USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 930 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 59 MET CE :methyl -177:sc= -1.83 (180deg=-1.96) USER MOD Set 1.2: A 115 HIS : no HD1:sc= -9.1! C(o=-11!,f=-7.9!) USER MOD Set 2.1: A 53 HIS : no HD1:sc= -0.85 K(o=-0.41,f=-9.9!) USER MOD Set 2.2: A 99 TYR OH : rot 120:sc= 0.44 USER MOD Set 3.1: A 68 ASN : amide:sc= 0.00625 K(o=-0.84,f=-4.9!) USER MOD Set 3.2: A 76 HIS : no HE2:sc= -0.846 K(o=-0.84,f=-4.1!) USER MOD Single : A 6 THR OG1 : rot 12:sc= 0.438 USER MOD Single : A 10 HIS : no HD1:sc= -0.801 X(o=-0.8,f=-0.58) USER MOD Single : A 18 LYS NZ :NH3+ -159:sc= 1.26 (180deg=1.18) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 180:sc=-0.00837 USER MOD Single : A 29 MET CE :methyl -170:sc= -0.61 (180deg=-1.17) USER MOD Single : A 33 LYS NZ :NH3+ 173:sc= 1.03 (180deg=0.75) USER MOD Single : A 35 GLN : amide:sc= -0.764 K(o=-0.76,f=-5.6!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -154:sc= 2.39 (180deg=1.15) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -69:sc= 1.21 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 77:sc= 1.11 USER MOD Single : A 57 LYS NZ :NH3+ -141:sc= -0.227 (180deg=-1.33) USER MOD Single : A 71 ASN : amide:sc= -0.364 X(o=-0.36,f=-0.056) USER MOD Single : A 86 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 91 ASN : amide:sc= -0.687 K(o=-0.69,f=-6.3!) USER MOD Single : A 93 GLN : amide:sc= 0.357 K(o=0.36,f=-3.7!) USER MOD Single : A 95 THR OG1 : rot 82:sc= 0.934 USER MOD Single : A 97 THR OG1 : rot 103:sc= 0.284 USER MOD Single : A 100 CYS SG : rot -160:sc= 0 USER MOD Single : A 101 SER OG : rot 92:sc= 0.00305 USER MOD Single : A 102 THR OG1 : rot 82:sc= 0.507 USER MOD Single : A 104 MET CE :methyl 176:sc= -1.14 (180deg=-1.17) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot -140:sc= -0.0635 USER MOD Single : A 109 LYS NZ :NH3+ 145:sc= 1.28 (180deg=0.747) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 CYS SG : rot 180:sc= -0.68 USER MOD Single : A 121 LYS NZ :NH3+ -162:sc= 2.19 (180deg=0.882) USER MOD ----------------------------------------------------------------- ATOM 38 N GLY A 4 -2.534 5.595 3.661 1.00 0.00 N ATOM 39 CA GLY A 4 -3.632 5.998 4.530 1.00 0.00 C ATOM 40 C GLY A 4 -3.325 7.305 5.243 1.00 0.00 C ATOM 41 O GLY A 4 -3.305 7.358 6.472 1.00 0.00 O ATOM 0 HA2 GLY A 4 -4.542 6.108 3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.821 5.216 5.266 1.00 0.00 H new ATOM 45 N ASP A 5 -3.100 8.356 4.454 1.00 0.00 N ATOM 46 CA ASP A 5 -2.816 9.688 4.944 1.00 0.00 C ATOM 47 C ASP A 5 -3.002 10.676 3.796 1.00 0.00 C ATOM 48 O ASP A 5 -3.733 11.649 3.934 1.00 0.00 O ATOM 49 CB ASP A 5 -1.368 9.769 5.497 1.00 0.00 C ATOM 50 CG ASP A 5 -1.073 11.130 6.124 1.00 0.00 C ATOM 51 OD1 ASP A 5 -2.011 11.722 6.702 1.00 0.00 O ATOM 52 OD2 ASP A 5 0.104 11.543 6.059 1.00 0.00 O ATOM 0 H ASP A 5 -3.112 8.295 3.436 1.00 0.00 H new ATOM 0 HA ASP A 5 -3.498 9.933 5.759 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.219 8.987 6.241 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.660 9.580 4.690 1.00 0.00 H new ATOM 57 N THR A 6 -2.333 10.399 2.669 1.00 0.00 N ATOM 58 CA THR A 6 -2.307 11.155 1.435 1.00 0.00 C ATOM 59 C THR A 6 -1.939 12.601 1.688 1.00 0.00 C ATOM 60 O THR A 6 -1.178 12.866 2.612 1.00 0.00 O ATOM 61 CB THR A 6 -3.496 10.867 0.525 1.00 0.00 C ATOM 62 OG1 THR A 6 -3.268 11.367 -0.780 1.00 0.00 O ATOM 63 CG2 THR A 6 -4.744 11.503 1.088 1.00 0.00 C ATOM 0 H THR A 6 -1.749 9.565 2.604 1.00 0.00 H new ATOM 0 HA THR A 6 -1.489 10.795 0.811 1.00 0.00 H new ATOM 0 HB THR A 6 -3.624 9.786 0.471 1.00 0.00 H new ATOM 0 HG1 THR A 6 -2.326 11.621 -0.873 1.00 0.00 H new ATOM 0 HG21 THR A 6 -5.588 11.292 0.431 1.00 0.00 H new ATOM 0 HG22 THR A 6 -4.945 11.096 2.079 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.602 12.581 1.161 1.00 0.00 H new ATOM 71 N PHE A 7 -2.397 13.499 0.810 1.00 0.00 N ATOM 72 CA PHE A 7 -1.979 14.887 0.772 1.00 0.00 C ATOM 73 C PHE A 7 -3.160 15.810 0.535 1.00 0.00 C ATOM 74 O PHE A 7 -4.281 15.319 0.404 1.00 0.00 O ATOM 75 CB PHE A 7 -0.847 14.909 -0.250 1.00 0.00 C ATOM 76 CG PHE A 7 0.087 13.689 0.019 1.00 0.00 C ATOM 77 CD1 PHE A 7 0.999 13.683 1.106 1.00 0.00 C ATOM 78 CD2 PHE A 7 -0.011 12.498 -0.751 1.00 0.00 C ATOM 79 CE1 PHE A 7 1.822 12.573 1.363 1.00 0.00 C ATOM 80 CE2 PHE A 7 0.816 11.391 -0.492 1.00 0.00 C ATOM 81 CZ PHE A 7 1.743 11.431 0.556 1.00 0.00 C ATOM 0 H PHE A 7 -3.084 13.267 0.093 1.00 0.00 H new ATOM 0 HA PHE A 7 -1.597 15.281 1.714 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -1.249 14.862 -1.262 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -0.285 15.840 -0.173 1.00 0.00 H new ATOM 0 HD1 PHE A 7 1.062 14.549 1.749 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -0.735 12.443 -1.551 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.519 12.601 2.187 1.00 0.00 H new ATOM 0 HE2 PHE A 7 0.736 10.505 -1.105 1.00 0.00 H new ATOM 0 HZ PHE A 7 2.392 10.588 0.741 1.00 0.00 H new ATOM 91 N ILE A 8 -2.927 17.132 0.542 1.00 0.00 N ATOM 92 CA ILE A 8 -4.004 18.107 0.458 1.00 0.00 C ATOM 93 C ILE A 8 -3.912 19.132 -0.661 1.00 0.00 C ATOM 94 O ILE A 8 -2.845 19.368 -1.224 1.00 0.00 O ATOM 95 CB ILE A 8 -4.167 18.724 1.861 1.00 0.00 C ATOM 96 CG1 ILE A 8 -4.779 17.593 2.701 1.00 0.00 C ATOM 97 CG2 ILE A 8 -4.999 20.013 1.937 1.00 0.00 C ATOM 98 CD1 ILE A 8 -5.250 18.074 4.048 1.00 0.00 C ATOM 0 H ILE A 8 -1.995 17.542 0.606 1.00 0.00 H new ATOM 0 HA ILE A 8 -4.909 17.580 0.156 1.00 0.00 H new ATOM 0 HB ILE A 8 -3.199 19.069 2.225 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.618 17.155 2.160 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -4.040 16.804 2.837 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -5.046 20.356 2.971 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -4.535 20.783 1.320 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -6.008 19.817 1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -5.675 17.239 4.605 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -4.407 18.488 4.602 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.010 18.844 3.914 1.00 0.00 H new ATOM 110 N ARG A 9 -5.078 19.737 -0.952 1.00 0.00 N ATOM 111 CA ARG A 9 -5.252 20.770 -1.948 1.00 0.00 C ATOM 112 C ARG A 9 -5.124 22.098 -1.209 1.00 0.00 C ATOM 113 O ARG A 9 -4.202 22.864 -1.489 1.00 0.00 O ATOM 114 CB ARG A 9 -6.633 20.608 -2.644 1.00 0.00 C ATOM 115 CG ARG A 9 -6.597 21.070 -4.108 1.00 0.00 C ATOM 116 CD ARG A 9 -6.252 22.557 -4.250 1.00 0.00 C ATOM 117 NE ARG A 9 -6.285 22.977 -5.657 1.00 0.00 N ATOM 118 CZ ARG A 9 -5.910 24.191 -6.098 1.00 0.00 C ATOM 119 NH1 ARG A 9 -5.530 25.137 -5.230 1.00 0.00 N ATOM 120 NH2 ARG A 9 -5.915 24.454 -7.412 1.00 0.00 N ATOM 0 H ARG A 9 -5.947 19.500 -0.474 1.00 0.00 H new ATOM 0 HA ARG A 9 -4.506 20.713 -2.740 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.940 19.563 -2.601 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.383 21.183 -2.101 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -5.863 20.477 -4.654 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.567 20.880 -4.569 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -6.958 23.154 -3.673 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -5.262 22.745 -3.835 1.00 0.00 H new ATOM 0 HE ARG A 9 -6.615 22.302 -6.347 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -5.524 24.938 -4.230 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -5.246 26.056 -5.569 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -6.203 23.734 -8.075 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -5.631 25.374 -7.749 1.00 0.00 H new ATOM 134 N HIS A 10 -6.043 22.364 -0.268 1.00 0.00 N ATOM 135 CA HIS A 10 -6.054 23.595 0.517 1.00 0.00 C ATOM 136 C HIS A 10 -7.133 23.654 1.605 1.00 0.00 C ATOM 137 O HIS A 10 -7.924 22.719 1.766 1.00 0.00 O ATOM 138 CB HIS A 10 -6.173 24.812 -0.440 1.00 0.00 C ATOM 139 CG HIS A 10 -7.531 25.483 -0.560 1.00 0.00 C ATOM 140 ND1 HIS A 10 -7.686 26.862 -0.532 1.00 0.00 N ATOM 141 CD2 HIS A 10 -8.808 24.993 -0.707 1.00 0.00 C ATOM 142 CE1 HIS A 10 -9.001 27.125 -0.659 1.00 0.00 C ATOM 143 NE2 HIS A 10 -9.739 26.021 -0.770 1.00 0.00 N ATOM 0 H HIS A 10 -6.801 21.723 -0.034 1.00 0.00 H new ATOM 0 HA HIS A 10 -5.109 23.621 1.060 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -5.454 25.565 -0.117 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -5.870 24.487 -1.435 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -9.055 23.943 -0.766 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -9.413 28.123 -0.670 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -10.751 25.948 -0.876 1.00 0.00 H new ATOM 151 N ILE A 11 -7.145 24.790 2.327 1.00 0.00 N ATOM 152 CA ILE A 11 -8.086 25.115 3.388 1.00 0.00 C ATOM 153 C ILE A 11 -8.986 26.274 2.959 1.00 0.00 C ATOM 154 O ILE A 11 -8.538 27.168 2.246 1.00 0.00 O ATOM 155 CB ILE A 11 -7.400 25.486 4.722 1.00 0.00 C ATOM 156 CG1 ILE A 11 -5.968 24.931 4.843 1.00 0.00 C ATOM 157 CG2 ILE A 11 -8.350 25.068 5.863 1.00 0.00 C ATOM 158 CD1 ILE A 11 -5.255 25.342 6.140 1.00 0.00 C ATOM 0 H ILE A 11 -6.464 25.533 2.171 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.671 24.212 3.559 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.239 26.563 4.778 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.003 23.843 4.787 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.381 25.275 3.991 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.897 25.316 6.823 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.297 25.599 5.761 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.529 23.994 5.812 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.252 24.915 6.155 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.187 26.429 6.189 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.819 24.975 6.997 1.00 0.00 H new ATOM 170 N ALA A 12 -10.239 26.278 3.425 1.00 0.00 N ATOM 171 CA ALA A 12 -11.226 27.310 3.189 1.00 0.00 C ATOM 172 C ALA A 12 -11.881 27.452 4.558 1.00 0.00 C ATOM 173 O ALA A 12 -12.059 26.434 5.226 1.00 0.00 O ATOM 174 CB ALA A 12 -12.233 26.850 2.128 1.00 0.00 C ATOM 0 H ALA A 12 -10.600 25.520 4.004 1.00 0.00 H new ATOM 0 HA ALA A 12 -10.814 28.247 2.813 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.970 27.636 1.960 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -11.709 26.639 1.196 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -12.738 25.947 2.472 1.00 0.00 H new ATOM 180 N LEU A 13 -12.226 28.661 5.008 1.00 0.00 N ATOM 181 CA LEU A 13 -12.844 28.853 6.314 1.00 0.00 C ATOM 182 C LEU A 13 -14.261 29.325 6.052 1.00 0.00 C ATOM 183 O LEU A 13 -14.480 30.130 5.147 1.00 0.00 O ATOM 184 CB LEU A 13 -11.962 29.781 7.153 1.00 0.00 C ATOM 185 CG LEU A 13 -12.034 29.752 8.708 1.00 0.00 C ATOM 186 CD1 LEU A 13 -11.007 30.754 9.218 1.00 0.00 C ATOM 187 CD2 LEU A 13 -13.301 30.101 9.470 1.00 0.00 C ATOM 0 H LEU A 13 -12.085 29.523 4.481 1.00 0.00 H new ATOM 0 HA LEU A 13 -12.920 27.947 6.915 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.928 29.578 6.876 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -12.182 30.802 6.840 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.901 28.687 8.899 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.022 30.768 10.308 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.014 30.465 8.872 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -11.248 31.747 8.839 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -13.118 30.012 10.541 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.596 31.124 9.236 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -14.099 29.418 9.181 1.00 0.00 H new ATOM 199 N LEU A 14 -15.221 28.789 6.808 1.00 0.00 N ATOM 200 CA LEU A 14 -16.625 29.110 6.607 1.00 0.00 C ATOM 201 C LEU A 14 -16.980 30.285 7.480 1.00 0.00 C ATOM 202 O LEU A 14 -17.547 31.268 7.003 1.00 0.00 O ATOM 203 CB LEU A 14 -17.511 27.880 6.920 1.00 0.00 C ATOM 204 CG LEU A 14 -18.602 27.741 5.836 1.00 0.00 C ATOM 205 CD1 LEU A 14 -18.040 27.302 4.465 1.00 0.00 C ATOM 206 CD2 LEU A 14 -19.679 26.751 6.292 1.00 0.00 C ATOM 0 H LEU A 14 -15.045 28.129 7.566 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.803 29.376 5.565 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.900 26.978 6.954 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -17.971 27.990 7.902 1.00 0.00 H new ATOM 0 HG LEU A 14 -19.035 28.732 5.703 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -18.855 27.222 3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -17.318 28.040 4.115 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -17.549 26.334 4.566 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -20.442 26.662 5.519 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -19.225 25.776 6.468 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -20.137 27.110 7.214 1.00 0.00 H new ATOM 218 N GLY A 15 -16.622 30.178 8.756 1.00 0.00 N ATOM 219 CA GLY A 15 -16.889 31.289 9.655 1.00 0.00 C ATOM 220 C GLY A 15 -17.055 30.900 11.111 1.00 0.00 C ATOM 221 O GLY A 15 -16.107 30.440 11.733 1.00 0.00 O ATOM 0 H GLY A 15 -16.165 29.368 9.176 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -16.073 32.007 9.576 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -17.794 31.798 9.323 1.00 0.00 H new ATOM 225 N PHE A 16 -18.256 31.117 11.652 1.00 0.00 N ATOM 226 CA PHE A 16 -18.567 30.913 13.057 1.00 0.00 C ATOM 227 C PHE A 16 -19.035 29.479 13.338 1.00 0.00 C ATOM 228 O PHE A 16 -19.017 28.648 12.437 1.00 0.00 O ATOM 229 CB PHE A 16 -19.649 31.951 13.430 1.00 0.00 C ATOM 230 CG PHE A 16 -19.222 33.411 13.121 1.00 0.00 C ATOM 231 CD1 PHE A 16 -18.314 34.101 13.966 1.00 0.00 C ATOM 232 CD2 PHE A 16 -19.707 34.107 11.982 1.00 0.00 C ATOM 233 CE1 PHE A 16 -17.915 35.420 13.689 1.00 0.00 C ATOM 234 CE2 PHE A 16 -19.303 35.427 11.710 1.00 0.00 C ATOM 235 CZ PHE A 16 -18.409 36.086 12.561 1.00 0.00 C ATOM 0 H PHE A 16 -19.053 31.447 11.108 1.00 0.00 H new ATOM 0 HA PHE A 16 -17.675 31.051 13.668 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.566 31.724 12.886 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -19.879 31.863 14.492 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -17.922 33.602 14.840 