USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 961 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 144 MET CE :methyl -175:sc= -4.05! (180deg=-3.21!) USER MOD Set 1.2: A 145 MET CE :methyl -139:sc= -9.11! (180deg=-7.87!) USER MOD Set 2.1: A 109 MET CE :methyl -147:sc= -0.994 (180deg=0) USER MOD Set 2.2: A 124 MET CE :methyl -177:sc= -2.21 (180deg=-1.83) USER MOD Set 3.1: A 107 HIS : no HD1:sc= 0 X(o=-0.08,f=-0.15) USER MOD Set 3.2: A 111 ASN : amide:sc= -0.0803 K(o=-0.08,f=-1.6) USER MOD Set 4.1: A 71 MET CE :methyl 153:sc= -2.01 (180deg=-4.02!) USER MOD Set 4.2: A 72 MET CE :methyl -160:sc= -3.48! (180deg=-4.58!) USER MOD Single : A 8 GLN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -152:sc= -0.479 (180deg=-2.57!) USER MOD Single : A 26 THR OG1 : rot -36:sc= 0.591 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0106 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0317 USER MOD Single : A 30 LYS NZ :NH3+ -98:sc= -0.156 (180deg=-1.17) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= -0.55 K(o=-0.55,f=-3.1!) USER MOD Single : A 44 THR OG1 : rot 180:sc=-0.00677 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -1.08 X(o=-1.1,f=-0.9) USER MOD Single : A 60 ASN : amide:sc= -6.1! C(o=-6.1!,f=-14!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.0108 USER MOD Single : A 70 THR OG1 : rot 85:sc= 0.93 USER MOD Single : A 94 LYS NZ :NH3+ -131:sc= -0.0583 (180deg=-0.195) USER MOD Single : A 97 ASN : amide:sc= -5.77! C(o=-5.8!,f=-16!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.00409 USER MOD Single : A 110 THR OG1 : rot 117:sc= 1.06 USER MOD Single : A 115 LYS NZ :NH3+ -158:sc=-0.00202 (180deg=-0.754) USER MOD Single : A 117 THR OG1 : rot -109:sc= 0.145 USER MOD Single : A 135 GLN : amide:sc= -2.74 X(o=-2.7,f=-2.7) USER MOD Single : A 137 ASN : amide:sc= -0.743 K(o=-0.74,f=-2.9!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -1.67 K(o=-1.7,f=-5.9!) USER MOD Single : A 146 THR OG1 : rot -85:sc= 0.0517 USER MOD ----------------------------------------------------------------- ATOM 75 N GLU A 6 -9.177 26.391 11.002 1.00 0.00 N ATOM 76 CA GLU A 6 -8.614 27.707 10.587 1.00 0.00 C ATOM 77 C GLU A 6 -8.669 27.841 9.062 1.00 0.00 C ATOM 78 O GLU A 6 -8.534 28.919 8.517 1.00 0.00 O ATOM 79 CB GLU A 6 -7.167 27.692 11.077 1.00 0.00 C ATOM 80 CG GLU A 6 -6.403 26.558 10.379 1.00 0.00 C ATOM 81 CD GLU A 6 -5.342 27.141 9.434 1.00 0.00 C ATOM 82 OE1 GLU A 6 -5.228 28.354 9.369 1.00 0.00 O ATOM 83 OE2 GLU A 6 -4.662 26.360 8.790 1.00 0.00 O ATOM 0 HA GLU A 6 -9.171 28.548 11.001 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -6.690 28.649 10.867 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -7.139 27.553 12.158 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.927 25.918 11.122 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.097 25.933 9.818 1.00 0.00 H new ATOM 90 N GLU A 7 -8.868 26.750 8.369 1.00 0.00 N ATOM 91 CA GLU A 7 -8.936 26.810 6.883 1.00 0.00 C ATOM 92 C GLU A 7 -10.270 27.422 6.449 1.00 0.00 C ATOM 93 O GLU A 7 -10.318 28.499 5.887 1.00 0.00 O ATOM 94 CB GLU A 7 -8.830 25.352 6.425 1.00 0.00 C ATOM 95 CG GLU A 7 -8.601 25.299 4.911 1.00 0.00 C ATOM 96 CD GLU A 7 -7.397 26.169 4.542 1.00 0.00 C ATOM 97 OE1 GLU A 7 -6.330 25.929 5.083 1.00 0.00 O ATOM 98 OE2 GLU A 7 -7.562 27.058 3.723 1.00 0.00 O ATOM 0 H GLU A 7 -8.986 25.820 8.771 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.148 27.427 6.450 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -8.009 24.857 6.944 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -9.741 24.813 6.683 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -8.429 24.270 4.595 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -9.490 25.649 4.386 1.00 0.00 H new ATOM 105 N GLN A 8 -11.352 26.748 6.709 1.00 0.00 N ATOM 106 CA GLN A 8 -12.685 27.294 6.319 1.00 0.00 C ATOM 107 C GLN A 8 -12.869 28.697 6.907 1.00 0.00 C ATOM 108 O GLN A 8 -13.069 29.659 6.191 1.00 0.00 O ATOM 109 CB GLN A 8 -13.704 26.321 6.913 1.00 0.00 C ATOM 110 CG GLN A 8 -13.558 24.953 6.239 1.00 0.00 C ATOM 111 CD GLN A 8 -14.550 23.944 6.850 1.00 0.00 C ATOM 112 OE1 GLN A 8 -15.484 24.353 7.678 1.00 0.00 O flip ATOM 113 NE2 GLN A 8 -14.476 22.766 6.566 1.00 0.00 N flip ATOM 0 H GLN A 8 -11.374 25.841 7.175 1.00 0.00 H new ATOM 0 HA GLN A 8 -12.797 27.385 5.239 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.549 26.227 7.988 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -14.715 26.703 6.769 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -13.738 25.047 5.168 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.538 24.588 6.359 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -13.753 22.441 5.924 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -15.136 22.102 6.970 1.00 0.00 H new ATOM 122 N ILE A 9 -12.797 28.825 8.208 1.00 0.00 N ATOM 123 CA ILE A 9 -12.964 30.173 8.835 1.00 0.00 C ATOM 124 C ILE A 9 -12.097 31.203 8.105 1.00 0.00 C ATOM 125 O ILE A 9 -12.557 32.264 7.732 1.00 0.00 O ATOM 126 CB ILE A 9 -12.491 30.003 10.280 1.00 0.00 C ATOM 127 CG1 ILE A 9 -13.457 29.075 11.028 1.00 0.00 C ATOM 128 CG2 ILE A 9 -12.458 31.369 10.972 1.00 0.00 C ATOM 129 CD1 ILE A 9 -13.079 29.027 12.512 1.00 0.00 C ATOM 0 H ILE A 9 -12.631 28.059 8.861 1.00 0.00 H new ATOM 0 HA ILE A 9 -13.994 30.527 8.784 1.00 0.00 H new ATOM 0 HB ILE A 9 -11.491 29.569 10.286 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -14.481 29.432 10.915 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -13.419 28.073 10.600 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.121 31.247 12.001 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.772 32.029 10.441 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.457 31.804 10.966 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -13.766 28.367 13.041 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -12.062 28.650 12.616 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -13.140 30.030 12.936 1.00 0.00 H new ATOM 141 N ALA A 10 -10.846 30.895 7.894 1.00 0.00 N ATOM 142 CA ALA A 10 -9.950 31.856 7.186 1.00 0.00 C ATOM 143 C ALA A 10 -10.578 32.283 5.856 1.00 0.00 C ATOM 144 O ALA A 10 -10.536 33.438 5.481 1.00 0.00 O ATOM 145 CB ALA A 10 -8.658 31.082 6.942 1.00 0.00 C ATOM 0 H ALA A 10 -10.405 30.021 8.181 1.00 0.00 H new ATOM 0 HA ALA A 10 -9.780 32.765 7.763 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -7.943 31.721 6.423 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -8.237 30.767 7.897 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.870 30.204 6.332 1.00 0.00 H new ATOM 151 N GLU A 11 -11.159 31.360 5.142 1.00 0.00 N ATOM 152 CA GLU A 11 -11.787 31.713 3.837 1.00 0.00 C ATOM 153 C GLU A 11 -12.910 32.736 4.051 1.00 0.00 C ATOM 154 O GLU A 11 -13.057 33.677 3.296 1.00 0.00 O ATOM 155 CB GLU A 11 -12.350 30.399 3.302 1.00 0.00 C ATOM 156 CG GLU A 11 -12.320 30.415 1.772 1.00 0.00 C ATOM 157 CD GLU A 11 -13.065 31.648 1.256 1.00 0.00 C ATOM 158 OE1 GLU A 11 -14.250 31.757 1.527 1.00 0.00 O ATOM 159 OE2 GLU A 11 -12.437 32.463 0.601 1.00 0.00 O ATOM 0 H GLU A 11 -11.227 30.377 5.405 1.00 0.00 H new ATOM 0 HA GLU A 11 -11.077 32.163 3.143 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -11.765 29.560 3.679 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -13.372 30.259 3.655 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -11.289 30.427 1.419 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -12.781 29.509 1.380 1.00 0.00 H new ATOM 166 N PHE A 12 -13.700 32.560 5.079 1.00 0.00 N ATOM 167 CA PHE A 12 -14.804 33.529 5.341 1.00 0.00 C ATOM 168 C PHE A 12 -14.219 34.904 5.658 1.00 0.00 C ATOM 169 O PHE A 12 -14.815 35.923 5.374 1.00 0.00 O ATOM 170 CB PHE A 12 -15.554 32.970 6.552 1.00 0.00 C ATOM 171 CG PHE A 12 -16.446 31.829 6.119 1.00 0.00 C ATOM 172 CD1 PHE A 12 -17.238 31.947 4.950 1.00 0.00 C ATOM 173 CD2 PHE A 12 -16.494 30.640 6.886 1.00 0.00 C ATOM 174 CE1 PHE A 12 -18.073 30.879 4.549 1.00 0.00 C ATOM 175 CE2 PHE A 12 -17.329 29.571 6.484 1.00 0.00 C ATOM 176 CZ PHE A 12 -18.119 29.690 5.316 1.00 0.00 C ATOM 0 H PHE A 12 -13.628 31.791 5.745 1.00 0.00 H new ATOM 0 HA PHE A 12 -15.464 33.649 4.482 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -14.844 32.624 7.303 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.151 33.755 7.016 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -17.204 32.854 4.365 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.893 30.549 7.779 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -18.676 30.970 3.658 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -17.364 28.664 7.069 1.00 0.00 H new ATOM 0 HZ PHE A 12 -18.757 28.874 5.010 1.00 0.00 H new ATOM 186 N LYS A 13 -13.048 34.941 6.237 1.00 0.00 N ATOM 187 CA LYS A 13 -12.422 36.254 6.558 1.00 0.00 C ATOM 188 C LYS A 13 -12.020 36.960 5.261 1.00 0.00 C ATOM 189 O LYS A 13 -12.173 38.157 5.121 1.00 0.00 O ATOM 190 CB LYS A 13 -11.193 35.919 7.405 1.00 0.00 C ATOM 191 CG LYS A 13 -11.606 35.805 8.877 1.00 0.00 C ATOM 192 CD LYS A 13 -10.631 34.887 9.618 1.00 0.00 C ATOM 193 CE LYS A 13 -9.437 35.703 10.122 1.00 0.00 C ATOM 194 NZ LYS A 13 -8.593 34.727 10.869 1.00 0.00 N ATOM 0 H LYS A 13 -12.501 34.121 6.500 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.098 36.923 7.091 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -10.749 34.983 7.067 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -10.434 36.693 7.287 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -11.614 36.792 9.340 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -12.619 35.410 8.951 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -11.135 34.406 10.456 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -10.288 34.093 8.954 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -8.886 36.149 9.294 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -9.761 36.520 10.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -7.753 35.211 11.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -9.142 34.323 11.