USER MOD reduce.3.24.130724 H: found=0, std=0, add=1289, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1290 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 139 LYS NZ :NH3+ 166:sc=-0.00661 (180deg=-0.166) USER MOD Set 1.2: A 140 GLN : amide:sc= 0.969 K(o=0.96,f=-0.12) USER MOD Set 2.1: A 27 GLN : amide:sc= 0.354 K(o=0.76,f=-2.4) USER MOD Set 2.2: A 30 LYS NZ :NH3+ -129:sc= 0.409 (180deg=-0.542) USER MOD Single : A 2 SER OG : rot -35:sc= 0.124 USER MOD Single : A 5 GLN : amide:sc= -0.709 K(o=-0.71,f=-4!) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 10 HIS : no HD1:sc= -0.909 K(o=-0.91,f=-2.4) USER MOD Single : A 17 TYR OH : rot -19:sc= 0.0731 USER MOD Single : A 22 THR OG1 : rot -179:sc= 0.0185 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0.5 K(o=0.5,f=-0.099) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 85:sc= 1.21 USER MOD Single : A 45 GLN : amide:sc=-0.00588 K(o=-0.0059,f=-0.7) USER MOD Single : A 57 TYR OH : rot -166:sc= 0.949 USER MOD Single : A 59 MET CE :methyl 156:sc= -0.714 (180deg=-1.83!) USER MOD Single : A 61 GLN : amide:sc= -0.259 K(o=-0.26,f=-5.8!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 1.2 K(o=1.2,f=-0.0001) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.0489 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 78 SER OG : rot 155:sc= 0.917 USER MOD Single : A 83 THR OG1 : rot -18:sc= 0.187 USER MOD Single : A 94 MET CE :methyl -125:sc= -0.684 (180deg=-1.97!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= 0.675 K(o=0.67,f=-0.2) USER MOD Single : A 105 THR OG1 : rot -73:sc= 0.403 USER MOD Single : A 107 MET CE :methyl 180:sc= -1.61 (180deg=-1.61) USER MOD Single : A 111 SER OG : rot 180:sc= -0.308 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 170:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 78:sc= 0.044 USER MOD Single : A 131 THR OG1 : rot 76:sc= 1.29 USER MOD Single : A 141 THR OG1 : rot -19:sc= 0.799 USER MOD Single : B 28 MET CE :methyl -138:sc= 0 (180deg=-0.557) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 GLN : amide:sc= 0.702 K(o=0.7,f=-7!) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot 180:sc= 0 USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : B 48 MET CE :methyl 173:sc= -2.19 (180deg=-2.35) USER MOD Single : B 53 ASN : amide:sc= 0.271 K(o=0.27,f=-0.84) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 -7.633 -16.546 -6.113 1.00 0.00 N ATOM 19 CA SER A 2 -6.947 -15.949 -7.253 1.00 0.00 C ATOM 20 C SER A 2 -6.276 -14.627 -6.880 1.00 0.00 C ATOM 21 O SER A 2 -6.061 -13.772 -7.738 1.00 0.00 O ATOM 22 CB SER A 2 -7.947 -15.745 -8.391 1.00 0.00 C ATOM 23 OG SER A 2 -9.008 -14.918 -7.959 1.00 0.00 O ATOM 0 HA SER A 2 -6.157 -16.627 -7.577 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.448 -15.293 -9.248 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.337 -16.708 -8.721 1.00 0.00 H new ATOM 0 HG SER A 2 -9.201 -15.099 -7.015 1.00 0.00 H new ATOM 29 N LEU A 3 -5.943 -14.449 -5.596 1.00 0.00 N ATOM 30 CA LEU A 3 -5.323 -13.226 -5.104 1.00 0.00 C ATOM 31 C LEU A 3 -4.037 -12.905 -5.863 1.00 0.00 C ATOM 32 O LEU A 3 -3.739 -11.735 -6.101 1.00 0.00 O ATOM 33 CB LEU A 3 -5.025 -13.392 -3.608 1.00 0.00 C ATOM 34 CG LEU A 3 -4.289 -12.183 -3.013 1.00 0.00 C ATOM 35 CD1 LEU A 3 -5.121 -10.906 -3.121 1.00 0.00 C ATOM 36 CD2 LEU A 3 -3.983 -12.453 -1.543 1.00 0.00 C ATOM 0 H LEU A 3 -6.098 -15.152 -4.874 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.011 -12.395 -5.262 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -5.961 -13.543 -3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.423 -14.288 -3.459 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.368 -12.039 -3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.566 -10.073 -2.689 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -5.332 -10.697 -4.170 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -6.059 -11.036 -2.581 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -3.460 -11.597 -1.117 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -4.915 -12.616 -1.001 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.355 -13.340 -1.459 1.00 0.00 H new ATOM 48 N GLY A 4 -3.261 -13.924 -6.259 1.00 0.00 N ATOM 49 CA GLY A 4 -1.995 -13.695 -6.936 1.00 0.00 C ATOM 50 C GLY A 4 -2.192 -13.000 -8.281 1.00 0.00 C ATOM 51 O GLY A 4 -1.380 -12.167 -8.674 1.00 0.00 O ATOM 0 H GLY A 4 -3.494 -14.907 -6.119 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.349 -13.087 -6.303 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.487 -14.647 -7.089 1.00 0.00 H new ATOM 55 N GLN A 5 -3.277 -13.334 -8.987 1.00 0.00 N ATOM 56 CA GLN A 5 -3.621 -12.734 -10.270 1.00 0.00 C ATOM 57 C GLN A 5 -4.145 -11.308 -10.094 1.00 0.00 C ATOM 58 O GLN A 5 -4.516 -10.661 -11.073 1.00 0.00 O ATOM 59 CB GLN A 5 -4.665 -13.603 -10.975 1.00 0.00 C ATOM 60 CG GLN A 5 -4.082 -14.948 -11.422 1.00 0.00 C ATOM 61 CD GLN A 5 -3.765 -15.887 -10.261 1.00 0.00 C ATOM 62 OE1 GLN A 5 -4.452 -15.905 -9.244 1.00 0.00 O ATOM 63 NE2 GLN A 5 -2.712 -16.688 -10.406 1.00 0.00 N ATOM 0 H GLN A 5 -3.946 -14.038 -8.675 1.00 0.00 H new ATOM 0 HA GLN A 5 -2.720 -12.680 -10.881 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -5.506 -13.777 -10.303 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -5.055 -13.070 -11.842 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -4.789 -15.437 -12.093 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -3.171 -14.769 -11.994 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -2.158 -16.652 -11.262 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -2.459 -17.337 -9.661 1.00 0.00 H new ATOM 72 N GLN A 6 -4.178 -10.813 -8.853 1.00 0.00 N ATOM 73 CA GLN A 6 -4.653 -9.476 -8.530 1.00 0.00 C ATOM 74 C GLN A 6 -3.655 -8.743 -7.632 1.00 0.00 C ATOM 75 O GLN A 6 -3.907 -7.610 -7.227 1.00 0.00 O ATOM 76 CB GLN A 6 -6.020 -9.565 -7.849 1.00 0.00 C ATOM 77 CG GLN A 6 -7.029 -10.262 -8.765 1.00 0.00 C ATOM 78 CD GLN A 6 -8.440 -10.235 -8.185 1.00 0.00 C ATOM 79 OE1 GLN A 6 -8.625 -10.125 -6.975 1.00 0.00 O ATOM 80 NE2 GLN A 6 -9.447 -10.334 -9.050 1.00 0.00 N ATOM 0 H GLN A 6 -3.870 -11.342 -8.037 1.00 0.00 H new ATOM 0 HA GLN A 6 -4.750 -8.908 -9.455 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -5.931 -10.114 -6.911 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -6.375 -8.565 -7.601 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -7.029 -9.776 -9.741 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -6.722 -11.296 -8.923 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -9.255 -10.424 -10.048 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -10.410 -10.320 -8.715 1.00 0.00 H new ATOM 89 N LEU A 7 -2.527 -9.388 -7.322 1.00 0.00 N ATOM 90 CA LEU A 7 -1.467 -8.801 -6.518 1.00 0.00 C ATOM 91 C LEU A 7 -0.207 -8.624 -7.368 1.00 0.00 C ATOM 92 O LEU A 7 0.499 -7.631 -7.230 1.00 0.00 O ATOM 93 CB LEU A 7 -1.219 -9.719 -5.312 1.00 0.00 C ATOM 94 CG LEU A 7 -0.758 -8.964 -4.060 1.00 0.00 C ATOM 95 CD1 LEU A 7 -0.834 -9.904 -2.858 1.00 0.00 C ATOM 96 CD2 LEU A 7 0.682 -8.464 -4.166 1.00 0.00 C ATOM 0 H LEU A 7 -2.328 -10.341 -7.628 1.00 0.00 H new ATOM 0 HA LEU A 7 -1.753 -7.813 -6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -2.136 -10.262 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -0.466 -10.461 -5.578 1.00 0.00 H new ATOM 0 HG LEU A 7 -1.413 -8.100 -3.950 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.508 -9.376 -1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -1.861 -10.243 -2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.187 -10.765 -3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 7 0.953 -7.937 -3.251 1.00 0.00 H new ATOM 0 HD22 LEU A 7 1.352 -9.312 -4.308 1.00 0.00 H new ATOM 0 HD23 LEU A 7 0.770 -7.786 -5.015 1.00 0.00 H new ATOM 108 N ALA A 8 0.076 -9.586 -8.251 1.00 0.00 N ATOM 109 CA ALA A 8 1.253 -9.558 -9.106 1.00 0.00 C ATOM 110 C ALA A 8 1.335 -8.335 -10.029 1.00 0.00 C ATOM 111 O ALA A 8 2.416 -7.760 -10.149 1.00 0.00 O ATOM 112 CB ALA A 8 1.290 -10.844 -9.930 1.00 0.00 C ATOM 0 H ALA A 8 -0.512 -10.408 -8.389 1.00 0.00 H new ATOM 0 HA ALA A 8 2.120 -9.482 -8.450 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.168 -10.837 -10.576 1.00 0.00 H new ATOM 0 HB2 ALA A 8 1.339 -11.703 -9.261 1.00 0.00 H new ATOM 0 HB3 ALA A 8 0.390 -10.910 -10.541 1.00 0.00 H new ATOM 118 N PRO A 9 0.247 -7.902 -10.689 1.00 0.00 N ATOM 119 CA PRO A 9 0.296 -6.789 -11.627 1.00 0.00 C ATOM 120 C PRO A 9 0.444 -5.430 -10.932 1.00 0.00 C ATOM 121 O PRO A 9 0.521 -4.406 -11.613 1.00 0.00 O ATOM 122 CB PRO A 9 -1.012 -6.869 -12.413 1.00 0.00 C ATOM 123 CG PRO A 9 -1.978 -7.500 -11.415 1.00 0.00 C ATOM 124 CD PRO A 9 -1.095 -8.459 -10.627 1.00 0.00 C ATOM 0 HA PRO A 9 1.172 -6.866 -12.271 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -1.350 -5.884 -12.734 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.906 -7.477 -13.311 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -2.434 -6.750 -10.768 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -2.791 -8.024 -11.918 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -1.435 -8.546 -9.595 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -1.123 -9.460 -11.057 1.00 0.00 H new ATOM 132 N HIS A 10 0.485 -5.415 -9.597 1.00 0.00 N ATOM 133 CA HIS A 10 0.618 -4.190 -8.814 1.00 0.00 C ATOM 134 C HIS A 10 1.668 -4.370 -7.716 1.00 0.00 C ATOM 135 O HIS A 10 1.826 -3.525 -6.836 1.00 0.00 O ATOM 136 CB HIS A 10 -0.741 -3.829 -8.208 1.00 0.00 C ATOM 137 CG HIS A 10 -1.850 -3.804 -9.225 1.00 0.00 C ATOM 138 ND1 HIS A 10 -1.939 -2.941 -10.319 1.00 0.00 N ATOM 139 CD2 HIS A 10 -2.930 -4.636 -9.216 1.00 0.00 C ATOM 140 CE1 HIS A 10 -3.080 -3.277 -10.942 1.00 0.00 C ATOM 141 NE2 HIS A 10 -3.695 -4.287 -10.306 1.00 0.00 N ATOM 0 H HIS A 10 0.426 -6.260 -9.028 1.00 0.00 H new ATOM 0 HA HIS A 10 0.947 -3.379 -9.463 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -0.987 -4.549 -7.427 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -0.672 -2.852 -7.730 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -3.143 -5.414 -8.497 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -3.453 -2.799 -11.835 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -4.576 -4.720 -10.582 1.00 0.00 H new ATOM 149 N LEU A 11 2.387 -5.494 -7.772 1.00 0.00 N ATOM 150 CA LEU A 11 3.381 -5.905 -6.797 1.00 0.00 C ATOM 151 C LEU A 11 4.542 -4.919 -6.632 1.00 0.00 C ATOM 152 O LEU A 11 4.955 -4.675 -5.497 1.00 0.00 O ATOM 153 CB LEU A 11 3.873 -7.284 -7.239 1.00 0.00 C ATOM 154 CG LEU A 11 4.927 -7.922 -6.335 1.00 0.00 C ATOM 155 CD1 LEU A 11 4.471 -8.007 -4.883 1.00 0.00 C ATOM 156 CD2 LEU A 11 5.153 -9.346 -6.828 1.00 0.00 C ATOM 0 H LEU A 11 2.282 -6.165 -8.533 1.00 0.00 H new ATOM 0 HA LEU A 11 2.923 -5.934 -5.808 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.016 -7.955 -7.300 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.284 -7.200 -8.245 1.00 0.00 H new ATOM 0 HG LEU A 11 5.827 -7.309 -6.375 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.255 -8.468 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.267 -7.005 -4.507 1.00 0.00 H new ATOM 0 HD13 LEU A 11 3.565 -8.610 -4.821 1.00 0.00 H new ATOM 0 HD21 LEU A 11 5.902 -9.833 -6.203 1.00 0.00 H new ATOM 0 HD22 LEU A 11 4.218 -9.903 -6.773 1.00 0.00 H new ATOM 0 HD23 LEU A 11 5.501 -9.323 -7.861 1.00 0.00 H new ATOM 168 N PRO A 12 5.097 -4.332 -7.707 1.00 0.00 N ATOM 169 CA PRO A 12 6.254 -3.460 -7.592 1.00 0.00 C ATOM 170 C PRO A 12 5.882 -2.055 -7.123 1.00 0.00 C ATOM 171 O PRO A 12 6.766 -1.268 -6.794 1.00 0.00 O ATOM 172 CB PRO A 12 6.850 -3.419 -8.996 1.00 0.00 C ATOM 173 CG PRO A 12 5.612 -3.526 -9.884 1.00 0.00 C ATOM 174 CD PRO A 12 4.703 -4.474 -9.103 1.00 0.00 C ATOM 0 HA PRO A 12 6.954 -3.834 -6.845 1.00 0.00 H new ATOM 0 HB2 PRO A 12 7.400 -2.496 -9.176 1.00 0.00 H new ATOM 0 HB3 PRO A 12 7.544 -4.242 -9.166 1.00 0.00 H new ATOM 0 HG2 PRO A 12 5.143 -2.555 -10.039 1.00 0.00 H new ATOM 0 HG3 PRO A 12 5.856 -3.923 -10.869 1.00 0.00 H new ATOM 0 HD2 PRO A 12 3.654 -4.215 -9.243 1.00 0.00 H new ATOM 0 HD3 PRO A 12 4.825 -5.503 -9.442 1.00 0.00 H new ATOM 182 N PHE A 13 4.590 -1.716 -7.088 1.00 0.00 N ATOM 183 CA PHE A 13 4.168 -0.378 -6.696 1.00 0.00 C ATOM 184 C PHE A 13 4.475 -0.115 -5.221 1.00 0.00 C ATOM 185 O PHE A 13 4.547 1.042 -4.811 1.00 0.00 O ATOM 186 CB PHE A 13 2.674 -0.198 -6.961 1.00 0.00 C ATOM 187 CG PHE A 13 2.238 -0.345 -8.403 1.00 0.00 C ATOM 188 CD1 PHE A 13 3.169 -0.325 -9.457 1.00 0.00 C ATOM 189 CD2 PHE A 13 0.874 -0.495 -8.688 1.00 0.00 C ATOM 190 CE1 PHE A 13 2.738 -0.467 -10.783 1.00 0.00 C ATOM 191 CE2 PHE A 13 0.444 -0.631 -10.015 1.00 0.00 C ATOM 192 CZ PHE A 13 1.373 -0.621 -11.062 1.00 0.00 C ATOM 0 H PHE A 13 3.826 -2.349 -7.326 1.00 0.00 H new ATOM 0 HA PHE A 13 4.726 0.342 -7.294 1.00 0.00 H new ATOM 0 HB2 PHE A 13 2.128 -0.925 -6.360 1.00 0.00 H new ATOM 0 HB3 PHE A 13 2.379 0.791 -6.611 1.00 0.00 H new ATOM 0 HD1 PHE A 13 4.220 -0.200 -9.244 1.00 0.00 H new ATOM 0 HD2 PHE A 13 0.153 -0.506 -7.884 1.00 0.00 H new ATOM 0 HE1 PHE A 13 3.457 -0.458 -11.589 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -0.608 -0.744 -10.231 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.039 -0.732 -12.083 1.00 0.00 H new ATOM 202 N LEU A 14 4.659 -1.168 -4.419 1.00 0.00 N ATOM 203 CA LEU A 14 4.992 -1.003 -3.012 1.00 0.00 C ATOM 204 C LEU A 14 6.430 -0.504 -2.851 1.00 0.00 C ATOM 205 O LEU A 14 6.774 0.067 -1.819 1.00 0.00 O ATOM 206 CB LEU A 14 4.812 -2.331 -2.277 1.00 0.00 C ATOM 207 CG LEU A 14 3.389 -2.884 -2.384 1.00 0.00 C ATOM 208 CD1 LEU A 14 3.286 -4.173 -1.570 1.00 0.00 C ATOM 209 CD2 LEU A 14 2.377 -1.876 -1.844 1.00 0.00 C ATOM 0 H LEU A 14 4.582 -2.138 -4.724 1.00 0.00 H new ATOM 0 HA LEU A 14 4.321 -0.260 -2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.512 -3.062 -2.682 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.065 -2.196 -1.226 1.00 0.00 H new ATOM 0 HG LEU A 14 3.170 -3.079 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.274 -4.570 -1.644 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.993 -4.906 -1.959 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.518 -3.963 -0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.372 -2.288 -1.929 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.596 -1.666 -0.797 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.440 -0.953 -2.420 1.00 0.00 H new ATOM 221 N ARG A 15 7.269 -0.717 -3.871 1.00 0.00 N ATOM 222 CA ARG A 15 8.654 -0.274 -3.850 1.00 0.00 C ATOM 223 C ARG A 15 8.776 1.088 -4.528 1.00 0.00 C ATOM 224 O ARG A 15 9.728 1.822 -4.270 1.00 0.00 O ATOM 225 CB ARG A 15 9.507 -1.324 -4.568 1.00 0.00 C ATOM 226 CG ARG A 15 11.002 -1.049 -4.393 1.00 0.00 C ATOM 227 CD ARG A 15 11.817 -2.130 -5.099 1.00 0.00 C ATOM 228 NE ARG A 15 11.666 -2.051 -6.561 1.00 0.00 N ATOM 229 CZ ARG A 15 12.111 -2.985 -7.409 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.711 -4.082 -6.954 1.00 0.00 N ATOM 231 NH2 ARG A 15 11.956 -2.822 -8.720 1.00 0.00 N ATOM 0 H ARG A 15 7.001 -1.200 -4.728 1.00 0.00 H new ATOM 0 HA ARG A 15 9.003 -0.166 -2.823 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.270 -2.314 -4.179 1.00 0.00 H new ATOM 0 HB3 ARG A 15 9.259 -1.331 -5.629 1.00 0.00 H new ATOM 0 HG2 ARG A 15 11.250 -0.069 -4.802 1.00 0.00 H new ATOM 0 HG3 ARG A 15 11.254 -1.026 -3.333 1.00 0.00 H new ATOM 0 HD2 ARG A 15 12.869 -2.025 -4.835 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.498 -3.113 -4.752 1.00 0.00 H new ATOM 0 HE ARG A 15 11.194 -1.235 -6.951 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.835 -4.217 -5.951 1.00 0.00 H new ATOM 0 HH12 ARG A 15 13.047 -4.788 -7.609 1.00 0.00 H new ATOM 0 HH21 ARG A 15 11.498 -1.985 -9.079 1.00 0.00 H new ATOM 0 HH22 ARG A 15 12.296 -3.534 -9.366 1.00 0.00 H new ATOM 245 N ARG A 16 7.805 1.421 -5.388 1.00 0.00 N ATOM 246 CA ARG A 16 7.766 2.664 -6.153 1.00 0.00 C ATOM 247 C ARG A 16 7.845 3.887 -5.245 1.00 0.00 C ATOM 248 O ARG A 16 8.319 4.937 -5.665 1.00 0.00 O ATOM 249 CB ARG A 16 6.467 2.682 -6.963 1.00 0.00 C ATOM 250 CG ARG A 16 6.419 3.847 -7.957 1.00 0.00 C ATOM 251 CD ARG A 16 5.031 3.942 -8.582 1.00 0.00 C ATOM 252 NE ARG A 16 4.041 4.374 -7.585 1.00 0.00 N ATOM 253 CZ ARG A 16 2.728 4.163 -7.681 1.00 0.00 C ATOM 254 NH1 ARG A 16 2.206 3.511 -8.715 1.00 0.00 N ATOM 255 NH2 ARG A 16 1.915 4.609 -6.729 1.00 0.00 N ATOM 0 H ARG A 16 7.006 0.814 -5.572 1.00 0.00 H new ATOM 0 HA ARG A 16 8.630 2.706 -6.816 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.365 1.741 -7.504 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.618 2.752 -6.283 1.00 0.00 H new ATOM 0 HG2 ARG A 16 6.663 4.780 -7.449 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.168 3.703 -8.735 1.00 0.00 H new ATOM 0 HD2 ARG A 16 5.049 4.647 -9.413 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.744 2.973 -8.991 1.00 0.00 H new ATOM 0 HE ARG A 16 4.383 4.870 -6.762 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.813 3.160 -9.456 1.00 0.00 H new ATOM 0 HH12 ARG A 16 1.198 3.361 -8.767 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.296 5.111 -5.927 1.00 0.00 H new ATOM 0 HH22 ARG A 16 0.910 4.449 -6.800 1.00 0.00 H new ATOM 269 N TYR A 17 7.382 3.757 -3.999 1.00 0.00 N ATOM 270 CA TYR A 17 7.411 4.862 -3.049 1.00 0.00 C ATOM 271 C TYR A 17 7.790 4.392 -1.648 1.00 0.00 C ATOM 272 O TYR A 17 8.199 5.206 -0.822 1.00 0.00 O ATOM 273 CB TYR A 17 6.037 5.536 -3.021 1.00 0.00 C ATOM 274 CG TYR A 17 4.971 4.700 -2.347 1.00 0.00 C ATOM 275 CD1 TYR A 17 4.296 3.703 -3.068 1.00 0.00 C ATOM 276 CD2 TYR A 17 4.666 4.920 -0.993 1.00 0.00 C ATOM 277 CE1 TYR A 17 3.325 2.917 -2.437 1.00 0.00 C ATOM 278 CE2 TYR A 17 3.693 4.136 -0.359 1.00 0.00 C ATOM 279 CZ TYR A 17 3.017 3.129 -1.077 1.00 0.00 C ATOM 280 OH TYR A 17 2.068 2.373 -0.459 1.00 0.00 O ATOM 0 H TYR A 17 6.983 2.895 -3.628 1.00 0.00 H new ATOM 0 HA TYR A 17 8.171 5.573 -3.373 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.120 6.492 -2.503 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.726 5.753 -4.043 1.00 0.00 H new ATOM 0 HD1 TYR A 17 4.526 3.542 -4.111 1.00 0.00 H new ATOM 0 HD2 TYR A 17 5.181 5.693 -0.442 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.811 2.147 -2.992 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.460 4.304 0.682 1.00 0.00 H new ATOM 0 HH TYR A 17 1.493 1.955 -1.133 1.00 0.00 H new ATOM 290 N GLY A 18 7.665 3.091 -1.362 1.00 0.00 N ATOM 291 CA GLY A 18 8.015 2.561 -0.056 1.00 0.00 C ATOM 292 C GLY A 18 9.525 2.558 0.153 1.00 0.00 C ATOM 293 O GLY A 18 9.991 2.607 1.288 1.00 0.00 O ATOM 0 H GLY A 18 7.324 2.393 -2.023 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.539 3.159 0.721 1.00 0.00 H new ATOM 0 HA3 GLY A 18 7.630 1.546 0.042 1.00 0.00 H new ATOM 297 N ARG A 19 10.299 2.500 -0.941 1.00 0.00 N ATOM 298 CA ARG A 19 11.754 2.532 -0.856 1.00 0.00 C ATOM 299 C ARG A 19 12.263 3.968 -0.714 1.00 0.00 C ATOM 300 O ARG A 19 13.446 4.183 -0.453 1.00 0.00 O ATOM 301 CB ARG A 19 12.334 1.837 -2.088 1.00 0.00 C ATOM 302 CG ARG A 19 13.753 1.334 -1.813 1.00 0.00 C ATOM 303 CD ARG A 19 14.290 0.546 -3.009 1.00 0.00 C ATOM 304 NE ARG A 19 