USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1104 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 32 TYR OH : rot 73:sc= -3.79! USER MOD Set 1.2: A 34 SER OG : rot -69:sc= 1.09 USER MOD Set 1.3: A 36 HIS : no HE2:sc= -4.26! C(o=-10!,f=-7.7!) USER MOD Set 1.4: A 41 CYS SG : rot -85:sc= -3.5! USER MOD Set 1.5: A 45 THR OG1 : rot 170:sc= 0.136 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= 0 (180deg=-0.0178) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -178:sc= -3.84! (180deg=-3.91!) USER MOD Single : A 12 LYS NZ :NH3+ -164:sc= -0.0579 (180deg=-0.709) USER MOD Single : A 13 ASN : amide:sc=-0.00275 K(o=-0.0027,f=-0.51) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -2.42! C(o=-2.4!,f=-2.5!) USER MOD Single : A 20 ASN : amide:sc= -0.253 K(o=-0.25,f=-3!) USER MOD Single : A 24 LYS NZ :NH3+ -164:sc= -0.378 (180deg=-1.02) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG : rot -108:sc= -2.51! USER MOD Single : A 51 MET CE :methyl 173:sc=-0.00234 (180deg=-0.0346) USER MOD Single : A 52 TYR OH : rot 125:sc= 0.198 USER MOD Single : A 53 SER OG : rot 18:sc= 1.02 USER MOD Single : A 59 SER OG : rot -50:sc= 0.0148 USER MOD Single : A 68 SER OG : rot -50:sc= -4! USER MOD Single : A 69 SER OG : rot 180:sc= 0.895 USER MOD Single : A 72 SER OG : rot -152:sc= -0.382! USER MOD Single : A 76 MET CE :methyl -104:sc= -0.915 (180deg=-4.85!) USER MOD Single : A 78 GLN : amide:sc= -2.53! K(o=-2.5!,f=-0.21) USER MOD Single : A 79 TYR OH : rot 65:sc= 0.195 USER MOD Single : A 80 MET CE :methyl -168:sc= -1.77 (180deg=-2.12) USER MOD Single : A 81 MET CE :methyl -149:sc= -0.439 (180deg=-2.48!) USER MOD Single : A 83 SER OG : rot 79:sc= 0.339 USER MOD Single : A 84 HIS : no HE2:sc= -12.7! C(o=-13!,f=-14!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -71:sc= -0.927 USER MOD Single : A 98 SER OG : rot -65:sc= 0.323 USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0359 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 62:sc= 0.994 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -129:sc= -0.0221 (180deg=-0.267) USER MOD Single : A 120 THR OG1 : rot -170:sc= -1.06! USER MOD Single : A 123 SER OG : rot 129:sc= 0.177 USER MOD Single : A 124 MET CE :methyl -101:sc= -12.1! (180deg=-15.6!) USER MOD Single : A 125 ASN : amide:sc= -0.0229 X(o=-0.023,f=0) USER MOD Single : A 131 GLN : amide:sc= -6.23! C(o=-6.2!,f=-12!) USER MOD Single : A 132 SER OG : rot 59:sc= 0.373! USER MOD Single : A 139 GLN : amide:sc= -1.05 K(o=-1.1,f=0) USER MOD Single : A 140 ASN : amide:sc= -7.3! C(o=-7.3!,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 103.489 -7.667 7.438 1.00 0.00 N ATOM 2 CA MET A 1 102.552 -8.825 7.462 1.00 0.00 C ATOM 3 C MET A 1 103.125 -9.957 6.616 1.00 0.00 C ATOM 4 O MET A 1 102.853 -10.049 5.419 1.00 0.00 O ATOM 5 CB MET A 1 101.194 -8.392 6.905 1.00 0.00 C ATOM 6 CG MET A 1 100.521 -7.431 7.887 1.00 0.00 C ATOM 7 SD MET A 1 100.350 -5.803 7.115 1.00 0.00 S ATOM 8 CE MET A 1 98.920 -5.246 8.074 1.00 0.00 C ATOM 0 H1 MET A 1 103.161 -6.941 8.106 1.00 0.00 H new ATOM 0 H2 MET A 1 104.441 -7.985 7.712 1.00 0.00 H new ATOM 0 H3 MET A 1 103.521 -7.266 6.479 1.00 0.00 H new ATOM 0 HA MET A 1 102.423 -9.173 8.487 1.00 0.00 H new ATOM 0 HB2 MET A 1 101.324 -7.908 5.937 1.00 0.00 H new ATOM 0 HB3 MET A 1 100.561 -9.264 6.742 1.00 0.00 H new ATOM 0 HG2 MET A 1 99.542 -7.814 8.174 1.00 0.00 H new ATOM 0 HG3 MET A 1 101.113 -7.353 8.799 1.00 0.00 H new ATOM 0 HE1 MET A 1 98.637 -4.242 7.756 1.00 0.00 H new ATOM 0 HE2 MET A 1 98.085 -5.927 7.911 1.00 0.00 H new ATOM 0 HE3 MET A 1 99.175 -5.233 9.134 1.00 0.00 H new ATOM 20 N GLU A 2 103.920 -10.816 7.246 1.00 0.00 N ATOM 21 CA GLU A 2 104.526 -11.939 6.540 1.00 0.00 C ATOM 22 C GLU A 2 104.731 -11.599 5.067 1.00 0.00 C ATOM 23 O GLU A 2 105.762 -11.045 4.686 1.00 0.00 O ATOM 24 CB GLU A 2 103.634 -13.175 6.662 1.00 0.00 C ATOM 25 CG GLU A 2 102.241 -12.755 7.138 1.00 0.00 C ATOM 26 CD GLU A 2 101.361 -13.986 7.327 1.00 0.00 C ATOM 27 OE1 GLU A 2 101.445 -14.882 6.504 1.00 0.00 O ATOM 28 OE2 GLU A 2 100.616 -14.014 8.293 1.00 0.00 O ATOM 0 H GLU A 2 104.158 -10.757 8.236 1.00 0.00 H new ATOM 0 HA GLU A 2 105.496 -12.146 6.991 1.00 0.00 H new ATOM 0 HB2 GLU A 2 103.563 -13.682 5.700 1.00 0.00 H new ATOM 0 HB3 GLU A 2 104.071 -13.884 7.365 1.00 0.00 H new ATOM 0 HG2 GLU A 2 102.319 -12.206 8.076 1.00 0.00 H new ATOM 0 HG3 GLU A 2 101.787 -12.081 6.411 1.00 0.00 H new ATOM 35 N PHE A 3 103.744 -11.936 4.244 1.00 0.00 N ATOM 36 CA PHE A 3 103.827 -11.661 2.815 1.00 0.00 C ATOM 37 C PHE A 3 104.293 -10.229 2.571 1.00 0.00 C ATOM 38 O PHE A 3 103.690 -9.278 3.066 1.00 0.00 O ATOM 39 CB PHE A 3 102.460 -11.874 2.161 1.00 0.00 C ATOM 40 CG PHE A 3 101.379 -11.763 3.209 1.00 0.00 C ATOM 41 CD1 PHE A 3 100.981 -12.897 3.928 1.00 0.00 C ATOM 42 CD2 PHE A 3 100.773 -10.527 3.461 1.00 0.00 C ATOM 43 CE1 PHE A 3 99.978 -12.794 4.899 1.00 0.00 C ATOM 44 CE2 PHE A 3 99.770 -10.423 4.433 1.00 0.00 C ATOM 45 CZ PHE A 3 99.373 -11.557 5.152 1.00 0.00 C ATOM 0 H PHE A 3 102.883 -12.397 4.539 1.00 0.00 H new ATOM 0 HA PHE A 3 104.551 -12.346 2.374 1.00 0.00 H new ATOM 0 HB2 PHE A 3 102.300 -11.133 1.378 1.00 0.00 H new ATOM 0 HB3 PHE A 3 102.421 -12.854 1.685 1.00 0.00 H new ATOM 0 HD1 PHE A 3 101.448 -13.851 3.733 1.00 0.00 H new ATOM 0 HD2 PHE A 3 101.079 -9.653 2.906 1.00 0.00 H new ATOM 0 HE1 PHE A 3 99.671 -13.669 5.453 1.00 0.00 H new ATOM 0 HE2 PHE A 3 99.303 -9.469 4.628 1.00 0.00 H new ATOM 0 HZ PHE A 3 98.600 -11.477 5.902 1.00 0.00 H new ATOM 55 N ILE A 4 105.369 -10.086 1.804 1.00 0.00 N ATOM 56 CA ILE A 4 105.906 -8.764 1.501 1.00 0.00 C ATOM 57 C ILE A 4 104.872 -7.920 0.766 1.00 0.00 C ATOM 58 O ILE A 4 104.476 -6.854 1.237 1.00 0.00 O ATOM 59 CB ILE A 4 107.165 -8.896 0.641 1.00 0.00 C ATOM 60 CG1 ILE A 4 107.205 -10.290 0.010 1.00 0.00 C ATOM 61 CG2 ILE A 4 108.405 -8.696 1.515 1.00 0.00 C ATOM 62 CD1 ILE A 4 108.163 -10.281 -1.183 1.00 0.00 C ATOM 0 H ILE A 4 105.882 -10.861 1.384 1.00 0.00 H new ATOM 0 HA ILE A 4 106.158 -8.272 2.440 1.00 0.00 H new ATOM 0 HB ILE A 4 107.150 -8.140 -0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 4 107.530 -11.025 0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 4 106.206 -10.583 -0.314 1.00 0.00 H new ATOM 0 HG21 ILE A 4 109.301 -8.790 0.902 1.00 0.00 H new ATOM 0 HG22 ILE A 4 108.376 -7.704 1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 4 108.422 -9.451 2.301 1.00 0.00 H new ATOM 0 HD11 ILE A 4 108.193 -11.273 -1.633 1.00 0.00 H new ATOM 0 HD12 ILE A 4 107.818 -9.557 -1.921 1.00 0.00 H new ATOM 0 HD13 ILE A 4 109.162 -10.006 -0.845 1.00 0.00 H new ATOM 74 N GLN A 5 104.441 -8.406 -0.390 1.00 0.00 N ATOM 75 CA GLN A 5 103.452 -7.690 -1.189 1.00 0.00 C ATOM 76 C GLN A 5 102.469 -6.950 -0.288 1.00 0.00 C ATOM 77 O GLN A 5 101.789 -7.558 0.539 1.00 0.00 O ATOM 78 CB GLN A 5 102.690 -8.674 -2.080 1.00 0.00 C ATOM 79 CG GLN A 5 102.071 -9.774 -1.215 1.00 0.00 C ATOM 80 CD GLN A 5 100.558 -9.795 -1.402 1.00 0.00 C ATOM 81 OE1 GLN A 5 100.072 -9.964 -2.519 1.00 0.00 O ATOM 82 NE2 GLN A 5 99.779 -9.630 -0.367 1.00 0.00 N ATOM 0 H GLN A 5 104.757 -9.287 -0.795 1.00 0.00 H new ATOM 0 HA GLN A 5 103.973 -6.963 -1.813 1.00 0.00 H new ATOM 0 HB2 GLN A 5 101.911 -8.151 -2.634 1.00 0.00 H new ATOM 0 HB3 GLN A 5 103.365 -9.112 -2.816 1.00 0.00 H new ATOM 0 HG2 GLN A 5 102.493 -10.742 -1.486 1.00 0.00 H new ATOM 0 HG3 GLN A 5 102.314 -9.603 -0.166 1.00 0.00 H new ATOM 0 HE21 GLN A 5 100.184 -9.490 0.559 1.00 0.00 H new ATOM 0 HE22 GLN A 5 98.766 -9.641 -0.484 1.00 0.00 H new ATOM 91 N GLY A 6 102.401 -5.633 -0.453 1.00 0.00 N ATOM 92 CA GLY A 6 101.498 -4.817 0.352 1.00 0.00 C ATOM 93 C GLY A 6 102.264 -3.724 1.089 1.00 0.00 C ATOM 94 O GLY A 6 101.670 -2.887 1.770 1.00 0.00 O ATOM 0 H GLY A 6 102.956 -5.111 -1.131 1.00 0.00 H new ATOM 0 HA2 GLY A 6 100.740 -4.367 -0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 6 100.975 -5.448 1.071 1.00 0.00 H new ATOM 98 N ILE A 7 103.585 -3.738 0.948 1.00 0.00 N ATOM 99 CA ILE A 7 104.425 -2.752 1.599 1.00 0.00 C ATOM 100 C ILE A 7 105.000 -1.778 0.575 1.00 0.00 C ATOM 101 O ILE A 7 104.709 -1.873 -0.617 1.00 0.00 O ATOM 102 CB ILE A 7 105.565 -3.456 2.327 1.00 0.00 C ATOM 103 CG1 ILE A 7 106.320 -4.354 1.343 1.00 0.00 C ATOM 104 CG2 ILE A 7 105.002 -4.306 3.467 1.00 0.00 C ATOM 105 CD1 ILE A 7 107.381 -5.158 2.096 1.00 0.00 C ATOM 0 H ILE A 7 104.093 -4.423 0.388 1.00 0.00 H new ATOM 0 HA ILE A 7 103.820 -2.193 2.313 1.00 0.00 H new ATOM 0 HB ILE A 7 106.247 -2.711 2.737 1.00 0.00 H new ATOM 0 HG12 ILE A 7 105.625 -5.028 0.843 1.00 0.00 H new ATOM 0 HG13 ILE A 7 106.790 -3.748 0.568 1.00 0.00 H new ATOM 0 HG21 ILE A 7 105.820 -4.808 3.985 1.00 0.00 H new ATOM 0 HG22 ILE A 7 104.467 -3.666 4.168 1.00 0.00 H new ATOM 0 HG23 ILE A 7 104.318 -5.051 3.061 1.00 0.00 H new ATOM 0 HD11 ILE A 7 107.918 -5.797 1.395 1.00 0.00 H new ATOM 0 HD12 ILE A 7 108.082 -4.475 2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 7 106.899 -5.775 2.854 1.00 0.00 H new ATOM 117 N LYS A 8 105.821 -0.846 1.049 1.00 0.00 N ATOM 118 CA LYS A 8 106.436 0.135 0.164 1.00 0.00 C ATOM 119 C LYS A 8 107.735 -0.415 -0.415 1.00 0.00 C ATOM 120 O LYS A 8 108.234 -1.446 0.033 1.00 0.00 O ATOM 121 CB LYS A 8 106.723 1.427 0.933 1.00 0.00 C ATOM 122 CG LYS A 8 105.444 1.904 1.625 1.00 0.00 C ATOM 123 CD LYS A 8 105.122 0.981 2.801 1.00 0.00 C ATOM 124 CE LYS A 8 104.575 1.807 3.965 1.00 0.00 C ATOM 125 NZ LYS A 8 103.921 0.903 4.953 1.00 0.00 N ATOM 0 H LYS A 8 106.074 -0.750 2.033 1.00 0.00 H new ATOM 0 HA LYS A 8 105.746 0.347 -0.652 1.00 0.00 H new ATOM 0 HB2 LYS A 8 107.507 1.257 1.671 1.00 0.00 H new ATOM 0 HB3 LYS A 8 107.088 2.195 0.251 1.00 0.00 H new ATOM 0 HG2 LYS A 8 105.569 2.928 1.977 1.00 0.00 H new ATOM 0 HG3 LYS A 8 104.616 1.910 0.917 1.00 0.00 H new ATOM 0 HD2 LYS A 8 104.391 0.231 2.499 1.00 0.00 H new ATOM 0 HD3 LYS A 8 106.019 0.445 3.112 1.00 0.00 H new ATOM 0 HE2 LYS A 8 105.383 2.361 4.443 1.00 0.00 H new ATOM 0 HE3 LYS A 8 103.858 2.541 3.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 103.549 1.465 5.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 103.140 0.393 4.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 104.617 0.219 5.311 1.00 0.00 H new ATOM 139 N LEU A 9 108.281 0.284 -1.405 1.00 0.00 N ATOM 140 CA LEU A 9 109.528 -0.139 -2.033 1.00 0.00 C ATOM 141 C LEU A 9 110.216 1.055 -2.690 1.00 0.00 C ATOM 142 O LEU A 9 109.573 2.066 -2.972 1.00 0.00 O ATOM 143 CB LEU A 9 109.252 -1.221 -3.080 1.00 0.00 C ATOM 144 CG LEU A 9 110.053 -2.480 -2.735 1.00 0.00 C ATOM 145 CD1 LEU A 9 109.496 -3.111 -1.458 1.00 0.00 C ATOM 146 CD2 LEU A 9 109.942 -3.486 -3.880 1.00 0.00 C ATOM 0 H LEU A 9 107.882 1.141 -1.788 1.00 0.00 H new ATOM 0 HA LEU A 9 110.184 -0.549 -1.265 1.00 0.00 H new ATOM 0 HB2 LEU A 9 108.187 -1.451 -3.109 1.00 0.00 H new ATOM 0 HB3 LEU A 9 109.528 -0.862 -4.071 1.00 0.00 H new ATOM 0 HG LEU A 9 111.098 -2.209 -2.583 1.00 0.00 H new ATOM 0 HD11 LEU A 9 110.068 -4.007 -1.215 1.00 0.00 H new ATOM 0 HD12 LEU A 9 109.572 -2.398 -0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 9 108.450 -3.379 -1.611 1.00 0.00 H new ATOM 0 HD21 LEU A 9 110.512 -4.382 -3.634 1.00 0.00 H new ATOM 0 HD22 LEU A 9 108.896 -3.752 -4.031 1.00 0.00 H new ATOM 0 HD23 LEU A 9 110.339 -3.043 -4.793 1.00 0.00 H new ATOM 158 N VAL A 10 111.523 0.947 -2.921 1.00 0.00 N ATOM 159 CA VAL A 10 112.261 2.047 -3.532 1.00 0.00 C ATOM 160 C VAL A 10 112.940 1.612 -4.828 1.00 0.00 C ATOM 161 O VAL A 10 113.836 0.769 -4.820 1.00 0.00 O ATOM 162 CB VAL A 10 113.316 2.571 -2.557 1.00 0.00 C ATOM 163 CG1 VAL A 10 114.194 3.606 -3.262 1.00 0.00 C ATOM 164 CG2 VAL A 10 112.620 3.226 -1.361 1.00 0.00 C ATOM 0 H VAL A 10 112.083 0.124 -2.699 1.00 0.00 H new ATOM 0 HA VAL A 10 111.548 2.837 -3.767 1.00 0.00 H new ATOM 0 HB VAL A 10 113.936 1.743 -2.212 1.00 0.00 H new ATOM 0 HG11 VAL A 10 114.946 3.979 -2.567 1.00 0.00 H new ATOM 0 HG12 VAL A 10 114.688 3.143 -4.116 1.00 0.00 H new ATOM 0 HG13 VAL A 10 113.575 4.434 -3.606 1.00 0.00 H new ATOM 0 HG21 VAL A 10 113.370 3.601 -0.664 1.00 0.00 H new ATOM 0 HG22 VAL A 10 112.002 4.054 -1.708 1.00 0.00 H new ATOM 0 HG23 VAL A 10 111.992 2.491 -0.858 1.00 0.00 H new ATOM 174 N LYS A 11 112.512 2.204 -5.941 1.00 0.00 N ATOM 175 CA LYS A 11 113.090 1.883 -7.241 1.00 0.00 C ATOM 176 C LYS A 11 114.486 2.485 -7.364 1.00 0.00 C ATOM 177 O LYS A 11 114.725 3.613 -6.930 1.00 0.00 O ATOM 178 CB LYS A 11 112.203 2.426 -8.363 1.00 0.00 C ATOM 179 CG LYS A 11 110.735 2.340 -7.943 1.00 0.00 C ATOM 180 CD LYS A 11 109.845 2.744 -9.121 1.00 0.00 C ATOM 181 CE LYS A 11 109.487 1.503 -9.942 1.00 0.00 C ATOM 182 NZ LYS A 11 110.632 0.549 -9.929 1.00 0.00 N ATOM 0 H LYS A 11 111.771 2.905 -5.968 1.00 0.00 H new ATOM 0 HA LYS A 11 113.158 0.799 -7.327 1.00 0.00 H new ATOM 0 HB2 LYS A 11 112.469 3.460 -8.583 1.00 0.00 H new ATOM 0 HB3 LYS A 11 112.364 1.854 -9.277 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.496 1.326 -7.623 1.00 0.00 H new ATOM 0 HG3 LYS A 11 110.550 2.995 -7.092 1.00 0.00 H new ATOM 0 HD2 LYS A 11 108.938 3.225 -8.756 1.00 0.00 H new ATOM 0 HD3 LYS A 11 110.362 3.471 -9.748 1.00 0.00 H new ATOM 0 HE2 LYS A 11 108.598 1.026 -9.530 1.00 0.00 H new ATOM 0 HE3 LYS A 11 109.250 1.788 -10.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 110.401 -0.279 -10.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 111.479 1.018 -10.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 110.817 0.241 -8.953 1.00 0.00 H new ATOM 196 N LYS A 12 115.400 1.726 -7.960 1.00 0.00 N ATOM 197 CA LYS A 12 116.771 2.191 -8.135 1.00 0.00 C ATOM 198 C LYS A 12 116.791 3.652 -8.569 1.00 0.00 C ATOM 199 O LYS A 12 117.685 4.409 -8.194 1.00 0.00 O ATOM 200 CB LYS A 12 117.481 1.335 -9.186 1.00 0.00 C ATOM 201 CG LYS A 12 116.630 1.276 -10.456 1.00 0.00 C ATOM 202 CD LYS A 12 117.454 0.673 -11.595 1.00 0.00 C ATOM 203 CE LYS A 12 116.672 0.783 -12.905 1.00 0.00 C ATOM 204 NZ LYS A 12 115.316 0.192 -12.725 1.00 0.00 N ATOM 0 H LYS A 12 115.218 0.792 -8.328 1.00 0.00 H new ATOM 0 HA LYS A 12 117.290 2.101 -7.181 1.00 0.00 H new ATOM 0 HB2 LYS A 12 118.461 1.756 -9.411 1.00 0.00 H new ATOM 0 HB3 LYS A 12 117.647 0.329 -8.800 1.00 0.00 H new ATOM 0 HG2 LYS A 12 115.738 0.675 -10.281 1.00 0.00 H new ATOM 0 HG3 LYS A 12 116.293 2.276 -10.727 1.00 0.00 H new ATOM 0 HD2 LYS A 12 118.407 1.194 -11.684 1.00 0.00 H new ATOM 0 HD3 LYS A 12 117.680 -0.372 -11.381 1.00 0.00 H new ATOM 0 HE2 LYS A 12 116.588 1.828 -13.204 1.00 0.00 H new ATOM 0 HE3 LYS A 12 117.203 0.264 -13.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 114.887 0.017 -13.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 115.395 -0.706 -12.