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -8.294 33.964 10.228 1.00 0.00 H new ATOM 208 N GLU A 14 -11.525 36.222 4.303 1.00 0.00 N ATOM 209 CA GLU A 14 -11.136 36.852 3.009 1.00 0.00 C ATOM 210 C GLU A 14 -12.368 37.483 2.363 1.00 0.00 C ATOM 211 O GLU A 14 -12.332 38.604 1.893 1.00 0.00 O ATOM 212 CB GLU A 14 -10.602 35.706 2.147 1.00 0.00 C ATOM 213 CG GLU A 14 -9.195 35.329 2.611 1.00 0.00 C ATOM 214 CD GLU A 14 -8.656 34.196 1.736 1.00 0.00 C ATOM 215 OE1 GLU A 14 -8.625 34.370 0.530 1.00 0.00 O ATOM 216 OE2 GLU A 14 -8.285 33.173 2.288 1.00 0.00 O ATOM 0 H GLU A 14 -11.374 35.215 4.360 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.391 37.638 3.132 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.264 34.843 2.221 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.583 36.004 1.099 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.536 36.195 2.550 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -9.216 35.018 3.655 1.00 0.00 H new ATOM 223 N ALA A 15 -13.466 36.776 2.349 1.00 0.00 N ATOM 224 CA ALA A 15 -14.702 37.341 1.747 1.00 0.00 C ATOM 225 C ALA A 15 -15.062 38.647 2.455 1.00 0.00 C ATOM 226 O ALA A 15 -15.384 39.640 1.829 1.00 0.00 O ATOM 227 CB ALA A 15 -15.782 36.285 1.985 1.00 0.00 C ATOM 0 H ALA A 15 -13.558 35.834 2.728 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.588 37.565 0.686 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.727 36.631 1.567 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.491 35.352 1.502 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -15.898 36.118 3.056 1.00 0.00 H new ATOM 233 N PHE A 16 -14.998 38.658 3.759 1.00 0.00 N ATOM 234 CA PHE A 16 -15.325 39.904 4.504 1.00 0.00 C ATOM 235 C PHE A 16 -14.438 41.044 4.011 1.00 0.00 C ATOM 236 O PHE A 16 -14.890 42.151 3.820 1.00 0.00 O ATOM 237 CB PHE A 16 -15.024 39.594 5.965 1.00 0.00 C ATOM 238 CG PHE A 16 -15.500 40.741 6.819 1.00 0.00 C ATOM 239 CD1 PHE A 16 -14.684 41.881 6.998 1.00 0.00 C ATOM 240 CD2 PHE A 16 -16.770 40.679 7.431 1.00 0.00 C ATOM 241 CE1 PHE A 16 -15.138 42.958 7.794 1.00 0.00 C ATOM 242 CE2 PHE A 16 -17.228 41.754 8.226 1.00 0.00 C ATOM 243 CZ PHE A 16 -16.412 42.895 8.409 1.00 0.00 C ATOM 0 H PHE A 16 -14.734 37.860 4.338 1.00 0.00 H new ATOM 0 HA PHE A 16 -16.362 40.209 4.363 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -15.521 38.671 6.264 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -13.954 39.440 6.104 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -13.713 41.930 6.527 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -17.393 39.808 7.292 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -14.513 43.828 7.933 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -18.200 41.704 8.693 1.00 0.00 H new ATOM 0 HZ PHE A 16 -16.760 43.717 9.017 1.00 0.00 H new ATOM 253 N SER A 17 -13.177 40.777 3.798 1.00 0.00 N ATOM 254 CA SER A 17 -12.260 41.846 3.309 1.00 0.00 C ATOM 255 C SER A 17 -12.768 42.387 1.972 1.00 0.00 C ATOM 256 O SER A 17 -12.778 43.578 1.737 1.00 0.00 O ATOM 257 CB SER A 17 -10.906 41.160 3.128 1.00 0.00 C ATOM 258 OG SER A 17 -9.967 42.101 2.617 1.00 0.00 O ATOM 0 H SER A 17 -12.743 39.865 3.942 1.00 0.00 H new ATOM 0 HA SER A 17 -12.196 42.688 3.998 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.557 40.761 4.081 1.00 0.00 H new ATOM 0 HB3 SER A 17 -11.001 40.316 2.445 1.00 0.00 H new ATOM 0 HG SER A 17 -9.097 41.665 2.501 1.00 0.00 H new ATOM 264 N LEU A 18 -13.199 41.517 1.100 1.00 0.00 N ATOM 265 CA LEU A 18 -13.718 41.979 -0.217 1.00 0.00 C ATOM 266 C LEU A 18 -14.912 42.911 0.004 1.00 0.00 C ATOM 267 O LEU A 18 -15.171 43.804 -0.778 1.00 0.00 O ATOM 268 CB LEU A 18 -14.151 40.698 -0.942 1.00 0.00 C ATOM 269 CG LEU A 18 -14.249 40.967 -2.446 1.00 0.00 C ATOM 270 CD1 LEU A 18 -14.126 39.646 -3.211 1.00 0.00 C ATOM 271 CD2 LEU A 18 -15.602 41.611 -2.762 1.00 0.00 C ATOM 0 H LEU A 18 -13.214 40.507 1.243 1.00 0.00 H new ATOM 0 HA LEU A 18 -12.978 42.535 -0.793 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -13.434 39.900 -0.751 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -15.114 40.359 -0.559 1.00 0.00 H new ATOM 0 HG LEU A 18 -13.445 41.639 -2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -14.196 39.838 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -13.164 39.184 -2.987 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -14.930 38.975 -2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -15.672 41.803 -3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -16.405 40.938 -2.460 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -15.693 42.551 -2.218 1.00 0.00 H new ATOM 283 N PHE A 19 -15.634 42.711 1.074 1.00 0.00 N ATOM 284 CA PHE A 19 -16.812 43.586 1.363 1.00 0.00 C ATOM 285 C PHE A 19 -16.370 44.813 2.167 1.00 0.00 C ATOM 286 O PHE A 19 -17.063 45.809 2.232 1.00 0.00 O ATOM 287 CB PHE A 19 -17.759 42.712 2.196 1.00 0.00 C ATOM 288 CG PHE A 19 -17.965 41.361 1.521 1.00 0.00 C ATOM 289 CD1 PHE A 19 -17.737 41.208 0.127 1.00 0.00 C ATOM 290 CD2 PHE A 19 -18.390 40.250 2.289 1.00 0.00 C ATOM 291 CE1 PHE A 19 -17.931 39.951 -0.489 1.00 0.00 C ATOM 292 CE2 PHE A 19 -18.583 38.992 1.670 1.00 0.00 C ATOM 293 CZ PHE A 19 -18.355 38.844 0.281 1.00 0.00 C ATOM 0 H PHE A 19 -15.460 41.979 1.763 1.00 0.00 H new ATOM 0 HA PHE A 19 -17.289 43.954 0.454 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -17.347 42.568 3.195 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -18.718 43.216 2.316 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -17.415 42.054 -0.463 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.567 40.363 3.348 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.755 39.836 -1.548 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -18.904 38.145 2.258 1.00 0.00 H new ATOM 0 HZ PHE A 19 -18.505 37.884 -0.191 1.00 0.00 H new ATOM 303 N ASP A 20 -15.217 44.746 2.775 1.00 0.00 N ATOM 304 CA ASP A 20 -14.719 45.902 3.572 1.00 0.00 C ATOM 305 C ASP A 20 -13.626 46.628 2.784 1.00 0.00 C ATOM 306 O ASP A 20 -12.477 46.664 3.177 1.00 0.00 O ATOM 307 CB ASP A 20 -14.146 45.287 4.852 1.00 0.00 C ATOM 308 CG ASP A 20 -13.920 46.385 5.889 1.00 0.00 C ATOM 309 OD1 ASP A 20 -14.309 47.509 5.622 1.00 0.00 O ATOM 310 OD2 ASP A 20 -13.366 46.083 6.932 1.00 0.00 O ATOM 0 H ASP A 20 -14.596 43.937 2.754 1.00 0.00 H new ATOM 0 HA ASP A 20 -15.500 46.630 3.793 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -14.831 44.536 5.245 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.207 44.779 4.635 1.00 0.00 H new ATOM 315 N LYS A 21 -13.981 47.187 1.664 1.00 0.00 N ATOM 316 CA LYS A 21 -12.978 47.901 0.822 1.00 0.00 C ATOM 317 C LYS A 21 -12.077 48.804 1.675 1.00 0.00 C ATOM 318 O LYS A 21 -10.866 48.724 1.604 1.00 0.00 O ATOM 319 CB LYS A 21 -13.812 48.722 -0.148 1.00 0.00 C ATOM 320 CG LYS A 21 -14.544 47.774 -1.102 1.00 0.00 C ATOM 321 CD LYS A 21 -15.459 48.581 -2.017 1.00 0.00 C ATOM 322 CE LYS A 21 -15.887 47.721 -3.211 1.00 0.00 C ATOM 323 NZ LYS A 21 -14.619 47.209 -3.802 1.00 0.00 N ATOM 0 H LYS A 21 -14.930 47.181 1.290 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.306 47.212 0.311 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -14.529 49.335 0.398 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.173 49.403 -0.710 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.824 47.210 -1.695 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.127 47.049 -0.535 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.337 48.916 -1.465 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.942 49.475 -2.367 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.532 46.902 -2.894 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.450 48.308 -3.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.754 47.037 -4.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -13.865 47.912 -3.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.352 46.320 -3.333 1.00 0.00 H new ATOM 337 N ASP A 22 -12.646 49.664 2.474 1.00 0.00 N ATOM 338 CA ASP A 22 -11.797 50.562 3.313 1.00 0.00 C ATOM 339 C ASP A 22 -11.088 49.745 4.408 1.00 0.00 C ATOM 340 O ASP A 22 -9.914 49.923 4.666 1.00 0.00 O ATOM 341 CB ASP A 22 -12.770 51.585 3.921 1.00 0.00 C ATOM 342 CG ASP A 22 -13.641 50.915 4.982 1.00 0.00 C ATOM 343 OD1 ASP A 22 -14.442 50.071 4.617 1.00 0.00 O ATOM 344 OD2 ASP A 22 -13.490 51.257 6.138 1.00 0.00 O ATOM 0 H ASP A 22 -13.653 49.785 2.583 1.00 0.00 H new ATOM 0 HA ASP A 22 -11.014 51.055 2.737 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.212 52.410 4.365 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -13.399 52.010 3.139 1.00 0.00 H new ATOM 349 N GLY A 23 -11.790 48.845 5.040 1.00 0.00 N ATOM 350 CA GLY A 23 -11.153 48.011 6.101 1.00 0.00 C ATOM 351 C GLY A 23 -11.437 48.605 7.488 1.00 0.00 C ATOM 352 O GLY A 23 -10.537 48.806 8.278 1.00 0.00 O ATOM 0 H GLY A 23 -12.776 48.650 4.869 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -11.535 46.991 6.050 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -10.077 47.958 5.934 1.00 0.00 H new ATOM 356 N ASP A 24 -12.679 48.875 7.797 1.00 0.00 N ATOM 357 CA ASP A 24 -13.000 49.439 9.142 1.00 0.00 C ATOM 358 C ASP A 24 -13.645 48.358 10.021 1.00 0.00 C ATOM 359 O ASP A 24 -13.585 48.414 11.233 1.00 0.00 O ATOM 360 CB ASP A 24 -13.979 50.590 8.884 1.00 0.00 C ATOM 361 CG ASP A 24 -15.223 50.063 8.164 1.00 0.00 C ATOM 362 OD1 ASP A 24 -15.823 49.133 8.668 1.00 0.00 O ATOM 363 OD2 ASP A 24 -15.557 50.607 7.125 1.00 0.00 O ATOM 0 H ASP A 24 -13.479 48.731 7.181 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.110 49.788 9.666 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.264 51.055 9.828 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -13.498 51.360 8.281 1.00 0.00 H new ATOM 368 N GLY A 25 -14.254 47.370 9.417 1.00 0.00 N ATOM 369 CA GLY A 25 -14.889 46.285 10.220 1.00 0.00 C ATOM 370 C GLY A 25 -16.416 46.345 10.081 1.00 0.00 C ATOM 371 O GLY A 25 -17.138 45.975 10.982 1.00 0.00 O ATOM 0 H GLY A 25 -14.338 47.269 8.406 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -14.524 45.314 9.885 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -14.608 46.387 11.268 1.00 0.00 H new ATOM 375 N THR A 26 -16.915 46.798 8.960 1.00 0.00 N ATOM 376 CA THR A 26 -18.402 46.866 8.785 1.00 0.00 C ATOM 377 C THR A 26 -18.773 46.781 7.300 1.00 0.00 C ATOM 378 O THR A 26 -17.972 47.064 6.432 1.00 0.00 O ATOM 379 CB THR A 26 -18.818 48.225 9.359 1.00 0.00 C ATOM 380 OG1 THR A 26 -18.207 49.264 8.605 1.00 0.00 O ATOM 381 CG2 THR A 26 -18.377 48.325 10.820 1.00 0.00 C ATOM 0 H THR A 26 -16.366 47.122 8.164 1.00 0.00 H new ATOM 0 HA THR A 26 -18.905 46.040 9.287 1.00 0.00 H new ATOM 0 HB THR A 26 -19.902 48.324 9.304 1.00 0.00 H new ATOM 0 HG1 THR A 26 -17.308 48.985 8.332 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.675 49.292 11.224 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.848 47.530 11.398 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.293 48.224 10.881 1.00 0.00 H new ATOM 389 N ILE A 27 -19.986 46.394 7.005 1.00 0.00 N ATOM 390 CA ILE A 27 -20.414 46.293 5.576 1.00 0.00 C ATOM 391 C ILE A 27 -21.669 47.146 5.344 1.00 0.00 C ATOM 392 O ILE A 27 -22.744 46.824 5.807 1.00 0.00 O ATOM 393 CB ILE A 27 -20.720 44.811 5.359 1.00 0.00 