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -20.398 33.615 11.313 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -17.224 35.922 14.350 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -19.686 35.936 10.838 1.00 0.00 H new ATOM 0 HZ PHE A 16 -18.103 37.100 12.349 1.00 0.00 H new ATOM 245 N GLU A 17 -19.446 29.223 14.588 1.00 0.00 N ATOM 246 CA GLU A 17 -19.995 27.994 15.163 1.00 0.00 C ATOM 247 C GLU A 17 -20.399 28.268 16.620 1.00 0.00 C ATOM 248 O GLU A 17 -20.301 29.410 17.066 1.00 0.00 O ATOM 249 CB GLU A 17 -19.140 26.740 14.917 1.00 0.00 C ATOM 250 CG GLU A 17 -19.884 25.745 14.011 1.00 0.00 C ATOM 251 CD GLU A 17 -21.188 25.254 14.623 1.00 0.00 C ATOM 252 OE1 GLU A 17 -21.144 24.839 15.800 1.00 0.00 O ATOM 253 OE2 GLU A 17 -22.223 25.355 13.928 1.00 0.00 O ATOM 0 H GLU A 17 -19.395 29.955 15.296 1.00 0.00 H new ATOM 0 HA GLU A 17 -20.903 27.719 14.626 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -18.194 27.023 14.455 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -18.900 26.265 15.868 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -20.094 26.220 13.052 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -19.238 24.891 13.809 1.00 0.00 H new ATOM 260 N LYS A 18 -20.908 27.256 17.340 1.00 0.00 N ATOM 261 CA LYS A 18 -21.444 27.330 18.684 1.00 0.00 C ATOM 262 C LYS A 18 -21.161 26.048 19.496 1.00 0.00 C ATOM 263 O LYS A 18 -21.603 24.961 19.126 1.00 0.00 O ATOM 264 CB LYS A 18 -22.971 27.567 18.658 1.00 0.00 C ATOM 265 CG LYS A 18 -23.551 28.342 17.465 1.00 0.00 C ATOM 266 CD LYS A 18 -23.871 27.383 16.306 1.00 0.00 C ATOM 267 CE LYS A 18 -24.084 28.123 14.983 1.00 0.00 C ATOM 268 NZ LYS A 18 -24.243 27.175 13.864 1.00 0.00 N ATOM 0 H LYS A 18 -20.953 26.309 16.964 1.00 0.00 H new ATOM 0 HA LYS A 18 -20.943 28.169 19.166 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -23.462 26.595 18.698 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -23.244 28.100 19.569 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -24.456 28.868 17.770 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -22.839 29.098 17.134 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -23.056 26.668 16.193 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -24.766 26.810 16.548 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -24.968 28.757 15.055 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -23.236 28.780 14.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -24.032 27.658 12.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -23.589 26.376 13.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -25.221 26.822 13.845 1.00 0.00 H new ATOM 282 N ARG A 19 -20.456 26.176 20.621 1.00 0.00 N ATOM 283 CA ARG A 19 -20.133 25.135 21.591 1.00 0.00 C ATOM 284 C ARG A 19 -20.276 25.780 22.965 1.00 0.00 C ATOM 285 O ARG A 19 -19.383 26.490 23.424 1.00 0.00 O ATOM 286 CB ARG A 19 -18.714 24.585 21.407 1.00 0.00 C ATOM 287 CG ARG A 19 -18.502 23.803 20.111 1.00 0.00 C ATOM 288 CD ARG A 19 -19.231 22.454 20.129 1.00 0.00 C ATOM 289 NE ARG A 19 -18.982 21.713 18.888 1.00 0.00 N ATOM 290 CZ ARG A 19 -19.514 22.025 17.698 1.00 0.00 C ATOM 291 NH1 ARG A 19 -20.405 23.018 17.595 1.00 0.00 N ATOM 292 NH2 ARG A 19 -19.144 21.345 16.609 1.00 0.00 N ATOM 0 H ARG A 19 -20.068 27.078 20.896 1.00 0.00 H new ATOM 0 HA ARG A 19 -20.801 24.283 21.464 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -18.009 25.416 21.435 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -18.476 23.937 22.251 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -18.857 24.396 19.268 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -17.436 23.637 19.958 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -18.896 21.865 20.983 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -20.302 22.615 20.253 1.00 0.00 H new ATOM 0 HE ARG A 19 -18.361 20.905 18.934 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -20.683 23.542 18.425 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -20.806 23.251 16.687 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -18.460 20.592 16.686 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -19.546 21.578 15.701 1.00 0.00 H new ATOM 401 N TYR A 26 -17.415 29.947 21.951 1.00 0.00 N ATOM 402 CA TYR A 26 -17.788 29.710 20.558 1.00 0.00 C ATOM 403 C TYR A 26 -16.543 29.256 19.788 1.00 0.00 C ATOM 404 O TYR A 26 -15.415 29.506 20.218 1.00 0.00 O ATOM 405 CB TYR A 26 -18.462 30.930 19.896 1.00 0.00 C ATOM 406 CG TYR A 26 -20.014 30.964 19.988 1.00 0.00 C ATOM 407 CD1 TYR A 26 -20.716 30.348 21.058 1.00 0.00 C ATOM 408 CD2 TYR A 26 -20.794 31.608 18.990 1.00 0.00 C ATOM 409 CE1 TYR A 26 -22.118 30.380 21.126 1.00 0.00 C ATOM 410 CE2 TYR A 26 -22.197 31.636 19.063 1.00 0.00 C ATOM 411 CZ TYR A 26 -22.861 31.024 20.131 1.00 0.00 C ATOM 412 OH TYR A 26 -24.222 31.048 20.203 1.00 0.00 O ATOM 0 HA TYR A 26 -18.543 28.924 20.532 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -18.067 31.836 20.356 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -18.176 30.956 18.844 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.160 29.845 21.835 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.298 32.086 18.158 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -22.626 29.904 21.952 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -22.765 32.133 18.291 1.00 0.00 H new ATOM 0 HH TYR A 26 -24.582 31.537 19.433 1.00 0.00 H new ATOM 422 N VAL A 27 -16.759 28.563 18.665 1.00 0.00 N ATOM 423 CA VAL A 27 -15.711 27.991 17.836 1.00 0.00 C ATOM 424 C VAL A 27 -15.983 28.385 16.379 1.00 0.00 C ATOM 425 O VAL A 27 -17.113 28.765 16.086 1.00 0.00 O ATOM 426 CB VAL A 27 -15.682 26.466 18.096 1.00 0.00 C ATOM 427 CG1 VAL A 27 -15.714 26.150 19.598 1.00 0.00 C ATOM 428 CG2 VAL A 27 -16.828 25.707 17.425 1.00 0.00 C ATOM 0 H VAL A 27 -17.696 28.384 18.304 1.00 0.00 H new ATOM 0 HA VAL A 27 -14.717 28.370 18.075 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.744 26.129 17.654 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -15.692 25.070 19.743 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.847 26.599 20.083 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -16.625 26.557 20.036 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -16.742 24.644 17.651 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -17.781 26.082 17.799 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -16.779 25.853 16.346 1.00 0.00 H new ATOM 438 N TYR A 28 -14.989 28.317 15.475 1.00 0.00 N ATOM 439 CA TYR A 28 -15.114 28.656 14.077 1.00 0.00 C ATOM 440 C TYR A 28 -15.216 27.416 13.187 1.00 0.00 C ATOM 441 O TYR A 28 -14.443 26.470 13.348 1.00 0.00 O ATOM 442 CB TYR A 28 -14.035 29.645 13.580 1.00 0.00 C ATOM 443 CG TYR A 28 -12.810 29.963 14.412 1.00 0.00 C ATOM 444 CD1 TYR A 28 -11.945 28.946 14.819 1.00 0.00 C ATOM 445 CD2 TYR A 28 -12.515 31.296 14.759 1.00 0.00 C ATOM 446 CE1 TYR A 28 -10.830 29.252 15.603 1.00 0.00 C ATOM 447 CE2 TYR A 28 -11.392 31.610 15.541 1.00 0.00 C ATOM 448 CZ TYR A 28 -10.550 30.576 15.981 1.00 0.00 C ATOM 449 OH TYR A 28 -9.451 30.856 16.739 1.00 0.00 O ATOM 0 H TYR A 28 -14.048 28.011 15.724 1.00 0.00 H new ATOM 0 HA TYR A 28 -16.060 29.190 13.992 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -13.678 29.269 12.621 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -14.539 30.591 13.383 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -12.137 27.924 14.528 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -13.163 32.090 14.418 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -10.172 28.458 15.924 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -11.178 32.636 15.801 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.407 31.820 16.908 1.00 0.00 H new ATOM 459 N MET A 29 -16.173 27.426 12.246 1.00 0.00 N ATOM 460 CA MET A 29 -16.399 26.312 11.314 1.00 0.00 C ATOM 461 C MET A 29 -15.356 26.318 10.171 1.00 0.00 C ATOM 462 O MET A 29 -15.295 27.300 9.426 1.00 0.00 O ATOM 463 CB MET A 29 -17.844 26.429 10.812 1.00 0.00 C ATOM 464 CG MET A 29 -18.556 25.277 10.099 1.00 0.00 C ATOM 465 SD MET A 29 -17.747 24.559 8.668 1.00 0.00 S ATOM 466 CE MET A 29 -17.065 23.122 9.502 1.00 0.00 C ATOM 0 H MET A 29 -16.813 28.209 12.110 1.00 0.00 H new ATOM 0 HA MET A 29 -16.268 25.350 11.810 1.00 0.00 H new ATOM 0 HB2 MET A 29 -18.456 26.688 11.676 1.00 0.00 H new ATOM 0 HB3 MET A 29 -17.872 27.282 10.134 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.720 24.482 10.826 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.539 25.631 9.787 1.00 0.00 H new ATOM 0 HE1 MET A 29 -16.366 22.614 8.838 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.543 23.439 10.405 1.00 0.00 H new ATOM 0 HE3 MET A 29 -17.872 22.440 9.770 1.00 0.00 H new ATOM 476 N PHE A 30 -14.534 25.252 10.029 1.00 0.00 N ATOM 477 CA PHE A 30 -13.467 25.111 9.045 1.00 0.00 C ATOM 478 C PHE A 30 -13.714 24.081 7.933 1.00 0.00 C ATOM 479 O PHE A 30 -14.101 22.953 8.231 1.00 0.00 O ATOM 480 CB PHE A 30 -12.149 24.729 9.753 1.00 0.00 C ATOM 481 CG PHE A 30 -11.275 25.943 10.169 1.00 0.00 C ATOM 482 CD1 PHE A 30 -11.731 27.009 11.002 1.00 0.00 C ATOM 483 CD2 PHE A 30 -9.942 26.027 9.695 1.00 0.00 C ATOM 484 CE1 PHE A 30 -10.877 28.072 11.318 1.00 0.00 C ATOM 485 CE2 PHE A 30 -9.099 27.089 10.013 1.00 0.00 C ATOM 486 CZ PHE A 30 -9.565 28.113 10.823 1.00 0.00 C ATOM 0 H PHE A 30 -14.611 24.434 10.633 1.00 0.00 H new ATOM 0 HA PHE A 30 -13.421 26.086 8.559 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.384 24.143 10.642 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -11.567 24.086 9.092 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -12.739 26.995 11.390 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.565 25.237 9.063 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -11.233 28.871 11.951 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -8.089 27.115 9.631 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.919 28.941 11.073 1.00 0.00 H new ATOM 496 N LEU A 31 -13.447 24.433 6.659 1.00 0.00 N ATOM 497 CA LEU A 31 -13.590 23.526 5.534 1.00 0.00 C ATOM 498 C LEU A 31 -12.236 23.019 5.036 1.00 0.00 C ATOM 499 O LEU A 31 -11.420 23.826 4.594 1.00 0.00 O ATOM 500 CB LEU A 31 -14.333 24.223 4.379 1.00 0.00 C ATOM 501 CG LEU A 31 -15.848 24.009 4.388 1.00 0.00 C ATOM 502 CD1 LEU A 31 -16.200 22.586 3.972 1.00 0.00 C ATOM 503 CD2 LEU A 31 -16.464 24.311 5.752 1.00 0.00 C ATOM 0 H LEU A 31 -13.125 25.364 6.395 1.00 0.00 H new ATOM 0 HA LEU A 31 -14.167 22.668 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -14.128 25.293 4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -13.932 23.861 3.433 1.00 0.00 H new ATOM 0 HG LEU A 31 -16.266 24.710 3.666 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -17.283 22.460 3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -15.826 22.398 2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -15.743 21.880 4.666 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -17.540 24.145 5.710 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -16.025 23.654 6.503 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -16.267 25.349 6.018 1.00 0.00 H new ATOM 515 N VAL A 32 -11.998 21.695 5.062 1.00 0.00 N ATOM 516 CA VAL A 32 -10.769 21.137 4.519 1.00 0.00 C ATOM 517 C VAL A 32 -11.111 20.571 3.145 1.00 0.00 C ATOM 518 O VAL A 32 -12.142 19.905 3.001 1.00 0.00 O ATOM 519 CB VAL A 32 -10.073 20.128 5.439 1.00 0.00 C ATOM 520 CG1 VAL A 32 -11.033 19.184 6.156 1.00 0.00 C ATOM 521 CG2 VAL A 32 -9.009 19.321 4.684 1.00 0.00 C ATOM 0 H VAL A 32 -12.641 21.006 5.452 1.00 0.00 H new ATOM 0 HA VAL A 32 -10.020 21.924 4.431 1.00 0.00 H new ATOM 0 HB VAL A 32 -9.591 20.730 6.209 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -10.467 18.500 6.788 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -11.720 19.763 6.773 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.599 18.613 5.420 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -8.535 18.615 5.366 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -9.479 18.775 3.866 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -8.256 19.999 4.282 1.00 0.00 H new ATOM 531 N LYS A 33 -10.260 20.833 2.142 1.00 0.00 N ATOM 532 CA LYS A 33 -10.494 20.349 0.794 1.00 0.00 C ATOM 533 C LYS A 33 -9.401 19.367 0.405 1.00 0.00 C ATOM 534 O LYS A 33 -8.260 19.792 0.205 1.00 0.00 O ATOM 535 CB LYS A 33 -10.602 21.505 -0.203 1.00 0.00 C ATOM 536 CG LYS A 33 -11.174 20.994 -1.533 1.00 0.00 C ATOM 537 CD LYS A 33 -11.433 22.157 -2.496 1.00 0.00 C ATOM 538 CE LYS A 33 -11.938 21.666 -3.860 1.00 0.00 C ATOM 539 NZ LYS A 33 -13.254 21.005 -3.771 1.00 0.00 N ATOM 0 H LYS A 33 -9.405 21.379 2.250 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.450 19.826 0.769 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.243 22.288 0.202 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.620 21.950 -0.366 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -10.478 20.289 -1.986 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.103 20.453 -1.351 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -12.167 22.834 -2.059 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -10.514 22.727 -2.632 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -12.005 22.511 -4.545 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.213 20.970 -4.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -13.604 20.798 -4.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -13.161 20.117 -3.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -13.926 21.633 -3.285 1.00 0.00 H new ATOM 553 N TRP A 34 -9.722 18.069 0.285 1.00 0.00 N ATOM 554 CA TRP A 34 -8.708 17.113 -0.106 1.00 0.00 C ATOM 555 C TRP A 34 -8.731 16.997 -1.631 1.00 0.00 C ATOM 556 O TRP A 34 -9.766 17.274 -2.236 1.00 0.00 O ATOM 557 CB TRP A 34 -8.935 15.770 0.577 1.00 0.00 C ATOM 558 CG TRP A 34 -8.851 15.724 2.072 1.00 0.00 C ATOM 559 CD1 TRP A 34 -9.788 16.151 2.946 1.00 0.00 C ATOM 560 CD2 TRP A 34 -7.763 15.205 2.884 1.00 0.00 C ATOM 561 NE1 TRP A 34 -9.359 15.935 4.241 1.00 0.00 N ATOM 562 CE2 TRP A 34 -8.107 15.349 4.261 1.00 0.00 C ATOM 563 CE3 TRP A 34 -6.515 14.624 2.586 1.00 0.00 C ATOM 564 CZ2 TRP A 34 -7.253 14.931 5.295 1.00 0.00 C ATOM 565 CZ3 TRP A 34 -5.653 14.210 3.616 1.00 0.00 C ATOM 566 CH2 TRP A 34 -6.018 14.357 4.965 1.00 0.00 C ATOM 0 H TRP A 34 -10.650 17.679 0.450 1.00 0.00 H new ATOM 0 HA TRP A 34 -7.722 17.451 0.212 1.00 0.00 H new ATOM 0 HB2 TRP A 34 -9.921 15.408 0.286 1.00 0.00 H new ATOM 0 HB3 TRP A 34 -8.206 15.064 0.179 1.00 0.00 H new ATOM 0 HD1 TRP A 34 -10.733 16.596 2.673 1.00 0.00 H new ATOM 0 HE1 TRP A 34 -9.896 16.176 5.074 1.00 0.00 H new ATOM 0 HE3 TRP A 34 -6.217 14.495 1.556 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 -7.544 15.050 6.