOM 0 HG21 ILE A 35 19.002 -2.038 5.168 1.00 0.00 H new ATOM 0 HG22 ILE A 35 20.003 -0.924 4.207 1.00 0.00 H new ATOM 0 HG23 ILE A 35 18.244 -0.989 3.946 1.00 0.00 H new ATOM 0 HD11 ILE A 35 17.227 -5.200 4.375 1.00 0.00 H new ATOM 0 HD12 ILE A 35 18.975 -5.031 4.658 1.00 0.00 H new ATOM 0 HD13 ILE A 35 17.851 -3.796 5.271 1.00 0.00 H new ATOM 518 N ALA A 36 18.348 0.073 1.209 1.00 0.00 N ATOM 519 CA ALA A 36 17.232 0.906 0.748 1.00 0.00 C ATOM 520 C ALA A 36 16.672 0.512 -0.639 1.00 0.00 C ATOM 521 O ALA A 36 15.458 0.313 -0.732 1.00 0.00 O ATOM 522 CB ALA A 36 17.609 2.391 0.807 1.00 0.00 C ATOM 0 H ALA A 36 19.153 0.609 1.534 1.00 0.00 H new ATOM 0 HA ALA A 36 16.411 0.720 1.441 1.00 0.00 H new ATOM 0 HB1 ALA A 36 16.769 2.994 0.461 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.853 2.664 1.834 1.00 0.00 H new ATOM 0 HB3 ALA A 36 18.473 2.573 0.168 1.00 0.00 H new ATOM 528 N PRO A 37 17.474 0.325 -1.708 1.00 0.00 N ATOM 529 CA PRO A 37 16.932 -0.123 -2.988 1.00 0.00 C ATOM 530 C PRO A 37 16.380 -1.550 -2.913 1.00 0.00 C ATOM 531 O PRO A 37 15.433 -1.877 -3.624 1.00 0.00 O ATOM 532 CB PRO A 37 18.072 0.005 -4.004 1.00 0.00 C ATOM 533 CG PRO A 37 19.331 -0.063 -3.144 1.00 0.00 C ATOM 534 CD PRO A 37 18.893 0.611 -1.846 1.00 0.00 C ATOM 0 HA PRO A 37 16.080 0.488 -3.284 1.00 0.00 H new ATOM 0 HB2 PRO A 37 18.045 -0.799 -4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 37 18.014 0.943 -4.555 1.00 0.00 H new ATOM 0 HG2 PRO A 37 19.651 -1.091 -2.977 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.167 0.460 -3.609 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.454 0.223 -0.996 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.073 1.685 -1.884 1.00 0.00 H new ATOM 542 N VAL A 38 16.920 -2.395 -2.034 1.00 0.00 N ATOM 543 CA VAL A 38 16.397 -3.732 -1.801 1.00 0.00 C ATOM 544 C VAL A 38 15.016 -3.635 -1.133 1.00 0.00 C ATOM 545 O VAL A 38 14.130 -4.411 -1.481 1.00 0.00 O ATOM 546 CB VAL A 38 17.390 -4.586 -0.984 1.00 0.00 C ATOM 547 CG1 VAL A 38 17.019 -6.069 -1.077 1.00 0.00 C ATOM 548 CG2 VAL A 38 18.843 -4.452 -1.467 1.00 0.00 C ATOM 0 H VAL A 38 17.735 -2.166 -1.464 1.00 0.00 H new ATOM 0 HA VAL A 38 16.273 -4.242 -2.756 1.00 0.00 H new ATOM 0 HB VAL A 38 17.322 -4.215 0.039 1.00 0.00 H new ATOM 0 HG11 VAL A 38 17.728 -6.659 -0.496 1.00 0.00 H new ATOM 0 HG12 VAL A 38 16.014 -6.218 -0.682 1.00 0.00 H new ATOM 0 HG13 VAL A 38 17.051 -6.387 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 38 19.490 -5.077 -0.852 1.00 0.00 H new ATOM 0 HG22 VAL A 38 18.912 -4.772 -2.507 1.00 0.00 H new ATOM 0 HG23 VAL A 38 19.159 -3.412 -1.386 1.00 0.00 H new ATOM 558 N LEU A 39 14.789 -2.676 -0.225 1.00 0.00 N ATOM 559 CA LEU A 39 13.464 -2.409 0.326 1.00 0.00 C ATOM 560 C LEU A 39 12.518 -1.864 -0.738 1.00 0.00 C ATOM 561 O LEU A 39 11.340 -2.202 -0.707 1.00 0.00 O ATOM 562 CB LEU A 39 13.522 -1.443 1.522 1.00 0.00 C ATOM 563 CG LEU A 39 14.223 -2.038 2.755 1.00 0.00 C ATOM 564 CD1 LEU A 39 14.426 -0.951 3.814 1.00 0.00 C ATOM 565 CD2 LEU A 39 13.441 -3.211 3.365 1.00 0.00 C ATOM 0 H LEU A 39 15.520 -2.068 0.144 1.00 0.00 H new ATOM 0 HA LEU A 39 13.077 -3.364 0.681 1.00 0.00 H new ATOM 0 HB2 LEU A 39 14.043 -0.534 1.220 1.00 0.00 H new ATOM 0 HB3 LEU A 39 12.507 -1.153 1.795 1.00 0.00 H new ATOM 0 HG LEU A 39 15.187 -2.424 2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.923 -1.379 4.684 1.00 0.00 H new ATOM 0 HD12 LEU A 39 15.042 -0.152 3.402 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.458 -0.547 4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 39 13.978 -3.595 4.232 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.453 -2.869 3.673 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.336 -4.003 2.624 1.00 0.00 H new ATOM 577 N GLU A 40 12.994 -1.064 -1.695 1.00 0.00 N ATOM 578 CA GLU A 40 12.165 -0.671 -2.833 1.00 0.00 C ATOM 579 C GLU A 40 11.773 -1.896 -3.667 1.00 0.00 C ATOM 580 O GLU A 40 10.621 -2.028 -4.085 1.00 0.00 O ATOM 581 CB GLU A 40 12.842 0.408 -3.693 1.00 0.00 C ATOM 582 CG GLU A 40 12.931 1.757 -2.970 1.00 0.00 C ATOM 583 CD GLU A 40 13.540 2.845 -3.874 1.00 0.00 C ATOM 584 OE1 GLU A 40 12.791 3.490 -4.644 1.00 0.00 O ATOM 585 OE2 GLU A 40 14.766 3.084 -3.814 1.00 0.00 O ATOM 0 H GLU A 40 13.939 -0.680 -1.704 1.00 0.00 H new ATOM 0 HA GLU A 40 11.252 -0.226 -2.438 1.00 0.00 H new ATOM 0 HB2 GLU A 40 13.844 0.077 -3.965 1.00 0.00 H new ATOM 0 HB3 GLU A 40 12.285 0.532 -4.622 1.00 0.00 H new ATOM 0 HG2 GLU A 40 11.936 2.065 -2.649 1.00 0.00 H new ATOM 0 HG3 GLU A 40 13.537 1.649 -2.070 1.00 0.00 H new ATOM 592 N GLU A 41 12.704 -2.817 -3.906 1.00 0.00 N ATOM 593 CA GLU A 41 12.410 -4.058 -4.610 1.00 0.00 C ATOM 594 C GLU A 41 11.423 -4.908 -3.805 1.00 0.00 C ATOM 595 O GLU A 41 10.492 -5.467 -4.379 1.00 0.00 O ATOM 596 CB GLU A 41 13.704 -4.817 -4.943 1.00 0.00 C ATOM 597 CG GLU A 41 14.482 -4.125 -6.072 1.00 0.00 C ATOM 598 CD GLU A 41 15.804 -4.844 -6.382 1.00 0.00 C ATOM 599 OE1 GLU A 41 15.794 -5.782 -7.213 1.00 0.00 O ATOM 600 OE2 GLU A 41 16.861 -4.476 -5.823 1.00 0.00 O ATOM 0 H GLU A 41 13.678 -2.723 -3.618 1.00 0.00 H new ATOM 0 HA GLU A 41 11.931 -3.822 -5.560 1.00 0.00 H new ATOM 0 HB2 GLU A 41 14.330 -4.881 -4.053 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.463 -5.839 -5.237 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.866 -4.094 -6.971 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.688 -3.092 -5.791 1.00 0.00 H new ATOM 607 N LEU A 42 11.567 -4.953 -2.478 1.00 0.00 N ATOM 608 CA LEU A 42 10.647 -5.652 -1.589 1.00 0.00 C ATOM 609 C LEU A 42 9.254 -5.033 -1.679 1.00 0.00 C ATOM 610 O LEU A 42 8.264 -5.757 -1.760 1.00 0.00 O ATOM 611 CB LEU A 42 11.165 -5.615 -0.137 1.00 0.00 C ATOM 612 CG LEU A 42 10.298 -6.437 0.836 1.00 0.00 C ATOM 613 CD1 LEU A 42 10.370 -7.935 0.520 1.00 0.00 C ATOM 614 CD2 LEU A 42 10.759 -6.180 2.273 1.00 0.00 C ATOM 0 H LEU A 42 12.337 -4.498 -1.988 1.00 0.00 H new ATOM 0 HA LEU A 42 10.584 -6.694 -1.902 1.00 0.00 H new ATOM 0 HB2 LEU A 42 12.187 -5.994 -0.112 1.00 0.00 H new ATOM 0 HB3 LEU A 42 11.201 -4.580 0.203 1.00 0.00 H new ATOM 0 HG LEU A 42 9.261 -6.123 0.721 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.747 -8.486 1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.012 -8.110 -0.495 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.402 -8.276 0.605 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.146 -6.761 2.961 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.803 -6.476 2.379 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.657 -5.120 2.504 1.00 0.00 H new ATOM 626 N ASP A 43 9.163 -3.702 -1.700 1.00 0.00 N ATOM 627 CA ASP A 43 7.900 -2.985 -1.818 1.00 0.00 C ATOM 628 C ASP A 43 7.191 -3.349 -3.114 1.00 0.00 C ATOM 629 O ASP A 43 5.989 -3.601 -3.129 1.00 0.00 O ATOM 630 CB ASP A 43 8.123 -1.472 -1.795 1.00 0.00 C ATOM 631 CG ASP A 43 6.772 -0.754 -1.711 1.00 0.00 C ATOM 632 OD1 ASP A 43 6.083 -0.915 -0.680 1.00 0.00 O ATOM 633 OD2 ASP A 43 6.416 -0.017 -2.658 1.00 0.00 O ATOM 0 H ASP A 43 9.975 -3.088 -1.635 1.00 0.00 H new ATOM 0 HA ASP A 43 7.284 -3.275 -0.967 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.745 -1.199 -0.942 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.657 -1.159 -2.692 1.00 0.00 H new ATOM 638 N GLN A 44 7.955 -3.432 -4.202 1.00 0.00 N ATOM 639 CA GLN A 44 7.433 -3.757 -5.521 1.00 0.00 C ATOM 640 C GLN A 44 7.020 -5.236 -5.643 1.00 0.00 C ATOM 641 O GLN A 44 6.351 -5.600 -6.611 1.00 0.00 O ATOM 642 CB GLN A 44 8.463 -3.337 -6.579 1.00 0.00 C ATOM 643 CG GLN A 44 8.578 -1.802 -6.646 1.00 0.00 C ATOM 644 CD GLN A 44 9.784 -1.377 -7.481 1.00 0.00 C ATOM 645 OE1 GLN A 44 9.685 -1.120 -8.679 1.00 0.00 O ATOM 646 NE2 GLN A 44 10.950 -1.304 -6.861 1.00 0.00 N ATOM 0 H GLN A 44 8.963 -3.273 -4.189 1.00 0.00 H new ATOM 0 HA GLN A 44 6.513 -3.197 -5.688 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.435 -3.770 -6.340 1.00 0.00 H new ATOM 0 HB3 GLN A 44 8.171 -3.728 -7.554 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.668 -1.385 -7.077 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.668 -1.397 -5.638 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.013 -1.521 -5.866 1.00 0.00 H new ATOM 0 HE22 GLN A 44 11.786 -1.031 -7.378 1.00 0.00 H new ATOM 655 N GLU A 45 7.370 -6.083 -4.669 1.00 0.00 N ATOM 656 CA GLU A 45 7.061 -7.508 -4.641 1.00 0.00 C ATOM 657 C GLU A 45 5.948 -7.818 -3.641 1.00 0.00 C ATOM 658 O GLU A 45 5.137 -8.708 -3.904 1.00 0.00 O ATOM 659 CB GLU A 45 8.337 -8.293 -4.285 1.00 0.00 C ATOM 660 CG GLU A 45 9.350 -8.333 -5.439 1.00 0.00 C ATOM 661 CD GLU A 45 8.905 -9.251 -6.595 1.00 0.00 C ATOM 662 OE1 GLU A 45 9.216 -10.463 -6.572 1.00 0.00 O ATOM 663 OE2 GLU A 45 8.267 -8.768 -7.558 1.00 0.00 O ATOM 0 H GLU A 45 7.896 -5.779 -3.850 1.00 0.00 H new ATOM 0 HA GLU A 45 6.706 -7.809 -5.627 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.805 -7.840 -3.411 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.066 -9.312 -4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.499 -7.323 -5.820 1.00 0.00 H new ATOM 0 HG3 GLU A 45 10.313 -8.676 -5.059 1.00 0.00 H new ATOM 670 N MET A 46 5.864 -7.067 -2.539 1.00 0.00 N ATOM 671 CA MET A 46 5.022 -7.412 -1.396 1.00 0.00 C ATOM 672 C MET A 46 4.061 -6.295 -1.000 1.00 0.00 C ATOM 673 O MET A 46 3.257 -6.509 -0.099 1.00 0.00 O ATOM 674 CB MET A 46 5.908 -7.792 -0.193 1.00 0.00 C ATOM 675 CG MET A 46 6.983 -8.842 -0.512 1.00 0.00 C ATOM 676 SD MET A 46 6.380 -10.409 -1.205 1.00 0.00 S ATOM 677 CE MET A 46 5.879 -11.242 0.316 1.00 0.00 C ATOM 0 H MET A 46 6.383 -6.197 -2.417 1.00 0.00 H new ATOM 0 HA MET A 46 4.409 -8.261 -1.699 1.00 0.00 H new ATOM 0 HB2 MET A 46 6.395 -6.893 0.184 1.00 0.00 H new ATOM 0 HB3 MET A 46 5.272 -8.170 0.608 1.00 0.00 H new ATOM 0 HG2 MET A 46 7.693 -8.405 -1.215 1.00 0.00 H new ATOM 0 HG3 MET A 46 7.534 -9.060 0.403 1.00 0.00 H new ATOM 0 HE1 MET A 46 5.481 -12.228 0.077 1.00 0.00 H new ATOM 0 HE2 MET A 46 6.742 -11.349 0.973 1.00 0.00 H new ATOM 0 HE3 MET A 46 5.111 -10.653 0.818 1.00 0.00 H new ATOM 687 N GLY A 47 4.101 -5.126 -1.645 1.00 0.00 N ATOM 688 CA GLY A 47 3.348 -3.931 -1.251 1.00 0.00 C ATOM 689 C GLY A 47 1.826 -4.096 -1.172 1.00 0.00 C ATOM 690 O GLY A 47 1.142 -3.236 -0.617 1.00 0.00 O ATOM 0 H GLY A 47 4.673 -4.980 -2.477 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.710 -3.602 -0.277 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.572 -3.134 -1.960 1.00 0.00 H new ATOM 694 N ASP A 48 1.275 -5.183 -1.716 1.00 0.00 N ATOM 695 CA ASP A 48 -0.146 -5.510 -1.613 1.00 0.00 C ATOM 696 C ASP A 48 -0.498 -6.083 -0.235 1.00 0.00 C ATOM 697 O ASP A 48 -1.638 -5.967 0.214 1.00 0.00 O ATOM 698 CB ASP A 48 -0.543 -6.510 -2.705 1.00 0.00 C ATOM 699 CG ASP A 48 -2.061 -6.763 -2.702 1.00 0.00 C ATOM 700 OD1 ASP A 48 -2.829 -5.847 -3.074 1.00 0.00 O ATOM 701 OD2 ASP A 48 -2.489 -7.892 -2.373 1.00 0.00 O ATOM 0 H ASP A 48 1.811 -5.869 -2.247 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.704 -4.584 -1.747 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -0.237 -6.129 -3.679 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.014 -7.451 -2.550 1.00 0.00 H new ATOM 706 N LYS A 49 0.486 -6.678 0.454 1.00 0.00 N ATOM 707 CA LYS A 49 0.340 -7.338 1.754 1.00 0.00 C ATOM 708 C LYS A 49 1.175 -6.643 2.831 1.00 0.00 C ATOM 709 O LYS A 49 0.886 -6.807 4.017 1.00 0.00 O ATOM 710 CB LYS A 49 0.798 -8.808 1.668 1.00 0.00 C ATOM 711 CG LYS A 49 0.214 -9.661 0.530 1.00 0.00 C ATOM 712 CD LYS A 49 -1.319 -9.671 0.484 1.00 0.00 C ATOM 713 CE LYS A 49 -1.791 -10.636 -0.611 1.00 0.00 C ATOM 714 NZ LYS A 49 -3.135 -10.281 -1.122 1.00 0.00 N ATOM 0 H LYS A 49 1.444 -6.713 0.104 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.715 -7.284 2.022 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.884 -8.818 1.575 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.555 -9.293 2.613 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.594 -9.289 -0.421 1.00 0.00 H new ATOM 0 HG3 LYS A 49 0.571 -10.685 0.637 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.721 -9.976 1.450 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.694 -8.667 0.285 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.076 -10.628 -1.434 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.810 -11.652 -0.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.537 -11.092 -1.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.755 -10.032 -0.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -3.058 -9.469 -1.767 1.00 0.00 H new ATOM 728 N LEU A 50 2.199 -5.882 2.435 1.00 0.00 N ATOM 729 CA LEU A 50 3.221 -5.333 3.310 1.00 0.00 C ATOM 730 C LEU A 50 3.256 -3.815 3.191 1.00 0.00 C ATOM 731 O LEU A 50 3.049 -3.270 2.111 1.00 0.00 O ATOM 732 CB LEU A 50 4.577 -5.911 2.862 1.00 0.00 C ATOM 733 CG LEU A 50 5.795 -5.487 3.699 1.00 0.00 C ATOM 734 CD1 LEU A 50 5.696 -6.045 5.118 1.00 0.00 C ATOM 735 CD2 LEU A 50 7.076 -5.974 3.021 1.00 0.00 C ATOM 0 H LEU A 50 2.338 -5.626 1.458 1.00 0.00 H new ATOM 0 HA LEU A 50 3.008 -5.593 4.347 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.510 -6.999 2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.751 -5.618 1.827 1.00 0.00 H new ATOM 0 HG LEU A 50 5.817 -4.399 3.766 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.568 -5.733 5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.792 -5.667 5.595 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.658 -7.134 5.079 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.939 -5.673 3.615 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.053 -7.061 2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.150 -5.536 2.026 1.00 0.00 H new ATOM 747 N LYS A 51 3.604 -3.148 4.287 1.00 0.00 N ATOM 748 CA LYS A 51 3.951 -1.730 4.337 1.00 0.00 C ATOM 749 C LYS A 51 5.376 -1.688 4.881 1.00 0.00 C ATOM 750 O LYS A 51 5.717 -2.511 5.734 1.00 0.00 O ATOM 751 CB LYS A 51 2.961 -0.981 5.248 1.00 0.00 C ATOM 752 CG LYS A 51 3.240 0.532 5.331 1.00 0.00 C ATOM 753 CD LYS A 51 2.507 1.210 6.494 1.00 0.00 C ATOM 754 CE LYS A 51 0.987 1.239 6.303 1.00 0.00 C ATOM 755 NZ LYS A 51 0.338 1.924 7.436 1.00 0.00 N ATOM 0 H LYS A 51 3.654 -3.597 5.201 1.00 0.00 H new ATOM 0 HA LYS A 51 3.894 -1.243 3.363 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.947 -1.138 4.879 1.00 0.00 H new ATOM 0 HB3 LYS A 51 3.005 -1.408 6.250 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.312 0.693 5.441 1.00 0.00 H new ATOM 0 HG3 LYS A 51 2.941 1.004 4.395 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.742 0.686 7.420 1.00 0.00 H new ATOM 0 HD3 LYS A 51 2.874 2.230 6.603 1.00 0.00 H new ATOM 0 HE2 LYS A 51 0.741 1.750 5.372 1.00 0.00 H new ATOM 0 HE3 LYS A 51 0.606 0.221 6.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -0.695 1.832 7.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 0.653 1.493 8.