C ATOM 394 CG1 ILE A 27 -19.419 44.004 5.442 1.00 0.00 C ATOM 395 CG2 ILE A 27 -21.354 44.612 3.978 1.00 0.00 C ATOM 396 CD1 ILE A 27 -19.749 42.526 5.658 1.00 0.00 C ATOM 0 H ILE A 27 -20.699 46.143 7.690 1.00 0.00 H new ATOM 0 HA ILE A 27 -19.652 46.654 4.885 1.00 0.00 H new ATOM 0 HB ILE A 27 -21.413 44.469 6.128 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -18.842 44.129 4.526 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -18.801 44.373 6.261 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -21.571 43.555 3.826 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -22.279 45.185 3.916 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -20.663 44.955 3.208 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -18.824 41.952 5.717 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -20.308 42.410 6.586 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -20.350 42.162 4.825 1.00 0.00 H new ATOM 408 N THR A 28 -21.535 48.237 4.636 1.00 0.00 N ATOM 409 CA THR A 28 -22.718 49.115 4.380 1.00 0.00 C ATOM 410 C THR A 28 -23.347 48.778 3.022 1.00 0.00 C ATOM 411 O THR A 28 -23.079 47.745 2.441 1.00 0.00 O ATOM 412 CB THR A 28 -22.156 50.538 4.371 1.00 0.00 C ATOM 413 OG1 THR A 28 -21.176 50.653 3.349 1.00 0.00 O ATOM 414 CG2 THR A 28 -21.518 50.848 5.727 1.00 0.00 C ATOM 0 H THR A 28 -20.659 48.559 4.224 1.00 0.00 H new ATOM 0 HA THR A 28 -23.498 48.987 5.130 1.00 0.00 H new ATOM 0 HB THR A 28 -22.964 51.245 4.182 1.00 0.00 H new ATOM 0 HG1 THR A 28 -20.817 51.565 3.341 1.00 0.00 H new ATOM 0 HG21 THR A 28 -21.119 51.862 5.718 1.00 0.00 H new ATOM 0 HG22 THR A 28 -22.270 50.761 6.511 1.00 0.00 H new ATOM 0 HG23 THR A 28 -20.710 50.142 5.919 1.00 0.00 H new ATOM 422 N THR A 29 -24.183 49.644 2.514 1.00 0.00 N ATOM 423 CA THR A 29 -24.828 49.375 1.194 1.00 0.00 C ATOM 424 C THR A 29 -23.914 49.838 0.054 1.00 0.00 C ATOM 425 O THR A 29 -23.977 49.329 -1.048 1.00 0.00 O ATOM 426 CB THR A 29 -26.121 50.189 1.210 1.00 0.00 C ATOM 427 OG1 THR A 29 -25.826 51.540 1.542 1.00 0.00 O ATOM 428 CG2 THR A 29 -27.082 49.605 2.244 1.00 0.00 C ATOM 0 H THR A 29 -24.447 50.525 2.955 1.00 0.00 H new ATOM 0 HA THR A 29 -25.018 48.313 1.037 1.00 0.00 H new ATOM 0 HB THR A 29 -26.586 50.151 0.225 1.00 0.00 H new ATOM 0 HG1 THR A 29 -26.655 52.063 1.551 1.00 0.00 H new ATOM 0 HG21 THR A 29 -28.004 50.187 2.254 1.00 0.00 H new ATOM 0 HG22 THR A 29 -27.309 48.570 1.986 1.00 0.00 H new ATOM 0 HG23 THR A 29 -26.620 49.640 3.231 1.00 0.00 H new ATOM 436 N LYS A 30 -23.064 50.797 0.310 1.00 0.00 N ATOM 437 CA LYS A 30 -22.145 51.285 -0.761 1.00 0.00 C ATOM 438 C LYS A 30 -21.098 50.215 -1.081 1.00 0.00 C ATOM 439 O LYS A 30 -21.039 49.700 -2.181 1.00 0.00 O ATOM 440 CB LYS A 30 -21.479 52.533 -0.179 1.00 0.00 C ATOM 441 CG LYS A 30 -22.393 53.745 -0.386 1.00 0.00 C ATOM 442 CD LYS A 30 -22.936 54.215 0.967 1.00 0.00 C ATOM 443 CE LYS A 30 -22.058 55.348 1.509 1.00 0.00 C ATOM 444 NZ LYS A 30 -22.298 56.497 0.592 1.00 0.00 N ATOM 0 H LYS A 30 -22.966 51.263 1.212 1.00 0.00 H new ATOM 0 HA LYS A 30 -22.672 51.504 -1.690 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -21.282 52.391 0.883 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -20.517 52.703 -0.662 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -21.841 54.552 -0.868 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.217 53.483 -1.049 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -23.964 54.559 0.858 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -22.951 53.384 1.672 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -22.327 55.599 2.535 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -21.006 55.063 1.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -21.535 56.543 -0.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -23.210 56.370 0.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -22.317 57.381 1.140 1.00 0.00 H new ATOM 458 N GLU A 31 -20.274 49.869 -0.128 1.00 0.00 N ATOM 459 CA GLU A 31 -19.241 48.827 -0.385 1.00 0.00 C ATOM 460 C GLU A 31 -19.913 47.535 -0.835 1.00 0.00 C ATOM 461 O GLU A 31 -19.501 46.913 -1.792 1.00 0.00 O ATOM 462 CB GLU A 31 -18.533 48.624 0.954 1.00 0.00 C ATOM 463 CG GLU A 31 -17.869 49.931 1.388 1.00 0.00 C ATOM 464 CD GLU A 31 -17.158 49.722 2.724 1.00 0.00 C ATOM 465 OE1 GLU A 31 -17.825 49.355 3.677 1.00 0.00 O ATOM 466 OE2 GLU A 31 -15.958 49.933 2.772 1.00 0.00 O ATOM 0 H GLU A 31 -20.272 50.262 0.813 1.00 0.00 H new ATOM 0 HA GLU A 31 -18.543 49.119 -1.169 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -19.249 48.300 1.710 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -17.785 47.836 0.865 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -17.156 50.258 0.631 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -18.617 50.718 1.481 1.00 0.00 H new ATOM 473 N LEU A 32 -20.951 47.127 -0.158 1.00 0.00 N ATOM 474 CA LEU A 32 -21.651 45.876 -0.561 1.00 0.00 C ATOM 475 C LEU A 32 -22.180 46.019 -1.989 1.00 0.00 C ATOM 476 O LEU A 32 -22.249 45.064 -2.736 1.00 0.00 O ATOM 477 CB LEU A 32 -22.805 45.728 0.430 1.00 0.00 C ATOM 478 CG LEU A 32 -23.520 44.401 0.185 1.00 0.00 C ATOM 479 CD1 LEU A 32 -23.237 43.449 1.348 1.00 0.00 C ATOM 480 CD2 LEU A 32 -25.028 44.645 0.080 1.00 0.00 C ATOM 0 H LEU A 32 -21.343 47.604 0.654 1.00 0.00 H new ATOM 0 HA LEU A 32 -20.995 45.006 -0.546 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -22.428 45.767 1.452 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -23.504 46.556 0.317 1.00 0.00 H new ATOM 0 HG LEU A 32 -23.159 43.959 -0.744 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -23.747 42.501 1.175 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -22.164 43.275 1.423 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -23.599 43.891 2.276 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -25.539 43.698 -0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -25.391 45.087 1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -25.230 45.324 -0.748 1.00 0.00 H new ATOM 492 N GLY A 33 -22.547 47.211 -2.375 1.00 0.00 N ATOM 493 CA GLY A 33 -23.065 47.422 -3.754 1.00 0.00 C ATOM 494 C GLY A 33 -21.986 47.032 -4.762 1.00 0.00 C ATOM 495 O GLY A 33 -22.224 46.267 -5.677 1.00 0.00 O ATOM 0 H GLY A 33 -22.510 48.048 -1.793 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -23.962 46.824 -3.914 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -23.349 48.465 -3.893 1.00 0.00 H new ATOM 499 N THR A 34 -20.794 47.543 -4.602 1.00 0.00 N ATOM 500 CA THR A 34 -19.704 47.187 -5.553 1.00 0.00 C ATOM 501 C THR A 34 -19.297 45.730 -5.344 1.00 0.00 C ATOM 502 O THR A 34 -18.747 45.092 -6.222 1.00 0.00 O ATOM 503 CB THR A 34 -18.546 48.121 -5.207 1.00 0.00 C ATOM 504 OG1 THR A 34 -18.935 49.467 -5.454 1.00 0.00 O ATOM 505 CG2 THR A 34 -17.334 47.771 -6.070 1.00 0.00 C ATOM 0 H THR A 34 -20.530 48.188 -3.857 1.00 0.00 H new ATOM 0 HA THR A 34 -20.008 47.295 -6.594 1.00 0.00 H new ATOM 0 HB THR A 34 -18.286 48.006 -4.155 1.00 0.00 H new ATOM 0 HG1 THR A 34 -18.194 50.068 -5.231 1.00 0.00 H new ATOM 0 HG21 THR A 34 -16.507 48.437 -5.824 1.00 0.00 H new ATOM 0 HG22 THR A 34 -17.038 46.739 -5.880 1.00 0.00 H new ATOM 0 HG23 THR A 34 -17.591 47.886 -7.123 1.00 0.00 H new ATOM 513 N VAL A 35 -19.571 45.198 -4.186 1.00 0.00 N ATOM 514 CA VAL A 35 -19.214 43.780 -3.907 1.00 0.00 C ATOM 515 C VAL A 35 -20.113 42.855 -4.728 1.00 0.00 C ATOM 516 O VAL A 35 -19.708 41.790 -5.149 1.00 0.00 O ATOM 517 CB VAL A 35 -19.467 43.604 -2.408 1.00 0.00 C ATOM 518 CG1 VAL A 35 -19.406 42.120 -2.038 1.00 0.00 C ATOM 519 CG2 VAL A 35 -18.397 44.366 -1.625 1.00 0.00 C ATOM 0 H VAL A 35 -20.029 45.687 -3.417 1.00 0.00 H new ATOM 0 HA VAL A 35 -18.184 43.539 -4.172 1.00 0.00 H new ATOM 0 HB VAL A 35 -20.455 43.993 -2.161 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -19.587 42.004 -0.969 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -20.166 41.574 -2.596 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -18.421 41.724 -2.284 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -18.572 44.244 -0.556 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.412 43.973 -1.878 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.443 45.424 -1.882 1.00 0.00 H new ATOM 529 N MET A 36 -21.330 43.263 -4.969 1.00 0.00 N ATOM 530 CA MET A 36 -22.254 42.416 -5.774 1.00 0.00 C ATOM 531 C MET A 36 -22.063 42.718 -7.262 1.00 0.00 C ATOM 532 O MET A 36 -22.370 41.910 -8.115 1.00 0.00 O ATOM 533 CB MET A 36 -23.658 42.812 -5.318 1.00 0.00 C ATOM 534 CG MET A 36 -23.798 42.557 -3.815 1.00 0.00 C ATOM 535 SD MET A 36 -23.535 40.799 -3.471 1.00 0.00 S ATOM 536 CE MET A 36 -23.751 40.881 -1.676 1.00 0.00 C ATOM 0 H MET A 36 -21.723 44.146 -4.643 1.00 0.00 H new ATOM 0 HA MET A 36 -22.074 41.350 -5.635 1.00 0.00 H new ATOM 0 HB2 MET A 36 -23.840 43.864 -5.538 1.00 0.00 H new ATOM 0 HB3 MET A 36 -24.405 42.238 -5.866 1.00 0.00 H new ATOM 0 HG2 MET A 36 -23.074 43.158 -3.265 1.00 0.00 H new ATOM 0 HG3 MET A 36 -24.788 42.860 -3.475 1.00 0.00 H new ATOM 0 HE1 MET A 36 -23.628 39.886 -1.249 1.00 0.00 H new ATOM 0 HE2 MET A 36 -23.006 41.553 -1.250 1.00 0.00 H new ATOM 0 HE3 MET A 36 -24.749 41.254 -1.446 1.00 0.00 H new ATOM 546 N ARG A 37 -21.549 43.878 -7.578 1.00 0.00 N ATOM 547 CA ARG A 37 -21.328 44.232 -9.009 1.00 0.00 C ATOM 548 C ARG A 37 -20.223 43.354 -9.597 1.00 0.00 C ATOM 549 O ARG A 37 -20.348 42.825 -10.684 1.00 0.00 O ATOM 550 CB ARG A 37 -20.895 45.698 -8.994 1.00 0.00 C ATOM 551 CG ARG A 37 -22.134 46.593 -9.036 1.00 0.00 C ATOM 552 CD ARG A 37 -22.729 46.570 -10.445 1.00 0.00 C ATOM 553 NE ARG A 37 -21.679 47.167 -11.316 1.00 0.00 N ATOM 554 CZ ARG A 37 -21.410 48.443 -11.234 1.00 0.00 C ATOM 555 NH1 ARG A 37 -22.356 49.322 -11.418 1.00 0.00 N ATOM 556 NH2 ARG A 37 -20.195 48.837 -10.964 1.00 0.00 N ATOM 0 H ARG A 37 -21.273 44.594 -6.906 1.00 0.00 H new ATOM 0 HA ARG A 37 -22.219 44.079 -9.617 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -20.312 45.907 -8.097 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -20.252 45.908 -9.849 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -22.871 46.246 -8.312 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -21.869 47.613 -8.758 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -22.968 45.553 -10.756 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -23.654 47.144 -10.492 1.00 0.00 H new ATOM 0 HE ARG A 37 -21.170 46.580 -11.977 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -23.306 49.013 -11.626 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -22.146 50.318 -11.354 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -19.456 48.149 -10.817 