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -4.697 13.773 3.367 1.00 0.00 H new ATOM 0 HH2 TRP A 34 -5.348 14.028 5.746 1.00 0.00 H new ATOM 577 N GLN A 35 -7.616 16.592 -2.260 1.00 0.00 N ATOM 578 CA GLN A 35 -7.565 16.451 -3.722 1.00 0.00 C ATOM 579 C GLN A 35 -7.977 15.042 -4.153 1.00 0.00 C ATOM 580 O GLN A 35 -8.034 14.767 -5.350 1.00 0.00 O ATOM 581 CB GLN A 35 -6.150 16.838 -4.282 1.00 0.00 C ATOM 582 CG GLN A 35 -5.100 15.716 -4.218 1.00 0.00 C ATOM 583 CD GLN A 35 -4.640 15.458 -2.794 1.00 0.00 C ATOM 584 OE1 GLN A 35 -3.727 16.126 -2.321 1.00 0.00 O ATOM 585 NE2 GLN A 35 -5.273 14.509 -2.103 1.00 0.00 N ATOM 0 H GLN A 35 -6.745 16.358 -1.783 1.00 0.00 H new ATOM 0 HA GLN A 35 -8.285 17.148 -4.151 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -6.260 17.154 -5.319 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -5.777 17.697 -3.724 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.519 14.801 -4.636 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.242 15.985 -4.835 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -6.027 13.978 -2.539 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.003 14.314 -1.139 1.00 0.00 H new ATOM 594 N ASP A 36 -8.257 14.158 -3.186 1.00 0.00 N ATOM 595 CA ASP A 36 -8.662 12.782 -3.394 1.00 0.00 C ATOM 596 C ASP A 36 -9.929 12.552 -2.576 1.00 0.00 C ATOM 597 O ASP A 36 -11.003 12.315 -3.128 1.00 0.00 O ATOM 598 CB ASP A 36 -7.503 11.845 -2.966 1.00 0.00 C ATOM 599 CG ASP A 36 -7.861 10.388 -3.231 1.00 0.00 C ATOM 600 OD1 ASP A 36 -8.645 9.840 -2.427 1.00 0.00 O ATOM 601 OD2 ASP A 36 -7.337 9.849 -4.228 1.00 0.00 O ATOM 0 H ASP A 36 -8.202 14.404 -2.198 1.00 0.00 H new ATOM 0 HA ASP A 36 -8.877 12.569 -4.441 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -6.597 12.107 -3.512 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.288 11.985 -1.907 1.00 0.00 H new ATOM 606 N LEU A 37 -9.803 12.665 -1.251 1.00 0.00 N ATOM 607 CA LEU A 37 -10.914 12.510 -0.324 1.00 0.00 C ATOM 608 C LEU A 37 -12.009 13.567 -0.551 1.00 0.00 C ATOM 609 O LEU A 37 -13.102 13.419 -0.005 1.00 0.00 O ATOM 610 CB LEU A 37 -10.427 12.511 1.123 1.00 0.00 C ATOM 611 CG LEU A 37 -9.661 11.252 1.622 1.00 0.00 C ATOM 612 CD1 LEU A 37 -8.265 11.167 1.004 1.00 0.00 C ATOM 613 CD2 LEU A 37 -9.553 11.316 3.135 1.00 0.00 C ATOM 0 H LEU A 37 -8.915 12.869 -0.792 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.367 11.539 -0.524 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.778 13.376 1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.292 12.657 1.769 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.211 10.362 1.318 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.757 10.276 1.374 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.350 11.112 -0.081 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.691 12.052 1.279 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -9.018 10.439 3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.012 12.217 3.423 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.552 11.338 3.570 1.00 0.00 H new ATOM 625 N SER A 38 -11.743 14.617 -1.347 1.00 0.00 N ATOM 626 CA SER A 38 -12.710 15.671 -1.661 1.00 0.00 C ATOM 627 C SER A 38 -13.053 16.462 -0.393 1.00 0.00 C ATOM 628 O SER A 38 -12.279 16.465 0.566 1.00 0.00 O ATOM 629 CB SER A 38 -13.921 15.023 -2.400 1.00 0.00 C ATOM 630 OG SER A 38 -13.436 14.374 -3.561 1.00 0.00 O ATOM 0 H SER A 38 -10.837 14.755 -1.794 1.00 0.00 H new ATOM 0 HA SER A 38 -12.301 16.416 -2.344 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.426 14.310 -1.749 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.654 15.784 -2.668 1.00 0.00 H new ATOM 0 HG SER A 38 -14.183 13.958 -4.040 1.00 0.00 H new ATOM 636 N GLU A 39 -14.191 17.160 -0.392 1.00 0.00 N ATOM 637 CA GLU A 39 -14.628 17.991 0.712 1.00 0.00 C ATOM 638 C GLU A 39 -14.771 17.220 2.027 1.00 0.00 C ATOM 639 O GLU A 39 -15.306 16.109 2.042 1.00 0.00 O ATOM 640 CB GLU A 39 -15.965 18.693 0.358 1.00 0.00 C ATOM 641 CG GLU A 39 -15.772 20.157 -0.073 1.00 0.00 C ATOM 642 CD GLU A 39 -15.057 20.373 -1.405 1.00 0.00 C ATOM 643 OE1 GLU A 39 -14.582 19.390 -2.017 1.00 0.00 O ATOM 644 OE2 GLU A 39 -14.965 21.553 -1.811 1.00 0.00 O ATOM 0 H GLU A 39 -14.841 17.158 -1.178 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.848 18.736 0.868 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -16.457 18.144 -0.445 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -16.629 18.658 1.222 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -16.752 20.631 -0.128 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -15.211 20.674 0.706 1.00 0.00 H new ATOM 651 N LYS A 40 -14.321 17.826 3.134 1.00 0.00 N ATOM 652 CA LYS A 40 -14.443 17.285 4.479 1.00 0.00 C ATOM 653 C LYS A 40 -14.535 18.484 5.417 1.00 0.00 C ATOM 654 O LYS A 40 -14.040 19.561 5.082 1.00 0.00 O ATOM 655 CB LYS A 40 -13.301 16.326 4.861 1.00 0.00 C ATOM 656 CG LYS A 40 -13.693 14.848 4.693 1.00 0.00 C ATOM 657 CD LYS A 40 -13.063 14.175 3.468 1.00 0.00 C ATOM 658 CE LYS A 40 -13.938 12.990 3.030 1.00 0.00 C ATOM 659 NZ LYS A 40 -14.938 13.408 2.030 1.00 0.00 N ATOM 0 H LYS A 40 -13.850 18.731 3.109 1.00 0.00 H new ATOM 0 HA LYS A 40 -15.334 16.662 4.550 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -12.429 16.540 4.243 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -13.010 16.506 5.896 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.399 14.300 5.588 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -14.778 14.776 4.617 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -12.969 14.893 2.653 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -12.057 13.830 3.706 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.308 12.204 2.613 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -14.443 12.566 3.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -15.758 12.770 2.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -15.245 14.381 2.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.517 13.368 1.080 1.00 0.00 H new ATOM 673 N VAL A 41 -15.192 18.324 6.573 1.00 0.00 N ATOM 674 CA VAL A 41 -15.414 19.411 7.495 1.00 0.00 C ATOM 675 C VAL A 41 -14.738 19.175 8.842 1.00 0.00 C ATOM 676 O VAL A 41 -14.616 18.024 9.269 1.00 0.00 O ATOM 677 CB VAL A 41 -16.923 19.657 7.592 1.00 0.00 C ATOM 678 CG1 VAL A 41 -17.594 19.515 6.214 1.00 0.00 C ATOM 679 CG2 VAL A 41 -17.596 18.775 8.645 1.00 0.00 C ATOM 0 H VAL A 41 -15.579 17.432 6.882 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.942 20.320 7.122 1.00 0.00 H new ATOM 0 HB VAL A 41 -17.058 20.685 7.927 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -18.665 19.694 6.310 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -17.165 20.242 5.524 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -17.428 18.508 5.830 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -18.664 18.991 8.671 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -17.444 17.726 8.392 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -17.160 18.979 9.623 1.00 0.00 H new ATOM 689 N VAL A 42 -14.313 20.259 9.509 1.00 0.00 N ATOM 690 CA VAL A 42 -13.685 20.185 10.820 1.00 0.00 C ATOM 691 C VAL A 42 -14.013 21.474 11.559 1.00 0.00 C ATOM 692 O VAL A 42 -14.363 22.476 10.942 1.00 0.00 O ATOM 693 CB VAL A 42 -12.155 19.970 10.746 1.00 0.00 C ATOM 694 CG1 VAL A 42 -11.749 18.801 9.848 1.00 0.00 C ATOM 695 CG2 VAL A 42 -11.394 21.214 10.272 1.00 0.00 C ATOM 0 H VAL A 42 -14.399 21.209 9.147 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.076 19.316 11.350 1.00 0.00 H new ATOM 0 HB VAL A 42 -11.879 19.745 11.776 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.663 18.707 9.842 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.191 17.880 10.228 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.103 18.982 8.833 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.326 20.998 10.242 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.736 21.492 9.275 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.578 22.038 10.962 1.00 0.00 H new ATOM 705 N TYR A 43 -13.908 21.453 12.884 1.00 0.00 N ATOM 706 CA TYR A 43 -14.216 22.578 13.723 1.00 0.00 C ATOM 707 C TYR A 43 -12.914 23.112 14.291 1.00 0.00 C ATOM 708 O TYR A 43 -11.942 22.360 14.393 1.00 0.00 O ATOM 709 CB TYR A 43 -15.184 22.098 14.802 1.00 0.00 C ATOM 710 CG TYR A 43 -16.354 21.262 14.195 1.00 0.00 C ATOM 711 CD1 TYR A 43 -16.167 19.909 13.807 1.00 0.00 C ATOM 712 CD2 TYR A 43 -17.642 21.805 13.974 1.00 0.00 C ATOM 713 CE1 TYR A 43 -17.199 19.147 13.247 1.00 0.00 C ATOM 714 CE2 TYR A 43 -18.676 21.039 13.413 1.00 0.00 C ATOM 715 CZ TYR A 43 -18.462 19.706 13.048 1.00 0.00 C ATOM 716 OH TYR A 43 -19.468 18.964 12.501 1.00 0.00 O ATOM 0 H TYR A 43 -13.599 20.631 13.403 1.00 0.00 H new ATOM 0 HA TYR A 43 -14.695 23.393 13.180 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -14.645 21.494 15.532 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -15.589 22.957 15.336 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.198 19.453 13.948 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -17.834 22.833 14.243 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -17.017 18.120 12.967 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -19.648 21.484 13.261 1.00 0.00 H new ATOM 0 HH TYR A 43 -20.279 19.510 12.436 1.00 0.00 H new ATOM 726 N ARG A 44 -12.873 24.394 14.649 1.00 0.00 N ATOM 727 CA ARG A 44 -11.662 24.973 15.208 1.00 0.00 C ATOM 728 C ARG A 44 -12.017 25.968 16.301 1.00 0.00 C ATOM 729 O ARG A 44 -13.096 26.539 16.276 1.00 0.00 O ATOM 730 CB ARG A 44 -10.890 25.683 14.095 1.00 0.00 C ATOM 731 CG ARG A 44 -10.060 24.769 13.207 1.00 0.00 C ATOM 732 CD ARG A 44 -8.858 24.194 13.952 1.00 0.00 C ATOM 733 NE ARG A 44 -8.128 23.299 13.064 1.00 0.00 N ATOM 734 CZ ARG A 44 -8.511 22.050 12.768 1.00 0.00 C ATOM 735 NH1 ARG A 44 -9.587 21.479 13.323 1.00 0.00 N ATOM 736 NH2 ARG A 44 -7.786 21.358 11.895 1.00 0.00 N ATOM 0 H ARG A 44 -13.656 25.042 14.562 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.047 24.183 15.639 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -11.599 26.226 13.470 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -10.230 26.424 14.546 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -10.684 23.954 12.840 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -9.715 25.324 12.335 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -8.207 24.999 14.292 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -9.189 23.655 14.840 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.268 23.647 12.639 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -10.149 21.998 13.998 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -9.845 20.525 13.071 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.961 21.780 11.469 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -8.055 20.405 11.651 1.00 0.00 H new ATOM 750 N ARG A 45 -11.106 26.199 17.248 1.00 0.00 N ATOM 751 CA ARG A 45 -11.251 27.141 18.338 1.00 0.00 C ATOM 752 C ARG A 45 -9.874 27.666 18.728 1.00 0.00 C ATOM 753 O ARG A 45 -8.856 27.053 18.411 1.00 0.00 O ATOM 754 CB ARG A 45 -12.029 26.540 19.514 1.00 0.00 C ATOM 755 CG ARG A 45 -11.455 25.231 20.061 1.00 0.00 C ATOM 756 CD ARG A 45 -12.325 24.678 21.205 1.00 0.00 C ATOM 757 NE ARG A 45 -12.484 23.222 21.090 1.00 0.00 N ATOM 758 CZ ARG A 45 -11.558 22.296 21.385 1.00 0.00 C ATOM 759 NH1 ARG A 45 -10.541 22.557 22.211 1.00 0.00 N ATOM 760 NH2 ARG A 45 -11.654 21.095 20.813 1.00 0.00 N ATOM 0 H ARG A 45 -10.212 25.709 17.269 1.00 0.00 H new ATOM 0 HA ARG A 45 -11.853 27.989 18.010 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -12.062 27.271 20.321 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -13.058 26.366 19.200 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -11.392 24.495 19.259 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -10.440 25.398 20.420 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -11.869 24.923 22.164 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -13.304 25.157 21.186 1.00 0.00 H new ATOM 0 HE ARG A 45 -13.385 22.882 20.754 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -10.453 23.480 22.636 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -9.852 21.833 22.417 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -12.419 20.897 20.168 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -10.963 20.374 21.021 1.00 0.00 H new ATOM 774 N PHE A 46 -9.850 28.813 19.405 1.00 0.00 N ATOM 775 CA PHE A 46 -8.642 29.493 19.832 1.00 0.00 C ATOM 776 C PHE A 46 -7.610 28.557 20.462 1.00 0.00 C ATOM 777 O PHE A 46 -6.497 28.433 19.952 1.00 0.00 O ATOM 778 CB PHE A 46 -9.033 30.676 20.734 1.00 0.00 C ATOM 779 CG PHE A 46 -9.945 30.356 21.910 1.00 0.00 C ATOM 780 CD1 PHE A 46 -11.344 30.337 21.742 1.00 0.00 C ATOM 781 CD2 PHE A 46 -9.393 30.078 23.177 1.00 0.00 C ATOM 782 CE1 PHE A 46 -12.182 30.036 22.829 1.00 0.00 C ATOM 783 CE2 PHE A 46 -10.234 29.777 24.262 1.00 0.00 C ATOM 784 CZ PHE A 46 -11.628 29.754 24.089 1.00 0.00 C ATOM 0 H PHE A 46 -10.701 29.305 19.677 1.00 0.00 H new ATOM 0 HA PHE A 46 -8.128 29.882 18.953 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -8.120 31.126 21.122 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -9.522 31.429 20.117 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -11.773 30.554 20.775 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -8.322 30.096 23.314 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.254 30.021 22.696 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -9.808 29.563 25.231 1.00 0.00 H new ATOM 0 HZ PHE A 46 -12.273 29.520 24.923 1.00 0.00 H new ATOM 794 N THR A 47 -7.980 27.899 21.560 1.00 0.00 N ATOM 795 CA THR A 47 -7.098 