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 0.598 2.931 7.428 1.00 0.00 H new ATOM 769 N ILE A 52 6.197 -0.746 4.429 1.00 0.00 N ATOM 770 CA ILE A 52 7.557 -0.573 4.934 1.00 0.00 C ATOM 771 C ILE A 52 7.572 0.794 5.617 1.00 0.00 C ATOM 772 O ILE A 52 6.976 1.733 5.093 1.00 0.00 O ATOM 773 CB ILE A 52 8.581 -0.741 3.787 1.00 0.00 C ATOM 774 CG1 ILE A 52 8.484 -2.167 3.186 1.00 0.00 C ATOM 775 CG2 ILE A 52 10.016 -0.444 4.263 1.00 0.00 C ATOM 776 CD1 ILE A 52 9.409 -2.418 1.991 1.00 0.00 C ATOM 0 H ILE A 52 5.939 -0.079 3.701 1.00 0.00 H new ATOM 0 HA ILE A 52 7.851 -1.330 5.661 1.00 0.00 H new ATOM 0 HB ILE A 52 8.339 -0.016 3.010 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.714 -2.893 3.966 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.455 -2.348 2.877 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.709 -0.572 3.431 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.073 0.581 4.629 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.282 -1.131 5.066 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.275 -3.440 1.635 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.166 -1.720 1.190 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.445 -2.273 2.296 1.00 0.00 H new ATOM 788 N VAL A 53 8.208 0.925 6.784 1.00 0.00 N ATOM 789 CA VAL A 53 8.096 2.137 7.608 1.00 0.00 C ATOM 790 C VAL A 53 9.490 2.562 8.071 1.00 0.00 C ATOM 791 O VAL A 53 10.031 2.015 9.030 1.00 0.00 O ATOM 792 CB VAL A 53 7.095 1.903 8.766 1.00 0.00 C ATOM 793 CG1 VAL A 53 6.999 3.116 9.703 1.00 0.00 C ATOM 794 CG2 VAL A 53 5.677 1.634 8.236 1.00 0.00 C ATOM 0 H VAL A 53 8.809 0.204 7.183 1.00 0.00 H new ATOM 0 HA VAL A 53 7.691 2.965 7.026 1.00 0.00 H new ATOM 0 HB VAL A 53 7.477 1.039 9.310 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.285 2.905 10.499 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.978 3.319 10.137 1.00 0.00 H new ATOM 0 HG13 VAL A 53 6.666 3.987 9.138 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.999 1.474 9.075 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.338 2.491 7.654 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.687 0.746 7.603 1.00 0.00 H new ATOM 804 N LYS A 54 10.105 3.532 7.392 1.00 0.00 N ATOM 805 CA LYS A 54 11.402 4.057 7.815 1.00 0.00 C ATOM 806 C LYS A 54 11.178 4.930 9.050 1.00 0.00 C ATOM 807 O LYS A 54 10.207 5.693 9.088 1.00 0.00 O ATOM 808 CB LYS A 54 12.071 4.850 6.678 1.00 0.00 C ATOM 809 CG LYS A 54 12.259 3.996 5.408 1.00 0.00 C ATOM 810 CD LYS A 54 13.001 4.730 4.283 1.00 0.00 C ATOM 811 CE LYS A 54 14.437 5.088 4.695 1.00 0.00 C ATOM 812 NZ LYS A 54 15.224 5.654 3.569 1.00 0.00 N ATOM 0 H LYS A 54 9.727 3.968 6.551 1.00 0.00 H new ATOM 0 HA LYS A 54 12.077 3.238 8.063 1.00 0.00 H new ATOM 0 HB2 LYS A 54 11.464 5.724 6.440 1.00 0.00 H new ATOM 0 HB3 LYS A 54 13.041 5.217 7.014 1.00 0.00 H new ATOM 0 HG2 LYS A 54 12.809 3.091 5.666 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.281 3.681 5.043 1.00 0.00 H new ATOM 0 HD2 LYS A 54 13.023 4.104 3.391 1.00 0.00 H new ATOM 0 HD3 LYS A 54 12.459 5.639 4.021 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.409 5.808 5.513 1.00 0.00 H new ATOM 0 HE3 LYS A 54 14.937 4.196 5.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 16.185 5.880 3.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 15.275 4.959 2.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 14.763 6.520 3.224 1.00 0.00 H new ATOM 826 N ILE A 55 12.073 4.863 10.035 1.00 0.00 N ATOM 827 CA ILE A 55 12.020 5.704 11.228 1.00 0.00 C ATOM 828 C ILE A 55 13.453 6.084 11.623 1.00 0.00 C ATOM 829 O ILE A 55 14.344 5.230 11.698 1.00 0.00 O ATOM 830 CB ILE A 55 11.177 5.033 12.343 1.00 0.00 C ATOM 831 CG1 ILE A 55 11.138 5.932 13.599 1.00 0.00 C ATOM 832 CG2 ILE A 55 11.625 3.601 12.692 1.00 0.00 C ATOM 833 CD1 ILE A 55 10.009 5.582 14.576 1.00 0.00 C ATOM 0 H ILE A 55 12.862 4.217 10.026 1.00 0.00 H new ATOM 0 HA ILE A 55 11.496 6.639 11.032 1.00 0.00 H new ATOM 0 HB ILE A 55 10.168 4.927 11.944 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.093 5.855 14.119 1.00 0.00 H new ATOM 0 HG13 ILE A 55 11.027 6.971 13.288 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.986 3.202 13.480 1.00 0.00 H new ATOM 0 HG22 ILE A 55 11.548 2.970 11.807 1.00 0.00 H new ATOM 0 HG23 ILE A 55 12.659 3.617 13.037 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.047 6.256 15.432 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.047 5.687 14.074 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.129 4.554 14.918 1.00 0.00 H new ATOM 845 N ASP A 56 13.667 7.394 11.794 1.00 0.00 N ATOM 846 CA ASP A 56 14.978 8.002 12.013 1.00 0.00 C ATOM 847 C ASP A 56 15.324 7.915 13.494 1.00 0.00 C ATOM 848 O ASP A 56 14.763 8.666 14.298 1.00 0.00 O ATOM 849 CB ASP A 56 14.982 9.466 11.550 1.00 0.00 C ATOM 850 CG ASP A 56 16.317 10.187 11.831 1.00 0.00 C ATOM 851 OD1 ASP A 56 17.300 9.548 12.266 1.00 0.00 O ATOM 852 OD2 ASP A 56 16.374 11.412 11.577 1.00 0.00 O ATOM 0 H ASP A 56 12.909 8.077 11.783 1.00 0.00 H new ATOM 0 HA ASP A 56 15.725 7.464 11.430 1.00 0.00 H new ATOM 0 HB2 ASP A 56 14.774 9.503 10.481 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.175 10.001 12.050 1.00 0.00 H new ATOM 857 N VAL A 57 16.202 6.993 13.880 1.00 0.00 N ATOM 858 CA VAL A 57 16.521 6.737 15.278 1.00 0.00 C ATOM 859 C VAL A 57 17.074 7.982 15.974 1.00 0.00 C ATOM 860 O VAL A 57 16.858 8.135 17.176 1.00 0.00 O ATOM 861 CB VAL A 57 17.459 5.519 15.431 1.00 0.00 C ATOM 862 CG1 VAL A 57 16.811 4.267 14.827 1.00 0.00 C ATOM 863 CG2 VAL A 57 18.855 5.701 14.817 1.00 0.00 C ATOM 0 H VAL A 57 16.714 6.400 13.227 1.00 0.00 H new ATOM 0 HA VAL A 57 15.588 6.487 15.783 1.00 0.00 H new ATOM 0 HB VAL A 57 17.604 5.410 16.506 1.00 0.00 H new ATOM 0 HG11 VAL A 57 17.484 3.417 14.942 1.00 0.00 H new ATOM 0 HG12 VAL A 57 15.873 4.059 15.341 1.00 0.00 H new ATOM 0 HG13 VAL A 57 16.615 4.434 13.768 1.00 0.00 H new ATOM 0 HG21 VAL A 57 19.442 4.796 14.973 1.00 0.00 H new ATOM 0 HG22 VAL A 57 18.760 5.892 13.748 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.355 6.544 15.293 1.00 0.00 H new ATOM 873 N ASP A 58 17.731 8.896 15.253 1.00 0.00 N ATOM 874 CA ASP A 58 18.339 10.088 15.851 1.00 0.00 C ATOM 875 C ASP A 58 17.282 11.047 16.413 1.00 0.00 C ATOM 876 O ASP A 58 17.579 11.858 17.289 1.00 0.00 O ATOM 877 CB ASP A 58 19.220 10.809 14.826 1.00 0.00 C ATOM 878 CG ASP A 58 19.975 11.989 15.463 1.00 0.00 C ATOM 879 OD1 ASP A 58 20.842 11.756 16.335 1.00 0.00 O ATOM 880 OD2 ASP A 58 19.752 13.151 15.056 1.00 0.00 O ATOM 0 H ASP A 58 17.856 8.831 14.243 1.00 0.00 H new ATOM 0 HA ASP A 58 18.959 9.757 16.684 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.935 10.105 14.400 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.602 11.172 14.005 1.00 0.00 H new ATOM 885 N GLU A 59 16.031 10.909 15.960 1.00 0.00 N ATOM 886 CA GLU A 59 14.882 11.703 16.385 1.00 0.00 C ATOM 887 C GLU A 59 13.852 10.826 17.118 1.00 0.00 C ATOM 888 O GLU A 59 12.801 11.326 17.524 1.00 0.00 O ATOM 889 CB GLU A 59 14.258 12.368 15.143 1.00 0.00 C ATOM 890 CG GLU A 59 15.092 13.528 14.576 1.00 0.00 C ATOM 891 CD GLU A 59 15.021 14.786 15.463 1.00 0.00 C ATOM 892 OE1 GLU A 59 14.047 15.565 15.342 1.00 0.00 O ATOM 893 OE2 GLU A 59 15.942 15.030 16.275 1.00 0.00 O ATOM 0 H GLU A 59 15.786 10.211 15.258 1.00 0.00 H new ATOM 0 HA GLU A 59 15.206 12.473 17.085 1.00 0.00 H new ATOM 0 HB2 GLU A 59 14.126 11.614 14.367 1.00 0.00 H new ATOM 0 HB3 GLU A 59 13.266 12.738 15.400 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.131 13.212 14.479 1.00 0.00 H new ATOM 0 HG3 GLU A 59 14.738 13.772 13.574 1.00 0.00 H new ATOM 900 N ASN A 60 14.126 9.526 17.296 1.00 0.00 N ATOM 901 CA ASN A 60 13.158 8.533 17.773 1.00 0.00 C ATOM 902 C ASN A 60 13.855 7.550 18.712 1.00 0.00 C ATOM 903 O ASN A 60 13.650 6.334 18.640 1.00 0.00 O ATOM 904 CB ASN A 60 12.462 7.834 16.593 1.00 0.00 C ATOM 905 CG ASN A 60 11.597 8.803 15.798 1.00 0.00 C ATOM 906 OD1 ASN A 60 10.493 9.149 16.205 1.00 0.00 O ATOM 907 ND2 ASN A 60 12.074 9.275 14.660 1.00 0.00 N ATOM 0 H ASN A 60 15.047 9.129 17.108 1.00 0.00 H new ATOM 0 HA ASN A 60 12.371 9.032 18.339 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.212 7.393 15.937 1.00 0.00 H new ATOM 0 HB3 ASN A 60 11.845 7.017 16.966 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.523 9.934 14.110 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.993 8.980 14.331 1.00 0.00 H new ATOM 914 N GLN A 61 14.709 8.085 19.590 1.00 0.00 N ATOM 915 CA GLN A 61 15.440 7.316 20.590 1.00 0.00 C ATOM 916 C GLN A 61 14.487 6.505 21.473 1.00 0.00 C ATOM 917 O GLN A 61 14.843 5.408 21.894 1.00 0.00 O ATOM 918 CB GLN A 61 16.296 8.257 21.456 1.00 0.00 C ATOM 919 CG GLN A 61 17.479 8.877 20.696 1.00 0.00 C ATOM 920 CD GLN A 61 18.574 7.850 20.401 1.00 0.00 C ATOM 