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 114.718 0.852 -12.187 1.00 0.00 H new ATOM 218 N ASN A 13 115.796 4.045 -9.356 1.00 0.00 N ATOM 219 CA ASN A 13 115.709 5.421 -9.827 1.00 0.00 C ATOM 220 C ASN A 13 115.389 6.355 -8.664 1.00 0.00 C ATOM 221 O ASN A 13 114.928 7.478 -8.864 1.00 0.00 O ATOM 222 CB ASN A 13 114.623 5.543 -10.897 1.00 0.00 C ATOM 223 CG ASN A 13 115.033 4.769 -12.145 1.00 0.00 C ATOM 224 OD1 ASN A 13 116.169 4.889 -12.606 1.00 0.00 O ATOM 225 ND2 ASN A 13 114.172 3.978 -12.724 1.00 0.00 N ATOM 0 H ASN A 13 115.044 3.436 -9.679 1.00 0.00 H new ATOM 0 HA ASN A 13 116.670 5.703 -10.258 1.00 0.00 H new ATOM 0 HB2 ASN A 13 113.678 5.158 -10.514 1.00 0.00 H new ATOM 0 HB3 ASN A 13 114.462 6.592 -11.146 1.00 0.00 H new ATOM 0 HD21 ASN A 13 114.439 3.458 -13.560 1.00 0.00 H new ATOM 0 HD22 ASN A 13 113.232 3.880 -12.341 1.00 0.00 H new ATOM 232 N ARG A 14 115.637 5.878 -7.448 1.00 0.00 N ATOM 233 CA ARG A 14 115.369 6.673 -6.256 1.00 0.00 C ATOM 234 C ARG A 14 113.872 6.922 -6.109 1.00 0.00 C ATOM 235 O ARG A 14 113.450 7.820 -5.380 1.00 0.00 O ATOM 236 CB ARG A 14 116.106 8.010 -6.343 1.00 0.00 C ATOM 237 CG ARG A 14 116.241 8.611 -4.942 1.00 0.00 C ATOM 238 CD ARG A 14 116.419 10.126 -5.051 1.00 0.00 C ATOM 239 NE ARG A 14 116.252 10.749 -3.742 1.00 0.00 N ATOM 240 CZ ARG A 14 116.692 11.980 -3.506 1.00 0.00 C ATOM 241 NH1 ARG A 14 117.286 12.654 -4.453 1.00 0.00 N ATOM 242 NH2 ARG A 14 116.531 12.516 -2.328 1.00 0.00 N ATOM 0 H ARG A 14 116.021 4.951 -7.263 1.00 0.00 H new ATOM 0 HA ARG A 14 115.723 6.122 -5.385 1.00 0.00 H new ATOM 0 HB2 ARG A 14 117.092 7.866 -6.785 1.00 0.00 H new ATOM 0 HB3 ARG A 14 115.562 8.695 -6.993 1.00 0.00 H new ATOM 0 HG2 ARG A 14 115.356 8.380 -4.349 1.00 0.00 H new ATOM 0 HG3 ARG A 14 117.094 8.170 -4.426 1.00 0.00 H new ATOM 0 HD2 ARG A 14 117.408 10.356 -5.447 1.00 0.00 H new ATOM 0 HD3 ARG A 14 115.692 10.535 -5.752 1.00 0.00 H new ATOM 0 HE ARG A 14 115.789 10.230 -2.995 1.00 0.00 H new ATOM 0 HH11 ARG A 14 117.412 12.235 -5.375 1.00 0.00 H new ATOM 0 HH12 ARG A 14 117.624 13.599 -4.271 1.00 0.00 H new ATOM 0 HH21 ARG A 14 116.067 11.990 -1.587 1.00 0.00 H new ATOM 0 HH22 ARG A 14 116.869 13.461 -2.147 1.00 0.00 H new ATOM 256 N CYS A 15 113.074 6.126 -6.814 1.00 0.00 N ATOM 257 CA CYS A 15 111.624 6.272 -6.762 1.00 0.00 C ATOM 258 C CYS A 15 111.026 5.345 -5.708 1.00 0.00 C ATOM 259 O CYS A 15 111.721 4.498 -5.149 1.00 0.00 O ATOM 260 CB CYS A 15 111.018 5.951 -8.129 1.00 0.00 C ATOM 261 SG CYS A 15 109.766 7.192 -8.540 1.00 0.00 S ATOM 0 H CYS A 15 113.404 5.378 -7.424 1.00 0.00 H new ATOM 0 HA CYS A 15 111.392 7.303 -6.494 1.00 0.00 H new ATOM 0 HB2 CYS A 15 111.798 5.939 -8.891 1.00 0.00 H new ATOM 0 HB3 CYS A 15 110.570 4.957 -8.116 1.00 0.00 H new ATOM 0 HG CYS A 15 109.252 6.921 -9.703 1.00 0.00 H new ATOM 267 N GLU A 16 109.734 5.514 -5.444 1.00 0.00 N ATOM 268 CA GLU A 16 109.052 4.687 -4.457 1.00 0.00 C ATOM 269 C GLU A 16 107.821 4.027 -5.069 1.00 0.00 C ATOM 270 O GLU A 16 107.149 4.611 -5.919 1.00 0.00 O ATOM 271 CB GLU A 16 108.636 5.539 -3.257 1.00 0.00 C ATOM 272 CG GLU A 16 107.810 6.732 -3.741 1.00 0.00 C ATOM 273 CD GLU A 16 107.315 7.543 -2.550 1.00 0.00 C ATOM 274 OE1 GLU A 16 106.824 6.939 -1.611 1.00 0.00 O ATOM 275 OE2 GLU A 16 107.434 8.756 -2.592 1.00 0.00 O ATOM 0 H GLU A 16 109.143 6.211 -5.897 1.00 0.00 H new ATOM 0 HA GLU A 16 109.740 3.909 -4.126 1.00 0.00 H new ATOM 0 HB2 GLU A 16 108.054 4.940 -2.557 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.519 5.888 -2.721 1.00 0.00 H new ATOM 0 HG2 GLU A 16 108.414 7.362 -4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.962 6.382 -4.330 1.00 0.00 H new ATOM 282 N VAL A 17 107.532 2.804 -4.632 1.00 0.00 N ATOM 283 CA VAL A 17 106.380 2.070 -5.146 1.00 0.00 C ATOM 284 C VAL A 17 105.921 1.019 -4.140 1.00 0.00 C ATOM 285 O VAL A 17 106.590 0.771 -3.137 1.00 0.00 O ATOM 286 CB VAL A 17 106.742 1.386 -6.465 1.00 0.00 C ATOM 287 CG1 VAL A 17 106.438 2.329 -7.631 1.00 0.00 C ATOM 288 CG2 VAL A 17 108.231 1.037 -6.465 1.00 0.00 C ATOM 0 H VAL A 17 108.075 2.304 -3.928 1.00 0.00 H new ATOM 0 HA VAL A 17 105.569 2.779 -5.313 1.00 0.00 H new ATOM 0 HB VAL A 17 106.155 0.474 -6.575 1.00 0.00 H new ATOM 0 HG11 VAL A 17 106.696 1.841 -8.571 1.00 0.00 H new ATOM 0 HG12 VAL A 17 105.377 2.577 -7.631 1.00 0.00 H new ATOM 0 HG13 VAL A 17 107.024 3.242 -7.523 1.00 0.00 H new ATOM 0 HG21 VAL A 17 108.490 0.549 -7.405 1.00 0.00 H new ATOM 0 HG22 VAL A 17 108.818 1.949 -6.355 1.00 0.00 H new ATOM 0 HG23 VAL A 17 108.447 0.364 -5.635 1.00 0.00 H new ATOM 298 N ASN A 18 104.777 0.403 -4.419 1.00 0.00 N ATOM 299 CA ASN A 18 104.236 -0.622 -3.537 1.00 0.00 C ATOM 300 C ASN A 18 104.663 -2.010 -4.007 1.00 0.00 C ATOM 301 O ASN A 18 104.251 -2.468 -5.073 1.00 0.00 O ATOM 302 CB ASN A 18 102.709 -0.537 -3.511 1.00 0.00 C ATOM 303 CG ASN A 18 102.214 -0.470 -2.070 1.00 0.00 C ATOM 304 OD1 ASN A 18 102.572 -1.314 -1.249 1.00 0.00 O ATOM 305 ND2 ASN A 18 101.407 0.491 -1.711 1.00 0.00 N ATOM 0 H ASN A 18 104.210 0.595 -5.245 1.00 0.00 H new ATOM 0 HA ASN A 18 104.625 -0.454 -2.533 1.00 0.00 H new ATOM 0 HB2 ASN A 18 102.376 0.344 -4.060 1.00 0.00 H new ATOM 0 HB3 ASN A 18 102.280 -1.405 -4.012 1.00 0.00 H new ATOM 0 HD21 ASN A 18 101.072 0.543 -0.749 1.00 0.00 H new ATOM 0 HD22 ASN A 18 101.111 1.190 -2.393 1.00 0.00 H new ATOM 312 N ALA A 19 105.492 -2.672 -3.207 1.00 0.00 N ATOM 313 CA ALA A 19 105.972 -4.006 -3.552 1.00 0.00 C ATOM 314 C ALA A 19 104.885 -4.806 -4.264 1.00 0.00 C ATOM 315 O ALA A 19 105.179 -5.732 -5.019 1.00 0.00 O ATOM 316 CB ALA A 19 106.409 -4.748 -2.288 1.00 0.00 C ATOM 0 H ALA A 19 105.844 -2.310 -2.321 1.00 0.00 H new ATOM 0 HA ALA A 19 106.823 -3.899 -4.224 1.00 0.00 H new ATOM 0 HB1 ALA A 19 106.766 -5.743 -2.555 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.211 -4.194 -1.800 1.00 0.00 H new ATOM 0 HB3 ALA A 19 105.562 -4.837 -1.607 1.00 0.00 H new ATOM 322 N ASN A 20 103.630 -4.445 -4.021 1.00 0.00 N ATOM 323 CA ASN A 20 102.514 -5.142 -4.648 1.00 0.00 C ATOM 324 C ASN A 20 102.675 -5.145 -6.164 1.00 0.00 C ATOM 325 O ASN A 20 102.734 -6.202 -6.792 1.00 0.00 O ATOM 326 CB ASN A 20 101.196 -4.463 -4.272 1.00 0.00 C ATOM 327 CG ASN A 20 100.274 -5.460 -3.576 1.00 0.00 C ATOM 328 OD1 ASN A 20 100.082 -5.387 -2.362 1.00 0.00 O ATOM 329 ND2 ASN A 20 99.690 -6.393 -4.276 1.00 0.00 N ATOM 0 H ASN A 20 103.362 -3.681 -3.400 1.00 0.00 H new ATOM 0 HA ASN A 20 102.503 -6.172 -4.292 1.00 0.00 H new ATOM 0 HB2 ASN A 20 101.389 -3.614 -3.616 1.00 0.00 H new ATOM 0 HB3 ASN A 20 100.712 -4.071 -5.166 1.00 0.00 H new ATOM 0 HD21 ASN A 20 99.073 -7.064 -3.818 1.00 0.00 H new ATOM 0 HD22 ASN A 20 99.850 -6.452 -5.282 1.00 0.00 H new ATOM 336 N GLU A 21 102.745 -3.953 -6.744 1.00 0.00 N ATOM 337 CA GLU A 21 102.901 -3.823 -8.187 1.00 0.00 C ATOM 338 C GLU A 21 104.368 -3.627 -8.554 1.00 0.00 C ATOM 339 O GLU A 21 104.790 -3.956 -9.663 1.00 0.00 O ATOM 340 CB GLU A 21 102.082 -2.633 -8.694 1.00 0.00 C ATOM 341 CG GLU A 21 100.943 -2.342 -7.716 1.00 0.00 C ATOM 342 CD GLU A 21 101.424 -1.395 -6.622 1.00 0.00 C ATOM 343 OE1 GLU A 21 102.444 -0.757 -6.825 1.00 0.00 O ATOM 344 OE2 GLU A 21 100.766 -1.320 -5.598 1.00 0.00 O ATOM 0 H GLU A 21 102.697 -3.067 -6.240 1.00 0.00 H new ATOM 0 HA GLU A 21 102.542 -4.739 -8.656 1.00 0.00 H new ATOM 0 HB2 GLU A 21 102.721 -1.756 -8.796 1.00 0.00 H new ATOM 0 HB3 GLU A 21 101.679 -2.851 -9.683 1.00 0.00 H new ATOM 0 HG2 GLU A 21 100.101 -1.899 -8.247 1.00 0.00 H new ATOM 0 HG3 GLU A 21 100.587 -3.272 -7.273 1.00 0.00 H new ATOM 351 N ALA A 22 105.138 -3.087 -7.617 1.00 0.00 N ATOM 352 CA ALA A 22 106.557 -2.846 -7.852 1.00 0.00 C ATOM 353 C ALA A 22 107.269 -4.139 -8.234 1.00 0.00 C ATOM 354 O ALA A 22 107.999 -4.189 -9.223 1.00 0.00 O ATOM 355 CB ALA A 22 107.202 -2.259 -6.596 1.00 0.00 C ATOM 0 H ALA A 22 104.807 -2.809 -6.693 1.00 0.00 H new ATOM 0 HA ALA A 22 106.652 -2.138 -8.675 1.00 0.00 H new ATOM 0 HB1 ALA A 22 108.262 -2.082 -6.780 1.00 0.00 H new ATOM 0 HB2 ALA A 22 106.715 -1.317 -6.343 1.00 0.00 H new ATOM 0 HB3 ALA A 22 107.089 -2.959 -5.768 1.00 0.00 H new ATOM 361 N LEU A 23 107.053 -5.180 -7.442 1.00 0.00 N ATOM 362 CA LEU A 23 107.683 -6.469 -7.703 1.00 0.00 C ATOM 363 C LEU A 23 107.091 -7.111 -8.952 1.00 0.00 C ATOM 364 O LEU A 23 107.194 -8.323 -9.144 1.00 0.00 O ATOM 365 CB LEU A 23 107.486 -7.402 -6.505 1.00 0.00 C ATOM 366 CG LEU A 23 108.834 -7.650 -5.823 1.00 0.00 C ATOM 367 CD1 LEU A 23 109.267 -6.389 -5.073 1.00 0.00 C ATOM 368 CD2 LEU A 23 108.696 -8.809 -4.832 1.00 0.00 C ATOM 0 H LEU A 23 106.451 -5.159 -6.619 1.00 0.00 H new ATOM 0 HA LEU A 23 108.749 -6.304 -7.862 1.00 0.00 H new ATOM 0 HB2 LEU A 23 106.785 -6.960 -5.798 1.00 0.00 H new ATOM 0 HB3 LEU A 23 107.054 -8.347 -6.834 1.00 0.00 H new ATOM 0 HG LEU A 23 109.582 -7.899 -6.576 1.00 0.00 H new ATOM 0 HD11 LEU A 23 110.227 -6.566 -4.588 1.00 0.00 H new ATOM 0 HD12 LEU A 23 109.363 -5.562 -5.777 1.00 0.00 H new ATOM 0 HD13 LEU A 23 108.520 -6.139 -4.320 1.00 0.00 H new ATOM 0 HD21 LEU A 23 109.655 -8.987 -4.345 1.00 0.00 H new ATOM 0 HD22 LEU A 23 107.948 -8.558 -4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 23 108.387 -9.708 -5.365 1.00 0.00 H new ATOM 380 N LYS A 24 106.473 -6.287 -9.795 1.00 0.00 N ATOM 381 CA LYS A 24 105.864 -6.776 -11.030 1.00 0.00 C ATOM 382 C LYS A 24 106.086 -8.278 -11.183 1.00 0.00 C ATOM 383 O LYS A 24 105.258 -9.079 -10.750 1.00 0.00 O ATOM 384 CB LYS A 24 106.460 -6.041 -12.232 1.00 0.00 C ATOM 385 CG LYS A 24 105.353 -5.288 -12.974 1.00 0.00 C ATOM 386 CD LYS A 24 105.849 -4.891 -14.366 1.00 0.00 C ATOM 387 CE LYS A 24 104.719 -4.203 -15.134 1.00 0.00 C ATOM 388 NZ LYS A 24 103.415 -4.816 -14.755 1.00 0.00 N ATOM 0 H LYS A 24 106.381 -5.282 -9.647 1.00 0.00 H new ATOM 0 HA LYS A 24 104.792 -6.585 -10.984 1.00 0.00 H new ATOM 0 HB2 LYS A 24 107.229 -5.343 -11.900 1.00 0.00 H new ATOM 0 HB3 LYS A 24 106.943 -6.752 -12.903 1.00 0.00 H new ATOM 0 HG2 LYS A 24 104.465 -5.915 -13.058 1.00 0.00 H new ATOM 0 HG3 LYS A 24 105.064 -4.400 -12.413 1.00 0.00 H new ATOM 0 HD2 LYS A 24 106.705 -4.222 -14.281 1.00 0.00 H new ATOM 0 HD3 LYS A 24 106.187 -5.774 -14.909 1.00 0.00 H new ATOM 0 HE2 LYS A 24 104.710 -3.136 -14.910 1.00 0.00 H new ATOM 0 HE3 LYS A 24 104.881 -4.302 -16.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 102.691 -4.552 -15.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 103.512 -5.851 -14.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 103.130 -4.473 -13.815 1.00 0.00 H new ATOM 402 N ASP A 25 107.208 -8.652 -11.793 1.00 0.00 N ATOM 403 CA ASP A 25 107.532 -10.062 -11.991 1.00 0.00 C ATOM 404 C ASP A 25 106.402 -10.786 -12.714 1.00 0.00 C ATOM 405 O ASP A 25 106.587 -11.285 -13.824 1.00 0.00 O ATOM 406 CB ASP A 25 107.793 -10.731 -10.638 1.00 0.00 C ATOM 407 CG ASP A 25 106.473 -11.028 -9.934 1.00 0.00 C ATOM 408 OD1 ASP A 25 105.864 -12.034 -10.261 1.00 0.00 O ATOM 409 OD2 ASP A 25 106.092 -10.247 -9.078 1.00 0.00 O ATOM 0 H ASP A 25 107.905 -8.002 -12.157 1.00 0.00 H new ATOM 0 HA ASP A 25 108.429 -10.123 -12.607 1.00 0.00 H new ATOM 0 HB2 ASP A 25 108.352 -11.655 -10.783 1.00 0.00 H new ATOM 0 HB3 ASP A 25 108.408 -10.081 -10.015 1.00 0.00 H new ATOM 414 N LYS A 26 105.235 -10.851 -12.081 1.00 0.00 N ATOM 415 CA LYS A 26 104.100 -11.530 -12.687 1.00 0.00 C ATOM 416 C LYS A 26 104.560 -12.844 -13.304 1.00 0.00 C ATOM 417 O LYS A 26 103.823 -13.488 -14.049 1.00 0.00 O ATOM 418 CB LYS A 26 103.470 -10.646 -13.765 1.00 0.00 C ATOM 419 CG LYS A 26 101.965 -10.533 -13.520 1.00 0.00 C ATOM 420 CD LYS A 26 101.296 -9.886 -14.735 1.00 0.00 C ATOM 421 CE LYS A 26 99.865 -9.483 -14.377 1.00 0.00 C ATOM 422 NZ LYS A 26 98.905 -10.346 -15.123 1.00 0.00 N ATOM 0 H LYS A 26 105.053 -10.448 -11.162 1.00 0.00 H new ATOM 0 HA LYS A 26 103.355 -11.732 -11.917 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.926 -9.656 -13.751 1.00 0.00 H new ATOM 0 HB3 LYS A 26 103.657 -11.069 -14.752 1.00 0.00 H new ATOM 0 HG2 LYS A 26 101.540 -11.521 -13.341 1.00 0.00 H new ATOM 0 HG3 LYS A 26 101.775 -9.937 -12.627 1.00 0.00 H new ATOM 0 HD2 LYS A 26 101.863 -9.011 -15.052 1.00 0.00 H new ATOM 0 HD3 LYS A 26 101.290 -10.582 -15.573 1.00 0.00 H new ATOM 0 HE2 LYS A 26 99.705 -9.585 -13.304 1.00 0.00 H new ATOM 0 HE3 LYS A 26 99.698 -8.435 -14.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 97.931 -10.073 -14.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 99.053 -10.227 -16.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 99.060 -11.341 -14.864 1.00 0.00 H new ATOM 436 N ASP A 27 105.793 -13.230 -12.984 1.00 0.00 N ATOM 437 CA ASP A 27 106.357 -14.465 -13.509 1.00 0.00 C ATOM 438 C ASP A 27 107.331 -15.081 -12.508 1.00 0.00 C ATOM 439 O ASP A 27 107.024 -16.095 -11.881 1.00 0.00 O ATOM 440 CB ASP A 27 107.085 -14.187 -14.825 1.00 0.00 C ATOM 441 CG ASP A 27 106.189 -14.551 -16.004 1.00 0.00 C ATOM 442 OD1 ASP A 27 105.862 -15.719 -16.136 1.00 0.00 O ATOM 443 OD2 ASP A 27 105.843 -13.656 -16.758 1.00 0.00 O ATOM 0 H ASP A 27 106.415 -12.707 -12.367 1.00 0.00 H new ATOM 0 HA ASP A 27 105.542 -15.168 -13.684 1.00 0.00 H new ATOM 0 HB2 ASP A 27 107.364 -13.135 -14.881 1.00 0.00 H new ATOM 0 HB3 ASP A 27 108.009 -14.764 -14.868 1.00 0.00 H new ATOM 448 N ILE A 28 108.511 -14.478 -12.376 1.00 0.00 N ATOM 449 CA ILE A 28 109.523 -14.997 -11.461 1.00 0.00 C ATOM 450 C ILE A 28 110.183 -13.871 -10.669 1.00 0.00 C ATOM 451 O ILE A 28 110.210 -12.722 -11.104 1.00 0.00 O ATOM 452 CB ILE A 28 110.584 -15.747 -12.265 1.00 0.00 C ATOM 453 CG1 ILE A 28 109.957 -17.018 -12.845 1.00 0.00 C ATOM 454 CG2 ILE A 28 111.769 -16.103 -11.361 1.00 0.00 C ATOM 455 CD1 ILE A 28 110.866 -18.220 -12.578 1.00 0.00 C ATOM 0 H ILE A 28 108.787 -13.639 -12.885 1.00 0.00 H new ATOM 0 HA ILE A 28 109.039 -15.670 -10.753 1.00 0.00 H new ATOM 0 HB ILE A 28 110.948 -15.118 -13.077 1.00 0.00 H new ATOM 0 HG12 ILE A 28 108.977 -17.186 -12.398 1.00 0.00 H new ATOM 0 HG13 ILE A 28 109.802 -16.900 -13.917 1.00 0.00 H new ATOM 0 HG21 ILE A 28 112.521 -16.637 -11.941 1.00 0.00 H new ATOM 0 HG22 ILE A 28 112.205 -15.190 -10.956 1.00 0.00 H new ATOM 0 HG23 ILE A 28 111.425 -16.735 -10.542 1.00 0.00 H new ATOM 0 HD11 ILE A 28 110.412 -19.119 -12.994 1.00 0.00 H new ATOM 0 HD12 ILE A 28 111.836 -18.054 -13.046 1.00 0.00 H new ATOM 0 HD13 ILE A 28 110.998 -18.344 -11.503 1.00 0.00 H new ATOM 467 N ILE A 29 110.724 -14.217 -9.504 1.00 0.00 N ATOM 468 CA ILE A 29 111.394 -13.235 -8.658 1.00 0.00 C ATOM 469 C ILE A 29 112.649 -13.848 -8.043 1.00 0.00 C ATOM 470 O ILE A 29 112.652 -15.016 -7.655 1.00 0.00 O ATOM 471 CB ILE A 29 110.448 -12.760 -7.551 1.00 0.00 C ATOM 472 CG1 ILE A 29 109.757 -11.468 -7.994 1.00 0.00 C ATOM 473 CG2 ILE A 29 111.242 -12.496 -6.270 1.00 0.00 C ATOM 474 CD1 ILE A 29 108.275 -11.531 -7.626 1.00 0.00 C ATOM 0 H ILE A 29 110.712 -15.164 -9.126 1.00 0.00 H new ATOM 0 HA ILE A 29 111.679 -12.379 -9.269 1.00 0.00 H new ATOM 0 HB ILE A 29 109.701 -13.530 -7.360 1.00 0.00 H new ATOM 0 HG12 ILE A 29 110.226 -10.609 -7.514 1.00 0.00 H new ATOM 0 HG13 ILE A 29 109.870 -11.333 -9.070 1.00 0.00 H new ATOM 0 HG21 ILE A 29 110.565 -12.158 -5.485 1.00 0.00 H new ATOM 0 HG22 ILE A 29 111.736 -13.414 -5.953 1.00 0.00 H new ATOM 0 HG23 ILE A 29 111.991 -11.727 -6.458 1.00 0.00 H new ATOM 0 HD11 ILE A 29 107.782 -10.611 -7.941 1.00 0.00 H new ATOM 0 HD12 ILE A 29 107.812 -12.381 -8.127 1.00 0.00 H new ATOM 0 HD13 ILE A 29 108.173 -11.646 -6.547 1.00 0.00 H new ATOM 486 N GLY A 30 113.717 -13.058 -7.962 1.00 0.00 N ATOM 487 CA GLY A 30 114.970 -13.549 -7.400 1.00 0.00 C ATOM 488 C GLY A 30 115.451 -12.661 -6.258 1.00 0.00 C ATOM 489 O GLY A 30 115.701 -11.471 -6.445 1.00 0.00 O ATOM 0 H GLY A 30 113.740 -12.087 -8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 30 114.834 -14.568 -7.038 1.00 0.00 H new ATOM 0 HA3 GLY A 30 115.731 -13.586 -8.180 1.00 0.00 H new ATOM 493 N PHE A 31 115.585 -13.254 -5.076 1.00 0.00 N ATOM 494 CA PHE A 31 116.044 -12.516 -3.907 1.00 0.00 C ATOM 495 C PHE A 31 117.565 -12.573 -3.808 1.00 0.00 C ATOM 496 O PHE A 31 118.151 -13.652 -3.742 1.00 0.00 O ATOM 497 CB PHE A 31 115.428 -13.114 -2.640 1.00 0.00 C ATOM 498 CG PHE A 31 113.935 -12.895 -2.642 1.00 0.00 C ATOM 499 CD1 PHE A 31 113.102 -13.770 -3.350 1.00 0.00 C ATOM 500 CD2 PHE A 31 113.382 -11.822 -1.933 1.00 0.00 C ATOM 501 CE1 PHE A 31 111.716 -13.574 -3.346 1.00 0.00 C ATOM 502 CE2 PHE A 31 111.997 -11.625 -1.931 1.00 0.00 C ATOM 503 CZ PHE A 31 111.163 -12.501 -2.637 1.00 0.00 C ATOM 0 H PHE A 31 115.383 -14.239 -4.904 1.00 0.00 H new ATOM 0 HA PHE A 31 115.733 -11.476 -4.007 1.00 0.00 H new ATOM 0 HB2 PHE A 31 115.648 -14.180 -2.587 1.00 0.00 H new ATOM 0 HB3 PHE A 31 115.871 -12.653 -1.757 1.00 0.00 H new ATOM 0 HD1 PHE A 31 113.529 -14.596 -3.899 1.00 0.00 H new ATOM 0 HD2 PHE A 31 114.024 -11.146 -1.388 1.00 0.00 H new ATOM 0 HE1 PHE A 31 111.073 -14.250 -3.890 1.00 0.00 H new ATOM 0 HE2 PHE A 31 111.571 -10.797 -1.385 1.00 0.00 H new ATOM 0 HZ PHE A 31 110.094 -12.349 -2.634 1.00 0.00 H new ATOM 513 N TYR A 32 118.201 -11.405 -3.804 1.00 0.00 N ATOM 514 CA TYR A 32 119.657 -11.344 -3.719 1.00 0.00 C ATOM 515 C TYR A 32 120.101 -10.891 -2.331 1.00 0.00 C ATOM 516 O TYR A 32 119.657 -9.856 -1.834 1.00 0.00 O ATOM 517 CB TYR A 32 120.200 -10.375 -4.770 1.00 0.00 C ATOM 518 CG TYR A 32 121.703 -10.300 -4.657 1.00 0.00 C ATOM 519 CD1 TYR A 32 122.492 -11.376 -5.085 1.00 0.00 C ATOM 520 CD2 TYR A 32 122.309 -9.155 -4.125 1.00 0.00 C ATOM 521 CE1 TYR A 32 123.886 -11.307 -4.980 1.00 0.00 C ATOM 522 CE2 TYR A 32 123.703 -9.086 -4.021 1.00 0.00 C ATOM 523 CZ TYR A 32 124.492 -10.162 -4.448 1.00 0.00 C ATOM 524 OH TYR A 32 125.867 -10.094 -4.344 1.00 0.00 O ATOM 0 H TYR A 32 117.738 -10.498 -3.858 1.00 0.00 H new ATOM 0 HA TYR A 32 120.052 -12.343 -3.903 1.00 0.00 H new ATOM 0 HB2 TYR A 32 119.916 -10.708 -5.768 1.00 0.00 H new ATOM 0 HB3 TYR A 32 119.764 -9.386 -4.628 1.00 0.00 H new ATOM 0 HD1 TYR A 32 122.024 -12.259 -5.496 1.00 0.00 H new ATOM 0 HD2 TYR A 32 121.701 -8.326 -3.795 1.00 0.00 H new ATOM 0 HE1 TYR A 32 124.494 -12.137 -5.309 1.00 0.00 H new ATOM 0 HE2 TYR A 32 124.171 -8.203 -3.611 1.00 0.00 