14.668 1.440 -4.107 1.00 0.00 N ATOM 305 CZ ARG A 19 15.073 1.020 -5.308 1.00 0.00 C ATOM 306 NH1 ARG A 19 15.106 -0.275 -5.607 1.00 0.00 N ATOM 307 NH2 ARG A 19 15.450 1.909 -6.219 1.00 0.00 N ATOM 0 H ARG A 19 9.935 2.431 -1.891 1.00 0.00 H new ATOM 0 HA ARG A 19 12.084 1.998 0.035 1.00 0.00 H new ATOM 0 HB2 ARG A 19 11.696 1.000 -2.373 1.00 0.00 H new ATOM 0 HB3 ARG A 19 12.346 2.530 -2.930 1.00 0.00 H new ATOM 0 HG2 ARG A 19 14.409 2.179 -1.604 1.00 0.00 H new ATOM 0 HG3 ARG A 19 13.754 0.702 -0.925 1.00 0.00 H new ATOM 0 HD2 ARG A 19 15.155 -0.042 -2.702 1.00 0.00 H new ATOM 0 HD3 ARG A 19 13.532 -0.158 -3.354 1.00 0.00 H new ATOM 0 HE ARG A 19 14.619 2.446 -3.944 1.00 0.00 H new ATOM 0 HH11 ARG A 19 14.819 -0.966 -4.914 1.00 0.00 H new ATOM 0 HH12 ARG A 19 15.418 -0.578 -6.530 1.00 0.00 H new ATOM 0 HH21 ARG A 19 15.429 2.905 -5.999 1.00 0.00 H new ATOM 0 HH22 ARG A 19 15.761 1.596 -7.139 1.00 0.00 H new ATOM 321 N ALA A 20 11.372 4.947 -0.885 1.00 0.00 N ATOM 322 CA ALA A 20 11.687 6.359 -0.730 1.00 0.00 C ATOM 323 C ALA A 20 11.025 6.920 0.528 1.00 0.00 C ATOM 324 O ALA A 20 11.191 8.097 0.849 1.00 0.00 O ATOM 325 CB ALA A 20 11.234 7.112 -1.978 1.00 0.00 C ATOM 0 H ALA A 20 10.399 4.773 -1.138 1.00 0.00 H new ATOM 0 HA ALA A 20 12.764 6.484 -0.615 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.467 8.171 -1.869 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.752 6.715 -2.851 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.159 6.989 -2.107 1.00 0.00 H new ATOM 331 N LEU A 21 10.272 6.076 1.242 1.00 0.00 N ATOM 332 CA LEU A 21 9.655 6.412 2.518 1.00 0.00 C ATOM 333 C LEU A 21 10.622 6.067 3.660 1.00 0.00 C ATOM 334 O LEU A 21 10.271 6.164 4.834 1.00 0.00 O ATOM 335 CB LEU A 21 8.340 5.629 2.622 1.00 0.00 C ATOM 336 CG LEU A 21 7.421 6.067 3.767 1.00 0.00 C ATOM 337 CD1 LEU A 21 7.013 7.534 3.631 1.00 0.00 C ATOM 338 CD2 LEU A 21 6.154 5.212 3.736 1.00 0.00 C ATOM 0 H LEU A 21 10.074 5.123 0.938 1.00 0.00 H new ATOM 0 HA LEU A 21 9.439 7.478 2.589 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.798 5.729 1.681 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.572 4.571 2.745 1.00 0.00 H new ATOM 0 HG LEU A 21 7.963 5.942 4.704 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.362 7.809 4.461 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.904 8.162 3.645 1.00 0.00 H new ATOM 0 HD13 LEU A 21 6.482 7.678 2.690 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.491 5.514 4.547 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.646 5.349 2.782 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.421 4.162 3.858 1.00 0.00 H new ATOM 350 N THR A 22 11.847 5.661 3.307 1.00 0.00 N ATOM 351 CA THR A 22 12.851 5.201 4.257 1.00 0.00 C ATOM 352 C THR A 22 14.255 5.660 3.869 1.00 0.00 C ATOM 353 O THR A 22 15.171 5.584 4.685 1.00 0.00 O ATOM 354 CB THR A 22 12.845 3.671 4.309 1.00 0.00 C ATOM 355 OG1 THR A 22 13.322 3.161 3.085 1.00 0.00 O ATOM 356 CG2 THR A 22 11.453 3.093 4.549 1.00 0.00 C ATOM 0 H THR A 22 12.167 5.645 2.339 1.00 0.00 H new ATOM 0 HA THR A 22 12.599 5.627 5.228 1.00 0.00 H new ATOM 0 HB THR A 22 13.483 3.381 5.144 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.306 2.181 3.110 1.00 0.00 H new ATOM 0 HG21 THR A 22 11.511 2.005 4.576 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.066 3.460 5.500 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.787 3.401 3.743 1.00 0.00 H new ATOM 364 N GLY A 23 14.445 6.135 2.631 1.00 0.00 N ATOM 365 CA GLY A 23 15.741 6.586 2.148 1.00 0.00 C ATOM 366 C GLY A 23 16.779 5.463 2.086 1.00 0.00 C ATOM 367 O GLY A 23 17.969 5.742 1.946 1.00 0.00 O ATOM 0 H GLY A 23 13.698 6.214 1.941 1.00 0.00 H new ATOM 0 HA2 GLY A 23 15.622 7.019 1.155 1.00 0.00 H new ATOM 0 HA3 GLY A 23 16.110 7.379 2.799 1.00 0.00 H new ATOM 371 N SER A 24 16.344 4.203 2.189 1.00 0.00 N ATOM 372 CA SER A 24 17.249 3.061 2.179 1.00 0.00 C ATOM 373 C SER A 24 16.630 1.902 1.409 1.00 0.00 C ATOM 374 O SER A 24 15.464 1.561 1.609 1.00 0.00 O ATOM 375 CB SER A 24 17.549 2.644 3.619 1.00 0.00 C ATOM 376 OG SER A 24 18.317 1.459 3.618 1.00 0.00 O ATOM 0 H SER A 24 15.360 3.952 2.281 1.00 0.00 H new ATOM 0 HA SER A 24 18.179 3.341 1.683 1.00 0.00 H new ATOM 0 HB2 SER A 24 18.089 3.439 4.134 1.00 0.00 H new ATOM 0 HB3 SER A 24 16.618 2.486 4.164 1.00 0.00 H new ATOM 0 HG SER A 24 18.510 1.194 4.541 1.00 0.00 H new ATOM 382 N GLN A 25 17.414 1.286 0.519 1.00 0.00 N ATOM 383 CA GLN A 25 16.916 0.207 -0.318 1.00 0.00 C ATOM 384 C GLN A 25 16.661 -1.055 0.503 1.00 0.00 C ATOM 385 O GLN A 25 15.815 -1.868 0.136 1.00 0.00 O ATOM 386 CB GLN A 25 17.912 -0.079 -1.444 1.00 0.00 C ATOM 387 CG GLN A 25 18.110 1.162 -2.318 1.00 0.00 C ATOM 388 CD GLN A 25 19.094 0.890 -3.452 1.00 0.00 C ATOM 389 OE1 GLN A 25 18.985 -0.109 -4.159 1.00 0.00 O ATOM 390 NE2 GLN A 25 20.070 1.772 -3.638 1.00 0.00 N ATOM 0 H GLN A 25 18.395 1.521 0.365 1.00 0.00 H new ATOM 0 HA GLN A 25 15.966 0.519 -0.752 1.00 0.00 H new ATOM 0 HB2 GLN A 25 18.868 -0.389 -1.021 1.00 0.00 H new ATOM 0 HB3 GLN A 25 17.551 -0.906 -2.055 1.00 0.00 H new ATOM 0 HG2 GLN A 25 17.151 1.474 -2.732 1.00 0.00 H new ATOM 0 HG3 GLN A 25 18.476 1.986 -1.706 1.00 0.00 H new ATOM 0 HE21 GLN A 25 20.137 2.593 -3.036 1.00 0.00 H new ATOM 0 HE22 GLN A 25 20.752 1.628 -4.383 1.00 0.00 H new ATOM 399 N ASN A 26 17.386 -1.224 1.613 1.00 0.00 N ATOM 400 CA ASN A 26 17.226 -2.395 2.458 1.00 0.00 C ATOM 401 C ASN A 26 15.939 -2.301 3.278 1.00 0.00 C ATOM 402 O ASN A 26 15.279 -3.311 3.512 1.00 0.00 O ATOM 403 CB ASN A 26 18.439 -2.496 3.387 1.00 0.00 C ATOM 404 CG ASN A 26 18.377 -3.742 4.259 1.00 0.00 C ATOM 405 OD1 ASN A 26 18.013 -4.820 3.798 1.00 0.00 O ATOM 406 ND2 ASN A 26 18.734 -3.603 5.532 1.00 0.00 N ATOM 0 H ASN A 26 18.088 -0.560 1.941 1.00 0.00 H new ATOM 0 HA ASN A 26 17.159 -3.286 1.834 1.00 0.00 H new ATOM 0 HB2 ASN A 26 19.352 -2.513 2.793 1.00 0.00 H new ATOM 0 HB3 ASN A 26 18.487 -1.610 4.020 1.00 0.00 H new ATOM 0 HD21 ASN A 26 18.711 -4.407 6.159 1.00 0.00 H new ATOM 0 HD22 ASN A 26 19.031 -2.692 5.882 1.00 0.00 H new ATOM 413 N GLN A 27 15.578 -1.090 3.714 1.00 0.00 N ATOM 414 CA GLN A 27 14.377 -0.886 4.511 1.00 0.00 C ATOM 415 C GLN A 27 13.128 -0.952 3.639 1.00 0.00 C ATOM 416 O GLN A 27 12.078 -1.388 4.103 1.00 0.00 O ATOM 417 CB GLN A 27 14.450 0.483 5.194 1.00 0.00 C ATOM 418 CG GLN A 27 15.479 0.495 6.325 1.00 0.00 C ATOM 419 CD GLN A 27 15.017 -0.363 7.497 1.00 0.00 C ATOM 420 OE1 GLN A 27 15.460 -1.494 7.667 1.00 0.00 O ATOM 421 NE2 GLN A 27 14.115 0.172 8.316 1.00 0.00 N ATOM 0 H GLN A 27 16.106 -0.238 3.525 1.00 0.00 H new ATOM 0 HA GLN A 27 14.318 -1.676 5.260 1.00 0.00 H new ATOM 0 HB2 GLN A 27 14.709 1.244 4.458 1.00 0.00 H new ATOM 0 HB3 GLN A 27 13.469 0.745 5.591 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.435 0.125 5.955 1.00 0.00 H new ATOM 0 HG3 GLN A 27 15.642 1.519 6.662 1.00 0.00 H new ATOM 0 HE21 GLN A 27 13.768 1.116 8.145 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.771 -0.362 9.114 1.00 0.00 H new ATOM 430 N GLY A 28 13.225 -0.522 2.380 1.00 0.00 N ATOM 431 CA GLY A 28 12.073 -0.537 1.498 1.00 0.00 C ATOM 432 C GLY A 28 11.739 -1.959 1.063 1.00 0.00 C ATOM 433 O GLY A 28 10.567 -2.332 1.034 1.00 0.00 O ATOM 0 H GLY A 28 14.082 -0.164 1.958 1.00 0.00 H new ATOM 0 HA2 GLY A 28 11.215 -0.097 2.006 1.00 0.00 H new ATOM 0 HA3 GLY A 28 12.274 0.078 0.621 1.00 0.00 H new ATOM 437 N ASP A 29 12.755 -2.758 0.728 1.00 0.00 N ATOM 438 CA ASP A 29 12.526 -4.112 0.252 1.00 0.00 C ATOM 439 C ASP A 29 12.062 -5.029 1.383 1.00 0.00 C ATOM 440 O ASP A 29 11.353 -5.999 1.119 1.00 0.00 O ATOM 441 CB ASP A 29 13.803 -4.671 -0.379 1.00 0.00 C ATOM 442 CG ASP A 29 14.181 -3.959 -1.681 1.00 0.00 C ATOM 443 OD1 ASP A 29 13.306 -3.274 -2.255 1.00 0.00 O ATOM 444 OD2 ASP A 29 15.353 -4.109 -2.091 1.00 0.00 O ATOM 0 H ASP A 29 13.737 -2.487 0.779 1.00 0.00 H new ATOM 0 HA ASP A 29 11.737 -4.073 -0.499 1.00 0.00 H new ATOM 0 HB2 ASP A 29 14.624 -4.580 0.332 1.00 0.00 H new ATOM 0 HB3 ASP A 29 13.670 -5.735 -0.577 1.00 0.00 H new ATOM 449 N LYS A 30 12.441 -4.749 2.637 1.00 0.00 N ATOM 450 CA LYS A 30 12.029 -5.614 3.736 1.00 0.00 C ATOM 451 C LYS A 30 10.615 -5.295 4.206 1.00 0.00 C ATOM 452 O LYS A 30 9.948 -6.178 4.738 1.00 0.00 O ATOM 453 CB LYS A 30 13.063 -5.593 4.875 1.00 0.00 C ATOM 454 CG LYS A 30 13.108 -4.321 5.724 1.00 0.00 C ATOM 455 CD LYS A 30 11.989 -4.256 6.770 1.00 0.00 C ATOM 456 CE LYS A 30 12.307 -3.189 7.818 1.00 0.00 C ATOM 457 NZ LYS A 30 13.478 -3.561 8.638 1.00 0.00 N ATOM 0 H LYS A 30 13.017 -3.951 2.906 1.00 0.00 H new ATOM 0 HA LYS A 30 11.995 -6.639 3.366 1.00 0.00 H new ATOM 0 HB2 LYS A 30 12.864 -6.438 5.534 1.00 0.00 H new ATOM 0 HB3 LYS A 30 14.051 -5.752 4.443 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.072 -4.262 6.228 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.037 -3.452 5.070 1.00 0.00 H new ATOM 0 HD2 LYS A 30 11.040 -4.028 6.284 1.00 0.00 H new ATOM 0 HD3 LYS A 30 11.875 -5.227 7.252 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.497 -2.237 7.322 1.00 0.00 H new ATOM 0 HE3 LYS A 30 11.441 -3.044 8.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 13.238 -3.474 9.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 13.749 -4.543 8.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 14.273 -2.928 8.416 1.00 0.00 H new ATOM 471 N TYR A 31 10.138 -4.059 4.022 1.00 0.00 N ATOM 472 CA TYR A 31 8.764 -3.738 4.385 1.00 0.00 C ATOM 473 C TYR A 31 7.802 -4.350 3.370 1.00 0.00 C ATOM 474 O TYR A 31 6.685 -4.713 3.729 1.00 0.00 O ATOM 475 CB TYR A 31 8.558 -2.220 4.456 1.00 0.00 C ATOM 476 CG TYR A 31 9.114 -1.548 5.695 1.00 0.00 C ATOM 477 CD1 TYR A 31 8.907 -2.123 6.961 1.00 0.00 C ATOM 478 CD2 TYR A 31 9.818 -0.340 5.584 1.00 0.00 C ATOM 479 CE1 TYR A 31 9.404 -1.493 8.110 1.00 0.00 C ATOM 480 CE2 TYR A 31 10.319 0.294 6.732 1.00 0.00 C ATOM 481 CZ TYR A 31 10.121 -0.286 8.000 1.00 0.00 C ATOM 482 OH TYR A 31 10.619 0.319 9.113 1.00 0.00 O ATOM 0 H TYR A 31 10.674 -3.283 3.632 1.00 0.00 H new ATOM 0 HA TYR A 31 8.561 -4.157 5.371 1.00 0.00 H new ATOM 0 HB2 TYR A 31 9.019 -1.766 3.579 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.490 -2.012 4.398 1.00 0.00 H new ATOM 0 HD1 TYR A 31 8.364 -3.052 7.048 1.00 0.00 H new ATOM 0 HD2 TYR A 31 9.975 0.104 4.612 1.00 0.00 H new ATOM 0 HE1 TYR A 31 9.237 -1.934 9.082 1.00 0.00 H new ATOM 0 HE2 TYR A 31 10.856 1.227 6.643 1.00 0.00 H new ATOM 0 HH TYR A 31 11.087 1.141 8.857 1.00 0.00 H new ATOM 492 N VAL A 32 8.227 -4.471 2.108 1.00 0.00 N ATOM 493 CA VAL A 32 7.413 -5.088 1.072 1.00 0.00 C ATOM 494 C VAL A 32 7.171 -6.560 1.400 1.00 0.00 C ATOM 495 O VAL A 32 6.028 -7.019 1.410 1.00 0.00 O ATOM 496 CB VAL A 32 8.137 -4.942 -0.275 1.00 0.00 C ATOM 497 CG1 VAL A 32 7.553 -5.873 -1.334 1.00 0.00 C ATOM 498 CG2 VAL A 32 8.014 -3.501 -0.762 1.00 0.00 C ATOM 0 H VAL A 32 9.138 -4.145 1.784 1.00 0.00 H new ATOM 0 HA VAL A 32 6.443 -4.594 1.016 1.00 0.00 H new ATOM 0 HB VAL A 32 9.183 -5.210 -0.123 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.092 -5.740 -2.272 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.650 -6.907 -1.003 1.00 0.00 H new ATOM 0 HG13 VAL A 32 6.499 -5.638 -1.484 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.527 -3.395 -1.718 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.961 -3.247 -0.885 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.466 -2.830 -0.031 1.00 0.00 H new ATOM 508 N ARG A 33 8.244 -7.307 1.675 1.00 0.00 N ATOM 509 CA ARG A 33 8.113 -8.733 1.929 1.00 0.00 C ATOM 510 C ARG A 33 7.509 -9.001 3.307 1.00 0.00 C ATOM 511 O ARG A 33 6.865 -10.027 3.505 1.00 0.00 O ATOM 512 CB ARG A 33 9.483 -9.386 1.772 1.00 0.00 C ATOM 513 CG ARG A 33 9.333 -10.902 1.647 1.00 0.00 C ATOM 514 CD ARG A 33 10.671 -11.524 1.254 1.00 0.00 C ATOM 515 NE ARG A 33 11.673 -11.370 2.317 1.00 0.00 N ATOM 516 CZ ARG A 33 12.937 -11.792 2.206 1.00 0.00 C ATOM 517 NH1 ARG A 33 13.362 -12.394 1.100 1.00 0.00 N ATOM 518 NH2 ARG A 33 13.784 -11.607 3.215 1.00 0.00 N ATOM 0 H ARG A 33 9.198 -6.949 1.726 1.00 0.00 H new ATOM 0 HA ARG A 33 7.425 -9.170 1.205 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.984 -8.989 0.890 1.00 0.00 H new ATOM 0 HB3 ARG A 33 10.110 -9.145 2.631 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.990 -11.322 2.593 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.577 -11.141 0.899 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.531 -12.583 1.036 1.00 0.00 H new ATOM 0 HD3 ARG A 33 11.035 -11.056 0.339 1.00 0.00 H new ATOM 0 HE ARG A 33 11.390 -10.917 3.186 1.00 0.00 H new ATOM 0 HH11 ARG A 33 12.721 -12.540 0.320 1.00 0.00 H new ATOM 0 HH12 ARG A 33 14.329 -12.710 1.031 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.468 -11.145 4.068 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.749 -11.927 3.136 1.00 0.00 H new ATOM 532 N ALA A 34 7.711 -8.084 4.257 1.00 0.00 N ATOM 533 CA ALA A 34 7.122 -8.210 5.580 1.00 0.00 C ATOM 534 C ALA A 34 5.616 -7.957 5.528 1.00 0.00 C ATOM 535 O ALA A 34 4.879 -8.445 6.385 1.00 0.00 O ATOM 536 CB ALA A 34 7.791 -7.220 6.534 1.00 0.00 C ATOM 0 H ALA A 34 8.280 -7.247 4.128 1.00 0.00 H new ATOM 0 HA ALA A 34 7.283 -9.226 5.941 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.349 -7.315 7.526 1.00 0.00 H new ATOM 0 HB2 ALA A 34 8.858 -7.434 6.591 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.643 -6.204 6.167 1.00 0.00 H new ATOM 542 N THR A 35 5.148 -7.197 4.529 1.00 0.00 N ATOM 543 CA THR A 35 3.724 -6.933 4.379 1.00 0.00 C ATOM 544 C THR A 35 2.979 -8.219 4.069 1.00 0.00 C ATOM 545 O THR A 35 1.939 -8.467 4.673 1.00 0.00 O ATOM 546 CB THR A 35 3.462 -5.913 3.267 1.00 0.00 C ATOM 547 OG1 THR A 35 4.043 -4.675 3.603 1.00 0.00 O ATOM 548 CG2 THR A 35 1.964 -5.700 3.072 1.00 0.00 C ATOM 0 H THR A 35 5.737 -6.760 3.820 1.00 0.00 H new ATOM 0 HA THR A 35 3.364 -6.520 5.321 1.00 0.00 H new ATOM 0 HB THR A 35 3.900 -6.301 2.347 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.984 -4.670 3.328 1.00 0.00 H new ATOM 0 HG21 THR A 35 1.800 -4.972 2.278 1.00 0.00 H new ATOM 0 HG22 THR A 35 1.494 -6.645 2.800 1.00 0.00 H new ATOM 0 HG23 THR A 35 1.525 -5.330 3.999 1.00 0.00 H new ATOM 556 N LEU A 36 3.495 -9.040 3.147 1.00 0.00 N ATOM 557 CA LEU A 36 2.805 -10.271 2.782 1.00 0.00 C ATOM 558 C LEU A 36 2.924 -11.306 3.900 1.00 0.00 C ATOM 559 O LEU A 36 1.998 -12.072 4.138 1.00 0.00 O ATOM 560 CB LEU A 36 3.380 -10.796 1.459 1.00 0.00 C ATOM 561 CG LEU A 36 2.377 -11.580 0.594 1.00 0.00 C ATOM 562 CD1 LEU A 36 1.763 -12.785 1.296 1.00 0.00 C ATOM 563 CD2 LEU A 36 1.241 -10.672 0.129 1.00 0.00 C ATOM 0 H LEU A 36 4.371 -8.875 2.651 1.00 0.00 H new ATOM 0 HA LEU A 36 1.743 -10.070 2.644 1.00 0.00 H new ATOM 0 HB2 LEU A 36 3.757 -9.952 0.881 1.00 0.00 H new ATOM 0 HB3 LEU A 36 4.232 -11.439 1.678 1.00 0.00 H new ATOM 0 HG LEU A 36 2.959 -11.948 -0.250 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.068 -13.284 0.621 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.552 -13.480 1.583 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.229 -12.454 2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.543 -11.246 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.718 -10.270 0.997 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.649 -9.852 -0.461 1.00 0.00 H new ATOM 575 N GLU A 37 4.059 -11.344 4.601 1.00 0.00 N ATOM 576 CA GLU A 37 4.241 -12.305 5.680 1.00 0.00 C ATOM 577 C GLU A 37 3.226 -12.057 6.798 1.00 0.00 C ATOM 578 O GLU A 37 2.902 -12.967 7.559 1.00 0.00 O ATOM 579 CB GLU A 37 5.679 -12.210 6.203 1.00 0.00 C ATOM 580 CG GLU A 37 6.070 -13.423 7.048 1.00 0.00 C ATOM 581 CD GLU A 37 6.217 -14.686 6.195 1.00 0.00 C ATOM 582 OE1 GLU A 37 7.143 -14.707 5.355 1.00 0.00 O ATOM 583 OE2 GLU A 37 5.408 -15.622 6.388 1.00 0.00 O ATOM 0 H GLU A 37 4.855 -10.727 4.441 1.00 0.00 H new ATOM 0 HA GLU A 37 4.070 -13.313 5.303 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.365 -12.121 5.360 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.787 -11.304 6.800 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.009 -13.220 7.562 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.315 -13.589 7.817 1.00 0.00 H new ATOM 590 N ALA A 38 2.715 -10.820 6.896 1.00 0.00 N ATOM 591 CA ALA A 38 1.683 -10.466 7.862 1.00 0.00 C ATOM 592 C ALA A 38 0.289 -10.901 7.388 1.00 0.00 C ATOM 593 O ALA A 38 -0.696 -10.681 8.090 1.00 0.00 O ATOM 594 CB ALA A 38 1.720 -8.958 8.092 1.00 0.00 C ATOM 0 H ALA A 38 3.010 -10.043 6.305 1.00 0.00 H new ATOM 0 HA ALA A 38 1.883 -10.992 8.796 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.951 -8.681 8.814 1.00 0.00 H new ATOM 0 HB2 ALA A 38 2.699 -8.673 8.477 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.536 -8.442 7.150 1.00 0.00 H new ATOM 600 N ILE A 39 0.205 -11.518 6.204 1.00 0.00 N ATOM 601 CA ILE A 39 -1.050 -11.994 5.635 1.00 0.00 C ATOM 602 C ILE A 39 -1.061 -13.525 5.631 1.00 0.00 C ATOM 603 O ILE A 39 -2.123 -14.137 5.541 1.00 0.00 O ATOM 604 CB ILE A 39 -1.191 -11.470 4.194 1.00 0.00 C ATOM 605 CG1 ILE A 39 -0.869 -9.975 4.044 1.00 0.00 C ATOM 606 CG2 ILE A 39 -2.596 -11.739 3.663 1.00 0.00 C ATOM 607 CD1 ILE A 39 -1.815 -9.038 4.791 1.00 0.00 C ATOM 0 H ILE A 39 1.016 -11.700 5.613 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.884 -11.629 6.235 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.451 -12.015 3.608 1.00 0.00 H new ATOM 0 HG12 ILE A 39 0.147 -9.799 4.397 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -0.887 -9.718 2.985 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -2.678 -11.362 2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -2.788 -12.812 3.670 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.327 -11.235 4.296 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.509 -8.005 4.626 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.832 -9.178 4.423 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.781 -9.261 5.857 1.00 0.00 H new ATOM 619 N VAL A 40 0.119 -14.148 5.730 1.00 0.00 N ATOM 620 CA VAL A 40 0.282 -15.605 5.738 1.00 0.00 C ATOM 621 C VAL A 40 -0.459 -16.285 6.891 1.00 0.00 C ATOM 622 O VAL A 40 -0.624 -17.503 6.880 1.00 0.00 O ATOM 623 CB VAL A 40 1.783 -15.922 5.779 1.00 0.00 C ATOM 624 CG1 VAL A 40 2.088 -17.409 5.964 1.00 0.00 C ATOM 625 CG2 VAL A 40 2.421 -15.492 4.461 1.00 0.00 C ATOM 0 H VAL A 40 1.002 -13.644 5.808 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.167 -16.007 4.830 1.00 0.00 H new ATOM 0 HB VAL A 40 2.185 -15.382 6.637 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.167 -17.559 5.984 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.656 -17.755 6.903 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.658 -17.974 5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 40 3.488 -15.714 4.484 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.955 -16.033 3.638 1.00 0.00 H new ATOM 0 HG23 VAL A 40 2.277 -14.421 4.319 1.00 0.00 H new ATOM 635 N ALA A 41 -0.912 -15.521 7.889 1.00 0.00 N ATOM 636 CA ALA A 41 -1.606 -16.075 9.041 1.00 0.00 C ATOM 637 C ALA A 41 -2.995 -15.458 9.198 1.00 0.00 C ATOM 638 O ALA A 41 -3.711 -15.776 10.149 1.00 