921 OE1 GLN A 61 19.386 7.513 21.261 1.00 0.00 O ATOM 922 NE2 GLN A 61 18.620 7.322 19.190 1.00 0.00 N ATOM 0 H GLN A 61 14.912 9.084 19.622 1.00 0.00 H new ATOM 0 HA GLN A 61 16.092 6.615 20.069 1.00 0.00 H new ATOM 0 HB2 GLN A 61 15.665 9.056 21.845 1.00 0.00 H new ATOM 0 HB3 GLN A 61 16.675 7.704 22.315 1.00 0.00 H new ATOM 0 HG2 GLN A 61 17.123 9.306 19.759 1.00 0.00 H new ATOM 0 HG3 GLN A 61 17.898 9.695 21.282 1.00 0.00 H new ATOM 0 HE21 GLN A 61 17.942 7.608 18.483 1.00 0.00 H new ATOM 0 HE22 GLN A 61 19.333 6.629 18.963 1.00 0.00 H new ATOM 931 N GLU A 62 13.277 7.012 21.736 1.00 0.00 N ATOM 932 CA GLU A 62 12.294 6.315 22.555 1.00 0.00 C ATOM 933 C GLU A 62 11.828 5.034 21.858 1.00 0.00 C ATOM 934 O GLU A 62 11.828 3.969 22.475 1.00 0.00 O ATOM 935 CB GLU A 62 11.098 7.235 22.858 1.00 0.00 C ATOM 936 CG GLU A 62 11.461 8.474 23.693 1.00 0.00 C ATOM 937 CD GLU A 62 12.007 8.113 25.088 1.00 0.00 C ATOM 938 OE1 GLU A 62 11.213 7.737 25.980 1.00 0.00 O ATOM 939 OE2 GLU A 62 13.232 8.226 25.317 1.00 0.00 O ATOM 0 H GLU A 62 12.958 7.915 21.385 1.00 0.00 H new ATOM 0 HA GLU A 62 12.762 6.039 23.500 1.00 0.00 H new ATOM 0 HB2 GLU A 62 10.655 7.560 21.917 1.00 0.00 H new ATOM 0 HB3 GLU A 62 10.337 6.662 23.388 1.00 0.00 H new ATOM 0 HG2 GLU A 62 12.206 9.062 23.157 1.00 0.00 H new ATOM 0 HG3 GLU A 62 10.578 9.103 23.805 1.00 0.00 H new ATOM 946 N THR A 63 11.479 5.104 20.572 1.00 0.00 N ATOM 947 CA THR A 63 10.996 3.954 19.819 1.00 0.00 C ATOM 948 C THR A 63 12.141 2.956 19.617 1.00 0.00 C ATOM 949 O THR A 63 11.942 1.756 19.742 1.00 0.00 O ATOM 950 CB THR A 63 10.433 4.414 18.465 1.00 0.00 C ATOM 951 OG1 THR A 63 9.985 5.753 18.498 1.00 0.00 O ATOM 952 CG2 THR A 63 9.299 3.532 17.940 1.00 0.00 C ATOM 0 H THR A 63 11.525 5.964 20.025 1.00 0.00 H new ATOM 0 HA THR A 63 10.197 3.464 20.375 1.00 0.00 H new ATOM 0 HB THR A 63 11.277 4.326 17.781 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.393 5.881 19.268 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.952 3.918 16.981 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.661 2.512 17.811 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.474 3.537 18.653 1.00 0.00 H new ATOM 960 N ALA A 64 13.360 3.431 19.351 1.00 0.00 N ATOM 961 CA ALA A 64 14.543 2.579 19.287 1.00 0.00 C ATOM 962 C ALA A 64 14.749 1.855 20.623 1.00 0.00 C ATOM 963 O ALA A 64 14.898 0.631 20.651 1.00 0.00 O ATOM 964 CB ALA A 64 15.757 3.437 18.903 1.00 0.00 C ATOM 0 H ALA A 64 13.552 4.417 19.174 1.00 0.00 H new ATOM 0 HA ALA A 64 14.412 1.811 18.525 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.646 2.808 18.853 1.00 0.00 H new ATOM 0 HB2 ALA A 64 15.584 3.898 17.931 1.00 0.00 H new ATOM 0 HB3 ALA A 64 15.905 4.215 19.652 1.00 0.00 H new ATOM 970 N GLY A 65 14.679 2.587 21.736 1.00 0.00 N ATOM 971 CA GLY A 65 14.793 2.040 23.080 1.00 0.00 C ATOM 972 C GLY A 65 13.697 1.021 23.389 1.00 0.00 C ATOM 973 O GLY A 65 13.944 0.076 24.140 1.00 0.00 O ATOM 0 H GLY A 65 14.538 3.597 21.723 1.00 0.00 H new ATOM 0 HA2 GLY A 65 15.768 1.567 23.195 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.745 2.852 23.805 1.00 0.00 H new ATOM 977 N LYS A 66 12.518 1.152 22.766 1.00 0.00 N ATOM 978 CA LYS A 66 11.378 0.255 22.946 1.00 0.00 C ATOM 979 C LYS A 66 11.755 -1.198 22.644 1.00 0.00 C ATOM 980 O LYS A 66 11.190 -2.101 23.264 1.00 0.00 O ATOM 981 CB LYS A 66 10.209 0.725 22.054 1.00 0.00 C ATOM 982 CG LYS A 66 8.829 0.169 22.443 1.00 0.00 C ATOM 983 CD LYS A 66 8.329 0.684 23.804 1.00 0.00 C ATOM 984 CE LYS A 66 6.879 0.266 24.092 1.00 0.00 C ATOM 985 NZ LYS A 66 6.726 -1.195 24.322 1.00 0.00 N ATOM 0 H LYS A 66 12.330 1.907 22.106 1.00 0.00 H new ATOM 0 HA LYS A 66 11.066 0.291 23.990 1.00 0.00 H new ATOM 0 HB2 LYS A 66 10.166 1.814 22.082 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.421 0.440 21.023 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.106 0.437 21.673 1.00 0.00 H new ATOM 0 HG3 LYS A 66 8.877 -0.920 22.469 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.977 0.304 24.594 1.00 0.00 H new ATOM 0 HD3 LYS A 66 8.402 1.771 23.827 1.00 0.00 H new ATOM 0 HE2 LYS A 66 6.519 0.805 24.969 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.249 0.563 23.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 5.727 -1.414 24.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.041 -1.714 23.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.303 -1.480 25.139 1.00 0.00 H new ATOM 999 N TYR A 67 12.727 -1.426 21.751 1.00 0.00 N ATOM 1000 CA TYR A 67 13.169 -2.768 21.359 1.00 0.00 C ATOM 1001 C TYR A 67 14.679 -2.952 21.575 1.00 0.00 C ATOM 1002 O TYR A 67 15.251 -3.939 21.108 1.00 0.00 O ATOM 1003 CB TYR A 67 12.764 -3.056 19.903 1.00 0.00 C ATOM 1004 CG TYR A 67 11.481 -2.381 19.457 1.00 0.00 C ATOM 1005 CD1 TYR A 67 10.231 -2.838 19.915 1.00 0.00 C ATOM 1006 CD2 TYR A 67 11.558 -1.215 18.677 1.00 0.00 C ATOM 1007 CE1 TYR A 67 9.061 -2.126 19.598 1.00 0.00 C ATOM 1008 CE2 TYR A 67 10.398 -0.492 18.370 1.00 0.00 C ATOM 1009 CZ TYR A 67 9.139 -0.942 18.829 1.00 0.00 C ATOM 1010 OH TYR A 67 8.004 -0.233 18.573 1.00 0.00 O ATOM 0 H TYR A 67 13.232 -0.677 21.277 1.00 0.00 H new ATOM 0 HA TYR A 67 12.670 -3.494 22.001 1.00 0.00 H new ATOM 0 HB2 TYR A 67 13.573 -2.738 19.245 1.00 0.00 H new ATOM 0 HB3 TYR A 67 12.655 -4.133 19.777 1.00 0.00 H new ATOM 0 HD1 TYR A 67 10.171 -3.737 20.511 1.00 0.00 H new ATOM 0 HD2 TYR A 67 12.516 -0.874 18.312 1.00 0.00 H new ATOM 0 HE1 TYR A 67 8.102 -2.484 19.942 1.00 0.00 H new ATOM 0 HE2 TYR A 67 10.466 0.411 17.781 1.00 0.00 H new ATOM 0 HH TYR A 67 8.060 0.161 17.677 1.00 0.00 H new ATOM 1020 N GLY A 68 15.337 -2.013 22.266 1.00 0.00 N ATOM 1021 CA GLY A 68 16.777 -2.035 22.493 1.00 0.00 C ATOM 1022 C GLY A 68 17.579 -1.918 21.194 1.00 0.00 C ATOM 1023 O GLY A 68 18.663 -2.497 21.094 1.00 0.00 O ATOM 0 H GLY A 68 14.873 -1.208 22.687 1.00 0.00 H new ATOM 0 HA2 GLY A 68 17.049 -1.216 23.159 1.00 0.00 H new ATOM 0 HA3 GLY A 68 17.047 -2.961 23.000 1.00 0.00 H new ATOM 1027 N VAL A 69 17.056 -1.211 20.186 1.00 0.00 N ATOM 1028 CA VAL A 69 17.792 -0.896 18.967 1.00 0.00 C ATOM 1029 C VAL A 69 18.948 0.032 19.368 1.00 0.00 C ATOM 1030 O VAL A 69 18.720 1.085 19.967 1.00 0.00 O ATOM 1031 CB VAL A 69 16.854 -0.258 17.915 1.00 0.00 C ATOM 1032 CG1 VAL A 69 17.595 0.034 16.603 1.00 0.00 C ATOM 1033 CG2 VAL A 69 15.630 -1.139 17.612 1.00 0.00 C ATOM 0 H VAL A 69 16.105 -0.842 20.198 1.00 0.00 H new ATOM 0 HA VAL A 69 18.194 -1.795 18.499 1.00 0.00 H new ATOM 0 HB VAL A 69 16.508 0.678 18.353 1.00 0.00 H new ATOM 0 HG11 VAL A 69 16.905 0.482 15.887 1.00 0.00 H new ATOM 0 HG12 VAL A 69 18.417 0.724 16.795 1.00 0.00 H new ATOM 0 HG13 VAL A 69 17.990 -0.896 16.193 1.00 0.00 H new ATOM 0 HG21 VAL A 69 15.003 -0.647 16.868 1.00 0.00 H new ATOM 0 HG22 VAL A 69 15.962 -2.103 17.227 1.00 0.00 H new ATOM 0 HG23 VAL A 69 15.056 -1.292 18.526 1.00 0.00 H new ATOM 1043 N MET A 70 20.184 -0.363 19.044 1.00 0.00 N ATOM 1044 CA MET A 70 21.411 0.381 19.360 1.00 0.00 C ATOM 1045 C MET A 70 22.373 0.420 18.157 1.00 0.00 C ATOM 1046 O MET A 70 23.469 0.976 18.259 1.00 0.00 O ATOM 1047 CB MET A 70 22.097 -0.249 20.585 1.00 0.00 C ATOM 1048 CG MET A 70 21.286 -0.077 21.877 1.00 0.00 C ATOM 1049 SD MET A 70 22.038 -0.791 23.370 1.00 0.00 S ATOM 1050 CE MET A 70 23.440 0.334 23.619 1.00 0.00 C ATOM 0 H MET A 70 20.365 -1.232 18.541 1.00 0.00 H new ATOM 0 HA MET A 70 21.139 1.411 19.591 1.00 0.00 H new ATOM 0 HB2 MET A 70 22.256 -1.311 20.400 1.00 0.00 H new ATOM 0 HB3 MET A 70 23.081 0.202 20.716 1.00 0.00 H new ATOM 0 HG2 MET A 70 21.125 0.988 22.046 1.00 0.00 H new ATOM 0 HG3 MET A 70 20.305 -0.529 21.733 1.00 0.00 H new ATOM 0 HE1 MET A 70 23.927 0.104 24.566 1.00 0.00 H new ATOM 0 HE2 MET A 70 24.154 0.212 22.804 1.00 0.00 H new ATOM 0 HE3 MET A 70 23.082 1.363 23.636 1.00 0.00 H new ATOM 1060 N SER A 71 21.955 -0.135 17.018 