H new ATOM 0 HH TYR A 32 126.257 -9.972 -5.235 1.00 0.00 H new ATOM 534 N PHE A 33 120.983 -11.672 -1.711 1.00 0.00 N ATOM 535 CA PHE A 33 121.484 -11.338 -0.382 1.00 0.00 C ATOM 536 C PHE A 33 122.997 -11.150 -0.415 1.00 0.00 C ATOM 537 O PHE A 33 123.742 -12.080 -0.732 1.00 0.00 O ATOM 538 CB PHE A 33 121.131 -12.448 0.610 1.00 0.00 C ATOM 539 CG PHE A 33 119.666 -12.784 0.488 1.00 0.00 C ATOM 540 CD1 PHE A 33 119.195 -13.431 -0.658 1.00 0.00 C ATOM 541 CD2 PHE A 33 118.781 -12.451 1.520 1.00 0.00 C ATOM 542 CE1 PHE A 33 117.838 -13.746 -0.774 1.00 0.00 C ATOM 543 CE2 PHE A 33 117.422 -12.766 1.404 1.00 0.00 C ATOM 544 CZ PHE A 33 116.950 -13.414 0.256 1.00 0.00 C ATOM 0 H PHE A 33 121.362 -12.533 -2.104 1.00 0.00 H new ATOM 0 HA PHE A 33 121.016 -10.407 -0.064 1.00 0.00 H new ATOM 0 HB2 PHE A 33 121.736 -13.333 0.412 1.00 0.00 H new ATOM 0 HB3 PHE A 33 121.358 -12.127 1.627 1.00 0.00 H new ATOM 0 HD1 PHE A 33 119.879 -13.687 -1.453 1.00 0.00 H new ATOM 0 HD2 PHE A 33 119.146 -11.951 2.405 1.00 0.00 H new ATOM 0 HE1 PHE A 33 117.474 -14.246 -1.659 1.00 0.00 H new ATOM 0 HE2 PHE A 33 116.738 -12.509 2.199 1.00 0.00 H new ATOM 0 HZ PHE A 33 115.902 -13.657 0.165 1.00 0.00 H new ATOM 554 N SER A 34 123.442 -9.941 -0.084 1.00 0.00 N ATOM 555 CA SER A 34 124.866 -9.634 -0.077 1.00 0.00 C ATOM 556 C SER A 34 125.089 -8.134 -0.249 1.00 0.00 C ATOM 557 O SER A 34 125.398 -7.667 -1.346 1.00 0.00 O ATOM 558 CB SER A 34 125.568 -10.388 -1.205 1.00 0.00 C ATOM 559 OG SER A 34 126.753 -9.691 -1.569 1.00 0.00 O ATOM 0 H SER A 34 122.839 -9.162 0.181 1.00 0.00 H new ATOM 0 HA SER A 34 125.282 -9.946 0.881 1.00 0.00 H new ATOM 0 HB2 SER A 34 125.812 -11.401 -0.884 1.00 0.00 H new ATOM 0 HB3 SER A 34 124.906 -10.477 -2.066 1.00 0.00 H new ATOM 0 HG SER A 34 126.515 -8.843 -1.999 1.00 0.00 H new ATOM 565 N ALA A 35 124.931 -7.386 0.839 1.00 0.00 N ATOM 566 CA ALA A 35 125.122 -5.940 0.794 1.00 0.00 C ATOM 567 C ALA A 35 126.097 -5.567 -0.313 1.00 0.00 C ATOM 568 O ALA A 35 125.950 -4.530 -0.961 1.00 0.00 O ATOM 569 CB ALA A 35 125.653 -5.442 2.138 1.00 0.00 C ATOM 0 H ALA A 35 124.673 -7.753 1.755 1.00 0.00 H new ATOM 0 HA ALA A 35 124.161 -5.469 0.589 1.00 0.00 H new ATOM 0 HB1 ALA A 35 125.793 -4.362 2.096 1.00 0.00 H new ATOM 0 HB2 ALA A 35 124.938 -5.685 2.924 1.00 0.00 H new ATOM 0 HB3 ALA A 35 126.607 -5.923 2.353 1.00 0.00 H new ATOM 575 N HIS A 36 127.086 -6.423 -0.529 1.00 0.00 N ATOM 576 CA HIS A 36 128.078 -6.178 -1.566 1.00 0.00 C ATOM 577 C HIS A 36 128.883 -4.921 -1.262 1.00 0.00 C ATOM 578 O HIS A 36 130.015 -4.777 -1.722 1.00 0.00 O ATOM 579 CB HIS A 36 127.384 -6.024 -2.922 1.00 0.00 C ATOM 580 CG HIS A 36 127.782 -7.159 -3.826 1.00 0.00 C ATOM 581 ND1 HIS A 36 129.096 -7.584 -3.943 1.00 0.00 N ATOM 582 CD2 HIS A 36 127.051 -7.963 -4.664 1.00 0.00 C ATOM 583 CE1 HIS A 36 129.116 -8.603 -4.822 1.00 0.00 C ATOM 584 NE2 HIS A 36 127.896 -8.874 -5.292 1.00 0.00 N ATOM 0 H HIS A 36 127.222 -7.287 -0.004 1.00 0.00 H new ATOM 0 HA HIS A 36 128.759 -7.029 -1.595 1.00 0.00 H new ATOM 0 HB2 HIS A 36 126.302 -6.014 -2.789 1.00 0.00 H new ATOM 0 HB3 HIS A 36 127.658 -5.072 -3.376 1.00 0.00 H new ATOM 0 HD1 HIS A 36 129.901 -7.195 -3.452 1.00 0.00 H new ATOM 0 HD2 HIS A 36 125.983 -7.899 -4.814 1.00 0.00 H new ATOM 0 HE1 HIS A 36 130.009 -9.136 -5.112 1.00 0.00 H new ATOM 593 N TRP A 37 128.298 -4.005 -0.492 1.00 0.00 N ATOM 594 CA TRP A 37 128.990 -2.769 -0.157 1.00 0.00 C ATOM 595 C TRP A 37 129.735 -2.901 1.169 1.00 0.00 C ATOM 596 O TRP A 37 130.907 -2.537 1.267 1.00 0.00 O ATOM 597 CB TRP A 37 127.994 -1.614 -0.098 1.00 0.00 C ATOM 598 CG TRP A 37 127.513 -1.415 1.303 1.00 0.00 C ATOM 599 CD1 TRP A 37 126.292 -1.777 1.761 1.00 0.00 C ATOM 600 CD2 TRP A 37 128.212 -0.813 2.429 1.00 0.00 C ATOM 601 NE1 TRP A 37 126.195 -1.423 3.095 1.00 0.00 N ATOM 602 CE2 TRP A 37 127.354 -0.831 3.552 1.00 0.00 C ATOM 603 CE3 TRP A 37 129.494 -0.255 2.583 1.00 0.00 C ATOM 604 CZ2 TRP A 37 127.752 -0.316 4.786 1.00 0.00 C ATOM 605 CZ3 TRP A 37 129.899 0.265 3.823 1.00 0.00 C ATOM 606 CH2 TRP A 37 129.028 0.233 4.923 1.00 0.00 C ATOM 0 H TRP A 37 127.362 -4.095 -0.096 1.00 0.00 H new ATOM 0 HA TRP A 37 129.725 -2.564 -0.935 1.00 0.00 H new ATOM 0 HB2 TRP A 37 128.464 -0.700 -0.461 1.00 0.00 H new ATOM 0 HB3 TRP A 37 127.148 -1.820 -0.754 1.00 0.00 H new ATOM 0 HD1 TRP A 37 125.521 -2.262 1.181 1.00 0.00 H new ATOM 0 HE1 TRP A 37 125.368 -1.581 3.670 1.00 0.00 H new ATOM 0 HE3 TRP A 37 130.171 -0.226 1.742 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 127.078 -0.342 5.629 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 130.885 0.692 3.931 1.00 0.00 H new ATOM 0 HH2 TRP A 37 129.345 0.633 5.875 1.00 0.00 H new ATOM 617 N CYS A 38 129.057 -3.424 2.183 1.00 0.00 N ATOM 618 CA CYS A 38 129.685 -3.597 3.488 1.00 0.00 C ATOM 619 C CYS A 38 130.558 -4.852 3.493 1.00 0.00 C ATOM 620 O CYS A 38 131.731 -4.803 3.863 1.00 0.00 O ATOM 621 CB CYS A 38 128.618 -3.690 4.583 1.00 0.00 C ATOM 622 SG CYS A 38 128.895 -5.169 5.591 1.00 0.00 S ATOM 0 H CYS A 38 128.086 -3.732 2.130 1.00 0.00 H new ATOM 0 HA CYS A 38 130.316 -2.731 3.688 1.00 0.00 H new ATOM 0 HB2 CYS A 38 128.651 -2.800 5.211 1.00 0.00 H new ATOM 0 HB3 CYS A 38 127.626 -3.726 4.134 1.00 0.00 H new ATOM 0 HG CYS A 38 127.977 -6.051 5.329 1.00 0.00 H new ATOM 628 N PRO A 39 130.007 -5.966 3.085 1.00 0.00 N ATOM 629 CA PRO A 39 130.736 -7.260 3.031 1.00 0.00 C ATOM 630 C PRO A 39 131.471 -7.453 1.705 1.00 0.00 C ATOM 631 O PRO A 39 130.981 -7.052 0.649 1.00 0.00 O ATOM 632 CB PRO A 39 129.613 -8.281 3.181 1.00 0.00 C ATOM 633 CG PRO A 39 128.413 -7.640 2.554 1.00 0.00 C ATOM 634 CD PRO A 39 128.618 -6.119 2.631 1.00 0.00 C ATOM 0 HA PRO A 39 131.511 -7.338 3.793 1.00 0.00 H new ATOM 0 HB2 PRO A 39 129.864 -9.218 2.684 1.00 0.00 H new ATOM 0 HB3 PRO A 39 129.431 -8.515 4.230 1.00 0.00 H new ATOM 0 HG2 PRO A 39 128.302 -7.961 1.518 1.00 0.00 H new ATOM 0 HG3 PRO A 39 127.503 -7.933 3.078 1.00 0.00 H new ATOM 0 HD2 PRO A 39 128.461 -5.646 1.661 1.00 0.00 H new ATOM 0 HD3 PRO A 39 127.918 -5.657 3.327 1.00 0.00 H new ATOM 642 N PRO A 40 132.627 -8.061 1.741 1.00 0.00 N ATOM 643 CA PRO A 40 133.442 -8.319 0.519 1.00 0.00 C ATOM 644 C PRO A 40 132.888 -9.481 -0.305 1.00 0.00 C ATOM 645 O PRO A 40 132.350 -10.441 0.245 1.00 0.00 O ATOM 646 CB PRO A 40 134.824 -8.657 1.077 1.00 0.00 C ATOM 647 CG PRO A 40 134.573 -9.221 2.437 1.00 0.00 C ATOM 648 CD PRO A 40 133.287 -8.570 2.955 1.00 0.00 C ATOM 0 HA PRO A 40 133.447 -7.467 -0.161 1.00 0.00 H new ATOM 0 HB2 PRO A 40 135.339 -9.377 0.442 1.00 0.00 H new ATOM 0 HB3 PRO A 40 135.455 -7.770 1.130 1.00 0.00 H new ATOM 0 HG2 PRO A 40 134.467 -10.305 2.393 1.00 0.00 H new ATOM 0 HG3 PRO A 40 135.409 -9.010 3.104 1.00 0.00 H new ATOM 0 HD2 PRO A 40 132.658 -9.291 3.478 1.00 0.00 H new ATOM 0 HD3 PRO A 40 133.503 -7.766 3.658 1.00 0.00 H new ATOM 656 N CYS A 41 133.026 -9.386 -1.625 1.00 0.00 N ATOM 657 CA CYS A 41 132.536 -10.438 -2.509 1.00 0.00 C ATOM 658 C CYS A 41 132.340 -9.906 -3.926 1.00 0.00 C ATOM 659 O CYS A 41 131.670 -10.532 -4.747 1.00 0.00 O ATOM 660 CB CYS A 41 131.210 -10.988 -1.981 1.00 0.00 C ATOM 661 SG CYS A 41 130.270 -9.652 -1.203 1.00 0.00 S ATOM 0 H CYS A 41 133.468 -8.600 -2.101 1.00 0.00 H new ATOM 0 HA CYS A 41 133.278 -11.236 -2.535 1.00 0.00 H new ATOM 0 HB2 CYS A 41 130.634 -11.425 -2.797 1.00 0.00 H new ATOM 0 HB3 CYS A 41 131.396 -11.784 -1.260 1.00 0.00 H new ATOM 0 HG CYS A 41 130.653 -9.514 0.032 1.00 0.00 H new ATOM 667 N ARG A 42 132.927 -8.746 -4.205 1.00 0.00 N ATOM 668 CA ARG A 42 132.809 -8.138 -5.526 1.00 0.00 C ATOM 669 C ARG A 42 133.400 -9.051 -6.596 1.00 0.00 C ATOM 670 O ARG A 42 134.336 -9.808 -6.333 1.00 0.00 O ATOM 671 CB ARG A 42 133.535 -6.791 -5.546 1.00 0.00 C ATOM 672 CG ARG A 42 134.985 -6.986 -5.101 1.00 0.00 C ATOM 673 CD ARG A 42 135.699 -5.633 -5.082 1.00 0.00 C ATOM 674 NE ARG A 42 136.554 -5.530 -3.905 1.00 0.00 N ATOM 675 CZ ARG A 42 137.839 -5.869 -3.957 1.00 0.00 C ATOM 676 NH1 ARG A 42 138.354 -6.303 -5.074 1.00 0.00 N ATOM 677 NH2 ARG A 42 138.584 -5.768 -2.890 1.00 0.00 N ATOM 0 H ARG A 42 133.485 -8.211 -3.539 1.00 0.00 H new ATOM 0 HA ARG A 42 131.751 -7.987 -5.740 1.00 0.00 H new ATOM 0 HB2 ARG A 42 133.505 -6.365 -6.549 1.00 0.00 H new ATOM 0 HB3 ARG A 42 133.032 -6.085 -4.885 1.00 0.00 H new ATOM 0 HG2 ARG A 42 135.015 -7.439 -4.110 1.00 0.00 H new ATOM 0 HG3 ARG A 42 135.496 -7.669 -5.779 1.00 0.00 H new ATOM 0 HD2 ARG A 42 136.297 -5.517 -5.986 1.00 0.00 H new ATOM 0 HD3 ARG A 42 134.965 -4.827 -5.079 1.00 0.00 H new ATOM 0 HE ARG A 42 136.160 -5.192 -3.027 1.00 0.00 H new ATOM 0 HH11 ARG A 42 137.771 -6.382 -5.907 1.00 0.00 H new ATOM 0 HH12 ARG A 42 139.339 -6.563 -5.114 1.00 0.00 H new ATOM 0 HH21 ARG A 42 138.181 -5.429 -2.017 1.00 0.00 H new ATOM 0 HH22 ARG A 42 139.570 -6.028 -2.930 1.00 0.00 H new ATOM 691 N GLY A 43 132.851 -8.974 -7.805 1.00 0.00 N ATOM 692 CA GLY A 43 133.335 -9.796 -8.908 1.00 0.00 C ATOM 693 C GLY A 43 132.211 -10.641 -9.502 1.00 0.00 C ATOM 694 O GLY A 43 132.192 -10.907 -10.703 1.00 0.00 O ATOM 0 H GLY A 43 132.076 -8.355 -8.044 1.00 0.00 H new ATOM 0 HA2 GLY A 43 133.761 -9.157 -9.682 1.00 0.00 H new ATOM 0 HA3 GLY A 43 134.135 -10.447 -8.556 1.00 0.00 H new ATOM 698 N PHE A 44 131.278 -11.062 -8.655 1.00 0.00 N ATOM 699 CA PHE A 44 130.157 -11.877 -9.112 1.00 0.00 C ATOM 700 C PHE A 44 129.030 -10.993 -9.640 1.00 0.00 C ATOM 701 O PHE A 44 128.228 -11.420 -10.470 1.00 0.00 O ATOM 702 CB PHE A 44 129.636 -12.739 -7.961 1.00 0.00 C ATOM 703 CG PHE A 44 128.235 -13.208 -8.274 1.00 0.00 C ATOM 704 CD1 PHE A 44 127.923 -13.675 -9.557 1.00 0.00 C ATOM 705 CD2 PHE A 44 127.248 -13.175 -7.282 1.00 0.00 C ATOM 706 CE1 PHE A 44 126.624 -14.109 -9.847 1.00 0.00 C ATOM 707 CE2 PHE A 44 125.949 -13.609 -7.573 1.00 0.00 C ATOM 708 CZ PHE A 44 125.637 -14.077 -8.855 1.00 0.00 C ATOM 0 H PHE A 44 131.274 -10.855 -7.656 1.00 0.00 H new ATOM 0 HA PHE A 44 130.506 -12.521 -9.919 1.00 0.00 H new ATOM 0 HB2 PHE A 44 130.292 -13.596 -7.809 1.00 0.00 H new ATOM 0 HB3 PHE A 44 129.640 -12.166 -7.034 1.00 0.00 H new ATOM 0 HD1 PHE A 44 128.684 -13.700 -10.323 1.00 0.00 H new ATOM 0 HD2 PHE A 44 127.488 -12.815 -6.293 1.00 0.00 H new ATOM 0 HE1 PHE A 44 126.383 -14.469 -10.837 1.00 0.00 H new ATOM 0 HE2 PHE A 44 125.187 -13.583 -6.808 1.00 0.00 H new ATOM 0 HZ PHE A 44 124.635 -14.413 -9.078 1.00 0.00 H new ATOM 718 N THR A 45 128.977 -9.761 -9.147 1.00 0.00 N ATOM 719 CA THR A 45 127.942 -8.823 -9.570 1.00 0.00 C ATOM 720 C THR A 45 127.987 -8.597 -11.078 1.00 0.00 C ATOM 721 O THR A 45 126.982 -8.773 -11.767 1.00 0.00 O ATOM 722 CB THR A 45 128.108 -7.486 -8.843 1.00 0.00 C ATOM 723 OG1 THR A 45 129.044 -7.637 -7.785 1.00 0.00 O ATOM 724 CG2 THR A 45 126.759 -7.039 -8.273 1.00 0.00 C ATOM 0 H THR A 45 129.633 -9.390 -8.459 1.00 0.00 H new ATOM 0 HA THR A 45 126.975 -9.256 -9.314 1.00 0.00 H new ATOM 0 HB THR A 45 128.469 -6.734 -9.545 1.00 0.00 H new ATOM 0 HG1 THR A 45 129.273 -6.756 -7.423 1.00 0.00 H new ATOM 0 HG21 THR A 45 126.880 -6.087 -7.756 1.00 0.00 H new ATOM 0 HG22 THR A 45 126.042 -6.922 -9.085 1.00 0.00 H new ATOM 0 HG23 THR A 45 126.394 -7.789 -7.571 1.00 0.00 H new ATOM 732 N PRO A 46 129.121 -8.212 -11.605 1.00 0.00 N ATOM 733 CA PRO A 46 129.276 -7.961 -13.065 1.00 0.00 C ATOM 734 C PRO A 46 128.802 -9.146 -13.897 1.00 0.00 C ATOM 735 O PRO A 46 128.645 -9.040 -15.113 1.00 0.00 O ATOM 736 CB PRO A 46 130.780 -7.715 -13.257 1.00 0.00 C ATOM 737 CG PRO A 46 131.437 -8.091 -11.966 1.00 0.00 C ATOM 738 CD PRO A 46 130.373 -7.976 -10.878 1.00 0.00 C ATOM 0 HA PRO A 46 128.671 -7.117 -13.397 1.00 0.00 H new ATOM 0 HB2 PRO A 46 131.170 -8.314 -14.080 1.00 0.00 H new ATOM 0 HB3 PRO A 46 130.975 -6.671 -13.502 1.00 0.00 H new ATOM 0 HG2 PRO A 46 131.832 -9.106 -12.015 1.00 0.00 H new ATOM 0 HG3 PRO A 46 132.279 -7.432 -11.754 1.00 0.00 H new ATOM 0 HD2 PRO A 46 130.524 -8.712 -10.088 1.00 0.00 H new ATOM 0 HD3 PRO A 46 130.385 -6.994 -10.406 1.00 0.00 H new ATOM 746 N ILE A 47 128.568 -10.273 -13.233 1.00 0.00 N ATOM 747 CA ILE A 47 128.103 -11.466 -13.921 1.00 0.00 C ATOM 748 C ILE A 47 126.579 -11.489 -13.946 1.00 0.00 C ATOM 749 O ILE A 47 125.962 -11.721 -14.988 1.00 0.00 O ATOM 750 CB ILE A 47 128.627 -12.713 -13.211 1.00 0.00 C ATOM 751 CG1 ILE A 47 130.136 -12.572 -12.992 1.00 0.00 C ATOM 752 CG2 ILE A 47 128.346 -13.944 -14.072 1.00 0.00 C ATOM 753 CD1 ILE A 47 130.791 -13.954 -13.021 1.00 0.00 C ATOM 0 H ILE A 47 128.692 -10.383 -12.227 1.00 0.00 H new ATOM 0 HA ILE A 47 128.477 -11.454 -14.945 1.00 0.00 H new ATOM 0 HB ILE A 47 128.128 -12.825 -12.248 1.00 0.00 H new ATOM 0 HG12 ILE A 47 130.568 -11.938 -13.766 1.00 0.00 H new ATOM 0 HG13 ILE A 47 130.331 -12.086 -12.036 1.00 0.00 H new ATOM 0 HG21 ILE A 47 128.719 -14.835 -13.566 1.00 0.00 H new ATOM 0 HG22 ILE A 47 127.272 -14.040 -14.230 1.00 0.00 H new ATOM 0 HG23 ILE A 47 128.846 -13.837 -15.035 1.00 0.00 H new ATOM 0 HD11 ILE A 47 131.865 -13.851 -12.865 1.00 0.00 H new ATOM 0 HD12 ILE A 47 130.367 -14.574 -12.231 1.00 0.00 H new ATOM 0 HD13 ILE A 47 130.608 -14.423 -13.988 1.00 0.00 H new ATOM 765 N LEU A 48 125.980 -11.227 -12.791 1.00 0.00 N ATOM 766 CA LEU A 48 124.533 -11.201 -12.692 1.00 0.00 C ATOM 767 C LEU A 48 123.997 -9.967 -13.412 1.00 0.00 C ATOM 768 O LEU A 48 122.844 -9.931 -13.835 1.00 0.00 O ATOM 769 CB LEU A 48 124.117 -11.211 -11.214 1.00 0.00 C ATOM 770 CG LEU A 48 123.192 -10.034 -10.908 1.00 0.00 C ATOM 771 CD1 LEU A 48 121.853 -10.235 -11.617 1.00 0.00 C ATOM 772 CD2 LEU A 48 122.955 -9.963 -9.400 1.00 0.00 C ATOM 0 H LEU A 48 126.472 -11.032 -11.919 1.00 0.00 H new ATOM 0 HA LEU A 48 124.110 -12.085 -13.168 1.00 0.00 H new ATOM 0 HB2 LEU A 48 123.612 -12.148 -10.979 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.003 -11.159 -10.581 1.00 0.00 H new ATOM 0 HG LEU A 48 123.652 -9.109 -11.257 1.00 0.00 H new ATOM 0 HD11 LEU A 48 121.195 -9.394 -11.397 1.00 0.00 H new ATOM 0 HD12 LEU A 48 122.017 -10.296 -12.693 1.00 0.00 H new ATOM 0 HD13 LEU A 48 121.391 -11.158 -11.267 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.296 -9.125 -9.174 1.00 0.00 H new ATOM 0 HD22 LEU A 48 122.493 -10.890 -9.060 1.00 0.00 H new ATOM 0 HD23 LEU A 48 123.907 -9.823 -8.888 1.00 0.00 H new ATOM 784 N ALA A 49 124.854 -8.963 -13.575 1.00 0.00 N ATOM 785 CA ALA A 49 124.453 -7.750 -14.273 1.00 0.00 C ATOM 786 C ALA A 49 124.320 -8.043 -15.762 1.00 0.00 C ATOM 787 O ALA A 49 123.539 -7.408 -16.471 1.00 0.00 O ATOM 788 CB ALA A 49 125.488 -6.645 -14.050 1.00 0.00 C ATOM 0 H ALA A 49 125.817 -8.966 -13.238 1.00 0.00 H new ATOM 0 HA ALA A 49 123.493 -7.413 -13.882 1.00 0.00 H new ATOM 0 HB1 ALA A 49 125.177 -5.743 -14.577 1.00 0.00 H new ATOM 0 HB2 ALA A 49 125.569 -6.432 -12.984 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.456 -6.971 -14.430 1.00 0.00 H new ATOM 794 N ASP A 50 125.079 -9.026 -16.227 1.00 0.00 N ATOM 795 CA ASP A 50 125.024 -9.415 -17.626 1.00 0.00 C ATOM 796 C ASP A 50 123.821 -10.320 -17.854 1.00 0.00 C ATOM 797 O ASP A 50 123.206 -10.302 -18.922 1.00 0.00 O ATOM 798 CB ASP A 50 126.306 -10.149 -18.021 1.00 0.00 C ATOM 799 CG ASP A 50 126.076 -10.955 -19.294 1.00 0.00 C ATOM 800 OD1 ASP A 50 125.337 -10.484 -20.144 1.00 0.00 O ATOM 801 OD2 ASP A 50 126.640 -12.031 -19.402 1.00 0.00 O ATOM 0 H ASP A 50 125.734 -9.564 -15.660 1.00 0.00 H new ATOM 0 HA ASP A 50 124.928 -8.520 -18.241 1.00 0.00 H new ATOM 0 HB2 ASP A 50 127.112 -9.432 -18.176 1.00 0.00 H new ATOM 0 HB3 ASP A 50 126.619 -10.811 -17.214 1.00 0.00 H new ATOM 806 N MET A 51 123.486 -11.107 -16.834 1.00 0.00 N ATOM 807 CA MET A 51 122.351 -12.016 -16.929 1.00 0.00 C ATOM 808 C MET A 51 121.036 -11.249 -16.841 1.00 0.00 C ATOM 809 O MET A 51 120.114 -11.497 -17.619 1.00 0.00 O ATOM 810 CB MET A 51 122.428 -13.066 -15.816 1.00 0.00 C ATOM 811 CG MET A 51 121.601 -12.614 -14.612 1.00 0.00 C ATOM 812 SD MET A 51 119.847 -12.883 -14.951 1.00 0.00 S ATOM 813 CE MET A 51 119.799 -14.606 -14.411 1.00 0.00 C ATOM 0 H MET A 51 123.980 -11.133 -15.942 1.00 0.00 H new ATOM 0 HA MET A 51 122.389 -12.518 -17.896 1.00 0.00 H new ATOM 0 HB2 MET A 51 122.059 -14.024 -16.182 1.00 0.00 H new ATOM 0 HB3 MET A 51 123.466 -13.217 -15.519 1.00 0.00 H new ATOM 0 HG2 MET A 51 121.900 -13.169 -13.723 1.00 0.00 H new ATOM 0 HG3 MET A 51 121.785 -11.560 -14.406 1.00 0.00 H new ATOM 0 HE1 MET A 51 118.768 -14.959 -14.413 1.00 0.00 H new ATOM 0 HE2 MET A 51 120.393 -15.217 -15.091 1.00 0.00 H new ATOM 0 HE3 MET A 51 120.207 -14.683 -13.403 1.00 0.00 H new ATOM 823 N TYR A 52 120.951 -10.319 -15.898 1.00 0.00 N ATOM 824 CA TYR A 52 119.733 -9.535 -15.740 1.00 0.00 C ATOM 825 C TYR A 52 119.607 -8.533 -16.881 1.00 0.00 C ATOM 826 O TYR A 52 118.501 -8.149 -17.259 1.00 0.00 O ATOM 827 CB TYR A 52 119.725 -8.818 -14.385 1.00 0.00 C ATOM 828 CG TYR A 52 120.147 -7.379 -14.553 1.00 0.00 C ATOM 829 CD1 TYR A 52 121.315 -7.077 -15.252 1.00 0.00 C ATOM 830 CD2 TYR A 52 119.370 -6.349 -14.010 1.00 0.00 C ATOM 831 CE1 TYR A 52 121.712 -5.745 -15.413 1.00 0.00 C ATOM 832 CE2 TYR A 52 119.766 -5.016 -14.168 1.00 0.00 C ATOM 833 CZ TYR A 52 120.937 -4.714 -14.870 1.00 0.00 C ATOM 834 OH TYR A 52 121.328 -3.399 -15.028 1.00 0.00 O ATOM 0 H TYR A 52 121.697 -10.092 -15.241 1.00 0.00 H new ATOM 0 HA TYR A 52 118.876 -10.208 -15.770 1.00 0.00 H new ATOM 0 HB2 TYR A 52 118.728 -8.863 -13.948 1.00 0.00 H new ATOM 0 HB3 TYR A 52 120.399 -9.324 -13.694 1.00 0.00 H new ATOM 0 HD1 TYR A 52 121.914 -7.872 -15.670 1.00 0.00 H new ATOM 0 HD2 TYR A 52 118.465 -6.583 -13.469 1.00 0.00 H new ATOM 0 HE1 TYR A 52 122.616 -5.513 -15.956 1.00 0.00 H new ATOM 0 HE2 TYR A 52 119.168 -4.221 -13.748 1.00 0.00 H new ATOM 0 HH TYR A 52 120.601 -2.889 -15.443 1.00 0.00 H new ATOM 844 N SER A 53 120.742 -8.123 -17.442 1.00 0.00 N ATOM 845 CA SER A 53 120.724 -7.181 -18.551 1.00 0.00 C ATOM 846 C SER A 53 120.144 -7.849 -19.788 1.00 0.00 C ATOM 847 O SER A 53 119.346 -7.251 -20.511 1.00 0.00 O ATOM 848 CB SER A 53 122.138 -6.680 -18.849 1.00 0.00 C ATOM 849 OG SER A 53 122.371 -5.477 -18.128 1.00 0.00 O ATOM 0 H SER A 53 121.672 -8.425 -17.150 1.00 0.00 H new ATOM 0 HA SER A 53 120.101 -6.330 -18.275 1.00 0.00 H new ATOM 0 HB2 SER A 53 122.871 -7.435 -18.566 1.00 0.00 H new ATOM 0 HB3 SER A 53 122.257 -6.506 -19.918 1.00 0.00 H new ATOM 0 HG SER A 53 121.717 -5.399 -17.402 1.00 0.00 H new ATOM 855 N GLU A 54 120.536 -9.097 -20.020 1.00 0.00 N ATOM 856 CA GLU A 54 120.028 -9.833 -21.166 1.00 0.00 C ATOM 857 C GLU A 54 118.548 -10.133 -20.958 1.00 0.00 C ATOM 858 O GLU A 54 117.727 -9.949 -21.859 1.00 0.00 O ATOM 859 CB GLU A 54 120.819 -11.133 -21.344 1.00 0.00 C ATOM 860 CG GLU A 54 119.860 -12.317 -21.488 1.00 0.00 C ATOM 861 CD GLU A 54 118.955 -12.115 -22.699 1.00 0.00 C ATOM 862 OE1 GLU A 54 119.474 -11.784 -23.753 1.00 0.00 O ATOM 863 OE2 GLU A 54 117.758 -12.294 -22.555 1.00 0.00 O ATOM 0 H GLU A 54 121.195 -9.613 -19.437 1.00 0.00 H new ATOM 0 HA GLU A 54 120.145 -9.232 -22.068 1.00 0.00 H new ATOM 0 HB2 GLU A 54 121.456 -11.062 -22.225 1.00 0.00 H new ATOM 0 HB3 GLU A 54 121.475 -11.289 -20.488 1.00 0.00 H new ATOM 0 HG2 GLU A 54 120.426 -13.242 -21.598 1.00 0.00 H new ATOM 0 HG3 GLU A 54 119.256 -12.418 -20.586 1.00 0.00 H new ATOM 870 N LEU A 55 118.216 -10.586 -19.755 1.00 0.00 N ATOM 871 CA LEU A 55 116.834 -10.899 -19.427 1.00 0.00 C ATOM 872 C LEU A 55 115.960 -9.662 -19.590 1.00 0.00 C ATOM 873 O LEU A 55 114.886 -9.728 -20.186 1.00 0.00 O ATOM 874 CB LEU A 55 116.736 -11.413 -17.988 1.00 0.00 C ATOM 875 CG LEU A 55 116.764 -12.943 -17.984 1.00 0.00 C ATOM 876 CD1 LEU A 55 116.679 -13.449 -16.543 1.00 0.00 C ATOM 877 CD2 LEU A 55 115.570 -13.480 -18.779 1.00 0.00 C ATOM 0 H LEU A 55 118.880 -10.743 -18.997 1.00 0.00 H new ATOM 0 HA LEU A 55 116.484 -11.675 -20.108 1.00 0.00 H new ATOM 0 HB2 LEU A 55 117.563 -11.023 -17.395 1.00 0.00 H new ATOM 0 HB3 LEU A 55 115.816 -11.055 -17.526 1.00 0.00 H new ATOM 0 HG LEU A 55 117.691 -13.289 -18.441 1.00 0.00 H new ATOM 0 HD11 LEU A 55 116.699 -14.539 -16.538 1.00 0.00 H new ATOM 0 HD12 LEU A 55 117.527 -13.068 -15.973 1.00 0.00 H new ATOM 0 HD13 LEU A 55 115.751 -13.101 -16.089 1.00 0.00 H new ATOM 0 HD21 LEU A 55 115.591 -14.570 -18.775 1.00 0.00 H new ATOM 0 HD22 LEU A 55 114.643 -13.133 -18.322 1.00 0.00 H new ATOM 0 HD23 LEU A 55 115.625 -13.119 -19.806 1.00 0.00 H new ATOM 889 N VAL A 56 116.428 -8.532 -19.065 1.00 0.00 N ATOM 890 CA VAL A 56 115.672 -7.288 -19.171 1.00 0.00 C ATOM 891 C VAL A 56 115.421 -6.963 -20.631 1.00 0.00 C ATOM 892 O VAL A 56 114.337 -6.514 -21.002 1.00 0.00 O ATOM 893 CB VAL A 56 116.432 -6.146 -18.494 1.00 0.00 C ATOM 894 CG1 VAL A 56 115.623 -4.854 -18.616 1.00 0.00 C ATOM 895 CG2 VAL A 56 116.634 -6.479 -17.015 1.00 0.00 C ATOM 0 H VAL A 56 117.315 -8.452 -18.568 1.00 0.00 H new ATOM 0 HA VAL A 56 114.714 -7.410 -18.666 1.00 0.00 H new ATOM 0 HB VAL A 56 117.401 -6.017 -18.976 1.00 0.00 H new ATOM 0 HG11 VAL A 56 116.163 -4.039 -18.134 1.00 0.00 H new ATOM 0 HG12 VAL A 56 115.473 -4.617 -19.669 1.00 0.00 H new ATOM 0 HG13 VAL A 56 114.655 -4.984 -18.132 1.00 0.00 H new ATOM 0 HG21 VAL A 56 117.175 -5.667 -16.530 1.00 0.00 H new ATOM 0 HG22 VAL A 56 115.664 -6.606 -16.535 1.00 0.00 H new ATOM 0 HG23 VAL A 56 117.207 -7.402 -16.925 1.00 0.00 H new ATOM 905 N ASP A 57 116.420 -7.220 -21.459 1.00 0.00 N ATOM 906 CA ASP A 57 116.285 -6.981 -22.883 1.00 0.00 C ATOM 907 C ASP A 57 115.178 -7.871 -23.427 1.00 0.00 C ATOM 908 O ASP A 57 114.488 -7.520 -24.384 1.00 0.00 O ATOM 909 CB ASP A 57 117.601 -7.302 -23.585 1.00 0.00 C ATOM 910 CG ASP A 57 117.653 -6.613 -24.944 1.00 0.00 C ATOM 911 OD1 ASP A 57 116.834 -6.944 -25.786 1.00 0.00 O ATOM 912 OD2 ASP A 57 118.511 -5.764 -25.124 1.00 0.00 O ATOM 0 H ASP A 57 117.326 -7.591 -21.171 1.00 0.00 H new ATOM 0 HA ASP A 57 116.037 -5.935 -23.062 1.00 0.00 H new ATOM 0 HB2 ASP A 57 118.439 -6.974 -22.970 1.00 0.00 H new ATOM 0 HB3 ASP A 57 117.701 -8.380 -23.711 1.00 0.00 H new ATOM 917 N ASP A 58 115.017 -9.023 -22.788 1.00 0.00 N ATOM 918 CA ASP A 58 113.991 -9.977 -23.182 1.00 0.00 C ATOM 919 C ASP A 58 112.736 -9.769 -22.350 1.00 0.00 C ATOM 920 O ASP A 58 111.911 -10.673 -22.210 1.00 0.00 O ATOM 921 CB ASP A 58 114.504 -11.402 -22.974 1.00 0.00 C ATOM 922 CG ASP A 58 114.661 -12.104 -24.318 1.00 0.00 C ATOM 923 OD1 ASP A 58 114.935 -11.423 -25.292 1.00 0.00 O ATOM 924 OD2 ASP A 58 114.507 -13.313 -24.354 1.00 0.00 O ATOM 0 H ASP A 58 115.585 -9.318 -21.994 1.00 0.00 H new ATOM 0 HA ASP A 58 113.754 -9.823 -24.235 1.00 0.00 H new ATOM 0 HB2 ASP A 58 115.461 -11.380 -22.453 1.00 0.00 H new ATOM 0 HB3 ASP A 58 113.810 -11.958 -22.343 1.00 0.00 H new ATOM 929 N SER A 59 112.612 -8.580 -21.783 1.00 0.00 N ATOM 930 CA SER A 59 111.465 -8.266 -20.942 1.00 0.00 C ATOM 931 C SER A 59 111.603 -8.997 -19.617 1.00 0.00 C ATOM 932 O SER A 59 110.634 -9.196 -18.886 1.00 0.00 O ATOM 933 CB SER A 59 110.166 -8.680 -21.634 1.00 0.00 C ATOM 934 OG SER A 59 109.091 -7.910 -21.113 1.00 0.00 O ATOM 0 H SER A 59 113.285 -7.821 -21.887 1.00 0.00 H new ATOM 0 HA SER A 59 111.433 -7.191 -20.766 1.00 0.00 H new ATOM 0 HB2 SER A 59 110.249 -8.528 -22.710 1.00 0.00 H new ATOM 0 HB3 SER A 59 109.978 -9.742 -21.475 1.00 0.00 H new ATOM 0 HG SER A 59 109.109 -7.944 -20.134 1.00 0.00 H new ATOM 940 N ALA A 60 112.837 -9.386 -19.333 1.00 0.00 N ATOM 941 CA ALA A 60 113.167 -10.100 -18.106 1.00 0.00 C ATOM 942 C ALA A 60 111.915 -10.588 -17.385 1.00 0.00 C ATOM 943 O ALA A 60 111.344 -9.879 -16.558 1.00 0.00 O ATOM 944 CB ALA A 60 113.955 -9.183 -17.181 1.00 0.00 C ATOM 0 H ALA A 60 113.636 -9.217 -19.944 1.00 0.00 H new ATOM 0 HA ALA A 60 113.765 -10.971 -18.375 1.00 0.00 H new ATOM 0 HB1 ALA A 60 114.202 -9.717 -16.263 1.00 0.00 H new ATOM 0 HB2 ALA A 60 114.874 -8.869 -17.676 1.00 0.00 H new ATOM 0 HB3 ALA A 60 113.354 -8.306 -16.940 1.00 0.00 H new ATOM 950 N PRO A 61 111.497 -11.785 -17.681 1.00 0.00 N ATOM 951 CA PRO A 61 110.296 -12.404 -17.046 1.00 0.00 C ATOM 952 C PRO A 61 110.482 -12.592 -15.543 1.00 0.00 C ATOM 953 O PRO A 61 109.997 -13.565 -14.966 1.00 0.00 O ATOM 954 CB PRO A 61 110.164 -13.765 -17.745 1.00 0.00 C ATOM 955 CG PRO A 61 111.009 -13.681 -18.971 1.00 0.00 C ATOM 956 CD PRO A 61 112.118 -12.684 -18.659 1.00 0.00 C ATOM 0 HA PRO A 61 109.411 -11.778 -17.156 1.00 0.00 H new ATOM 0 HB2 PRO A 61 110.500 -14.572 -17.094 1.00 0.00 H new ATOM 0 HB3 PRO A 61 109.125 -13.973 -18.001 1.00 0.00 H new ATOM 0 HG2 PRO A 61 111.423 -14.657 -19.225 1.00 0.00 H new ATOM 0 HG3 PRO A 61 110.420 -13.352 -19.827 1.00 0.00 H new ATOM 0 HD2 PRO A 61 112.999 -13.178 -18.249 1.00 0.00 H new ATOM 0 HD3 PRO A 61 112.439 -12.147 -19.552 1.00 0.00 H new ATOM 964 N PHE A 62 111.183 -11.654 -14.915 1.00 0.00 N ATOM 965 CA PHE A 62 111.414 -11.736 -13.481 1.00 0.00 C ATOM 966 C PHE A 62 112.062 -10.459 -12.945 1.00 0.00 C ATOM 967 O PHE A 62 112.732 -9.733 -13.679 1.00 0.00 O ATOM 968 CB PHE A 62 112.285 -12.953 -13.172 1.00 0.00 C ATOM 969 CG PHE A 62 113.726 -12.539 -13.031 1.00 0.00 C ATOM 970 CD1 PHE A 62 114.416 -12.018 -14.129 1.00 0.00 C ATOM 971 CD2 PHE A 62 114.374 -12.689 -11.801 1.00 0.00 C ATOM 972 CE1 PHE A 62 115.757 -11.644 -13.997 1.00 0.00 C ATOM 973 CE2 PHE A 62 115.713 -12.316 -11.667 1.00 0.00 C ATOM 974 CZ PHE A 62 116.407 -11.793 -12.766 1.00 0.00 C ATOM 0 H PHE A 62 111.595 -10.840 -15.370 1.00 0.00 H new ATOM 0 HA PHE A 62 110.451 -11.846 -12.982 1.00 0.00 H new ATOM 0 HB2 PHE A 62 111.944 -13.429 -12.253 1.00 0.00 H new ATOM 0 HB3 PHE A 62 112.187 -13.691 -13.968 1.00 0.00 H new ATOM 0 HD1 PHE A 62 113.914 -11.904 -15.078 1.00 0.00 H new ATOM 0 HD2 PHE A 62 113.839 -13.093 -10.955 1.00 0.00 H new ATOM 0 HE1 PHE A 62 116.291 -11.240 -14.844 1.00 0.00 H new ATOM 0 HE2 PHE A 62 116.213 -12.431 -10.717 1.00 0.00 H new ATOM 0 HZ PHE A 62 117.443 -11.505 -12.664 1.00 0.00 H new ATOM 984 N GLU A 63 111.844 -10.192 -11.659 1.00 0.00 N ATOM 985 CA GLU A 63 112.395 -8.999 -11.017 1.00 0.00 C ATOM 986 C GLU A 63 113.378 -9.379 -9.912 1.00 0.00 C ATOM 987 O GLU A 63 113.230 -10.414 -9.262 1.00 0.00 O ATOM 988 CB GLU A 63 111.260 -8.160 -10.425 1.00 0.00 C ATOM 989 CG GLU A 63 110.496 -7.464 -11.552 1.00 0.00 C ATOM 990 CD GLU A 63 109.897 -6.156 -11.047 1.00 0.00 C ATOM 991 OE1 GLU A 63 109.610 -6.077 -9.864 1.00 0.00 O ATOM 992 OE2 GLU A 63 109.734 -5.252 -11.850 1.00 0.00 O ATOM 0 H GLU A 63 111.290 -10.785 -11.041 1.00 0.00 H new ATOM 0 HA GLU A 63 112.928 -8.419 -11.771 1.00 0.00 H new ATOM 0 HB2 GLU A 63 110.585 -8.796 -9.852 1.00 0.00 H new ATOM 0 HB3 GLU A 63 111.663 -7.420 -9.734 1.00 0.00 H new ATOM 0 HG2 GLU A 63 111.166 -7.267 -12.389 1.00 0.00 H new ATOM 0 HG3 GLU A 63 109.705 -8.116 -11.923 1.00 0.00 H new ATOM 999 N ILE A 64 114.376 -8.527 -9.707 1.00 0.00 N ATOM 1000 CA ILE A 64 115.380 -8.771 -8.677 1.00 0.00 C ATOM 1001 C ILE A 64 115.012 -8.039 -7.390 1.00 0.00 C ATOM 1002 O ILE A 64 114.737 -6.840 -7.403 1.00 0.00 O ATOM 1003 CB ILE A 64 116.760 -8.299 -9.160 1.00 0.00 C ATOM 1004 CG1 ILE A 64 117.714 -9.493 -9.262 1.00 0.00 C ATOM 1005 CG2 ILE A 64 117.342 -7.281 -8.175 1.00 0.00 C ATOM 1006 CD1 ILE A 64 117.567 -10.149 -10.634 1.00 0.00 C ATOM 0 H ILE A 64 114.512 -7.666 -10.237 1.00 0.00 H new ATOM 0 HA ILE A 64 115.415 -9.842 -8.479 1.00 0.00 H new ATOM 0 HB ILE A 64 116.645 -7.835 -10.140 1.00 0.00 H new ATOM 0 HG12 ILE A 64 118.742 -9.164 -9.113 1.00 0.00 H new ATOM 0 HG13 ILE A 64 117.494 -10.216 -8.476 1.00 0.00 H new ATOM 0 HG21 ILE A 64 118.320 -6.953 -8.527 1.00 0.00 H new ATOM 0 HG22 ILE A 64 116.675 -6.422 -8.103 1.00 0.00 H new ATOM 0 HG23 ILE A 64 117.446 -7.743 -7.193 1.00 0.00 H new ATOM 0 HD11 ILE A 64 118.246 -10.998 -10.706 1.00 0.00 H new ATOM 0 HD12 ILE A 64 116.541 -10.493 -10.765 1.00 0.00 H new ATOM 0 HD13 ILE A 64 117.809 -9.424 -11.412 1.00 0.00 H new ATOM 1018 N ILE A 65 115.029 -8.766 -6.280 1.00 0.00 N ATOM 1019 CA ILE A 65 114.717 -8.169 -4.987 1.00 0.00 C ATOM 1020 C ILE A 65 116.010 -7.742 -4.303 1.00 0.00 C ATOM 1021 O ILE A 65 116.987 -8.493 -4.290 1.00 0.00 O ATOM 1022 CB ILE A 65 113.970 -9.174 -4.108 1.00 0.00 C ATOM 1023 CG1 ILE A 65 113.171 -10.135 -4.992 1.00 0.00 C ATOM 1024 CG2 ILE A 65 113.012 -8.431 -3.174 1.00 0.00 C ATOM 1025 CD1 ILE A 65 112.073 -9.361 -5.726 1.00 0.00 C ATOM 0 H ILE A 65 115.253 -9.761 -6.248 1.00 0.00 H new ATOM 0 HA ILE A 65 114.080 -7.297 -5.138 1.00 0.00 H new ATOM 0 HB ILE A 65 114.691 -9.737 -3.516 1.00 0.00 H new ATOM 0 HG12 ILE A 65 113.832 -10.619 -5.711 1.00 0.00 H new ATOM 0 HG13 ILE A 65 112.730 -10.924 -4.383 1.00 0.00 H new ATOM 0 HG21 ILE A 65 112.482 -9.150 -2.550 1.00 0.00 H new ATOM 0 HG22 ILE A 65 113.578 -7.748 -2.540 1.00 0.00 H new ATOM 0 HG23 ILE A 65 112.293 -7.865 -3.766 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.504 -10.045 -6.355 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.406 -8.898 -4.999 1.00 0.00 H new ATOM 0 HD13 ILE A 65 112.526 -8.588 -6.347 1.00 0.00 H new ATOM 1037 N PHE A 66 116.021 -6.536 -3.745 1.00 0.00 N ATOM 1038 CA PHE A 66 117.219 -6.037 -3.078 1.00 0.00 C ATOM 1039 C PHE A 66 117.134 -6.241 -1.570 1.00 0.00 C ATOM 1040 O PHE A 66 116.258 -5.688 -0.903 1.00 0.00 O ATOM 1041 CB PHE A 66 117.408 -4.552 -3.384 1.00 0.00 C ATOM 1042 CG PHE A 66 118.880 -4.252 -3.533 1.00 0.00 C ATOM 1043 CD1 PHE A 66 119.705 -4.212 -2.403 1.00 0.00 C ATOM 1044 CD2 PHE A 66 119.421 -4.015 -4.804 1.00 0.00 C ATOM 1045 CE1 PHE A 66 121.069 -3.933 -2.542 1.00 0.00 C ATOM 1046 CE2 PHE A 66 120.786 -3.737 -4.942 1.00 0.00 C ATOM 1047 CZ PHE A 66 121.610 -3.695 -3.811 1.00 0.00 C ATOM 0 H PHE A 66 115.228 -5.895 -3.740 1.00 0.00 H new ATOM 0 HA PHE A 66 118.073 -6.600 -3.455 1.00 0.00 H new ATOM 0 HB2 PHE A 66 116.878 -4.288 -4.299 1.00 0.00 H new ATOM 0 HB3 PHE A 66 116.982 -3.948 -2.583 1.00 0.00 H new ATOM 0 HD1 PHE A 66 119.289 -4.397 -1.424 1.00 0.00 H new ATOM 0 HD2 PHE A 66 118.785 -4.047 -5.676 1.00 0.00 H new ATOM 0 HE1 PHE A 66 121.705 -3.901 -1.670 1.00 0.00 H new ATOM 0 HE2 PHE A 66 121.204 -3.555 -5.921 1.00 0.00 H new ATOM 0 HZ PHE A 66 122.663 -3.479 -3.917 1.00 0.00 H new ATOM 1057 N VAL A 67 118.062 -7.029 -1.039 1.00 0.00 N ATOM 1058 CA VAL A 67 118.104 -7.298 0.392 1.00 0.00 C ATOM 1059 C VAL A 67 119.529 -7.123 0.907 1.00 0.00 C ATOM 1060 O VAL A 67 120.343 -6.449 0.276 1.00 0.00 O ATOM 1061 CB VAL A 67 117.626 -8.723 0.675 1.00 0.00 C ATOM 1062 CG1 VAL A 67 116.751 -8.729 1.930 1.00 0.00 C ATOM 1063 CG2 VAL A 67 116.809 -9.231 -0.516 1.00 0.00 C ATOM 0 H VAL A 67 118.794 -7.492 -1.578 1.00 0.00 H new ATOM 0 HA VAL A 67 117.445 -6.596 0.903 1.00 0.00 H new ATOM 0 HB VAL A 67 118.488 -9.371 0.830 1.00 0.00 H new ATOM 0 HG11 VAL A 67 116.411 -9.745 2.131 1.00 0.00 H new ATOM 0 HG12 VAL A 67 117.330 -8.365 2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 67 115.888 -8.081 1.775 1.00 0.00 H new ATOM 0 HG21 VAL A 67 116.467 -10.247 -0.316 1.00 0.00 H new ATOM 0 HG22 VAL A 67 115.947 -8.582 -0.669 1.00 0.00 H new ATOM 0 HG23 VAL A 67 117.430 -9.227 -1.412 1.00 0.00 H new ATOM 1073 N SER A 68 119.833 -7.734 2.047 1.00 0.00 N ATOM 1074 CA SER A 68 121.172 -7.629 2.613 1.00 0.00 C ATOM 1075 C SER A 68 121.386 -6.253 3.235 1.00 0.00 C ATOM 1076 O SER A 68 120.793 -5.268 2.800 1.00 0.00 O ATOM 1077 CB SER A 68 122.214 -7.864 1.521 1.00 0.00 C ATOM 1078 OG SER A 68 123.085 -8.914 1.919 1.00 0.00 O ATOM 0 H SER A 68 119.181 -8.299 2.590 1.00 0.00 H new ATOM 0 HA SER A 68 121.280 -8.385 3.391 1.00 0.00 H new ATOM 0 HB2 SER A 68 121.722 -8.120 0.583 1.00 0.00 H new ATOM 0 HB3 SER A 68 122.783 -6.952 1.344 1.00 0.00 H new ATOM 0 HG SER A 68 123.414 -8.740 2.826 1.00 0.00 H new ATOM 1084 N SER A 69 122.228 -6.197 4.262 1.00 0.00 N ATOM 1085 CA SER A 69 122.508 -4.937 4.945 1.00 0.00 C ATOM 1086 C SER A 69 122.972 -3.865 3.959 1.00 0.00 C ATOM 1087 O SER A 69 124.110 -3.401 4.024 1.00 0.00 O ATOM 1088 CB SER A 69 123.586 -5.152 6.008 1.00 0.00 C ATOM 1089 OG SER A 69 123.053 -5.943 7.063 1.00 0.00 O ATOM 0 H SER A 69 122.726 -7.004 4.638 1.00 0.00 H new ATOM 0 HA SER A 69 121.586 -4.596 5.416 1.00 0.00 H new ATOM 0 HB2 SER A 69 124.453 -5.646 5.569 1.00 0.00 H new ATOM 0 HB3 SER A 69 123.929 -4.192 6.395 1.00 0.00 H new ATOM 0 HG SER A 69 123.742 -6.085 7.746 1.00 0.00 H new ATOM 1095 N ASP A 70 122.078 -3.467 3.059 1.00 0.00 N ATOM 1096 CA ASP A 70 122.396 -2.438 2.074 1.00 0.00 C ATOM 1097 C ASP A 70 121.956 -1.079 2.592 1.00 0.00 C ATOM 1098 O ASP A 70 121.917 -0.100 1.848 1.00 0.00 O ATOM 1099 CB ASP A 70 121.693 -2.721 0.748 1.00 0.00 C ATOM 1100 CG ASP A 70 121.206 -4.164 0.707 1.00 0.00 C ATOM 1101 OD1 ASP A 70 122.023 -5.037 0.463 1.00 0.00 O ATOM 1102 OD2 ASP A 70 120.024 -4.376 0.920 1.00 0.00 O ATOM 0 H ASP A 70 121.131 -3.840 2.991 1.00 0.00 H new ATOM 0 HA ASP A 70 123.474 -2.443 1.910 1.00 0.00 H new ATOM 0 HB2 ASP A 70 120.850 -2.042 0.623 1.00 0.00 H new ATOM 0 HB3 ASP A 70 122.377 -2.537 -0.081 1.00 0.00 