0.00 O ATOM 639 CB ALA A 41 -0.760 -15.839 10.286 1.00 0.00 C ATOM 0 H ALA A 41 -0.806 -14.507 7.916 1.00 0.00 H new ATOM 0 HA ALA A 41 -1.747 -17.146 8.895 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -1.271 -16.251 11.156 1.00 0.00 H new ATOM 0 HB2 ALA A 41 0.207 -16.329 10.167 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -0.610 -14.769 10.426 1.00 0.00 H new ATOM 645 N ALA A 42 -3.372 -14.575 8.269 1.00 0.00 N ATOM 646 CA ALA A 42 -4.642 -13.872 8.311 1.00 0.00 C ATOM 647 C ALA A 42 -4.996 -13.324 6.924 1.00 0.00 C ATOM 648 O ALA A 42 -5.163 -12.115 6.760 1.00 0.00 O ATOM 649 CB ALA A 42 -4.544 -12.750 9.349 1.00 0.00 C ATOM 0 H ALA A 42 -2.795 -14.331 7.464 1.00 0.00 H new ATOM 0 HA ALA A 42 -5.440 -14.556 8.600 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.491 -12.211 9.393 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -4.324 -13.178 10.327 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -3.748 -12.061 9.066 1.00 0.00 H new ATOM 655 N PRO A 43 -5.115 -14.194 5.909 1.00 0.00 N ATOM 656 CA PRO A 43 -5.354 -13.791 4.531 1.00 0.00 C ATOM 657 C PRO A 43 -6.715 -13.124 4.340 1.00 0.00 C ATOM 658 O PRO A 43 -6.974 -12.553 3.284 1.00 0.00 O ATOM 659 CB PRO A 43 -5.219 -15.070 3.703 1.00 0.00 C ATOM 660 CG PRO A 43 -5.537 -16.183 4.700 1.00 0.00 C ATOM 661 CD PRO A 43 -5.011 -15.636 6.021 1.00 0.00 C ATOM 0 HA PRO A 43 -4.638 -13.032 4.216 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -5.911 -15.077 2.861 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.215 -15.176 3.291 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -6.607 -16.386 4.747 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -5.046 -17.118 4.428 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -5.597 -16.008 6.861 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -3.979 -15.944 6.191 1.00 0.00 H new ATOM 669 N ASP A 44 -7.583 -13.185 5.349 1.00 0.00 N ATOM 670 CA ASP A 44 -8.878 -12.526 5.319 1.00 0.00 C ATOM 671 C ASP A 44 -8.745 -11.021 5.554 1.00 0.00 C ATOM 672 O ASP A 44 -9.702 -10.281 5.327 1.00 0.00 O ATOM 673 CB ASP A 44 -9.782 -13.156 6.381 1.00 0.00 C ATOM 674 CG ASP A 44 -9.209 -12.961 7.784 1.00 0.00 C ATOM 675 OD1 ASP A 44 -8.240 -13.678 8.116 1.00 0.00 O ATOM 676 OD2 ASP A 44 -9.750 -12.100 8.513 1.00 0.00 O ATOM 0 H ASP A 44 -7.402 -13.697 6.212 1.00 0.00 H new ATOM 0 HA ASP A 44 -9.319 -12.662 4.331 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -10.776 -12.711 6.326 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -9.898 -14.221 6.178 1.00 0.00 H new ATOM 681 N GLN A 45 -7.575 -10.556 6.010 1.00 0.00 N ATOM 682 CA GLN A 45 -7.356 -9.139 6.269 1.00 0.00 C ATOM 683 C GLN A 45 -7.056 -8.376 4.982 1.00 0.00 C ATOM 684 O GLN A 45 -7.250 -7.163 4.928 1.00 0.00 O ATOM 685 CB GLN A 45 -6.181 -8.958 7.230 1.00 0.00 C ATOM 686 CG GLN A 45 -6.446 -9.673 8.553 1.00 0.00 C ATOM 687 CD GLN A 45 -5.363 -9.378 9.587 1.00 0.00 C ATOM 688 OE1 GLN A 45 -4.287 -8.891 9.258 1.00 0.00 O ATOM 689 NE2 GLN A 45 -5.645 -9.669 10.854 1.00 0.00 N ATOM 0 H GLN A 45 -6.767 -11.147 6.206 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.270 -8.742 6.709 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -5.271 -9.350 6.776 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.015 -7.896 7.412 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -7.415 -9.364 8.945 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.500 -10.748 8.380 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.550 -10.074 11.095 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -4.956 -9.488 11.584 1.00 0.00 H new ATOM 698 N PHE A 46 -6.581 -9.073 3.944 1.00 0.00 N ATOM 699 CA PHE A 46 -6.232 -8.438 2.686 1.00 0.00 C ATOM 700 C PHE A 46 -7.516 -8.165 1.897 1.00 0.00 C ATOM 701 O PHE A 46 -8.249 -9.109 1.611 1.00 0.00 O ATOM 702 CB PHE A 46 -5.291 -9.345 1.901 1.00 0.00 C ATOM 703 CG PHE A 46 -4.425 -8.599 0.912 1.00 0.00 C ATOM 704 CD1 PHE A 46 -4.927 -8.192 -0.335 1.00 0.00 C ATOM 705 CD2 PHE A 46 -3.098 -8.303 1.255 1.00 0.00 C ATOM 706 CE1 PHE A 46 -4.100 -7.489 -1.227 1.00 0.00 C ATOM 707 CE2 PHE A 46 -2.272 -7.606 0.364 1.00 0.00 C ATOM 708 CZ PHE A 46 -2.774 -7.203 -0.879 1.00 0.00 C ATOM 0 H PHE A 46 -6.432 -10.082 3.959 1.00 0.00 H new ATOM 0 HA PHE A 46 -5.721 -7.492 2.867 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -4.651 -9.884 2.600 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -5.879 -10.091 1.367 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -5.947 -8.419 -0.608 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.710 -8.615 2.213 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -4.488 -7.169 -2.183 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -1.251 -7.380 0.635 1.00 0.00 H new ATOM 0 HZ PHE A 46 -2.138 -6.671 -1.571 1.00 0.00 H new ATOM 718 N PRO A 47 -7.800 -6.904 1.542 1.00 0.00 N ATOM 719 CA PRO A 47 -9.003 -6.524 0.815 1.00 0.00 C ATOM 720 C PRO A 47 -9.238 -7.371 -0.434 1.00 0.00 C ATOM 721 O PRO A 47 -8.291 -7.730 -1.129 1.00 0.00 O ATOM 722 CB PRO A 47 -8.803 -5.053 0.453 1.00 0.00 C ATOM 723 CG PRO A 47 -7.886 -4.541 1.562 1.00 0.00 C ATOM 724 CD PRO A 47 -6.981 -5.742 1.832 1.00 0.00 C ATOM 0 HA PRO A 47 -9.890 -6.686 1.428 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -8.347 -4.939 -0.531 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -9.749 -4.512 0.431 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -7.316 -3.668 1.245 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -8.448 -4.250 2.450 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -6.094 -5.717 1.200 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -6.636 -5.751 2.866 1.00 0.00 H new ATOM 732 N ARG A 48 -10.512 -7.679 -0.708 1.00 0.00 N ATOM 733 CA ARG A 48 -10.931 -8.460 -1.871 1.00 0.00 C ATOM 734 C ARG A 48 -12.141 -7.789 -2.526 1.00 0.00 C ATOM 735 O ARG A 48 -12.760 -8.362 -3.419 1.00 0.00 O ATOM 736 CB ARG A 48 -11.321 -9.884 -1.450 1.00 0.00 C ATOM 737 CG ARG A 48 -10.316 -10.601 -0.543 1.00 0.00 C ATOM 738 CD ARG A 48 -8.978 -10.921 -1.210 1.00 0.00 C ATOM 739 NE ARG A 48 -8.111 -11.628 -0.260 1.00 0.00 N ATOM 740 CZ ARG A 48 -7.768 -12.917 -0.349 1.00 0.00 C ATOM 741 NH1 ARG A 48 -8.173 -13.668 -1.371 1.00 0.00 N ATOM 742 NH2 ARG A 48 -7.010 -13.470 0.593 1.00 0.00 N ATOM 0 H ARG A 48 -11.290 -7.386 -0.117 1.00 0.00 H new ATOM 0 HA ARG A 48 -10.100 -8.509 -2.575 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -12.282 -9.842 -0.937 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -11.465 -10.483 -2.349 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -10.131 -9.982 0.335 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.763 -11.530 -0.189 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -9.140 -11.534 -2.096 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -8.497 -10.001 -1.542 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.742 -11.095 0.528 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -8.755 -13.262 -2.103 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.901 -14.650 -1.422 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -6.690 -12.911 1.384 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.748 -14.454 0.525 1.00 0.00 H new ATOM 756 N ASP A 49 -12.473 -6.577 -2.075 1.00 0.00 N ATOM 757 CA ASP A 49 -13.665 -5.846 -2.477 1.00 0.00 C ATOM 758 C ASP A 49 -13.353 -4.359 -2.668 1.00 0.00 C ATOM 759 O ASP A 49 -14.248 -3.518 -2.628 1.00 0.00 O ATOM 760 CB ASP A 49 -14.760 -6.058 -1.429 1.00 0.00 C ATOM 761 CG ASP A 49 -14.391 -5.447 -0.076 1.00 0.00 C ATOM 762 OD1 ASP A 49 -13.387 -5.904 0.518 1.00 0.00 O ATOM 763 OD2 ASP A 49 -15.118 -4.524 0.358 1.00 0.00 O ATOM 0 H ASP A 49 -11.901 -6.068 -1.402 1.00 0.00 H new ATOM 0 HA ASP A 49 -14.018 -6.225 -3.436 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -15.691 -5.615 -1.784 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -14.941 -7.126 -1.306 1.00 0.00 H new ATOM 768 N VAL A 50 -12.071 -4.043 -2.873 1.00 0.00 N ATOM 769 CA VAL A 50 -11.582 -2.685 -3.066 1.00 0.00 C ATOM 770 C VAL A 50 -10.639 -2.709 -4.267 1.00 0.00 C ATOM 771 O VAL A 50 -10.295 -3.782 -4.758 1.00 0.00 O ATOM 772 CB VAL A 50 -10.872 -2.195 -1.795 1.00 0.00 C ATOM 773 CG1 VAL A 50 -10.682 -0.679 -1.820 1.00 0.00 C ATOM 774 CG2 VAL A 50 -11.692 -2.513 -0.545 1.00 0.00 C ATOM 0 H VAL A 50 -11.331 -4.744 -2.909 1.00 0.00 H new ATOM 0 HA VAL A 50 -12.401 -1.992 -3.257 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.910 -2.707 -1.766 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.177 -0.361 -0.908 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.079 -0.402 -2.685 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -11.655 -0.191 -1.885 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -11.163 -2.154 0.338 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -12.663 -2.021 -0.612 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -11.836 -3.591 -0.469 1.00 0.00 H new ATOM 784 N ASP A 51 -10.217 -1.538 -4.752 1.00 0.00 N ATOM 785 CA ASP A 51 -9.330 -1.453 -5.902 1.00 0.00 C ATOM 786 C ASP A 51 -8.084 -2.315 -5.686 1.00 0.00 C ATOM 787 O ASP A 51 -7.590 -2.413 -4.562 1.00 0.00 O ATOM 788 CB ASP A 51 -8.943 0.007 -6.126 1.00 0.00 C ATOM 789 CG ASP A 51 -10.126 0.819 -6.652 1.00 0.00 C ATOM 790 OD1 ASP A 51 -10.305 0.831 -7.889 1.00 0.00 O ATOM 791 OD2 ASP A 51 -10.837 1.417 -5.814 1.00 0.00 O ATOM 0 H ASP A 51 -10.481 -0.634 -4.359 1.00 0.00 H new ATOM 0 HA ASP A 51 -9.845 -1.830 -6.786 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -8.589 0.440 -5.190 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.117 0.062 -6.835 1.00 0.00 H new ATOM 796 N PRO A 52 -7.568 -2.935 -6.754 1.00 0.00 N ATOM 797 CA PRO A 52 -6.443 -3.856 -6.700 1.00 0.00 C ATOM 798 C PRO A 52 -5.119 -3.130 -6.453 1.00 0.00 C ATOM 799 O PRO A 52 -4.053 -3.727 -6.595 1.00 0.00 O ATOM 800 CB PRO A 52 -6.458 -4.570 -8.054 1.00 0.00 C ATOM 801 CG PRO A 52 -7.022 -3.508 -8.994 1.00 0.00 C ATOM 802 CD PRO A 52 -8.056 -2.806 -8.115 1.00 0.00 C ATOM 0 HA PRO A 52 -6.533 -4.556 -5.870 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -5.459 -4.886 -8.355 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.082 -5.463 -8.033 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -6.250 -2.821 -9.340 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.476 -3.950 -9.881 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.161 -1.758 -8.395 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -9.039 -3.265 -8.224 1.00 0.00 H new ATOM 810 N ARG A 53 -5.178 -1.845 -6.083 1.00 0.00 N ATOM 811 CA ARG A 53 -3.999 -1.037 -5.802 1.00 0.00 C ATOM 812 C ARG A 53 -4.158 -0.304 -4.477 1.00 0.00 C ATOM 813 O ARG A 53 -3.167 0.004 -3.821 1.00 0.00 O ATOM 814 CB ARG A 53 -3.799 -0.033 -6.939 1.00 0.00 C ATOM 815 CG ARG A 53 -3.540 -0.760 -8.260 1.00 0.00 C ATOM 816 CD ARG A 53 -3.677 0.201 -9.439 1.00 0.00 C ATOM 817 NE ARG A 53 -2.627 1.229 -9.433 1.00 0.00 N ATOM 818 CZ ARG A 53 -2.039 1.700 -10.535 1.00 0.00 C ATOM 819 NH1 ARG A 53 -2.363 1.239 -11.741 1.00 0.00 N ATOM 820 NH2 ARG A 53 -1.113 2.645 -10.435 1.00 0.00 N ATOM 0 H ARG A 53 -6.056 -1.338 -5.971 1.00 0.00 H new ATOM 0 HA ARG A 53 -3.127 -1.686 -5.729 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -4.682 0.599 -7.033 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.960 0.623 -6.708 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.540 -1.194 -8.252 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -4.245 -1.584 -8.372 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -3.630 -0.360 -10.372 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.655 0.681 -9.404 1.00 0.00 H new ATOM 0 HE ARG A 53 -2.330 1.605 -8.533 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -3.073 0.512 -11.836 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -1.902 1.612 -12.571 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.853 3.009 -9.518 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.661 3.007 -11.275 1.00 0.00 H new ATOM 834 N LEU A 54 -5.397 -0.021 -4.065 1.00 0.00 N ATOM 835 CA LEU A 54 -5.649 0.630 -2.792 1.00 0.00 C ATOM 836 C LEU A 54 -5.443 -0.353 -1.647 1.00 0.00 C ATOM 837 O LEU A 54 -4.942 0.026 -0.591 1.00 0.00 O ATOM 838 CB LEU A 54 -7.077 1.179 -2.797 1.00 0.00 C ATOM 839 CG LEU A 54 -7.445 1.900 -1.493 1.00 0.00 C ATOM 840 CD1 LEU A 54 -6.521 3.085 -1.219 1.00 0.00 C ATOM 841 CD2 LEU A 54 -8.877 2.417 -1.602 1.00 0.00 C ATOM 0 H LEU A 54 -6.238 -0.236 -4.601 1.00 0.00 H new ATOM 0 HA LEU A 54 -4.949 1.453 -2.648 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.192 1.869 -3.633 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.776 0.359 -2.962 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.342 1.188 -0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.815 3.568 -0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.493 2.733 -1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.595 3.801 -2.038 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -9.149 2.931 -0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.951 3.110 -2.440 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -9.555 1.579 -1.764 1.00 0.00 H new ATOM 853 N GLY A 55 -5.820 -1.623 -1.840 1.00 0.00 N ATOM 854 CA GLY A 55 -5.657 -2.637 -0.805 1.00 0.00 C ATOM 855 C GLY A 55 -4.185 -2.990 -0.618 1.00 0.00 C ATOM 856 O GLY A 55 -3.754 -3.298 0.491 1.00 0.00 O ATOM 0 H GLY A 55 -6.239 -1.967 -2.704 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -6.070 -2.273 0.135 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -6.219 -3.532 -1.075 1.00 0.00 H new ATOM 860 N LEU A 56 -3.415 -2.937 -1.710 1.00 0.00 N ATOM 861 CA LEU A 56 -1.977 -3.154 -1.684 1.00 0.00 C ATOM 862 C LEU A 56 -1.319 -2.135 -0.757 1.00 0.00 C ATOM 863 O LEU A 56 -0.462 -2.486 0.056 1.00 0.00 O ATOM 864 CB LEU A 56 -1.429 -2.980 -3.109 1.00 0.00 C ATOM 865 CG LEU A 56 -1.569 -4.210 -4.013 1.00 0.00 C ATOM 866 CD1 LEU A 56 -0.492 -5.231 -3.662 1.00 0.00 C ATOM 867 CD2 LEU A 56 -2.945 -4.875 -3.912 1.00 0.00 C ATOM 0 H LEU A 56 -3.782 -2.740 -2.641 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.760 -4.158 -1.319 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.943 -2.142 -3.580 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.374 -2.712 -3.046 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.452 -3.861 -5.039 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.594 -6.104 -4.306 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.492 -4.786 -3.807 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.603 -5.534 -2.621 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.981 -5.739 -4.575 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.119 -5.198 -2.886 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.716 -4.162 -4.203 1.00 0.00 H new ATOM 879 N TYR A 57 -1.721 -0.866 -0.878 1.00 0.00 N ATOM 880 CA TYR A 57 -1.106 0.203 -0.107 1.00 0.00 C ATOM 881 C TYR A 57 -1.576 0.200 1.347 1.00 0.00 C ATOM 882 O TYR A 57 -0.850 0.677 2.216 1.00 0.00 O ATOM 883 CB TYR A 57 -1.418 1.549 -0.765 1.00 0.00 C ATOM 884 CG TYR A 57 -1.029 1.664 -2.228 1.00 0.00 C ATOM 885 CD1 TYR A 57 -0.114 0.768 -2.806 1.00 0.00 C ATOM 886 CD2 TYR A 57 -1.596 2.685 -3.006 1.00 0.00 C ATOM 887 CE1 TYR A 57 0.224 0.887 -4.161 1.00 0.00 C ATOM 888 CE2 TYR A 57 -1.266 2.807 -4.366 1.00 0.00 C ATOM 889 CZ TYR A 57 -0.358 1.901 -4.951 1.00 0.00 C ATOM 890 OH TYR A 57 -0.038 2.001 -6.273 1.00 0.00 O ATOM 0 H TYR A 57 -2.468 -0.561 -1.502 1.00 0.00 H new ATOM 0 HA TYR A 57 -0.029 0.039 -0.097 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -2.488 1.739 -0.675 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.907 2.334 -0.208 1.00 0.00 H new ATOM 0 HD1 TYR A 57 0.329 -0.013 -2.206 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -2.290 3.380 -2.557 1.00 0.00 H new ATOM 0 HE1 TYR A 57 0.932 0.201 -4.602 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -1.707 3.593 -4.962 1.00 0.00 H new ATOM 0 HH TYR A 57 -0.339 2.868 -6.618 1.00 0.00 H new ATOM 900 N ARG A 58 -2.774 -0.327 1.631 1.00 0.00 N ATOM 901 CA ARG A 58 -3.286 -0.346 2.996 1.00 0.00 C ATOM 902 C ARG A 58 -2.491 -1.296 3.880 1.00 0.00 C ATOM 903 O ARG A 58 -2.185 -0.951 5.019 1.00 0.00 O ATOM 904 CB ARG A 58 -4.763 -0.753 3.008 1.00 0.00 C ATOM 905 CG ARG A 58 -5.691 0.388 2.577 1.00 0.00 C ATOM 906 CD ARG A 58 -5.651 1.569 3.555 1.00 0.00 C ATOM 907 NE ARG A 58 -6.011 1.153 4.917 1.00 0.00 N ATOM 908 CZ ARG A 58 -5.241 1.326 5.994 1.00 0.00 C ATOM 909 NH1 ARG A 58 -4.056 1.920 5.897 1.00 0.00 N ATOM 910 NH2 ARG A 58 -5.655 0.902 7.183 1.00 0.00 N ATOM 0 H ARG A 58 -3.397 -0.741 0.937 1.00 0.00 H new ATOM 0 HA ARG A 58 -3.182 0.663 3.396 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -4.907 -1.605 2.343 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -5.038 -1.081 4.010 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -5.404 0.732 1.583 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -6.712 0.015 2.502 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -4.652 2.006 3.559 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -6.337 2.346 3.217 1.00 0.00 H new ATOM 0 HE ARG A 58 -6.915 0.699 5.050 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -3.724 2.251 4.991 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -3.479 2.045 6.729 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -6.562 0.444 7.274 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -5.066 1.035 8.005 1.00 0.00 H new ATOM 924 N MET A 59 -2.144 -2.490 3.384 1.00 0.00 N ATOM 925 CA MET A 59 -1.385 -3.427 4.194 1.00 0.00 C ATOM 926 C MET A 59 0.067 -2.974 4.337 1.00 0.00 C ATOM 927 O MET A 59 0.677 -3.203 5.381 1.00 0.00 O ATOM 928 CB MET A 59 -1.469 -4.828 3.584 1.00 0.00 C ATOM 929 CG MET A 59 -2.926 -5.257 3.405 1.00 0.00 C ATOM 930 SD MET A 59 -3.985 -5.037 4.863 1.00 0.00 S ATOM 931 CE MET A 59 -3.187 -6.183 6.020 1.00 0.00 C ATOM 0 H MET A 59 -2.374 -2.818 2.446 1.00 0.00 H new ATOM 0 HA MET A 59 -1.817 -3.457 5.194 1.00 0.00 H new ATOM 0 HB2 MET A 59 -0.961 -4.841 2.620 1.00 0.00 H new ATOM 0 HB3 MET A 59 -0.952 -5.541 4.226 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.354 -4.693 2.577 1.00 0.00 H new ATOM 0 HG3 MET A 59 -2.945 -6.308 3.118 1.00 0.00 H new ATOM 0 HE1 MET A 59 -3.410 -5.881 7.043 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.562 -7.192 5.849 1.00 0.00 H new ATOM 0 HE3 MET A 59 -2.108 -6.166 5.864 1.00 0.00 H new ATOM 941 N PHE A 60 0.629 -2.331 3.305 1.00 0.00 N ATOM 942 CA PHE A 60 1.994 -1.829 3.394 1.00 0.00 C ATOM 943 C PHE A 60 2.078 -0.686 4.400 1.00 0.00 C ATOM 944 O PHE A 60 3.051 -0.589 5.147 1.00 0.00 O ATOM 945 CB PHE A 60 2.451 -1.354 2.016 1.00 0.00 C ATOM 946 CG PHE A 60 3.872 -0.826 2.007 1.00 0.00 C ATOM 947 CD1 PHE A 60 4.946 -1.715 1.869 1.00 0.00 C ATOM 948 CD2 PHE A 60 4.115 0.549 2.141 1.00 0.00 C ATOM 949 CE1 PHE A 60 6.263 -1.235 1.872 1.00 0.00 C ATOM 950 CE2 PHE A 60 5.434 1.030 2.145 1.00 0.00 C ATOM 951 CZ PHE A 60 6.508 0.138 2.012 1.00 0.00 C ATOM 0 H PHE A 60 0.164 -2.151 2.415 1.00 0.00 H new ATOM 0 HA PHE A 60 2.648 -2.632 3.734 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.373 -2.181 1.310 1.00 0.00 H new ATOM 0 HB3 PHE A 60 1.777 -0.572 1.667 1.00 0.00 H new ATOM 0 HD1 PHE A 60 4.759 -2.773 1.760 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.288 1.237 2.241 1.00 0.00 H new ATOM 0 HE1 PHE A 60 7.089 -1.923 1.766 1.00 0.00 H new ATOM 0 HE2 PHE A 60 5.622 2.088 2.251 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.522 0.508 2.017 1.00 0.00 H new ATOM 961 N GLN A 61 1.061 0.182 4.427 1.00 0.00 N ATOM 962 CA GLN A 61 1.007 1.283 5.375 1.00 0.00 C ATOM 963 C GLN A 61 0.845 0.747 6.796 1.00 0.00 C ATOM 964 O GLN A 61 1.236 1.417 7.750 1.00 0.00 O ATOM 965 CB GLN A 61 -0.140 2.217 4.971 1.00 0.00 C ATOM 966 CG GLN A 61 -0.207 3.495 5.814 1.00 0.00 C ATOM 967 CD GLN A 61 -0.938 3.310 7.141 1.00 0.00 C ATOM 968 OE1 GLN A 61 -1.692 2.359 7.328 1.00 0.00 O ATOM 969 NE2 GLN A 61 -0.719 4.227 8.079 1.00 0.00 N ATOM 0 H GLN A 61 0.262 0.136 3.795 1.00 0.00 H new ATOM 0 HA GLN A 61 1.937 1.851 5.358 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -0.026 2.488 3.921 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -1.085 1.681 5.061 1.00 0.00 H new ATOM 0 HG2 GLN A 61 0.806 3.844 6.012 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.706 4.275 5.239 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -0.087 5.006 7.893 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -1.183 4.152 8.984 1.00 0.00 H new ATOM 978 N GLY A 62 0.276 -0.455 6.944 1.00 0.00 N ATOM 979 CA GLY A 62 0.078 -1.063 8.251 1.00 0.00 C ATOM 980 C GLY A 62 1.401 -1.491 8.873 1.00 0.00 C ATOM 981 O GLY A 62 1.577 -1.377 10.085 1.00 0.00 O ATOM 0 H GLY A 62 -0.055 -1.024 6.165 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -0.423 -0.355 8.911 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.577 -1.929 8.155 1.00 0.00 H new ATOM 985 N ILE A 63 2.343 -1.985 8.059 1.00 0.00 N ATOM 986 CA ILE A 63 3.656 -2.362 8.569 1.00 0.00 C ATOM 987 C ILE A 63 4.442 -1.116 8.957 1.00 0.00 C ATOM 988 O ILE A 63 5.119 -1.106 9.984 1.00 0.00 O ATOM 989 CB ILE A 63 4.441 -3.142 7.508 1.00 0.00 C ATOM 990 CG1 ILE A 63 3.673 -4.366 6.998 1.00 0.00 C ATOM 991 CG2 ILE A 63 5.792 -3.583 8.084 1.00 0.00 C ATOM 992 CD1 ILE A 63 3.351 -5.378 8.099 1.00 0.00 C ATOM 0 H ILE A 63 2.218 -2.130 7.057 1.00 0.00 H new ATOM 0 HA ILE A 63 3.514 -2.994 9.446 1.00 0.00 H new ATOM 0 HB ILE A 63 4.594 -2.475 6.659 1.00 0.00 H new ATOM 0 HG12 ILE A 63 2.744 -4.036 6.534 1.00 0.00 H new ATOM 0 HG13 ILE A 63 4.260 -4.858 6.222 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.347 -4.137 7.327 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.364 -2.705 8.383 1.00 0.00 H new ATOM 0 HG23 ILE A 63 5.627 -4.221 8.952 1.00 0.00 H new ATOM 0 HD11 ILE A 63 2.807 -6.220 7.671 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.278 -5.735 8.547 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.738 -4.901 8.864 1.00 0.00 H new ATOM 1004 N TRP A 64 4.359 -0.061 8.140 1.00 0.00 N ATOM 1005 CA TRP A 64 5.099 1.162 8.399 1.00 0.00 C ATOM 1006 C TRP A 64 4.527 1.890 9.610 1.00 0.00 C ATOM 1007 O TRP A 64 5.271 2.514 10.366 1.00 0.00 O ATOM 1008 CB TRP A 64 5.056 2.050 7.159 1.00 0.00 C ATOM 1009 CG TRP A 64 5.943 3.253 7.221 1.00 0.00 C ATOM 1010 CD1 TRP A 64 7.266 3.255 6.943 1.00 0.00 C ATOM 1011 CD2 TRP A 64 5.611 4.632 7.575 1.00 0.00 C ATOM 1012 NE1 TRP A 64 7.772 4.528 7.096 1.00 0.00 N ATOM 1013 CE2 TRP A 64 6.793 5.420 7.482 1.00 0.00 C ATOM 1014 CE3 TRP A 64 4.432 5.295 7.964 1.00 0.00 C ATOM 1015 CZ2 TRP A 64 6.804 6.792 7.758 1.00 0.00 C ATOM 1016 CZ3 TRP A 64 4.434 6.670 8.245 1.00 0.00 C ATOM 1017 CH2 TRP A 64 5.615 7.420 8.143 1.00 0.00 C ATOM 0 H TRP A 64 3.786 -0.037 7.297 1.00 0.00 H new ATOM 0 HA TRP A 64 6.137 0.914 8.622 1.00 0.00 H new ATOM 0 HB2 TRP A 64 5.336 1.453 6.291 1.00 0.00 H new ATOM 0 HB3 TRP A 64 4.029 2.380 7.001 1.00 0.00 H new ATOM 0 HD1 TRP A 64 7.840 2.390 6.646 1.00 0.00 H new ATOM 0 HE1 TRP A 64 8.749 4.779 6.943 1.00 0.00 H new ATOM 0 HE3 TRP A 64 3.511 4.737 8.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 7.719 7.359 7.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 3.517 7.156 8.543 1.00 0.00 H new ATOM 0 HH2 TRP A 64 5.606 8.478 8.361 1.00 0.00 H new ATOM 1028 N ALA A 65 3.208 1.815 9.815 1.00 0.00 N ATOM 1029 CA ALA A 65 2.583 2.425 10.975 1.00 0.00 C ATOM 1030 C ALA A 65 2.996 1.692 12.251 1.00 0.00 C ATOM 1031 O ALA A 65 3.129 2.313 13.305 1.00 0.00 O ATOM 1032 CB ALA A 65 1.068 2.383 10.806 1.00 0.00 C ATOM 0 H ALA A 65 2.560 1.337 9.189 1.00 0.00 H new ATOM 0 HA ALA A 65 2.910 3.461 11.059 1.00 0.00 H new ATOM 0 HB1 ALA A 65 0.592 2.840 11.674 1.00 0.00 H new ATOM 0 HB2 ALA A 65 0.787 2.932 9.907 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.741 1.347 10.716 1.00 0.00 H new ATOM 1038 N SER A 66 3.203 0.376 12.159 1.00 0.00 N ATOM 1039 CA SER A 66 3.643 -0.418 13.297 1.00 0.00 C ATOM 1040 C SER A 66 5.114 -0.141 13.601 1.00 0.00 C ATOM 1041 O SER A 66 5.536 -0.220 14.753 1.00 0.00 O ATOM 1042 CB SER A 66 3.424 -1.898 12.987 1.00 0.00 C ATOM 1043 OG SER A 66 3.765 -2.680 14.112 1.00 0.00 O ATOM 0 H SER A 66 3.071 -0.160 11.301 1.00 0.00 H new ATOM 0 HA SER A 66 3.062 -0.147 14.179 1.00 0.00 H new ATOM 0 HB2 SER A 66 2.383 -2.071 12.715 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.031 -2.193 12.131 1.00 0.00 H new ATOM 0 HG SER A 66 3.621 -3.628 13.908 1.00 0.00 H new ATOM 1049 N ALA A 67 5.899 0.186 12.571 1.00 0.00 N ATOM 1050 CA ALA A 67 7.307 0.506 12.738 1.00 0.00 C ATOM 1051 C ALA A 67 7.484 1.848 13.450 1.00 0.00 C ATOM 1052 O ALA A 67 8.490 2.060 14.125 1.00 0.00 O ATOM 1053 CB ALA A 67 7.976 0.531 11.365 1.00 0.00 C ATOM 0 H ALA A 67 5.573 0.234 11.606 1.00 0.00 H new ATOM 0 HA ALA A 67 7.777 -0.257 13.359 1.00 0.00 H new ATOM 0 HB1 ALA A 67 9.033 0.770 11.480 1.00 0.00 H new ATOM 0 HB2 ALA A 67 7.874 -0.446 10.893 1.00 0.00 H new ATOM 0 HB3 ALA A 67 7.499 1.287 10.741 1.00 0.00 H new ATOM 1059 N ASN A 68 6.514 2.756 13.303 1.00 0.00 N ATOM 1060 CA ASN A 68 6.541 4.045 13.982 1.00 0.00 C ATOM 1061 C ASN A 68 5.862 3.956 15.353 1.00 0.00 C ATOM 1062 O ASN A 68 6.000 4.869 16.166 1.00 0.00 O ATOM 1063 CB ASN A 68 5.846 5.102 13.116 1.00 0.00 C ATOM 1064 CG ASN A 68 6.730 5.565 11.964 1.00 0.00 C ATOM 1065 OD1 ASN A 68 7.403 6.587 12.069 1.00 0.00 O ATOM 1066 ND2 ASN A 68 6.739 4.830 10.860 1.00 0.00 N ATOM 0 H ASN A 68 5.695 2.615 12.712 1.00 0.00 H new ATOM 0 HA ASN A 68 7.581 4.333 14.137 1.00 0.00 H new ATOM 0 HB2 ASN A 68 4.917 4.692 12.719 1.00 0.00 H new ATOM 0 HB3 ASN A 68 5.578 5.959 13.734 1.00 0.00 H new ATOM 0 HD21 ASN A 68 7.316 5.108 10.067 1.00 0.00 H new ATOM 0 HD22 ASN A 68 6.169 3.986 10.804 1.00 0.00 H new ATOM 1073 N ALA A 69 5.133 2.868 15.613 1.00 0.00 N ATOM 1074 CA ALA A 69 4.436 2.663 16.875 1.00 0.00 C ATOM 1075 C ALA A 69 5.348 2.031 17.931 1.00 0.00 C ATOM 1076 O ALA A 69 4.900 1.757 19.044 1.00 0.00 O ATOM 1077 CB ALA A 69 3.208 1.785 16.634 1.00 0.00 C ATOM 0 H ALA A 69 5.012 2.104 14.948 1.00 0.00 H new ATOM 0 HA ALA A 69 4.125 3.634 17.259 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.682 1.628 17.576 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.543 2.277 15.925 1.00 0.00 H new ATOM 0 HB3 ALA A 69 3.522 0.823 16.229 1.00 0.00 H new ATOM 1083 N ASP A 70 6.619 1.799 17.590 1.00 0.00 N ATOM 1084 CA ASP A 70 7.585 1.212 18.510 1.00 0.00 C ATOM 1085 C ASP A 70 8.955 1.881 18.378 1.00 0.00 C ATOM 1086 O ASP A 70 9.909 1.492 19.049 1.00 0.00 O ATOM 1087 CB ASP A 70 7.662 -0.294 18.245 1.00 0.00 C ATOM 1088 CG ASP A 70 8.490 -1.023 19.305 1.00 0.00 C ATOM 1089 OD1 ASP A 70 8.137 -0.897 20.500 1.00 0.00 O ATOM 1090 OD2 ASP A 70 9.466 -1.700 18.915 1.00 0.00 O ATOM 0 H ASP A 70 7.002 2.014 16.669 1.00 0.00 H new ATOM 0 HA ASP A 70 7.259 1.378 19.537 1.00 0.00 H new ATOM 0 HB2 ASP A 70 6.655 -0.710 18.223 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.100 -0.467 17.262 1.00 0.00 H new ATOM 1095 N GLY A 71 9.064 2.897 17.516 1.00 0.00 N ATOM 1096 CA GLY A 71 10.294 3.661 17.355 1.00 0.00 C ATOM 1097 C GLY A 71 11.322 2.967 16.463 1.00 0.00 C ATOM 1098 O GLY A 71 12.469 3.410 16.393 1.00 0.00 O ATOM 0 H GLY A 71 8.301 3.208 16.914 1.00 0.00 H new ATOM 0 HA2 GLY A 71 10.055 4.637 16.932 1.00 0.00 H new ATOM 0 HA3 GLY A 71 10.735 3.838 18.336 1.00 0.00 H new ATOM 1102 N GLU A 72 10.929 1.887 15.782 1.00 0.00 N ATOM 1103 CA GLU A 72 11.826 1.155 14.893 1.00 0.00 C ATOM 1104 C GLU A 72 12.232 1.996 13.684 1.00 0.00 C ATOM 1105 O GLU A 72 13.145 1.626 12.948 1.00 0.00 O ATOM 1106 CB GLU A 72 11.163 -0.142 14.435 1.00 0.00 C ATOM 1107 CG GLU A 72 10.857 -1.044 15.632 1.00 0.00 C ATOM 1108 CD GLU A 72 10.273 -2.378 15.172 1.00 0.00 C ATOM 1109 OE1 GLU A 72 9.059 -2.412 14.871 1.00 0.00 O ATOM 1110 OE2 GLU A 72 11.048 -3.362 15.126 1.00 0.00 O ATOM 0 H GLU A 72 9.987 1.500 15.833 1.00 0.00 H new ATOM 0 HA GLU A 72 12.732 0.921 15.451 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.241 0.084 13.899 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.818 -0.664 13.737 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.769 -1.219 16.203 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.154 -0.545 16.299 1.00 0.00 H new ATOM 1117 N ALA A 73 11.554 3.130 13.478 1.00 0.00 N ATOM 1118 CA ALA A 73 11.867 4.066 12.415 1.00 0.00 C ATOM 1119 C ALA A 73 11.354 5.452 12.795 1.00 0.00 C ATOM 1120 O ALA A 73 10.231 5.586 13.283 1.00 0.00 O ATOM 1121 CB ALA A 73 11.201 3.585 11.127 1.00 0.00 C ATOM 0 H ALA A 73 10.765 3.419 14.056 1.00 0.00 H new ATOM 0 HA ALA A 73 12.945 4.123 12.264 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.428 4.280 10.319 1.00 0.00 H new ATOM 0 HB2 ALA A 73 11.577 2.595 10.871 1.00 0.00 H new ATOM 0 HB3 ALA A 73 10.122 3.537 11.272 1.00 0.00 H new ATOM 1127 N GLN A 74 12.177 6.481 12.572 1.00 0.00 N ATOM 1128 CA GLN A 74 11.828 7.867 12.869 1.00 0.00 C ATOM 1129 C GLN A 74 12.512 8.836 11.897 1.00 0.00 C ATOM 1130 O GLN A 74 12.390 10.050 12.050 1.00 0.00 O ATOM 1131 CB GLN A 74 12.251 8.221 14.301 1.00 0.00 C ATOM 1132 CG GLN A 74 11.511 7.389 15.352 1.00 0.00 C ATOM 1133 CD GLN A 74 11.843 7.848 16.770 1.00 0.00 C ATOM 1134 OE1 GLN A 74 12.935 8.344 17.035 1.00 0.00 O ATOM 1135 NE2 GLN A 74 10.902 7.689 17.697 1.00 0.00 N ATOM 0 H GLN A 74 13.111 6.371 12.177 1.00 0.00 H new ATOM 0 HA GLN A 74 10.748 7.965 12.761 1.00 0.00 H new ATOM 0 HB2 GLN A 74 13.324 8.065 14.409 1.00 0.00 H new ATOM 0 HB3 GLN A 74 12.063 9.279 14.481 1.00 0.00 H new ATOM 0 HG2 GLN A 74 10.436 7.466 15.187 1.00 0.00 H new ATOM 0 HG3 GLN A 74 11.777 6.338 15.238 1.00 0.00 H new ATOM 0 HE21 GLN A 74 10.005 7.274 17.447 1.00 0.00 H new ATOM 0 HE22 GLN A 74 11.078 7.982 18.658 1.00 0.00 H new ATOM 1144 N THR A 75 13.235 8.313 10.898 1.00 0.00 N ATOM 1145 CA THR A 75 14.005 9.127 9.967 1.00 0.00 C ATOM 1146 C THR A 75 14.266 8.348 8.677 1.00 0.00 C ATOM 1147 O THR A 75 13.728 7.255 8.493 1.00 0.00 O ATOM 1148 CB THR A 75 15.315 9.555 10.644 1.00 0.00 C ATOM 1149 OG1 THR A 75 16.000 10.492 9.844 1.00 0.00 O ATOM 1150 CG2 THR A 75 16.230 8.362 10.917 1.00 0.00 C ATOM 0 H THR A 75 13.298 7.311 10.718 1.00 0.00 H new ATOM 0 HA THR A 75 13.443 10.022 9.699 1.00 0.00 H new ATOM 0 HB THR A 75 15.049 10.009 11.598 1.00 0.00 H new ATOM 0 HG1 THR A 75 16.832 10.756 10.290 1.00 0.00 H new ATOM 0 HG21 THR A 75 17.146 8.708 11.396 1.00 0.00 H new ATOM 0 HG22 THR A 75 15.721 7.656 11.573 1.00 0.00 H new ATOM 0 HG23 THR A 75 16.477 7.870 9.976 1.00 0.00 H new ATOM 1158 N SER A 76 15.086 8.906 7.785 1.00 0.00 N ATOM 1159 CA SER A 76 15.429 8.289 6.511 1.00 0.00 C ATOM 1160 C SER A 76 16.917 8.471 6.220 1.00 0.00 C ATOM 1161 O SER A 76 17.651 9.025 7.038 1.00 0.00 O ATOM 1162 CB SER A 76 14.564 8.884 5.398 1.00 0.00 C ATOM 1163 OG SER A 76 14.818 10.269 5.278 1.00 0.00 O ATOM 0 H SER A 76 15.534 9.810 7.933 1.00 0.00 H new ATOM 0 HA SER A 76 15.230 7.219 6.561 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.777 8.383 4.453 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.509 8.717 5.617 1.00 0.00 H new ATOM 0 HG SER A 76 14.262 10.643 4.563 1.00 0.00 H new ATOM 1169 N GLN A 77 17.373 8.005 5.055 1.00 0.00 N ATOM 1170 CA GLN A 77 18.786 8.004 4.703 1.00 0.00 C ATOM 1171 C GLN A 77 18.968 8.401 3.233 1.00 0.00 C ATOM 1172 O GLN A 77 18.020 8.839 2.585 1.00 0.00 O ATOM 1173 CB GLN A 77 19.346 6.612 5.028 1.00 0.00 C ATOM 1174 CG GLN A 77 20.859 6.628 5.284 1.00 0.00 C ATOM 1175 CD GLN A 77 21.366 5.273 5.768 1.00 0.00 C ATOM 1176 OE1 GLN A 77 20.747 4.241 5.523 1.00 0.00 O ATOM 1177 NE2 GLN A 77 22.501 5.268 6.462 1.00 0.00 N ATOM 0 H GLN A 77 16.768 7.618 4.331 1.00 0.00 H new ATOM 0 HA GLN A 77 19.342 8.743 5.280 1.00 0.00 H new ATOM 0 HB2 GLN A 77 18.837 6.216 5.907 1.00 0.00 H new ATOM 0 HB3 GLN A 77 19.128 5.935 4.202 1.00 0.00 H new ATOM 0 HG2 GLN A 77 21.380 6.905 4.367 1.00 0.00 H new ATOM 0 HG3 GLN A 77 21.094 7.390 6.027 1.00 0.00 H new ATOM 0 HE21 GLN A 77 22.989 6.144 6.647 1.00 0.00 H new ATOM 0 HE22 GLN A 77 22.883 4.388 6.809 1.00 0.00 H new ATOM 1186 N SER A 78 20.189 8.248 2.705 1.00 0.00 N ATOM 1187 CA SER A 78 20.542 8.650 1.351 1.00 0.00 C ATOM 1188 C SER A 78 21.269 7.514 0.633 1.00 0.00 C ATOM 1189 O SER A 78 22.342 7.714 0.070 1.00 0.00 O ATOM 1190 CB SER A 78 21.398 9.918 1.379 1.00 0.00 C ATOM 1191 OG SER A 78 20.672 10.981 1.962 1.00 0.00 O ATOM 0 H SER A 78 20.966 7.834 3.220 1.00 0.00 H new ATOM 0 HA SER A 78 19.628 8.870 0.799 1.00 0.00 H new ATOM 0 HB2 SER A 78 22.311 9.737 1.946 1.00 0.00 H new ATOM 0 HB3 SER A 78 21.699 10.185 0.366 1.00 0.00 H new ATOM 0 HG SER A 78 21.296 11.635 2.340 1.00 0.00 H new ATOM 1197 N ASP A 79 20.677 6.317 0.660 1.00 0.00 N ATOM 1198 CA ASP A 79 21.204 5.123 0.007 1.00 0.00 C ATOM 1199 C ASP A 79 21.106 5.207 -1.527 1.00 0.00 C ATOM 1200 O ASP A 79 21.041 4.185 -2.209 1.00 0.00 O ATOM 1201 CB ASP A 79 20.450 3.907 0.553 1.00 0.00 C ATOM 1202 CG ASP A 79 21.136 2.589 0.203 1.00 0.00 C ATOM 1203 OD1 ASP A 79 22.386 2.573 0.159 1.00 0.00 O ATOM 1204 OD2 ASP A 79 20.398 1.604 -0.015 1.00 0.00 O ATOM 0 H ASP A 79 19.797 6.151 1.149 1.00 0.00 H new ATOM 0 HA ASP A 79 22.267 5.032 0.230 1.00 0.00 H new ATOM 0 HB2 ASP A 79 20.365 3.992 1.636 1.00 0.00 H new ATOM 0 HB3 ASP A 79 19.436 3.903 0.153 1.00 0.00 H new ATOM 1209 N ALA A 80 21.093 6.426 -2.066 1.00 0.00 N ATOM 1210 CA ALA A 80 21.029 6.706 -3.493 1.00 0.00 C ATOM 1211 C ALA A 80 21.808 7.992 -3.784 1.00 0.00 C ATOM 1212 O ALA A 80 22.374 8.589 -2.869 1.00 0.00 O ATOM 1213 CB ALA A 80 19.564 6.846 -3.909 1.00 0.00 C ATOM 0 H ALA A 80 21.128 7.272 -1.498 1.00 0.00 H new ATOM 0 HA ALA A 80 21.476 5.892 -4.064 1.00 0.00 H new ATOM 0 HB1 ALA A 80 19.508 7.056 -4.977 1.00 0.00 H new ATOM 0 HB2 ALA A 80 19.034 5.918 -3.693 1.00 0.00 H new ATOM 0 HB3 ALA A 80 19.105 7.664 -3.354 1.00 0.00 H new ATOM 1219 N GLU A 81 21.842 8.427 -5.046 1.00 0.00 N ATOM 1220 CA GLU A 81 22.631 9.595 -5.416 1.00 0.00 C ATOM 1221 C GLU A 81 21.915 10.519 -6.405 1.00 0.00 C ATOM 1222 O GLU A 81 22.509 11.493 -6.864 1.00 0.00 O ATOM 1223 CB GLU A 81 23.982 9.134 -5.972 1.00 0.00 C ATOM 1224 CG GLU A 81 23.820 8.331 -7.263 1.00 0.00 C ATOM 1225 CD GLU A 81 25.177 7.890 -7.805 1.00 0.00 C ATOM 1226 OE1 GLU A 81 25.662 6.827 -7.354 1.00 0.00 O ATOM 1227 OE2 GLU A 81 25.720 8.616 -8.668 1.00 0.00 O ATOM 0 H GLU A 81 21.337 7.991 -5.818 1.00 0.00 H new ATOM 0 HA GLU A 81 22.783 10.190 -4.516 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.613 10.003 -6.161 1.00 0.00 H new ATOM 0 HB3 GLU A 81 24.493 8.525 -5.227 1.00 0.00 H new ATOM 0 HG2 GLU A 81 23.197 7.456 -7.076 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.305 8.935 -8.010 1.00 0.00 H new ATOM 1234 N GLY A 82 20.653 10.240 -6.744 1.00 0.00 N ATOM 1235 CA GLY A 82 19.934 11.103 -7.670 1.00 0.00 C ATOM 1236 C GLY A 82 18.561 10.577 -8.081 1.00 0.00 C ATOM 1237 O GLY A 82 18.053 10.967 -9.133 1.00 0.00 O ATOM 0 H GLY A 82 20.122 9.441 -6.397 1.00 0.00 H new ATOM 0 HA2 GLY A 82 19.812 12.085 -7.213 1.00 0.00 H new ATOM 0 HA3 GLY A 82 20.540 11.241 -8.565 1.00 0.00 H new ATOM 1241 N THR A 83 17.944 9.696 -7.281 1.00 0.00 N ATOM 1242 CA THR A 83 16.650 9.131 -7.654 1.00 0.00 C ATOM 1243 C THR A 83 15.748 8.844 -6.452 1.00 0.00 C ATOM 1244 O THR A 83 14.545 8.649 -6.619 1.00 0.00 O ATOM 1245 CB THR A 83 16.888 7.868 -8.490 1.00 0.00 C ATOM 1246 OG1 THR A 83 15.660 7.322 -8.908 1.00 0.00 O ATOM 1247 CG2 THR A 83 17.660 6.804 -7.708 1.00 0.00 C ATOM 0 H THR A 83 18.315 9.367 -6.390 1.00 0.00 H new ATOM 0 HA THR A 83 16.113 9.874 -8.244 1.00 0.00 H new ATOM 0 HB THR A 83 17.483 8.164 -9.354 1.00 0.00 H new ATOM 0 HG1 THR A 83 14.936 7.683 -8.355 1.00 0.00 H new ATOM 0 HG21 THR A 83 17.807 5.926 -8.337 1.00 0.00 H new ATOM 0 HG22 THR A 83 18.629 7.203 -7.410 1.00 0.00 H new ATOM 0 HG23 THR A 83 17.094 6.523 -6.820 1.00 0.00 H new ATOM 1255 N GLU A 84 16.301 8.819 -5.236 1.00 0.00 N ATOM 1256 CA GLU A 84 15.512 8.611 -4.024 1.00 0.00 C ATOM 1257 C GLU A 84 16.042 9.501 -2.906 1.00 0.00 C ATOM 1258 O GLU A 84 15.268 10.066 -2.135 1.00 0.00 O ATOM 1259 CB GLU A 84 15.577 7.138 -3.609 1.00 0.00 C ATOM 1260 CG GLU A 84 14.867 6.254 -4.633 1.00 0.00 C ATOM 1261 CD GLU A 84 15.039 4.774 -4.309 1.00 0.00 C ATOM 1262 OE1 GLU A 84 16.033 4.195 -4.798 1.00 0.00 O ATOM 1263 OE2 GLU A 84 14.181 4.228 -3.583 1.00 0.00 O ATOM 0 H GLU A 84 17.299 8.941 -5.067 1.00 0.00 H new ATOM 0 HA GLU A 84 14.472 8.874 -4.220 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.618 6.828 -3.514 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.115 7.011 -2.630 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.806 6.502 -4.655 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.263 6.458 -5.628 1.00 0.00 H new ATOM 1270 N ALA A 85 17.369 9.634 -2.814 1.00 0.00 N ATOM 1271 CA ALA A 85 17.971 10.564 -1.879 1.00 0.00 C ATOM 1272 C ALA A 85 17.623 11.994 -2.284 1.00 0.00 C ATOM 1273 O ALA A 85 17.573 12.880 -1.438 1.00 0.00 O ATOM 1274 CB ALA A 85 19.483 10.346 -1.874 1.00 0.00 C ATOM 0 H ALA A 85 18.037 9.108 -3.377 1.00 0.00 H new ATOM 0 HA ALA A 85 17.587 10.395 -0.873 1.00 0.00 H new ATOM 0 HB1 ALA A 85 19.948 11.040 -1.174 1.00 0.00 H new ATOM 0 HB2 ALA A 85 19.702 9.322 -1.570 1.00 0.00 H new ATOM 0 HB3 ALA A 85 19.879 10.520 -2.875 1.00 0.00 H new ATOM 1280 N VAL A 86 17.378 12.220 -3.580 1.00 0.00 N ATOM 1281 CA VAL A 86 16.989 13.527 -4.094 1.00 0.00 C ATOM 1282 C VAL A 86 15.627 13.943 -3.536 1.00 0.00 C ATOM 1283 O VAL A 86 15.321 15.131 -3.463 1.00 0.00 O ATOM 1284 CB VAL A 86 16.964 13.470 -5.628 1.00 0.00 C ATOM 1285 CG1 VAL A 86 15.805 12.615 -6.146 1.00 0.00 C ATOM 1286 CG2 VAL A 86 16.848 14.871 -6.222 1.00 0.00 C ATOM 0 H VAL A 86 17.445 11.498 -4.297 1.00 0.00 H new ATOM 0 HA VAL A 86 17.713 14.276 -3.775 1.00 0.00 H new ATOM 0 HB VAL A 86 17.904 13.014 -5.940 1.00 0.00 H new ATOM 0 HG11 VAL A 86 15.823 12.600 -7.236 1.00 0.00 H new ATOM 0 HG12 VAL A 86 15.906 11.598 -5.768 1.00 0.00 H new ATOM 0 HG13 VAL A 86 14.860 13.037 -5.804 1.00 0.00 H new ATOM 0 HG21 VAL A 86 16.832 14.805 -7.310 1.00 0.00 H new ATOM 0 HG22 VAL A 86 15.927 15.339 -5.874 1.00 0.00 H new ATOM 0 HG23 VAL A 86 17.702 15.471 -5.907 1.00 0.00 H new ATOM 1296 N ALA A 87 