1.00 0.00 N ATOM 1061 CA SER A 71 22.683 -0.189 15.760 1.00 0.00 C ATOM 1062 C SER A 71 21.660 -0.036 14.632 1.00 0.00 C ATOM 1063 O SER A 71 20.467 -0.270 14.850 1.00 0.00 O ATOM 1064 CB SER A 71 23.425 -1.532 15.637 1.00 0.00 C ATOM 1065 OG SER A 71 24.280 -1.769 16.747 1.00 0.00 O ATOM 0 H SER A 71 21.042 -0.585 16.951 1.00 0.00 H new ATOM 0 HA SER A 71 23.426 0.607 15.708 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.699 -2.342 15.558 1.00 0.00 H new ATOM 0 HB3 SER A 71 24.012 -1.540 14.719 1.00 0.00 H new ATOM 0 HG SER A 71 24.732 -2.631 16.634 1.00 0.00 H new ATOM 1071 N ILE A 72 22.111 0.330 13.431 1.00 0.00 N ATOM 1072 CA ILE A 72 21.276 0.464 12.240 1.00 0.00 C ATOM 1073 C ILE A 72 22.078 -0.015 11.009 1.00 0.00 C ATOM 1074 O ILE A 72 23.311 0.038 11.056 1.00 0.00 O ATOM 1075 CB ILE A 72 20.754 1.915 12.080 1.00 0.00 C ATOM 1076 CG1 ILE A 72 21.885 2.968 12.014 1.00 0.00 C ATOM 1077 CG2 ILE A 72 19.743 2.266 13.190 1.00 0.00 C ATOM 1078 CD1 ILE A 72 21.382 4.360 11.618 1.00 0.00 C ATOM 0 H ILE A 72 23.092 0.547 13.257 1.00 0.00 H new ATOM 0 HA ILE A 72 20.390 -0.164 12.339 1.00 0.00 H new ATOM 0 HB ILE A 72 20.245 1.949 11.117 1.00 0.00 H new ATOM 0 HG12 ILE A 72 22.376 3.028 12.985 1.00 0.00 H new ATOM 0 HG13 ILE A 72 22.637 2.641 11.296 1.00 0.00 H new ATOM 0 HG21 ILE A 72 19.393 3.289 13.053 1.00 0.00 H new ATOM 0 HG22 ILE A 72 18.895 1.583 13.139 1.00 0.00 H new ATOM 0 HG23 ILE A 72 20.225 2.174 14.163 1.00 0.00 H new ATOM 0 HD11 ILE A 72 22.221 5.055 11.589 1.00 0.00 H new ATOM 0 HD12 ILE A 72 20.916 4.312 10.634 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.651 4.704 12.349 1.00 0.00 H new ATOM 1090 N PRO A 73 21.437 -0.471 9.912 1.00 0.00 N ATOM 1091 CA PRO A 73 19.998 -0.662 9.767 1.00 0.00 C ATOM 1092 C PRO A 73 19.515 -1.788 10.680 1.00 0.00 C ATOM 1093 O PRO A 73 20.170 -2.828 10.797 1.00 0.00 O ATOM 1094 CB PRO A 73 19.768 -1.011 8.291 1.00 0.00 C ATOM 1095 CG PRO A 73 21.086 -1.649 7.858 1.00 0.00 C ATOM 1096 CD PRO A 73 22.122 -0.912 8.705 1.00 0.00 C ATOM 0 HA PRO A 73 19.441 0.231 10.051 1.00 0.00 H new ATOM 0 HB2 PRO A 73 18.931 -1.699 8.168 1.00 0.00 H new ATOM 0 HB3 PRO A 73 19.540 -0.123 7.701 1.00 0.00 H new ATOM 0 HG2 PRO A 73 21.097 -2.722 8.051 1.00 0.00 H new ATOM 0 HG3 PRO A 73 21.268 -1.515 6.792 1.00 0.00 H new ATOM 0 HD2 PRO A 73 22.958 -1.567 8.951 1.00 0.00 H new ATOM 0 HD3 PRO A 73 22.533 -0.062 8.161 1.00 0.00 H new ATOM 1104 N THR A 74 18.355 -1.585 11.295 1.00 0.00 N ATOM 1105 CA THR A 74 17.692 -2.599 12.100 1.00 0.00 C ATOM 1106 C THR A 74 16.246 -2.664 11.623 1.00 0.00 C ATOM 1107 O THR A 74 15.645 -1.643 11.283 1.00 0.00 O ATOM 1108 CB THR A 74 17.870 -2.272 13.593 1.00 0.00 C ATOM 1109 OG1 THR A 74 19.229 -2.445 13.932 1.00 0.00 O ATOM 1110 CG2 THR A 74 17.050 -3.187 14.506 1.00 0.00 C ATOM 0 H THR A 74 17.845 -0.703 11.247 1.00 0.00 H new ATOM 0 HA THR A 74 18.124 -3.592 11.981 1.00 0.00 H new ATOM 0 HB THR A 74 17.528 -1.248 13.740 1.00 0.00 H new ATOM 0 HG1 THR A 74 19.557 -1.642 14.388 1.00 0.00 H new ATOM 0 HG21 THR A 74 17.217 -2.907 15.546 1.00 0.00 H new ATOM 0 HG22 THR A 74 15.991 -3.084 14.268 1.00 0.00 H new ATOM 0 HG23 THR A 74 17.357 -4.222 14.355 1.00 0.00 H new ATOM 1118 N LEU A 75 15.698 -3.873 11.553 1.00 0.00 N ATOM 1119 CA LEU A 75 14.429 -4.155 10.914 1.00 0.00 C ATOM 1120 C LEU A 75 13.527 -4.767 11.972 1.00 0.00 C ATOM 1121 O LEU A 75 13.890 -5.774 12.584 1.00 0.00 O ATOM 1122 CB LEU A 75 14.625 -5.108 9.722 1.00 0.00 C ATOM 1123 CG LEU A 75 15.574 -4.604 8.613 1.00 0.00 C ATOM 1124 CD1 LEU A 75 15.685 -5.667 7.515 1.00 0.00 C ATOM 1125 CD2 LEU A 75 15.143 -3.272 7.988 1.00 0.00 C ATOM 0 H LEU A 75 16.140 -4.701 11.951 1.00 0.00 H new ATOM 0 HA LEU A 75 13.979 -3.246 10.515 1.00 0.00 H new ATOM 0 HB2 LEU A 75 15.007 -6.057 10.098 1.00 0.00 H new ATOM 0 HB3 LEU A 75 13.651 -5.310 9.277 1.00 0.00 H new ATOM 0 HG LEU A 75 16.539 -4.427 9.089 1.00 0.00 H new ATOM 0 HD11 LEU A 75 16.355 -5.312 6.732 1.00 0.00 H new ATOM 0 HD12 LEU A 75 16.080 -6.589 7.940 1.00 0.00 H new ATOM 0 HD13 LEU A 75 14.699 -5.857 7.091 1.00 0.00 H new ATOM 0 HD21 LEU A 75 15.858 -2.983 7.218 1.00 0.00 H new ATOM 0 HD22 LEU A 75 14.155 -3.382 7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 75 15.109 -2.502 8.759 1.00 0.00 H new ATOM 1137 N LEU A 76 12.363 -4.166 12.199 1.00 0.00 N ATOM 1138 CA LEU A 76 11.382 -4.653 13.165 1.00 0.00 C ATOM 1139 C LEU A 76 10.208 -5.062 12.305 1.00 0.00 C ATOM 1140 O LEU A 76 9.700 -4.244 11.541 1.00 0.00 O ATOM 1141 CB LEU A 76 10.977 -3.552 14.172 1.00 0.00 C ATOM 1142 CG LEU A 76 11.867 -3.360 15.418 1.00 0.00 C ATOM 1143 CD1 LEU A 76 11.699 -4.533 16.386 1.00 0.00 C ATOM 1144 CD2 LEU A 76 13.346 -3.183 15.067 1.00 0.00 C ATOM 0 H LEU A 76 12.071 -3.318 11.713 1.00 0.00 H new ATOM 0 HA LEU A 76 11.768 -5.469 13.775 1.00 0.00 H new ATOM 0 HB2 LEU A 76 10.941 -2.604 13.636 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.964 -3.765 14.513 1.00 0.00 H new ATOM 0 HG LEU A 76 11.535 -2.439 15.898 1.00 0.00 H new ATOM 0 HD11 LEU A 76 12.335 -4.379 17.258 1.00 0.00 H new ATOM 0 HD12 LEU A 76 10.658 -4.597 16.703 1.00 0.00 H new ATOM 0 HD13 LEU A 76 11.985 -5.460 15.888 1.00 0.00 H new ATOM 0 HD21 LEU A 76 13.924 -3.052 15.982 1.00 0.00 H new ATOM 0 HD22 LEU A 76 13.702 -4.066 14.536 1.00 0.00 H new ATOM 0 HD23 LEU A 76 13.467 -2.305 14.433 1.00 0.00 H new ATOM 1156 N VAL A 77 9.791 -6.318 12.394 1.00 0.00 N ATOM 1157 CA VAL A 77 8.599 -6.768 11.701 1.00 0.00 C ATOM 1158 C VAL A 77 7.507 -6.672 12.749 1.00 0.00 C ATOM 1159 O VAL A 77 7.660 -7.213 13.849 1.00 0.00 O ATOM 1160 CB VAL A 77 8.748 -8.196 11.146 1.00 0.00 C ATOM 1161 CG1 VAL A 77 7.673 -8.453 10.079 1.00 0.00 C ATOM 1162 CG2 VAL A 77 10.126 -8.473 10.524 1.00 0.00 C ATOM 0 H VAL A 77 10.262 -7.040 12.939 1.00 0.00 H new ATOM 0 HA VAL A 77 8.383 -6.164 10.820 1.00 0.00 H new ATOM 0 HB VAL A 77 8.633 -8.866 11.998 1.00 0.00 H new ATOM 0 HG11 VAL A 77 7.782 -9.465 9.689 1.00 0.00 H new ATOM 0 HG12 VAL A 77 6.684 -8.340 10.524 1.00 0.00 H new ATOM 0 HG13 VAL A 77 7.789 -7.736 9.266 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.159 -9.498 10.154 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.298 -7.783 9.698 1.00 0.00 H new ATOM 0 HG23 VAL A 77 10.900 -8.335 11.279 1.00 0.00 H new ATOM 1172 N LEU A 78 6.417 -5.988 12.423 1.00 0.00 N ATOM 1173 CA LEU A 78 5.259 -5.843 13.278 1.00 0.00 C ATOM 1174 C LEU A 78 4.072 -6.440 12.538 1.00 0.00 C ATOM 1175 O LEU A 78 4.059 -6.499 11.306 1.00 0.00 O ATOM 1176 CB LEU A 78 5.003 -4.369 13.661 1.00 0.00 C ATOM 1177 CG LEU A 78 6.120 -3.746 14.531 1.00 0.00 C ATOM 1178 CD1 LEU A 78 7.163 -3.001 13.691 1.00 0.00 C ATOM 1179 CD2 LEU A 78 5.551 -2.793 15.587 1.00 0.00 C ATOM 0 H LEU A 78 6.318 -5.507 11.529 1.00 0.00 H new ATOM 0 HA LEU A 78 5.424 -6.367 14.219 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.894 -3.780 12.750 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.057 -4.302 14.198 1.00 0.00 H new ATOM 0 HG LEU A 78 6.609 -4.582 15.030 1.00 0.00 H new ATOM 0 HD11 LEU A 78 7.926 -2.581 14.347 1.00 0.00 H new ATOM 0 HD12 LEU A 78 7.628 -3.694 12.990 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.678 -2.197 13.138 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.366 -2.376 16.178 1.00 0.00 H new ATOM 0 HD22 LEU A 78 5.010 -1.985 15.094 1.00 0.00 H new ATOM 0 HD23 LEU A 78 4.871 -3.339 16.241 1.00 0.00 H new ATOM 1191 N LYS A 79 3.067 -6.873 13.289 1.00 0.00 N ATOM 1192 CA LYS A 79 1.828 -7.398 12.749 1.00 0.00 C ATOM 1193 C LYS A 79 0.712 -6.802 13.583 1.00 0.00 C ATOM 1194 O LYS A 79 0.677 -7.008 14.796 1.00 0.00 O ATOM 1195 CB LYS A 79 1.851 -8.934 12.785 1.00 0.00 C ATOM 1196 CG LYS A 79 0.684 -9.546 12.000 1.00 0.00 C ATOM 1197 CD LYS A 79 0.732 -11.081 12.054 1.00 0.00 C ATOM 1198 CE LYS A 79 -0.304 -11.742 11.131 1.00 0.00 C ATOM 1199 NZ LYS A 79 -1.705 -11.540 11.580 1.00 0.00 N ATOM 0 H LYS A 79 3.095 -6.867 14.309 1.00 0.00 H new ATOM 0 HA LYS A 79 1.681 -7.128 11.703 1.00 0.00 H new ATOM 0 HB2 LYS A 79 2.794 -9.292 12.371 1.00 0.00 H new ATOM 0 HB3 LYS A 79 1.809 -9.273 13.820 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -0.261 -9.193 12.412 1.00 0.00 H new ATOM 0 HG3 LYS A 79 0.724 -9.213 10.963 1.00 0.00 H new ATOM 0 HD2 LYS A 79 1.730 -11.419 11.774 1.00 0.00 H new ATOM 0 HD3 LYS A 79 0.561 -11.410 13.079 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -0.191 -11.341 10.124 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -0.099 -12.811 11.