H new ATOM 1107 N ARG A 71 121.603 -1.044 3.870 1.00 0.00 N ATOM 1108 CA ARG A 71 121.137 0.182 4.507 1.00 0.00 C ATOM 1109 C ARG A 71 121.800 1.415 3.901 1.00 0.00 C ATOM 1110 O ARG A 71 121.374 2.540 4.161 1.00 0.00 O ATOM 1111 CB ARG A 71 121.431 0.132 6.008 1.00 0.00 C ATOM 1112 CG ARG A 71 120.932 -1.197 6.581 1.00 0.00 C ATOM 1113 CD ARG A 71 120.976 -1.141 8.109 1.00 0.00 C ATOM 1114 NE ARG A 71 122.255 -1.647 8.595 1.00 0.00 N ATOM 1115 CZ ARG A 71 122.562 -2.937 8.510 1.00 0.00 C ATOM 1116 NH1 ARG A 71 121.711 -3.776 7.985 1.00 0.00 N ATOM 1117 NH2 ARG A 71 123.713 -3.365 8.952 1.00 0.00 N ATOM 0 H ARG A 71 121.631 -1.854 4.489 1.00 0.00 H new ATOM 0 HA ARG A 71 120.062 0.256 4.340 1.00 0.00 H new ATOM 0 HB2 ARG A 71 122.502 0.237 6.184 1.00 0.00 H new ATOM 0 HB3 ARG A 71 120.942 0.965 6.513 1.00 0.00 H new ATOM 0 HG2 ARG A 71 119.914 -1.392 6.243 1.00 0.00 H new ATOM 0 HG3 ARG A 71 121.551 -2.017 6.218 1.00 0.00 H new ATOM 0 HD2 ARG A 71 120.830 -0.115 8.447 1.00 0.00 H new ATOM 0 HD3 ARG A 71 120.161 -1.732 8.526 1.00 0.00 H new ATOM 0 HE ARG A 71 122.926 -0.999 9.008 1.00 0.00 H new ATOM 0 HH11 ARG A 71 120.811 -3.441 7.640 1.00 0.00 H new ATOM 0 HH12 ARG A 71 121.946 -4.766 7.919 1.00 0.00 H new ATOM 0 HH21 ARG A 71 124.377 -2.709 9.363 1.00 0.00 H new ATOM 0 HH22 ARG A 71 123.948 -4.355 8.887 1.00 0.00 H new ATOM 1131 N SER A 72 122.827 1.212 3.082 1.00 0.00 N ATOM 1132 CA SER A 72 123.495 2.338 2.454 1.00 0.00 C ATOM 1133 C SER A 72 122.672 2.816 1.265 1.00 0.00 C ATOM 1134 O SER A 72 122.558 2.116 0.259 1.00 0.00 O ATOM 1135 CB SER A 72 124.889 1.926 1.983 1.00 0.00 C ATOM 1136 OG SER A 72 124.945 0.511 1.862 1.00 0.00 O ATOM 0 H SER A 72 123.207 0.296 2.843 1.00 0.00 H new ATOM 0 HA SER A 72 123.592 3.146 3.179 1.00 0.00 H new ATOM 0 HB2 SER A 72 125.114 2.394 1.025 1.00 0.00 H new ATOM 0 HB3 SER A 72 125.642 2.272 2.691 1.00 0.00 H new ATOM 0 HG SER A 72 125.864 0.206 2.011 1.00 0.00 H new ATOM 1142 N GLU A 73 122.091 4.005 1.385 1.00 0.00 N ATOM 1143 CA GLU A 73 121.276 4.547 0.306 1.00 0.00 C ATOM 1144 C GLU A 73 122.134 4.817 -0.916 1.00 0.00 C ATOM 1145 O GLU A 73 121.656 4.763 -2.049 1.00 0.00 O ATOM 1146 CB GLU A 73 120.597 5.841 0.759 1.00 0.00 C ATOM 1147 CG GLU A 73 119.974 5.635 2.140 1.00 0.00 C ATOM 1148 CD GLU A 73 118.822 6.615 2.345 1.00 0.00 C ATOM 1149 OE1 GLU A 73 117.881 6.561 1.570 1.00 0.00 O ATOM 1150 OE2 GLU A 73 118.899 7.404 3.272 1.00 0.00 O ATOM 0 H GLU A 73 122.168 4.604 2.207 1.00 0.00 H new ATOM 0 HA GLU A 73 120.511 3.815 0.046 1.00 0.00 H new ATOM 0 HB2 GLU A 73 121.324 6.652 0.794 1.00 0.00 H new ATOM 0 HB3 GLU A 73 119.829 6.131 0.042 1.00 0.00 H new ATOM 0 HG2 GLU A 73 119.613 4.611 2.236 1.00 0.00 H new ATOM 0 HG3 GLU A 73 120.728 5.781 2.914 1.00 0.00 H new ATOM 1157 N ASP A 74 123.409 5.095 -0.681 1.00 0.00 N ATOM 1158 CA ASP A 74 124.325 5.356 -1.779 1.00 0.00 C ATOM 1159 C ASP A 74 124.767 4.043 -2.400 1.00 0.00 C ATOM 1160 O ASP A 74 124.687 3.866 -3.616 1.00 0.00 O ATOM 1161 CB ASP A 74 125.543 6.136 -1.281 1.00 0.00 C ATOM 1162 CG ASP A 74 126.393 6.586 -2.465 1.00 0.00 C ATOM 1163 OD1 ASP A 74 126.172 6.083 -3.553 1.00 0.00 O ATOM 1164 OD2 ASP A 74 127.253 7.428 -2.264 1.00 0.00 O ATOM 0 H ASP A 74 123.827 5.145 0.248 1.00 0.00 H new ATOM 0 HA ASP A 74 123.813 5.955 -2.532 1.00 0.00 H new ATOM 0 HB2 ASP A 74 125.220 7.003 -0.705 1.00 0.00 H new ATOM 0 HB3 ASP A 74 126.137 5.512 -0.613 1.00 0.00 H new ATOM 1169 N ASP A 75 125.225 3.116 -1.565 1.00 0.00 N ATOM 1170 CA ASP A 75 125.658 1.823 -2.063 1.00 0.00 C ATOM 1171 C ASP A 75 124.488 1.113 -2.726 1.00 0.00 C ATOM 1172 O ASP A 75 124.674 0.253 -3.585 1.00 0.00 O ATOM 1173 CB ASP A 75 126.199 0.969 -0.919 1.00 0.00 C ATOM 1174 CG ASP A 75 127.186 1.779 -0.085 1.00 0.00 C ATOM 1175 OD1 ASP A 75 127.717 2.747 -0.605 1.00 0.00 O ATOM 1176 OD2 ASP A 75 127.398 1.419 1.061 1.00 0.00 O ATOM 0 H ASP A 75 125.304 3.236 -0.555 1.00 0.00 H new ATOM 0 HA ASP A 75 126.452 1.974 -2.794 1.00 0.00 H new ATOM 0 HB2 ASP A 75 125.377 0.624 -0.291 1.00 0.00 H new ATOM 0 HB3 ASP A 75 126.690 0.081 -1.318 1.00 0.00 H new ATOM 1181 N MET A 76 123.277 1.490 -2.324 1.00 0.00 N ATOM 1182 CA MET A 76 122.080 0.892 -2.892 1.00 0.00 C ATOM 1183 C MET A 76 121.876 1.383 -4.319 1.00 0.00 C ATOM 1184 O MET A 76 121.881 0.593 -5.263 1.00 0.00 O ATOM 1185 CB MET A 76 120.860 1.255 -2.044 1.00 0.00 C ATOM 1186 CG MET A 76 119.670 0.387 -2.461 1.00 0.00 C ATOM 1187 SD MET A 76 119.136 -0.618 -1.054 1.00 0.00 S ATOM 1188 CE MET A 76 118.940 0.736 0.130 1.00 0.00 C ATOM 0 H MET A 76 123.103 2.201 -1.613 1.00 0.00 H new ATOM 0 HA MET A 76 122.201 -0.191 -2.901 1.00 0.00 H new ATOM 0 HB2 MET A 76 121.081 1.104 -0.987 1.00 0.00 H new ATOM 0 HB3 MET A 76 120.616 2.310 -2.171 1.00 0.00 H new ATOM 0 HG2 MET A 76 118.849 1.017 -2.804 1.00 0.00 H new ATOM 0 HG3 MET A 76 119.950 -0.256 -3.296 1.00 0.00 H new ATOM 0 HE1 MET A 76 119.780 0.736 0.825 1.00 0.00 H new ATOM 0 HE2 MET A 76 118.911 1.685 -0.405 1.00 0.00 H new ATOM 0 HE3 MET A 76 118.011 0.603 0.684 1.00 0.00 H new ATOM 1198 N PHE A 77 121.692 2.692 -4.472 1.00 0.00 N ATOM 1199 CA PHE A 77 121.481 3.270 -5.791 1.00 0.00 C ATOM 1200 C PHE A 77 122.734 3.136 -6.651 1.00 0.00 C ATOM 1201 O PHE A 77 122.667 3.232 -7.876 1.00 0.00 O ATOM 1202 CB PHE A 77 121.102 4.745 -5.656 1.00 0.00 C ATOM 1203 CG PHE A 77 120.258 4.933 -4.416 1.00 0.00 C ATOM 1204 CD1 PHE A 77 119.366 3.929 -4.018 1.00 0.00 C ATOM 1205 CD2 PHE A 77 120.368 6.109 -3.666 1.00 0.00 C ATOM 1206 CE1 PHE A 77 118.584 4.103 -2.869 1.00 0.00 C ATOM 1207 CE2 PHE A 77 119.586 6.283 -2.517 1.00 0.00 C ATOM 1208 CZ PHE A 77 118.694 5.280 -2.119 1.00 0.00 C ATOM 0 H PHE A 77 121.685 3.365 -3.705 1.00 0.00 H new ATOM 0 HA PHE A 77 120.670 2.728 -6.277 1.00 0.00 H new ATOM 0 HB2 PHE A 77 122.001 5.359 -5.595 1.00 0.00 H new ATOM 0 HB3 PHE A 77 120.551 5.073 -6.538 1.00 0.00 H new ATOM 0 HD1 PHE A 77 119.281 3.021 -4.597 1.00 0.00 H new ATOM 0 HD2 PHE A 77 121.056 6.883 -3.973 1.00 0.00 H new ATOM 0 HE1 PHE A 77 117.896 3.329 -2.562 1.00 0.00 H new ATOM 0 HE2 PHE A 77 119.671 7.191 -1.938 1.00 0.00 H new ATOM 0 HZ PHE A 77 118.091 5.414 -1.233 1.00 0.00 H new ATOM 1218 N GLN A 78 123.873 2.909 -6.005 1.00 0.00 N ATOM 1219 CA GLN A 78 125.128 2.759 -6.733 1.00 0.00 C ATOM 1220 C GLN A 78 125.218 1.371 -7.351 1.00 0.00 C ATOM 1221 O GLN A 78 125.395 1.228 -8.562 1.00 0.00 O ATOM 1222 CB GLN A 78 126.313 2.982 -5.792 1.00 0.00 C ATOM 1223 CG GLN A 78 126.638 4.475 -5.724 1.00 0.00 C ATOM 1224 CD GLN A 78 127.378 4.906 -6.986 1.00 0.00 C ATOM 1225 OE1 GLN A 78 127.827 6.047 -7.085 1.00 0.00 O ATOM 1226 NE2 GLN A 78 127.532 4.054 -7.963 1.00 0.00 N ATOM 0 H GLN A 78 123.954 2.826 -4.992 1.00 0.00 H new ATOM 0 HA GLN A 78 125.158 3.504 -7.528 1.00 0.00 H new ATOM 0 HB2 GLN A 78 126.077 2.605 -4.797 1.00 0.00 H new ATOM 0 HB3 GLN A 78 127.181 2.426 -6.146 1.00 0.00 H new ATOM 0 HG2 GLN A 78 125.719 5.051 -5.617 1.00 0.00 H new ATOM 0 HG3 GLN A 78 127.249 4.683 -4.845 1.00 0.00 H new ATOM 0 HE21 GLN A 78 127.159 3.108 -7.879 1.00 0.00 H new ATOM 0 HE22 GLN A 78 128.025 4.334 -8.811 1.00 0.00 H new ATOM 1235 N TYR A 79 125.088 0.351 -6.513 1.00 0.00 N ATOM 1236 CA TYR A 79 125.148 -1.026 -6.988 1.00 0.00 C ATOM 1237 C TYR A 79 124.004 -1.298 -7.957 1.00 0.00 C ATOM 1238 O TYR A 79 124.085 -2.197 -8.794 1.00 0.00 O ATOM 1239 CB TYR A 79 125.061 -1.995 -5.807 1.00 0.00 C ATOM 1240 CG TYR A 79 126.424 -2.587 -5.540 1.00 0.00 C ATOM 1241 CD1 TYR A 79 127.334 -1.910 -4.719 1.00 0.00 C ATOM 1242 CD2 TYR A 79 126.778 -3.815 -6.112 1.00 0.00 C ATOM 1243 CE1 TYR A 79 128.597 -2.459 -4.470 1.00 0.00 C ATOM 1244 CE2 TYR A 79 128.041 -4.365 -5.864 1.00 0.00 C ATOM 1245 CZ TYR A 79 128.951 -3.687 -5.043 1.00 0.00 C ATOM 1246 OH TYR A 79 130.196 -4.229 -4.798 1.00 0.00 O ATOM 0 H TYR A 79 124.941 0.449 -5.508 1.00 0.00 H new ATOM 0 HA TYR A 79 126.097 -1.174 -7.504 1.00 0.00 H new ATOM 0 HB2 TYR A 79 124.699 -1.473 -4.921 1.00 0.00 H new ATOM 0 HB3 TYR A 79 124.345 -2.787 -6.025 1.00 0.00 H new ATOM 0 HD1 TYR A 79 127.061 -0.963 -4.277 1.00 0.00 H new ATOM 0 HD2 TYR A 79 126.076 -4.338 -6.745 1.00 0.00 H new ATOM 0 HE1 TYR A 79 129.298 -1.936 -3.836 1.00 0.00 H new ATOM 0 HE2 TYR A 79 128.314 -5.312 -6.306 1.00 0.00 H new ATOM 0 HH TYR A 79 130.275 -4.451 -3.847 1.00 0.00 H new ATOM 1256 N MET A 80 122.939 -0.510 -7.839 1.00 0.00 N ATOM 1257 CA MET A 80 121.784 -0.670 -8.712 1.00 0.00 C ATOM 1258 C MET A 80 122.035 0.014 -10.053 1.00 0.00 C ATOM 1259 O MET A 80 121.840 -0.583 -11.111 1.00 0.00 O ATOM 1260 CB MET A 80 120.542 -0.068 -8.053 1.00 0.00 C ATOM 1261 CG MET A 80 119.954 -1.072 -7.060 1.00 0.00 C ATOM 1262 SD MET A 80 118.386 -0.437 -6.417 1.00 0.00 S ATOM 1263 CE MET A 80 117.309 -1.675 -7.181 1.00 0.00 C ATOM 0 H MET A 80 122.853 0.240 -7.153 1.00 0.00 H new ATOM 0 HA MET A 80 121.621 -1.734 -8.881 1.00 0.00 H new ATOM 0 HB2 MET A 80 120.802 0.858 -7.540 1.00 0.00 H new ATOM 0 HB3 MET A 80 119.802 0.186 -8.812 1.00 0.00 H new ATOM 0 HG2 MET A 80 119.796 -2.033 -7.549 1.00 0.00 H new ATOM 0 HG3 MET A 80 120.653 -1.242 -6.241 1.00 0.00 H new ATOM 0 HE1 MET A 80 116.270 -1.357 -7.094 1.00 0.00 H new ATOM 0 HE2 MET A 80 117.568 -1.782 -8.234 1.00 0.00 H new ATOM 0 HE3 MET A 80 117.439 -2.632 -6.676 1.00 0.00 H new ATOM 1273 N MET A 81 122.468 1.270 -9.999 1.00 0.00 N ATOM 1274 CA MET A 81 122.742 2.024 -11.215 1.00 0.00 C ATOM 1275 C MET A 81 123.857 1.359 -12.016 1.00 0.00 C ATOM 1276 O MET A 81 123.915 1.483 -13.238 1.00 0.00 O ATOM 1277 CB MET A 81 123.151 3.456 -10.864 1.00 0.00 C ATOM 1278 CG MET A 81 121.925 4.368 -10.930 1.00 0.00 C ATOM 1279 SD MET A 81 121.493 4.673 -12.661 1.00 0.00 S ATOM 1280 CE MET A 81 123.041 5.474 -13.144 1.00 0.00 C ATOM 0 H MET A 81 122.635 1.783 -9.133 1.00 0.00 H new ATOM 0 HA MET A 81 121.835 2.044 -11.819 1.00 0.00 H new ATOM 0 HB2 MET A 81 123.587 3.487 -9.865 1.00 0.00 H new ATOM 0 HB3 MET A 81 123.916 3.807 -11.556 1.00 0.00 H new ATOM 0 HG2 MET A 81 121.086 3.905 -10.411 1.00 0.00 H new ATOM 0 HG3 MET A 81 122.132 5.311 -10.424 1.00 0.00 H new ATOM 0 HE1 MET A 81 122.843 6.206 -13.927 1.00 0.00 H new ATOM 0 HE2 MET A 81 123.476 5.976 -12.280 1.00 0.00 H new ATOM 0 HE3 MET A 81 123.738 4.724 -13.517 1.00 0.00 H new ATOM 1290 N GLU A 82 124.741 0.653 -11.317 1.00 0.00 N ATOM 1291 CA GLU A 82 125.851 -0.027 -11.974 1.00 0.00 C ATOM 1292 C GLU A 82 125.338 -0.976 -13.049 1.00 0.00 C ATOM 1293 O GLU A 82 125.713 -0.868 -14.217 1.00 0.00 O ATOM 1294 CB GLU A 82 126.665 -0.813 -10.944 1.00 0.00 C ATOM 1295 CG GLU A 82 127.530 0.153 -10.130 1.00 0.00 C ATOM 1296 CD GLU A 82 129.004 -0.186 -10.315 1.00 0.00 C ATOM 1297 OE1 GLU A 82 129.359 -0.628 -11.396 1.00 0.00 O ATOM 1298 OE2 GLU A 82 129.759 0.003 -9.374 1.00 0.00 O ATOM 0 H GLU A 82 124.711 0.538 -10.304 1.00 0.00 H new ATOM 0 HA GLU A 82 126.486 0.725 -12.443 1.00 0.00 H new ATOM 0 HB2 GLU A 82 125.998 -1.366 -10.283 1.00 0.00 H new ATOM 0 HB3 GLU A 82 127.295 -1.547 -11.446 1.00 0.00 H new ATOM 0 HG2 GLU A 82 127.342 1.179 -10.447 1.00 0.00 H new ATOM 0 HG3 GLU A 82 127.264 0.092 -9.075 1.00 0.00 H new ATOM 1305 N SER A 83 124.480 -1.905 -12.648 1.00 0.00 N ATOM 1306 CA SER A 83 123.923 -2.871 -13.594 1.00 0.00 C ATOM 1307 C SER A 83 123.341 -4.104 -12.890 1.00 0.00 C ATOM 1308 O SER A 83 122.916 -5.048 -13.549 1.00 0.00 O ATOM 1309 CB SER A 83 125.008 -3.315 -14.575 1.00 0.00 C ATOM 1310 OG SER A 83 125.064 -2.396 -15.660 1.00 0.00 O ATOM 0 H SER A 83 124.156 -2.012 -11.687 1.00 0.00 H new ATOM 0 HA SER A 83 123.110 -2.376 -14.124 1.00 0.00 H new ATOM 0 HB2 SER A 83 125.974 -3.360 -14.071 1.00 0.00 H new ATOM 0 HB3 SER A 83 124.793 -4.318 -14.943 1.00 0.00 H new ATOM 0 HG SER A 83 125.555 -1.594 -15.384 1.00 0.00 H new ATOM 1316 N HIS A 84 123.328 -4.106 -11.561 1.00 0.00 N ATOM 1317 CA HIS A 84 122.795 -5.244 -10.823 1.00 0.00 C ATOM 1318 C HIS A 84 121.365 -4.968 -10.364 1.00 0.00 C ATOM 1319 O HIS A 84 121.138 -4.186 -9.442 1.00 0.00 O ATOM 1320 CB HIS A 84 123.680 -5.534 -9.609 1.00 0.00 C ATOM 1321 CG HIS A 84 125.117 -5.270 -9.968 1.00 0.00 C ATOM 1322 ND1 HIS A 84 125.852 -4.254 -9.379 1.00 0.00 N ATOM 1323 CD2 HIS A 84 125.966 -5.879 -10.858 1.00 0.00 C ATOM 1324 CE1 HIS A 84 127.084 -4.281 -9.916 1.00 0.00 C ATOM 1325 NE2 HIS A 84 127.208 -5.254 -10.824 1.00 0.00 N ATOM 0 H HIS A 84 123.676 -3.343 -10.980 1.00 0.00 H new ATOM 0 HA HIS A 84 122.786 -6.111 -11.483 1.00 0.00 H new ATOM 0 HB2 HIS A 84 123.382 -4.907 -8.769 1.00 0.00 H new ATOM 0 HB3 HIS A 84 123.556 -6.570 -9.293 1.00 0.00 H new ATOM 0 HD1 HIS A 84 125.519 -3.604 -8.667 1.00 0.00 H new ATOM 0 HD2 HIS A 84 125.709 -6.717 -11.489 1.00 0.00 H new ATOM 0 HE1 HIS A 84 127.877 -3.599 -9.647 1.00 0.00 H new ATOM 1334 N GLY A 85 120.403 -5.620 -11.014 1.00 0.00 N ATOM 1335 CA GLY A 85 118.997 -5.441 -10.663 1.00 0.00 C ATOM 1336 C GLY A 85 118.391 -4.256 -11.409 1.00 0.00 C ATOM 1337 O GLY A 85 118.833 -3.119 -11.244 1.00 0.00 O ATOM 0 H GLY A 85 120.570 -6.272 -11.781 1.00 0.00 H new ATOM 0 HA2 GLY A 85 118.441 -6.348 -10.902 1.00 0.00 H new ATOM 0 HA3 GLY A 85 118.904 -5.284 -9.588 1.00 0.00 H new ATOM 1341 N ASP A 86 117.379 -4.527 -12.232 1.00 0.00 N ATOM 1342 CA ASP A 86 116.732 -3.465 -12.992 1.00 0.00 C ATOM 1343 C ASP A 86 115.245 -3.370 -12.654 1.00 0.00 C ATOM 1344 O ASP A 86 114.392 -3.507 -13.532 1.00 0.00 O ATOM 1345 CB ASP A 86 116.899 -3.721 -14.494 1.00 0.00 C ATOM 1346 CG ASP A 86 117.868 -2.705 -15.092 1.00 0.00 C ATOM 1347 OD1 ASP A 86 117.592 -1.521 -14.988 1.00 0.00 O ATOM 1348 OD2 ASP A 86 118.870 -3.126 -15.645 1.00 0.00 O ATOM 0 H ASP A 86 116.996 -5.459 -12.387 1.00 0.00 H new ATOM 0 HA ASP A 86 117.208 -2.522 -12.724 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.271 -4.732 -14.660 1.00 0.00 H new ATOM 0 HB3 ASP A 86 115.932 -3.651 -14.993 1.00 0.00 H new ATOM 1353 N TRP A 87 114.931 -3.130 -11.382 1.00 0.00 N ATOM 1354 CA TRP A 87 113.535 -3.017 -10.974 1.00 0.00 C ATOM 1355 C TRP A 87 113.403 -2.269 -9.649 1.00 0.00 C ATOM 1356 O TRP A 87 113.592 -1.053 -9.601 1.00 0.00 O ATOM 1357 CB TRP A 87 112.912 -4.409 -10.873 1.00 0.00 C ATOM 1358 CG TRP A 87 113.103 -5.105 -12.179 1.00 0.00 C ATOM 1359 CD1 TRP A 87 112.261 -5.025 -13.234 1.00 0.00 C ATOM 1360 CD2 TRP A 87 114.199 -5.966 -12.591 1.00 0.00 C ATOM 1361 NE1 TRP A 87 112.776 -5.782 -14.272 1.00 0.00 N ATOM 1362 CE2 TRP A 87 113.969 -6.382 -13.922 1.00 0.00 C ATOM 1363 CE3 TRP A 87 115.357 -6.421 -11.945 1.00 0.00 C ATOM 1364 CZ2 TRP A 87 114.863 -7.217 -14.588 1.00 0.00 C ATOM 1365 CZ3 TRP A 87 116.259 -7.264 -12.612 1.00 0.00 C ATOM 1366 CH2 TRP A 87 116.014 -7.658 -13.931 1.00 0.00 C ATOM 0 H TRP A 87 115.610 -3.012 -10.630 1.00 0.00 H new ATOM 0 HA TRP A 87 113.000 -2.441 -11.729 1.00 0.00 H new ATOM 0 HB2 TRP A 87 113.380 -4.977 -10.069 1.00 0.00 H new ATOM 0 HB3 TRP A 87 111.851 -4.334 -10.635 1.00 0.00 H new ATOM 0 HD1 TRP A 87 111.339 -4.463 -13.262 1.00 0.00 H new ATOM 0 HE1 TRP A 87 112.329 -5.884 -15.183 1.00 0.00 H new ATOM 0 HE3 TRP A 87 115.556 -6.121 -10.927 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 114.668 -7.521 -15.