26.988 22.279 1.00 0.00 C ATOM 796 C THR A 47 -6.567 25.854 21.403 1.00 0.00 C ATOM 797 O THR A 47 -5.506 25.327 21.698 1.00 0.00 O ATOM 798 CB THR A 47 -7.766 26.479 23.569 1.00 0.00 C ATOM 799 OG1 THR A 47 -6.820 25.831 24.394 1.00 0.00 O ATOM 800 CG2 THR A 47 -8.944 25.539 23.296 1.00 0.00 C ATOM 0 H THR A 47 -8.907 27.985 21.976 1.00 0.00 H new ATOM 0 HA THR A 47 -6.216 27.559 22.570 1.00 0.00 H new ATOM 0 HB THR A 47 -8.162 27.357 24.080 1.00 0.00 H new ATOM 0 HG1 THR A 47 -6.545 24.988 23.977 1.00 0.00 H new ATOM 0 HG21 THR A 47 -9.375 25.212 24.242 1.00 0.00 H new ATOM 0 HG22 THR A 47 -9.701 26.064 22.714 1.00 0.00 H new ATOM 0 HG23 THR A 47 -8.595 24.671 22.737 1.00 0.00 H new ATOM 808 N GLU A 48 -7.268 25.479 20.331 1.00 0.00 N ATOM 809 CA GLU A 48 -6.844 24.422 19.440 1.00 0.00 C ATOM 810 C GLU A 48 -5.805 24.967 18.479 1.00 0.00 C ATOM 811 O GLU A 48 -4.788 24.317 18.262 1.00 0.00 O ATOM 812 CB GLU A 48 -8.025 23.867 18.658 1.00 0.00 C ATOM 813 CG GLU A 48 -8.905 22.933 19.488 1.00 0.00 C ATOM 814 CD GLU A 48 -8.231 21.636 19.930 1.00 0.00 C ATOM 815 OE1 GLU A 48 -7.218 21.264 19.301 1.00 0.00 O ATOM 816 OE2 GLU A 48 -8.765 21.030 20.888 1.00 0.00 O ATOM 0 H GLU A 48 -8.153 25.911 20.063 1.00 0.00 H new ATOM 0 HA GLU A 48 -6.416 23.613 20.032 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -8.630 24.695 18.289 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.655 23.329 17.785 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.244 23.469 20.374 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.793 22.684 18.908 1.00 0.00 H new ATOM 823 N ILE A 49 -6.044 26.160 17.915 1.00 0.00 N ATOM 824 CA ILE A 49 -5.041 26.760 17.037 1.00 0.00 C ATOM 825 C ILE A 49 -3.746 26.877 17.849 1.00 0.00 C ATOM 826 O ILE A 49 -2.666 26.545 17.360 1.00 0.00 O ATOM 827 CB ILE A 49 -5.497 28.110 16.432 1.00 0.00 C ATOM 828 CG1 ILE A 49 -6.387 27.890 15.194 1.00 0.00 C ATOM 829 CG2 ILE A 49 -4.274 28.942 16.015 1.00 0.00 C ATOM 830 CD1 ILE A 49 -7.844 27.622 15.563 1.00 0.00 C ATOM 0 H ILE A 49 -6.893 26.709 18.047 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.881 26.126 16.165 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.069 28.638 17.195 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -6.334 28.769 14.551 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.001 27.049 14.617 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.606 29.890 15.591 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.650 29.134 16.888 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.697 28.393 15.270 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -8.428 27.474 14.655 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.904 26.727 16.183 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.242 28.473 16.115 1.00 0.00 H new ATOM 842 N TYR A 50 -3.869 27.328 19.101 1.00 0.00 N ATOM 843 CA TYR A 50 -2.742 27.474 20.001 1.00 0.00 C ATOM 844 C TYR A 50 -2.123 26.129 20.323 1.00 0.00 C ATOM 845 O TYR A 50 -0.918 25.998 20.201 1.00 0.00 O ATOM 846 CB TYR A 50 -3.165 28.180 21.300 1.00 0.00 C ATOM 847 CG TYR A 50 -3.979 29.485 21.114 1.00 0.00 C ATOM 848 CD1 TYR A 50 -3.911 30.251 19.921 1.00 0.00 C ATOM 849 CD2 TYR A 50 -4.836 29.947 22.140 1.00 0.00 C ATOM 850 CE1 TYR A 50 -4.659 31.431 19.775 1.00 0.00 C ATOM 851 CE2 TYR A 50 -5.582 31.128 21.992 1.00 0.00 C ATOM 852 CZ TYR A 50 -5.493 31.873 20.807 1.00 0.00 C ATOM 853 OH TYR A 50 -6.222 33.015 20.651 1.00 0.00 O ATOM 0 H TYR A 50 -4.762 27.601 19.512 1.00 0.00 H new ATOM 0 HA TYR A 50 -1.996 28.087 19.495 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -3.757 27.485 21.895 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -2.269 28.410 21.877 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -3.274 29.922 19.113 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -4.918 29.380 23.056 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -4.590 32.001 18.860 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.225 31.463 22.792 1.00 0.00 H new ATOM 0 HH TYR A 50 -6.749 33.180 21.461 1.00 0.00 H new ATOM 863 N GLU A 51 -2.912 25.140 20.739 1.00 0.00 N ATOM 864 CA GLU A 51 -2.407 23.814 21.084 1.00 0.00 C ATOM 865 C GLU A 51 -1.653 23.195 19.903 1.00 0.00 C ATOM 866 O GLU A 51 -0.584 22.620 20.096 1.00 0.00 O ATOM 867 CB GLU A 51 -3.514 22.917 21.648 1.00 0.00 C ATOM 868 CG GLU A 51 -3.768 23.264 23.125 1.00 0.00 C ATOM 869 CD GLU A 51 -5.033 22.599 23.661 1.00 0.00 C ATOM 870 OE1 GLU A 51 -4.929 21.409 24.026 1.00 0.00 O ATOM 871 OE2 GLU A 51 -6.067 23.300 23.727 1.00 0.00 O ATOM 0 H GLU A 51 -3.922 25.237 20.846 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.681 23.917 21.890 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.430 23.049 21.072 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -3.227 21.869 21.556 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.913 22.950 23.723 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.853 24.345 23.234 1.00 0.00 H new ATOM 878 N PHE A 52 -2.180 23.341 18.685 1.00 0.00 N ATOM 879 CA PHE A 52 -1.524 22.842 17.476 1.00 0.00 C ATOM 880 C PHE A 52 -0.172 23.500 17.350 1.00 0.00 C ATOM 881 O PHE A 52 0.865 22.843 17.341 1.00 0.00 O ATOM 882 CB PHE A 52 -2.290 23.209 16.195 1.00 0.00 C ATOM 883 CG PHE A 52 -1.460 23.009 14.888 1.00 0.00 C ATOM 884 CD1 PHE A 52 -0.595 23.987 14.304 1.00 0.00 C ATOM 885 CD2 PHE A 52 -1.562 21.773 14.223 1.00 0.00 C ATOM 886 CE1 PHE A 52 0.087 23.711 13.104 1.00 0.00 C ATOM 887 CE2 PHE A 52 -0.883 21.508 13.028 1.00 0.00 C ATOM 888 CZ PHE A 52 -0.063 22.483 12.454 1.00 0.00 C ATOM 0 H PHE A 52 -3.070 23.807 18.510 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.470 21.758 17.573 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -3.194 22.603 16.137 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.607 24.250 16.258 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.464 24.944 14.787 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.186 21.002 14.650 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.737 24.461 12.678 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.993 20.547 12.548 1.00 0.00 H new ATOM 0 HZ PHE A 52 0.447 22.290 11.522 1.00 0.00 H new ATOM 898 N HIS A 53 -0.220 24.822 17.212 1.00 0.00 N ATOM 899 CA HIS A 53 0.958 25.617 17.004 1.00 0.00 C ATOM 900 C HIS A 53 2.002 25.376 18.078 1.00 0.00 C ATOM 901 O HIS A 53 3.193 25.269 17.799 1.00 0.00 O ATOM 902 CB HIS A 53 0.540 27.073 16.862 1.00 0.00 C ATOM 903 CG HIS A 53 1.601 27.827 16.139 1.00 0.00 C ATOM 904 ND1 HIS A 53 1.960 27.370 14.904 1.00 0.00 N ATOM 905 CD2 HIS A 53 2.386 28.930 16.369 1.00 0.00 C ATOM 906 CE1 HIS A 53 2.901 28.165 14.420 1.00 0.00 C ATOM 907 NE2 HIS A 53 3.220 29.149 15.268 1.00 0.00 N ATOM 0 H HIS A 53 -1.085 25.361 17.243 1.00 0.00 H new ATOM 0 HA HIS A 53 1.453 25.319 16.080 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -0.403 27.140 16.319 1.00 0.00 H new ATOM 0 HB3 HIS A 53 0.373 27.512 17.846 1.00 0.00 H new ATOM 0 HD2 HIS A 53 2.363 29.535 17.263 1.00 0.00 H new ATOM 0 HE1 HIS A 53 3.359 28.034 13.451 1.00 0.00 H new ATOM 0 HE2 HIS A 53 3.911 29.888 15.141 1.00 0.00 H new ATOM 915 N LYS A 54 1.516 25.255 19.305 1.00 0.00 N ATOM 916 CA LYS A 54 2.339 24.963 20.466 1.00 0.00 C ATOM 917 C LYS A 54 3.036 23.622 20.273 1.00 0.00 C ATOM 918 O LYS A 54 4.214 23.483 20.581 1.00 0.00 O ATOM 919 CB LYS A 54 1.502 24.906 21.750 1.00 0.00 C ATOM 920 CG LYS A 54 1.204 26.275 22.375 1.00 0.00 C ATOM 921 CD LYS A 54 -0.003 26.227 23.329 1.00 0.00 C ATOM 922 CE LYS A 54 0.063 25.104 24.375 1.00 0.00 C ATOM 923 NZ LYS A 54 -1.194 25.006 25.143 1.00 0.00 N ATOM 0 H LYS A 54 0.525 25.359 19.523 1.00 0.00 H new ATOM 0 HA LYS A 54 3.071 25.764 20.565 1.00 0.00 H new ATOM 0 HB2 LYS A 54 0.558 24.407 21.532 1.00 0.00 H new ATOM 0 HB3 LYS A 54 2.025 24.292 22.483 1.00 0.00 H new ATOM 0 HG2 LYS A 54 2.082 26.623 22.919 1.00 0.00 H new ATOM 0 HG3 LYS A 54 1.011 27.000 21.584 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -0.082 27.184 23.845 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -0.912 26.106 22.740 1.00 0.00 H new ATOM 0 HE2 LYS A 54 0.262 24.154 23.879 1.00 0.00 H new ATOM 0 HE3 LYS A 54 0.894 25.288 25.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.116 24.238 25.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -1.371 25.905 25.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -1.982 24.806 24.495 1.00 0.00 H new ATOM 937 N THR A 55 2.300 22.635 19.766 1.00 0.00 N ATOM 938 CA THR A 55 2.846 21.301 19.564 1.00 0.00 C ATOM 939 C THR A 55 3.887 21.347 18.471 1.00 0.00 C ATOM 940 O THR A 55 4.939 20.736 18.605 1.00 0.00 O ATOM 941 CB THR A 55 1.723 20.287 19.319 1.00 0.00 C ATOM 942 OG1 THR A 55 0.860 20.263 20.436 1.00 0.00 O ATOM 943 CG2 THR A 55 2.243 18.875 19.087 1.00 0.00 C ATOM 0 H THR A 55 1.324 22.737 19.488 1.00 0.00 H new ATOM 0 HA THR A 55 3.352 20.956 20.465 1.00 0.00 H new ATOM 0 HB THR A 55 1.200 20.606 18.417 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.280 21.052 20.418 1.00 0.00 H new ATOM 0 HG21 THR A 55 1.403 18.201 18.919 1.00 0.00 H new ATOM 0 HG22 THR A 55 2.895 18.866 18.214 1.00 0.00 H new ATOM 0 HG23 THR A 55 2.804 18.545 19.962 1.00 0.00 H new ATOM 951 N LEU A 56 3.622 22.097 17.409 1.00 0.00 N ATOM 952 CA LEU A 56 4.591 22.243 16.347 1.00 0.00 C ATOM 953 C LEU A 56 5.872 22.804 16.936 1.00 0.00 C ATOM 954 O LEU A 56 6.942 22.258 16.711 1.00 0.00 O ATOM 955 CB LEU A 56 4.039 23.149 15.240 1.00 0.00 C ATOM 956 CG LEU A 56 4.769 23.175 13.895 1.00 0.00 C ATOM 957 CD1 LEU A 56 6.127 23.850 14.009 1.00 0.00 C ATOM 958 CD2 LEU A 56 4.955 21.836 13.156 1.00 0.00 C ATOM 0 H LEU A 56 2.750 22.607 17.267 1.00 0.00 H new ATOM 0 HA LEU A 56 4.801 21.274 15.895 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.006 22.854 15.053 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.015 24.168 15.625 1.00 0.00 H new ATOM 0 HG LEU A 56 4.074 23.748 13.281 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.616 23.850 13.035 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.995 24.877 14.349 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.744 23.307 14.725 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.487 22.008 12.220 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.530 21.153 13.781 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.979 21.399 12.943 1.00 0.00 H new ATOM 970 N LYS A 57 5.757 23.883 17.704 1.00 0.00 N ATOM 971 CA LYS A 57 6.916 24.509 18.310 1.00 0.00 C ATOM 972 C LYS A 57 7.633 23.616 19.322 1.00 0.00 C ATOM 973 O LYS A 57 8.832 23.778 19.532 1.00 0.00 O ATOM 974 CB LYS A 57 6.483 25.805 19.007 1.00 0.00 C ATOM 975 CG LYS A 57 5.889 26.889 18.090 1.00 0.00 C ATOM 976 CD LYS A 57 5.045 27.919 18.856 1.00 0.00 C ATOM 977 CE LYS A 57 5.812 28.680 19.951 1.00 0.00 C ATOM 978 NZ LYS A 57 5.958 27.908 21.202 1.00 0.00 N ATOM 0 H LYS A 57 4.870 24.339 17.919 1.00 0.00 H new ATOM 0 HA LYS A 57 7.623 24.706 17.504 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.746 25.557 19.770 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.347 26.225 19.523 1.00 0.00 H new ATOM 0 HG2 LYS A 57 6.698 27.403 17.571 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.271 26.415 17.327 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.640 28.640 18.145 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.196 27.409 19.311 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.801 28.943 19.577 1.00 0.00 H new ATOM 0 HE3 LYS A 57 5.294 29.614 20.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.842 28.543 22.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.232 27.164 21.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.902 27.473 21.233 1.00 0.00 H new ATOM 992 N GLU A 58 6.908 22.696 19.959 1.00 0.00 N ATOM 993 CA GLU A 58 7.461 21.807 20.961 1.00 0.00 C ATOM 994 C GLU A 58 8.218 20.688 20.266 1.00 0.00 C ATOM 995 O GLU A 58 9.396 20.475 20.548 1.00 0.00 O ATOM 996 CB GLU A 58 6.348 21.260 21.884 1.00 0.00 C ATOM 997 CG GLU A 58 5.913 22.407 22.851 1.00 0.00 C ATOM 998 CD GLU A 58 6.915 22.567 23.989 1.00 0.00 C ATOM 999 OE1 GLU A 58 7.105 21.572 24.720 1.00 0.00 O ATOM 1000 OE2 GLU A 58 7.471 23.681 24.106 1.00 0.00 O ATOM 0 H GLU A 58 5.913 22.552 19.787 1.00 0.00 H new ATOM 0 HA GLU A 58 8.156 22.356 21.596 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.498 20.917 21.294 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.710 20.402 22.450 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.831 23.343 22.298 1.00 0.00 H new ATOM 0 HG3 GLU A 58 4.925 22.190 23.258 1.00 0.00 H new ATOM 1007 N MET A 59 7.549 19.979 19.349 1.00 0.00 N ATOM 1008 CA MET A 59 8.189 18.910 18.618 1.00 0.00 C ATOM 1009 C MET A 59 9.352 19.476 17.808 1.00 0.00 C ATOM 1010 O MET A 59 10.467 18.965 17.887 1.00 0.00 O ATOM 1011 CB MET A 59 7.202 18.215 17.682 1.00 0.00 C ATOM 1012 CG MET A 59 5.902 17.630 18.264 1.00 0.00 C ATOM 1013 SD MET A 59 4.782 16.917 17.021 1.00 0.00 S ATOM 1014 CE MET A 59 4.485 18.348 15.947 1.00 0.00 C ATOM 0 H MET A 59 6.571 20.135 19.106 1.00 0.00 H new ATOM 0 HA MET A 59 8.556 18.174 19.333 1.00 0.00 H new ATOM 0 HB2 MET A 59 6.923 18.931 16.909 1.00 0.00 H new ATOM 0 HB3 MET A 59 7.735 17.403 17.187 1.00 0.00 H new ATOM 0 HG2 MET A 59 6.157 16.859 18.991 1.00 0.00 H new ATOM 0 HG3 MET A 59 5.374 18.415 18.805 1.00 0.00 H new ATOM 0 HE1 MET A 59 3.772 18.077 15.168 1.00 0.00 H new ATOM 0 HE2 MET A 59 4.081 19.169 16.539 1.00 0.00 H new ATOM 0 HE3 MET A 59 5.423 18.659 15.488 1.00 0.00 H new ATOM 1024 N PHE A 60 9.086 20.533 17.034 1.00 0.00 N ATOM 1025 CA PHE A 60 10.063 21.201 16.217 1.00 0.00 C ATOM 1026 C PHE A 60 10.541 22.494 16.925 1.00 0.00 C ATOM 1027 O PHE A 60 9.916 23.535 16.714 1.00 0.00 O ATOM 1028 CB PHE A 60 9.416 21.580 14.887 1.00 0.00 C ATOM 1029 CG PHE A 60 8.822 20.422 14.021 1.00 0.00 C ATOM 1030 CD1 PHE A 60 9.628 19.757 13.065 1.00 0.00 C ATOM 1031 CD2 PHE A 60 7.474 19.979 14.134 1.00 0.00 C ATOM 1032 CE1 PHE A 60 9.131 18.721 12.256 1.00 0.00 C ATOM 1033 CE2 PHE A 60 6.979 18.942 13.317 1.00 0.00 C ATOM 1034 CZ PHE A 60 7.802 18.313 12.378 1.00 0.00 C ATOM 0 H PHE A 60 8.156 20.946 16.968 1.00 0.00 H new ATOM 0 HA PHE A 60 10.914 20.539 16.052 