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -19.984 49.833 -10.900 1.00 0.00 H new ATOM 570 N SER A 38 -19.141 43.191 -8.883 1.00 0.00 N ATOM 571 CA SER A 38 -18.028 42.342 -9.399 1.00 0.00 C ATOM 572 C SER A 38 -18.155 40.911 -8.858 1.00 0.00 C ATOM 573 O SER A 38 -17.271 40.094 -9.025 1.00 0.00 O ATOM 574 CB SER A 38 -16.754 43.000 -8.876 1.00 0.00 C ATOM 575 OG SER A 38 -16.657 44.319 -9.400 1.00 0.00 O ATOM 0 H SER A 38 -18.980 43.608 -7.966 1.00 0.00 H new ATOM 0 HA SER A 38 -18.034 42.271 -10.487 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.767 43.029 -7.786 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.882 42.415 -9.169 1.00 0.00 H new ATOM 0 HG SER A 38 -15.841 44.745 -9.065 1.00 0.00 H new ATOM 581 N LEU A 39 -19.250 40.600 -8.211 1.00 0.00 N ATOM 582 CA LEU A 39 -19.426 39.224 -7.662 1.00 0.00 C ATOM 583 C LEU A 39 -20.898 38.979 -7.310 1.00 0.00 C ATOM 584 O LEU A 39 -21.277 38.974 -6.156 1.00 0.00 O ATOM 585 CB LEU A 39 -18.561 39.190 -6.404 1.00 0.00 C ATOM 586 CG LEU A 39 -17.891 37.822 -6.283 1.00 0.00 C ATOM 587 CD1 LEU A 39 -16.409 37.948 -6.641 1.00 0.00 C ATOM 588 CD2 LEU A 39 -18.025 37.314 -4.844 1.00 0.00 C ATOM 0 H LEU A 39 -20.027 41.239 -8.040 1.00 0.00 H new ATOM 0 HA LEU A 39 -19.139 38.452 -8.376 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -17.805 39.974 -6.448 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -19.173 39.386 -5.524 1.00 0.00 H new ATOM 0 HG LEU A 39 -18.372 37.120 -6.964 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -15.930 36.973 -6.555 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -16.311 38.311 -7.664 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -15.928 38.650 -5.959 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -17.547 36.338 -4.757 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -17.543 38.016 -4.164 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -19.080 37.226 -4.586 1.00 0.00 H new ATOM 600 N GLY A 40 -21.729 38.775 -8.296 1.00 0.00 N ATOM 601 CA GLY A 40 -23.172 38.531 -8.012 1.00 0.00 C ATOM 602 C GLY A 40 -24.018 39.040 -9.179 1.00 0.00 C ATOM 603 O GLY A 40 -24.277 38.326 -10.128 1.00 0.00 O ATOM 0 H GLY A 40 -21.472 38.767 -9.283 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -23.348 37.466 -7.860 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -23.462 39.037 -7.091 1.00 0.00 H new ATOM 607 N GLN A 41 -24.452 40.268 -9.118 1.00 0.00 N ATOM 608 CA GLN A 41 -25.282 40.821 -10.224 1.00 0.00 C ATOM 609 C GLN A 41 -25.288 42.354 -10.160 1.00 0.00 C ATOM 610 O GLN A 41 -24.308 42.970 -9.794 1.00 0.00 O ATOM 611 CB GLN A 41 -26.684 40.258 -9.983 1.00 0.00 C ATOM 612 CG GLN A 41 -27.223 40.778 -8.650 1.00 0.00 C ATOM 613 CD GLN A 41 -28.501 40.021 -8.287 1.00 0.00 C ATOM 614 OE1 GLN A 41 -29.511 40.156 -8.946 1.00 0.00 O ATOM 615 NE2 GLN A 41 -28.497 39.219 -7.256 1.00 0.00 N ATOM 0 H GLN A 41 -24.268 40.913 -8.350 1.00 0.00 H new ATOM 0 HA GLN A 41 -24.902 40.549 -11.209 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -27.349 40.551 -10.795 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -26.653 39.168 -9.974 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -26.476 40.647 -7.867 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -27.428 41.846 -8.720 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -27.648 39.105 -6.702 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -29.343 38.707 -7.005 1.00 0.00 H new ATOM 624 N ASN A 42 -26.381 42.974 -10.512 1.00 0.00 N ATOM 625 CA ASN A 42 -26.436 44.463 -10.469 1.00 0.00 C ATOM 626 C ASN A 42 -27.564 44.927 -9.540 1.00 0.00 C ATOM 627 O ASN A 42 -28.576 45.421 -9.996 1.00 0.00 O ATOM 628 CB ASN A 42 -26.717 44.891 -11.909 1.00 0.00 C ATOM 629 CG ASN A 42 -26.674 46.417 -12.006 1.00 0.00 C ATOM 630 OD1 ASN A 42 -25.669 47.027 -11.699 1.00 0.00 O ATOM 631 ND2 ASN A 42 -27.728 47.063 -12.424 1.00 0.00 N ATOM 0 H ASN A 42 -27.236 42.516 -10.827 1.00 0.00 H new ATOM 0 HA ASN A 42 -25.513 44.898 -10.087 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -25.979 44.452 -12.580 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -27.693 44.523 -12.225 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -27.708 48.080 -12.493 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -28.571 46.550 -12.682 1.00 0.00 H new ATOM 638 N PRO A 43 -27.349 44.752 -8.256 1.00 0.00 N ATOM 639 CA PRO A 43 -28.361 45.163 -7.264 1.00 0.00 C ATOM 640 C PRO A 43 -28.341 46.685 -7.088 1.00 0.00 C ATOM 641 O PRO A 43 -27.295 47.296 -6.997 1.00 0.00 O ATOM 642 CB PRO A 43 -27.925 44.460 -5.985 1.00 0.00 C ATOM 643 CG PRO A 43 -26.450 44.228 -6.143 1.00 0.00 C ATOM 644 CD PRO A 43 -26.159 44.165 -7.629 1.00 0.00 C ATOM 0 HA PRO A 43 -29.378 44.902 -7.555 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -28.135 45.073 -5.108 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -28.459 43.519 -5.852 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -25.882 45.032 -5.674 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -26.153 43.301 -5.654 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -25.259 44.725 -7.882 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -26.000 43.139 -7.960 1.00 0.00 H new ATOM 652 N THR A 44 -29.489 47.301 -7.045 1.00 0.00 N ATOM 653 CA THR A 44 -29.536 48.783 -6.881 1.00 0.00 C ATOM 654 C THR A 44 -29.173 49.170 -5.444 1.00 0.00 C ATOM 655 O THR A 44 -28.412 48.493 -4.783 1.00 0.00 O ATOM 656 CB THR A 44 -30.985 49.163 -7.193 1.00 0.00 C ATOM 657 OG1 THR A 44 -31.847 48.570 -6.231 1.00 0.00 O ATOM 658 CG2 THR A 44 -31.356 48.662 -8.589 1.00 0.00 C ATOM 0 H THR A 44 -30.398 46.843 -7.116 1.00 0.00 H new ATOM 0 HA THR A 44 -28.828 49.297 -7.532 1.00 0.00 H new ATOM 0 HB THR A 44 -31.092 50.247 -7.158 1.00 0.00 H new ATOM 0 HG1 THR A 44 -32.775 48.814 -6.429 1.00 0.00 H new ATOM 0 HG21 THR A 44 -32.388 48.933 -8.810 1.00 0.00 H new ATOM 0 HG22 THR A 44 -30.695 49.117 -9.327 1.00 0.00 H new ATOM 0 HG23 THR A 44 -31.250 47.578 -8.627 1.00 0.00 H new ATOM 666 N GLU A 45 -29.712 50.254 -4.957 1.00 0.00 N ATOM 667 CA GLU A 45 -29.398 50.682 -3.563 1.00 0.00 C ATOM 668 C GLU A 45 -30.581 50.367 -2.642 1.00 0.00 C ATOM 669 O GLU A 45 -30.409 49.892 -1.537 1.00 0.00 O ATOM 670 CB GLU A 45 -29.174 52.190 -3.655 1.00 0.00 C ATOM 671 CG GLU A 45 -28.045 52.483 -4.646 1.00 0.00 C ATOM 672 CD GLU A 45 -27.984 53.986 -4.923 1.00 0.00 C ATOM 673 OE1 GLU A 45 -27.742 54.733 -3.988 1.00 0.00 O ATOM 674 OE2 GLU A 45 -28.181 54.366 -6.066 1.00 0.00 O ATOM 0 H GLU A 45 -30.356 50.862 -5.463 1.00 0.00 H new ATOM 0 HA GLU A 45 -28.529 50.167 -3.154 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.091 52.685 -3.976 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -28.922 52.591 -2.673 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -27.093 52.138 -4.241 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -28.212 51.938 -5.575 1.00 0.00 H new ATOM 681 N ALA A 46 -31.783 50.623 -3.091 1.00 0.00 N ATOM 682 CA ALA A 46 -32.974 50.330 -2.240 1.00 0.00 C ATOM 683 C ALA A 46 -33.151 48.816 -2.102 1.00 0.00 C ATOM 684 O ALA A 46 -33.044 48.263 -1.025 1.00 0.00 O ATOM 685 CB ALA A 46 -34.158 50.942 -2.986 1.00 0.00 C ATOM 0 H ALA A 46 -31.990 51.021 -4.007 1.00 0.00 H new ATOM 0 HA ALA A 46 -32.877 50.738 -1.234 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -35.074 50.767 -2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -34.001 52.015 -3.100 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -34.245 50.481 -3.970 1.00 0.00 H new ATOM 691 N GLU A 47 -33.410 48.139 -3.188 1.00 0.00 N ATOM 692 CA GLU A 47 -33.581 46.660 -3.120 1.00 0.00 C ATOM 693 C GLU A 47 -32.388 46.036 -2.393 1.00 0.00 C ATOM 694 O GLU A 47 -32.536 45.142 -1.586 1.00 0.00 O ATOM 695 CB GLU A 47 -33.624 46.200 -4.576 1.00 0.00 C ATOM 696 CG GLU A 47 -33.829 44.685 -4.629 1.00 0.00 C ATOM 697 CD GLU A 47 -33.691 44.202 -6.074 1.00 0.00 C ATOM 698 OE1 GLU A 47 -32.615 44.355 -6.629 1.00 0.00 O ATOM 699 OE2 GLU A 47 -34.664 43.689 -6.603 1.00 0.00 O ATOM 0 H GLU A 47 -33.510 48.546 -4.118 1.00 0.00 H new ATOM 0 HA GLU A 47 -34.479 46.366 -2.577 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -34.433 46.705 -5.104 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -32.696 46.470 -5.081 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -33.096 44.186 -3.996 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -34.814 44.427 -4.240 1.00 0.00 H new ATOM 706 N LEU A 48 -31.208 46.509 -2.670 1.00 0.00 N ATOM 707 CA LEU A 48 -30.002 45.956 -1.994 1.00 0.00 C ATOM 708 C LEU A 48 -30.174 46.041 -0.474 1.00 0.00 C ATOM 709 O LEU A 48 -30.038 45.060 0.236 1.00 0.00 O ATOM 710 CB LEU A 48 -28.856 46.852 -2.461 1.00 0.00 C ATOM 711 CG LEU A 48 -27.554 46.415 -1.798 1.00 0.00 C ATOM 712 CD1 LEU A 48 -26.399 46.607 -2.780 1.00 0.00 C ATOM 713 CD2 LEU A 48 -27.306 47.268 -0.555 1.00 0.00 C ATOM 0 H LEU A 48 -31.025 47.258 -3.338 1.00 0.00 H new ATOM 0 HA LEU A 48 -29.824 44.908 -2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -28.759 46.798 -3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -29.070 47.891 -2.212 1.00 0.00 H new ATOM 0 HG LEU A 48 -27.624 45.365 -1.513 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -25.466 46.296 -2.310 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -26.575 46.004 -3.671 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -26.331 47.658 -3.061 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -26.376 46.957 -0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -27.234 48.317 -0.842 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -28.132 47.140 0.145 1.00 0.00 H new ATOM 725 N GLN A 49 -30.480 47.205 0.028 1.00 0.00 N ATOM 726 CA GLN A 49 -30.670 47.353 1.497 1.00 0.00 C ATOM 727 C GLN A 49 -31.653 46.294 2.001 1.00 0.00 C ATOM 728 O GLN A 49 -31.494 45.744 3.072 1.00 0.00 O ATOM 729 CB GLN A 49 -31.245 48.757 1.680 1.00 0.00 C ATOM 730 CG GLN A 49 -31.439 49.046 3.170 1.00 0.00 C ATOM 731 CD GLN A 49 -31.722 50.537 3.365 1.00 0.00 C ATOM 732 OE1 GLN A 49 -30.877 51.369 3.098 1.00 0.00 O ATOM 733 NE2 GLN A 49 -32.886 50.915 3.820 1.00 0.00 N ATOM 0 H GLN A 49 -30.606 48.059 -0.515 1.00 0.00 H new ATOM 0 HA GLN A 49 -29.744 47.221 2.056 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -30.574 49.495 1.241 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -32.197 48.841 1.157 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -32.265 48.453 3.562 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -30.547 48.758 3.727 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -33.596 50.218 4.045 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -33.085 