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 117.147 -7.610 -12.104 1.00 0.00 H new ATOM 0 HH2 TRP A 87 116.714 -8.303 -14.441 1.00 0.00 H new ATOM 1377 N LEU A 88 113.057 -2.981 -8.579 1.00 0.00 N ATOM 1378 CA LEU A 88 112.888 -2.330 -7.283 1.00 0.00 C ATOM 1379 C LEU A 88 113.832 -2.887 -6.221 1.00 0.00 C ATOM 1380 O LEU A 88 114.578 -3.839 -6.452 1.00 0.00 O ATOM 1381 CB LEU A 88 111.444 -2.460 -6.783 1.00 0.00 C ATOM 1382 CG LEU A 88 110.699 -3.580 -7.517 1.00 0.00 C ATOM 1383 CD1 LEU A 88 110.287 -3.100 -8.911 1.00 0.00 C ATOM 1384 CD2 LEU A 88 111.587 -4.823 -7.636 1.00 0.00 C ATOM 0 H LEU A 88 112.891 -3.987 -8.581 1.00 0.00 H new ATOM 0 HA LEU A 88 113.131 -1.279 -7.441 1.00 0.00 H new ATOM 0 HB2 LEU A 88 111.445 -2.662 -5.712 1.00 0.00 H new ATOM 0 HB3 LEU A 88 110.920 -1.515 -6.929 1.00 0.00 H new ATOM 0 HG LEU A 88 109.807 -3.841 -6.947 1.00 0.00 H new ATOM 0 HD11 LEU A 88 109.758 -3.899 -9.429 1.00 0.00 H new ATOM 0 HD12 LEU A 88 109.634 -2.232 -8.819 1.00 0.00 H new ATOM 0 HD13 LEU A 88 111.176 -2.826 -9.479 1.00 0.00 H new ATOM 0 HD21 LEU A 88 111.044 -5.610 -8.160 1.00 0.00 H new ATOM 0 HD22 LEU A 88 112.490 -4.573 -8.193 1.00 0.00 H new ATOM 0 HD23 LEU A 88 111.860 -5.172 -6.640 1.00 0.00 H new ATOM 1396 N ALA A 89 113.771 -2.259 -5.053 1.00 0.00 N ATOM 1397 CA ALA A 89 114.597 -2.647 -3.917 1.00 0.00 C ATOM 1398 C ALA A 89 113.843 -2.413 -2.614 1.00 0.00 C ATOM 1399 O ALA A 89 113.384 -1.302 -2.344 1.00 0.00 O ATOM 1400 CB ALA A 89 115.891 -1.832 -3.912 1.00 0.00 C ATOM 0 H ALA A 89 113.151 -1.471 -4.867 1.00 0.00 H new ATOM 0 HA ALA A 89 114.837 -3.707 -4.005 1.00 0.00 H new ATOM 0 HB1 ALA A 89 116.504 -2.127 -3.060 1.00 0.00 H new ATOM 0 HB2 ALA A 89 116.440 -2.016 -4.835 1.00 0.00 H new ATOM 0 HB3 ALA A 89 115.652 -0.771 -3.837 1.00 0.00 H new ATOM 1406 N ILE A 90 113.723 -3.458 -1.803 1.00 0.00 N ATOM 1407 CA ILE A 90 113.025 -3.338 -0.528 1.00 0.00 C ATOM 1408 C ILE A 90 113.859 -2.518 0.444 1.00 0.00 C ATOM 1409 O ILE A 90 114.994 -2.883 0.752 1.00 0.00 O ATOM 1410 CB ILE A 90 112.782 -4.721 0.074 1.00 0.00 C ATOM 1411 CG1 ILE A 90 112.573 -5.740 -1.049 1.00 0.00 C ATOM 1412 CG2 ILE A 90 111.540 -4.681 0.968 1.00 0.00 C ATOM 1413 CD1 ILE A 90 111.715 -6.899 -0.534 1.00 0.00 C ATOM 0 H ILE A 90 114.095 -4.387 -2.002 1.00 0.00 H new ATOM 0 HA ILE A 90 112.069 -2.844 -0.703 1.00 0.00 H new ATOM 0 HB ILE A 90 113.647 -5.012 0.670 1.00 0.00 H new ATOM 0 HG12 ILE A 90 112.087 -5.264 -1.901 1.00 0.00 H new ATOM 0 HG13 ILE A 90 113.535 -6.114 -1.399 1.00 0.00 H new ATOM 0 HG21 ILE A 90 111.368 -5.668 1.397 1.00 0.00 H new ATOM 0 HG22 ILE A 90 111.692 -3.959 1.770 1.00 0.00 H new ATOM 0 HG23 ILE A 90 110.674 -4.387 0.375 1.00 0.00 H new ATOM 0 HD11 ILE A 90 111.566 -7.625 -1.334 1.00 0.00 H new ATOM 0 HD12 ILE A 90 112.219 -7.381 0.304 1.00 0.00 H new ATOM 0 HD13 ILE A 90 110.748 -6.518 -0.205 1.00 0.00 H new ATOM 1425 N PRO A 91 113.336 -1.428 0.938 1.00 0.00 N ATOM 1426 CA PRO A 91 114.080 -0.572 1.893 1.00 0.00 C ATOM 1427 C PRO A 91 114.420 -1.334 3.170 1.00 0.00 C ATOM 1428 O PRO A 91 113.534 -1.692 3.943 1.00 0.00 O ATOM 1429 CB PRO A 91 113.135 0.601 2.181 1.00 0.00 C ATOM 1430 CG PRO A 91 111.783 0.163 1.725 1.00 0.00 C ATOM 1431 CD PRO A 91 111.999 -0.894 0.646 1.00 0.00 C ATOM 0 HA PRO A 91 115.035 -0.239 1.487 1.00 0.00 H new ATOM 0 HB2 PRO A 91 113.128 0.845 3.243 1.00 0.00 H new ATOM 0 HB3 PRO A 91 113.454 1.498 1.650 1.00 0.00 H new ATOM 0 HG2 PRO A 91 111.209 -0.246 2.556 1.00 0.00 H new ATOM 0 HG3 PRO A 91 111.216 1.007 1.331 1.00 0.00 H new ATOM 0 HD2 PRO A 91 111.238 -1.673 0.692 1.00 0.00 H new ATOM 0 HD3 PRO A 91 111.951 -0.461 -0.353 1.00 0.00 H new ATOM 1439 N TYR A 92 115.709 -1.590 3.378 1.00 0.00 N ATOM 1440 CA TYR A 92 116.154 -2.322 4.559 1.00 0.00 C ATOM 1441 C TYR A 92 115.205 -2.077 5.725 1.00 0.00 C ATOM 1442 O TYR A 92 115.053 -2.923 6.605 1.00 0.00 O ATOM 1443 CB TYR A 92 117.570 -1.887 4.945 1.00 0.00 C ATOM 1444 CG TYR A 92 117.708 -0.393 4.768 1.00 0.00 C ATOM 1445 CD1 TYR A 92 117.824 0.153 3.484 1.00 0.00 C ATOM 1446 CD2 TYR A 92 117.724 0.444 5.889 1.00 0.00 C ATOM 1447 CE1 TYR A 92 117.956 1.538 3.323 1.00 0.00 C ATOM 1448 CE2 TYR A 92 117.856 1.828 5.728 1.00 0.00 C ATOM 1449 CZ TYR A 92 117.971 2.375 4.444 1.00 0.00 C ATOM 1450 OH TYR A 92 118.100 3.739 4.285 1.00 0.00 O ATOM 0 H TYR A 92 116.459 -1.303 2.749 1.00 0.00 H new ATOM 0 HA TYR A 92 116.157 -3.387 4.325 1.00 0.00 H new ATOM 0 HB2 TYR A 92 117.776 -2.161 5.980 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.302 -2.406 4.326 1.00 0.00 H new ATOM 0 HD1 TYR A 92 117.812 -0.493 2.619 1.00 0.00 H new ATOM 0 HD2 TYR A 92 117.634 0.022 6.879 1.00 0.00 H new ATOM 0 HE1 TYR A 92 118.046 1.960 2.333 1.00 0.00 H new ATOM 0 HE2 TYR A 92 117.869 2.474 6.594 1.00 0.00 H new ATOM 0 HH TYR A 92 118.091 4.173 5.164 1.00 0.00 H new ATOM 1460 N ARG A 93 114.561 -0.916 5.716 1.00 0.00 N ATOM 1461 CA ARG A 93 113.616 -0.570 6.772 1.00 0.00 C ATOM 1462 C ARG A 93 112.253 -1.181 6.475 1.00 0.00 C ATOM 1463 O ARG A 93 111.224 -0.715 6.966 1.00 0.00 O ATOM 1464 CB ARG A 93 113.489 0.950 6.891 1.00 0.00 C ATOM 1465 CG ARG A 93 114.682 1.503 7.673 1.00 0.00 C ATOM 1466 CD ARG A 93 114.365 2.920 8.152 1.00 0.00 C ATOM 1467 NE ARG A 93 113.559 3.621 7.160 1.00 0.00 N ATOM 1468 CZ ARG A 93 114.105 4.105 6.049 1.00 0.00 C ATOM 1469 NH1 ARG A 93 115.384 3.958 5.832 1.00 0.00 N ATOM 1470 NH2 ARG A 93 113.362 4.728 5.175 1.00 0.00 N ATOM 0 H ARG A 93 114.674 -0.203 4.996 1.00 0.00 H new ATOM 0 HA ARG A 93 113.987 -0.969 7.716 1.00 0.00 H new ATOM 0 HB2 ARG A 93 113.450 1.401 5.899 1.00 0.00 H new ATOM 0 HB3 ARG A 93 112.558 1.209 7.396 1.00 0.00 H new ATOM 0 HG2 ARG A 93 114.901 0.860 8.525 1.00 0.00 H new ATOM 0 HG3 ARG A 93 115.571 1.511 7.043 1.00 0.00 H new ATOM 0 HD2 ARG A 93 113.831 2.879 9.101 1.00 0.00 H new ATOM 0 HD3 ARG A 93 115.291 3.467 8.330 1.00 0.00 H new ATOM 0 HE ARG A 93 112.559 3.742 7.321 1.00 0.00 H new ATOM 0 HH11 ARG A 93 115.965 3.472 6.515 1.00 0.00 H new ATOM 0 HH12 ARG A 93 115.803 4.330 4.979 1.00 0.00 H new ATOM 0 HH21 ARG A 93 112.363 4.843 5.345 1.00 0.00 H new ATOM 0 HH22 ARG A 93 113.781 5.100 4.322 1.00 0.00 H new ATOM 1484 N SER A 94 112.263 -2.224 5.657 1.00 0.00 N ATOM 1485 CA SER A 94 111.036 -2.907 5.272 1.00 0.00 C ATOM 1486 C SER A 94 110.942 -4.274 5.942 1.00 0.00 C ATOM 1487 O SER A 94 110.935 -5.304 5.268 1.00 0.00 O ATOM 1488 CB SER A 94 110.993 -3.079 3.755 1.00 0.00 C ATOM 1489 OG SER A 94 110.250 -4.248 3.435 1.00 0.00 O ATOM 0 H SER A 94 113.110 -2.617 5.246 1.00 0.00 H new ATOM 0 HA SER A 94 110.191 -2.301 5.597 1.00 0.00 H new ATOM 0 HB2 SER A 94 110.535 -2.205 3.291 1.00 0.00 H new ATOM 0 HB3 SER A 94 112.005 -3.157 3.358 1.00 0.00 H new ATOM 0 HG SER A 94 110.767 -5.043 3.683 1.00 0.00 H new ATOM 1495 N GLY A 95 110.873 -4.274 7.270 1.00 0.00 N ATOM 1496 CA GLY A 95 110.780 -5.516 8.035 1.00 0.00 C ATOM 1497 C GLY A 95 110.567 -6.728 7.127 1.00 0.00 C ATOM 1498 O GLY A 95 111.412 -7.620 7.065 1.00 0.00 O ATOM 0 H GLY A 95 110.880 -3.428 7.840 1.00 0.00 H new ATOM 0 HA2 GLY A 95 111.691 -5.654 8.617 1.00 0.00 H new ATOM 0 HA3 GLY A 95 109.956 -5.445 8.745 1.00 0.00 H new ATOM 1502 N PRO A 96 109.463 -6.775 6.427 1.00 0.00 N ATOM 1503 CA PRO A 96 109.141 -7.900 5.505 1.00 0.00 C ATOM 1504 C PRO A 96 110.372 -8.410 4.756 1.00 0.00 C ATOM 1505 O PRO A 96 110.387 -9.540 4.267 1.00 0.00 O ATOM 1506 CB PRO A 96 108.126 -7.281 4.549 1.00 0.00 C ATOM 1507 CG PRO A 96 107.414 -6.240 5.354 1.00 0.00 C ATOM 1508 CD PRO A 96 108.389 -5.765 6.439 1.00 0.00 C ATOM 0 HA PRO A 96 108.764 -8.776 6.032 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.619 -6.840 3.683 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.431 -8.031 4.173 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.106 -5.407 4.721 1.00 0.00 H new ATOM 0 HG3 PRO A 96 106.509 -6.651 5.802 1.00 0.00 H new ATOM 0 HD2 PRO A 96 108.776 -4.770 6.219 1.00 0.00 H new ATOM 0 HD3 PRO A 96 107.904 -5.710 7.414 1.00 0.00 H new ATOM 1516 N ALA A 97 111.404 -7.577 4.681 1.00 0.00 N ATOM 1517 CA ALA A 97 112.635 -7.959 4.003 1.00 0.00 C ATOM 1518 C ALA A 97 113.471 -8.855 4.908 1.00 0.00 C ATOM 1519 O ALA A 97 114.049 -9.846 4.460 1.00 0.00 O ATOM 1520 CB ALA A 97 113.437 -6.712 3.626 1.00 0.00 C ATOM 0 H ALA A 97 111.412 -6.638 5.079 1.00 0.00 H new ATOM 0 HA ALA A 97 112.381 -8.505 3.095 1.00 0.00 H new ATOM 0 HB1 ALA A 97 114.355 -7.009 3.120 1.00 0.00 H new ATOM 0 HB2 ALA A 97 112.843 -6.085 2.961 1.00 0.00 H new ATOM 0 HB3 ALA A 97 113.685 -6.152 4.528 1.00 0.00 H new ATOM 1526 N SER A 98 113.515 -8.509 6.190 1.00 0.00 N ATOM 1527 CA SER A 98 114.266 -9.306 7.148 1.00 0.00 C ATOM 1528 C SER A 98 113.561 -10.638 7.346 1.00 0.00 C ATOM 1529 O SER A 98 114.095 -11.694 7.005 1.00 0.00 O ATOM 1530 CB SER A 98 114.370 -8.571 8.484 1.00 0.00 C ATOM 1531 OG SER A 98 113.082 -8.101 8.861 1.00 0.00 O ATOM 0 H SER A 98 113.046 -7.693 6.584 1.00 0.00 H new ATOM 0 HA SER A 98 115.273 -9.474 6.766 1.00 0.00 H new ATOM 0 HB2 SER A 98 114.765 -9.238 9.250 1.00 0.00 H new ATOM 0 HB3 SER A 98 115.065 -7.735 8.400 1.00 0.00 H new ATOM 0 HG SER A 98 112.778 -7.427 8.217 1.00 0.00 H new ATOM 1537 N ASN A 99 112.350 -10.579 7.882 1.00 0.00 N ATOM 1538 CA ASN A 99 111.570 -11.787 8.103 1.00 0.00 C ATOM 1539 C ASN A 99 111.642 -12.671 6.865 1.00 0.00 C ATOM 1540 O ASN A 99 111.621 -13.897 6.960 1.00 0.00 O ATOM 1541 CB ASN A 99 110.111 -11.426 8.397 1.00 0.00 C ATOM 1542 CG ASN A 99 109.872 -11.411 9.902 1.00 0.00 C ATOM 1543 OD1 ASN A 99 109.859 -10.346 10.519 1.00 0.00 O ATOM 1544 ND2 ASN A 99 109.678 -12.536 10.535 1.00 0.00 N ATOM 0 H ASN A 99 111.890 -9.715 8.170 1.00 0.00 H new ATOM 0 HA ASN A 99 111.979 -12.325 8.959 1.00 0.00 H new ATOM 0 HB2 ASN A 99 109.877 -10.449 7.973 1.00 0.00 H new ATOM 0 HB3 ASN A 99 109.446 -12.147 7.922 1.00 0.00 H new ATOM 0 HD21 ASN A 99 109.515 -12.533 11.542 1.00 0.00 H new ATOM 0 HD22 ASN A 99 109.689 -13.418 10.023 1.00 0.00 H new ATOM 1551 N VAL A 100 111.745 -12.030 5.704 1.00 0.00 N ATOM 1552 CA VAL A 100 111.839 -12.754 4.443 1.00 0.00 C ATOM 1553 C VAL A 100 113.100 -13.611 4.432 1.00 0.00 C ATOM 1554 O VAL A 100 113.051 -14.811 4.165 1.00 0.00 O ATOM 1555 CB VAL A 100 111.879 -11.756 3.280 1.00 0.00 C ATOM 1556 CG1 VAL A 100 112.746 -12.311 2.148 1.00 0.00 C ATOM 1557 CG2 VAL A 100 110.459 -11.517 2.763 1.00 0.00 C ATOM 0 H VAL A 100 111.765 -11.014 5.612 1.00 0.00 H new ATOM 0 HA VAL A 100 110.968 -13.401 4.333 1.00 0.00 H new ATOM 0 HB VAL A 100 112.304 -10.815 3.630 1.00 0.00 H new ATOM 0 HG11 VAL A 100 112.770 -11.597 1.325 1.00 0.00 H new ATOM 0 HG12 VAL A 100 113.759 -12.478 2.514 1.00 0.00 H new ATOM 0 HG13 VAL A 100 112.327 -13.254 1.798 1.00 0.00 H new ATOM 0 HG21 VAL A 100 110.487 -10.807 1.936 1.00 0.00 H new ATOM 0 HG22 VAL A 100 110.034 -12.460 2.418 1.00 0.00 H new ATOM 0 HG23 VAL A 100 109.842 -11.114 3.566 1.00 0.00 H new ATOM 1567 N THR A 101 114.228 -12.979 4.737 1.00 0.00 N ATOM 1568 CA THR A 101 115.509 -13.677 4.779 1.00 0.00 C ATOM 1569 C THR A 101 115.512 -14.713 5.886 1.00 0.00 C ATOM 1570 O THR A 101 115.924 -15.858 5.695 1.00 0.00 O ATOM 1571 CB THR A 101 116.624 -12.677 5.068 1.00 0.00 C ATOM 1572 OG1 THR A 101 116.359 -11.460 4.385 1.00 0.00 O ATOM 1573 CG2 THR A 101 117.964 -13.250 4.604 1.00 0.00 C ATOM 0 H THR A 101 114.282 -11.985 4.959 1.00 0.00 H new ATOM 0 HA THR A 101 115.665 -14.164 3.816 1.00 0.00 H new ATOM 0 HB THR A 101 116.670 -12.486 6.140 1.00 0.00 H new ATOM 0 HG1 THR A 101 117.075 -10.817 4.572 1.00 0.00 H new ATOM 0 HG21 THR A 101 118.758 -12.533 4.812 1.00 0.00 H new ATOM 0 HG22 THR A 101 118.166 -14.180 5.136 1.00 0.00 H new ATOM 0 HG23 THR A 101 117.924 -13.447 3.533 1.00 0.00 H new ATOM 1581 N ALA A 102 115.058 -14.283 7.048 1.00 0.00 N ATOM 1582 CA ALA A 102 115.006 -15.142 8.213 1.00 0.00 C ATOM 1583 C ALA A 102 113.905 -16.186 8.060 1.00 0.00 C ATOM 1584 O ALA A 102 113.936 -17.234 8.704 1.00 0.00 O ATOM 1585 CB ALA A 102 114.763 -14.284 9.449 1.00 0.00 C ATOM 0 H ALA A 102 114.717 -13.335 7.209 1.00 0.00 H new ATOM 0 HA ALA A 102 115.954 -15.670 8.318 1.00 0.00 H new ATOM 0 HB1 ALA A 102 114.722 -14.922 10.332 1.00 0.00 H new ATOM 0 HB2 ALA A 102 115.575 -13.565 9.558 1.00 0.00 H new ATOM 0 HB3 ALA A 102 113.818 -13.751 9.342 1.00 0.00 H new ATOM 1591 N LYS A 103 112.939 -15.895 7.194 1.00 0.00 N ATOM 1592 CA LYS A 103 111.840 -16.823 6.957 1.00 0.00 C ATOM 1593 C LYS A 103 112.283 -17.929 6.005 1.00 0.00 C ATOM 1594 O LYS A 103 111.869 -19.081 6.139 1.00 0.00 O ATOM 1595 CB LYS A 103 110.641 -16.084 6.359 1.00 0.00 C ATOM 1596 CG LYS A 103 109.646 -17.099 5.793 1.00 0.00 C ATOM 1597 CD LYS A 103 108.219 -16.641 6.102 1.00 0.00 C ATOM 1598 CE LYS A 103 107.940 -15.320 5.386 1.00 0.00 C ATOM 1599 NZ LYS A 103 106.864 -14.582 6.105 1.00 0.00 N ATOM 0 H LYS A 103 112.895 -15.033 6.650 1.00 0.00 H new ATOM 0 HA LYS A 103 111.548 -17.264 7.910 1.00 0.00 H new ATOM 0 HB2 LYS A 103 110.159 -15.473 7.123 1.00 0.00 H new ATOM 0 HB3 LYS A 103 110.973 -15.407 5.572 1.00 0.00 H new ATOM 0 HG2 LYS A 103 109.783 -17.197 4.716 1.00 0.00 H new ATOM 0 HG3 LYS A 103 109.826 -18.082 6.228 1.00 0.00 H new ATOM 0 HD2 LYS A 103 107.505 -17.399 5.780 1.00 0.00 H new ATOM 0 HD3 LYS A 103 108.090 -16.518 7.177 1.00 0.00 H new ATOM 0 HE2 LYS A 103 108.847 -14.716 5.348 1.00 0.00 H new ATOM 0 HE3 LYS A 103 107.640 -15.509 4.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 106.674 -13.683 5.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 105.998 -15.158 6.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 107.168 -14.389 7.081 1.00 0.00 H new ATOM 1613 N TYR A 104 113.129 -17.570 5.043 1.00 0.00 N ATOM 1614 CA TYR A 104 113.623 -18.542 4.074 1.00 0.00 C ATOM 1615 C TYR A 104 114.794 -19.327 4.654 1.00 0.00 C ATOM 1616 O TYR A 104 115.292 -20.266 4.033 1.00 0.00 O ATOM 1617 CB TYR A 104 114.066 -17.827 2.796 1.00 0.00 C ATOM 1618 CG TYR A 104 112.888 -17.690 1.861 1.00 0.00 C ATOM 1619 CD1 TYR A 104 111.794 -16.896 2.226 1.00 0.00 C ATOM 1620 CD2 TYR A 104 112.889 -18.356 0.630 1.00 0.00 C ATOM 1621 CE1 TYR A 104 110.702 -16.767 1.360 1.00 0.00 C ATOM 1622 CE2 TYR A 104 111.796 -18.229 -0.236 1.00 0.00 C ATOM 1623 CZ TYR A 104 110.703 -17.434 0.128 1.00 0.00 C ATOM 1624 OH TYR A 104 109.627 -17.309 -0.725 1.00 0.00 O ATOM 0 H TYR A 104 113.484 -16.622 4.915 1.00 0.00 H new ATOM 0 HA TYR A 104 112.816 -19.236 3.839 1.00 0.00 H new ATOM 0 HB2 TYR A 104 114.468 -16.843 3.038 1.00 0.00 H new ATOM 0 HB3 TYR A 104 114.865 -18.388 2.311 1.00 0.00 H new ATOM 0 HD1 TYR A 104 111.793 -16.383 3.176 1.00 0.00 H new ATOM 0 HD2 TYR A 104 113.733 -18.968 0.348 1.00 0.00 H new ATOM 0 HE1 TYR A 104 109.859 -16.153 1.641 1.00 0.00 H new ATOM 0 HE2 TYR A 104 111.796 -18.745 -1.185 1.00 0.00 H new ATOM 0 HH TYR A 104 109.790 -17.835 -1.536 1.00 0.00 H new ATOM 1634 N GLY A 105 115.232 -18.935 5.845 1.00 0.00 N ATOM 1635 CA GLY A 105 116.348 -19.608 6.498 1.00 0.00 C ATOM 1636 C GLY A 105 117.647 -19.356 5.744 1.00 0.00 C ATOM 1637 O GLY A 105 118.541 -20.203 5.726 1.00 0.00 O ATOM 0 H GLY A 105 114.834 -18.160 6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 105 116.443 -19.253 7.524 1.00 0.00 H new ATOM 0 HA3 GLY A 105 116.153 -20.679 6.548 1.00 0.00 H new ATOM 1641 N ILE A 106 117.743 -18.187 5.120 1.00 0.00 N ATOM 1642 CA ILE A 106 118.935 -17.830 4.361 1.00 0.00 C ATOM 1643 C ILE A 106 120.088 -17.494 5.293 1.00 0.00 C ATOM 1644 O ILE A 106 119.919 -16.747 6.258 1.00 0.00 O ATOM 1645 CB ILE A 106 118.650 -16.622 3.488 1.00 0.00 C ATOM 1646 CG1 ILE A 106 117.318 -16.818 2.751 1.00 0.00 C ATOM 1647 CG2 ILE A 106 119.790 -16.457 2.483 1.00 0.00 C ATOM 1648 CD1 ILE A 106 117.579 -17.209 1.295 1.00 0.00 C ATOM 0 H ILE A 106 117.014 -17.474 5.125 1.00 0.00 H new ATOM 0 HA ILE A 106 119.209 -18.685 3.743 1.00 0.00 H new ATOM 0 HB ILE A 106 118.578 -15.726 4.105 1.00 0.00 H new ATOM 0 HG12 ILE A 106 116.730 -17.592 3.244 1.00 0.00 H new ATOM 0 HG13 ILE A 106 116.732 -15.899 2.790 1.00 0.00 H new ATOM 0 HG21 ILE A 106 119.595 -15.591 1.850 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.728 -16.311 3.018 1.00 0.00 H new ATOM 0 HG23 ILE A 106 119.861 -17.351 1.863 1.00 0.00 H new ATOM 0 HD11 ILE A 106 116.629 -17.346 0.779 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.148 -16.420 0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 106 118.146 -18.139 1.264 1.00 0.00 H new ATOM 1660 N THR A 107 121.259 -18.047 5.002 1.00 0.00 N ATOM 1661 CA THR A 107 122.429 -17.800 5.830 1.00 0.00 C ATOM 1662 C THR A 107 123.704 -18.215 5.103 1.00 0.00 C ATOM 1663 O THR A 107 124.715 -18.530 5.731 1.00 0.00 O ATOM 1664 CB THR A 107 122.299 -18.583 7.137 1.00 0.00 C ATOM 1665 OG1 THR A 107 123.231 -19.656 7.139 1.00 0.00 O ATOM 1666 CG2 THR A 107 120.877 -19.138 7.255 1.00 0.00 C ATOM 0 H THR A 107 121.422 -18.664 4.206 1.00 0.00 H new ATOM 0 HA THR A 107 122.489 -16.733 6.044 1.00 0.00 H new ATOM 0 HB THR A 107 122.503 -17.925 7.981 1.00 0.00 H new ATOM 0 HG1 THR A 107 124.142 -19.298 7.087 1.00 0.00 H new ATOM 0 HG21 THR A 107 120.781 -19.697 8.186 1.00 0.00 H new ATOM 0 HG22 THR A 107 120.163 -18.314 7.251 1.00 0.00 H new ATOM 0 HG23 THR A 107 120.673 -19.799 6.412 1.00 0.00 H new ATOM 1674 N GLY A 108 123.649 -18.212 3.776 1.00 0.00 N ATOM 1675 CA GLY A 108 124.805 -18.588 2.971 1.00 0.00 C ATOM 1676 C GLY A 108 125.339 -17.389 2.194 1.00 0.00 C ATOM 1677 O GLY A 108 126.016 -17.546 1.179 1.00 0.00 O ATOM 0 H GLY A 108 122.822 -17.955 3.237 1.00 0.00 H new ATOM 0 HA2 GLY A 108 125.588 -18.987 3.616 1.00 0.00 H new ATOM 0 HA3 GLY A 108 124.528 -19.382 2.278 1.00 0.00 H new ATOM 1681 N ILE A 109 125.026 -16.192 2.680 1.00 0.00 N ATOM 1682 CA ILE A 109 125.475 -14.970 2.027 1.00 0.00 C ATOM 1683 C ILE A 109 