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.616 22.292 15.092 1.00 0.00 H new ATOM 0 HB3 PHE A 60 10.161 22.102 14.286 1.00 0.00 H new ATOM 0 HD1 PHE A 60 10.660 20.056 12.954 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.820 20.444 14.857 1.00 0.00 H new ATOM 0 HE1 PHE A 60 9.779 18.240 11.538 1.00 0.00 H new ATOM 0 HE2 PHE A 60 5.950 18.629 13.418 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.414 17.521 11.755 1.00 0.00 H new ATOM 1044 N PRO A 61 11.617 22.538 17.737 1.00 0.00 N ATOM 1045 CA PRO A 61 12.031 23.798 18.346 1.00 0.00 C ATOM 1046 C PRO A 61 12.679 24.700 17.293 1.00 0.00 C ATOM 1047 O PRO A 61 12.760 25.910 17.472 1.00 0.00 O ATOM 1048 CB PRO A 61 12.972 23.427 19.488 1.00 0.00 C ATOM 1049 CG PRO A 61 13.617 22.137 18.997 1.00 0.00 C ATOM 1050 CD PRO A 61 12.540 21.482 18.126 1.00 0.00 C ATOM 0 HA PRO A 61 11.192 24.371 18.741 1.00 0.00 H new ATOM 0 HB2 PRO A 61 13.713 24.205 19.669 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.432 23.278 20.423 1.00 0.00 H new ATOM 0 HG2 PRO A 61 14.523 22.338 18.425 1.00 0.00 H new ATOM 0 HG3 PRO A 61 13.902 21.493 19.829 1.00 0.00 H new ATOM 0 HD2 PRO A 61 12.985 21.014 17.248 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.021 20.698 18.677 1.00 0.00 H new ATOM 1058 N ILE A 62 13.113 24.108 16.178 1.00 0.00 N ATOM 1059 CA ILE A 62 13.709 24.777 15.041 1.00 0.00 C ATOM 1060 C ILE A 62 12.638 25.591 14.339 1.00 0.00 C ATOM 1061 O ILE A 62 12.863 26.747 13.991 1.00 0.00 O ATOM 1062 CB ILE A 62 14.277 23.739 14.075 1.00 0.00 C ATOM 1063 CG1 ILE A 62 15.258 22.738 14.714 1.00 0.00 C ATOM 1064 CG2 ILE A 62 14.847 24.392 12.828 1.00 0.00 C ATOM 1065 CD1 ILE A 62 16.432 23.403 15.441 1.00 0.00 C ATOM 0 H ILE A 62 13.051 23.098 16.047 1.00 0.00 H new ATOM 0 HA ILE A 62 14.514 25.431 15.375 1.00 0.00 H new ATOM 0 HB ILE A 62 13.426 23.128 13.774 1.00 0.00 H new ATOM 0 HG12 ILE A 62 14.714 22.110 15.420 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.649 22.080 13.938 1.00 0.00 H new ATOM 0 HG21 ILE A 62 15.242 23.624 12.163 1.00 0.00 H new ATOM 0 HG22 ILE A 62 14.060 24.946 12.315 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.648 25.076 13.109 1.00 0.00 H new ATOM 0 HD11 ILE A 62 17.079 22.635 15.865 1.00 0.00 H new ATOM 0 HD12 ILE A 62 17.001 24.008 14.735 1.00 0.00 H new ATOM 0 HD13 ILE A 62 16.052 24.039 16.240 1.00 0.00 H new ATOM 1077 N GLU A 63 11.456 24.998 14.147 1.00 0.00 N ATOM 1078 CA GLU A 63 10.370 25.734 13.524 1.00 0.00 C ATOM 1079 C GLU A 63 9.955 26.905 14.425 1.00 0.00 C ATOM 1080 O GLU A 63 9.192 27.777 14.014 1.00 0.00 O ATOM 1081 CB GLU A 63 9.202 24.796 13.210 1.00 0.00 C ATOM 1082 CG GLU A 63 8.667 25.039 11.799 1.00 0.00 C ATOM 1083 CD GLU A 63 7.954 26.378 11.664 1.00 0.00 C ATOM 1084 OE1 GLU A 63 6.821 26.468 12.184 1.00 0.00 O ATOM 1085 OE2 GLU A 63 8.496 27.258 10.967 1.00 0.00 O ATOM 0 H GLU A 63 11.237 24.037 14.408 1.00 0.00 H new ATOM 0 HA GLU A 63 10.705 26.152 12.574 1.00 0.00 H new ATOM 0 HB2 GLU A 63 9.527 23.760 13.306 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.404 24.948 13.936 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.493 24.999 11.089 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.979 24.237 11.533 1.00 0.00 H new ATOM 1092 N ALA A 64 10.479 26.930 15.659 1.00 0.00 N ATOM 1093 CA ALA A 64 10.231 27.956 16.639 1.00 0.00 C ATOM 1094 C ALA A 64 11.529 28.553 17.135 1.00 0.00 C ATOM 1095 O ALA A 64 11.629 28.960 18.292 1.00 0.00 O ATOM 1096 CB ALA A 64 9.430 27.352 17.784 1.00 0.00 C ATOM 0 H ALA A 64 11.108 26.202 15.998 1.00 0.00 H new ATOM 0 HA ALA A 64 9.659 28.766 16.186 1.00 0.00 H new ATOM 0 HB1 ALA A 64 9.234 28.118 18.535 1.00 0.00 H new ATOM 0 HB2 ALA A 64 8.484 26.967 17.403 1.00 0.00 H new ATOM 0 HB3 ALA A 64 9.997 26.538 18.235 1.00 0.00 H new ATOM 1102 N GLY A 65 12.523 28.605 16.251 1.00 0.00 N ATOM 1103 CA GLY A 65 13.807 29.137 16.619 1.00 0.00 C ATOM 1104 C GLY A 65 14.633 29.503 15.415 1.00 0.00 C ATOM 1105 O GLY A 65 15.101 30.635 15.324 1.00 0.00 O ATOM 0 H GLY A 65 12.453 28.285 15.285 1.00 0.00 H new ATOM 0 HA2 GLY A 65 13.668 30.019 17.245 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.345 28.403 17.218 1.00 0.00 H new ATOM 1109 N ALA A 66 14.797 28.558 14.487 1.00 0.00 N ATOM 1110 CA ALA A 66 15.532 28.835 13.274 1.00 0.00 C ATOM 1111 C ALA A 66 14.598 29.403 12.228 1.00 0.00 C ATOM 1112 O ALA A 66 15.052 29.997 11.258 1.00 0.00 O ATOM 1113 CB ALA A 66 16.286 27.616 12.755 1.00 0.00 C ATOM 0 H ALA A 66 14.432 27.608 14.560 1.00 0.00 H new ATOM 0 HA ALA A 66 16.294 29.579 13.506 1.00 0.00 H new ATOM 0 HB1 ALA A 66 16.821 27.880 11.843 1.00 0.00 H new ATOM 0 HB2 ALA A 66 16.998 27.281 13.509 1.00 0.00 H new ATOM 0 HB3 ALA A 66 15.579 26.814 12.542 1.00 0.00 H new ATOM 1119 N ILE A 67 13.294 29.220 12.441 1.00 0.00 N ATOM 1120 CA ILE A 67 12.288 29.732 11.519 1.00 0.00 C ATOM 1121 C ILE A 67 11.450 30.816 12.189 1.00 0.00 C ATOM 1122 O ILE A 67 10.486 31.311 11.618 1.00 0.00 O ATOM 1123 CB ILE A 67 11.494 28.549 10.940 1.00 0.00 C ATOM 1124 CG1 ILE A 67 12.510 27.474 10.478 1.00 0.00 C ATOM 1125 CG2 ILE A 67 10.632 28.999 9.750 1.00 0.00 C ATOM 1126 CD1 ILE A 67 11.970 26.383 9.554 1.00 0.00 C ATOM 0 H ILE A 67 12.913 28.721 13.245 1.00 0.00 H new ATOM 0 HA ILE A 67 12.748 30.234 10.668 1.00 0.00 H new ATOM 0 HB ILE A 67 10.826 28.146 11.701 1.00 0.00 H new ATOM 0 HG12 ILE A 67 13.332 27.977 9.969 1.00 0.00 H new ATOM 0 HG13 ILE A 67 12.928 26.996 11.364 1.00 0.00 H new ATOM 0 HG21 ILE A 67 10.080 28.145 9.357 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.930 29.765 10.078 1.00 0.00 H new ATOM 0 HG23 ILE A 67 11.274 29.406 8.969 1.00 0.00 H new ATOM 0 HD11 ILE A 67 12.773 25.691 9.300 1.00 0.00 H new ATOM 0 HD12 ILE A 67 11.170 25.841 10.059 1.00 0.00 H new ATOM 0 HD13 ILE A 67 11.581 26.838 8.643 1.00 0.00 H new ATOM 1138 N ASN A 68 11.836 31.234 13.393 1.00 0.00 N ATOM 1139 CA ASN A 68 11.104 32.269 14.107 1.00 0.00 C ATOM 1140 C ASN A 68 11.534 33.710 13.827 1.00 0.00 C ATOM 1141 O ASN A 68 10.641 34.530 13.638 1.00 0.00 O ATOM 1142 CB ASN A 68 11.027 31.960 15.608 1.00 0.00 C ATOM 1143 CG ASN A 68 9.572 31.829 16.044 1.00 0.00 C ATOM 1144 OD1 ASN A 68 9.120 32.552 16.930 1.00 0.00 O ATOM 1145 ND2 ASN A 68 8.834 30.932 15.386 1.00 0.00 N ATOM 0 H ASN A 68 12.649 30.871 13.890 1.00 0.00 H new ATOM 0 HA ASN A 68 10.098 32.229 13.690 1.00 0.00 H new ATOM 0 HB2 ASN A 68 11.564 31.036 15.825 1.00 0.00 H new ATOM 0 HB3 ASN A 68 11.514 32.753 16.176 1.00 0.00 H new ATOM 0 HD21 ASN A 68 7.845 30.822 15.610 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.259 30.357 14.659 1.00 0.00 H new ATOM 1152 N PRO A 69 12.821 34.083 13.810 1.00 0.00 N ATOM 1153 CA PRO A 69 13.244 35.452 13.581 1.00 0.00 C ATOM 1154 C PRO A 69 13.400 35.862 12.125 1.00 0.00 C ATOM 1155 O PRO A 69 12.833 36.864 11.692 1.00 0.00 O ATOM 1156 CB PRO A 69 14.552 35.576 14.360 1.00 0.00 C ATOM 1157 CG PRO A 69 15.166 34.175 14.246 1.00 0.00 C ATOM 1158 CD PRO A 69 13.961 33.238 14.084 1.00 0.00 C ATOM 0 HA PRO A 69 12.469 36.140 13.917 1.00 0.00 H new ATOM 0 HB2 PRO A 69 15.204 36.337 13.932 1.00 0.00 H new ATOM 0 HB3 PRO A 69 14.376 35.855 15.399 1.00 0.00 H new ATOM 0 HG2 PRO A 69 15.840 34.106 13.392 1.00 0.00 H new ATOM 0 HG3 PRO A 69 15.748 33.923 15.133 1.00 0.00 H new ATOM 0 HD2 PRO A 69 14.125 32.531 13.270 1.00 0.00 H new ATOM 0 HD3 PRO A 69 13.801 32.651 14.988 1.00 0.00 H new ATOM 1166 N GLU A 70 14.180 35.099 11.373 1.00 0.00 N ATOM 1167 CA GLU A 70 14.444 35.384 9.973 1.00 0.00 C ATOM 1168 C GLU A 70 13.173 35.241 9.152 1.00 0.00 C ATOM 1169 O GLU A 70 12.965 35.977 8.190 1.00 0.00 O ATOM 1170 CB GLU A 70 15.557 34.417 9.471 1.00 0.00 C ATOM 1171 CG GLU A 70 15.216 32.910 9.696 1.00 0.00 C ATOM 1172 CD GLU A 70 16.513 32.118 9.768 1.00 0.00 C ATOM 1173 OE1 GLU A 70 17.166 32.214 10.830 1.00 0.00 O ATOM 1174 OE2 GLU A 70 16.845 31.463 8.757 1.00 0.00 O ATOM 0 H GLU A 70 14.649 34.262 11.720 1.00 0.00 H new ATOM 0 HA GLU A 70 14.786 36.412 9.859 1.00 0.00 H new ATOM 0 HB2 GLU A 70 15.725 34.589 8.408 1.00 0.00 H new ATOM 0 HB3 GLU A 70 16.490 34.651 9.983 1.00 0.00 H new ATOM 0 HG2 GLU A 70 14.646 32.786 10.617 1.00 0.00 H new ATOM 0 HG3 GLU A 70 14.592 32.539 8.883 1.00 0.00 H new ATOM 1181 N ASN A 71 12.328 34.298 9.562 1.00 0.00 N ATOM 1182 CA ASN A 71 11.058 34.022 8.923 1.00 0.00 C ATOM 1183 C ASN A 71 9.909 34.352 9.872 1.00 0.00 C ATOM 1184 O ASN A 71 8.931 33.610 9.934 1.00 0.00 O ATOM 1185 CB ASN A 71 11.054 32.541 8.498 1.00 0.00 C ATOM 1186 CG ASN A 71 10.076 32.279 7.363 1.00 0.00 C ATOM 1187 OD1 ASN A 71 10.174 32.870 6.291 1.00 0.00 O ATOM 1188 ND2 ASN A 71 9.131 31.376 7.598 1.00 0.00 N ATOM 0 H ASN A 71 12.517 33.697 10.364 1.00 0.00 H new ATOM 0 HA ASN A 71 10.921 34.645 8.039 1.00 0.00 H new ATOM 0 HB2 ASN A 71 12.057 32.250 8.187 1.00 0.00 H new ATOM 0 HB3 ASN A 71 10.792 31.919 9.354 1.00 0.00 H new ATOM 0 HD21 ASN A 71 8.450 31.150 6.873 1.00 0.00 H new ATOM 0 HD22 ASN A 71 9.086 30.909 8.503 1.00 0.00 H new ATOM 1195 N ARG A 72 10.019 35.479 10.592 1.00 0.00 N ATOM 1196 CA ARG A 72 8.986 35.960 11.517 1.00 0.00 C ATOM 1197 C ARG A 72 7.702 36.444 10.819 1.00 0.00 C ATOM 1198 O ARG A 72 7.321 37.606 10.945 1.00 0.00 O ATOM 1199 CB ARG A 72 9.560 37.044 12.450 1.00 0.00 C ATOM 1200 CG ARG A 72 8.763 37.137 13.759 1.00 0.00 C ATOM 1201 CD ARG A 72 9.610 37.764 14.874 1.00 0.00 C ATOM 1202 NE ARG A 72 9.058 37.480 16.208 1.00 0.00 N ATOM 1203 CZ ARG A 72 9.107 36.283 16.822 1.00 0.00 C ATOM 1204 NH1 ARG A 72 9.657 35.221 16.221 1.00 0.00 N ATOM 1205 NH2 ARG A 72 8.581 36.141 18.046 1.00 0.00 N ATOM 0 H ARG A 72 10.837 36.087 10.547 1.00 0.00 H new ATOM 0 HA ARG A 72 8.684 35.099 12.114 1.00 0.00 H new ATOM 0 HB2 ARG A 72 10.603 36.819 12.673 1.00 0.00 H new ATOM 0 HB3 ARG A 72 9.543 38.009 11.943 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.865 37.734 13.601 1.00 0.00 H new ATOM 0 HG3 ARG A 72 8.436 36.142 14.061 1.00 0.00 H new ATOM 0 HD2 ARG A 72 10.629 37.382 14.814 1.00 0.00 H new ATOM 0 HD3 ARG A 72 9.664 38.842 14.726 1.00 0.00 H new ATOM 0 HE ARG A 72 8.605 38.247 16.704 1.00 0.00 H new ATOM 0 HH11 ARG A 72 10.048 35.311 15.283 1.00 0.00 H new ATOM 0 HH12 ARG A 72 9.686 34.321 16.701 1.00 0.00 H new ATOM 0 HH21 ARG A 72 8.145 36.938 18.509 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.616 35.236 18.514 1.00 0.00 H new ATOM 1219 N ILE A 73 7.016 35.537 10.113 1.00 0.00 N ATOM 1220 CA ILE A 73 5.746 35.754 9.438 1.00 0.00 C ATOM 1221 C ILE A 73 4.891 34.542 9.833 1.00 0.00 C ATOM 1222 O ILE A 73 4.287 33.872 8.999 1.00 0.00 O ATOM 1223 CB ILE A 73 5.897 35.950 7.910 1.00 0.00 C ATOM 1224 CG1 ILE A 73 6.958 36.997 7.507 1.00 0.00 C ATOM 1225 CG2 ILE A 73 4.555 36.440 7.333 1.00 0.00 C ATOM 1226 CD1 ILE A 73 8.367 36.425 7.330 1.00 0.00 C ATOM 0 H ILE A 73 7.357 34.583 9.996 1.00 0.00 H new ATOM 0 HA ILE A 73 5.271 36.686 9.743 1.00 0.00 H new ATOM 0 HB ILE A 73 6.210 34.982 7.519 1.00 0.00 H new ATOM 0 HG12 ILE A 73 6.650 37.470 6.574 1.00 0.00 H new ATOM 0 HG13 ILE A 73 6.988 37.779 8.266 1.00 0.00 H new ATOM 0 HG21 ILE A 73 4.652 36.581 6.256 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.781 35.700 7.534 1.00 0.00 H new ATOM 0 HG23 ILE A 73 4.282 37.386 7.800 1.00 0.00 H new ATOM 0 HD11 ILE A 73 9.051 37.225 7.047 1.00 0.00 H new ATOM 0 HD12 ILE A 73 8.699 35.978 8.267 1.00 0.00 H new ATOM 0 HD13 ILE A 73 8.355 35.664 6.549 1.00 0.00 H new ATOM 1238 N ILE A 74 4.871 34.266 11.143 1.00 0.00 N ATOM 1239 CA ILE A 74 4.141 33.185 11.786 1.00 0.00 C ATOM 1240 C ILE A 74 3.273 33.882 12.843 1.00 0.00 C ATOM 1241 O ILE A 74 3.799 34.717 13.580 1.00 0.00 O ATOM 1242 CB ILE A 74 5.130 32.196 12.434 1.00 0.00 C ATOM 1243 CG1 ILE A 74 6.153 31.592 11.450 1.00 0.00 C ATOM 1244 CG2 ILE A 74 4.325 31.069 13.099 1.00 0.00 C ATOM 1245 CD1 ILE A 74 7.417 31.090 12.168 1.00 0.00 C ATOM 0 H ILE A 74 5.396 34.827 11.814 1.00 0.00 H new ATOM 0 HA ILE A 74 3.537 32.604 11.089 1.00 0.00 H new ATOM 0 HB ILE A 74 5.715 32.759 13.162 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.691 30.766 10.909 1.00 0.00 H new ATOM 0 HG13 ILE A 74 6.431 32.342 10.710 1.00 0.00 H new ATOM 0 HG21 ILE A 74 5.009 30.359 13.563 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.668 31.491 13.860 1.00 0.00 H new ATOM 0 HG23 ILE A 74 3.726 30.557 12.346 1.00 0.00 H new ATOM 0 HD11 ILE A 74 8.109 30.673 11.437 1.00 0.00 H new ATOM 0 HD12 ILE A 74 7.895 31.921 12.687 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.144 30.320 12.890 1.00 0.00 H new ATOM 1257 N PRO A 75 1.963 33.593 12.943 1.00 0.00 N ATOM 1258 CA PRO A 75 1.078 34.259 13.881 1.00 0.00 C ATOM 1259 C PRO A 75 1.172 33.656 15.288 1.00 0.00 C ATOM 1260 O PRO A 75 0.180 33.211 15.865 1.00 0.00 O ATOM 1261 CB PRO A 75 -0.315 34.100 13.284 1.00 0.00 C ATOM 1262 CG PRO A 75 -0.219 32.700 12.697 1.00 0.00 C ATOM 1263 CD PRO A 75 1.207 32.647 12.149 1.00 0.00 C ATOM 0 HA PRO A 75 1.345 35.308 14.013 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.098 34.179 14.038 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -0.527 34.852 12.524 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -0.388 31.934 13.454 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.958 32.541 11.912 1.00 0.00 H new ATOM 0 HD2 PRO A 75 1.623 31.643 12.234 1.00 0.00 H new ATOM 0 HD3 PRO A 75 1.231 32.914 11.092 1.00 0.00 H new ATOM 1271 N HIS A 76 2.382 33.643 15.841 1.00 0.00 N ATOM 1272 CA HIS A 76 2.681 33.110 17.165 1.00 0.00 C ATOM 1273 C HIS A 76 2.319 34.140 18.241 1.00 0.00 C ATOM 1274 O HIS A 76 3.196 34.655 18.934 1.00 0.00 O ATOM 1275 CB HIS A 76 4.153 32.662 17.221 1.00 0.00 C ATOM 1276 CG HIS A 76 5.112 33.628 16.573 1.00 0.00 C ATOM 1277 ND1 HIS A 76 5.032 34.999 16.748 1.00 0.00 N ATOM 1278 CD2 HIS A 76 6.178 33.431 15.731 1.00 0.00 C ATOM 1279 CE1 HIS A 76 6.017 35.553 16.025 1.00 0.00 C ATOM 1280 NE2 HIS A 76 6.755 34.647 15.380 1.00 0.00 N ATOM 0 H HIS A 76 3.205 34.014 15.366 1.00 0.00 H new ATOM 0 HA HIS A 76 2.073 32.228 17.365 1.00 0.00 H new ATOM 0 HB2 HIS A 76 4.441 32.524 18.263 1.00 0.00 H new ATOM 0 HB3 HIS A 76 4.246 31.692 16.733 1.00 0.00 H new ATOM 0 HD1 HIS A 76 4.350 35.496 17.321 1.00 0.00 H new ATOM 0 HD2 