51.907 3.951 1.00 0.00 H new ATOM 742 N ASP A 50 -32.666 45.997 1.227 1.00 0.00 N ATOM 743 CA ASP A 50 -33.649 44.966 1.657 1.00 0.00 C ATOM 744 C ASP A 50 -32.953 43.612 1.786 1.00 0.00 C ATOM 745 O ASP A 50 -33.198 42.862 2.712 1.00 0.00 O ATOM 746 CB ASP A 50 -34.704 44.931 0.554 1.00 0.00 C ATOM 747 CG ASP A 50 -35.787 43.912 0.914 1.00 0.00 C ATOM 748 OD1 ASP A 50 -35.451 42.751 1.072 1.00 0.00 O ATOM 749 OD2 ASP A 50 -36.936 44.311 1.026 1.00 0.00 O ATOM 0 H ASP A 50 -32.852 46.424 0.320 1.00 0.00 H new ATOM 0 HA ASP A 50 -34.093 45.192 2.626 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -35.147 45.919 0.429 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -34.242 44.666 -0.397 1.00 0.00 H new ATOM 754 N MET A 51 -32.077 43.297 0.871 1.00 0.00 N ATOM 755 CA MET A 51 -31.354 41.996 0.949 1.00 0.00 C ATOM 756 C MET A 51 -30.433 41.992 2.171 1.00 0.00 C ATOM 757 O MET A 51 -30.012 40.953 2.640 1.00 0.00 O ATOM 758 CB MET A 51 -30.535 41.911 -0.341 1.00 0.00 C ATOM 759 CG MET A 51 -29.943 40.503 -0.476 1.00 0.00 C ATOM 760 SD MET A 51 -29.408 40.230 -2.187 1.00 0.00 S ATOM 761 CE MET A 51 -27.663 40.664 -1.965 1.00 0.00 C ATOM 0 H MET A 51 -31.831 43.884 0.074 1.00 0.00 H new ATOM 0 HA MET A 51 -32.032 41.149 1.050 1.00 0.00 H new ATOM 0 HB2 MET A 51 -31.166 42.136 -1.201 1.00 0.00 H new ATOM 0 HB3 MET A 51 -29.737 42.653 -0.328 1.00 0.00 H new ATOM 0 HG2 MET A 51 -29.098 40.386 0.203 1.00 0.00 H new ATOM 0 HG3 MET A 51 -30.685 39.757 -0.193 1.00 0.00 H new ATOM 0 HE1 MET A 51 -27.139 40.562 -2.915 1.00 0.00 H new ATOM 0 HE2 MET A 51 -27.586 41.694 -1.616 1.00 0.00 H new ATOM 0 HE3 MET A 51 -27.213 39.997 -1.229 1.00 0.00 H new ATOM 771 N ILE A 52 -30.116 43.148 2.691 1.00 0.00 N ATOM 772 CA ILE A 52 -29.221 43.208 3.885 1.00 0.00 C ATOM 773 C ILE A 52 -30.041 43.100 5.176 1.00 0.00 C ATOM 774 O ILE A 52 -29.547 42.680 6.200 1.00 0.00 O ATOM 775 CB ILE A 52 -28.537 44.571 3.805 1.00 0.00 C ATOM 776 CG1 ILE A 52 -27.730 44.664 2.503 1.00 0.00 C ATOM 777 CG2 ILE A 52 -27.597 44.741 5.006 1.00 0.00 C ATOM 778 CD1 ILE A 52 -26.904 45.953 2.502 1.00 0.00 C ATOM 0 H ILE A 52 -30.437 44.051 2.342 1.00 0.00 H new ATOM 0 HA ILE A 52 -28.502 42.389 3.895 1.00 0.00 H new ATOM 0 HB ILE A 52 -29.291 45.358 3.820 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -27.073 43.799 2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -28.402 44.650 1.645 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -27.108 45.714 4.950 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -28.172 44.676 5.930 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -26.843 43.954 4.992 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -26.331 46.018 1.577 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -27.570 46.812 2.577 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -26.221 45.948 3.352 1.00 0.00 H new ATOM 790 N ASN A 53 -31.288 43.479 5.137 1.00 0.00 N ATOM 791 CA ASN A 53 -32.125 43.396 6.371 1.00 0.00 C ATOM 792 C ASN A 53 -32.256 41.938 6.831 1.00 0.00 C ATOM 793 O ASN A 53 -32.240 41.647 8.011 1.00 0.00 O ATOM 794 CB ASN A 53 -33.489 43.962 5.973 1.00 0.00 C ATOM 795 CG ASN A 53 -33.428 45.493 5.983 1.00 0.00 C ATOM 796 OD1 ASN A 53 -32.839 46.082 6.867 1.00 0.00 O ATOM 797 ND2 ASN A 53 -34.028 46.166 5.041 1.00 0.00 N ATOM 0 H ASN A 53 -31.763 43.841 4.310 1.00 0.00 H new ATOM 0 HA ASN A 53 -31.685 43.949 7.201 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -33.768 43.605 4.982 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -34.256 43.613 6.665 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -34.002 47.186 5.047 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -34.523 45.673 4.298 1.00 0.00 H new ATOM 804 N GLU A 54 -32.385 41.020 5.911 1.00 0.00 N ATOM 805 CA GLU A 54 -32.516 39.582 6.306 1.00 0.00 C ATOM 806 C GLU A 54 -31.224 39.092 6.971 1.00 0.00 C ATOM 807 O GLU A 54 -31.214 38.096 7.667 1.00 0.00 O ATOM 808 CB GLU A 54 -32.776 38.822 5.000 1.00 0.00 C ATOM 809 CG GLU A 54 -31.645 39.091 4.005 1.00 0.00 C ATOM 810 CD GLU A 54 -31.775 38.140 2.814 1.00 0.00 C ATOM 811 OE1 GLU A 54 -32.519 37.180 2.926 1.00 0.00 O ATOM 812 OE2 GLU A 54 -31.127 38.388 1.810 1.00 0.00 O ATOM 0 H GLU A 54 -32.406 41.199 4.907 1.00 0.00 H new ATOM 0 HA GLU A 54 -33.319 39.428 7.026 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -32.849 37.753 5.200 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -33.729 39.132 4.572 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -31.685 40.125 3.664 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -30.679 38.953 4.490 1.00 0.00 H new ATOM 819 N VAL A 55 -30.138 39.788 6.769 1.00 0.00 N ATOM 820 CA VAL A 55 -28.849 39.363 7.397 1.00 0.00 C ATOM 821 C VAL A 55 -28.625 40.127 8.706 1.00 0.00 C ATOM 822 O VAL A 55 -28.687 39.568 9.783 1.00 0.00 O ATOM 823 CB VAL A 55 -27.768 39.726 6.381 1.00 0.00 C ATOM 824 CG1 VAL A 55 -26.389 39.457 6.985 1.00 0.00 C ATOM 825 CG2 VAL A 55 -27.941 38.878 5.119 1.00 0.00 C ATOM 0 H VAL A 55 -30.085 40.631 6.198 1.00 0.00 H new ATOM 0 HA VAL A 55 -28.841 38.300 7.637 1.00 0.00 H new ATOM 0 HB VAL A 55 -27.856 40.782 6.124 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -25.617 39.716 6.260 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -26.261 40.062 7.883 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -26.305 38.401 7.243 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -27.168 39.139 4.396 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -27.856 37.822 5.376 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -28.923 39.068 4.685 1.00 0.00 H new ATOM 835 N ASP A 56 -28.361 41.405 8.616 1.00 0.00 N ATOM 836 CA ASP A 56 -28.128 42.219 9.849 1.00 0.00 C ATOM 837 C ASP A 56 -29.183 41.896 10.914 1.00 0.00 C ATOM 838 O ASP A 56 -30.370 42.014 10.682 1.00 0.00 O ATOM 839 CB ASP A 56 -28.260 43.672 9.389 1.00 0.00 C ATOM 840 CG ASP A 56 -27.893 44.608 10.542 1.00 0.00 C ATOM 841 OD1 ASP A 56 -27.588 44.108 11.612 1.00 0.00 O ATOM 842 OD2 ASP A 56 -27.921 45.810 10.335 1.00 0.00 O ATOM 0 H ASP A 56 -28.296 41.922 7.739 1.00 0.00 H new ATOM 0 HA ASP A 56 -27.156 42.015 10.299 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -27.607 43.855 8.536 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -29.280 43.868 9.058 1.00 0.00 H new ATOM 847 N ALA A 57 -28.757 41.491 12.081 1.00 0.00 N ATOM 848 CA ALA A 57 -29.733 41.161 13.160 1.00 0.00 C ATOM 849 C ALA A 57 -29.663 42.207 14.282 1.00 0.00 C ATOM 850 O ALA A 57 -29.797 41.888 15.447 1.00 0.00 O ATOM 851 CB ALA A 57 -29.302 39.790 13.676 1.00 0.00 C ATOM 0 H ALA A 57 -27.776 41.375 12.333 1.00 0.00 H new ATOM 0 HA ALA A 57 -30.761 41.156 12.798 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -29.973 39.475 14.475 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -29.342 39.066 12.862 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -28.283 39.849 14.059 1.00 0.00 H new ATOM 857 N ASP A 58 -29.456 43.449 13.940 1.00 0.00 N ATOM 858 CA ASP A 58 -29.380 44.510 14.990 1.00 0.00 C ATOM 859 C ASP A 58 -30.407 45.607 14.713 1.00 0.00 C ATOM 860 O ASP A 58 -31.186 45.977 15.570 1.00 0.00 O ATOM 861 CB ASP A 58 -27.966 45.082 14.882 1.00 0.00 C ATOM 862 CG ASP A 58 -26.971 44.134 15.549 1.00 0.00 C ATOM 863 OD1 ASP A 58 -27.330 43.540 16.553 1.00 0.00 O ATOM 864 OD2 ASP A 58 -25.863 44.028 15.052 1.00 0.00 O ATOM 0 H ASP A 58 -29.336 43.777 12.982 1.00 0.00 H new ATOM 0 HA ASP A 58 -29.590 44.112 15.983 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -27.701 45.224 13.834 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -27.923 46.062 15.357 1.00 0.00 H new ATOM 869 N GLY A 59 -30.405 46.138 13.526 1.00 0.00 N ATOM 870 CA GLY A 59 -31.369 47.220 13.189 1.00 0.00 C ATOM 871 C GLY A 59 -30.596 48.518 12.930 1.00 0.00 C ATOM 872 O GLY A 59 -31.157 49.596 12.922 1.00 0.00 O ATOM 0 H GLY A 59 -29.775 45.869 12.770 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -31.949 46.946 12.308 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -32.077 47.361 14.006 1.00 0.00 H new ATOM 876 N ASN A 60 -29.309 48.421 12.717 1.00 0.00 N ATOM 877 CA ASN A 60 -28.498 49.648 12.457 1.00 0.00 C ATOM 878 C ASN A 60 -28.382 49.890 10.950 1.00 0.00 C ATOM 879 O ASN A 60 -28.113 50.989 10.506 1.00 0.00 O ATOM 880 CB ASN A 60 -27.121 49.360 13.065 1.00 0.00 C ATOM 881 CG ASN A 60 -26.574 48.043 12.508 1.00 0.00 C ATOM 882 OD1 ASN A 60 -26.669 47.784 11.328 1.00 0.00 O ATOM 883 ND2 ASN A 60 -26.004 47.193 13.316 1.00 0.00 N ATOM 0 H ASN A 60 -28.785 47.546 12.712 1.00 0.00 H new ATOM 0 HA ASN A 60 -28.950 50.540 12.891 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.435 50.175 12.836 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -27.197 49.303 14.151 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.639 46.312 12.955 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -25.923 47.409 14.310 1.00 0.00 H new ATOM 890 N GLY A 61 -28.587 48.871 10.158 1.00 0.00 N ATOM 891 CA GLY A 61 -28.495 49.046 8.681 1.00 0.00 C ATOM 892 C GLY A 61 -27.250 48.331 8.150 1.00 0.00 C ATOM 893 O GLY A 61 -27.297 47.646 7.149 1.00 0.00 O ATOM 0 H GLY A 61 -28.814 47.927 10.470 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -29.388 48.645 8.202 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -28.450 50.107 8.433 1.00 0.00 H new ATOM 897 N THR A 62 -26.134 48.486 8.809 1.00 0.00 N ATOM 898 CA THR A 62 -24.889 47.816 8.332 1.00 0.00 C ATOM 899 C THR A 62 -24.637 46.524 9.119 1.00 0.00 C ATOM 900 O THR A 62 -25.220 46.294 10.160 1.00 0.00 O ATOM 901 CB THR A 62 -23.774 48.827 8.590 1.00 0.00 C ATOM 902 OG1 THR A 62 -23.748 49.160 9.972 1.00 0.00 O ATOM 903 CG2 THR A 62 -24.028 50.088 7.765 1.00 0.00 C ATOM 0 H THR A 62 -26.030 49.046 9.655 1.00 0.00 H new ATOM 0 HA THR A 62 -24.952 47.534 7.281 1.00 0.00 H new ATOM 0 HB THR A 62 -22.816 48.394 8.303 1.00 0.00 H new ATOM 0 HG1 THR A 62 -23.032 49.808 10.139 1.00 0.00 H new ATOM 0 HG21 THR A 62 -23.232 50.810 7.949 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.048 49.832 6.706 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.986 50.523 8.051 1.00 0.00 H new ATOM 911 N ILE A 63 -23.772 45.679 8.629 1.00 0.00 N ATOM 912 CA ILE A 63 -23.480 44.404 9.348 1.00 0.00 C ATOM 913 C ILE A 63 -22.154 44.518 10.106 1.00 0.00 C ATOM 914 O ILE A 63 -21.323 45.351 9.796 1.00 0.00 O ATOM 915 CB ILE A 63 -23.388 43.344 8.252 1.00 0.00 C ATOM 916 CG1 ILE A 63 -24.735 43.243 7.533 1.00 0.00 C ATOM 917 CG2 ILE A 63 -23.043 41.992 8.878 1.00 0.00 C ATOM 918 CD1 ILE A 63 -24.576 42.405 6.264 1.00 0.00 C ATOM 0 H ILE A 63 -23.254 45.815 7.761 1.00 0.00 H new ATOM 0 HA