126.983 -15.015 1.780 1.00 0.00 C ATOM 1684 O ILE A 109 127.751 -15.378 2.672 1.00 0.00 O ATOM 1685 CB ILE A 109 125.135 -13.771 2.910 1.00 0.00 C ATOM 1686 CG1 ILE A 109 124.312 -14.248 4.110 1.00 0.00 C ATOM 1687 CG2 ILE A 109 124.321 -12.752 2.107 1.00 0.00 C ATOM 1688 CD1 ILE A 109 123.040 -14.943 3.618 1.00 0.00 C ATOM 0 H ILE A 109 124.466 -16.044 3.520 1.00 0.00 H new ATOM 0 HA ILE A 109 124.969 -14.877 1.066 1.00 0.00 H new ATOM 0 HB ILE A 109 126.056 -13.302 3.257 1.00 0.00 H new ATOM 0 HG12 ILE A 109 124.901 -14.934 4.718 1.00 0.00 H new ATOM 0 HG13 ILE A 109 124.053 -13.401 4.746 1.00 0.00 H new ATOM 0 HG21 ILE A 109 124.080 -11.898 2.740 1.00 0.00 H new ATOM 0 HG22 ILE A 109 124.904 -12.415 1.250 1.00 0.00 H new ATOM 0 HG23 ILE A 109 123.399 -13.217 1.759 1.00 0.00 H new ATOM 0 HD11 ILE A 109 122.456 -15.282 4.474 1.00 0.00 H new ATOM 0 HD12 ILE A 109 122.448 -14.243 3.029 1.00 0.00 H new ATOM 0 HD13 ILE A 109 123.309 -15.800 3.001 1.00 0.00 H new ATOM 1700 N PRO A 110 127.421 -14.656 0.599 1.00 0.00 N ATOM 1701 CA PRO A 110 126.527 -14.210 -0.511 1.00 0.00 C ATOM 1702 C PRO A 110 125.745 -15.371 -1.119 1.00 0.00 C ATOM 1703 O PRO A 110 126.275 -16.471 -1.277 1.00 0.00 O ATOM 1704 CB PRO A 110 127.492 -13.611 -1.536 1.00 0.00 C ATOM 1705 CG PRO A 110 128.799 -14.285 -1.290 1.00 0.00 C ATOM 1706 CD PRO A 110 128.837 -14.641 0.197 1.00 0.00 C ATOM 0 HA PRO A 110 125.770 -13.505 -0.168 1.00 0.00 H new ATOM 0 HB2 PRO A 110 127.144 -13.788 -2.554 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.577 -12.531 -1.412 1.00 0.00 H new ATOM 0 HG2 PRO A 110 128.895 -15.180 -1.905 1.00 0.00 H new ATOM 0 HG3 PRO A 110 129.628 -13.628 -1.552 1.00 0.00 H new ATOM 0 HD2 PRO A 110 129.309 -15.609 0.363 1.00 0.00 H new ATOM 0 HD3 PRO A 110 129.406 -13.907 0.768 1.00 0.00 H new ATOM 1714 N ALA A 111 124.482 -15.124 -1.456 1.00 0.00 N ATOM 1715 CA ALA A 111 123.647 -16.168 -2.043 1.00 0.00 C ATOM 1716 C ALA A 111 122.458 -15.562 -2.781 1.00 0.00 C ATOM 1717 O ALA A 111 121.986 -14.478 -2.437 1.00 0.00 O ATOM 1718 CB ALA A 111 123.142 -17.107 -0.947 1.00 0.00 C ATOM 0 H ALA A 111 124.019 -14.223 -1.335 1.00 0.00 H new ATOM 0 HA ALA A 111 124.252 -16.728 -2.756 1.00 0.00 H new ATOM 0 HB1 ALA A 111 122.520 -17.884 -1.392 1.00 0.00 H new ATOM 0 HB2 ALA A 111 123.991 -17.567 -0.442 1.00 0.00 H new ATOM 0 HB3 ALA A 111 122.554 -16.540 -0.225 1.00 0.00 H new ATOM 1724 N LEU A 112 121.979 -16.272 -3.798 1.00 0.00 N ATOM 1725 CA LEU A 112 120.843 -15.799 -4.581 1.00 0.00 C ATOM 1726 C LEU A 112 119.712 -16.822 -4.548 1.00 0.00 C ATOM 1727 O LEU A 112 119.896 -17.972 -4.944 1.00 0.00 O ATOM 1728 CB LEU A 112 121.280 -15.563 -6.030 1.00 0.00 C ATOM 1729 CG LEU A 112 120.408 -14.480 -6.666 1.00 0.00 C ATOM 1730 CD1 LEU A 112 121.148 -13.869 -7.858 1.00 0.00 C ATOM 1731 CD2 LEU A 112 119.095 -15.100 -7.148 1.00 0.00 C ATOM 0 H LEU A 112 122.357 -17.171 -4.098 1.00 0.00 H new ATOM 0 HA LEU A 112 120.484 -14.864 -4.150 1.00 0.00 H new ATOM 0 HB2 LEU A 112 122.327 -15.262 -6.059 1.00 0.00 H new ATOM 0 HB3 LEU A 112 121.198 -16.489 -6.599 1.00 0.00 H new ATOM 0 HG LEU A 112 120.196 -13.705 -5.930 1.00 0.00 H new ATOM 0 HD11 LEU A 112 120.529 -13.096 -8.314 1.00 0.00 H new ATOM 0 HD12 LEU A 112 122.085 -13.429 -7.518 1.00 0.00 H new ATOM 0 HD13 LEU A 112 121.358 -14.646 -8.593 1.00 0.00 H new ATOM 0 HD21 LEU A 112 118.473 -14.328 -7.601 1.00 0.00 H new ATOM 0 HD22 LEU A 112 119.307 -15.874 -7.885 1.00 0.00 H new ATOM 0 HD23 LEU A 112 118.568 -15.540 -6.301 1.00 0.00 H new ATOM 1743 N VAL A 113 118.541 -16.399 -4.078 1.00 0.00 N ATOM 1744 CA VAL A 113 117.392 -17.296 -4.009 1.00 0.00 C ATOM 1745 C VAL A 113 116.392 -16.951 -5.104 1.00 0.00 C ATOM 1746 O VAL A 113 116.082 -15.783 -5.327 1.00 0.00 O ATOM 1747 CB VAL A 113 116.723 -17.184 -2.636 1.00 0.00 C ATOM 1748 CG1 VAL A 113 115.235 -17.531 -2.750 1.00 0.00 C ATOM 1749 CG2 VAL A 113 117.396 -18.148 -1.654 1.00 0.00 C ATOM 0 H VAL A 113 118.364 -15.452 -3.743 1.00 0.00 H new ATOM 0 HA VAL A 113 117.735 -18.320 -4.155 1.00 0.00 H new ATOM 0 HB VAL A 113 116.828 -16.162 -2.273 1.00 0.00 H new ATOM 0 HG11 VAL A 113 114.766 -17.449 -1.769 1.00 0.00 H new ATOM 0 HG12 VAL A 113 114.752 -16.841 -3.442 1.00 0.00 H new ATOM 0 HG13 VAL A 113 115.126 -18.551 -3.120 1.00 0.00 H new ATOM 0 HG21 VAL A 113 116.918 -18.066 -0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 113 117.297 -19.169 -2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 113 118.452 -17.896 -1.563 1.00 0.00 H new ATOM 1759 N ILE A 114 115.898 -17.974 -5.792 1.00 0.00 N ATOM 1760 CA ILE A 114 114.944 -17.749 -6.870 1.00 0.00 C ATOM 1761 C ILE A 114 113.618 -18.449 -6.602 1.00 0.00 C ATOM 1762 O ILE A 114 113.571 -19.653 -6.355 1.00 0.00 O ATOM 1763 CB ILE A 114 115.527 -18.237 -8.196 1.00 0.00 C ATOM 1764 CG1 ILE A 114 116.858 -17.531 -8.449 1.00 0.00 C ATOM 1765 CG2 ILE A 114 114.557 -17.904 -9.333 1.00 0.00 C ATOM 1766 CD1 ILE A 114 116.640 -16.018 -8.421 1.00 0.00 C ATOM 0 H ILE A 114 116.137 -18.952 -5.626 1.00 0.00 H new ATOM 0 HA ILE A 114 114.754 -16.677 -6.925 1.00 0.00 H new ATOM 0 HB ILE A 114 115.682 -19.315 -8.152 1.00 0.00 H new ATOM 0 HG12 ILE A 114 117.586 -17.819 -7.691 1.00 0.00 H new ATOM 0 HG13 ILE A 114 117.266 -17.834 -9.413 1.00 0.00 H new ATOM 0 HG21 ILE A 114 114.972 -18.252 -10.279 1.00 0.00 H new ATOM 0 HG22 ILE A 114 113.602 -18.397 -9.153 1.00 0.00 H new ATOM 0 HG23 ILE A 114 114.405 -16.826 -9.378 1.00 0.00 H new ATOM 0 HD11 ILE A 114 117.588 -15.510 -8.601 1.00 0.00 H new ATOM 0 HD12 ILE A 114 115.926 -15.739 -9.196 1.00 0.00 H new ATOM 0 HD13 ILE A 114 116.251 -15.724 -7.446 1.00 0.00 H new ATOM 1778 N VAL A 115 112.543 -17.672 -6.658 1.00 0.00 N ATOM 1779 CA VAL A 115 111.204 -18.201 -6.432 1.00 0.00 C ATOM 1780 C VAL A 115 110.230 -17.607 -7.441 1.00 0.00 C ATOM 1781 O VAL A 115 110.400 -16.472 -7.885 1.00 0.00 O ATOM 1782 CB VAL A 115 110.737 -17.873 -5.014 1.00 0.00 C ATOM 1783 CG1 VAL A 115 111.923 -17.952 -4.051 1.00 0.00 C ATOM 1784 CG2 VAL A 115 110.151 -16.459 -4.986 1.00 0.00 C ATOM 0 H VAL A 115 112.573 -16.672 -6.858 1.00 0.00 H new ATOM 0 HA VAL A 115 111.233 -19.284 -6.555 1.00 0.00 H new ATOM 0 HB VAL A 115 109.975 -18.590 -4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 115 111.588 -17.718 -3.041 1.00 0.00 H new ATOM 0 HG12 VAL A 115 112.341 -18.958 -4.070 1.00 0.00 H new ATOM 0 HG13 VAL A 115 112.687 -17.236 -4.355 1.00 0.00 H new ATOM 0 HG21 VAL A 115 109.817 -16.223 -3.975 1.00 0.00 H new ATOM 0 HG22 VAL A 115 110.914 -15.743 -5.293 1.00 0.00 H new ATOM 0 HG23 VAL A 115 109.304 -16.402 -5.670 1.00 0.00 H new ATOM 1794 N LYS A 116 109.212 -18.378 -7.802 1.00 0.00 N ATOM 1795 CA LYS A 116 108.222 -17.914 -8.761 1.00 0.00 C ATOM 1796 C LYS A 116 107.368 -16.799 -8.162 1.00 0.00 C ATOM 1797 O LYS A 116 107.355 -16.600 -6.948 1.00 0.00 O ATOM 1798 CB LYS A 116 107.332 -19.084 -9.166 1.00 0.00 C ATOM 1799 CG LYS A 116 108.146 -20.062 -10.012 1.00 0.00 C ATOM 1800 CD LYS A 116 107.199 -20.993 -10.764 1.00 0.00 C ATOM 1801 CE LYS A 116 107.860 -22.360 -10.946 1.00 0.00 C ATOM 1802 NZ LYS A 116 107.432 -22.950 -12.245 1.00 0.00 N ATOM 0 H LYS A 116 109.052 -19.321 -7.447 1.00 0.00 H new ATOM 0 HA LYS A 116 108.737 -17.518 -9.636 1.00 0.00 H new ATOM 0 HB2 LYS A 116 106.944 -19.586 -8.280 1.00 0.00 H new ATOM 0 HB3 LYS A 116 106.472 -18.724 -9.730 1.00 0.00 H new ATOM 0 HG2 LYS A 116 108.772 -19.516 -10.717 1.00 0.00 H new ATOM 0 HG3 LYS A 116 108.814 -20.642 -9.375 1.00 0.00 H new ATOM 0 HD2 LYS A 116 106.265 -21.100 -10.213 1.00 0.00 H new ATOM 0 HD3 LYS A 116 106.949 -20.567 -11.735 1.00 0.00 H new ATOM 0 HE2 LYS A 116 108.945 -22.257 -10.921 1.00 0.00 H new ATOM 0 HE3 LYS A 116 107.583 -23.022 -10.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 107.881 -23.880 -12.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 106.398 -23.062 -12.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 107.717 -22.321 -13.023 1.00 0.00 H new ATOM 1816 N LYS A 117 106.659 -16.076 -9.022 1.00 0.00 N ATOM 1817 CA LYS A 117 105.807 -14.985 -8.564 1.00 0.00 C ATOM 1818 C LYS A 117 104.964 -15.429 -7.374 1.00 0.00 C ATOM 1819 O LYS A 117 104.915 -14.751 -6.348 1.00 0.00 O ATOM 1820 CB LYS A 117 104.888 -14.527 -9.698 1.00 0.00 C ATOM 1821 CG LYS A 117 103.989 -13.394 -9.202 1.00 0.00 C ATOM 1822 CD LYS A 117 102.671 -13.974 -8.686 1.00 0.00 C ATOM 1823 CE LYS A 117 101.599 -13.851 -9.771 1.00 0.00 C ATOM 1824 NZ LYS A 117 101.188 -12.425 -9.904 1.00 0.00 N ATOM 0 H LYS A 117 106.657 -16.224 -10.031 1.00 0.00 H new ATOM 0 HA LYS A 117 106.445 -14.156 -8.256 1.00 0.00 H new ATOM 0 HB2 LYS A 117 105.482 -14.189 -10.547 1.00 0.00 H new ATOM 0 HB3 LYS A 117 104.280 -15.362 -10.047 1.00 0.00 H new ATOM 0 HG2 LYS A 117 104.490 -12.840 -8.408 1.00 0.00 H new ATOM 0 HG3 LYS A 117 103.796 -12.689 -10.010 1.00 0.00 H new ATOM 0 HD2 LYS A 117 102.805 -15.020 -8.410 1.00 0.00 H new ATOM 0 HD3 LYS A 117 102.356 -13.445 -7.787 1.00 0.00 H new ATOM 0 HE2 LYS A 117 101.985 -14.220 -10.722 1.00 0.00 H new ATOM 0 HE3 LYS A 117 100.736 -14.467 -9.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 100.151 -12.357 -9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 101.608 -11.869 -9.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 101.517 -12.053 -10.818 1.00 0.00 H new ATOM 1838 N ASP A 118 104.305 -16.575 -7.518 1.00 0.00 N ATOM 1839 CA ASP A 118 103.469 -17.103 -6.446 1.00 0.00 C ATOM 1840 C ASP A 118 104.336 -17.611 -5.300 1.00 0.00 C ATOM 1841 O ASP A 118 103.829 -17.972 -4.237 1.00 0.00 O ATOM 1842 CB ASP A 118 102.598 -18.243 -6.976 1.00 0.00 C ATOM 1843 CG ASP A 118 101.508 -18.580 -5.964 1.00 0.00 C ATOM 1844 OD1 ASP A 118 101.407 -17.872 -4.976 1.00 0.00 O ATOM 1845 OD2 ASP A 118 100.790 -19.539 -6.194 1.00 0.00 O ATOM 0 H ASP A 118 104.333 -17.151 -8.359 1.00 0.00 H new ATOM 0 HA ASP A 118 102.829 -16.302 -6.077 1.00 0.00 H new ATOM 0 HB2 ASP A 118 102.147 -17.956 -7.926 1.00 0.00 H new ATOM 0 HB3 ASP A 118 103.213 -19.123 -7.167 1.00 0.00 H new ATOM 1850 N GLY A 119 105.645 -17.635 -5.524 1.00 0.00 N ATOM 1851 CA GLY A 119 106.577 -18.100 -4.503 1.00 0.00 C ATOM 1852 C GLY A 119 106.921 -19.571 -4.708 1.00 0.00 C ATOM 1853 O GLY A 119 107.280 -20.270 -3.761 1.00 0.00 O ATOM 0 H GLY A 119 106.083 -17.340 -6.397 1.00 0.00 H new ATOM 0 HA2 GLY A 119 107.487 -17.502 -4.537 1.00 0.00 H new ATOM 0 HA3 GLY A 119 106.139 -17.959 -3.515 1.00 0.00 H new ATOM 1857 N THR A 120 106.809 -20.035 -5.949 1.00 0.00 N ATOM 1858 CA THR A 120 107.112 -21.427 -6.258 1.00 0.00 C ATOM 1859 C THR A 120 108.619 -21.640 -6.354 1.00 0.00 C ATOM 1860 O THR A 120 109.268 -21.147 -7.277 1.00 0.00 O ATOM 1861 CB THR A 120 106.453 -21.834 -7.578 1.00 0.00 C ATOM 1862 OG1 THR A 120 105.355 -20.970 -7.843 1.00 0.00 O ATOM 1863 CG2 THR A 120 105.956 -23.277 -7.478 1.00 0.00 C ATOM 0 H THR A 120 106.514 -19.474 -6.748 1.00 0.00 H new ATOM 0 HA THR A 120 106.717 -22.047 -5.453 1.00 0.00 H new ATOM 0 HB THR A 120 107.180 -21.758 -8.387 1.00 0.00 H new ATOM 0 HG1 THR A 120 104.838 -21.321 -8.598 1.00 0.00 H new ATOM 0 HG21 THR A 120 105.487 -23.566 -8.418 1.00 0.00 H new ATOM 0 HG22 THR A 120 106.798 -23.939 -7.274 1.00 0.00 H new ATOM 0 HG23 THR A 120 105.229 -23.356 -6.670 1.00 0.00 H new ATOM 1871 N LEU A 121 109.170 -22.379 -5.396 1.00 0.00 N ATOM 1872 CA LEU A 121 110.604 -22.651 -5.384 1.00 0.00 C ATOM 1873 C LEU A 121 111.042 -23.250 -6.712 1.00 0.00 C ATOM 1874 O LEU A 121 110.307 -24.013 -7.340 1.00 0.00 O ATOM 1875 CB LEU A 121 110.943 -23.615 -4.244 1.00 0.00 C ATOM 1876 CG LEU A 121 112.290 -23.235 -3.625 1.00 0.00 C ATOM 1877 CD1 LEU A 121 113.390 -23.349 -4.682 1.00 0.00 C ATOM 1878 CD2 LEU A 121 112.229 -21.795 -3.107 1.00 0.00 C ATOM 0 H LEU A 121 108.651 -22.797 -4.624 1.00 0.00 H new ATOM 0 HA LEU A 121 111.135 -21.711 -5.231 1.00 0.00 H new ATOM 0 HB2 LEU A 121 110.162 -23.583 -3.485 1.00 0.00 H new ATOM 0 HB3 LEU A 121 110.981 -24.638 -4.620 1.00 0.00 H new ATOM 0 HG LEU A 121 112.510 -23.910 -2.798 1.00 0.00 H new ATOM 0 HD11 LEU A 121 114.349 -23.078 -4.240 1.00 0.00 H new ATOM 0 HD12 LEU A 121 113.437 -24.374 -5.050 1.00 0.00 H new ATOM 0 HD13 LEU A 121 113.169 -22.676 -5.511 1.00 0.00 H new ATOM 0 HD21 LEU A 121 113.189 -21.526 -2.666 1.00 0.00 H new ATOM 0 HD22 LEU A 121 112.007 -21.120 -3.934 1.00 0.00 H new ATOM 0 HD23 LEU A 121 111.447 -21.713 -2.352 1.00 0.00 H new ATOM 1890 N ILE A 122 112.244 -22.886 -7.136 1.00 0.00 N ATOM 1891 CA ILE A 122 112.783 -23.372 -8.396 1.00 0.00 C ATOM 1892 C ILE A 122 114.252 -23.742 -8.237 1.00 0.00 C ATOM 1893 O ILE A 122 114.634 -24.906 -8.363 1.00 0.00 O ATOM 1894 CB ILE A 122 112.649 -22.273 -9.443 1.00 0.00 C ATOM 1895 CG1 ILE A 122 113.405 -22.668 -10.709 1.00 0.00 C ATOM 1896 CG2 ILE A 122 113.229 -20.975 -8.885 1.00 0.00 C ATOM 1897 CD1 ILE A 122 112.516 -22.406 -11.925 1.00 0.00 C ATOM 0 H ILE A 122 112.863 -22.256 -6.626 1.00 0.00 H new ATOM 0 HA ILE A 122 112.231 -24.259 -8.706 1.00 0.00 H new ATOM 0 HB ILE A 122 111.596 -22.131 -9.687 1.00 0.00 H new ATOM 0 HG12 ILE A 122 114.329 -22.096 -10.789 1.00 0.00 H new ATOM 0 HG13 ILE A 122 113.684 -23.721 -10.667 1.00 0.00 H new ATOM 0 HG21 ILE A 122 113.136 -20.185 -9.630 1.00 0.00 H new ATOM 0 HG22 ILE A 122 112.684 -20.691 -7.985 1.00 0.00 H new ATOM 0 HG23 ILE A 122 114.281 -21.122 -8.642 1.00 0.00 H new ATOM 0 HD11 ILE A 122 113.050 -22.686 -12.833 1.00 0.00 H new ATOM 0 HD12 ILE A 122 111.604 -22.997 -11.843 1.00 0.00 H new ATOM 0 HD13 ILE A 122 112.259 -21.347 -11.967 1.00 0.00 H new ATOM 1909 N SER A 123 115.063 -22.735 -7.956 1.00 0.00 N ATOM 1910 CA SER A 123 116.496 -22.937 -7.770 1.00 0.00 C ATOM 1911 C SER A 123 117.022 -22.025 -6.666 1.00 0.00 C ATOM 1912 O SER A 123 116.946 -20.802 -6.771 1.00 0.00 O ATOM 1913 CB SER A 123 117.239 -22.646 -9.074 1.00 0.00 C ATOM 1914 OG SER A 123 116.750 -23.505 -10.095 1.00 0.00 O ATOM 0 H SER A 123 114.756 -21.768 -7.851 1.00 0.00 H new ATOM 0 HA SER A 123 116.665 -23.975 -7.482 1.00 0.00 H new ATOM 0 HB2 SER A 123 117.098 -21.604 -9.361 1.00 0.00 H new ATOM 0 HB3 SER A 123 118.310 -22.797 -8.937 1.00 0.00 H new ATOM 0 HG SER A 123 116.506 -22.973 -10.881 1.00 0.00 H new ATOM 1920 N MET A 124 117.552 -22.628 -5.605 1.00 0.00 N ATOM 1921 CA MET A 124 118.082 -21.856 -4.486 1.00 0.00 C ATOM 1922 C MET A 124 119.473 -21.319 -4.810 1.00 0.00 C ATOM 1923 O MET A 124 119.659 -20.113 -4.961 1.00 0.00 O ATOM 1924 CB MET A 124 118.142 -22.727 -3.230 1.00 0.00 C ATOM 1925 CG MET A 124 117.281 -22.101 -2.130 1.00 0.00 C ATOM 1926 SD MET A 124 115.530 -22.223 -2.584 1.00 0.00 S ATOM 1927 CE MET A 124 115.319 -20.548 -3.244 1.00 0.00 C ATOM 0 H MET A 124 117.625 -23.640 -5.497 1.00 0.00 H new ATOM 0 HA MET A 124 117.417 -21.011 -4.307 1.00 0.00 H new ATOM 0 HB2 MET A 124 117.787 -23.733 -3.455 1.00 0.00 H new ATOM 0 HB3 MET A 124 119.173 -22.821 -2.889 1.00 0.00 H new ATOM 0 HG2 MET A 124 117.458 -22.610 -1.182 1.00 0.00 H new ATOM 0 HG3 MET A 124 117.558 -21.056 -1.988 1.00 0.00 H new ATOM 0 HE1 MET A 124 114.828 -19.922 -2.499 1.00 0.00 H new ATOM 0 HE2 MET A 124 116.295 -20.127 -3.486 1.00 0.00 H new ATOM 0 HE3 MET A 124 114.707 -20.586 -4.145 1.00 0.00 H new ATOM 1937 N ASN A 125 120.445 -22.218 -4.917 1.00 0.00 N ATOM 1938 CA ASN A 125 121.810 -21.813 -5.228 1.00 0.00 C ATOM 1939 C ASN A 125 121.878 -21.250 -6.642 1.00 0.00 C ATOM 1940 O ASN A 125 122.805 -21.543 -7.396 1.00 0.00 O ATOM 1941 CB ASN A 125 122.753 -23.012 -5.105 1.00 0.00 C ATOM 1942 CG ASN A 125 123.982 -22.626 -4.291 1.00 0.00 C ATOM 1943 OD1 ASN A 125 124.159 -23.100 -3.169 1.00 0.00 O ATOM 1944 ND2 ASN A 125 124.849 -21.789 -4.792 1.00 0.00 N ATOM 0 H ASN A 125 120.315 -23.222 -4.794 1.00 0.00 H new ATOM 0 HA ASN A 125 122.117 -21.042 -4.521 1.00 0.00 H new ATOM 0 HB2 ASN A 125 122.236 -23.844 -4.627 1.00 0.00 H new ATOM 0 HB3 ASN A 125 123.055 -23.351 -6.096 1.00 0.00 H new ATOM 0 HD21 ASN A 125 125.675 -21.527 -4.254 1.00 0.00 H new ATOM 0 HD22 ASN A 125 124.701 -21.397 -5.722 1.00 0.00 H new ATOM 1951 N GLY A 126 120.882 -20.444 -6.994 1.00 0.00 N ATOM 1952 CA GLY A 126 120.827 -19.847 -8.319 1.00 0.00 C ATOM 1953 C GLY A 126 122.175 -19.256 -8.709 1.00 0.00 C ATOM 1954 O GLY A 126 122.415 -18.963 -9.880 1.00 0.00 O ATOM 0 H GLY A 126 120.106 -20.191 -6.382 1.00 0.00 H new ATOM 0 HA2 GLY A 126 120.532 -20.601 -9.049 1.00 0.00 H new ATOM 0 HA3 GLY A 126 120.065 -19.068 -8.339 1.00 0.00 H new ATOM 1958 N ARG A 127 123.050 -19.068 -7.725 1.00 0.00 N ATOM 1959 CA ARG A 127 124.361 -18.492 -8.001 1.00 0.00 C ATOM 1960 C ARG A 127 125.069 -19.257 -9.109 1.00 0.00 C ATOM 1961 O ARG A 127 124.929 -18.918 -10.284 1.00 0.00 O ATOM 1962 CB ARG A 127 125.219 -18.500 -6.734 1.00 0.00 C ATOM 1963 CG ARG A 127 126.538 -17.775 -7.007 1.00 0.00 C ATOM 1964 CD ARG A 127 127.652 -18.413 -6.176 1.00 0.00 C ATOM 1965 NE ARG A 127 128.879 -17.633 -6.292 1.00 0.00 N ATOM 1966 CZ ARG A 127 129.804 -17.937 -7.196 1.00 0.00 C ATOM 1967 NH1 ARG A 127 129.623 -18.949 -7.999 1.00 0.00 N ATOM 1968 NH2 ARG A 127 130.894 -17.223 -7.280 1.00 0.00 N ATOM 0 H ARG A 127 122.880 -19.301 -6.747 1.00 0.00 H new ATOM 0 HA ARG A 127 124.216 -17.463 -8.330 1.00 0.00 H new ATOM 0 HB2 ARG A 127 124.686 -18.012 -5.918 1.00 0.00 H new ATOM 0 HB3 ARG A 127 125.414 -19.526 -6.420 1.00 0.00 H new ATOM 0 HG2 ARG A 127 126.783 -17.831 -8.068 1.00 0.00 H new ATOM 0 HG3 ARG A 127 126.443 -16.718 -6.757 1.00 0.00 H new ATOM 0 HD2 ARG A 127 127.348 -18.472 -5.131 1.00 0.00 H new ATOM 0 HD3 ARG A 127 127.828 -19.434 -6.514 1.00 0.00 H new ATOM 0 HE ARG A 127 129.030 -16.840 -5.668 1.00 0.00 H new ATOM 0 HH11 ARG A 127 128.772 -19.507 -7.933 1.00 0.00 H new ATOM 0 HH12 ARG A 127 130.333 -19.183 -8.693 1.00 0.00 H new ATOM 0 HH21 ARG A 127 131.035 -16.432 -6.652 1.00 0.00 H new ATOM 0 HH22 ARG A 127 131.604 -17.456 -7.974 1.00 0.00 H new ATOM 1982 N GLY A 128 125.839 -20.278 -8.749 1.00 0.00 N ATOM 1983 CA GLY A 128 126.560 -21.051 -9.750 1.00 0.00 C ATOM 1984 C GLY A 128 125.677 -21.322 -10.956 1.00 0.00 C ATOM 1985 O GLY A 128 126.161 -21.418 -12.083 1.00 0.00 O ATOM 0 H GLY A 128 125.978 -20.585 -7.786 1.00 0.00 H new ATOM 0 HA2 GLY A 128 127.453 -20.509 -10.061 1.00 0.00 H new ATOM 0 HA3 GLY A 128 126.894 -21.994 -9.318 1.00 0.00 H new ATOM 1989 N GLU A 129 124.378 -21.444 -10.717 1.00 0.00 N ATOM 1990 CA GLU A 129 123.444 -21.698 -11.801 1.00 0.00 C ATOM 1991 C GLU A 129 123.535 -20.588 -12.836 1.00 0.00 C ATOM 1992 O GLU A 129 123.699 -20.850 -14.028 1.00 0.00 O ATOM 1993 CB GLU A 129 122.016 -21.790 -11.262 1.00 0.00 C ATOM 1994 CG GLU A 129 121.928 -22.924 -10.241 1.00 0.00 C ATOM 1995 CD GLU A 129 121.318 -24.163 -10.889 1.00 0.00 C ATOM 1996 OE1 GLU A 129 121.399 -24.274 -12.101 1.00 0.00 O ATOM 1997 OE2 GLU A 129 120.778 -24.982 -10.163 1.00 0.00 O ATOM 0 H GLU A 129 123.953 -21.372 -9.793 1.00 0.00 H new ATOM 0 HA GLU A 129 123.704 -22.647 -12.270 1.00 0.00 H new ATOM 0 HB2 GLU A 129 121.730 -20.846 -10.798 1.00 0.00 H new ATOM 0 HB3 GLU A 129 121.318 -21.968 -12.080 1.00 0.00 H new ATOM 0 HG2 GLU A 129 122.921 -23.156 -9.857 1.00 0.00 H new ATOM 0 HG3 GLU A 129 121.322 -22.612 -9.390 1.00 0.00 H new ATOM 2004 N VAL A 130 123.435 -19.346 -12.378 1.00 0.00 N ATOM 2005 CA VAL A 130 123.518 -18.212 -13.287 1.00 0.00 C ATOM 2006 C VAL A 130 124.922 -18.097 -13.861 1.00 0.00 C ATOM 2007 O VAL A 130 125.102 -17.946 -15.069 1.00 0.00 O ATOM 2008 CB VAL A 130 123.154 -16.921 -12.556 1.00 0.00 C ATOM 2009 CG1 VAL A 130 123.443 -15.722 -13.460 1.00 0.00 C ATOM 2010 CG2 VAL A 130 121.668 -16.943 -12.202 1.00 0.00 C ATOM 0 H VAL A 130 123.298 -19.101 -11.397 1.00 0.00 H new ATOM 0 HA VAL A 130 122.813 -18.371 -14.103 1.00 0.00 H new ATOM 0 HB VAL A 130 123.747 -16.839 -11.645 1.00 0.00 H new ATOM 0 HG11 VAL A 130 123.183 -14.801 -12.938 1.00 0.00 H new ATOM 0 HG12 VAL A 130 124.502 -15.707 -13.717 1.00 0.00 H new ATOM 0 HG13 VAL A 130 122.850 -15.802 -14.371 1.00 0.00 H new ATOM 0 HG21 VAL A 130 121.405 -16.023 -11.680 1.00 0.00 H new ATOM 0 HG22 VAL A 130 121.078 -17.024 -13.115 1.00 0.00 H new ATOM 0 HG23 VAL A 130 121.460 -17.798 -11.558 1.00 0.00 H new ATOM 2020 N GLN A 131 125.915 -18.175 -12.986 1.00 0.00 N ATOM 2021 CA GLN A 131 127.304 -18.084 -13.414 1.00 0.00 C ATOM 2022 C GLN A 131 127.684 -19.302 -14.249 1.00 0.00 C ATOM 2023 O GLN A 131 128.655 -19.268 -15.006 1.00 0.00 O ATOM 2024 CB GLN A 131 128.223 -17.991 -12.193 1.00 0.00 C ATOM 2025 CG GLN A 131 127.760 -16.846 -11.291 1.00 0.00 C ATOM 2026 CD GLN A 131 128.830 -16.537 -10.251 1.00 0.00 C ATOM 2027 OE1 GLN A 131 128.547 -16.520 -9.054 1.00 0.00 O ATOM 2028 NE2 GLN A 131 130.052 -16.289 -10.639 1.00 0.00 N ATOM 0 H GLN A 131 125.786 -18.300 -11.982 1.00 0.00 H new ATOM 0 HA GLN A 131 127.421 -17.188 -14.023 1.00 0.00 H new ATOM 0 HB2 GLN A 131 128.209 -18.931 -11.641 1.00 0.00 H new ATOM 0 HB3 GLN A 131 129.252 -17.824 -12.511 1.00 0.00 H new ATOM 0 HG2 GLN A 131 127.557 -15.959 -11.891 1.00 0.00 H new ATOM 0 HG3 GLN A 131 126.827 -17.116 -10.796 1.00 0.00 H new ATOM 0 HE21 GLN A 131 130.285 -16.304 -11.632 1.00 0.00 H new ATOM 0 HE22 GLN A 131 130.774 -16.081 -9.949 1.00 0.00 H new ATOM 2037 N SER A 132 126.915 -20.377 -14.106 1.00 0.00 N ATOM 2038 CA SER A 132 127.186 -21.597 -14.854 1.00 0.00 C ATOM 2039 C SER A 132 126.592 -21.509 -16.255 1.00 0.00 C ATOM 2040 O SER A 132 127.263 -21.804 -17.243 1.00 0.00 O ATOM 2041 CB SER A 132 126.594 -22.802 -14.123 1.00 0.00 C ATOM 2042 OG SER A 132 127.357 -23.063 -12.952 1.00 0.00 O ATOM 0 H SER A 132 126.107 -20.428 -13.485 1.00 0.00 H new ATOM 0 HA SER A 132 128.266 -21.717 -14.935 1.00 0.00 H new ATOM 0 HB2 SER A 132 125.555 -22.606 -13.858 1.00 0.00 H new ATOM 0 HB3 SER A 132 126.598 -23.675 -14.775 1.00 0.00 H new ATOM 0 HG SER A 132 127.354 -22.270 -12.376 1.00 0.00 H new ATOM 2048 N LEU A 133 125.328 -21.107 -16.332 1.00 0.00 N ATOM 2049 CA LEU A 133 124.653 -20.991 -17.614 1.00 0.00 C ATOM 2050 C LEU A 133 124.557 -19.534 -18.054 1.00 0.00 C ATOM 2051 O LEU A 133 124.004 -19.234 -19.111 1.00 0.00 O ATOM 2052 CB LEU A 133 123.250 -21.583 -17.509 1.00 0.00 C ATOM 2053 CG LEU A 133 123.277 -23.045 -17.945 1.00 0.00 C ATOM 2054 CD1 LEU A 133 121.876 -23.641 -17.804 1.00 0.00 C ATOM 2055 CD2 LEU A 133 123.725 -23.130 -19.406 1.00 0.00 C ATOM 0 H LEU A 133 124.755 -20.858 -15.526 1.00 0.00 H new ATOM 0 HA LEU A 133 125.234 -21.538 -18.357 1.00 0.00 H new ATOM 0 HB2 LEU A 133 122.887 -21.505 -16.484 1.00 0.00 H new ATOM 0 HB3 LEU A 133 122.559 -21.019 -18.135 1.00 0.00 H new ATOM 0 HG LEU A 133 123.974 -23.602 -17.319 1.00 0.00 H new ATOM 0 HD11 LEU A 133 121.892 -24.686 -18.115 1.00 0.00 H new ATOM 0 HD12 LEU A 133 121.556 -23.577 -16.764 1.00 0.00 H new ATOM 0 HD13 LEU A 133 121.180 -23.086 -18.433 1.00 0.00 H new ATOM 0 HD21 LEU A 133 123.745 -24.174 -19.720 1.00 0.00 H new ATOM 0 HD22 LEU A 133 123.027 -22.576 -20.033 1.00 0.00 H new ATOM 0 HD23 LEU A 133 124.722 -22.702 -19.506 1.00 0.00 H new ATOM 2067 N GLY A 134 125.089 -18.630 -17.238 1.00 0.00 N ATOM 2068 CA GLY A 134 125.043 -17.211 -17.567 1.00 0.00 C ATOM 2069 C GLY A 134 123.603 -16.765 -17.798 1.00 0.00 C ATOM 2070 O GLY A 134 122.675 -17.279 -17.172 1.00 0.00 O ATOM 0 H GLY A 134 125.551 -18.851 -16.356 1.00 0.00 H new ATOM 0 HA2 GLY A 134 125.485 -16.629 -16.758 1.00 0.00 H new ATOM 0 HA3 GLY A 134 125.638 -17.019 -18.460 1.00 0.00 H new ATOM 2074 N PRO A 135 123.403 -15.826 -18.682 1.00 0.00 N ATOM 2075 CA PRO A 135 122.045 -15.300 -19.007 1.00 0.00 C ATOM 2076 C PRO A 135 121.120 -16.391 -19.544 1.00 0.00 C ATOM 2077 O PRO A 135 119.906 -16.204 -19.623 1.00 0.00 O ATOM 2078 CB PRO A 135 122.298 -14.228 -20.074 1.00 0.00 C ATOM 2079 CG PRO A 135 123.757 -13.915 -20.006 1.00 0.00 C ATOM 2080 CD PRO A 135 124.450 -15.162 -19.466 1.00 0.00 C ATOM 0 HA PRO A 135 121.544 -14.908 -18.122 1.00 0.00 H new ATOM 0 HB2 PRO A 135 122.023 -14.591 -21.064 1.00 0.00 H new ATOM 0 HB3 PRO A 135 121.699 -13.338 -19.882 1.00 0.00 H new ATOM 0 HG2 PRO A 135 124.143 -13.654 -20.992 1.00 0.00 H new ATOM 0 HG3 PRO A 135 123.939 -13.059 -19.356 1.00 0.00 H new ATOM 0 HD2 PRO A 135 124.813 -15.800 -20.272 1.00 0.00 H new ATOM 0 HD3 PRO A 135 125.312 -14.907 -18.849 1.00 0.00 H new ATOM 2088 N ARG A 136 121.702 -17.530 -19.908 1.00 0.00 N ATOM 2089 CA ARG A 136 120.923 -18.642 -20.427 1.00 0.00 C ATOM 2090 C ARG A 136 120.380 -19.474 -19.271 1.00 0.00 C ATOM 2091 O ARG A 136 119.576 -20.385 -19.466 1.00 0.00 O ATOM 2092 CB ARG A 136 121.802 -19.501 -21.341 1.00 0.00 C ATOM 2093 CG ARG A 136 121.485 -20.979 -21.123 1.00 0.00 C ATOM 2094 CD ARG A 136 122.247 -21.822 -22.145 1.00 0.00 C ATOM 2095 NE ARG A 136 121.822 -23.215 -22.070 1.00 0.00 N ATOM 2096 CZ ARG A 136 120.789 -23.657 -22.779 1.00 0.00 C ATOM 2097 NH1 ARG A 136 120.138 -22.841 -23.562 1.00 0.00 N ATOM 2098 NH2 ARG A 136 120.426 -24.908 -22.695 1.00 0.00 N ATOM 0 H ARG A 136 122.706 -17.704 -19.852 1.00 0.00 H new ATOM 0 HA ARG A 136 120.082 -18.261 -21.006 1.00 0.00 H new ATOM 0 HB2 ARG A 136 121.630 -19.233 -22.383 1.00 0.00 H new ATOM 0 HB3 ARG A 136 122.855 -19.311 -21.132 1.00 0.00 H new ATOM 0 HG2 ARG A 136 121.763 -21.276 -20.112 1.00 0.00 H new ATOM 0 HG3 ARG A 136 120.413 -21.150 -21.222 1.00 0.00 H new ATOM 0 HD2 ARG A 136 122.072 -21.435 -23.149 1.00 0.00 H new ATOM 0 HD3 ARG A 136 123.319 -21.751 -21.958 1.00 0.00 H new ATOM 0 HE ARG A 136 122.326 -23.861 -21.463 1.00 0.00 H new ATOM 0 HH11 ARG A 136 120.422 -21.864 -23.630 1.00 0.00 H new ATOM 0 HH12 ARG A 136 119.345 -23.180 -24.106 1.00 0.00 H new ATOM 0 HH21 ARG A 136 120.936 -25.547 -22.085 1.00 0.00 H new ATOM 0 HH22 ARG A 136 119.633 -25.247 -23.240 1.00 0.00 H new ATOM 2112 N ALA A 137 120.815 -19.135 -18.063 1.00 0.00 N ATOM 2113 CA ALA A 137 120.359 -19.839 -16.873 1.00 0.00 C ATOM 2114 C ALA A 137 118.861 -19.634 -16.693 1.00 0.00 C ATOM 2115 O ALA A 137 118.175 -20.464 -16.095 1.00 0.00 O ATOM 2116 CB ALA A 137 121.100 -19.324 -15.639 1.00 0.00 C ATOM 0 H ALA A 137 121.479 -18.382 -17.883 1.00 0.00 H new ATOM 0 HA ALA A 137 120.566 -20.902 -16.993 1.00 0.00 H new ATOM 0 HB1 ALA A 137 120.750 -19.858 -14.755 1.00 0.00 H new ATOM 0 HB2 ALA A 137 122.170 -19.488 -15.762 1.00 0.00 H new ATOM 0 HB3 ALA A 137 120.908 -18.258 -15.518 1.00 0.00 H new ATOM 2122 N PHE A 138 118.359 -18.524 -17.227 1.00 0.00 N ATOM 2123 CA PHE A 138 116.938 -18.220 -17.130 1.00 0.00 C ATOM 2124 C PHE A 138 116.126 -19.500 -17.279 1.00 0.00 C ATOM 2125 O PHE A 138 114.968 -19.567 -16.866 1.00 0.00 O ATOM 2126 CB PHE A 138 116.537 -17.225 -18.221 1.00 0.00 C ATOM 2127 CG PHE A 138 115.055 -17.340 -18.488 1.00 0.00 C ATOM 2128 CD1 PHE A 138 114.135 -16.912 -17.523 1.00 0.00 C ATOM 2129 CD2 PHE A 138 114.601 -17.872 -19.700 1.00 0.00 C ATOM 2130 CE1 PHE A 138 112.761 -17.019 -17.771 1.00 0.00 C ATOM 2131 CE2 PHE A 138 113.228 -17.978 -19.947 1.00 0.00 C ATOM 2132 CZ PHE A 138 112.308 -17.552 -18.983 1.00 0.00 C ATOM 0 H PHE A 138 118.911 -17.827 -17.727 1.00 0.00 H new ATOM 0 HA PHE A 138 116.737 -17.777 -16.155 1.00 0.00 H new ATOM 0 HB2 PHE A 138 116.784 -16.210 -17.910 1.00 0.00 H new ATOM 0 HB3 PHE A 138 117.098 -17.424 -19.134 1.00 0.00 H new ATOM 0 HD1 PHE A 138 114.485 -16.500 -16.588 1.00 0.00 H new ATOM 0 HD2 PHE A 138 115.311 -18.201 -20.445 1.00 0.00 H new ATOM 0 HE1 PHE A 138 112.051 -16.690 -17.027 1.00 0.00 H new ATOM 0 HE2 PHE A 138 112.878 -18.389 -20.882 1.00 0.00 H new ATOM 0 HZ PHE A 138 111.248 -17.634 -19.174 1.00 0.00 H new ATOM 2142 N GLN A 139 116.752 -20.517 -17.862 1.00 0.00 N ATOM 2143 CA GLN A 139 116.090 -21.799 -18.055 1.00 0.00 C ATOM 2144 C GLN A 139 115.985 -22.533 -16.727 1.00 0.00 C ATOM 2145 O GLN A 139 114.899 -22.931 -16.309 1.00 0.00 O ATOM 2146 CB GLN A 139 116.877 -22.647 -19.056 1.00 0.00 C ATOM 2147 CG GLN A 139 116.631 -22.123 -20.473 1.00 0.00 C ATOM 2148 CD GLN A 139 116.939 -23.214 -21.493 1.00 0.00 C ATOM 2149 OE1 GLN A 139 116.542 -23.110 -22.653 1.00 0.00 O ATOM 2150 NE2 GLN A 139 117.628 -24.261 -21.127 1.00 0.00 N ATOM 0 H GLN A 139 117.711 -20.478 -18.207 1.00 0.00 H new ATOM 0 HA GLN A 139 115.088 -21.625 -18.446 1.00 0.00 H new ATOM 0 HB2 GLN A 139 117.941 -22.610 -18.823 1.00 0.00 H new ATOM 0 HB3 GLN A 139 116.571 -23.691 -18.984 1.00 0.00 H new ATOM 0 HG2 GLN A 139 115.595 -21.800 -20.575 1.00 0.00 H new ATOM 0 HG3 GLN A 139 117.257 -21.251 -20.661 1.00 0.00 H new ATOM 0 HE21 GLN A 139 117.956 -24.345 -20.165 1.00 0.00 H new ATOM 0 HE22 GLN A 139 117.838 -24.995 -21.803 1.00 0.00 H new ATOM 2159 N ASN A 140 117.121 -22.695 -16.061 1.00 0.00 N ATOM 2160 CA ASN A 140 117.145 -23.368 -14.769 1.00 0.00 C ATOM 2161 C ASN A 140 116.412 -22.520 -13.737 1.00 0.00 C ATOM 2162 O ASN A 140 115.686 -23.040 -12.890 1.00 0.00 O ATOM 2163 CB ASN A 140 118.590 -23.593 -14.319 1.00 0.00 C ATOM 2164 CG ASN A 140 119.388 -24.253 -15.440 1.00 0.00 C ATOM 2165 OD1 ASN A 140 120.568 -24.556 -15.267 1.00 0.00 O ATOM 2166 ND2 ASN A 140 118.809 -24.494 -16.584 1.00 0.00 N ATOM 0 H ASN A 140 118.031 -22.373 -16.391 1.00 0.00 H new ATOM 0 HA ASN A 140 116.650 -24.334 -14.863 1.00 0.00 H new ATOM 0 HB2 ASN A 140 119.047 -22.642 -14.047 1.00 0.00 H new ATOM 0 HB3 ASN A 140 118.609 -24.222 -13.429 1.00 0.00 H new ATOM 0 HD21 ASN A 140 119.335 -24.935 -17.339 1.00 0.00 H new ATOM 0 HD22 ASN A 140 117.831 -24.241 -16.724 1.00 0.00 H new ATOM 2173 N TRP A 141 116.600 -21.209 -13.831 1.00 0.00 N ATOM 2174 CA TRP A 141 115.943 -20.282 -12.918 1.00 0.00 C ATOM 2175 C TRP A 141 114.433 -20.331 -13.131 1.00 0.00 C ATOM 2176 O TRP A 141 113.655 -20.099 -12.207 1.00 0.00 O ATOM 2177 CB TRP A 141 116.441 -18.857 -13.174 1.00 0.00 C ATOM 2178 CG TRP A 141 117.583 -18.536 -12.262 1.00 0.00 C ATOM 2179 CD1 TRP A 141 118.464 -19.434 -11.760 1.00 0.00 C ATOM 2180 CD2 TRP A 141 117.986 -17.236 -11.741 1.00 0.00 C ATOM 2181 NE1 TRP A 141 119.372 -18.767 -10.959 1.00 0.00 N ATOM 2182 CE2 TRP A 141 119.121 -17.412 -10.916 1.00 0.00 C ATOM 2183 CE3 TRP A 141 117.478 -15.934 -11.903 1.00 0.00 C ATOM 2184 CZ2 TRP A 141 119.731 -16.335 -10.274 1.00 0.00 C ATOM 2185 CZ3 TRP A 141 118.092 -14.849 -11.258 1.00 0.00 C ATOM 2186 CH2 TRP A 141 119.216 -15.050 -10.445 1.00 0.00 C ATOM 0 H TRP A 141 117.199 -20.765 -14.527 1.00 0.00 H new ATOM 0 HA TRP A 141 116.178 -20.570 -11.893 1.00 0.00 H new ATOM 0 HB2 TRP A 141 116.756 -18.755 -14.213 1.00 0.00 H new ATOM 0 HB3 TRP A 141 115.629 -18.147 -13.016 1.00 0.00 H new ATOM 0 HD1 TRP A 141 118.458 -20.496 -11.954 1.00 0.00 H new ATOM 0 HE1 TRP A 141 120.136 -19.223 -10.460 1.00 0.00 H new ATOM 0 HE3 TRP A 141 116.612 -15.769 -12.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 120.597 -16.495 -9.648 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 117.696 -13.853 -11.389 1.00 0.00 H new ATOM 0 HH2 TRP A 141 119.683 -14.211 -9.951 1.00 0.00 H new ATOM 2197 N ALA A 142 114.031 -20.634 -14.363 1.00 0.00 N ATOM 2198 CA ALA A 142 112.617 -20.712 -14.703 1.00 0.00 C ATOM 2199 C ALA A 142 112.231 -22.135 -15.070 1.00 0.00 C ATOM 2200 O ALA A 142 111.112 -22.402 -15.509 1.00 0.00 O ATOM 2201 CB ALA A 142 112.299 -19.772 -15.867 1.00 0.00 C ATOM 0 H ALA A 142 114.664 -20.829 -15.139 1.00 0.00 H new ATOM 0 HA ALA A 142 112.039 -20.407 -13.830 1.00 0.00 H new ATOM 0 HB1 ALA A 142 111.239 -19.840 -16.111 1.00 0.00 H new ATOM 0 HB2 ALA A 142 112.541 -18.748 -15.584 1.00 0.00 H new ATOM 0 HB3 ALA A 142 112.890 -20.057 -16.737 1.00 0.00 H new ATOM 2207 N ARG A 143 113.173 -23.038 -14.883 1.00 0.00 N ATOM 2208 CA ARG A 143 112.952 -24.447 -15.190 1.00 0.00 C ATOM 2209 C ARG A 143 111.471 -24.795 -15.069 1.00 0.00 C ATOM 2210 O ARG A 143 110.840 -24.976 -16.098 1.00 0.00 O ATOM 2211 CB ARG A 143 113.763 -25.323 -14.233 1.00 0.00 C ATOM 2212 CG ARG A 143 114.610 -26.311 -15.037 1.00 0.00 C ATOM 2213 CD ARG A 143 115.647 -26.963 -14.120 1.00 0.00 C ATOM 2214 NE ARG A 143 115.551 -28.415 -14.200 1.00 0.00 N ATOM 2215 CZ ARG A 143 116.317 -29.110 -15.036 1.00 0.00 C ATOM 2216 NH1 ARG A 143 117.173 -28.492 -15.802 1.00 0.00 N ATOM 2217 NH2 ARG A 143 116.213 -30.410 -15.088 1.00 0.00 N ATOM 2218 OXT ARG A 143 110.991 -24.876 -13.950 1.00 0.00 O ATOM 0 H ARG A 143 114.102 -22.826 -14.520 1.00 0.00 H new ATOM 0 HA ARG A 143 113.275 -24.632 -16.214 1.00 0.00 H new ATOM 0 HB2 ARG A 143 114.405 -24.701 -13.610 1.00 0.00 H new ATOM 0 HB3 ARG A 143 113.094 -25.863 -13.563 1.00 0.00 H new ATOM 0 HG2 ARG A 143 113.972 -27.075 -15.482 1.00 0.00 H new ATOM 0 HG3 ARG A 143 115.109 -25.795 -15.857 1.00 0.00 H new ATOM 0 HD2 ARG A 143 116.649 -26.642 -14.406 1.00 0.00 H new ATOM 0 HD3 ARG A 143 115.489 -26.637 -13.092 1.00 0.00 H new ATOM 0 HE ARG A 143 114.885 -28.907 -13.604 1.00 0.00 H new ATOM 0 HH11 ARG A 143 117.255 -27.476 -15.760 1.00 0.00 H new ATOM 0 HH12 ARG A 143 117.761 -29.025 -16.443 1.00 0.00 H new ATOM 0 HH21 ARG A 143 115.544 -30.893 -14.488 1.00 0.00 H new ATOM 0 HH22 ARG A 143 116.800 -30.943 -15.729 1.00 0.00 H new TER 2232 ARG A 143