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -2.353 -12.009 10.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -1.827 -11.947 12.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -1.917 -10.522 11.609 1.00 0.00 H new ATOM 1213 N ASP A 80 -0.177 -6.052 12.932 1.00 0.00 N ATOM 1214 CA ASP A 80 -1.360 -5.436 13.538 1.00 0.00 C ATOM 1215 C ASP A 80 -1.026 -4.664 14.832 1.00 0.00 C ATOM 1216 O ASP A 80 -1.767 -4.699 15.817 1.00 0.00 O ATOM 1217 CB ASP A 80 -2.472 -6.486 13.701 1.00 0.00 C ATOM 1218 CG ASP A 80 -3.812 -5.867 14.146 1.00 0.00 C ATOM 1219 OD1 ASP A 80 -4.228 -4.833 13.580 1.00 0.00 O ATOM 1220 OD2 ASP A 80 -4.488 -6.452 15.023 1.00 0.00 O ATOM 0 H ASP A 80 -0.092 -5.849 11.936 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.742 -4.670 12.864 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.614 -7.009 12.755 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.159 -7.230 14.433 1.00 0.00 H new ATOM 1225 N GLY A 81 0.127 -3.986 14.837 1.00 0.00 N ATOM 1226 CA GLY A 81 0.497 -3.017 15.863 1.00 0.00 C ATOM 1227 C GLY A 81 1.537 -3.497 16.876 1.00 0.00 C ATOM 1228 O GLY A 81 1.966 -2.685 17.698 1.00 0.00 O ATOM 0 H GLY A 81 0.838 -4.100 14.114 1.00 0.00 H new ATOM 0 HA2 GLY A 81 0.879 -2.122 15.372 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.403 -2.724 16.403 1.00 0.00 H new ATOM 1232 N GLU A 82 1.966 -4.763 16.845 1.00 0.00 N ATOM 1233 CA GLU A 82 2.920 -5.311 17.808 1.00 0.00 C ATOM 1234 C GLU A 82 4.044 -6.046 17.080 1.00 0.00 C ATOM 1235 O GLU A 82 3.834 -6.558 15.980 1.00 0.00 O ATOM 1236 CB GLU A 82 2.166 -6.199 18.808 1.00 0.00 C ATOM 1237 CG GLU A 82 1.676 -7.549 18.259 1.00 0.00 C ATOM 1238 CD GLU A 82 0.917 -8.346 19.336 1.00 0.00 C ATOM 1239 OE1 GLU A 82 -0.321 -8.203 19.453 1.00 0.00 O ATOM 1240 OE2 GLU A 82 1.548 -9.140 20.073 1.00 0.00 O ATOM 0 H GLU A 82 1.658 -5.438 16.146 1.00 0.00 H new ATOM 0 HA GLU A 82 3.397 -4.510 18.374 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.817 -6.389 19.661 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.305 -5.645 19.181 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.025 -7.381 17.401 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.527 -8.131 17.904 1.00 0.00 H new ATOM 1247 N VAL A 83 5.245 -6.080 17.666 1.00 0.00 N ATOM 1248 CA VAL A 83 6.399 -6.748 17.073 1.00 0.00 C ATOM 1249 C VAL A 83 6.095 -8.238 16.952 1.00 0.00 C ATOM 1250 O VAL A 83 5.636 -8.879 17.903 1.00 0.00 O ATOM 1251 CB VAL A 83 7.685 -6.466 17.879 1.00 0.00 C ATOM 1252 CG1 VAL A 83 8.924 -7.080 17.205 1.00 0.00 C ATOM 1253 CG2 VAL A 83 7.935 -4.956 18.016 1.00 0.00 C ATOM 0 H VAL A 83 5.441 -5.643 18.567 1.00 0.00 H new ATOM 0 HA VAL A 83 6.584 -6.352 16.074 1.00 0.00 H new ATOM 0 HB VAL A 83 7.533 -6.917 18.860 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.809 -6.860 17.802 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.798 -8.160 17.127 1.00 0.00 H new ATOM 0 HG13 VAL A 83 9.044 -6.656 16.208 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.847 -4.789 18.588 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.042 -4.514 17.026 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.093 -4.493 18.531 1.00 0.00 H new ATOM 1263 N VAL A 84 6.396 -8.775 15.775 1.00 0.00 N ATOM 1264 CA VAL A 84 6.277 -10.178 15.444 1.00 0.00 C ATOM 1265 C VAL A 84 7.653 -10.757 15.060 1.00 0.00 C ATOM 1266 O VAL A 84 7.833 -11.966 15.212 1.00 0.00 O ATOM 1267 CB VAL A 84 5.153 -10.340 14.392 1.00 0.00 C ATOM 1268 CG1 VAL A 84 5.583 -9.939 12.972 1.00 0.00 C ATOM 1269 CG2 VAL A 84 4.560 -11.752 14.410 1.00 0.00 C ATOM 0 H VAL A 84 6.744 -8.215 14.997 1.00 0.00 H new ATOM 0 HA VAL A 84 5.972 -10.778 16.301 1.00 0.00 H new ATOM 0 HB VAL A 84 4.372 -9.638 14.685 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.747 -10.077 12.286 1.00 0.00 H new ATOM 0 HG12 VAL A 84 5.888 -8.893 12.966 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.419 -10.562 12.655 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.774 -11.826 13.658 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.343 -12.478 14.190 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.140 -11.958 15.395 1.00 0.00 H new ATOM 1279 N GLU A 85 8.650 -9.945 14.655 1.00 0.00 N ATOM 1280 CA GLU A 85 10.019 -10.425 14.406 1.00 0.00 C ATOM 1281 C GLU A 85 11.015 -9.260 14.486 1.00 0.00 C ATOM 1282 O GLU A 85 10.621 -8.092 14.510 1.00 0.00 O ATOM 1283 CB GLU A 85 10.121 -11.119 13.025 1.00 0.00 C ATOM 1284 CG GLU A 85 10.320 -12.643 13.073 1.00 0.00 C ATOM 1285 CD GLU A 85 11.709 -13.103 13.543 1.00 0.00 C ATOM 1286 OE1 GLU A 85 12.329 -12.447 14.410 1.00 0.00 O ATOM 1287 OE2 GLU A 85 12.158 -14.168 13.059 1.00 0.00 O ATOM 0 H GLU A 85 8.528 -8.945 14.493 1.00 0.00 H new ATOM 0 HA GLU A 85 10.266 -11.156 15.175 1.00 0.00 H new ATOM 0 HB2 GLU A 85 9.214 -10.904 12.460 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.951 -10.677 12.474 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.568 -13.072 13.736 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.137 -13.050 12.078 1.00 0.00 H new ATOM 1294 N THR A 86 12.317 -9.551 14.516 1.00 0.00 N ATOM 1295 CA THR A 86 13.385 -8.556 14.491 1.00 0.00 C ATOM 1296 C THR A 86 14.586 -9.129 13.727 1.00 0.00 C ATOM 1297 O THR A 86 14.908 -10.312 13.875 1.00 0.00 O ATOM 1298 CB THR A 86 13.776 -8.205 15.939 1.00 0.00 C ATOM 1299 OG1 THR A 86 12.627 -7.917 16.719 1.00 0.00 O ATOM 1300 CG2 THR A 86 14.732 -7.011 16.037 1.00 0.00 C ATOM 0 H THR A 86 12.664 -10.509 14.559 1.00 0.00 H new ATOM 0 HA THR A 86 13.051 -7.649 13.987 1.00 0.00 H new ATOM 0 HB THR A 86 14.291 -9.087 16.320 1.00 0.00 H new ATOM 0 HG1 THR A 86 12.900 -7.699 17.635 1.00 0.00 H new ATOM 0 HG21 THR A 86 14.967 -6.818 17.084 1.00 0.00 H new ATOM 0 HG22 THR A 86 15.651 -7.235 15.495 1.00 0.00 H new ATOM 0 HG23 THR A 86 14.260 -6.130 15.602 1.00 0.00 H new ATOM 1308 N SER A 87 15.279 -8.278 12.966 1.00 0.00 N ATOM 1309 CA SER A 87 16.494 -8.599 12.224 1.00 0.00 C ATOM 1310 C SER A 87 17.417 -7.376 12.242 1.00 0.00 C ATOM 1311 O SER A 87 16.954 -6.249 12.423 1.00 0.00 O ATOM 1312 CB SER A 87 16.136 -8.998 10.783 1.00 0.00 C ATOM 1313 OG SER A 87 15.271 -10.120 10.755 1.00 0.00 O ATOM 0 H SER A 87 14.994 -7.306 12.847 1.00 0.00 H new ATOM 0 HA SER A 87 17.008 -9.441 12.687 1.00 0.00 H new ATOM 0 HB2 SER A 87 15.659 -8.157 10.279 1.00 0.00 H new ATOM 0 HB3 SER A 87 17.047 -9.226 10.230 1.00 0.00 H new ATOM 0 HG SER A 87 15.312 -10.542 9.872 1.00 0.00 H new ATOM 1319 N VAL A 88 18.725 -7.574 12.066 1.00 0.00 N ATOM 1320 CA VAL A 88 19.727 -6.513 12.156 1.00 0.00 C ATOM 1321 C VAL A 88 20.663 -6.655 10.952 1.00 0.00 C ATOM 1322 O VAL A 88 20.931 -7.776 10.501 1.00 0.00 O ATOM 1323 CB VAL A 88 20.459 -6.611 13.519 1.00 0.00 C ATOM 1324 CG1 VAL A 88 21.450 -5.453 13.724 1.00 0.00 C ATOM 1325 CG2 VAL A 88 19.489 -6.624 14.718 1.00 0.00 C ATOM 0 H VAL A 88 19.122 -8.489 11.854 1.00 0.00 H new ATOM 0 HA VAL A 88 19.279 -5.520 12.120 1.00 0.00 H new ATOM 0 HB VAL A 88 20.995 -7.559 13.482 1.00 0.00 H new ATOM 0 HG11 VAL A 88 21.941 -5.561 14.691 1.00 0.00 H new ATOM 0 HG12 VAL A 88 22.200 -5.471 12.933 1.00 0.00 H new ATOM 0 HG13 VAL A 88 20.913 -4.505 13.693 1.00 0.00 H new ATOM 0 HG21 VAL A 88 20.058 -6.694 15.645 1.00 0.00 H new