14.809 12.961 -3.145 1.00 0.00 N ATOM 1297 CA ALA A 87 13.466 13.206 -2.648 1.00 0.00 C ATOM 1298 C ALA A 87 13.444 13.458 -1.139 1.00 0.00 C ATOM 1299 O ALA A 87 12.373 13.695 -0.580 1.00 0.00 O ATOM 1300 CB ALA A 87 12.586 12.011 -3.006 1.00 0.00 C ATOM 0 H ALA A 87 15.067 11.974 -3.167 1.00 0.00 H new ATOM 0 HA ALA A 87 13.082 14.111 -3.119 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.574 12.181 -2.639 1.00 0.00 H new ATOM 0 HB2 ALA A 87 12.563 11.887 -4.089 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.992 11.110 -2.547 1.00 0.00 H new ATOM 1306 N ARG A 88 14.602 13.413 -0.467 1.00 0.00 N ATOM 1307 CA ARG A 88 14.668 13.757 0.952 1.00 0.00 C ATOM 1308 C ARG A 88 15.791 14.750 1.242 1.00 0.00 C ATOM 1309 O ARG A 88 15.728 15.472 2.233 1.00 0.00 O ATOM 1310 CB ARG A 88 14.751 12.475 1.793 1.00 0.00 C ATOM 1311 CG ARG A 88 16.162 11.895 1.940 1.00 0.00 C ATOM 1312 CD ARG A 88 16.872 12.513 3.148 1.00 0.00 C ATOM 1313 NE ARG A 88 18.186 11.901 3.382 1.00 0.00 N ATOM 1314 CZ ARG A 88 18.733 11.746 4.590 1.00 0.00 C ATOM 1315 NH1 ARG A 88 18.083 12.112 5.693 1.00 0.00 N ATOM 1316 NH2 ARG A 88 19.950 11.222 4.701 1.00 0.00 N ATOM 0 H ARG A 88 15.495 13.144 -0.881 1.00 0.00 H new ATOM 0 HA ARG A 88 13.752 14.274 1.239 1.00 0.00 H new ATOM 0 HB2 ARG A 88 14.353 12.682 2.786 1.00 0.00 H new ATOM 0 HB3 ARG A 88 14.107 11.719 1.343 1.00 0.00 H new ATOM 0 HG2 ARG A 88 16.106 10.813 2.058 1.00 0.00 H new ATOM 0 HG3 ARG A 88 16.737 12.088 1.034 1.00 0.00 H new ATOM 0 HD2 ARG A 88 16.994 13.584 2.989 1.00 0.00 H new ATOM 0 HD3 ARG A 88 16.251 12.391 4.036 1.00 0.00 H new ATOM 0 HE ARG A 88 18.713 11.574 2.572 1.00 0.00 H new ATOM 0 HH11 ARG A 88 17.150 12.519 5.624 1.00 0.00 H new ATOM 0 HH12 ARG A 88 18.518 11.985 6.607 1.00 0.00 H new ATOM 0 HH21 ARG A 88 20.462 10.940 3.865 1.00 0.00 H new ATOM 0 HH22 ARG A 88 20.371 11.102 5.622 1.00 0.00 H new ATOM 1330 N ALA A 89 16.813 14.795 0.381 1.00 0.00 N ATOM 1331 CA ALA A 89 17.902 15.755 0.492 1.00 0.00 C ATOM 1332 C ALA A 89 17.461 17.151 0.042 1.00 0.00 C ATOM 1333 O ALA A 89 18.249 18.093 0.097 1.00 0.00 O ATOM 1334 CB ALA A 89 19.082 15.272 -0.351 1.00 0.00 C ATOM 0 H ALA A 89 16.903 14.162 -0.413 1.00 0.00 H new ATOM 0 HA ALA A 89 18.201 15.827 1.538 1.00 0.00 H new ATOM 0 HB1 ALA A 89 19.902 15.986 -0.273 1.00 0.00 H new ATOM 0 HB2 ALA A 89 19.413 14.299 0.011 1.00 0.00 H new ATOM 0 HB3 ALA A 89 18.774 15.186 -1.393 1.00 0.00 H new ATOM 1340 N ARG A 90 16.205 17.286 -0.404 1.00 0.00 N ATOM 1341 CA ARG A 90 15.654 18.560 -0.850 1.00 0.00 C ATOM 1342 C ARG A 90 14.400 18.922 -0.058 1.00 0.00 C ATOM 1343 O ARG A 90 13.928 20.051 -0.153 1.00 0.00 O ATOM 1344 CB ARG A 90 15.344 18.496 -2.349 1.00 0.00 C ATOM 1345 CG ARG A 90 16.608 18.188 -3.157 1.00 0.00 C ATOM 1346 CD ARG A 90 16.276 18.127 -4.649 1.00 0.00 C ATOM 1347 NE ARG A 90 15.963 19.452 -5.190 1.00 0.00 N ATOM 1348 CZ ARG A 90 15.774 19.716 -6.484 1.00 0.00 C ATOM 1349 NH1 ARG A 90 15.864 18.751 -7.399 1.00 0.00 N ATOM 1350 NH2 ARG A 90 15.492 20.957 -6.865 1.00 0.00 N ATOM 0 H ARG A 90 15.546 16.510 -0.463 1.00 0.00 H new ATOM 0 HA ARG A 90 16.396 19.339 -0.673 1.00 0.00 H new ATOM 0 HB2 ARG A 90 14.592 17.729 -2.536 1.00 0.00 H new ATOM 0 HB3 ARG A 90 14.920 19.445 -2.677 1.00 0.00 H new ATOM 0 HG2 ARG A 90 17.361 18.955 -2.975 1.00 0.00 H new ATOM 0 HG3 ARG A 90 17.034 17.239 -2.832 1.00 0.00 H new ATOM 0 HD2 ARG A 90 17.120 17.702 -5.192 1.00 0.00 H new ATOM 0 HD3 ARG A 90 15.428 17.460 -4.806 1.00 0.00 H new ATOM 0 HE ARG A 90 15.884 20.227 -4.531 1.00 0.00 H new ATOM 0 HH11 ARG A 90 16.080 17.796 -7.113 1.00 0.00 H new ATOM 0 HH12 ARG A 90 15.717 18.968 -8.385 1.00 0.00 H new ATOM 0 HH21 ARG A 90 15.421 21.700 -6.170 1.00 0.00 H new ATOM 0 HH22 ARG A 90 15.346 21.167 -7.853 1.00 0.00 H new ATOM 1364 N LEU A 91 13.868 17.965 0.713 1.00 0.00 N ATOM 1365 CA LEU A 91 12.682 18.145 1.541 1.00 0.00 C ATOM 1366 C LEU A 91 12.950 17.657 2.967 1.00 0.00 C ATOM 1367 O LEU A 91 12.035 17.212 3.654 1.00 0.00 O ATOM 1368 CB LEU A 91 11.474 17.413 0.931 1.00 0.00 C ATOM 1369 CG LEU A 91 10.793 18.118 -0.250 1.00 0.00 C ATOM 1370 CD1 LEU A 91 10.549 19.591 0.074 1.00 0.00 C ATOM 1371 CD2 LEU A 91 11.582 17.982 -1.551 1.00 0.00 C ATOM 0 H LEU A 91 14.263 17.027 0.776 1.00 0.00 H new ATOM 0 HA LEU A 91 12.446 19.208 1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 91 11.799 16.426 0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 91 10.732 17.259 1.715 1.00 0.00 H new ATOM 0 HG LEU A 91 9.836 17.621 -0.405 1.00 0.00 H new ATOM 0 HD11 LEU A 91 10.066 20.075 -0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 91 9.906 19.669 0.951 1.00 0.00 H new ATOM 0 HD13 LEU A 91 11.501 20.081 0.277 1.00 0.00 H new ATOM 0 HD21 LEU A 91 11.054 18.499 -2.352 1.00 0.00 H new ATOM 0 HD22 LEU A 91 12.571 18.422 -1.424 1.00 0.00 H new ATOM 0 HD23 LEU A 91 11.684 16.927 -1.806 1.00 0.00 H new ATOM 1383 N ALA A 92 14.206 17.741 3.413 1.00 0.00 N ATOM 1384 CA ALA A 92 14.638 17.357 4.752 1.00 0.00 C ATOM 1385 C ALA A 92 13.944 18.145 5.876 1.00 0.00 C ATOM 1386 O ALA A 92 14.363 18.050 7.029 1.00 0.00 O ATOM 1387 CB ALA A 92 16.158 17.522 4.844 1.00 0.00 C ATOM 0 H ALA A 92 14.970 18.089 2.833 1.00 0.00 H new ATOM 0 HA ALA A 92 14.349 16.317 4.902 1.00 0.00 H new ATOM 0 HB1 ALA A 92 16.495 17.238 5.841 1.00 0.00 H new ATOM 0 HB2 ALA A 92 16.639 16.884 4.103 1.00 0.00 H new ATOM 0 HB3 ALA A 92 16.423 18.562 4.654 1.00 0.00 H new ATOM 1393 N ARG A 93 12.899 18.919 5.562 1.00 0.00 N ATOM 1394 CA ARG A 93 12.186 19.742 6.536 1.00 0.00 C ATOM 1395 C ARG A 93 10.675 19.524 6.455 1.00 0.00 C ATOM 1396 O ARG A 93 9.931 20.148 7.209 1.00 0.00 O ATOM 1397 CB ARG A 93 12.519 21.219 6.290 1.00 0.00 C ATOM 1398 CG ARG A 93 14.012 21.530 6.431 1.00 0.00 C ATOM 1399 CD ARG A 93 14.483 21.320 7.870 1.00 0.00 C ATOM 1400 NE ARG A 93 15.895 21.692 8.014 1.00 0.00 N ATOM 1401 CZ ARG A 93 16.919 20.833 7.983 1.00 0.00 C ATOM 1402 NH1 ARG A 93 16.718 19.530 7.804 1.00 0.00 N ATOM 1403 NH2 ARG A 93 18.161 21.280 8.133 1.00 0.00 N ATOM 0 H ARG A 93 12.524 18.990 4.616 1.00 0.00 H new ATOM 0 HA ARG A 93 12.508 19.450 7.536 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.189 21.498 5.289 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.958 21.834 6.994 1.00 0.00 H new ATOM 0 HG2 ARG A 93 14.585 20.890 5.760 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.202 22.560 6.129 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.874 21.917 8.548 1.00 0.00 H new ATOM 0 HD3 ARG A 93 14.346 20.277 8.154 1.00 0.00 H new ATOM 0 HE ARG A 93 16.112 22.680 8.148 1.00 0.00 H new ATOM 0 HH11 ARG A 93 15.770 19.171 7.688 1.00 0.00 H new ATOM 0 HH12 ARG A 93 17.512 18.890 7.783 1.00 0.00 H new ATOM 0 HH21 ARG A 93 18.331 22.276 8.271 1.00 0.00 H new ATOM 0 HH22 ARG A 93 18.944 20.627 8.110 1.00 0.00 H new ATOM 1417 N MET A 94 10.214 18.651 5.554 1.00 0.00 N ATOM 1418 CA MET A 94 8.795 18.366 5.388 1.00 0.00 C ATOM 1419 C MET A 94 8.337 17.320 6.408 1.00 0.00 C ATOM 1420 O MET A 94 9.116 16.461 6.818 1.00 0.00 O ATOM 1421 CB MET A 94 8.564 17.875 3.956 1.00 0.00 C ATOM 1422 CG MET A 94 7.072 17.695 3.672 1.00 0.00 C ATOM 1423 SD MET A 94 6.675 17.206 1.972 1.00 0.00 S ATOM 1424 CE MET A 94 7.125 18.723 1.096 1.00 0.00 C ATOM 0 H MET A 94 10.818 18.125 4.922 1.00 0.00 H new ATOM 0 HA MET A 94 8.209 19.269 5.561 1.00 0.00 H new ATOM 0 HB2 MET A 94 8.989 18.589 3.250 1.00 0.00 H new ATOM 0 HB3 MET A 94 9.083 16.929 3.804 1.00 0.00 H new ATOM 0 HG2 MET A 94 6.675 16.943 4.354 1.00 0.00 H new ATOM 0 HG3 MET A 94 6.559 18.630 3.895 1.00 0.00 H new ATOM 0 HE1 MET A 94 6.275 19.070 0.509 1.00 0.00 H new ATOM 0 HE2 MET A 94 7.405 19.491 1.818 1.00 0.00 H new ATOM 0 HE3 MET A 94 7.967 18.524 0.433 1.00 0.00 H new ATOM 1434 N THR A 95 7.069 17.398 6.812 1.00 0.00 N ATOM 1435 CA THR A 95 6.458 16.460 7.745 1.00 0.00 C ATOM 1436 C THR A 95 6.434 15.057 7.132 1.00 0.00 C ATOM 1437 O THR A 95 6.143 14.922 5.944 1.00 0.00 O ATOM 1438 CB THR A 95 5.032 16.942 8.045 1.00 0.00 C ATOM 1439 OG1 THR A 95 5.064 18.299 8.425 1.00 0.00 O ATOM 1440 CG2 THR A 95 4.372 16.145 9.165 1.00 0.00 C ATOM 0 H THR A 95 6.430 18.127 6.494 1.00 0.00 H new ATOM 0 HA THR A 95 7.033 16.415 8.670 1.00 0.00 H new ATOM 0 HB THR A 95 4.448 16.800 7.135 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.153 18.607 8.615 1.00 0.00 H new ATOM 0 HG21 THR A 95 3.365 16.526 9.338 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.319 15.094 8.881 1.00 0.00 H new ATOM 0 HG23 THR A 95 4.959 16.245 10.078 1.00 0.00 H new ATOM 1448 N PRO A 96 6.726 14.006 7.911 1.00 0.00 N ATOM 1449 CA PRO A 96 6.768 12.628 7.440 1.00 0.00 C ATOM 1450 C PRO A 96 5.390 12.071 7.067 1.00 0.00 C ATOM 1451 O PRO A 96 5.273 10.884 6.755 1.00 0.00 O ATOM 1452 CB PRO A 96 7.409 11.834 8.579 1.00 0.00 C ATOM 1453 CG PRO A 96 7.022 12.631 9.822 1.00 0.00 C ATOM 1454 CD PRO A 96 7.064 14.072 9.321 1.00 0.00 C ATOM 0 HA PRO A 96 7.339 12.557 6.514 1.00 0.00 H new ATOM 0 HB2 PRO A 96 7.030 10.813 8.621 1.00 0.00 H new ATOM 0 HB3 PRO A 96 8.491 11.767 8.464 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.032 12.358 10.187 1.00 0.00 H new ATOM 0 HG3 PRO A 96 7.721 12.467 10.642 1.00 0.00 H new ATOM 0 HD2 PRO A 96 6.355 14.697 9.865 1.00 0.00 H new ATOM 0 HD3 PRO A 96 8.052 14.509 9.467 1.00 0.00 H new ATOM 1462 N LEU A 97 4.346 12.905 7.092 1.00 0.00 N ATOM 1463 CA LEU A 97 2.993 12.486 6.758 1.00 0.00 C ATOM 1464 C LEU A 97 2.481 13.326 5.589 1.00 0.00 C ATOM 1465 O LEU A 97 1.792 12.813 4.708 1.00 0.00 O ATOM 1466 CB LEU A 97 2.137 12.610 8.029 1.00 0.00 C ATOM 1467 CG LEU A 97 0.809 11.840 8.042 1.00 0.00 C ATOM 1468 CD1 LEU A 97 -0.238 12.454 7.121 1.00 0.00 C ATOM 1469 CD2 LEU A 97 0.997 10.373 7.662 1.00 0.00 C ATOM 0 H LEU A 97 4.422 13.890 7.346 1.00 0.00 H new ATOM 0 HA LEU A 97 2.950 11.448 6.429 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.734 12.273 8.876 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.920 13.666 8.192 1.00 0.00 H new ATOM 0 HG LEU A 97 0.450 11.907 9.069 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.156 11.868 7.171 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.444 13.477 7.435 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.135 12.457 6.097 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.033 9.865 7.684 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.419 10.308 6.659 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.674 9.897 8.372 1.00 0.00 H new ATOM 1481 N SER A 98 2.812 14.621 5.561 1.00 0.00 N ATOM 1482 CA SER A 98 2.505 15.468 4.415 1.00 0.00 C ATOM 1483 C SER A 98 3.366 15.060 3.219 1.00 0.00 C ATOM 1484 O SER A 98 2.992 15.307 2.072 1.00 0.00 O ATOM 1485 CB SER A 98 2.769 16.932 4.762 1.00 0.00 C ATOM 1486 OG SER A 98 2.037 17.296 5.913 1.00 0.00 O ATOM 0 H SER A 98 3.293 15.101 6.322 1.00 0.00 H new ATOM 0 HA SER A 98 1.453 15.345 4.158 1.00 0.00 H new ATOM 0 HB2 SER A 98 3.834 17.087 4.935 1.00 0.00 H new ATOM 0 HB3 SER A 98 2.486 17.569 3.924 1.00 0.00 H new ATOM 0 HG SER A 98 2.213 18.235 6.129 1.00 0.00 H new ATOM 1492 N ARG A 99 4.521 14.436 3.483 1.00 0.00 N ATOM 1493 CA ARG A 99 5.422 13.996 2.429 1.00 0.00 C ATOM 1494 C ARG A 99 4.838 12.814 1.663 1.00 0.00 C ATOM 1495 O ARG A 99 5.030 12.726 0.456 1.00 0.00 O ATOM 1496 CB ARG A 99 6.781 13.642 3.043 1.00 0.00 C ATOM 1497 CG ARG A 99 7.790 13.274 1.952 1.00 0.00 C ATOM 1498 CD ARG A 99 9.171 13.075 2.572 1.00 0.00 C ATOM 1499 NE ARG A 99 10.151 12.666 1.561 1.00 0.00 N ATOM 1500 CZ ARG A 99 10.469 11.399 1.283 1.00 0.00 C ATOM 1501 NH1 ARG A 99 9.899 10.388 1.932 1.00 0.00 N ATOM 1502 NH2 ARG A 99 11.369 11.135 0.343 1.00 0.00 N ATOM 0 H ARG A 99 4.848 14.227 4.426 1.00 0.00 H new ATOM 0 HA ARG A 99 5.555 14.806 1.712 1.00 0.00 H new ATOM 0 HB2 ARG A 99 7.155 14.487 3.621 1.00 0.00 H new ATOM 0 HB3 ARG A 99 6.666 12.808 3.735 1.00 0.00 H new ATOM 0 HG2 ARG A 99 7.474 12.363 1.444 1.00 0.00 H new ATOM 0 HG3 ARG A 99 7.829 14.061 1.199 1.00 0.00 H new ATOM 0 HD2 ARG A 99 9.497 14.001 3.045 1.00 0.00 H new ATOM 0 HD3 ARG A 99 9.116 12.319 3.356 1.00 0.00 H new ATOM 0 HE ARG A 99 10.623 13.400 1.033 1.00 0.00 H new ATOM 0 HH11 ARG A 99 9.205 10.573 2.657 1.00 0.00 H new ATOM 0 HH12 ARG A 99 10.155 9.427 1.705 1.00 0.00 H new ATOM 0 HH21 ARG A 99 11.815 11.899 -0.165 1.00 0.00 H new ATOM 0 HH22 ARG A 99 11.614 10.168 0.129 1.00 0.00 H new ATOM 1516 N GLN A 100 4.127 11.903 2.336 1.00 0.00 N ATOM 1517 CA GLN A 100 3.533 10.773 1.639 1.00 0.00 C ATOM 1518 C GLN A 100 2.229 11.194 0.966 1.00 0.00 C ATOM 1519 O GLN A 100 1.807 10.569 -0.005 1.00 0.00 O ATOM 1520 CB GLN A 100 3.366 9.575 2.579 1.00 0.00 C ATOM 1521 CG GLN A 100 2.597 9.905 3.854 1.00 0.00 C ATOM 1522 CD GLN A 100 2.565 8.696 4.781 1.00 0.00 C ATOM 1523 OE1 GLN A 100 1.755 7.789 4.600 1.00 0.00 O ATOM 1524 NE2 GLN A 100 3.443 8.670 5.780 1.00 0.00 N ATOM 0 H GLN A 100 3.955 11.929 3.341 1.00 0.00 H new ATOM 0 HA GLN A 100 4.207 10.444 0.847 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.848 8.776 2.048 1.00 0.00 H new ATOM 0 HB3 GLN A 100 4.351 9.193 2.847 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.066 10.748 4.361 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.580 10.208 3.605 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.101 9.440 5.901 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.458 7.880 6.425 1.00 0.00 H new ATOM 1533 N ALA A 101 1.582 12.251 1.466 1.00 0.00 N ATOM 1534 CA ALA A 101 0.412 12.795 0.793 1.00 0.00 C ATOM 1535 C ALA A 101 0.812 13.316 -0.585 1.00 0.00 C ATOM 1536 O ALA A 101 0.027 13.233 -1.527 1.00 0.00 O ATOM 1537 CB ALA A 101 -0.191 13.918 1.639 1.00 0.00 C ATOM 0 H ALA A 101 1.848 12.737 2.322 1.00 0.00 H new ATOM 0 HA ALA A 101 -0.337 12.013 0.667 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.067 14.324 1.133 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.484 13.523 2.612 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.548 14.708 1.775 1.00 0.00 H new ATOM 1543 N LEU A 102 2.033 13.850 -0.710 1.00 0.00 N ATOM 1544 CA LEU A 102 2.558 14.296 -1.992 1.00 0.00 C ATOM 1545 C LEU A 102 2.771 13.094 -2.912 1.00 0.00 C ATOM 1546 O LEU A 102 2.467 13.162 -4.099 1.00 0.00 O ATOM 1547 CB LEU A 102 3.875 15.043 -1.745 1.00 0.00 C ATOM 1548 CG LEU A 102 4.623 15.410 -3.032 1.00 0.00 C ATOM 1549 CD1 LEU A 102 3.798 16.329 -3.930 1.00 0.00 C ATOM 1550 CD2 LEU A 102 5.923 16.126 -2.666 1.00 0.00 C ATOM 0 H LEU A 102 2.675 13.981 0.072 1.00 0.00 H new ATOM 0 HA LEU A 102 1.852 14.968 -2.480 1.00 0.00 H new ATOM 0 HB2 LEU A 102 3.667 15.954 -1.183 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.522 14.425 -1.122 1.00 0.00 H new ATOM 0 HG LEU A 102 4.820 14.487 -3.577 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.366 16.564 -4.830 1.00 0.00 H new ATOM 0 HD12 LEU A 102 2.869 15.830 -4.207 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.569 17.251 -3.395 1.00 0.00 H new ATOM 0 HD21 LEU A 102 6.461 16.391 -3.576 1.00 0.00 H new ATOM 0 HD22 LEU A 102 5.694 17.031 -2.104 1.00 0.00 H new ATOM 0 HD23 LEU A 102 6.542 15.467 -2.057 1.00 0.00 H new ATOM 1562 N LEU A 103 3.287 11.988 -2.370 1.00 0.00 N ATOM 1563 CA LEU A 103 3.493 10.761 -3.135 1.00 0.00 C ATOM 1564 C LEU A 103 2.160 10.081 -3.461 1.00 0.00 C ATOM 1565 O LEU A 103 2.137 9.084 -4.180 1.00 0.00 O ATOM 1566 CB LEU A 103 4.372 9.789 -2.335 1.00 0.00 C ATOM 1567 CG LEU A 103 5.708 10.395 -1.887 1.00 0.00 C ATOM 1568 CD1 LEU A 103 6.477 9.362 -1.068 1.00 0.00 C ATOM 1569 CD2 LEU A 103 6.564 10.817 -3.073 1.00 0.00 C ATOM 0 H LEU A 103 3.572 11.920 -1.393 1.00 0.00 H new ATOM 0 HA LEU A 103 3.986 11.027 -4.070 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.822 9.454 -1.456 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.569 8.906 -2.943 1.00 0.00 H new ATOM 0 HG LEU A 103 5.490 11.281 -1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 103 7.428 9.787 -0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.891 9.082 -0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 103 6.663 8.478 -1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 103 7.501 11.241 -2.713 1.00 0.00 H new ATOM 0 HD22 LEU A 103 6.775 9.948 -3.697 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.030 11.564 -3.660 1.00 0.00 H new ATOM 1581 N LEU A 104 1.052 10.614 -2.936 1.00 0.00 N ATOM 1582 CA LEU A 104 -0.266 10.024 -3.092 1.00 0.00 C ATOM 1583 C LEU A 104 -1.183 10.880 -3.968 1.00 0.00 C ATOM 1584 O LEU A 104 -2.302 10.468 -4.268 1.00 0.00 O ATOM 1585 CB LEU A 104 -0.831 9.824 -1.683 1.00 0.00 C ATOM 1586 CG LEU A 104 -2.143 9.042 -1.616 1.00 0.00 C ATOM 1587 CD1 LEU A 104 -2.068 7.716 -2.372 1.00 0.00 C ATOM 1588 CD2 LEU A 104 -2.414 8.763 -0.139 1.00 0.00 C ATOM 0 H LEU A 104 1.053 11.474 -2.388 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.196 9.069 -3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.086 9.306 -1.080 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.985 10.802 -1.228 1.00 0.00 H new ATOM 0 HG LEU A 104 -2.936 9.627 -2.082 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.024 7.198 -2.294 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.843 7.908 -3.421 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.283 7.095 -1.940 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.345 8.204 -0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.593 8.179 0.277 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.498 9.707 0.400 1.00 0.00 H new ATOM 1600 N THR A 105 -0.723 12.065 -4.386 1.00 0.00 N ATOM 1601 CA THR A 105 -1.514 12.958 -5.229 1.00 0.00 C ATOM 1602 C THR A 105 -0.680 13.608 -6.331 1.00 0.00 C ATOM 1603 O THR A 105 -1.188 14.455 -7.064 1.00 0.00 O ATOM 1604 CB THR A 105 -2.184 14.042 -4.386 1.00 0.00 C ATOM 1605 OG1 THR A 105 -1.190 14.844 -3.782 1.00 0.00 O ATOM 1606 CG2 THR A 105 -3.076 13.429 -3.306 1.00 0.00 C ATOM 0 H THR A 105 0.201 12.426 -4.150 1.00 0.00 H new ATOM 0 HA THR A 105 -2.276 12.343 -5.707 1.00 0.00 H new ATOM 0 HB THR A 105 -2.810 14.650 -5.039 1.00 0.00 H new ATOM 0 HG1 THR A 105 -0.764 14.345 -3.054 1.00 0.00 H new ATOM 0 HG21 THR A 105 -3.539 14.224 -2.722 1.00 0.00 H new ATOM 0 HG22 THR A 105 -3.852 12.824 -3.775 1.00 0.00 H new ATOM 0 HG23 THR A 105 -2.474 12.801 -2.650 1.00 0.00 H new ATOM 1614 N ALA A 106 0.593 13.223 -6.460 1.00 0.00 N ATOM 1615 CA ALA A 106 1.458 13.748 -7.509 1.00 0.00 C ATOM 1616 C ALA A 106 2.251 12.630 -8.196 1.00 0.00 C ATOM 1617 O ALA A 106 3.102 12.907 -9.036 1.00 0.00 O ATOM 1618 CB ALA A 106 2.375 14.822 -6.920 1.00 0.00 C ATOM 0 H ALA A 106 1.045 12.546 -5.845 1.00 0.00 H new ATOM 0 HA ALA A 106 0.841 14.205 -8.283 1.00 0.00 H new ATOM 0 HB1 ALA A 106 3.023 15.216 -7.703 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.771 15.630 -6.508 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.985 14.386 -6.129 1.00 0.00 H new ATOM 1624 N MET A 107 1.969 11.369 -7.843 1.00 0.00 N ATOM 1625 CA MET A 107 2.587 10.200 -8.459 1.00 0.00 C ATOM 1626 C MET A 107 1.567 9.099 -8.741 1.00 0.00 C ATOM 1627 O MET A 107 1.947 8.032 -9.218 1.00 0.00 O ATOM 1628 CB MET A 107 3.685 9.657 -7.544 1.00 0.00 C ATOM 1629 CG MET A 