HIS A 76 6.521 32.466 15.389 1.00 0.00 H new ATOM 0 HE1 HIS A 76 6.194 36.617 15.971 1.00 0.00 H new ATOM 1288 N LEU A 77 1.022 34.440 18.372 1.00 0.00 N ATOM 1289 CA LEU A 77 0.489 35.388 19.345 1.00 0.00 C ATOM 1290 C LEU A 77 -0.057 34.613 20.552 1.00 0.00 C ATOM 1291 O LEU A 77 -0.492 33.473 20.394 1.00 0.00 O ATOM 1292 CB LEU A 77 -0.607 36.246 18.691 1.00 0.00 C ATOM 1293 CG LEU A 77 -0.046 37.474 17.950 1.00 0.00 C ATOM 1294 CD1 LEU A 77 0.845 37.100 16.758 1.00 0.00 C ATOM 1295 CD2 LEU A 77 -1.204 38.343 17.446 1.00 0.00 C ATOM 0 H LEU A 77 0.300 34.018 17.788 1.00 0.00 H new ATOM 0 HA LEU A 77 1.278 36.057 19.688 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.172 35.632 17.990 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.306 36.579 19.458 1.00 0.00 H new ATOM 0 HG LEU A 77 0.571 38.017 18.665 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.209 38.008 16.277 1.00 0.00 H new ATOM 0 HD12 LEU A 77 1.692 36.510 17.108 1.00 0.00 H new ATOM 0 HD13 LEU A 77 0.267 36.517 16.041 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.806 39.212 16.922 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.825 37.762 16.765 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.805 38.674 18.293 1.00 0.00 H new ATOM 1307 N PRO A 78 -0.042 35.205 21.760 1.00 0.00 N ATOM 1308 CA PRO A 78 -0.530 34.570 22.977 1.00 0.00 C ATOM 1309 C PRO A 78 -2.063 34.519 22.990 1.00 0.00 C ATOM 1310 O PRO A 78 -2.713 34.989 22.058 1.00 0.00 O ATOM 1311 CB PRO A 78 0.013 35.438 24.117 1.00 0.00 C ATOM 1312 CG PRO A 78 0.038 36.832 23.492 1.00 0.00 C ATOM 1313 CD PRO A 78 0.454 36.542 22.050 1.00 0.00 C ATOM 0 HA PRO A 78 -0.199 33.535 23.066 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.629 35.400 24.997 1.00 0.00 H new ATOM 0 HB3 PRO A 78 1.006 35.118 24.433 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.937 37.317 23.543 1.00 0.00 H new ATOM 0 HG3 PRO A 78 0.748 37.489 23.995 1.00 0.00 H new ATOM 0 HD2 PRO A 78 0.029 37.275 21.365 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.537 36.591 21.937 1.00 0.00 H new ATOM 1321 N ALA A 79 -2.640 33.951 24.056 1.00 0.00 N ATOM 1322 CA ALA A 79 -4.081 33.835 24.222 1.00 0.00 C ATOM 1323 C ALA A 79 -4.616 35.168 24.742 1.00 0.00 C ATOM 1324 O ALA A 79 -4.265 35.555 25.855 1.00 0.00 O ATOM 1325 CB ALA A 79 -4.394 32.722 25.220 1.00 0.00 C ATOM 0 H ALA A 79 -2.108 33.557 24.832 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.552 33.593 23.269 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.474 32.637 25.343 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.995 31.778 24.849 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -3.937 32.956 26.181 1.00 0.00 H new ATOM 1430 N GLN A 86 -13.452 43.137 23.355 1.00 0.00 N ATOM 1431 CA GLN A 86 -13.575 43.181 21.899 1.00 0.00 C ATOM 1432 C GLN A 86 -12.241 42.957 21.206 1.00 0.00 C ATOM 1433 O GLN A 86 -12.213 42.579 20.039 1.00 0.00 O ATOM 1434 CB GLN A 86 -14.209 44.501 21.436 1.00 0.00 C ATOM 1435 CG GLN A 86 -13.295 45.715 21.677 1.00 0.00 C ATOM 1436 CD GLN A 86 -13.776 46.946 20.918 1.00 0.00 C ATOM 1437 OE1 GLN A 86 -14.221 47.916 21.525 1.00 0.00 O ATOM 1438 NE2 GLN A 86 -13.672 46.924 19.589 1.00 0.00 N ATOM 0 HA GLN A 86 -14.234 42.362 21.612 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -14.444 44.434 20.374 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -15.152 44.651 21.962 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -13.259 45.937 22.744 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -12.279 45.472 21.368 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -13.297 46.099 19.120 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -13.967 47.732 19.041 1.00 0.00 H new ATOM 1447 N ARG A 87 -11.137 43.156 21.928 1.00 0.00 N ATOM 1448 CA ARG A 87 -9.817 42.973 21.361 1.00 0.00 C ATOM 1449 C ARG A 87 -9.373 41.532 21.533 1.00 0.00 C ATOM 1450 O ARG A 87 -8.383 41.149 20.931 1.00 0.00 O ATOM 1451 CB ARG A 87 -8.820 43.972 21.984 1.00 0.00 C ATOM 1452 CG ARG A 87 -8.458 45.070 20.975 1.00 0.00 C ATOM 1453 CD ARG A 87 -7.645 44.515 19.791 1.00 0.00 C ATOM 1454 NE ARG A 87 -8.364 44.598 18.510 1.00 0.00 N ATOM 1455 CZ ARG A 87 -7.830 44.260 17.323 1.00 0.00 C ATOM 1456 NH1 ARG A 87 -6.665 43.602 17.249 1.00 0.00 N ATOM 1457 NH2 ARG A 87 -8.479 44.585 16.203 1.00 0.00 N ATOM 0 H ARG A 87 -11.140 43.444 22.906 1.00 0.00 H new ATOM 0 HA ARG A 87 -9.849 43.180 20.291 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -9.255 44.420 22.877 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -7.918 43.447 22.298 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -9.370 45.536 20.602 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -7.884 45.849 21.476 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -6.708 45.066 19.711 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.388 43.475 19.990 1.00 0.00 H new ATOM 0 HE ARG A 87 -9.327 44.933 18.523 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -6.167 43.349 18.103 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -6.276 43.354 16.339 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -9.368 45.083 16.255 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.086 44.335 15.295 1.00 0.00 H new ATOM 1471 N ALA A 88 -10.141 40.715 22.252 1.00 0.00 N ATOM 1472 CA ALA A 88 -9.891 39.291 22.365 1.00 0.00 C ATOM 1473 C ALA A 88 -10.639 38.647 21.220 1.00 0.00 C ATOM 1474 O ALA A 88 -10.144 37.710 20.594 1.00 0.00 O ATOM 1475 CB ALA A 88 -10.373 38.709 23.688 1.00 0.00 C ATOM 0 H ALA A 88 -10.958 41.031 22.774 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.818 39.101 22.329 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.159 37.641 23.715 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -9.858 39.203 24.512 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -11.447 38.866 23.785 1.00 0.00 H new ATOM 1481 N ALA A 89 -11.819 39.199 20.936 1.00 0.00 N ATOM 1482 CA ALA A 89 -12.643 38.761 19.834 1.00 0.00 C ATOM 1483 C ALA A 89 -11.826 38.987 18.570 1.00 0.00 C ATOM 1484 O ALA A 89 -11.562 38.051 17.826 1.00 0.00 O ATOM 1485 CB ALA A 89 -13.981 39.504 19.824 1.00 0.00 C ATOM 0 H ALA A 89 -12.223 39.966 21.473 1.00 0.00 H new ATOM 0 HA ALA A 89 -12.905 37.706 19.917 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.584 39.157 18.985 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.511 39.311 20.756 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.802 40.574 19.724 1.00 0.00 H new ATOM 1491 N GLU A 90 -11.409 40.234 18.360 1.00 0.00 N ATOM 1492 CA GLU A 90 -10.614 40.637 17.204 1.00 0.00 C ATOM 1493 C GLU A 90 -9.153 40.174 17.205 1.00 0.00 C ATOM 1494 O GLU A 90 -8.531 40.218 16.144 1.00 0.00 O ATOM 1495 CB GLU A 90 -10.642 42.167 17.089 1.00 0.00 C ATOM 1496 CG GLU A 90 -12.029 42.822 16.959 1.00 0.00 C ATOM 1497 CD GLU A 90 -12.000 44.286 17.405 1.00 0.00 C ATOM 1498 OE1 GLU A 90 -10.937 44.922 17.218 1.00 0.00 O ATOM 1499 OE2 GLU A 90 -13.029 44.753 17.940 1.00 0.00 O ATOM 0 H GLU A 90 -11.617 41.003 18.997 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.078 40.140 16.352 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -10.149 42.584 17.967 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -10.047 42.455 16.223 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -12.366 42.762 15.924 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.751 42.271 17.561 1.00 0.00 H new ATOM 1506 N ASN A 91 -8.580 39.735 18.333 1.00 0.00 N ATOM 1507 CA ASN A 91 -7.190 39.277 18.341 1.00 0.00 C ATOM 1508 C ASN A 91 -7.229 37.820 17.937 1.00 0.00 C ATOM 1509 O ASN A 91 -6.518 37.439 17.019 1.00 0.00 O ATOM 1510 CB ASN A 91 -6.463 39.430 19.703 1.00 0.00 C ATOM 1511 CG ASN A 91 -5.810 40.803 19.889 1.00 0.00 C ATOM 1512 OD1 ASN A 91 -5.782 41.630 18.978 1.00 0.00 O ATOM 1513 ND2 ASN A 91 -5.271 41.056 21.080 1.00 0.00 N ATOM 0 H ASN A 91 -9.050 39.688 19.237 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.616 39.901 17.656 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -7.177 39.263 20.509 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -5.699 38.657 19.788 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.820 41.954 21.255 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -5.309 40.352 21.817 1.00 0.00 H new ATOM 1520 N ARG A 92 -8.065 37.005 18.589 1.00 0.00 N ATOM 1521 CA ARG A 92 -8.177 35.603 18.223 1.00 0.00 C ATOM 1522 C ARG A 92 -8.747 35.457 16.823 1.00 0.00 C ATOM 1523 O ARG A 92 -8.394 34.512 16.122 1.00 0.00 O ATOM 1524 CB ARG A 92 -9.001 34.823 19.268 1.00 0.00 C ATOM 1525 CG ARG A 92 -10.504 34.911 18.962 1.00 0.00 C ATOM 1526 CD ARG A 92 -11.428 34.452 20.095 1.00 0.00 C ATOM 1527 NE ARG A 92 -12.718 33.926 19.605 1.00 0.00 N ATOM 1528 CZ ARG A 92 -13.546 34.445 18.675 1.00 0.00 C ATOM 1529 NH1 ARG A 92 -13.333 35.636 18.097 1.00 0.00 N ATOM 1530 NH2 ARG A 92 -14.623 33.740 18.305 1.00 0.00 N ATOM 0 H ARG A 92 -8.664 37.294 19.362 1.00 0.00 H new ATOM 0 HA ARG A 92 -7.178 35.167 18.214 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.689 33.779 19.277 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.805 35.223 20.263 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.748 35.943 18.712 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -10.714 34.310 18.077 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.925 33.681 20.678 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.614 35.289 20.767 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.025 33.050 20.028 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.517 36.190 18.356 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.987 35.988 17.398 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -14.805 32.828 18.725 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -15.261 34.115 17.603 1.00 0.00 H new ATOM 1544 N GLN A 93 -9.624 36.383 16.423 1.00 0.00 N ATOM 1545 CA GLN A 93 -10.238 36.307 15.104 1.00 0.00 C ATOM 1546 C GLN A 93 -9.311 36.864 14.028 1.00 0.00 C ATOM 1547 O GLN A 93 -9.579 36.644 12.854 1.00 0.00 O ATOM 1548 CB GLN A 93 -11.643 36.921 15.122 1.00 0.00 C ATOM 1549 CG GLN A 93 -12.570 36.434 14.003 1.00 0.00 C ATOM 1550 CD GLN A 93 -14.031 36.709 14.365 1.00 0.00 C ATOM 1551 OE1 GLN A 93 -14.498 36.298 15.429 1.00 0.00 O ATOM 1552 NE2 GLN A 93 -14.757 37.409 13.493 1.00 0.00 N ATOM 0 H GLN A 93 -9.918 37.180 16.987 1.00 0.00 H new ATOM 0 HA GLN A 93 -10.382 35.261 14.833 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -12.109 36.700 16.083 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.552 38.005 15.053 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -12.319 36.937 13.069 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -12.424 35.366 13.839 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -14.336 37.733 12.622 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -15.734 37.621 13.697 1.00 0.00 H new ATOM 1561 N GLY A 94 -8.220 37.545 14.413 1.00 0.00 N ATOM 1562 CA GLY A 94 -7.223 38.077 13.488 1.00 0.00 C ATOM 1563 C GLY A 94 -6.105 37.047 13.380 1.00 0.00 C ATOM 1564 O GLY A 94 -5.671 36.701 12.289 1.00 0.00 O ATOM 0 H GLY A 94 -8.008 37.741 15.391 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -7.668 38.264 12.511 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -6.834 39.029 13.849 1.00 0.00 H new ATOM 1568 N THR A 95 -5.673 36.543 14.539 1.00 0.00 N ATOM 1569 CA THR A 95 -4.658 35.513 14.709 1.00 0.00 C ATOM 1570 C THR A 95 -5.100 34.293 13.940 1.00 0.00 C ATOM 1571 O THR A 95 -4.329 33.762 13.155 1.00 0.00 O ATOM 1572 CB THR A 95 -4.494 35.204 16.207 1.00 0.00 C ATOM 1573 OG1 THR A 95 -3.983 36.341 16.867 1.00 0.00 O ATOM 1574 CG2 THR A 95 -3.576 34.007 16.499 1.00 0.00 C ATOM 0 H THR A 95 -6.047 36.865 15.432 1.00 0.00 H new ATOM 0 HA THR A 95 -3.691 35.844 14.329 1.00 0.00 H new ATOM 0 HB THR A 95 -5.486 34.939 16.574 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.715 36.962 17.063 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.511 33.853 17.576 1.00 0.00 H new ATOM 0 HG22 THR A 95 -3.984 33.112 16.028 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.581 34.206 16.100 1.00 0.00 H new ATOM 1582 N LEU A 96 -6.349 33.874 14.139 1.00 0.00 N ATOM 1583 CA LEU A 96 -6.895 32.763 13.379 1.00 0.00 C ATOM 1584 C LEU A 96 -6.894 33.151 11.899 1.00 0.00 C ATOM 1585 O LEU A 96 -6.309 32.444 11.088 1.00 0.00 O ATOM 1586 CB LEU A 96 -8.286 32.450 13.930 1.00 0.00 C ATOM 1587 CG LEU A 96 -9.121 31.370 13.232 1.00 0.00 C ATOM 1588 CD1 LEU A 96 -9.192 31.471 11.755 1.00 0.00 C ATOM 1589 CD2 LEU A 96 -8.804 29.900 13.453 1.00 0.00 C ATOM 0 H LEU A 96 -6.993 34.286 14.815 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.300 31.855 13.472 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -8.172 32.158 14.974 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -8.863 33.375 13.919 1.00 0.00 H new ATOM 0 HG LEU A 96 -10.045 31.625 13.751 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -9.806 30.660 11.364 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -9.634 32.428 11.477 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -8.188 31.400 11.337 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -9.499 29.288 12.879 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -7.784 29.695 13.127 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -8.901 29.662 14.512 1.00 0.00 H new ATOM 1601 N THR A 97 -7.549 34.263 11.550 1.00 0.00 N ATOM 1602 CA THR A 97 -7.655 34.770 10.172 1.00 0.00 C ATOM 1603 C THR A 97 -6.322 34.784 9.448 1.00 0.00 C ATOM 1604 O THR A 97 -6.280 34.557 8.239 1.00 0.00 O ATOM 1605 CB THR A 97 -8.338 36.152 10.122 1.00 0.00 C ATOM 1606 OG1 THR A 97 -9.737 35.983 10.015 1.00 0.00 O ATOM 1607 CG2 THR A 97 -7.853 37.106 9.027 1.00 0.00 C ATOM 0 H THR A 97 -8.032 34.851 12.230 1.00 0.00 H new ATOM 0 HA THR A 97 -8.292 34.066 9.637 1.00 0.00 H new ATOM 0 HB THR A 97 -8.054 36.636 11.057 1.00 0.00 H new ATOM 0 HG1 THR A 97 -10.154 36.152 10.885 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.405 38.044 9.091 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.789 37.301 9.160 1.00 0.00 H new ATOM 0 HG23 THR A 97 -8.020 36.653 8.050 1.00 0.00 H new ATOM 1615 N GLU A 98 -5.241 35.019 10.186 1.00 0.00 N ATOM 1616 CA