ATOM 0 HG22 VAL A 88 18.902 -5.706 14.721 1.00 0.00 H new ATOM 0 HG23 VAL A 88 18.821 -7.482 14.636 1.00 0.00 H new ATOM 1335 N GLY A 89 21.170 -5.537 10.429 1.00 0.00 N ATOM 1336 CA GLY A 89 22.101 -5.529 9.310 1.00 0.00 C ATOM 1337 C GLY A 89 21.408 -5.819 7.977 1.00 0.00 C ATOM 1338 O GLY A 89 20.179 -5.898 7.894 1.00 0.00 O ATOM 0 H GLY A 89 20.941 -4.606 10.777 1.00 0.00 H new ATOM 0 HA2 GLY A 89 22.594 -4.558 9.257 1.00 0.00 H new ATOM 0 HA3 GLY A 89 22.879 -6.273 9.482 1.00 0.00 H new ATOM 1342 N PHE A 90 22.212 -5.947 6.920 1.00 0.00 N ATOM 1343 CA PHE A 90 21.732 -6.186 5.562 1.00 0.00 C ATOM 1344 C PHE A 90 21.048 -7.555 5.444 1.00 0.00 C ATOM 1345 O PHE A 90 21.454 -8.516 6.107 1.00 0.00 O ATOM 1346 CB PHE A 90 22.919 -6.098 4.589 1.00 0.00 C ATOM 1347 CG PHE A 90 22.544 -6.259 3.125 1.00 0.00 C ATOM 1348 CD1 PHE A 90 22.173 -5.134 2.363 1.00 0.00 C ATOM 1349 CD2 PHE A 90 22.546 -7.535 2.525 1.00 0.00 C ATOM 1350 CE1 PHE A 90 21.793 -5.284 1.018 1.00 0.00 C ATOM 1351 CE2 PHE A 90 22.159 -7.685 1.181 1.00 0.00 C ATOM 1352 CZ PHE A 90 21.781 -6.561 0.428 1.00 0.00 C ATOM 0 H PHE A 90 23.228 -5.886 6.986 1.00 0.00 H new ATOM 0 HA PHE A 90 20.991 -5.427 5.313 1.00 0.00 H new ATOM 0 HB2 PHE A 90 23.411 -5.134 4.722 1.00 0.00 H new ATOM 0 HB3 PHE A 90 23.646 -6.866 4.852 1.00 0.00 H new ATOM 0 HD1 PHE A 90 22.181 -4.153 2.814 1.00 0.00 H new ATOM 0 HD2 PHE A 90 22.845 -8.400 3.099 1.00 0.00 H new ATOM 0 HE1 PHE A 90 21.510 -4.418 0.437 1.00 0.00 H new ATOM 0 HE2 PHE A 90 22.152 -8.665 0.728 1.00 0.00 H new ATOM 0 HZ PHE A 90 21.481 -6.677 -0.603 1.00 0.00 H new ATOM 1362 N LYS A 91 20.053 -7.658 4.558 1.00 0.00 N ATOM 1363 CA LYS A 91 19.453 -8.911 4.105 1.00 0.00 C ATOM 1364 C LYS A 91 19.031 -8.702 2.645 1.00 0.00 C ATOM 1365 O LYS A 91 18.533 -7.618 2.329 1.00 0.00 O ATOM 1366 CB LYS A 91 18.228 -9.319 4.949 1.00 0.00 C ATOM 1367 CG LYS A 91 18.599 -10.131 6.201 1.00 0.00 C ATOM 1368 CD LYS A 91 18.604 -9.311 7.500 1.00 0.00 C ATOM 1369 CE LYS A 91 19.366 -10.081 8.591 1.00 0.00 C ATOM 1370 NZ LYS A 91 20.824 -9.812 8.555 1.00 0.00 N ATOM 0 H LYS A 91 19.629 -6.839 4.122 1.00 0.00 H new ATOM 0 HA LYS A 91 20.180 -9.716 4.209 1.00 0.00 H new ATOM 0 HB2 LYS A 91 17.689 -8.422 5.252 1.00 0.00 H new ATOM 0 HB3 LYS A 91 17.548 -9.906 4.331 1.00 0.00 H new ATOM 0 HG2 LYS A 91 17.895 -10.957 6.308 1.00 0.00 H new ATOM 0 HG3 LYS A 91 19.586 -10.570 6.057 1.00 0.00 H new ATOM 0 HD2 LYS A 91 19.073 -8.342 7.329 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.581 -9.117 7.824 1.00 0.00 H new ATOM 0 HE2 LYS A 91 18.972 -9.806 9.569 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.193 -11.150 8.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 21.345 -10.698 8.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.082 -9.423 7.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.069 -9.126 9.298 1.00 0.00 H new ATOM 1384 N PRO A 92 19.214 -9.699 1.761 1.00 0.00 N ATOM 1385 CA PRO A 92 18.756 -9.621 0.380 1.00 0.00 C ATOM 1386 C PRO A 92 17.229 -9.732 0.314 1.00 0.00 C ATOM 1387 O PRO A 92 16.587 -10.250 1.230 1.00 0.00 O ATOM 1388 CB PRO A 92 19.448 -10.784 -0.339 1.00 0.00 C ATOM 1389 CG PRO A 92 19.623 -11.827 0.763 1.00 0.00 C ATOM 1390 CD PRO A 92 19.875 -10.974 2.006 1.00 0.00 C ATOM 0 HA PRO A 92 19.004 -8.669 -0.089 1.00 0.00 H new ATOM 0 HB2 PRO A 92 18.842 -11.166 -1.161 1.00 0.00 H new ATOM 0 HB3 PRO A 92 20.406 -10.482 -0.762 1.00 0.00 H new ATOM 0 HG2 PRO A 92 18.735 -12.450 0.874 1.00 0.00 H new ATOM 0 HG3 PRO A 92 20.458 -12.496 0.557 1.00 0.00 H new ATOM 0 HD2 PRO A 92 19.474 -11.456 2.898 1.00 0.00 H new ATOM 0 HD3 PRO A 92 20.943 -10.834 2.173 1.00 0.00 H new ATOM 1398 N LYS A 93 16.641 -9.307 -0.810 1.00 0.00 N ATOM 1399 CA LYS A 93 15.189 -9.320 -1.020 1.00 0.00 C ATOM 1400 C LYS A 93 14.569 -10.703 -0.896 1.00 0.00 C ATOM 1401 O LYS A 93 13.400 -10.802 -0.533 1.00 0.00 O ATOM 1402 CB LYS A 93 14.819 -8.679 -2.367 1.00 0.00 C ATOM 1403 CG LYS A 93 15.492 -9.325 -3.589 1.00 0.00 C ATOM 1404 CD LYS A 93 15.254 -8.462 -4.831 1.00 0.00 C ATOM 1405 CE LYS A 93 15.857 -9.164 -6.055 1.00 0.00 C ATOM 1406 NZ LYS A 93 15.476 -8.508 -7.328 1.00 0.00 N ATOM 0 H LYS A 93 17.164 -8.941 -1.606 1.00 0.00 H new ATOM 0 HA LYS A 93 14.767 -8.721 -0.213 1.00 0.00 H new ATOM 0 HB2 LYS A 93 13.738 -8.731 -2.494 1.00 0.00 H new ATOM 0 HB3 LYS A 93 15.086 -7.623 -2.337 1.00 0.00 H new ATOM 0 HG2 LYS A 93 16.562 -9.434 -3.411 1.00 0.00 H new ATOM 0 HG3 LYS A 93 15.092 -10.326 -3.749 1.00 0.00 H new ATOM 0 HD2 LYS A 93 14.186 -8.302 -4.978 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.709 -7.480 -4.699 1.00 0.00 H new ATOM 0 HE2 LYS A 93 16.943 -9.174 -5.966 1.00 0.00 H new ATOM 0 HE3 LYS A 93 15.529 -10.203 -6.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 15.962 -8.977 -8.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 14.447 -8.580 -7.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 15.752 -7.506 -7.298 1.00 0.00 H new ATOM 1420 N GLU A 94 15.308 -11.761 -1.208 1.00 0.00 N ATOM 1421 CA GLU A 94 14.827 -13.128 -1.040 1.00 0.00 C ATOM 1422 C GLU A 94 14.633 -13.424 0.451 1.00 0.00 C ATOM 1423 O GLU A 94 13.550 -13.842 0.859 1.00 0.00 O ATOM 1424 CB GLU A 94 15.800 -14.126 -1.688 1.00 0.00 C ATOM 1425 CG GLU A 94 15.854 -13.970 -3.215 1.00 0.00 C ATOM 1426 CD GLU A 94 16.773 -15.024 -3.859 1.00 0.00 C ATOM 1427 OE1 GLU A 94 17.988 -14.764 -4.024 1.00 0.00 O ATOM 1428 OE2 GLU A 94 16.289 -16.118 -4.229 1.00 0.00 O ATOM 0 H GLU A 94 16.254 -11.697 -1.583 1.00 0.00 H new ATOM 0 HA GLU A 94 13.865 -13.237 -1.542 1.00 0.00 H new ATOM 0 HB2 GLU A 94 16.798 -13.981 -1.273 1.00 0.00 H new ATOM 0 HB3 GLU A 94 15.496 -15.143 -1.438 1.00 0.00 H new ATOM 0 HG2 GLU A 94 14.849 -14.062 -3.627 1.00 0.00 H new ATOM 0 HG3 GLU A 94 16.211 -12.972 -3.467 1.00 0.00 H new ATOM 1435 N ALA A 95 15.645 -13.141 1.280 1.00 0.00 N ATOM 1436 CA ALA A 95 15.568 -13.356 2.719 1.00 0.00 C ATOM 1437 C ALA A 95 14.488 -12.471 3.344 1.00 0.00 C ATOM 1438 O ALA A 95 13.754 -12.917 4.224 1.00 0.00 O ATOM 1439 CB ALA A 95 16.930 -13.081 3.365 1.00 0.00 C ATOM 0 H ALA A 95 16.537 -12.757 0.967 1.00 0.00 H new ATOM 0 HA ALA A 95 15.297 -14.396 2.900 1.00 0.00 H new ATOM 0 HB1 ALA A 95 16.862 -13.244 4.441 1.00 0.00 H new ATOM 0 HB2 ALA A 95 17.676 -13.754 2.942 1.00 0.00 H new ATOM 0 HB3 ALA A 95 17.222 -12.049 3.173 1.00 0.00 H new ATOM 1445 N LEU A 96 14.367 -11.229 2.871 1.00 0.00 N ATOM 1446 CA LEU A 96 13.340 -10.304 3.327 1.00 0.00 C ATOM 1447 C LEU A 96 11.946 -10.819 2.988 1.00 0.00 C ATOM 1448 O LEU A 96 11.062 -10.780 3.838 1.00 0.00 O ATOM 1449 CB LEU A 96 13.546 -8.919 2.708 1.00 0.00 C ATOM 1450 CG LEU A 96 14.789 -8.160 3.217 1.00 0.00 C ATOM 1451 CD1 LEU A 96 15.026 -6.909 2.369 1.00 0.00 C ATOM 1452 CD2 LEU A 96 14.650 -7.754 4.689 1.00 0.00 C ATOM 0 H LEU A 96 14.984 -10.840 2.158 1.00 0.00 H new ATOM 0 HA LEU A 96 13.426 -10.225 4.411 1.00 0.00 H new ATOM 0 HB2 LEU A 96 13.622 -9.028 1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 96 12.662 -8.313 2.906 1.00 0.00 H new ATOM 0 HG LEU A 96 15.639 -8.837 3.130 1.00 0.00 H new ATOM 0 HD11 LEU A 96 15.906 -6.381 2.737 1.00 0.00 H new ATOM 0 HD12 LEU A 96 15.185 -7.198 1.330 1.00 0.00 H new ATOM 0 HD13 LEU A 96 14.157 -6.255 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 96 15.547 -7.222 5.006 1.00 0.00 H new ATOM 0 HD22 LEU A 96 13.783 -7.105 4.807 1.00 0.00 H new ATOM 0 HD23 LEU A 96 14.521 -8.646 5.302 1.00 0.00 H new ATOM 1464 N GLN A 97 11.736 -11.330 1.775 1.00 0.00 N ATOM 1465 CA GLN A 97 10.458 -11.920 1.402 1.00 0.00 C ATOM 1466 C GLN A 97 10.150 -13.108 2.295 1.00 0.00 C ATOM 1467 O GLN A 97 9.015 -13.244 2.740 1.00 0.00 O ATOM 1468 CB GLN A 97 10.459 -12.373 -0.065 1.00 0.00 C ATOM 1469 CG GLN A 97 10.129 -11.217 -1.005 1.00 0.00 C ATOM 1470 CD GLN A 97 10.434 -11.575 -2.455 1.00 0.00 C ATOM 1471 OE1 GLN A 