ILE A 63 -24.244 44.158 10.085 1.00 0.00 H new ATOM 0 HB ILE A 63 -22.612 43.622 7.539 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -25.477 42.789 8.190 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -25.100 44.239 7.280 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -22.977 41.235 8.096 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -22.086 42.064 9.395 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -23.820 41.712 9.590 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -25.536 42.334 5.753 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -23.848 42.878 5.605 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -24.231 41.406 6.529 1.00 0.00 H new ATOM 930 N ASP A 64 -21.955 43.697 11.102 1.00 0.00 N ATOM 931 CA ASP A 64 -20.685 43.769 11.885 1.00 0.00 C ATOM 932 C ASP A 64 -19.845 42.504 11.677 1.00 0.00 C ATOM 933 O ASP A 64 -20.110 41.706 10.800 1.00 0.00 O ATOM 934 CB ASP A 64 -21.131 43.879 13.342 1.00 0.00 C ATOM 935 CG ASP A 64 -22.005 45.123 13.516 1.00 0.00 C ATOM 936 OD1 ASP A 64 -22.147 45.863 12.556 1.00 0.00 O ATOM 937 OD2 ASP A 64 -22.517 45.314 14.607 1.00 0.00 O ATOM 0 H ASP A 64 -22.614 42.981 11.408 1.00 0.00 H new ATOM 0 HA ASP A 64 -20.062 44.609 11.577 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -21.687 42.987 13.631 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -20.261 43.938 13.996 1.00 0.00 H new ATOM 942 N PHE A 65 -18.833 42.320 12.482 1.00 0.00 N ATOM 943 CA PHE A 65 -17.969 41.115 12.343 1.00 0.00 C ATOM 944 C PHE A 65 -18.661 39.859 12.913 1.00 0.00 C ATOM 945 O PHE A 65 -18.600 38.806 12.307 1.00 0.00 O ATOM 946 CB PHE A 65 -16.706 41.432 13.139 1.00 0.00 C ATOM 947 CG PHE A 65 -15.644 40.407 12.820 1.00 0.00 C ATOM 948 CD1 PHE A 65 -14.759 40.618 11.735 1.00 0.00 C ATOM 949 CD2 PHE A 65 -15.532 39.235 13.606 1.00 0.00 C ATOM 950 CE1 PHE A 65 -13.763 39.658 11.437 1.00 0.00 C ATOM 951 CE2 PHE A 65 -14.537 38.276 13.307 1.00 0.00 C ATOM 952 CZ PHE A 65 -13.652 38.487 12.223 1.00 0.00 C ATOM 0 H PHE A 65 -18.567 42.957 13.233 1.00 0.00 H new ATOM 0 HA PHE A 65 -17.755 40.899 11.296 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -16.348 42.432 12.892 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -16.924 41.426 14.207 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -14.844 41.512 11.135 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -16.206 39.073 14.434 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -13.088 39.819 10.610 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -14.452 37.382 13.906 1.00 0.00 H new ATOM 0 HZ PHE A 65 -12.892 37.754 11.996 1.00 0.00 H new ATOM 962 N PRO A 66 -19.297 39.992 14.068 1.00 0.00 N ATOM 963 CA PRO A 66 -19.971 38.828 14.671 1.00 0.00 C ATOM 964 C PRO A 66 -21.239 38.484 13.888 1.00 0.00 C ATOM 965 O PRO A 66 -21.675 37.358 13.870 1.00 0.00 O ATOM 966 CB PRO A 66 -20.296 39.279 16.090 1.00 0.00 C ATOM 967 CG PRO A 66 -20.355 40.772 16.024 1.00 0.00 C ATOM 968 CD PRO A 66 -19.447 41.206 14.894 1.00 0.00 C ATOM 0 HA PRO A 66 -19.358 37.927 14.660 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -21.245 38.862 16.428 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -19.533 38.946 16.793 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.376 41.109 15.848 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -20.032 41.212 16.968 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -19.884 42.025 14.323 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -18.485 41.556 15.268 1.00 0.00 H new ATOM 976 N GLU A 67 -21.824 39.442 13.225 1.00 0.00 N ATOM 977 CA GLU A 67 -23.051 39.152 12.431 1.00 0.00 C ATOM 978 C GLU A 67 -22.657 38.488 11.117 1.00 0.00 C ATOM 979 O GLU A 67 -23.433 37.781 10.505 1.00 0.00 O ATOM 980 CB GLU A 67 -23.691 40.513 12.166 1.00 0.00 C ATOM 981 CG GLU A 67 -24.331 41.039 13.449 1.00 0.00 C ATOM 982 CD GLU A 67 -25.004 42.383 13.164 1.00 0.00 C ATOM 983 OE1 GLU A 67 -24.298 43.315 12.814 1.00 0.00 O ATOM 984 OE2 GLU A 67 -26.215 42.457 13.296 1.00 0.00 O ATOM 0 H GLU A 67 -21.507 40.411 13.198 1.00 0.00 H new ATOM 0 HA GLU A 67 -23.735 38.481 12.950 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -22.939 41.216 11.809 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -24.443 40.426 11.382 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -25.064 40.324 13.823 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -23.575 41.155 14.225 1.00 0.00 H new ATOM 991 N PHE A 68 -21.452 38.717 10.678 1.00 0.00 N ATOM 992 CA PHE A 68 -20.995 38.110 9.403 1.00 0.00 C ATOM 993 C PHE A 68 -20.624 36.638 9.613 1.00 0.00 C ATOM 994 O PHE A 68 -21.077 35.764 8.899 1.00 0.00 O ATOM 995 CB PHE A 68 -19.764 38.913 9.007 1.00 0.00 C ATOM 996 CG PHE A 68 -19.329 38.510 7.623 1.00 0.00 C ATOM 997 CD1 PHE A 68 -19.875 39.162 6.495 1.00 0.00 C ATOM 998 CD2 PHE A 68 -18.371 37.482 7.455 1.00 0.00 C ATOM 999 CE1 PHE A 68 -19.464 38.788 5.193 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -17.961 37.107 6.154 1.00 0.00 C ATOM 1001 CZ PHE A 68 -18.508 37.759 5.023 1.00 0.00 C ATOM 0 H PHE A 68 -20.763 39.301 11.151 1.00 0.00 H new ATOM 0 HA PHE A 68 -21.769 38.135 8.636 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -19.988 39.979 9.034 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.957 38.738 9.719 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -20.606 39.946 6.626 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.954 36.985 8.318 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -19.880 39.288 4.330 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -17.230 36.323 6.024 1.00 0.00 H new ATOM 0 HZ PHE A 68 -18.196 37.471 4.030 1.00 0.00 H new ATOM 1011 N LEU A 69 -19.794 36.359 10.581 1.00 0.00 N ATOM 1012 CA LEU A 69 -19.383 34.946 10.830 1.00 0.00 C ATOM 1013 C LEU A 69 -20.513 34.164 11.510 1.00 0.00 C ATOM 1014 O LEU A 69 -20.538 32.952 11.483 1.00 0.00 O ATOM 1015 CB LEU A 69 -18.165 35.044 11.752 1.00 0.00 C ATOM 1016 CG LEU A 69 -17.307 33.787 11.597 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -15.852 34.118 11.929 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -17.809 32.702 12.551 1.00 0.00 C ATOM 0 H LEU A 69 -19.382 37.048 11.211 1.00 0.00 H new ATOM 0 HA LEU A 69 -19.155 34.418 9.904 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.579 35.930 11.506 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.487 35.152 12.788 1.00 0.00 H new ATOM 0 HG LEU A 69 -17.375 33.429 10.570 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -15.241 33.222 11.819 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -15.490 34.890 11.250 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -15.786 34.478 12.956 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.197 31.807 12.439 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -17.742 33.061 13.578 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.846 32.463 12.317 1.00 0.00 H new ATOM 1030 N THR A 70 -21.445 34.845 12.125 1.00 0.00 N ATOM 1031 CA THR A 70 -22.564 34.122 12.806 1.00 0.00 C ATOM 1032 C THR A 70 -23.649 33.737 11.794 1.00 0.00 C ATOM 1033 O THR A 70 -24.075 32.601 11.733 1.00 0.00 O ATOM 1034 CB THR A 70 -23.115 35.112 13.839 1.00 0.00 C ATOM 1035 OG1 THR A 70 -22.168 35.271 14.886 1.00 0.00 O ATOM 1036 CG2 THR A 70 -24.428 34.582 14.417 1.00 0.00 C ATOM 0 H THR A 70 -21.481 35.863 12.186 1.00 0.00 H new ATOM 0 HA THR A 70 -22.227 33.196 13.272 1.00 0.00 H new ATOM 0 HB THR A 70 -23.298 36.073 13.358 1.00 0.00 H new ATOM 0 HG1 THR A 70 -21.511 35.952 14.632 1.00 0.00 H new ATOM 0 HG21 THR A 70 -24.815 35.290 15.150 1.00 0.00 H new ATOM 0 HG22 THR A 70 -25.155 34.458 13.614 1.00 0.00 H new ATOM 0 HG23 THR A 70 -24.252 33.620 14.899 1.00 0.00 H new ATOM 1044 N MET A 71 -24.105 34.671 11.005 1.00 0.00 N ATOM 1045 CA MET A 71 -25.167 34.341 10.010 1.00 0.00 C ATOM 1046 C MET A 71 -24.591 33.427 8.914 1.00 0.00 C ATOM 1047 O MET A 71 -25.288 32.616 8.338 1.00 0.00 O ATOM 1048 CB MET A 71 -25.628 35.703 9.444 1.00 0.00 C ATOM 1049 CG MET A 71 -24.677 36.188 8.341 1.00 0.00 C ATOM 1050 SD MET A 71 -25.204 35.495 6.752 1.00 0.00 S ATOM 1051 CE MET A 71 -24.595 36.837 5.707 1.00 0.00 C ATOM 0 H MET A 71 -23.792 35.642 11.005 1.00 0.00 H new ATOM 0 HA MET A 71 -26.005 33.800 10.448 1.00 0.00 H new ATOM 0 HB2 MET A 71 -26.638 35.612 9.045 1.00 0.00 H new ATOM 0 HB3 MET A 71 -25.667 36.440 10.246 1.00 0.00 H new ATOM 0 HG2 MET A 71 -24.680 37.277 8.295 1.00 0.00 H new ATOM 0 HG3 MET A 71 -23.655 35.881 8.564 1.00 0.00 H new ATOM 0 HE1 MET A 71 -24.369 36.450 4.713 1.00 0.00 H new ATOM 0 HE2 MET A 71 -25.357 37.613 5.630 1.00 0.00 H new ATOM 0 HE3 MET A 71 -23.691 37.259 6.146 1.00 0.00 H new ATOM 1061 N MET A 72 -23.320 33.551 8.631 1.00 0.00 N ATOM 1062 CA MET A 72 -22.699 32.688 7.584 1.00 0.00 C ATOM 1063 C MET A 72 -22.237 31.357 8.199 1.00 0.00 C ATOM 1064 O MET A 72 -21.911 30.420 7.499 1.00 0.00 O ATOM 1065 CB MET A 72 -21.493 33.481 7.073 1.00 0.00 C ATOM 1066 CG MET A 72 -21.968 34.689 6.261 1.00 0.00 C ATOM 1067 SD MET A 72 -20.534 35.515 5.522 1.00 0.00 S ATOM 1068 CE MET A 72 -21.444 36.655 4.449 1.00 0.00 C ATOM 0 H MET A 72 -22.686 34.212 9.080 1.00 0.00 H new ATOM 0 HA MET A 72 -23.399 32.448 6.784 1.00 0.00 H new ATOM 0 HB2 MET A 72 -20.883 33.814 7.913 1.00 0.00 H new ATOM 0 HB3 MET A 72 -20.862 32.842 6.455 1.00 0.00 H new ATOM 0 HG2 MET A 72 -22.659 34.369 5.482 1.00 0.00 H new ATOM 0 HG3 MET A 72 -22.511 35.383 6.903 1.00 0.00 H new ATOM 0 HE1 MET A 72 -20.787 37.009 3.654 1.00 0.00 H new ATOM 0 HE2 MET A 72 -22.298 36.139 4.011 1.00 0.00 H new ATOM 0 HE3 MET A 72 -21.795 37.505 5.035 1.00 0.00 H new ATOM 1078 N ALA A 73 -22.200 31.274 9.503 1.00 0.00 N ATOM 1079 CA ALA A 73 -21.751 30.009 10.158 1.00 0.00 C ATOM 1080 C ALA A 73 -22.844 28.936 10.068 1.00 0.00 C ATOM 1081 O ALA A 73 -22.567 27.754 10.100 1.00 0.00 O ATOM 1082 CB ALA A 73 -21.498 30.392 11.616 1.00 0.00 C ATOM 0 H ALA A 73 -22.460 32.025 10.142 1.00 0.00 H new ATOM 0 HA ALA A 73 -20.864 29.592 9.680 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -21.163 29.515 12.170 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -20.730 31.164 11.661 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -22.420 30.770 12.058 1.00 0.00 H new ATOM 1252 N GLU A 84 -34.886 5.120 -8.059 1.00 0.00 N ATOM 1253 CA GLU A 84 -35.758 3.960 -8.422 1.00 0.00 C ATOM 1254 C GLU A 84 -34.927 2.860 -9.099 1.00 0.00 C ATOM 1255 O GLU A 84 -34.692 1.805 -8.535 1.00 0.00 O ATOM 1256 CB GLU A 84 -36.792 4.530 -9.396 1.00 0.00 C ATOM 1257 CG GLU A 84 -37.498 5.726 -8.752 1.00 0.00 C ATOM 1258 CD GLU A 84 -38.208 6.543 -9.834 