GLU A 98 -3.934 35.055 9.586 1.00 0.00 C ATOM 1617 C GLU A 98 -3.382 33.653 9.597 1.00 0.00 C ATOM 1618 O GLU A 98 -2.835 33.246 8.581 1.00 0.00 O ATOM 1619 CB GLU A 98 -3.037 36.062 10.322 1.00 0.00 C ATOM 1620 CG GLU A 98 -1.694 36.237 9.609 1.00 0.00 C ATOM 1621 CD GLU A 98 -0.755 37.150 10.388 1.00 0.00 C ATOM 1622 OE1 GLU A 98 -1.149 38.315 10.611 1.00 0.00 O ATOM 1623 OE2 GLU A 98 0.338 36.663 10.750 1.00 0.00 O ATOM 0 H GLU A 98 -5.255 35.185 11.192 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.982 35.398 8.553 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -3.545 37.024 10.387 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.867 35.722 11.343 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -1.224 35.263 9.474 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -1.861 36.651 8.615 1.00 0.00 H new ATOM 1630 N TYR A 99 -3.541 32.889 10.678 1.00 0.00 N ATOM 1631 CA TYR A 99 -3.033 31.528 10.653 1.00 0.00 C ATOM 1632 C TYR A 99 -3.655 30.722 9.556 1.00 0.00 C ATOM 1633 O TYR A 99 -2.934 29.959 8.971 1.00 0.00 O ATOM 1634 CB TYR A 99 -3.091 30.679 11.939 1.00 0.00 C ATOM 1635 CG TYR A 99 -1.948 29.624 12.096 1.00 0.00 C ATOM 1636 CD1 TYR A 99 -0.688 29.742 11.440 1.00 0.00 C ATOM 1637 CD2 TYR A 99 -2.136 28.493 12.928 1.00 0.00 C ATOM 1638 CE1 TYR A 99 0.328 28.785 11.624 1.00 0.00 C ATOM 1639 CE2 TYR A 99 -1.111 27.533 13.114 1.00 0.00 C ATOM 1640 CZ TYR A 99 0.110 27.686 12.445 1.00 0.00 C ATOM 1641 OH TYR A 99 1.110 26.768 12.546 1.00 0.00 O ATOM 0 H TYR A 99 -3.997 33.177 11.544 1.00 0.00 H new ATOM 0 HA TYR A 99 -1.973 31.729 10.497 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -3.065 31.349 12.798 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -4.049 30.160 11.969 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.509 30.584 10.788 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.082 28.360 13.432 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.279 28.906 11.126 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -1.270 26.688 13.768 1.00 0.00 H new ATOM 0 HH TYR A 99 1.394 26.695 13.481 1.00 0.00 H new ATOM 1651 N CYS A 100 -4.938 30.843 9.245 1.00 0.00 N ATOM 1652 CA CYS A 100 -5.486 30.038 8.160 1.00 0.00 C ATOM 1653 C CYS A 100 -4.737 30.320 6.865 1.00 0.00 C ATOM 1654 O CYS A 100 -4.317 29.396 6.167 1.00 0.00 O ATOM 1655 CB CYS A 100 -6.989 30.297 8.005 1.00 0.00 C ATOM 1656 SG CYS A 100 -7.671 29.197 6.739 1.00 0.00 S ATOM 0 H CYS A 100 -5.599 31.466 9.708 1.00 0.00 H new ATOM 0 HA CYS A 100 -5.355 28.983 8.402 1.00 0.00 H new ATOM 0 HB2 CYS A 100 -7.496 30.132 8.956 1.00 0.00 H new ATOM 0 HB3 CYS A 100 -7.162 31.337 7.728 1.00 0.00 H new ATOM 0 HG CYS A 100 -8.799 29.678 6.308 1.00 0.00 H new ATOM 1662 N SER A 101 -4.547 31.604 6.565 1.00 0.00 N ATOM 1663 CA SER A 101 -3.829 32.003 5.362 1.00 0.00 C ATOM 1664 C SER A 101 -2.335 31.658 5.395 1.00 0.00 C ATOM 1665 O SER A 101 -1.743 31.334 4.368 1.00 0.00 O ATOM 1666 CB SER A 101 -4.026 33.514 5.191 1.00 0.00 C ATOM 1667 OG SER A 101 -5.406 33.808 5.101 1.00 0.00 O ATOM 0 H SER A 101 -4.880 32.380 7.137 1.00 0.00 H new ATOM 0 HA SER A 101 -4.234 31.445 4.518 1.00 0.00 H new ATOM 0 HB2 SER A 101 -3.585 34.046 6.034 1.00 0.00 H new ATOM 0 HB3 SER A 101 -3.512 33.858 4.294 1.00 0.00 H new ATOM 0 HG SER A 101 -5.757 34.009 5.994 1.00 0.00 H new ATOM 1673 N THR A 102 -1.732 31.761 6.575 1.00 0.00 N ATOM 1674 CA THR A 102 -0.326 31.569 6.870 1.00 0.00 C ATOM 1675 C THR A 102 0.051 30.106 7.013 1.00 0.00 C ATOM 1676 O THR A 102 1.151 29.754 6.619 1.00 0.00 O ATOM 1677 CB THR A 102 0.056 32.526 8.019 1.00 0.00 C ATOM 1678 OG1 THR A 102 -0.240 33.838 7.584 1.00 0.00 O ATOM 1679 CG2 THR A 102 1.507 32.540 8.473 1.00 0.00 C ATOM 0 H THR A 102 -2.261 32.000 7.413 1.00 0.00 H new ATOM 0 HA THR A 102 0.304 31.850 6.026 1.00 0.00 H new ATOM 0 HB THR A 102 -0.511 32.165 8.877 1.00 0.00 H new ATOM 0 HG1 THR A 102 -1.194 34.020 7.718 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.627 33.258 9.284 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.789 31.547 8.822 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.147 32.826 7.638 1.00 0.00 H new ATOM 1687 N LEU A 103 -0.840 29.243 7.503 1.00 0.00 N ATOM 1688 CA LEU A 103 -0.603 27.803 7.637 1.00 0.00 C ATOM 1689 C LEU A 103 -0.357 27.265 6.219 1.00 0.00 C ATOM 1690 O LEU A 103 0.460 26.362 6.042 1.00 0.00 O ATOM 1691 CB LEU A 103 -1.804 27.100 8.355 1.00 0.00 C ATOM 1692 CG LEU A 103 -1.690 26.300 9.681 1.00 0.00 C ATOM 1693 CD1 LEU A 103 -3.024 26.261 10.441 1.00 0.00 C ATOM 1694 CD2 LEU A 103 -1.276 24.821 9.538 1.00 0.00 C ATOM 0 H LEU A 103 -1.765 29.530 7.824 1.00 0.00 H new ATOM 0 HA LEU A 103 0.264 27.596 8.264 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.546 27.878 8.535 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.233 26.414 7.624 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.906 26.846 10.207 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.901 25.692 11.363 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.336 27.277 10.681 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -3.783 25.786 9.820 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.228 24.360 10.524 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.010 24.295 8.927 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.298 24.762 9.061 1.00 0.00 H new ATOM 1706 N MET A 104 -1.034 27.850 5.212 1.00 0.00 N ATOM 1707 CA MET A 104 -0.860 27.489 3.805 1.00 0.00 C ATOM 1708 C MET A 104 0.247 28.280 3.117 1.00 0.00 C ATOM 1709 O MET A 104 0.639 27.944 1.998 1.00 0.00 O ATOM 1710 CB MET A 104 -2.185 27.686 3.044 1.00 0.00 C ATOM 1711 CG MET A 104 -2.299 26.738 1.845 1.00 0.00 C ATOM 1712 SD MET A 104 -3.244 25.226 2.139 1.00 0.00 S ATOM 1713 CE MET A 104 -2.564 24.669 3.720 1.00 0.00 C ATOM 0 H MET A 104 -1.720 28.590 5.360 1.00 0.00 H new ATOM 0 HA MET A 104 -0.563 26.440 3.786 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.022 27.517 3.722 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.257 28.718 2.700 1.00 0.00 H new ATOM 0 HG2 MET A 104 -2.759 27.279 1.018 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.294 26.462 1.525 1.00 0.00 H new ATOM 0 HE1 MET A 104 -3.104 23.785 4.057 1.00 0.00 H new ATOM 0 HE2 MET A 104 -1.509 24.424 3.596 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.668 25.462 4.460 1.00 0.00 H new ATOM 1723 N SER A 105 0.742 29.320 3.780 1.00 0.00 N ATOM 1724 CA SER A 105 1.782 30.184 3.253 1.00 0.00 C ATOM 1725 C SER A 105 3.150 29.653 3.637 1.00 0.00 C ATOM 1726 O SER A 105 4.039 29.627 2.789 1.00 0.00 O ATOM 1727 CB SER A 105 1.614 31.648 3.730 1.00 0.00 C ATOM 1728 OG SER A 105 2.293 32.508 2.839 1.00 0.00 O ATOM 0 H SER A 105 0.425 29.587 4.712 1.00 0.00 H new ATOM 0 HA SER A 105 1.692 30.184 2.167 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.557 31.910 3.772 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.012 31.762 4.738 1.00 0.00 H new ATOM 0 HG SER A 105 2.188 33.436 3.136 1.00 0.00 H new ATOM 1734 N LEU A 106 3.316 29.252 4.906 1.00 0.00 N ATOM 1735 CA LEU A 106 4.538 28.767 5.462 1.00 0.00 C ATOM 1736 C LEU A 106 5.493 28.052 4.508 1.00 0.00 C ATOM 1737 O LEU A 106 5.058 27.187 3.748 1.00 0.00 O ATOM 1738 CB LEU A 106 4.301 28.063 6.800 1.00 0.00 C ATOM 1739 CG LEU A 106 3.703 28.883 7.965 1.00 0.00 C ATOM 1740 CD1 LEU A 106 4.183 28.313 9.286 1.00 0.00 C ATOM 1741 CD2 LEU A 106 4.046 30.368 7.965 1.00 0.00 C ATOM 0 H LEU A 106 2.554 29.267 5.583 1.00 0.00 H new ATOM 0 HA LEU A 106 5.124 29.661 5.674 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.640 27.215 6.617 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.255 27.657 7.135 1.00 0.00 H new ATOM 0 HG LEU A 106 2.624 28.804 7.829 1.00 0.00 H new ATOM 0 HD11 LEU A 106 3.761 28.892 10.107 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.863 27.275 9.372 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.271 28.362 9.330 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.577 30.850 8.823 1.00 0.00 H new ATOM 0 HD22 LEU A 106 5.127 30.492 8.025 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.679 30.826 7.047 1.00 0.00 H new ATOM 1753 N PRO A 107 6.800 28.403 4.534 1.00 0.00 N ATOM 1754 CA PRO A 107 7.761 27.779 3.645 1.00 0.00 C ATOM 1755 C PRO A 107 8.165 26.407 4.134 1.00 0.00 C ATOM 1756 O PRO A 107 8.879 25.676 3.452 1.00 0.00 O ATOM 1757 CB PRO A 107 8.957 28.706 3.585 1.00 0.00 C ATOM 1758 CG PRO A 107 8.961 29.342 4.975 1.00 0.00 C ATOM 1759 CD PRO A 107 7.485 29.367 5.399 1.00 0.00 C ATOM 0 HA PRO A 107 7.326 27.631 2.657 1.00 0.00 H new ATOM 0 HB2 PRO A 107 9.881 28.163 3.386 1.00 0.00 H new ATOM 0 HB3 PRO A 107 8.851 29.453 2.798 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.564 28.762 5.674 1.00 0.00 H new ATOM 0 HG3 PRO A 107 9.382 30.347 4.949 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.376 29.095 6.449 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.062 30.365 5.282 1.00 0.00 H new ATOM 1767 N THR A 108 7.655 26.040 5.303 1.00 0.00 N ATOM 1768 CA THR A 108 7.844 24.743 5.889 1.00 0.00 C ATOM 1769 C THR A 108 6.737 23.895 5.309 1.00 0.00 C ATOM 1770 O THR A 108 6.051 23.188 6.025 1.00 0.00 O ATOM 1771 CB THR A 108 7.681 24.869 7.403 1.00 0.00 C ATOM 1772 OG1 THR A 108 6.670 25.795 7.756 1.00 0.00 O ATOM 1773 CG2 THR A 108 8.980 25.254 8.083 1.00 0.00 C ATOM 0 H THR A 108 7.085 26.662 5.876 1.00 0.00 H new ATOM 0 HA THR A 108 8.826 24.314 5.688 1.00 0.00 H new ATOM 0 HB THR A 108 7.382 23.881 7.754 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.962 26.319 8.531 1.00 0.00 H new ATOM 0 HG21 THR A 108 8.819 25.333 9.158 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.734 24.493 7.884 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.322 26.214 7.696 1.00 0.00 H new ATOM 1781 N LYS A 109 6.537 23.961 4.001 1.00 0.00 N ATOM 1782 CA LYS A 109 5.468 23.197 3.387 1.00 0.00 C ATOM 1783 C LYS A 109 5.763 21.704 3.355 1.00 0.00 C ATOM 1784 O LYS A 109 4.854 20.915 3.121 1.00 0.00 O ATOM 1785 CB LYS A 109 5.158 23.783 1.986 1.00 0.00 C ATOM 1786 CG LYS A 109 3.708 23.583 1.535 1.00 0.00 C ATOM 1787 CD LYS A 109 2.717 24.332 2.440 1.00 0.00 C ATOM 1788 CE LYS A 109 1.359 24.502 1.747 1.00 0.00 C ATOM 1789 NZ LYS A 109 1.371 25.595 0.755 1.00 0.00 N ATOM 0 H LYS A 109 7.091 24.525 3.357 1.00 0.00 H new ATOM 0 HA LYS A 109 4.573 23.290 4.002 1.00 0.00 H new ATOM 0 HB2 LYS A 109 5.382 24.850 1.992 1.00 0.00 H new ATOM 0 HB3 LYS A 109 5.822 23.322 1.255 1.00 0.00 H new ATOM 0 HG2 LYS A 109 3.596 23.931 0.508 1.00 0.00 H new ATOM 0 HG3 LYS A 109 3.470 22.519 1.539 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.587 23.785 3.374 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.123 25.310 2.698 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.086 23.569 1.254 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.593 24.702 2.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 0.761 25.341 -0.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 1.018 26.468 1.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.343 25.747 0.417 1.00 0.00 H new ATOM 1803 N ILE A 110 7.012 21.322 3.620 1.00 0.00 N ATOM 1804 CA ILE A 110 7.438 19.935 3.682 1.00 0.00 C ATOM 1805 C ILE A 110 7.422 19.466 5.138 1.00 0.00 C ATOM 1806 O ILE A 110 7.125 18.305 5.410 1.00 0.00 O ATOM 1807 CB ILE A 110 8.824 19.772 3.019 1.00 0.00 C ATOM 1808 CG1 ILE A 110 8.781 20.283 1.564 1.00 0.00 C ATOM 1809 CG2 ILE A 110 9.274 18.303 3.058 1.00 0.00 C ATOM 1810 CD1 ILE A 110 10.142 20.237 0.862 1.00 0.00 C ATOM 0 H ILE A 110 7.766 21.985 3.800 1.00 0.00 H new ATOM 0 HA ILE A 110 6.748 19.303 3.123 1.00 0.00 H new ATOM 0 HB ILE A 110 9.547 20.366 3.578 1.00 0.00 H new ATOM 0 HG12 ILE A 110 8.068 19.684 0.997 1.00 0.00 H new ATOM 0 HG13 ILE A 110 8.412 21.309 1.558 1.00 0.00 H new ATOM 0 HG21 ILE A 110 10.252 18.209 2.586 1.00 0.00 H new ATOM 0 HG22 ILE A 110 9.337 17.969 4.094 1.00 0.00 H new ATOM 0 HG23 ILE A 110 8.552 17.687 2.522 1.00 0.00 H new ATOM 0 HD11 ILE A 110 10.039 20.610 -0.157 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.853 20.859 1.406 1.00 0.00 H new ATOM 0 HD13 ILE A 110 10.504 19.209 0.837 1.00 0.00 H new ATOM 1822 N SER A 111 7.743 20.367 6.073 1.00 0.00 N ATOM 1823 CA SER A 111 7.798 20.051 7.491 1.00 0.00 C ATOM 1824 C SER A 111 6.420 20.119 8.134 1.00 0.00 C ATOM 1825 O SER A 111 6.063 19.276 8.954 1.00 0.00 O ATOM 1826 CB SER A 111 8.795 20.973 8.202 1.00 0.00 C ATOM 1827 OG SER A 111 9.991 21.067 7.454 1.00 0.00 O ATOM 0 H SER A 111 7.972 21.338 5.859 1.00 0.00 H new ATOM 0 HA SER A 111 8.146 19.024 7.597 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.358 21.964 8.330 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.010 20.589 9.199 1.00 0.00 H new ATOM 0 HG SER A 111 10.620 21.660 7.916 1.00 0.00 H new ATOM 1833 N ARG A 112 5.652 21.139 7.750 1.00 0.00 N ATOM 1834 CA ARG A 112 4.314 21.375 8.264 1.00 0.00 C ATOM 1835 C ARG A 112 3.271 20.479 7.611 1.00 0.00 C ATOM 1836 O ARG A 112 2.193 20.324 8.177 1.00 0.00 O ATOM 1837 CB ARG A 112 3.959 22.855 8.117 1.00 0.00 C ATOM 1838 CG ARG A 112 2.647 23.226 8.812 1.00 0.00 C ATOM 1839 CD ARG A 112 2.596 24.737 9.052 1.00 0.00 C ATOM 1840 NE ARG A 112 2.913 25.069 10.448 1.00 0.00 N ATOM 1841 CZ ARG A 112 4.109 25.453 10.926 1.00 0.00 C ATOM 1842 NH1 ARG A 112 5.220 25.429 10.184 1.00 0.00 N ATOM 1843 NH2 ARG A 112 4.199 25.929 12.168 1.00 0.00 N ATOM 0 H ARG A 112 5.952 21.831 7.063 1.00 0.00 H new ATOM 0 HA ARG A 112 4.310 21.114 9.322 1.00 0.00 H new ATOM 0 HB2 ARG A 112 4.766 23.460 8.530 1.00 0.00 H new ATOM 0 HB3 ARG A 112 3.886 23.102 7.058 1.00 0.00 H new ATOM 0 HG2 ARG A 112 1.800 22.917 8.199 1.00 0.00 H new ATOM 0 HG3 ARG A 112 2.564 22.695 9.760 1.00 0.00 H new ATOM 0 HD2 ARG A 112 3.302 25.236 8.388 1.00 0.00 H new ATOM 0 HD3 ARG A 112 1.604 25.113 8.803 1.00 0.00 H new ATOM 0 HE ARG A 112 2.150 25.001 11.121 1.00 0.00 H new ATOM 0 HH11 ARG A 112 5.180 25.111 9.216 1.00 0.00 H new ATOM 0 HH12 ARG A 112 6.108 25.729 10.586 1.00 0.00 H new ATOM 0 HH21 ARG A 112 3.364 26.000 12.749 1.00 0.00 H new ATOM 0 HH22 ARG A 112 5.103 26.222 12.537 1.00 0.00 H new ATOM 1857 N CYS A 113 3.584 19.895 6.447 1.00 0.00 N ATOM 1858 CA CYS A 113 2.675 19.008 