97 9.574 -12.029 -3.206 1.00 0.00 O ATOM 1472 NE2 GLN A 97 11.679 -11.392 -2.864 1.00 0.00 N ATOM 0 H GLN A 97 12.438 -11.345 1.035 1.00 0.00 H new ATOM 0 HA GLN A 97 9.691 -11.156 1.528 1.00 0.00 H new ATOM 0 HB2 GLN A 97 11.436 -12.784 -0.320 1.00 0.00 H new ATOM 0 HB3 GLN A 97 9.732 -13.173 -0.201 1.00 0.00 H new ATOM 0 HG2 GLN A 97 9.075 -10.956 -0.907 1.00 0.00 H new ATOM 0 HG3 GLN A 97 10.704 -10.337 -0.717 1.00 0.00 H new ATOM 0 HE21 GLN A 97 12.376 -11.014 -2.223 1.00 0.00 H new ATOM 0 HE22 GLN A 97 11.942 -11.629 -3.821 1.00 0.00 H new ATOM 1481 N GLU A 98 11.141 -13.949 2.586 1.00 0.00 N ATOM 1482 CA GLU A 98 10.935 -15.113 3.438 1.00 0.00 C ATOM 1483 C GLU A 98 10.533 -14.673 4.847 1.00 0.00 C ATOM 1484 O GLU A 98 9.609 -15.240 5.427 1.00 0.00 O ATOM 1485 CB GLU A 98 12.174 -16.022 3.464 1.00 0.00 C ATOM 1486 CG GLU A 98 12.311 -16.843 2.173 1.00 0.00 C ATOM 1487 CD GLU A 98 13.505 -17.811 2.246 1.00 0.00 C ATOM 1488 OE1 GLU A 98 14.647 -17.416 1.920 1.00 0.00 O ATOM 1489 OE2 GLU A 98 13.311 -18.993 2.616 1.00 0.00 O ATOM 0 H GLU A 98 12.096 -13.843 2.242 1.00 0.00 H new ATOM 0 HA GLU A 98 10.120 -15.702 3.018 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.068 -15.413 3.603 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.111 -16.697 4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.394 -17.406 2.000 1.00 0.00 H new ATOM 0 HG3 GLU A 98 12.437 -16.171 1.324 1.00 0.00 H new ATOM 1496 N LEU A 99 11.168 -13.624 5.372 1.00 0.00 N ATOM 1497 CA LEU A 99 10.866 -13.038 6.662 1.00 0.00 C ATOM 1498 C LEU A 99 9.431 -12.502 6.690 1.00 0.00 C ATOM 1499 O LEU A 99 8.699 -12.794 7.632 1.00 0.00 O ATOM 1500 CB LEU A 99 11.915 -11.948 6.916 1.00 0.00 C ATOM 1501 CG LEU A 99 11.678 -11.123 8.181 1.00 0.00 C ATOM 1502 CD1 LEU A 99 11.731 -11.998 9.436 1.00 0.00 C ATOM 1503 CD2 LEU A 99 12.738 -10.019 8.238 1.00 0.00 C ATOM 0 H LEU A 99 11.930 -13.149 4.888 1.00 0.00 H new ATOM 0 HA LEU A 99 10.916 -13.779 7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 99 12.898 -12.415 6.981 1.00 0.00 H new ATOM 0 HB3 LEU A 99 11.938 -11.276 6.058 1.00 0.00 H new ATOM 0 HG LEU A 99 10.682 -10.682 8.148 1.00 0.00 H new ATOM 0 HD11 LEU A 99 11.559 -11.381 10.318 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.961 -12.768 9.376 1.00 0.00 H new ATOM 0 HD13 LEU A 99 12.711 -12.470 9.509 1.00 0.00 H new ATOM 0 HD21 LEU A 99 12.588 -9.417 9.134 1.00 0.00 H new ATOM 0 HD22 LEU A 99 13.731 -10.469 8.265 1.00 0.00 H new ATOM 0 HD23 LEU A 99 12.651 -9.385 7.356 1.00 0.00 H new ATOM 1515 N VAL A 100 8.997 -11.774 5.658 1.00 0.00 N ATOM 1516 CA VAL A 100 7.611 -11.328 5.515 1.00 0.00 C ATOM 1517 C VAL A 100 6.679 -12.549 5.504 1.00 0.00 C ATOM 1518 O VAL A 100 5.656 -12.573 6.192 1.00 0.00 O ATOM 1519 CB VAL A 100 7.486 -10.478 4.229 1.00 0.00 C ATOM 1520 CG1 VAL A 100 6.038 -10.095 3.889 1.00 0.00 C ATOM 1521 CG2 VAL A 100 8.310 -9.182 4.307 1.00 0.00 C ATOM 0 H VAL A 100 9.603 -11.476 4.893 1.00 0.00 H new ATOM 0 HA VAL A 100 7.316 -10.703 6.357 1.00 0.00 H new ATOM 0 HB VAL A 100 7.874 -11.124 3.442 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.024 -9.500 2.976 1.00 0.00 H new ATOM 0 HG12 VAL A 100 5.447 -10.999 3.742 1.00 0.00 H new ATOM 0 HG13 VAL A 100 5.614 -9.514 4.708 1.00 0.00 H new ATOM 0 HG21 VAL A 100 8.191 -8.619 3.381 1.00 0.00 H new ATOM 0 HG22 VAL A 100 7.962 -8.579 5.146 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.362 -9.428 4.449 1.00 0.00 H new ATOM 1531 N ASN A 101 7.053 -13.584 4.749 1.00 0.00 N ATOM 1532 CA ASN A 101 6.248 -14.777 4.510 1.00 0.00 C ATOM 1533 C ASN A 101 5.970 -15.554 5.800 1.00 0.00 C ATOM 1534 O ASN A 101 4.929 -16.204 5.897 1.00 0.00 O ATOM 1535 CB ASN A 101 6.928 -15.655 3.448 1.00 0.00 C ATOM 1536 CG ASN A 101 5.965 -16.650 2.820 1.00 0.00 C ATOM 1537 OD1 ASN A 101 5.685 -17.714 3.364 1.00 0.00 O ATOM 1538 ND2 ASN A 101 5.460 -16.328 1.640 1.00 0.00 N ATOM 0 H ASN A 101 7.955 -13.613 4.273 1.00 0.00 H new ATOM 0 HA ASN A 101 5.274 -14.464 4.133 1.00 0.00 H new ATOM 0 HB2 ASN A 101 7.349 -15.019 2.669 1.00 0.00 H new ATOM 0 HB3 ASN A 101 7.759 -16.194 3.903 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.825 -16.969 1.165 1.00 0.00 H new ATOM 0 HD22 ASN A 101 5.706 -15.438 1.206 1.00 0.00 H new ATOM 1545 N LYS A 102 6.827 -15.431 6.827 1.00 0.00 N ATOM 1546 CA LYS A 102 6.578 -16.002 8.158 1.00 0.00 C ATOM 1547 C LYS A 102 5.269 -15.493 8.779 1.00 0.00 C ATOM 1548 O LYS A 102 4.737 -16.166 9.663 1.00 0.00 O ATOM 1549 CB LYS A 102 7.727 -15.688 9.140 1.00 0.00 C ATOM 1550 CG LYS A 102 9.096 -16.266 8.753 1.00 0.00 C ATOM 1551 CD LYS A 102 10.208 -15.957 9.771 1.00 0.00 C ATOM 1552 CE LYS A 102 9.985 -16.640 11.129 1.00 0.00 C ATOM 1553 NZ LYS A 102 11.179 -16.560 12.009 1.00 0.00 N ATOM 0 H LYS A 102 7.713 -14.931 6.756 1.00 0.00 H new ATOM 0 HA LYS A 102 6.507 -17.078 8.001 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.820 -14.606 9.231 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.456 -16.068 10.125 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.006 -17.347 8.643 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.386 -15.870 7.780 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.166 -16.277 9.362 1.00 0.00 H new ATOM 0 HD3 LYS A 102 10.269 -14.879 9.918 1.00 0.00 H new ATOM 0 HE2 LYS A 102 9.136 -16.175 11.631 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.726 -17.686 10.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 11.021 -17.134 12.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.011 -16.919 11.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 11.342 -15.570 12.284 1.00 0.00 H new ATOM 1567 N HIS A 103 4.751 -14.338 8.345 1.00 0.00 N ATOM 1568 CA HIS A 103 3.657 -13.637 9.015 1.00 0.00 C ATOM 1569 C HIS A 103 2.456 -13.367 8.102 1.00 0.00 C ATOM 1570 O HIS A 103 1.414 -12.927 8.594 1.00 0.00 O ATOM 1571 CB HIS A 103 4.207 -12.328 9.597 1.00 0.00 C ATOM 1572 CG HIS A 103 5.450 -12.535 10.424 1.00 0.00 C ATOM 1573 ND1 HIS A 103 5.557 -13.288 11.573 1.00 0.00 N ATOM 1574 CD2 HIS A 103 6.711 -12.115 10.098 1.00 0.00 C ATOM 1575 CE1 HIS A 103 6.849 -13.298 11.941 1.00 0.00 C ATOM 1576 NE2 HIS A 103 7.592 -12.594 11.071 1.00 0.00 N ATOM 0 H HIS A 103 5.086 -13.861 7.508 1.00 0.00 H new ATOM 0 HA HIS A 103 3.278 -14.282 9.807 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.428 -11.638 8.783 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.440 -11.859 10.213 1.00 0.00 H new ATOM 0 HD1 HIS A 103 4.791 -13.755 12.058 1.00 0.00 H new ATOM 0 HD2 HIS A 103 6.978 -11.518 9.239 1.00 0.00 H new ATOM 0 HE1 HIS A 103 7.236 -13.802 12.814 1.00 0.00 H new ATOM 1584 N LEU A 104 2.575 -13.625 6.794 1.00 0.00 N ATOM 1585 CA LEU A 104 1.448 -13.576 5.869 1.00 0.00 C ATOM 1586 C LEU A 104 0.388 -14.580 6.308 1.00 0.00 C ATOM 1587 O LEU A 104 -0.809 -14.239 6.253 1.00 0.00 O ATOM 1588 CB LEU A 104 1.886 -13.860 4.423 1.00 0.00 C ATOM 1589 CG LEU A 104 2.823 -12.809 3.804 1.00 0.00 C ATOM 1590 CD1 LEU A 104 3.143 -13.206 2.361 1.00 0.00 C ATOM 1591 CD2 LEU A 104 2.230 -11.396 3.825 1.00 0.00 C ATOM 1592 OXT LEU A 104 0.746 -15.724 6.666 1.00 0.00 O ATOM 0 H LEU A 104 3.460 -13.874 6.351 1.00 0.00 H new ATOM 0 HA LEU A 104 1.032 -12.569 5.890 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.384 -14.829 4.395 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.995 -13.941 3.800 1.00 0.00 H new ATOM 0 HG LEU A 104 3.729 -12.785 4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.807 -12.464 1.918 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.631 -14.181 2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.219 -13.257 1.784 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.936 -10.698 3.375 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.298 -11.384 3.260 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.033 -11.099 4.855 1.00 0.00 H new TER 1604 LEU A 104