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -37.532 6.994 -10.745 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -39.412 6.705 -9.733 1.00 0.00 O ATOM 0 HA GLU A 84 -36.228 3.508 -7.548 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -36.305 4.837 -10.321 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -37.520 3.763 -9.659 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -38.219 5.380 -8.011 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -36.774 6.349 -8.227 1.00 0.00 H new ATOM 1267 N ILE A 85 -34.477 3.096 -10.304 1.00 0.00 N ATOM 1268 CA ILE A 85 -33.664 2.064 -11.003 1.00 0.00 C ATOM 1269 C ILE A 85 -32.419 1.742 -10.177 1.00 0.00 C ATOM 1270 O ILE A 85 -31.955 0.622 -10.151 1.00 0.00 O ATOM 1271 CB ILE A 85 -33.286 2.692 -12.345 1.00 0.00 C ATOM 1272 CG1 ILE A 85 -34.558 2.907 -13.175 1.00 0.00 C ATOM 1273 CG2 ILE A 85 -32.335 1.757 -13.105 1.00 0.00 C ATOM 1274 CD1 ILE A 85 -34.185 3.400 -14.575 1.00 0.00 C ATOM 0 H ILE A 85 -34.638 3.955 -10.830 1.00 0.00 H new ATOM 0 HA ILE A 85 -34.204 1.128 -11.142 1.00 0.00 H new ATOM 0 HB ILE A 85 -32.790 3.647 -12.173 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -35.120 1.975 -13.245 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -35.205 3.633 -12.684 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -32.068 2.208 -14.061 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -31.433 1.597 -12.514 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -32.828 0.801 -13.280 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -35.092 3.551 -15.161 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -33.642 4.342 -14.496 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -33.555 2.658 -15.066 1.00 0.00 H new ATOM 1286 N ARG A 86 -31.882 2.714 -9.491 1.00 0.00 N ATOM 1287 CA ARG A 86 -30.677 2.450 -8.658 1.00 0.00 C ATOM 1288 C ARG A 86 -30.968 1.296 -7.693 1.00 0.00 C ATOM 1289 O ARG A 86 -30.173 0.393 -7.525 1.00 0.00 O ATOM 1290 CB ARG A 86 -30.436 3.746 -7.886 1.00 0.00 C ATOM 1291 CG ARG A 86 -29.117 3.649 -7.116 1.00 0.00 C ATOM 1292 CD ARG A 86 -28.982 4.852 -6.178 1.00 0.00 C ATOM 1293 NE ARG A 86 -29.441 4.357 -4.852 1.00 0.00 N ATOM 1294 CZ ARG A 86 -29.367 5.134 -3.804 1.00 0.00 C ATOM 1295 NH1 ARG A 86 -28.429 6.036 -3.728 1.00 0.00 N ATOM 1296 NH2 ARG A 86 -30.233 5.008 -2.835 1.00 0.00 N ATOM 0 H ARG A 86 -32.224 3.675 -9.472 1.00 0.00 H new ATOM 0 HA ARG A 86 -29.808 2.169 -9.252 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -30.405 4.591 -8.574 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -31.259 3.928 -7.195 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -29.086 2.722 -6.543 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -28.279 3.622 -7.812 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -27.951 5.204 -6.133 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -29.591 5.689 -6.519 1.00 0.00 H new ATOM 0 HE ARG A 86 -29.813 3.412 -4.761 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -27.754 6.135 -4.486 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -28.370 6.643 -2.910 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -30.968 4.303 -2.896 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -30.175 5.615 -2.017 1.00 0.00 H new ATOM 1310 N GLU A 87 -32.114 1.319 -7.062 1.00 0.00 N ATOM 1311 CA GLU A 87 -32.471 0.223 -6.112 1.00 0.00 C ATOM 1312 C GLU A 87 -32.610 -1.099 -6.865 1.00 0.00 C ATOM 1313 O GLU A 87 -32.262 -2.149 -6.366 1.00 0.00 O ATOM 1314 CB GLU A 87 -33.818 0.635 -5.520 1.00 0.00 C ATOM 1315 CG GLU A 87 -33.656 1.934 -4.726 1.00 0.00 C ATOM 1316 CD GLU A 87 -32.901 1.647 -3.428 1.00 0.00 C ATOM 1317 OE1 GLU A 87 -31.737 1.291 -3.507 1.00 0.00 O ATOM 1318 OE2 GLU A 87 -33.501 1.788 -2.374 1.00 0.00 O ATOM 0 H GLU A 87 -32.818 2.050 -7.164 1.00 0.00 H new ATOM 0 HA GLU A 87 -31.711 0.080 -5.344 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -34.549 0.773 -6.316 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -34.198 -0.154 -4.871 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -33.114 2.670 -5.319 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -34.634 2.361 -4.504 1.00 0.00 H new ATOM 1325 N ALA A 88 -33.123 -1.055 -8.060 1.00 0.00 N ATOM 1326 CA ALA A 88 -33.289 -2.308 -8.848 1.00 0.00 C ATOM 1327 C ALA A 88 -31.931 -2.974 -9.078 1.00 0.00 C ATOM 1328 O ALA A 88 -31.689 -4.084 -8.649 1.00 0.00 O ATOM 1329 CB ALA A 88 -33.893 -1.854 -10.173 1.00 0.00 C ATOM 0 H ALA A 88 -33.436 -0.204 -8.528 1.00 0.00 H new ATOM 0 HA ALA A 88 -33.916 -3.040 -8.339 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -34.049 -2.719 -10.817 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -34.848 -1.363 -9.988 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -33.214 -1.155 -10.662 1.00 0.00 H new ATOM 1335 N PHE A 89 -31.048 -2.301 -9.757 1.00 0.00 N ATOM 1336 CA PHE A 89 -29.701 -2.884 -10.028 1.00 0.00 C ATOM 1337 C PHE A 89 -29.021 -3.299 -8.718 1.00 0.00 C ATOM 1338 O PHE A 89 -28.207 -4.202 -8.687 1.00 0.00 O ATOM 1339 CB PHE A 89 -28.923 -1.754 -10.700 1.00 0.00 C ATOM 1340 CG PHE A 89 -28.084 -2.311 -11.824 1.00 0.00 C ATOM 1341 CD1 PHE A 89 -28.669 -2.554 -13.089 1.00 0.00 C ATOM 1342 CD2 PHE A 89 -26.712 -2.587 -11.615 1.00 0.00 C ATOM 1343 CE1 PHE A 89 -27.882 -3.074 -14.144 1.00 0.00 C ATOM 1344 CE2 PHE A 89 -25.926 -3.107 -12.671 1.00 0.00 C ATOM 1345 CZ PHE A 89 -26.512 -3.350 -13.935 1.00 0.00 C ATOM 0 H PHE A 89 -31.199 -1.367 -10.139 1.00 0.00 H new ATOM 0 HA PHE A 89 -29.753 -3.779 -10.648 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -29.613 -1.004 -11.086 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -28.285 -1.255 -9.970 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -29.716 -2.343 -13.250 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -26.265 -2.401 -10.650 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -28.329 -3.260 -15.109 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -24.879 -3.318 -12.512 1.00 0.00 H new ATOM 0 HZ PHE A 89 -25.912 -3.747 -14.741 1.00 0.00 H new ATOM 1355 N ARG A 90 -29.342 -2.643 -7.638 1.00 0.00 N ATOM 1356 CA ARG A 90 -28.706 -2.993 -6.335 1.00 0.00 C ATOM 1357 C ARG A 90 -29.175 -4.375 -5.851 1.00 0.00 C ATOM 1358 O ARG A 90 -28.381 -5.204 -5.455 1.00 0.00 O ATOM 1359 CB ARG A 90 -29.162 -1.901 -5.368 1.00 0.00 C ATOM 1360 CG ARG A 90 -28.237 -1.886 -4.152 1.00 0.00 C ATOM 1361 CD ARG A 90 -29.072 -1.818 -2.870 1.00 0.00 C ATOM 1362 NE ARG A 90 -28.100 -2.055 -1.766 1.00 0.00 N ATOM 1363 CZ ARG A 90 -27.422 -3.173 -1.720 1.00 0.00 C ATOM 1364 NH1 ARG A 90 -28.047 -4.317 -1.764 1.00 0.00 N ATOM 1365 NH2 ARG A 90 -26.119 -3.143 -1.633 1.00 0.00 N ATOM 0 H ARG A 90 -30.017 -1.879 -7.600 1.00 0.00 H new ATOM 0 HA ARG A 90 -27.620 -3.046 -6.413 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -29.146 -0.930 -5.864 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -30.190 -2.082 -5.055 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -27.615 -2.781 -4.145 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -27.564 -1.030 -4.205 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -29.559 -0.848 -2.766 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -29.860 -2.571 -2.871 1.00 0.00 H new ATOM 0 HE ARG A 90 -27.963 -1.346 -1.046 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -29.064 -4.340 -1.834 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -27.518 -5.189 -1.728 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -25.630 -2.248 -1.601 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -25.590 -4.014 -1.597 1.00 0.00 H new ATOM 1379 N VAL A 91 -30.457 -4.627 -5.876 1.00 0.00 N ATOM 1380 CA VAL A 91 -30.964 -5.954 -5.411 1.00 0.00 C ATOM 1381 C VAL A 91 -30.557 -7.059 -6.395 1.00 0.00 C ATOM 1382 O VAL A 91 -30.461 -8.216 -6.035 1.00 0.00 O ATOM 1383 CB VAL A 91 -32.483 -5.805 -5.369 1.00 0.00 C ATOM 1384 CG1 VAL A 91 -32.866 -4.754 -4.327 1.00 0.00 C ATOM 1385 CG2 VAL A 91 -32.991 -5.365 -6.744 1.00 0.00 C ATOM 0 H VAL A 91 -31.173 -3.975 -6.197 1.00 0.00 H new ATOM 0 HA VAL A 91 -30.554 -6.233 -4.440 1.00 0.00 H new ATOM 0 HB VAL A 91 -32.933 -6.762 -5.103 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -33.951 -4.649 -4.298 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -32.505 -5.065 -3.347 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -32.416 -3.798 -4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -34.075 -5.259 -6.714 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -32.540 -4.409 -7.010 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -32.720 -6.114 -7.489 1.00 0.00 H new ATOM 1395 N PHE A 92 -30.320 -6.713 -7.630 1.00 0.00 N ATOM 1396 CA PHE A 92 -29.923 -7.748 -8.633 1.00 0.00 C ATOM 1397 C PHE A 92 -28.407 -7.968 -8.596 1.00 0.00 C ATOM 1398 O PHE A 92 -27.903 -8.958 -9.089 1.00 0.00 O ATOM 1399 CB PHE A 92 -30.355 -7.176 -9.986 1.00 0.00 C ATOM 1400 CG PHE A 92 -31.819 -6.786 -9.931 1.00 0.00 C ATOM 1401 CD1 PHE A 92 -32.727 -7.537 -9.142 1.00 0.00 C ATOM 1402 CD2 PHE A 92 -32.282 -5.672 -10.672 1.00 0.00 C ATOM 1403 CE1 PHE A 92 -34.092 -7.172 -9.092 1.00 0.00 C ATOM 1404 CE2 PHE A 92 -33.649 -5.307 -10.621 1.00 0.00 C ATOM 1405 CZ PHE A 92 -34.552 -6.058 -9.832 1.00 0.00 C ATOM 0 H PHE A 92 -30.383 -5.761 -7.990 1.00 0.00 H new ATOM 0 HA PHE A 92 -30.386 -8.715 -8.435 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -29.746 -6.307 -10.236 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -30.194 -7.914 -10.772 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -32.375 -8.389 -8.579 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -31.593 -5.101 -11.276 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -34.783 -7.743 -8.489 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -34.002 -4.456 -11.184 1.00 0.00 H new ATOM 0 HZ PHE A 92 -35.595 -5.780 -9.795 1.00 0.00 H new ATOM 1415 N ASP A 93 -27.679 -7.057 -8.012 1.00 0.00 N ATOM 1416 CA ASP A 93 -26.196 -7.218 -7.941 1.00 0.00 C ATOM 1417 C ASP A 93 -25.763 -7.520 -6.500 1.00 0.00 C ATOM 1418 O ASP A 93 -25.610 -6.629 -5.690 1.00 0.00 O ATOM 1419 CB ASP A 93 -25.633 -5.873 -8.395 1.00 0.00 C ATOM 1420 CG ASP A 93 -24.116 -5.977 -8.536 1.00 0.00 C ATOM 1421 OD1 ASP A 93 -23.609 -7.085 -8.474 1.00 0.00 O ATOM 1422 OD2 ASP A 93 -23.486 -4.947 -8.707 1.00 0.00 O ATOM 0 H ASP A 93 -28.045 -6.208 -7.581 1.00 0.00 H new ATOM 0 HA ASP A 93 -25.840 -8.042 -8.559 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -26.078 -5.583 -9.347 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -25.889 -5.097 -7.674 1.00 0.00 H new ATOM 1427 N LYS A 94 -25.568 -8.770 -6.177 1.00 0.00 N ATOM 1428 CA LYS A 94 -25.148 -9.124 -4.792 1.00 0.00 C ATOM 1429 C LYS A 94 -23.652 -9.463 -4.753 1.00 0.00 C ATOM 1430 O LYS A 94 -23.155 -9.994 -3.780 1.00 0.00 O ATOM 1431 CB LYS A 94 -25.983 -10.353 -4.427 1.00 0.00 C ATOM 1432 CG LYS A 94 -27.467 -9.977 -4.390 1.00 0.00 C ATOM 1433 CD LYS A 94 -28.289 -11.176 -3.903 1.00 0.00 C ATOM 1434 CE LYS A 94 -28.773 -10.924 -2.471 1.00 0.00 C ATOM 1435 NZ LYS A 94 -27.678 -11.433 -1.596 1.00 0.00 N ATOM 0 H LYS A 94 -25.681 -9.560 -6.812 1.00 0.00 H new ATOM 0 HA LYS A 94 -25.302 -8.300 -4.095 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -25.817 -11.147 -5.156 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -25.672 -10.741 -3.457 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -27.620 -9.125 -3.728 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -27.801 -9.673 -5.382 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -29.142 -11.336 -4.562 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -27.684 -12.082 -3.938 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -28.956 -9.864 -2.297 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -29.710 -11.445 -2.