107 5.016 10.359 -7.798 1.00 0.00 C ATOM 1630 SD MET A 107 5.793 10.962 -6.287 1.00 0.00 S ATOM 1631 CE MET A 107 4.880 12.512 -6.127 1.00 0.00 C ATOM 0 H MET A 107 1.297 11.135 -7.112 1.00 0.00 H new ATOM 0 HA MET A 107 3.013 10.513 -9.412 1.00 0.00 H new ATOM 0 HB2 MET A 107 3.393 9.792 -6.503 1.00 0.00 H new ATOM 0 HB3 MET A 107 3.800 8.585 -7.707 1.00 0.00 H new ATOM 0 HG2 MET A 107 5.695 9.669 -8.299 1.00 0.00 H new ATOM 0 HG3 MET A 107 4.855 11.197 -8.477 1.00 0.00 H new ATOM 0 HE1 MET A 107 5.219 13.044 -5.238 1.00 0.00 H new ATOM 0 HE2 MET A 107 5.055 13.130 -7.008 1.00 0.00 H new ATOM 0 HE3 MET A 107 3.815 12.299 -6.039 1.00 0.00 H new ATOM 1641 N GLU A 108 0.280 9.331 -8.457 1.00 0.00 N ATOM 1642 CA GLU A 108 -0.742 8.326 -8.722 1.00 0.00 C ATOM 1643 C GLU A 108 -2.097 8.950 -9.078 1.00 0.00 C ATOM 1644 O GLU A 108 -2.946 8.288 -9.668 1.00 0.00 O ATOM 1645 CB GLU A 108 -0.855 7.417 -7.494 1.00 0.00 C ATOM 1646 CG GLU A 108 -1.600 6.112 -7.789 1.00 0.00 C ATOM 1647 CD GLU A 108 -0.759 5.127 -8.597 1.00 0.00 C ATOM 1648 OE1 GLU A 108 -0.362 5.472 -9.732 1.00 0.00 O ATOM 1649 OE2 GLU A 108 -0.511 4.019 -8.067 1.00 0.00 O ATOM 0 H GLU A 108 -0.070 10.197 -8.048 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.445 7.743 -9.593 1.00 0.00 H new ATOM 0 HB2 GLU A 108 0.144 7.184 -7.126 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.371 7.953 -6.697 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.896 5.646 -6.849 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -2.516 6.336 -8.336 1.00 0.00 H new ATOM 1656 N GLY A 109 -2.315 10.225 -8.727 1.00 0.00 N ATOM 1657 CA GLY A 109 -3.525 10.947 -9.103 1.00 0.00 C ATOM 1658 C GLY A 109 -4.792 10.408 -8.437 1.00 0.00 C ATOM 1659 O GLY A 109 -5.893 10.731 -8.887 1.00 0.00 O ATOM 0 H GLY A 109 -1.657 10.777 -8.177 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -3.407 11.999 -8.842 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -3.645 10.899 -10.185 1.00 0.00 H new ATOM 1663 N PHE A 110 -4.663 9.599 -7.378 1.00 0.00 N ATOM 1664 CA PHE A 110 -5.812 9.074 -6.653 1.00 0.00 C ATOM 1665 C PHE A 110 -6.696 10.197 -6.120 1.00 0.00 C ATOM 1666 O PHE A 110 -6.232 11.312 -5.881 1.00 0.00 O ATOM 1667 CB PHE A 110 -5.338 8.199 -5.489 1.00 0.00 C ATOM 1668 CG PHE A 110 -4.999 6.761 -5.821 1.00 0.00 C ATOM 1669 CD1 PHE A 110 -4.929 6.307 -7.147 1.00 0.00 C ATOM 1670 CD2 PHE A 110 -4.764 5.865 -4.767 1.00 0.00 C ATOM 1671 CE1 PHE A 110 -4.641 4.958 -7.413 1.00 0.00 C ATOM 1672 CE2 PHE A 110 -4.474 4.518 -5.033 1.00 0.00 C ATOM 1673 CZ PHE A 110 -4.413 4.064 -6.359 1.00 0.00 C ATOM 0 H PHE A 110 -3.763 9.295 -7.007 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.402 8.477 -7.348 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.456 8.665 -5.049 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -6.114 8.199 -4.724 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -5.097 6.995 -7.963 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.807 6.214 -3.746 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.595 4.609 -8.434 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.298 3.832 -4.218 1.00 0.00 H new ATOM 0 HZ PHE A 110 -4.191 3.028 -6.567 1.00 0.00 H new ATOM 1683 N SER A 111 -7.982 9.887 -5.929 1.00 0.00 N ATOM 1684 CA SER A 111 -8.939 10.806 -5.344 1.00 0.00 C ATOM 1685 C SER A 111 -8.529 11.125 -3.906 1.00 0.00 C ATOM 1686 O SER A 111 -7.978 10.256 -3.226 1.00 0.00 O ATOM 1687 CB SER A 111 -10.321 10.148 -5.359 1.00 0.00 C ATOM 1688 OG SER A 111 -11.257 10.944 -4.669 1.00 0.00 O ATOM 0 H SER A 111 -8.382 8.983 -6.181 1.00 0.00 H new ATOM 0 HA SER A 111 -8.966 11.733 -5.916 1.00 0.00 H new ATOM 0 HB2 SER A 111 -10.649 10.001 -6.388 1.00 0.00 H new ATOM 0 HB3 SER A 111 -10.265 9.162 -4.899 1.00 0.00 H new ATOM 0 HG SER A 111 -12.135 10.509 -4.690 1.00 0.00 H new ATOM 1694 N PRO A 112 -8.781 12.348 -3.422 1.00 0.00 N ATOM 1695 CA PRO A 112 -8.446 12.735 -2.064 1.00 0.00 C ATOM 1696 C PRO A 112 -9.279 11.961 -1.043 1.00 0.00 C ATOM 1697 O PRO A 112 -8.925 11.932 0.133 1.00 0.00 O ATOM 1698 CB PRO A 112 -8.711 14.241 -1.989 1.00 0.00 C ATOM 1699 CG PRO A 112 -9.779 14.463 -3.059 1.00 0.00 C ATOM 1700 CD PRO A 112 -9.402 13.450 -4.136 1.00 0.00 C ATOM 0 HA PRO A 112 -7.408 12.505 -1.825 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -9.063 14.539 -1.001 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -7.810 14.819 -2.194 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -10.782 14.285 -2.671 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -9.761 15.484 -3.441 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -10.281 13.116 -4.688 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -8.716 13.885 -4.863 1.00 0.00 H new ATOM 1708 N GLU A 113 -10.377 11.331 -1.477 1.00 0.00 N ATOM 1709 CA GLU A 113 -11.207 10.538 -0.582 1.00 0.00 C ATOM 1710 C GLU A 113 -10.512 9.219 -0.245 1.00 0.00 C ATOM 1711 O GLU A 113 -10.504 8.800 0.912 1.00 0.00 O ATOM 1712 CB GLU A 113 -12.555 10.248 -1.245 1.00 0.00 C ATOM 1713 CG GLU A 113 -13.319 11.539 -1.546 1.00 0.00 C ATOM 1714 CD GLU A 113 -14.675 11.234 -2.175 1.00 0.00 C ATOM 1715 OE1 GLU A 113 -14.730 11.136 -3.423 1.00 0.00 O ATOM 1716 OE2 GLU A 113 -15.650 11.102 -1.405 1.00 0.00 O ATOM 0 H GLU A 113 -10.706 11.359 -2.442 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.367 11.102 0.337 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -12.395 9.694 -2.170 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -13.154 9.613 -0.592 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -13.460 12.106 -0.626 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.733 12.164 -2.220 1.00 0.00 H new ATOM 1723 N ASP A 114 -9.923 8.562 -1.248 1.00 0.00 N ATOM 1724 CA ASP A 114 -9.221 7.304 -1.036 1.00 0.00 C ATOM 1725 C ASP A 114 -7.847 7.571 -0.435 1.00 0.00 C ATOM 1726 O ASP A 114 -7.316 6.742 0.304 1.00 0.00 O ATOM 1727 CB ASP A 114 -9.075 6.571 -2.367 1.00 0.00 C ATOM 1728 CG ASP A 114 -10.435 6.206 -2.952 1.00 0.00 C ATOM 1729 OD1 ASP A 114 -11.159 5.426 -2.292 1.00 0.00 O ATOM 1730 OD2 ASP A 114 -10.745 6.708 -4.057 1.00 0.00 O ATOM 0 H ASP A 114 -9.921 8.886 -2.215 1.00 0.00 H new ATOM 0 HA ASP A 114 -9.793 6.684 -0.345 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -8.530 7.199 -3.072 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -8.484 5.666 -2.223 1.00 0.00 H new ATOM 1735 N ALA A 115 -7.264 8.732 -0.750 1.00 0.00 N ATOM 1736 CA ALA A 115 -5.994 9.132 -0.180 1.00 0.00 C ATOM 1737 C ALA A 115 -6.138 9.429 1.312 1.00 0.00 C ATOM 1738 O ALA A 115 -5.183 9.264 2.069 1.00 0.00 O ATOM 1739 CB ALA A 115 -5.480 10.367 -0.919 1.00 0.00 C ATOM 0 H ALA A 115 -7.662 9.408 -1.402 1.00 0.00 H new ATOM 0 HA ALA A 115 -5.280 8.316 -0.292 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -4.524 10.673 -0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.349 10.131 -1.975 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -6.200 11.179 -0.815 1.00 0.00 H new ATOM 1745 N ALA A 116 -7.329 9.865 1.738 1.00 0.00 N ATOM 1746 CA ALA A 116 -7.586 10.153 3.139 1.00 0.00 C ATOM 1747 C ALA A 116 -7.724 8.854 3.929 1.00 0.00 C ATOM 1748 O ALA A 116 -7.310 8.780 5.085 1.00 0.00 O ATOM 1749 CB ALA A 116 -8.865 10.980 3.249 1.00 0.00 C ATOM 0 H ALA A 116 -8.128 10.024 1.124 1.00 0.00 H new ATOM 0 HA ALA A 116 -6.751 10.717 3.555 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -9.066 11.201 4.297 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -8.744 11.913 2.698 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.699 10.417 2.830 1.00 0.00 H new ATOM 1755 N TYR A 117 -8.305 7.827 3.300 1.00 0.00 N ATOM 1756 CA TYR A 117 -8.447 6.515 3.907 1.00 0.00 C ATOM 1757 C TYR A 117 -7.088 5.827 4.060 1.00 0.00 C ATOM 1758 O TYR A 117 -6.911 4.984 4.940 1.00 0.00 O ATOM 1759 CB TYR A 117 -9.377 5.686 3.019 1.00 0.00 C ATOM 1760 CG TYR A 117 -9.415 4.210 3.335 1.00 0.00 C ATOM 1761 CD1 TYR A 117 -9.975 3.761 4.538 1.00 0.00 C ATOM 1762 CD2 TYR A 117 -8.885 3.291 2.415 1.00 0.00 C ATOM 1763 CE1 TYR A 117 -10.010 2.390 4.826 1.00 0.00 C ATOM 1764 CE2 TYR A 117 -8.920 1.919 2.694 1.00 0.00 C ATOM 1765 CZ TYR A 117 -9.480 1.462 3.905 1.00 0.00 C ATOM 1766 OH TYR A 117 -9.506 0.128 4.179 1.00 0.00 O ATOM 0 H TYR A 117 -8.687 7.890 2.356 1.00 0.00 H new ATOM 0 HA TYR A 117 -8.868 6.613 4.908 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -10.387 6.086 3.104 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -9.070 5.812 1.981 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -10.380 4.471 5.244 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -8.450 3.643 1.491 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -10.443 2.044 5.753 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -8.519 1.212 1.983 1.00 0.00 H new ATOM 0 HH TYR A 117 -9.101 -0.366 3.436 1.00 0.00 H new ATOM 1776 N LEU A 118 -6.122 6.185 3.207 1.00 0.00 N ATOM 1777 CA LEU A 118 -4.795 5.590 3.217 1.00 0.00 C ATOM 1778 C LEU A 118 -3.889 6.181 4.306 1.00 0.00 C ATOM 1779 O LEU A 118 -2.802 5.654 4.540 1.00 0.00 O ATOM 1780 CB LEU A 118 -4.191 5.746 1.818 1.00 0.00 C ATOM 1781 CG LEU A 118 -2.853 5.021 1.628 1.00 0.00 C ATOM 1782 CD1 LEU A 118 -2.928 3.558 2.061 1.00 0.00 C ATOM 1783 CD2 LEU A 118 -2.490 5.055 0.145 1.00 0.00 C ATOM 0 H LEU A 118 -6.246 6.899 2.490 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.880 4.532 3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -4.903 5.370 1.083 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.049 6.807 1.612 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.107 5.525 2.243 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.959 3.083 1.909 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.197 3.504 3.116 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.682 3.041 1.467 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.540 4.543 -0.009 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -3.269 4.556 -0.432 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.402 6.090 -0.184 1.00 0.00 H new ATOM 1795 N ILE A 119 -4.313 7.258 4.977 1.00 0.00 N ATOM 1796 CA ILE A 119 -3.537 7.867 6.056 1.00 0.00 C ATOM 1797 C ILE A 119 -4.421 8.192 7.265 1.00 0.00 C ATOM 1798 O ILE A 119 -4.009 8.931 8.159 1.00 0.00 O ATOM 1799 CB ILE A 119 -2.756 9.100 5.570 1.00 0.00 C ATOM 1800 CG1 ILE A 119 -3.723 10.207 5.133 1.00 0.00 C ATOM 1801 CG2 ILE A 119 -1.781 8.726 4.446 1.00 0.00 C ATOM 1802 CD1 ILE A 119 -2.992 11.415 4.552 1.00 0.00 C ATOM 0 H ILE A 119 -5.198 7.727 4.787 1.00 0.00 H new ATOM 0 HA ILE A 119 -2.800 7.133 6.382 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.161 9.482 6.400 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -4.414 9.811 4.389 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.321 10.523 5.988 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.242 9.616 4.121 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.071 7.985 4.812 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -2.337 8.311 3.605 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -3.718 12.172 4.257 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -2.320 11.830 5.304 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.415 11.106 3.680 1.00 0.00 H new ATOM 1814 N GLU A 120 -5.639 7.640 7.293 1.00 0.00 N ATOM 1815 CA GLU A 120 -6.576 7.752 8.406 1.00 0.00 C ATOM 1816 C GLU A 120 -6.960 9.195 8.756 1.00 0.00 C ATOM 1817 O GLU A 120 -6.844 9.608 9.911 1.00 0.00 O ATOM 1818 CB GLU A 120 -6.050 6.983 9.623 1.00 0.00 C ATOM 1819 CG GLU A 120 -5.812 5.511 9.282 1.00 0.00 C ATOM 1820 CD GLU A 120 -5.358 4.734 10.518 1.00 0.00 C ATOM 1821 OE1 GLU A 120 -6.244 4.280 11.278 1.00 0.00 O ATOM 1822 OE2 GLU A 120 -4.126 4.599 10.695 1.00 0.00 O ATOM 0 H GLU A 120 -6.006 7.088 6.518 1.00 0.00 H new ATOM 0 HA GLU A 120 -7.508 7.292 8.077 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -5.120 7.435 9.969 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -6.765 7.059 10.442 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.728 5.072 8.887 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -5.057 5.432 8.500 1.00 0.00 H new ATOM 1829 N VAL A 121 -7.419 9.964 7.764 1.00 0.00 N ATOM 1830 CA VAL A 121 -7.891 11.334 7.958 1.00 0.00 C ATOM 1831 C VAL A 121 -9.165 11.570 7.145 1.00 0.00 C ATOM 1832 O VAL A 121 -9.683 10.645 6.517 1.00 0.00 O ATOM 1833 CB VAL A 121 -6.809 12.351 7.562 1.00 0.00 C ATOM 1834 CG1 VAL A 121 -5.531 12.143 8.373 1.00 0.00 C ATOM 1835 CG2 VAL A 121 -6.485 12.260 6.071 1.00 0.00 C ATOM 0 H VAL A 121 -7.473 9.648 6.796 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.114 11.473 9.016 1.00 0.00 H new ATOM 0 HB VAL A 121 -7.207 13.342 7.778 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.784 12.877 8.070 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -5.750 12.264 9.434 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -5.146 11.139 8.194 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -5.716 12.991 5.820 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -6.123 11.259 5.838 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -7.384 12.465 5.490 1.00 0.00 H new ATOM 1845 N ASP A 122 -9.670 12.806 7.149 1.00 0.00 N ATOM 1846 CA ASP A 122 -10.822 13.185 6.341 1.00 0.00 C ATOM 1847 C ASP A 122 -10.352 13.725 4.991 1.00 0.00 C ATOM 1848 O ASP A 122 -9.190 14.097 4.831 1.00 0.00 O ATOM 1849 CB ASP A 122 -11.638 14.247 7.076 1.00 0.00 C ATOM 1850 CG ASP A 122 -12.185 13.710 8.395 1.00 0.00 C ATOM 1851 OD1 ASP A 122 -13.183 12.958 8.341 1.00 0.00 O ATOM 1852 OD2 ASP A 122 -11.603 14.057 9.448 1.00 0.00 O ATOM 0 H ASP A 122 -9.290 13.567 7.712 1.00 0.00 H new ATOM 0 HA ASP A 122 -11.448 12.309 6.172 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.014 15.120 7.267 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -12.463 14.576 6.445 1.00 0.00 H new ATOM 1857 N THR A 123 -11.255 13.776 4.006 1.00 0.00 N ATOM 1858 CA THR A 123 -10.912 14.213 2.657 1.00 0.00 C ATOM 1859 C THR A 123 -10.345 15.632 2.651 1.00 0.00 C ATOM 1860 O THR A 123 -9.407 15.924 1.909 1.00 0.00 O ATOM 1861 CB THR A 123 -12.166 14.153 1.783 1.00 0.00 C ATOM 1862 OG1 THR A 123 -12.734 12.865 1.865 1.00 0.00 O ATOM 1863 CG2 THR A 123 -11.827 14.451 0.324 1.00 0.00 C ATOM 0 H THR A 123 -12.235 13.517 4.124 1.00 0.00 H new ATOM 0 HA THR A 123 -10.142 13.549 2.264 1.00 0.00 H new ATOM 0 HB THR A 123 -12.871 14.902 2.143 1.00 0.00 H new ATOM 0 HG1 THR A 123 -13.617 12.869 1.440 1.00 0.00 H new ATOM 0 HG21 THR A 123 -12.735 14.402 -0.278 1.00 0.00 H new ATOM 0 HG22 THR A 123 -11.394 15.448 0.247 1.00 0.00 H new ATOM 0 HG23 THR A 123 -11.110 13.715 -0.041 1.00 0.00 H new ATOM 1871 N SER A 124 -10.907 16.518 3.479 1.00 0.00 N ATOM 1872 CA SER A 124 -10.479 17.908 3.535 1.00 0.00 C ATOM 1873 C SER A 124 -9.106 18.047 4.184 1.00 0.00 C ATOM 1874 O SER A 124 -8.431 19.054 3.979 1.00 0.00 O ATOM 1875 CB SER A 124 -11.510 18.727 4.309 1.00 0.00 C ATOM 1876 OG SER A 124 -11.685 18.186 5.604 1.00 0.00 O ATOM 0 H SER A 124 -11.665 16.289 4.122 1.00 0.00 H new ATOM 0 HA SER A 124 -10.400 18.282 2.514 1.00 0.00 H new ATOM 0 HB2 SER A 124 -11.183 19.764 4.381 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.460 18.728 3.775 1.00 0.00 H new ATOM 0 HG SER A 124 -12.346 18.718 6.094 1.00 0.00 H new ATOM 1882 N GLU A 125 -8.678 17.050 4.964 1.00 0.00 N ATOM 1883 CA GLU A 125 -7.362 17.099 5.574 1.00 0.00 C ATOM 1884 C GLU A 125 -6.298 16.820 4.519 1.00 0.00 C ATOM 1885 O GLU A 125 -5.228 17.421 4.562 1.00 0.00 O ATOM 1886 CB GLU A 125 -7.259 16.070 6.701 1.00 0.00 C ATOM 1887 CG GLU A 125 -8.217 16.397 7.850 1.00 0.00 C ATOM 1888 CD GLU A 125 -7.852 17.719 8.520 1.00 0.00 C ATOM 1889 OE1 GLU A 125 -6.836 17.735 9.250 1.00 0.00 O ATOM 1890 OE2 GLU A 125 -8.590 18.707 8.304 1.00 0.00 O ATOM 0 H GLU A 125 -9.220 16.214 5.181 1.00 0.00 H new ATOM 0 HA GLU A 125 -7.204 18.093 5.994 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -7.483 15.077 6.310 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -6.236 16.041 7.076 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -9.238 16.449 7.471 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -8.191 15.594 8.587 1.00 0.00 H new ATOM 1897 N VAL A 126 -6.575 15.920 3.570 1.00 0.00 N ATOM 1898 CA VAL A 126 -5.616 15.631 2.516 1.00 0.00 C ATOM 1899 C VAL A 126 -5.413 16.877 1.666 1.00 0.00 C ATOM 1900 O VAL A 126 -4.294 17.150 1.242 1.00 0.00 O ATOM 1901 CB VAL A 126 -6.099 14.471 1.643 1.00 0.00 C ATOM 1902 CG1 VAL A 126 -5.082 14.164 0.542 1.00 0.00 C ATOM 1903 CG2 VAL A 126 -6.273 13.214 2.490 1.00 0.00 C ATOM 0 H VAL A 126 -7.444 15.389 3.515 1.00 0.00 H new ATOM 0 HA VAL A 126 -4.669 15.339 2.971 1.00 0.00 H new ATOM 0 HB VAL A 126 -7.050 14.763 1.197 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -5.444 13.336 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -4.948 15.045 -0.085 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.128 13.892 0.994 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -6.617 12.395 1.859 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -5.319 12.946 2.944 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -7.008 13.402 3.273 1.00 0.00 H new ATOM 1913 N GLU A 127 -6.485 17.635 1.418 1.00 0.00 N ATOM 1914 CA GLU A 127 -6.395 18.853 0.626 1.00 0.00 C ATOM 1915 C GLU A 127 -5.473 19.872 1.292 1.00 0.00 C ATOM 1916 O GLU A 127 -4.729 20.574 0.608 1.00 0.00 O ATOM 1917 CB GLU A 127 -7.794 19.440 0.448 1.00 0.00 C ATOM 1918 CG GLU A 127 -8.642 18.540 -0.447 1.00 0.00 C ATOM 1919 CD GLU A 127 -10.000 19.178 -0.730 1.00 0.00 C ATOM 1920 OE1 GLU A 127 -10.082 19.944 -1.717 1.00 0.00 O ATOM 1921 OE2 GLU A 127 -10.946 18.895 0.041 1.00 0.00 O ATOM 0 H GLU A 127 -7.423 17.422 1.757 1.00 0.00 H new ATOM 0 HA GLU A 127 -5.973 18.610 -0.349 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -8.274 19.552 1.420 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -7.724 20.436 0.010 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -8.119 18.357 -1.386 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -8.783 17.572 0.033 1.00 0.00 H new ATOM 1928 N THR A 128 -5.510 19.964 2.622 1.00 0.00 N ATOM 1929 CA THR A 128 -4.643 20.880 3.350 1.00 0.00 C ATOM 1930 C THR A 128 -3.215 20.344 3.406 1.00 0.00 C ATOM 1931 O THR A 128 -2.264 21.116 3.295 1.00 0.00 O ATOM 1932 CB THR A 128 -5.186 21.072 4.765 1.00 0.00 C ATOM 1933 OG1 THR A 128 -6.502 21.584 4.699 1.00 0.00 O ATOM 1934 CG2 THR A 128 -4.329 22.058 5.559 1.00 0.00 C ATOM 0 H THR A 128 -6.133 19.414 3.214 1.00 0.00 H new ATOM 0 HA THR A 128 -4.626 21.838 2.831 1.00 0.00 H new ATOM 0 HB THR A 128 -5.170 20.103 5.264 1.00 0.00 H new ATOM 0 HG1 THR A 128 -7.125 20.859 4.482 1.00 0.00 H new ATOM 0 HG21 THR A 128 -4.741 22.173 6.561 1.00 0.00 H new ATOM 0 HG22 THR A 128 -3.309 21.680 5.627 1.00 0.00 H new ATOM 0 HG23 THR A 128 -4.325 23.025 5.055 1.00 0.00 H new ATOM 1942 N LEU A 129 -3.050 19.029 3.573 1.00 0.00 N ATOM 1943 CA LEU A 129 -1.732 18.424 3.688 1.00 0.00 C ATOM 1944 C LEU A 129 -0.942 18.539 2.387 1.00 0.00 C ATOM 1945 O LEU A 129 0.281 18.652 2.432 1.00 0.00 O ATOM 1946 CB LEU A 129 -1.873 16.957 4.104 1.00 0.00 C ATOM 1947 CG LEU A 129 -1.671 16.759 5.609 1.00 0.00 C ATOM 1948 CD1 LEU A 129 -2.591 17.630 6.465 1.00 0.00 C ATOM 1949 CD2 LEU A 129 -1.935 15.296 5.954 1.00 0.00 C ATOM 0 H LEU A 129 -3.822 18.364 3.631 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.175 18.965 4.453 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.861 16.595 3.821 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.145 16.355 3.559 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.645 17.053 5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.395 17.439 7.520 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -2.405 18.681 6.246 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.631 17.391 6.240 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.794 15.143 7.024 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.958 15.037 5.682 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.241 14.661 5.402 1.00 0.00 H new ATOM 1961 N VAL A 130 -1.609 18.519 1.226 1.00 0.00 N ATOM 1962 CA VAL A 130 -0.901 18.679 -0.039 1.00 0.00 C ATOM 1963 C VAL A 130 -0.649 20.151 -0.333 1.00 0.00 C ATOM 1964 O VAL A 130 0.309 20.479 -1.028 1.00 0.00 O ATOM 1965 CB VAL A 130 -1.668 18.037 -1.198 1.00 0.00 C ATOM 1966 CG1 VAL A 130 -1.820 16.534 -0.956 1.00 0.00 C ATOM 1967 CG2 VAL A 130 -3.044 18.666 -1.412 1.00 0.00 C ATOM 0 H VAL A 130 -2.618 18.396 1.141 1.00 0.00 H new ATOM 0 HA VAL A 130 0.057 18.168 0.058 1.00 0.00 H new ATOM 0 HB VAL A 130 -1.086 18.214 -2.102 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.367 16.085 -1.785 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.834 16.076 -0.882 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.368 16.368 -0.028 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -3.544 18.173 -2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.643 18.548 -0.509 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -2.929 19.727 -1.634 1.00 0.00 H new ATOM 1977 N THR A 131 -1.497 21.041 0.192 1.00 0.00 N ATOM 1978 CA THR A 131 -1.307 22.473 0.010 1.00 0.00 C ATOM 1979 C THR A 131 -0.071 22.931 0.772 1.00 0.00 C ATOM 1980 O THR A 131 0.651 23.814 0.314 1.00 0.00 O ATOM 1981 CB THR A 131 -2.547 23.227 0.499 1.00 0.00 C ATOM 1982 OG1 THR A 131 -3.659 22.870 -0.290 1.00 0.00 O ATOM 1983 CG2 THR A 131 -2.358 24.740 0.380 1.00 0.00 C ATOM 0 H THR A 131 -2.317 20.791 0.744 1.00 0.00 H new ATOM 0 HA THR A 131 -1.163 22.686 -1.049 1.00 0.00 H new ATOM 0 HB THR A 131 -2.705 22.961 1.544 1.00 0.00 H new ATOM 0 HG1 THR A 131 -3.973 21.979 -0.029 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.255 25.248 0.735 1.00 0.00 H new ATOM 0 HG22 THR A 131 -1.504 25.049 0.983 1.00 0.00 H new ATOM 0 HG23 THR A 131 -2.180 25.004 -0.663 1.00 0.00 H new ATOM 1991 N GLU A 132 0.184 22.338 1.941 1.00 0.00 N ATOM 1992 CA GLU A 132 1.370 22.661 2.719 1.00 0.00 C ATOM 1993 C GLU A 132 2.599 21.966 2.136 1.00 0.00 C ATOM 1994 O GLU A 132 3.716 22.458 2.284 1.00 0.00 O ATOM 1995 CB GLU A 132 1.170 22.222 4.171 1.00 0.00 C ATOM 1996 CG GLU A 132 0.084 23.063 4.840 1.00 0.00 C ATOM 1997 CD GLU A 132 -0.070 22.689 6.317 1.00 0.00 C ATOM 1998 OE1 GLU A 132 -0.495 21.541 6.583 1.00 0.00 O ATOM 1999 OE2 GLU A 132 0.236 23.553 7.168 1.00 0.00 O ATOM 0 H GLU A 132 -0.418 21.632 2.365 1.00 0.00 H new ATOM 0 HA GLU A 132 1.528 23.739 2.683 1.00 0.00 H new ATOM 0 HB2 GLU A 132 0.894 21.168 4.204 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.106 22.323 4.720 1.00 0.00 H new ATOM 0 HG2 GLU A 132 0.333 24.121 4.753 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -0.864 22.916 4.323 1.00 0.00 H new ATOM 2006 N ALA A 133 2.405 20.824 1.471 1.00 0.00 N ATOM 2007 CA ALA A 133 3.510 20.088 0.883 1.00 0.00 C ATOM 2008 C ALA A 133 4.071 20.833 -0.326 1.00 0.00 C ATOM 2009 O ALA A 133 5.286 20.919 -0.490 1.00 0.00 O ATOM 2010 CB ALA A 133 3.022 18.696 0.482 1.00 0.00 C ATOM 0 H ALA A 133 1.490 20.395 1.330 1.00 0.00 H new ATOM 0 HA ALA A 133 4.313 19.993 1.614 1.00 0.00 H new ATOM 0 HB1 ALA A 133 3.845 18.135 0.039 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.658 18.170 1.364 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.214 18.789 -0.244 1.00 0.00 H new ATOM 2016 N LEU A 134 3.199 21.381 -1.177 1.00 0.00 N ATOM 2017 CA LEU A 134 3.635 22.150 -2.336 1.00 0.00 C ATOM 2018 C LEU A 134 4.122 23.538 -1.923 1.00 0.00 C ATOM 2019 O LEU A 134 4.889 24.163 -2.653 1.00 0.00 O ATOM 2020 CB LEU A 134 2.525 22.190 -3.392 1.00 0.00 C ATOM 2021 CG LEU A 134 1.233 22.886 -2.940 1.00 0.00 C ATOM 2022 CD1 LEU A 134 1.302 24.405 -3.100 1.00 0.00 C ATOM 2023 CD2 LEU A 134 0.080 22.384 -3.808 1.00 0.00 C ATOM 0 H LEU A 134 2.186 21.304 -1.081 1.00 0.00 H new ATOM 0 HA LEU A 134 4.492 21.655 -2.794 1.00 0.00 H new ATOM 0 HB2 LEU A 134 2.904 22.698 -4.279 1.00 0.00 H new ATOM 0 HB3 LEU A 134 2.287 21.168 -3.688 1.00 0.00 H new ATOM 0 HG LEU A 134 1.089 22.655 -1.885 1.00 0.00 H new ATOM 0 HD11 LEU A 134 0.364 24.849 -2.767 1.00 0.00 H new ATOM 0 HD12 LEU A 134 2.123 24.797 -2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 134 1.468 24.653 -4.148 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -0.846 22.869 -3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.282 22.619 -4.853 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -0.020 21.305 -3.692 1.00 0.00 H new ATOM 2035 N ALA A 135 3.687 24.027 -0.755 1.00 0.00 N ATOM 2036 CA ALA A 135 4.175 25.295 -0.244 1.00 0.00 C ATOM 2037 C ALA A 135 5.618 25.144 0.237 1.00 0.00 C ATOM 2038 O ALA A 135 6.422 26.059 0.072 1.00 0.00 O ATOM 2039 CB ALA A 135 3.275 25.765 0.899 1.00 0.00 C ATOM 0 H ALA A 135 3.004 23.562 -0.157 1.00 0.00 H new ATOM 0 HA ALA A 135 4.154 26.040 -1.040 1.00 0.00 H new ATOM 0 HB1 ALA A 135 3.641 26.717 1.283 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.256 25.890 0.532 1.00 0.00 H new ATOM 0 HB3 ALA A 135 3.285 25.024 1.698 1.00 0.00 H new ATOM 2045 N GLU A 136 5.950 23.993 0.829 1.00 0.00 N ATOM 2046 CA GLU A 136 7.314 23.716 1.256 1.00 0.00 C ATOM 2047 C GLU A 136 8.206 23.420 0.052 1.00 0.00 C ATOM 2048 O GLU A 136 9.422 23.555 0.154 1.00 0.00 O ATOM 2049 CB GLU A 136 7.330 22.529 2.223 1.00 0.00 C ATOM 2050 CG GLU A 136 6.797 22.925 3.601 1.00 0.00 C ATOM 2051 CD GLU A 136 7.685 23.982 4.255 1.00 0.00 C ATOM 2052 OE1 GLU A 136 8.882 23.681 4.468 1.00 0.00 O ATOM 2053 OE2 GLU A 136 7.164 25.083 4.539 1.00 0.00 O ATOM 0 H GLU A 136 5.288 23.241 1.021 1.00 0.00 H new ATOM 0 HA GLU A 136 7.702 24.598 1.766 1.00 0.00 H new ATOM 0 HB2 GLU A 136 6.725 21.718 1.816 1.00 0.00 H new ATOM 0 HB3 GLU A 136 8.347 22.150 2.320 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.781 23.309 3.504 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.745 22.044 4.241 1.00 0.00 H new ATOM 2060 N ILE A 137 7.626 23.024 -1.085 1.00 0.00 N ATOM 2061 CA ILE A 137 8.391 22.840 -2.307 1.00 0.00 C ATOM 2062 C ILE A 137 8.759 24.200 -2.892 1.00 0.00 C ATOM 2063 O ILE A 137 9.931 24.463 -3.150 1.00 0.00 O ATOM 2064 CB ILE A 137 7.560 22.017 -3.305 1.00 0.00 C ATOM 2065 CG1 ILE A 137 7.540 20.544 -2.881 1.00 0.00 C ATOM 2066 CG2 ILE A 137 8.105 22.136 -4.729 1.00 0.00 C ATOM 2067 CD1 ILE A 137 8.884 19.855 -3.111 1.00 0.00 C ATOM 0 H ILE A 137 6.630 22.827 -1.178 1.00 0.00 H new ATOM 0 HA ILE A 137 9.314 22.301 -2.093 1.00 0.00 H new ATOM 0 HB ILE A 137 6.546 22.416 -3.299 1.00 0.00 H new ATOM 0 HG12 ILE A 137 7.275 20.476 -1.826 1.00 0.00 H new ATOM 0 HG13 ILE A 137 6.765 20.018 -3.439 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.491 21.540 -5.405 1.00 0.00 H new ATOM 0 HG22 ILE A 137 8.081 23.180 -5.042 1.00 0.00 H new ATOM 0 HG23 ILE A 137 9.132 21.773 -4.757 1.00 0.00 H new ATOM 0 HD11 ILE A 137 8.818 18.814 -2.795 1.00 0.00 H new ATOM 0 HD12 ILE A 137 9.138 19.897 -4.170 1.00 0.00 H new ATOM 0 HD13 ILE A 137 9.656 20.362 -2.532 1.00 0.00 H new ATOM 2079 N GLU A 138 7.768 25.071 -3.103 1.00 0.00 N ATOM 2080 CA GLU A 138 7.988 26.366 -3.734 1.00 0.00 C ATOM 2081 C GLU A 138 8.896 27.259 -2.887 1.00 0.00 C ATOM 2082 O GLU A 138 9.513 28.186 -3.411 1.00 0.00 O ATOM 2083 CB GLU A 138 6.627 27.025 -3.961 1.00 0.00 C ATOM 2084 CG GLU A 138 6.756 28.313 -4.778 1.00 0.00 C ATOM 2085 CD GLU A 138 5.381 28.891 -5.097 1.00 0.00 C ATOM 2086 OE1 GLU A 138 4.864 29.663 -4.257 1.00 0.00 O ATOM 2087 OE2 GLU A 138 4.852 28.559 -6.182 1.00 0.00 O ATOM 0 H GLU A 138 6.798 24.896 -2.841 1.00 0.00 H new ATOM 0 HA GLU A 138 8.497 26.223 -4.687 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.967 26.329 -4.479 1.00 0.00 H new ATOM 0 HB3 GLU A 138 6.165 27.248 -2.999 1.00 0.00 H new ATOM 0 HG2 GLU A 138 7.343 29.044 -4.222 1.00 0.00 H new ATOM 0 HG3 GLU A 138 7.294 28.110 -5.704 1.00 0.00 H new ATOM 2094 N LYS A 139 8.984 26.984 -1.581 1.00 0.00 N ATOM 2095 CA LYS A 139 9.760 27.798 -0.659 1.00 0.00 C ATOM 2096 C LYS A 139 11.268 27.605 -0.810 1.00 0.00 C ATOM 2097 O LYS A 139 12.024 28.510 -0.459 1.00 0.00 O ATOM 2098 CB LYS A 139 9.343 27.428 0.768 1.00 0.00 C ATOM 2099 CG LYS A 139 9.936 28.388 1.800 1.00 0.00 C ATOM 2100 CD LYS A 139 9.511 27.973 3.210 1.00 0.00 C ATOM 2101 CE LYS A 139 10.221 26.691 3.648 1.00 0.00 C ATOM 2102 NZ LYS A 139 11.657 26.929 3.896 1.00 0.00 N ATOM 0 H LYS A 139 8.518 26.191 -1.141 1.00 0.00 H new ATOM 0 HA LYS A 139 9.555 28.845 -0.883 1.00 0.00 H new ATOM 0 HB2 LYS A 139 8.256 27.440 0.843 1.00 0.00 H new ATOM 0 HB3 LYS A 139 9.667 26.411 0.989 1.00 0.00 H new ATOM 0 HG2 LYS A 139 11.023 28.388 1.725 1.00 0.00 H new ATOM 0 HG3 LYS A 139 9.602 29.405 1.596 1.00 0.00 H new ATOM 0 HD2 LYS A 139 9.738 28.775 3.912 1.00 0.00 H new ATOM 0 HD3 LYS A 139 8.432 27.822 3.237 1.00 0.00 H new ATOM 0 HE2 LYS A 139 9.753 26.305 4.553 1.00 0.00 H new ATOM 0 HE3 LYS A 139 10.105 25.928 2.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 12.059 26.120 4.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 12.152 27.042 2.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 11.773 27.793 4.464 1.00 0.00 H new ATOM 2116 N GLN A 140 11.727 26.456 -1.319 1.00 0.00 N ATOM 2117 CA GLN A 140 13.149 26.151 -1.244 1.00 0.00 C ATOM 2118 C GLN A 140 13.644 25.138 -2.276 1.00 0.00 C ATOM 2119 O GLN A 140 14.763 25.289 -2.757 1.00 0.00 O ATOM 2120 CB GLN A 140 13.416 25.611 0.166 1.00 0.00 C ATOM 2121 CG GLN A 140 12.604 24.338 0.439 1.00 0.00 C ATOM 2122 CD GLN A 140 12.433 24.076 1.926 1.00 0.00 C ATOM 2123 OE1 GLN A 140 13.333 24.321 2.723 1.00 0.00 O ATOM 2124 NE2 GLN A 140 11.264 23.572 2.310 1.00 0.00 N ATOM 0 H GLN A 140 11.151 25.746 -1.772 1.00 0.00 H new ATOM 0 HA GLN A 140 13.694 27.069 -1.464 1.00 0.00 H new ATOM 0 HB2 GLN A 140 14.479 25.398 0.281 1.00 0.00 H new ATOM 0 HB3 GLN A 140 13.162 26.372 0.903 1.00 0.00 H new ATOM 0 HG2 GLN A 140 11.623 24.427 -0.028 1.00 0.00 H new ATOM 0 HG3 GLN A 140 13.101 23.485 -0.024 1.00 0.00 H new ATOM 0 HE21 GLN A 140 10.539 23.381 1.618 1.00 0.00 H new ATOM 0 HE22 GLN A 140 11.092 23.376 3.296 1.00 0.00 H new ATOM 2133 N THR A 141 12.840 24.122 -2.613 1.00 0.00 N ATOM 2134 CA THR A 141 13.234 22.986 -3.452 1.00 0.00 C ATOM 2135 C THR A 141 14.606 22.399 -3.111 1.00 0.00 C ATOM 2136 O THR A 141 15.184 21.715 -3.952 1.00 0.00 O ATOM 2137 CB THR A 141 13.188 23.339 -4.949 1.00 0.00 C ATOM 2138 OG1 THR A 141 14.235 24.224 -5.285 1.00 0.00 O ATOM 2139 CG2 THR A 141 11.864 23.980 -5.352 1.00 0.00 C ATOM 0 H THR A 141 11.871 24.067 -2.300 1.00 0.00 H new ATOM 0 HA THR A 141 12.494 22.217 -3.232 1.00 0.00 H new ATOM 0 HB THR A 141 13.299 22.399 -5.490 1.00 0.00 H new ATOM 0 HG1 THR A 141 14.572 24.656 -4.472 1.00 0.00 H new ATOM 0 HG21 THR A 141 11.881 24.211 -6.417 1.00 0.00 H new ATOM 0 HG22 THR A 141 11.047 23.289 -5.143 1.00 0.00 H new ATOM 0 HG23 THR A 141 11.717 24.899 -4.784 1.00 0.00 H new ATOM 2824 N ASP B 27 4.463 20.692 -11.342 1.00 0.00 N ATOM 2825 CA ASP B 27 5.369 19.890 -12.156 1.00 0.00 C ATOM 2826 C ASP B 27 6.285 19.045 -11.270 1.00 0.00 C ATOM 2827 O ASP B 27 7.032 18.206 -11.768 1.00 0.00 O ATOM 2828 CB ASP B 27 6.193 20.825 -13.043 1.00 0.00 C ATOM 2829 CG ASP B 27 7.061 20.053 -14.033 1.00 0.00 C ATOM 2830 OD1 ASP B 27 6.474 19.321 -14.862 1.00 0.00 O ATOM 2831 OD2 ASP B 27 8.300 20.200 -13.952 1.00 0.00 O ATOM 0 HA ASP B 27 4.791 19.209 -12.780 1.00 0.00 H new ATOM 0 HB2 ASP B 27 5.524 21.490 -13.589 1.00 0.00 H new ATOM 0 HB3 ASP B 27 6.827 21.453 -12.418 1.00 0.00 H new ATOM 2836 N MET B 28 6.230 19.254 -9.950 1.00 0.00 N ATOM 2837 CA MET B 28 7.039 18.501 -9.004 1.00 0.00 C ATOM 2838 C MET B 28 6.662 17.019 -9.027 1.00 0.00 C ATOM 2839 O MET B 28 7.473 16.166 -8.671 1.00 0.00 O ATOM 2840 CB MET B 28 6.836 19.101 -7.612 1.00 0.00 C ATOM 2841 CG MET B 28 7.700 18.389 -6.574 1.00 0.00 C ATOM 2842 SD MET B 28 9.479 18.481 -6.897 1.00 0.00 S ATOM 2843 CE MET B 28 10.041 17.289 -5.660 1.00 0.00 C ATOM 0 H MET B 28 5.623 19.949 -9.515 1.00 0.00 H new ATOM 0 HA MET B 28 8.091 18.567 -9.280 1.00 0.00 H new ATOM 0 HB2 MET B 28 7.085 20.162 -7.630 1.00 0.00 H new ATOM 0 HB3 MET B 28 5.786 19.025 -7.330 1.00 0.00 H new ATOM 0 HG2 MET B 28 7.498 18.819 -5.593 1.00 0.00 H new ATOM 0 HG3 MET B 28 7.404 17.341 -6.529 1.00 0.00 H new ATOM 0 HE1 MET B 28 10.935 17.671 -5.166 1.00 0.00 H new ATOM 0 HE2 MET B 28 9.256 17.135 -4.920 1.00 0.00 H new ATOM 0 HE3 MET B 28 10.272 16.341 -6.147 1.00 0.00 H new ATOM 2853 N GLY B 29 5.434 16.699 -9.448 1.00 0.00 N ATOM 2854 CA GLY B 29 4.982 15.319 -9.504 1.00 0.00 C ATOM 2855 C GLY B 29 5.626 14.577 -10.667 1.00 0.00 C ATOM 2856 O GLY B 29 5.904 13.386 -10.562 1.00 0.00 O ATOM 0 H GLY B 29 4.741 17.382 -9.753 1.00 0.00 H new ATOM 0 HA2 GLY B 29 5.225 14.815 -8.568 1.00 0.00 H new ATOM 0 HA3 GLY B 29 3.897 15.292 -9.608 1.00 0.00 H new ATOM 2860 N ALA B 30 5.870 15.276 -11.779 1.00 0.00 N ATOM 2861 CA ALA B 30 6.503 14.679 -12.941 1.00 0.00 C ATOM 2862 C ALA B 30 7.973 14.373 -12.659 1.00 0.00 C ATOM 2863 O ALA B 30 8.569 13.531 -13.333 1.00 0.00 O ATOM 2864 CB ALA B 30 6.376 15.639 -14.125 1.00 0.00 C ATOM 0 H ALA B 30 5.634 16.262 -11.892 1.00 0.00 H new ATOM 0 HA ALA B 30 6.006 13.738 -13.178 1.00 0.00 H new ATOM 0 HB1 ALA B 30 6.849 15.199 -15.003 1.00 0.00 H new ATOM 0 HB2 ALA B 30 5.322 15.822 -14.334 1.00 0.00 H new ATOM 0 HB3 ALA B 30 6.867 16.582 -13.883 1.00 0.00 H new ATOM 2870 N ALA B 31 8.563 15.047 -11.668 1.00 0.00 N ATOM 2871 CA ALA B 31 9.962 14.849 -11.328 1.00 0.00 C ATOM 2872 C ALA B 31 10.111 13.624 -10.427 1.00 0.00 C ATOM 2873 O ALA B 31 11.041 12.835 -10.596 1.00 0.00 O ATOM 2874 CB ALA B 31 10.475 16.097 -10.612 1.00 0.00 C ATOM 0 H ALA B 31 8.085 15.737 -11.088 1.00 0.00 H new ATOM 0 HA ALA B 31 10.544 14.682 -12.234 1.00 0.00 H new ATOM 0 HB1 ALA B 31 11.525 15.961 -10.351 1.00 0.00 H new ATOM 0 HB2 ALA B 31 10.373 16.961 -11.269 1.00 0.00 H new ATOM 0 HB3 ALA B 31 9.894 16.261 -9.704 1.00 0.00 H new ATOM 2880 N LEU B 32 9.190 13.468 -9.470 1.00 0.00 N ATOM 2881 CA LEU B 32 9.209 12.341 -8.557 1.00 0.00 C ATOM 2882 C LEU B 32 8.738 11.073 -9.265 1.00 0.00 C ATOM 2883 O LEU B 32 9.325 10.010 -9.074 1.00 0.00 O ATOM 2884 CB LEU B 32 8.279 12.654 -7.381 1.00 0.00 C ATOM 2885 CG LEU B 32 8.767 13.825 -6.528 1.00 0.00 C ATOM 2886 CD1 LEU B 32 7.657 14.267 -5.575 1.00 0.00 C ATOM 2887 CD2 LEU B 32 9.968 13.410 -5.685 1.00 0.00 C ATOM 0 H LEU B 32 8.420 14.119 -9.314 1.00 0.00 H new ATOM 0 HA LEU B 32 10.226 12.176 -8.201 1.00 0.00 H new ATOM 0 HB2 LEU B 32 7.283 12.880 -7.763 1.00 0.00 H new ATOM 0 HB3 LEU B 32 8.186 11.768 -6.753 1.00 0.00 H new ATOM 0 HG LEU B 32 9.047 14.637 -7.199 1.00 0.00 H new ATOM 0 HD11 LEU B 32 8.009 15.102 -4.969 1.00 0.00 H new ATOM 0 HD12 LEU B 32 6.786 14.579 -6.151 1.00 0.00 H new ATOM 0 HD13 LEU B 32 7.384 13.436 -4.925 1.00 0.00 H new ATOM 0 HD21 LEU B 32 10.301 14.257 -5.085 1.00 0.00 H new ATOM 0 HD22 LEU B 32 9.684 12.588 -5.027 1.00 0.00 H new ATOM 0 HD23 LEU B 32 10.778 13.088 -6.339 1.00 0.00 H new ATOM 2899 N ARG B 33 7.684 11.170 -10.084 1.00 0.00 N ATOM 2900 CA ARG B 33 7.151 10.007 -10.778 1.00 0.00 C ATOM 2901 C ARG B 33 8.154 9.476 -11.796 1.00 0.00 C ATOM 2902 O ARG B 33 8.208 8.271 -12.013 1.00 0.00 O ATOM 2903 CB ARG B 33 5.821 10.365 -11.453 1.00 0.00 C ATOM 2904 CG ARG B 33 5.240 9.190 -12.252 1.00 0.00 C ATOM 2905 CD ARG B 33 4.962 7.957 -11.383 1.00 0.00 C ATOM 2906 NE ARG B 33 4.640 6.795 -12.217 1.00 0.00 N ATOM 2907 CZ ARG B 33 3.545 6.036 -12.114 1.00 0.00 C ATOM 2908 NH1 ARG B 33 2.596 6.287 -11.214 1.00 0.00 N ATOM 2909 NH2 ARG B 33 3.395 5.001 -12.931 1.00 0.00 N ATOM 0 H ARG B 33 7.190 12.041 -10.277 1.00 0.00 H new ATOM 0 HA ARG B 33 6.970 9.217 -10.049 1.00 0.00 H new ATOM 0 HB2 ARG B 33 5.103 10.676 -10.694 1.00 0.00 H new ATOM 0 HB3 ARG B 33 5.971 11.215 -12.118 1.00 0.00 H new ATOM 0 HG2 ARG B 33 4.314 9.506 -12.732 1.00 0.00 H new ATOM 0 HG3 ARG B 33 5.935 8.919 -13.047 1.00 0.00 H new ATOM 0 HD2 ARG B 33 5.833 7.737 -10.766 1.00 0.00 H new ATOM 0 HD3 ARG B 33 4.135 8.164 -10.704 1.00 0.00 H new ATOM 0 HE ARG B 33 5.313 6.543 -12.941 1.00 0.00 H new ATOM 0 HH11 ARG B 33 2.693 7.078 -10.578 1.00 0.00 H new ATOM 0 HH12 ARG B 33 1.772 5.688 -11.161 1.00 0.00 H new ATOM 0 HH21 ARG B 33 4.111 4.793 -13.627 1.00 0.00 H new ATOM 0 HH22 ARG B 33 2.564 4.414 -12.863 1.00 0.00 H new ATOM 2923 N SER B 34 8.949 10.348 -12.421 1.00 0.00 N ATOM 2924 CA SER B 34 9.954 9.891 -13.371 1.00 0.00 C ATOM 2925 C SER B 34 11.023 9.075 -12.643 1.00 0.00 C ATOM 2926 O SER B 34 11.453 8.032 -13.137 1.00 0.00 O ATOM 2927 CB SER B 34 10.584 11.100 -14.063 1.00 0.00 C ATOM 2928 OG SER B 34 11.543 10.664 -15.003 1.00 0.00 O ATOM 0 H SER B 34 8.915 11.359 -12.286 1.00 0.00 H new ATOM 0 HA SER B 34 9.486 9.256 -14.123 1.00 0.00 H new ATOM 0 HB2 SER B 34 9.813 11.688 -14.561 1.00 0.00 H new ATOM 0 HB3 SER B 34 11.054 11.750 -13.325 1.00 0.00 H new ATOM 0 HG SER B 34 11.944 11.441 -15.446 1.00 0.00 H new ATOM 2934 N ALA B 35 11.449 9.552 -11.469 1.00 0.00 N ATOM 2935 CA ALA B 35 12.456 8.869 -10.673 1.00 0.00 C ATOM 2936 C ALA B 35 11.942 7.539 -10.126 1.00 0.00 C ATOM 2937 O ALA B 35 12.738 6.683 -9.744 1.00 0.00 O ATOM 2938 CB ALA B 35 12.887 9.790 -9.537 1.00 0.00 C ATOM 0 H ALA B 35 11.104 10.417 -11.052 1.00 0.00 H new ATOM 0 HA ALA B 35 13.310 8.637 -11.309 1.00 0.00 H new ATOM 0 HB1 ALA B 35 13.643 9.291 -8.931 1.00 0.00 H new ATOM 0 HB2 ALA B 35 13.303 10.709 -9.951 1.00 0.00 H new ATOM 0 HB3 ALA B 35 12.024 10.030 -8.916 1.00 0.00 H new ATOM 2944 N TYR B 36 10.620 7.346 -10.089 1.00 0.00 N ATOM 2945 CA TYR B 36 10.046 6.116 -9.565 1.00 0.00 C ATOM 2946 C TYR B 36 9.469 5.245 -10.681 1.00 0.00 C ATOM 2947 O TYR B 36 9.156 4.079 -10.452 1.00 0.00 O ATOM 2948 CB TYR B 36 8.979 6.448 -8.523 1.00 0.00 C ATOM 2949 CG TYR B 36 9.454 7.296 -7.358 1.00 0.00 C ATOM 2950 CD1 TYR B 36 10.770 7.185 -6.879 1.00 0.00 C ATOM 2951 CD2 TYR B 36 8.564 8.197 -6.755 1.00 0.00 C ATOM 2952 CE1 TYR B 36 11.200 7.984 -5.808 1.00 0.00 C ATOM 2953 CE2 TYR B 36 8.985 8.995 -5.683 1.00 0.00 C ATOM 2954 CZ TYR B 36 10.306 8.890 -5.204 1.00 0.00 C ATOM 2955 OH TYR B 36 10.715 9.664 -4.157 1.00 0.00 O ATOM 0 H TYR B 36 9.934 8.027 -10.416 1.00 0.00 H new ATOM 0 HA TYR B 36 10.840 5.541 -9.089 1.00 0.00 H new ATOM 0 HB2 TYR B 36 8.159 6.968 -9.019 1.00 0.00 H new ATOM 0 HB3 TYR B 36 8.574 5.515 -8.131 1.00 0.00 H new ATOM 0 HD1 TYR B 36 11.452 6.483 -7.336 1.00 0.00 H new ATOM 0 HD2 TYR B 36 7.550 8.276 -7.118 1.00 0.00 H new ATOM 0 HE1 TYR B 36 12.215 7.904 -5.447 1.00 0.00 H new ATOM 0 HE2 TYR B 36 8.297 9.690 -5.224 1.00 0.00 H new ATOM 0 HH TYR B 36 9.974 10.233 -3.861 1.00 0.00 H new ATOM 2965 N GLN B 37 9.323 5.791 -11.894 1.00 0.00 N ATOM 2966 CA GLN B 37 8.892 5.002 -13.034 1.00 0.00 C ATOM 2967 C GLN B 37 9.999 4.025 -13.414 1.00 0.00 C ATOM 2968 O GLN B 37 9.719 2.899 -13.820 1.00 0.00 O ATOM 2969 CB GLN B 37 8.551 5.935 -14.200 1.00 0.00 C ATOM 2970 CG GLN B 37 8.009 5.154 -15.399 1.00 0.00 C ATOM 2971 CD GLN B 37 6.722 4.412 -15.064 1.00 0.00 C ATOM 2972 OE1 GLN B 37 5.873 4.914 -14.328 1.00 0.00 O ATOM 2973 NE2 GLN B 37 6.557 3.206 -15.595 1.00 0.00 N ATOM 0 H GLN B 37 9.499 6.774 -12.102 1.00 0.00 H new ATOM 0 HA GLN B 37 7.998 4.431 -12.783 1.00 0.00 H new ATOM 0 HB2 GLN B 37 7.812 6.668 -13.877 1.00 0.00 H new ATOM 0 HB3 GLN B 37 9.441 6.489 -14.497 1.00 0.00 H new ATOM 0 HG2 GLN B 37 7.827 5.840 -16.226 1.00 0.00 H new ATOM 0 HG3 GLN B 37 8.761 4.441 -15.737 1.00 0.00 H new ATOM 0 HE21 GLN B 37 7.277 2.813 -16.202 1.00 0.00 H new ATOM 0 HE22 GLN B 37 5.711 2.673 -15.396 1.00 0.00 H new ATOM 2982 N LYS B 38 11.261 4.454 -13.278 1.00 0.00 N ATOM 2983 CA LYS B 38 12.403 3.580 -13.530 1.00 0.00 C ATOM 2984 C LYS B 38 12.538 2.508 -12.447 1.00 0.00 C ATOM 2985 O LYS B 38 13.130 1.460 -12.690 1.00 0.00 O ATOM 2986 CB LYS B 38 13.684 4.412 -13.649 1.00 0.00 C ATOM 2987 CG LYS B 38 13.976 5.208 -12.374 1.00 0.00 C ATOM 2988 CD LYS B 38 15.207 6.096 -12.549 1.00 0.00 C ATOM 2989 CE LYS B 38 16.458 5.257 -12.808 1.00 0.00 C ATOM 2990 NZ LYS B 38 17.649 6.110 -12.961 1.00 0.00 N ATOM 0 H LYS B 38 11.512 5.401 -12.995 1.00 0.00 H new ATOM 0 HA LYS B 38 12.236 3.061 -14.474 1.00 0.00 H new ATOM 0 HB2 LYS B 38 14.525 3.753 -13.865 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.593 5.098 -14.491 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.113 5.824 -12.120 1.00 0.00 H new ATOM 0 HG3 LYS B 38 14.134 4.522 -11.542 1.00 0.00 H new ATOM 0 HD2 LYS B 38 15.048 6.784 -13.380 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.351 6.703 -11.655 1.00 0.00 H new ATOM 0 HE2 LYS B 38 16.610 4.561 -11.983 1.00 0.00 H new ATOM 0 HE3 LYS B 38 16.318 4.659 -13.708 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 18.483 5.514 -13.136 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 17.512 6.757 -13.764 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.794 6.662 -12.092 1.00 0.00 H new ATOM 3004 N THR B 39 11.987 2.760 -11.256 1.00 0.00 N ATOM 3005 CA THR B 39 11.969 1.787 -10.167 1.00 0.00 C ATOM 3006 C THR B 39 11.009 0.633 -10.464 1.00 0.00 C ATOM 3007 O THR B 39 11.036 -0.380 -9.764 1.00 0.00 O ATOM 3008 CB THR B 39 11.592 2.490 -8.856 1.00 0.00 C ATOM 3009 OG1 THR B 39 12.492 3.554 -8.636 1.00 0.00 O ATOM 3010 CG2 THR B 39 11.664 1.553 -7.652 1.00 0.00 C ATOM 0 H THR B 39 11.541 3.647 -11.022 1.00 0.00 H new ATOM 0 HA THR B 39 12.966 1.358 -10.068 1.00 0.00 H new ATOM 0 HB THR B 39 10.565 2.840 -8.955 1.00 0.00 H new ATOM 0 HG1 THR B 39 12.260 4.012 -7.801 1.00 0.00 H new ATOM 0 HG21 THR B 39 11.388 2.098 -6.749 1.00 0.00 H new ATOM 0 HG22 THR B 39 10.976 0.720 -7.797 1.00 0.00 H new ATOM 0 HG23 THR B 39 12.679 1.171 -7.549 1.00 0.00 H new ATOM 3018 N ILE B 40 10.160 0.767 -11.487 1.00 0.00 N ATOM 3019 CA ILE B 40 9.166 -0.248 -11.829 1.00 0.00 C ATOM 3020 C ILE B 40 9.186 -0.577 -13.326 1.00 0.00 C ATOM 3021 O ILE B 40 8.287 -1.246 -13.827 1.00 0.00 O ATOM 3022 CB ILE B 40 7.767 0.200 -11.382 1.00 0.00 C ATOM 3023 CG1 ILE B 40 7.343 1.461 -12.145 1.00 0.00 C ATOM 3024 CG2 ILE B 40 7.754 0.451 -9.873 1.00 0.00 C ATOM 3025 CD1 ILE B 40 5.913 1.881 -11.794 1.00 0.00 C ATOM 0 H ILE B 40 10.144 1.582 -12.099 1.00 0.00 H new ATOM 0 HA ILE B 40 9.424 -1.162 -11.294 1.00 0.00 H new ATOM 0 HB ILE B 40 7.053 -0.592 -11.608 1.00 0.00 H new ATOM 0 HG12 ILE B 40 8.029 2.275 -11.912 1.00 0.00 H new ATOM 0 HG13 ILE B 40 7.416 1.279 -13.217 1.00 0.00 H new ATOM 0 HG21 ILE B 40 6.758 0.768 -9.566 1.00 0.00 H new ATOM 0 HG22 ILE B 40 8.020 -0.467 -9.349 1.00 0.00 H new ATOM 0 HG23 ILE B 40 8.475 1.231 -9.628 1.00 0.00 H new ATOM 0 HD11 ILE B 40 5.649 2.778 -12.354 1.00 0.00 H new ATOM 0 HD12 ILE B 40 5.224 1.077 -12.051 1.00 0.00 H new ATOM 0 HD13 ILE B 40 5.846 2.088 -10.726 1.00 0.00 H new ATOM 3037 N GLU B 41 10.215 -0.109 -14.041 1.00 0.00 N ATOM 3038 CA GLU B 41 10.375 -0.358 -15.469 1.00 0.00 C ATOM 3039 C GLU B 41 10.960 -1.757 -15.710 1.00 0.00 C ATOM 3040 O GLU B 41 11.537 -2.022 -16.761 1.00 0.00 O ATOM 3041 CB GLU B 41 11.277 0.737 -16.051 1.00 0.00 C ATOM 3042 CG GLU B 41 11.111 0.871 -17.566 1.00 0.00 C ATOM 3043 CD GLU B 41 11.966 2.013 -18.101 1.00 0.00 C ATOM 3044 OE1 GLU B 41 13.148 1.749 -18.423 1.00 0.00 O ATOM 3045 OE2 GLU B 41 11.439 3.143 -18.188 1.00 0.00 O ATOM 0 H GLU B 41 10.962 0.456 -13.638 1.00 0.00 H new ATOM 0 HA GLU B 41 9.406 -0.328 -15.968 1.00 0.00 H new ATOM 0 HB2 GLU B 41 11.044 1.690 -15.575 1.00 0.00 H new ATOM 0 HB3 GLU B 41 12.318 0.511 -15.819 1.00 0.00 H new ATOM 0 HG2 GLU B 41 11.396 -0.062 -18.052 1.00 0.00 H new ATOM 0 HG3 GLU B 41 10.063 1.050 -17.808 1.00 0.00 H new ATOM 3052 N GLU B 42 10.812 -2.660 -14.738 1.00 0.00 N ATOM 3053 CA GLU B 42 11.422 -3.982 -14.779 1.00 0.00 C ATOM 3054 C GLU B 42 10.445 -5.054 -14.298 1.00 0.00 C ATOM 3055 O GLU B 42 9.298 -4.758 -13.957 1.00 0.00 O ATOM 3056 CB GLU B 42 12.676 -3.996 -13.897 1.00 0.00 C ATOM 3057 CG GLU B 42 13.681 -2.927 -14.328 1.00 0.00 C ATOM 3058 CD GLU B 42 14.974 -3.036 -13.522 1.00 0.00 C ATOM 3059 OE1 GLU B 42 14.957 -2.599 -12.349 1.00 0.00 O ATOM 3060 OE2 GLU B 42 15.966 -3.552 -14.084 1.00 0.00 O ATOM 0 H GLU B 42 10.261 -2.489 -13.897 1.00 0.00 H new ATOM 0 HA GLU B 42 11.692 -4.204 -15.811 1.00 0.00 H new ATOM 0 HB2 GLU B 42 12.392 -3.831 -12.858 1.00 0.00 H new ATOM 0 HB3 GLU B 42 13.145 -4.978 -13.947 1.00 0.00 H new ATOM 0 HG2 GLU B 42 13.900 -3.036 -15.390 1.00 0.00 H new ATOM 0 HG3 GLU B 42 13.246 -1.937 -14.192 1.00 0.00 H new ATOM 3067 N GLN B 43 10.908 -6.308 -14.275 1.00 0.00 N ATOM 3068 CA GLN B 43 10.139 -7.452 -13.811 1.00 0.00 C ATOM 3069 C GLN B 43 9.742 -7.320 -12.337 1.00 0.00 C ATOM 3070 O GLN B 43 10.074 -6.333 -11.676 1.00 0.00 O ATOM 3071 CB GLN B 43 10.946 -8.725 -14.055 1.00 0.00 C ATOM 3072 CG GLN B 43 12.228 -8.745 -13.212 1.00 0.00 C ATOM 3073 CD GLN B 43 13.016 -10.029 -13.434 1.00 0.00 C ATOM 3074 OE1 GLN B 43 13.170 -10.496 -14.561 1.00 0.00 O ATOM 3075 NE2 GLN B 43 13.517 -10.617 -12.353 1.00 0.00 N ATOM 0 H GLN B 43 11.848 -6.554 -14.586 1.00 0.00 H new ATOM 0 HA GLN B 43 9.207 -7.497 -14.375 1.00 0.00 H new ATOM 0 HB2 GLN B 43 10.336 -9.596 -13.814 1.00 0.00 H new ATOM 0 HB3 GLN B 43 11.202 -8.798 -15.112 1.00 0.00 H new ATOM 0 HG2 GLN B 43 12.848 -7.886 -13.469 1.00 0.00 H new ATOM 0 HG3 GLN B 43 11.973 -8.650 -12.156 1.00 0.00 H new ATOM 0 HE21 GLN B 43 13.370 -10.202 -11.433 1.00 0.00 H new ATOM 0 HE22 GLN B 43 14.048 -11.483 -12.443 1.00 0.00 H new ATOM 3084 N VAL B 44 9.033 -8.326 -11.818 1.00 0.00 N ATOM 3085 CA VAL B 44 8.531 -8.317 -10.450 1.00 0.00 C ATOM 3086 C VAL B 44 8.864 -9.640 -9.762 1.00 0.00 C ATOM 3087 O VAL B 44 9.038 -10.659 -10.429 1.00 0.00 O ATOM 3088 CB VAL B 44 7.016 -8.082 -10.454 1.00 0.00 C ATOM 3089 CG1 VAL B 44 6.691 -6.748 -11.118 1.00 0.00 C ATOM 3090 CG2 VAL B 44 6.267 -9.194 -11.197 1.00 0.00 C ATOM 0 H VAL B 44 8.793 -9.169 -12.339 1.00 0.00 H new ATOM 0 HA VAL B 44 9.010 -7.509 -9.898 1.00 0.00 H new ATOM 0 HB VAL B 44 6.691 -8.077 -9.414 1.00 0.00 H new ATOM 0 HG11 VAL B 44 5.612 -6.593 -11.114 1.00 0.00 H new ATOM 0 HG12 VAL B 44 7.175 -5.941 -10.569 1.00 0.00 H new ATOM 0 HG13 VAL B 44 7.053 -6.756 -12.146 1.00 0.00 H new ATOM 0 HG21 VAL B 44 5.197 -8.989 -11.176 1.00 0.00 H new ATOM 0 HG22 VAL B 44 6.609 -9.235 -12.231 1.00 0.00 H new ATOM 0 HG23 VAL B 44 6.462 -10.151 -10.713 1.00 0.00 H new ATOM 3100 N PRO B 45 8.955 -9.642 -8.423 1.00 0.00 N ATOM 3101 CA PRO B 45 9.237 -10.838 -7.649 1.00 0.00 C ATOM 3102 C PRO B 45 8.009 -11.745 -7.586 1.00 0.00 C ATOM 3103 O PRO B 45 6.939 -11.401 -8.084 1.00 0.00 O ATOM 3104 CB PRO B 45 9.638 -10.325 -6.267 1.00 0.00 C ATOM 3105 CG PRO B 45 8.847 -9.027 -6.132 1.00 0.00 C ATOM 3106 CD PRO B 45 8.804 -8.488 -7.558 1.00 0.00 C ATOM 0 HA PRO B 45 10.026 -11.445 -8.092 1.00 0.00 H new ATOM 0 HB2 PRO B 45 9.380 -11.037 -5.483 1.00 0.00 H new ATOM 0 HB3 PRO B 45 10.712 -10.151 -6.198 1.00 0.00 H new ATOM 0 HG2 PRO B 45 7.846 -9.206 -5.740 1.00 0.00 H new ATOM 0 HG3 PRO B 45 9.335 -8.328 -5.453 1.00 0.00 H new ATOM 0 HD2 PRO B 45 7.863 -7.974 -7.753 1.00 0.00 H new ATOM 0 HD3 PRO B 45 9.603 -7.766 -7.727 1.00 0.00 H new ATOM 3114 N ASP B 46 8.170 -12.912 -6.965 1.00 0.00 N ATOM 3115 CA ASP B 46 7.077 -13.850 -6.759 1.00 0.00 C ATOM 3116 C ASP B 46 7.234 -14.612 -5.442 1.00 0.00 C ATOM 3117 O ASP B 46 6.385 -15.436 -5.103 1.00 0.00 O ATOM 3118 CB ASP B 46 7.005 -14.826 -7.939 1.00 0.00 C ATOM 3119 CG ASP B 46 8.267 -15.679 -8.048 1.00 0.00 C ATOM 3120 OD1 ASP B 46 9.235 -15.202 -8.680 1.00 0.00 O ATOM 3121 OD2 ASP B 46 8.260 -16.805 -7.501 1.00 0.00 O ATOM 0 H ASP B 46 9.064 -13.231 -6.592 1.00 0.00 H new ATOM 0 HA ASP B 46 6.147 -13.285 -6.701 1.00 0.00 H new ATOM 0 HB2 ASP B 46 6.137 -15.475 -7.822 1.00 0.00 H new ATOM 0 HB3 ASP B 46 6.863 -14.268 -8.864 1.00 0.00 H new ATOM 3126 N GLU B 47 8.310 -14.345 -4.693 1.00 0.00 N ATOM 3127 CA GLU B 47 8.582 -15.014 -3.428 1.00 0.00 C ATOM 3128 C GLU B 47 7.490 -14.734 -2.399 1.00 0.00 C ATOM 3129 O GLU B 47 7.288 -15.519 -1.474 1.00 0.00 O ATOM 3130 CB GLU B 47 9.947 -14.549 -2.904 1.00 0.00 C ATOM 3131 CG GLU B 47 9.952 -13.050 -2.571 1.00 0.00 C ATOM 3132 CD GLU B 47 11.369 -12.583 -2.245 1.00 0.00 C ATOM 3133 OE1 GLU B 47 11.882 -12.975 -1.176 1.00 0.00 O ATOM 3134 OE2 GLU B 47 11.932 -11.830 -3.075 1.00 0.00 O ATOM 0 H GLU B 47 9.015 -13.656 -4.953 1.00 0.00 H new ATOM 0 HA GLU B 47 8.596 -16.091 -3.596 1.00 0.00 H new ATOM 0 HB2 GLU B 47 10.207 -15.120 -2.013 1.00 0.00 H new ATOM 0 HB3 GLU B 47 10.713 -14.758 -3.651 1.00 0.00 H new ATOM 0 HG2 GLU B 47 9.560 -12.482 -3.415 1.00 0.00 H new ATOM 0 HG3 GLU B 47 9.294 -12.857 -1.723 1.00 0.00 H new ATOM 3141 N MET B 48 6.778 -13.613 -2.557 1.00 0.00 N ATOM 3142 CA MET B 48 5.723 -13.222 -1.641 1.00 0.00 C ATOM 3143 C MET B 48 4.443 -14.002 -1.926 1.00 0.00 C ATOM 3144 O MET B 48 3.717 -14.368 -1.004 1.00 0.00 O ATOM 3145 CB MET B 48 5.488 -11.726 -1.804 1.00 0.00 C ATOM 3146 CG MET B 48 6.655 -10.963 -1.184 1.00 0.00 C ATOM 3147 SD MET B 48 6.634 -9.194 -1.529 1.00 0.00 S ATOM 3148 CE MET B 48 7.347 -9.265 -3.190 1.00 0.00 C ATOM 0 H MET B 48 6.923 -12.958 -3.325 1.00 0.00 H new ATOM 0 HA MET B 48 6.018 -13.445 -0.616 1.00 0.00 H new ATOM 0 HB2 MET B 48 5.393 -11.474 -2.860 1.00 0.00 H new ATOM 0 HB3 MET B 48 4.553 -11.438 -1.323 1.00 0.00 H new ATOM 0 HG2 MET B 48 6.642 -11.113 -0.104 1.00 0.00 H new ATOM 0 HG3 MET B 48 7.590 -11.385 -1.554 1.00 0.00 H new ATOM 0 HE1 MET B 48 7.310 -8.275 -3.645 1.00 0.00 H new ATOM 0 HE2 MET B 48 8.383 -9.597 -3.127 1.00 0.00 H new ATOM 0 HE3 MET B 48 6.778 -9.966 -3.801 1.00 0.00 H new ATOM 3158 N LEU B 49 4.153 -14.263 -3.200 1.00 0.00 N ATOM 3159 CA LEU B 49 3.001 -15.068 -3.561 1.00 0.00 C ATOM 3160 C LEU B 49 3.347 -16.543 -3.396 1.00 0.00 C ATOM 3161 O LEU B 49 2.457 -17.389 -3.338 1.00 0.00 O ATOM 3162 CB LEU B 49 2.575 -14.756 -4.994 1.00 0.00 C ATOM 3163 CG LEU B 49 1.811 -13.431 -5.116 1.00 0.00 C ATOM 3164 CD1 LEU B 49 0.484 -13.477 -4.356 1.00 0.00 C ATOM 3165 CD2 LEU B 49 2.603 -12.219 -4.627 1.00 0.00 C ATOM 0 H LEU B 49 4.701 -13.927 -3.992 1.00 0.00 H new ATOM 0 HA LEU B 49 2.163 -14.832 -2.905 1.00 0.00 H new ATOM 0 HB2 LEU B 49 3.459 -14.719 -5.630 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.948 -15.566 -5.366 1.00 0.00 H new ATOM 0 HG LEU B 49 1.634 -13.311 -6.185 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -0.030 -12.522 -4.464 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -0.140 -14.273 -4.761 1.00 0.00 H new ATOM 0 HD13 LEU B 49 0.676 -13.668 -3.300 1.00 0.00 H new ATOM 0 HD21 LEU B 49 2.000 -11.319 -4.744 1.00 0.00 H new ATOM 0 HD22 LEU B 49 2.858 -12.351 -3.575 1.00 0.00 H new ATOM 0 HD23 LEU B 49 3.517 -12.121 -5.212 1.00 0.00 H new ATOM 3177 N ASP B 50 4.637 -16.863 -3.317 1.00 0.00 N ATOM 3178 CA ASP B 50 5.068 -18.209 -2.980 1.00 0.00 C ATOM 3179 C ASP B 50 4.736 -18.520 -1.523 1.00 0.00 C ATOM 3180 O ASP B 50 4.652 -19.681 -1.133 1.00 0.00 O ATOM 3181 CB ASP B 50 6.562 -18.366 -3.252 1.00 0.00 C ATOM 3182 CG ASP B 50 6.984 -19.833 -3.170 1.00 0.00 C ATOM 3183 OD1 ASP B 50 6.369 -20.644 -3.900 1.00 0.00 O ATOM 3184 OD2 ASP B 50 7.911 -20.129 -2.383 1.00 0.00 O ATOM 0 H ASP B 50 5.399 -16.205 -3.483 1.00 0.00 H new ATOM 0 HA ASP B 50 4.533 -18.923 -3.607 1.00 0.00 H new ATOM 0 HB2 ASP B 50 6.799 -17.971 -4.240 1.00 0.00 H new ATOM 0 HB3 ASP B 50 7.130 -17.780 -2.530 1.00 0.00 H new ATOM 3189 N LEU B 51 4.545 -17.482 -0.704 1.00 0.00 N ATOM 3190 CA LEU B 51 4.046 -17.662 0.655 1.00 0.00 C ATOM 3191 C LEU B 51 2.593 -18.125 0.621 1.00 0.00 C ATOM 3192 O LEU B 51 2.109 -18.690 1.598 1.00 0.00 O ATOM 3193 CB LEU B 51 4.131 -16.356 1.444 1.00 0.00 C ATOM 3194 CG LEU B 51 5.518 -15.719 1.385 1.00 0.00 C ATOM 3195 CD1 LEU B 51 5.502 -14.401 2.149 1.00 0.00 C ATOM 3196 CD2 LEU B 51 6.575 -16.645 1.983 1.00 0.00 C ATOM 0 H LEU B 51 4.729 -16.512 -0.961 1.00 0.00 H new ATOM 0 HA LEU B 51 4.665 -18.415 1.143 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.396 -15.652 1.053 1.00 0.00 H new ATOM 0 HB3 LEU B 51 3.868 -16.547 2.484 1.00 0.00 H new ATOM 0 HG LEU B 51 5.772 -15.541 0.340 1.00 0.00 H new ATOM 0 HD11 LEU B 51 6.491 -13.945 2.108 1.00 0.00 H new ATOM 0 HD12 LEU B 51 4.773 -13.728 1.698 1.00 0.00 H new ATOM 0 HD13 LEU B 51 5.231 -14.586 3.188 1.00 0.00 H new ATOM 0 HD21 LEU B 51 7.552 -16.165 1.927 1.00 0.00 H new ATOM 0 HD22 LEU B 51 6.331 -16.851 3.025 1.00 0.00 H new ATOM 0 HD23 LEU B 51 6.598 -17.580 1.424 1.00 0.00 H new ATOM 3208 N LEU B 52 1.888 -17.898 -0.491 1.00 0.00 N ATOM 3209 CA LEU B 52 0.551 -18.446 -0.635 1.00 0.00 C ATOM 3210 C LEU B 52 0.624 -19.909 -1.053 1.00 0.00 C ATOM 3211 O LEU B 52 -0.332 -20.654 -0.847 1.00 0.00 O ATOM 3212 CB LEU B 52 -0.271 -17.653 -1.645 1.00 0.00 C ATOM 3213 CG LEU B 52 -0.424 -16.180 -1.265 1.00 0.00 C ATOM 3214 CD1 LEU B 52 -1.521 -15.612 -2.156 1.00 0.00 C ATOM 3215 CD2 LEU B 52 -0.833 -15.990 0.198 1.00 0.00 C ATOM 0 H LEU B 52 2.218 -17.350 -1.285 1.00 0.00 H new ATOM 0 HA LEU B 52 0.055 -18.373 0.333 1.00 0.00 H new ATOM 0 HB2 LEU B 52 0.202 -17.723 -2.625 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -1.259 -18.104 -1.735 1.00 0.00 H new ATOM 0 HG LEU B 52 0.534 -15.677 -1.397 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -1.670 -14.558 -1.923 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.230 -15.715 -3.201 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -2.449 -16.156 -1.982 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -0.927 -14.926 0.414 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -1.789 -16.483 0.375 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -0.074 -16.426 0.848 1.00 0.00 H new ATOM 3227 N ASN B 53 1.749 -20.336 -1.633 1.00 0.00 N ATOM 3228 CA ASN B 53 1.977 -21.744 -1.929 1.00 0.00 C ATOM 3229 C ASN B 53 2.310 -22.490 -0.633 1.00 0.00 C ATOM 3230 O ASN B 53 2.735 -23.646 -0.668 1.00 0.00 O ATOM 3231 CB ASN B 53 3.092 -21.895 -2.968 1.00 0.00 C ATOM 3232 CG ASN B 53 2.722 -21.263 -4.303 1.00 0.00 C ATOM 3233 OD1 ASN B 53 1.555 -21.236 -4.689 1.00 0.00 O ATOM 3234 ND2 ASN B 53 3.712 -20.748 -5.023 1.00 0.00 N ATOM 0 H ASN B 53 2.515 -19.721 -1.906 1.00 0.00 H new ATOM 0 HA ASN B 53 1.073 -22.181 -2.354 1.00 0.00 H new ATOM 0 HB2 ASN B 53 4.004 -21.434 -2.590 1.00 0.00 H new ATOM 0 HB3 ASN B 53 3.308 -22.953 -3.116 1.00 0.00 H new ATOM 0 HD21 ASN B 53 3.515 -20.314 -5.925 1.00 0.00 H new ATOM 0 HD22 ASN B 53 4.670 -20.787 -4.674 1.00 0.00 H new ATOM 3241 N LYS B 54 2.114 -21.819 0.509 1.00 0.00 N ATOM 3242 CA LYS B 54 2.389 -22.341 1.834 1.00 0.00 C ATOM 3243 C LYS B 54 1.103 -22.358 2.672 1.00 0.00 C ATOM 3244 O LYS B 54 1.125 -22.788 3.822 1.00 0.00 O ATOM 3245 CB LYS B 54 3.484 -21.458 2.452 1.00 0.00 C ATOM 3246 CG LYS B 54 4.094 -22.045 3.723 1.00 0.00 C ATOM 3247 CD LYS B 54 5.207 -21.141 4.264 1.00 0.00 C ATOM 3248 CE LYS B 54 4.661 -19.769 4.673 1.00 0.00 C ATOM 3249 NZ LYS B 54 5.719 -18.924 5.263 1.00 0.00 N ATOM 0 H LYS B 54 1.747 -20.867 0.526 1.00 0.00 H new ATOM 0 HA LYS B 54 2.740 -23.372 1.795 1.00 0.00 H new ATOM 0 HB2 LYS B 54 4.274 -21.304 1.717 1.00 0.00 H new ATOM 0 HB3 LYS B 54 3.064 -20.478 2.679 1.00 0.00 H new ATOM 0 HG2 LYS B 54 3.319 -22.167 4.480 1.00 0.00 H new ATOM 0 HG3 LYS B 54 4.495 -23.037 3.514 1.00 0.00 H new ATOM 0 HD2 LYS B 54 5.680 -21.617 5.123 1.00 0.00 H new ATOM 0 HD3 LYS B 54 5.978 -21.016 3.504 1.00 0.00 H new ATOM 0 HE2 LYS B 54 4.237 -19.269 3.802 1.00 0.00 H new ATOM 0 HE3 LYS B 54 3.852 -19.897 5.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 5.319 -18.002 5.530 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 6.105 -19.391 6.108 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 6.479 -18.783 4.567 1.00 0.00 H new ATOM 3263 N LEU B 55 -0.018 -21.891 2.105 1.00 0.00 N ATOM 3264 CA LEU B 55 -1.291 -21.850 2.822 1.00 0.00 C ATOM 3265 C LEU B 55 -2.501 -22.014 1.901 1.00 0.00 C ATOM 3266 O LEU B 55 -3.601 -22.259 2.392 1.00 0.00 O ATOM 3267 CB LEU B 55 -1.371 -20.540 3.620 1.00 0.00 C ATOM 3268 CG LEU B 55 -1.528 -19.298 2.736 1.00 0.00 C ATOM 3269 CD1 LEU B 55 -2.996 -18.955 2.481 1.00 0.00 C ATOM 3270 CD2 LEU B 55 -0.908 -18.099 3.442 1.00 0.00 C ATOM 0 H LEU B 55 -0.064 -21.537 1.150 1.00 0.00 H new ATOM 0 HA LEU B 55 -1.324 -22.701 3.502 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -2.213 -20.594 4.310 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -0.470 -20.435 4.224 1.00 0.00 H new ATOM 0 HG LEU B 55 -1.038 -19.516 1.787 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -3.058 -18.068 1.850 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -3.483 -19.791 1.980 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -3.494 -18.760 3.431 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -1.017 -17.213 2.817 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -1.413 -17.936 4.394 1.00 0.00 H new ATOM 0 HD23 LEU B 55 0.150 -18.289 3.621 1.00 0.00 H new ATOM 3282 N ALA B 56 -2.320 -21.889 0.582 1.00 0.00 N ATOM 3283 CA ALA B 56 -3.395 -22.031 -0.389 1.00 0.00 C ATOM 3284 C ALA B 56 -3.052 -23.055 -1.476 1.00 0.00 C ATOM 3285 O ALA B 56 -3.651 -23.034 -2.553 1.00 0.00 O ATOM 3286 CB ALA B 56 -3.707 -20.662 -0.998 1.00 0.00 C ATOM 0 H ALA B 56 -1.414 -21.685 0.161 1.00 0.00 H new ATOM 0 HA ALA B 56 -4.279 -22.408 0.124 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -4.512 -20.763 -1.726 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -4.015 -19.975 -0.210 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -2.817 -20.272 -1.492 1.00 0.00 H new