5.725 1.00 0.00 C ATOM 1859 C CYS A 113 1.977 18.014 6.668 1.00 0.00 C ATOM 1860 O CYS A 113 0.773 18.154 6.883 1.00 0.00 O ATOM 1861 CB CYS A 113 3.375 18.341 4.526 1.00 0.00 C ATOM 1862 SG CYS A 113 2.388 16.981 3.856 1.00 0.00 S ATOM 0 H CYS A 113 4.481 20.028 5.981 1.00 0.00 H new ATOM 0 HA CYS A 113 1.875 19.615 5.302 1.00 0.00 H new ATOM 0 HB2 CYS A 113 3.551 19.083 3.747 1.00 0.00 H new ATOM 0 HB3 CYS A 113 4.351 17.966 4.835 1.00 0.00 H new ATOM 0 HG CYS A 113 3.012 16.448 2.847 1.00 0.00 H new ATOM 1868 N PRO A 114 2.675 17.030 7.259 1.00 0.00 N ATOM 1869 CA PRO A 114 2.053 16.062 8.151 1.00 0.00 C ATOM 1870 C PRO A 114 1.369 16.686 9.349 1.00 0.00 C ATOM 1871 O PRO A 114 0.383 16.128 9.816 1.00 0.00 O ATOM 1872 CB PRO A 114 3.149 15.067 8.539 1.00 0.00 C ATOM 1873 CG PRO A 114 4.433 15.875 8.343 1.00 0.00 C ATOM 1874 CD PRO A 114 4.097 16.750 7.136 1.00 0.00 C ATOM 0 HA PRO A 114 1.234 15.557 7.639 1.00 0.00 H new ATOM 0 HB2 PRO A 114 3.039 14.727 9.569 1.00 0.00 H new ATOM 0 HB3 PRO A 114 3.130 14.179 7.907 1.00 0.00 H new ATOM 0 HG2 PRO A 114 4.674 16.473 9.222 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.291 15.231 8.150 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.682 17.670 7.140 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.319 16.235 6.201 1.00 0.00 H new ATOM 1882 N HIS A 115 1.848 17.832 9.835 1.00 0.00 N ATOM 1883 CA HIS A 115 1.185 18.469 10.957 1.00 0.00 C ATOM 1884 C HIS A 115 -0.208 18.919 10.488 1.00 0.00 C ATOM 1885 O HIS A 115 -1.214 18.572 11.105 1.00 0.00 O ATOM 1886 CB HIS A 115 2.060 19.540 11.628 1.00 0.00 C ATOM 1887 CG HIS A 115 1.774 19.737 13.106 1.00 0.00 C ATOM 1888 ND1 HIS A 115 1.369 18.712 13.954 1.00 0.00 N ATOM 1889 CD2 HIS A 115 1.822 20.849 13.913 1.00 0.00 C ATOM 1890 CE1 HIS A 115 1.199 19.239 15.179 1.00 0.00 C ATOM 1891 NE2 HIS A 115 1.462 20.542 15.220 1.00 0.00 N ATOM 0 H HIS A 115 2.669 18.321 9.478 1.00 0.00 H new ATOM 0 HA HIS A 115 1.032 17.767 11.776 1.00 0.00 H new ATOM 0 HB2 HIS A 115 3.108 19.267 11.505 1.00 0.00 H new ATOM 0 HB3 HIS A 115 1.915 20.489 11.111 1.00 0.00 H new ATOM 0 HD2 HIS A 115 2.103 21.835 13.575 1.00 0.00 H new ATOM 0 HE1 HIS A 115 0.883 18.666 16.038 1.00 0.00 H new ATOM 0 HE2 HIS A 115 1.411 21.169 16.023 1.00 0.00 H new ATOM 1899 N LEU A 116 -0.300 19.664 9.376 1.00 0.00 N ATOM 1900 CA LEU A 116 -1.583 20.085 8.862 1.00 0.00 C ATOM 1901 C LEU A 116 -2.514 18.886 8.632 1.00 0.00 C ATOM 1902 O LEU A 116 -3.649 18.847 9.102 1.00 0.00 O ATOM 1903 CB LEU A 116 -1.484 20.929 7.585 1.00 0.00 C ATOM 1904 CG LEU A 116 -2.709 21.841 7.392 1.00 0.00 C ATOM 1905 CD1 LEU A 116 -3.294 21.766 5.970 1.00 0.00 C ATOM 1906 CD2 LEU A 116 -3.920 21.603 8.259 1.00 0.00 C ATOM 0 H LEU A 116 0.501 19.978 8.829 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.009 20.727 9.633 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.582 21.539 7.624 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -1.385 20.269 6.723 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.248 22.792 7.658 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -4.155 22.430 5.895 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.536 22.071 5.248 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -3.606 20.743 5.758 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -4.697 22.324 8.005 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.294 20.593 8.093 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.646 21.720 9.307 1.00 0.00 H new ATOM 1918 N LEU A 117 -2.024 17.871 7.927 1.00 0.00 N ATOM 1919 CA LEU A 117 -2.781 16.642 7.735 1.00 0.00 C ATOM 1920 C LEU A 117 -3.241 16.123 9.095 1.00 0.00 C ATOM 1921 O LEU A 117 -4.395 15.755 9.230 1.00 0.00 O ATOM 1922 CB LEU A 117 -2.022 15.610 6.907 1.00 0.00 C ATOM 1923 CG LEU A 117 -1.989 15.909 5.389 1.00 0.00 C ATOM 1924 CD1 LEU A 117 -0.793 16.737 4.945 1.00 0.00 C ATOM 1925 CD2 LEU A 117 -1.958 14.577 4.679 1.00 0.00 C ATOM 0 H LEU A 117 -1.107 17.877 7.480 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.669 16.856 7.140 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.998 15.548 7.275 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.476 14.632 7.063 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.869 16.504 5.144 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.844 16.902 3.869 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.804 17.697 5.461 1.00 0.00 H new ATOM 0 HD13 LEU A 117 0.127 16.206 5.187 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.934 14.740 3.601 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.069 14.024 4.982 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.848 14.005 4.940 1.00 0.00 H new ATOM 1937 N ASP A 118 -2.394 16.142 10.121 1.00 0.00 N ATOM 1938 CA ASP A 118 -2.770 15.754 11.485 1.00 0.00 C ATOM 1939 C ASP A 118 -3.633 16.799 12.230 1.00 0.00 C ATOM 1940 O ASP A 118 -4.063 16.552 13.353 1.00 0.00 O ATOM 1941 CB ASP A 118 -1.481 15.588 12.303 1.00 0.00 C ATOM 1942 CG ASP A 118 -0.752 14.276 12.048 1.00 0.00 C ATOM 1943 OD1 ASP A 118 -1.397 13.358 11.496 1.00 0.00 O ATOM 1944 OD2 ASP A 118 0.438 14.207 12.422 1.00 0.00 O ATOM 0 H ASP A 118 -1.419 16.429 10.032 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.359 14.842 11.392 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.809 16.416 12.076 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -1.724 15.657 13.363 1.00 0.00 H new ATOM 1949 N PHE A 119 -3.891 17.959 11.631 1.00 0.00 N ATOM 1950 CA PHE A 119 -4.694 19.075 12.145 1.00 0.00 C ATOM 1951 C PHE A 119 -6.124 18.691 11.774 1.00 0.00 C ATOM 1952 O PHE A 119 -7.073 18.852 12.539 1.00 0.00 O ATOM 1953 CB PHE A 119 -4.264 20.393 11.401 1.00 0.00 C ATOM 1954 CG PHE A 119 -4.111 21.772 12.054 1.00 0.00 C ATOM 1955 CD1 PHE A 119 -4.984 22.130 13.082 1.00 0.00 C ATOM 1956 CD2 PHE A 119 -3.113 22.713 11.669 1.00 0.00 C ATOM 1957 CE1 PHE A 119 -4.908 23.354 13.760 1.00 0.00 C ATOM 1958 CE2 PHE A 119 -3.029 23.924 12.369 1.00 0.00 C ATOM 1959 CZ PHE A 119 -3.911 24.260 13.404 1.00 0.00 C ATOM 0 H PHE A 119 -3.518 18.163 10.704 1.00 0.00 H new ATOM 0 HA PHE A 119 -4.577 19.250 13.215 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -3.301 20.174 10.940 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -4.982 20.525 10.592 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -5.755 21.430 13.369 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -2.436 22.498 10.855 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -5.610 23.591 14.545 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.254 24.626 12.100 1.00 0.00 H new ATOM 0 HZ PHE A 119 -3.820 25.206 13.918 1.00 0.00 H new ATOM 1969 N PHE A 120 -6.239 18.199 10.544 1.00 0.00 N ATOM 1970 CA PHE A 120 -7.455 17.816 9.865 1.00 0.00 C ATOM 1971 C PHE A 120 -7.898 16.371 10.051 1.00 0.00 C ATOM 1972 O PHE A 120 -9.024 16.131 10.477 1.00 0.00 O ATOM 1973 CB PHE A 120 -7.129 18.049 8.386 1.00 0.00 C ATOM 1974 CG PHE A 120 -6.986 19.481 7.917 1.00 0.00 C ATOM 1975 CD1 PHE A 120 -7.401 20.566 8.702 1.00 0.00 C ATOM 1976 CD2 PHE A 120 -6.444 19.723 6.650 1.00 0.00 C ATOM 1977 CE1 PHE A 120 -7.326 21.875 8.215 1.00 0.00 C ATOM 1978 CE2 PHE A 120 -6.372 21.027 6.145 1.00 0.00 C ATOM 1979 CZ PHE A 120 -6.822 22.098 6.930 1.00 0.00 C ATOM 0 H PHE A 120 -5.417 18.050 9.959 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.285 18.394 10.271 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.199 17.527 8.161 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -7.911 17.577 7.791 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -7.784 20.389 9.696 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.078 18.898 6.057 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -7.654 22.704 8.825 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -5.973 21.207 5.158 1.00 0.00 H new ATOM 0 HZ PHE A 120 -6.779 23.104 6.539 1.00 0.00 H new ATOM 1989 N LYS A 121 -7.038 15.413 9.709 1.00 0.00 N ATOM 1990 CA LYS A 121 -7.352 13.993 9.801 1.00 0.00 C ATOM 1991 C LYS A 121 -7.712 13.573 11.224 1.00 0.00 C ATOM 1992 O LYS A 121 -8.424 12.590 11.418 1.00 0.00 O ATOM 1993 CB LYS A 121 -6.368 13.082 9.053 1.00 0.00 C ATOM 1994 CG LYS A 121 -5.158 12.596 9.847 1.00 0.00 C ATOM 1995 CD LYS A 121 -4.444 11.518 9.014 1.00 0.00 C ATOM 1996 CE LYS A 121 -3.121 11.027 9.618 1.00 0.00 C ATOM 1997 NZ LYS A 121 -2.011 11.964 9.372 1.00 0.00 N ATOM 0 H LYS A 121 -6.099 15.604 9.359 1.00 0.00 H new ATOM 0 HA LYS A 121 -8.271 13.836 9.236 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.914 12.210 8.694 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -6.008 13.616 8.174 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -4.482 13.425 10.057 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.472 12.189 10.808 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -5.113 10.666 8.893 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.250 11.915 8.017 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -3.244 10.888 10.692 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -2.871 10.053 9.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.105 11.474 9.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -2.063 12.315 8.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.080 12.765 10.032 1.00 0.00 H new ATOM 2011 N VAL A 122 -7.226 14.337 12.207 1.00 0.00 N ATOM 2012 CA VAL A 122 -7.482 14.101 13.616 1.00 0.00 C ATOM 2013 C VAL A 122 -8.704 14.905 14.044 1.00 0.00 C ATOM 2014 O VAL A 122 -9.598 14.342 14.673 1.00 0.00 O ATOM 2015 CB VAL A 122 -6.221 14.398 14.431 1.00 0.00 C ATOM 2016 CG1 VAL A 122 -6.412 14.008 15.901 1.00 0.00 C ATOM 2017 CG2 VAL A 122 -5.067 13.592 13.818 1.00 0.00 C ATOM 0 H VAL A 122 -6.634 15.149 12.034 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.717 13.053 13.803 1.00 0.00 H new ATOM 0 HB VAL A 122 -6.005 15.466 14.401 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -5.501 14.229 16.457 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -7.242 14.575 16.323 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.629 12.942 15.969 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.152 13.783 14.378 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -5.303 12.529 13.860 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.926 13.891 12.779 1.00 0.00 H new ATOM 2027 N ARG A 123 -8.754 16.200 13.690 1.00 0.00 N ATOM 2028 CA ARG A 123 -9.881 17.078 13.993 1.00 0.00 C ATOM 2029 C ARG A 123 -10.315 16.976 15.446 1.00 0.00 C ATOM 2030 O ARG A 123 -11.389 16.448 15.743 1.00 0.00 O ATOM 2031 CB ARG A 123 -11.016 16.936 12.970 1.00 0.00 C ATOM 2032 CG ARG A 123 -11.436 15.509 12.572 1.00 0.00 C ATOM 2033 CD ARG A 123 -12.446 15.577 11.421 1.00 0.00 C ATOM 2034 NE ARG A 123 -13.213 14.336 11.291 1.00 0.00 N ATOM 2035 CZ ARG A 123 -14.393 14.234 10.655 1.00 0.00 C ATOM 2036 NH1 ARG A 123 -14.879 15.250 9.925 1.00 0.00 N ATOM 2037 NH2 ARG A 123 -15.102 13.107 10.778 1.00 0.00 N ATOM 0 H ARG A 123 -8.002 16.665 13.181 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.538 18.107 13.882 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -11.893 17.447 13.367 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -10.721 17.466 12.064 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -10.562 14.932 12.270 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -11.876 14.996 13.427 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -13.129 16.410 11.587 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -11.920 15.777 10.488 1.00 0.00 H new ATOM 0 HE ARG A 123 -12.825 13.492 11.712 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -14.351 16.119 9.845 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -15.776 15.153 9.450 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -14.746 12.340 11.348 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -15.999 13.014 10.302 1.00 0.00 H new ATOM 2051 N PRO A 124 -9.492 17.507 16.366 1.00 0.00 N ATOM 2052 CA PRO A 124 -9.777 17.474 17.785 1.00 0.00 C ATOM 2053 C PRO A 124 -10.891 18.412 18.240 1.00 0.00 C ATOM 2054 O PRO A 124 -10.927 18.829 19.394 1.00 0.00 O ATOM 2055 CB PRO A 124 -8.433 17.750 18.469 1.00 0.00 C ATOM 2056 CG PRO A 124 -7.780 18.711 17.479 1.00 0.00 C ATOM 2057 CD PRO A 124 -8.209 18.153 16.124 1.00 0.00 C ATOM 0 HA PRO A 124 -10.185 16.503 18.065 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -8.559 18.199 19.454 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -7.848 16.841 18.605 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -8.126 19.735 17.622 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -6.695 18.724 17.585 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -8.301 18.947 15.383 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -7.476 17.443 15.741 1.00 0.00 H new ATOM 2065 N ASP A 125 -11.830 18.701 17.342 1.00 0.00 N ATOM 2066 CA ASP A 125 -13.007 19.490 17.629 1.00 0.00 C ATOM 2067 C ASP A 125 -14.209 18.962 16.829 1.00 0.00 C ATOM 2068 O ASP A 125 -15.288 19.546 16.871 1.00 0.00 O ATOM 2069 CB ASP A 125 -12.667 20.977 17.467 1.00 0.00 C ATOM 2070 CG ASP A 125 -13.627 21.913 18.190 1.00 0.00 C ATOM 2071 OD1 ASP A 125 -13.899 21.634 19.378 1.00 0.00 O ATOM 2072 OD2 ASP A 125 -14.008 22.935 17.583 1.00 0.00 O ATOM 0 H ASP A 125 -11.785 18.382 16.374 1.00 0.00 H new ATOM 0 HA ASP A 125 -13.326 19.389 18.666 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -11.657 21.151 17.838 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -12.664 21.225 16.406 1.00 0.00 H new ATOM 2077 N ASP A 126 -14.032 17.824 16.134 1.00 0.00 N ATOM 2078 CA ASP A 126 -15.058 17.115 15.387 1.00 0.00 C ATOM 2079 C ASP A 126 -15.490 15.910 16.224 1.00 0.00 C ATOM 2080 O ASP A 126 -16.679 15.748 16.497 1.00 0.00 O ATOM 2081 CB ASP A 126 -14.480 16.629 14.051 1.00 0.00 C ATOM 2082 CG ASP A 126 -15.317 15.545 13.375 1.00 0.00 C ATOM 2083 OD1 ASP A 126 -15.022 14.360 13.637 1.00 0.00 O ATOM 2084 OD2 ASP A 126 -16.188 15.902 12.554 1.00 0.00 O ATOM 0 H ASP A 126 -13.124 17.362 16.083 1.00 0.00 H new ATOM 0 HA ASP A 126 -15.906 17.769 15.185 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -14.389 17.479 13.375 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -13.474 16.246 14.219 1.00 0.00 H new