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -28.079 -12.051 -0.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -26.998 -11.973 -2.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -27.192 -10.631 -1.146 1.00 0.00 H new ATOM 1449 N ASP A 95 -22.929 -9.167 -5.801 1.00 0.00 N ATOM 1450 CA ASP A 95 -21.468 -9.484 -5.807 1.00 0.00 C ATOM 1451 C ASP A 95 -20.637 -8.193 -5.902 1.00 0.00 C ATOM 1452 O ASP A 95 -19.633 -8.040 -5.231 1.00 0.00 O ATOM 1453 CB ASP A 95 -21.260 -10.371 -7.045 1.00 0.00 C ATOM 1454 CG ASP A 95 -21.356 -9.526 -8.316 1.00 0.00 C ATOM 1455 OD1 ASP A 95 -20.424 -8.787 -8.580 1.00 0.00 O ATOM 1456 OD2 ASP A 95 -22.359 -9.631 -9.002 1.00 0.00 O ATOM 0 H ASP A 95 -23.283 -8.722 -6.648 1.00 0.00 H new ATOM 0 HA ASP A 95 -21.149 -9.986 -4.894 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -20.286 -10.857 -6.995 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -22.010 -11.161 -7.066 1.00 0.00 H new ATOM 1461 N GLY A 96 -21.049 -7.264 -6.725 1.00 0.00 N ATOM 1462 CA GLY A 96 -20.285 -5.989 -6.854 1.00 0.00 C ATOM 1463 C GLY A 96 -19.633 -5.901 -8.242 1.00 0.00 C ATOM 1464 O GLY A 96 -18.536 -5.399 -8.388 1.00 0.00 O ATOM 0 H GLY A 96 -21.880 -7.333 -7.312 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -20.952 -5.140 -6.703 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -19.519 -5.935 -6.080 1.00 0.00 H new ATOM 1468 N ASN A 97 -20.297 -6.377 -9.265 1.00 0.00 N ATOM 1469 CA ASN A 97 -19.698 -6.304 -10.640 1.00 0.00 C ATOM 1470 C ASN A 97 -20.558 -5.426 -11.566 1.00 0.00 C ATOM 1471 O ASN A 97 -20.159 -5.089 -12.662 1.00 0.00 O ATOM 1472 CB ASN A 97 -19.651 -7.751 -11.147 1.00 0.00 C ATOM 1473 CG ASN A 97 -21.045 -8.379 -11.091 1.00 0.00 C ATOM 1474 OD1 ASN A 97 -22.019 -7.705 -10.845 1.00 0.00 O ATOM 1475 ND2 ASN A 97 -21.177 -9.656 -11.313 1.00 0.00 N ATOM 0 H ASN A 97 -21.219 -6.810 -9.213 1.00 0.00 H new ATOM 0 HA ASN A 97 -18.706 -5.853 -10.622 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -19.276 -7.773 -12.170 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -18.958 -8.334 -10.541 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -22.101 -10.087 -11.279 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -20.356 -10.225 -11.521 1.00 0.00 H new ATOM 1482 N GLY A 98 -21.728 -5.045 -11.128 1.00 0.00 N ATOM 1483 CA GLY A 98 -22.603 -4.176 -11.979 1.00 0.00 C ATOM 1484 C GLY A 98 -23.151 -4.973 -13.169 1.00 0.00 C ATOM 1485 O GLY A 98 -23.316 -4.450 -14.253 1.00 0.00 O ATOM 0 H GLY A 98 -22.118 -5.296 -10.220 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -23.428 -3.786 -11.383 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -22.035 -3.318 -12.338 1.00 0.00 H new ATOM 1489 N TYR A 99 -23.447 -6.229 -12.972 1.00 0.00 N ATOM 1490 CA TYR A 99 -23.997 -7.063 -14.089 1.00 0.00 C ATOM 1491 C TYR A 99 -25.096 -7.985 -13.551 1.00 0.00 C ATOM 1492 O TYR A 99 -24.956 -8.582 -12.503 1.00 0.00 O ATOM 1493 CB TYR A 99 -22.811 -7.894 -14.595 1.00 0.00 C ATOM 1494 CG TYR A 99 -21.696 -6.981 -15.053 1.00 0.00 C ATOM 1495 CD1 TYR A 99 -21.967 -5.925 -15.955 1.00 0.00 C ATOM 1496 CD2 TYR A 99 -20.378 -7.186 -14.579 1.00 0.00 C ATOM 1497 CE1 TYR A 99 -20.917 -5.074 -16.383 1.00 0.00 C ATOM 1498 CE2 TYR A 99 -19.331 -6.336 -15.008 1.00 0.00 C ATOM 1499 CZ TYR A 99 -19.601 -5.279 -15.908 1.00 0.00 C ATOM 1500 OH TYR A 99 -18.579 -4.449 -16.325 1.00 0.00 O ATOM 0 H TYR A 99 -23.333 -6.719 -12.084 1.00 0.00 H new ATOM 0 HA TYR A 99 -24.434 -6.456 -14.882 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -22.452 -8.550 -13.802 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -23.130 -8.533 -15.418 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -22.972 -5.768 -16.317 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -20.171 -7.991 -13.890 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -21.122 -4.268 -17.072 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -18.325 -6.495 -14.648 1.00 0.00 H new ATOM 0 HH TYR A 99 -17.739 -4.727 -15.903 1.00 0.00 H new ATOM 1510 N ILE A 100 -26.188 -8.113 -14.256 1.00 0.00 N ATOM 1511 CA ILE A 100 -27.281 -9.005 -13.764 1.00 0.00 C ATOM 1512 C ILE A 100 -27.103 -10.411 -14.343 1.00 0.00 C ATOM 1513 O ILE A 100 -27.112 -10.604 -15.544 1.00 0.00 O ATOM 1514 CB ILE A 100 -28.597 -8.389 -14.266 1.00 0.00 C ATOM 1515 CG1 ILE A 100 -28.585 -6.865 -14.071 1.00 0.00 C ATOM 1516 CG2 ILE A 100 -29.762 -8.984 -13.471 1.00 0.00 C ATOM 1517 CD1 ILE A 100 -29.769 -6.254 -14.820 1.00 0.00 C ATOM 0 H ILE A 100 -26.371 -7.644 -15.143 1.00 0.00 H new ATOM 0 HA ILE A 100 -27.272 -9.088 -12.677 1.00 0.00 H new ATOM 0 HB ILE A 100 -28.709 -8.610 -15.327 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -28.645 -6.621 -13.010 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -27.649 -6.446 -14.442 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -30.700 -8.552 -13.821 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -29.785 -10.065 -13.613 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -29.632 -8.760 -12.412 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -29.766 -5.172 -14.685 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -29.688 -6.488 -15.882 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -30.699 -6.666 -14.428 1.00 0.00 H new ATOM 1529 N SER A 101 -26.936 -11.395 -13.502 1.00 0.00 N ATOM 1530 CA SER A 101 -26.754 -12.787 -14.008 1.00 0.00 C ATOM 1531 C SER A 101 -27.991 -13.633 -13.688 1.00 0.00 C ATOM 1532 O SER A 101 -28.690 -13.389 -12.726 1.00 0.00 O ATOM 1533 CB SER A 101 -25.530 -13.321 -13.268 1.00 0.00 C ATOM 1534 OG SER A 101 -25.770 -13.270 -11.866 1.00 0.00 O ATOM 0 H SER A 101 -26.918 -11.296 -12.487 1.00 0.00 H new ATOM 0 HA SER A 101 -26.621 -12.819 -15.089 1.00 0.00 H new ATOM 0 HB2 SER A 101 -25.323 -14.346 -13.576 1.00 0.00 H new ATOM 0 HB3 SER A 101 -24.651 -12.728 -13.520 1.00 0.00 H new ATOM 0 HG SER A 101 -24.987 -13.614 -11.387 1.00 0.00 H new ATOM 1540 N ALA A 102 -28.266 -14.626 -14.489 1.00 0.00 N ATOM 1541 CA ALA A 102 -29.460 -15.487 -14.234 1.00 0.00 C ATOM 1542 C ALA A 102 -29.397 -16.085 -12.822 1.00 0.00 C ATOM 1543 O ALA A 102 -30.410 -16.353 -12.207 1.00 0.00 O ATOM 1544 CB ALA A 102 -29.379 -16.591 -15.287 1.00 0.00 C ATOM 0 H ALA A 102 -27.716 -14.880 -15.310 1.00 0.00 H new ATOM 0 HA ALA A 102 -30.393 -14.927 -14.297 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -30.224 -17.270 -15.168 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -29.407 -16.147 -16.282 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -28.448 -17.145 -15.163 1.00 0.00 H new ATOM 1550 N ALA A 103 -28.218 -16.297 -12.307 1.00 0.00 N ATOM 1551 CA ALA A 103 -28.096 -16.878 -10.937 1.00 0.00 C ATOM 1552 C ALA A 103 -28.715 -15.934 -9.905 1.00 0.00 C ATOM 1553 O ALA A 103 -29.552 -16.322 -9.112 1.00 0.00 O ATOM 1554 CB ALA A 103 -26.595 -17.016 -10.696 1.00 0.00 C ATOM 0 H ALA A 103 -27.334 -16.094 -12.773 1.00 0.00 H new ATOM 0 HA ALA A 103 -28.614 -17.833 -10.848 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -26.423 -17.438 -9.706 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -26.164 -17.674 -11.451 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -26.125 -16.035 -10.759 1.00 0.00 H new ATOM 1560 N GLU A 104 -28.306 -14.696 -9.905 1.00 0.00 N ATOM 1561 CA GLU A 104 -28.866 -13.729 -8.922 1.00 0.00 C ATOM 1562 C GLU A 104 -30.352 -13.482 -9.207 1.00 0.00 C ATOM 1563 O GLU A 104 -31.190 -13.664 -8.352 1.00 0.00 O ATOM 1564 CB GLU A 104 -28.052 -12.451 -9.116 1.00 0.00 C ATOM 1565 CG GLU A 104 -26.597 -12.712 -8.718 1.00 0.00 C ATOM 1566 CD GLU A 104 -25.741 -11.493 -9.065 1.00 0.00 C ATOM 1567 OE1 GLU A 104 -26.257 -10.597 -9.712 1.00 0.00 O ATOM 1568 OE2 GLU A 104 -24.583 -11.477 -8.680 1.00 0.00 O ATOM 0 H GLU A 104 -27.609 -14.313 -10.543 1.00 0.00 H new ATOM 0 HA GLU A 104 -28.803 -14.095 -7.897 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -28.104 -12.127 -10.156 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -28.468 -11.646 -8.510 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -26.534 -12.921 -7.650 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -26.220 -13.593 -9.238 1.00 0.00 H new ATOM 1575 N LEU A 105 -30.684 -13.072 -10.399 1.00 0.00 N ATOM 1576 CA LEU A 105 -32.119 -12.818 -10.728 1.00 0.00 C ATOM 1577 C LEU A 105 -32.970 -14.052 -10.394 1.00 0.00 C ATOM 1578 O LEU A 105 -34.154 -13.953 -10.142 1.00 0.00 O ATOM 1579 CB LEU A 105 -32.138 -12.541 -12.232 1.00 0.00 C ATOM 1580 CG LEU A 105 -33.583 -12.368 -12.702 1.00 0.00 C ATOM 1581 CD1 LEU A 105 -34.086 -10.977 -12.309 1.00 0.00 C ATOM 1582 CD2 LEU A 105 -33.647 -12.519 -14.225 1.00 0.00 C ATOM 0 H LEU A 105 -30.027 -12.901 -11.160 1.00 0.00 H new ATOM 0 HA LEU A 105 -32.532 -11.987 -10.156 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -31.562 -11.642 -12.454 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -31.666 -13.363 -12.770 1.00 0.00 H new ATOM 0 HG LEU A 105 -34.209 -13.128 -12.233 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -35.116 -10.854 -12.644 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -34.042 -10.867 -11.226 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -33.459 -10.218 -12.777 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -34.677 -12.396 -14.560 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -33.020 -11.760 -14.693 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -33.290 -13.509 -14.508 1.00 0.00 H new ATOM 1594 N ARG A 106 -32.372 -15.211 -10.391 1.00 0.00 N ATOM 1595 CA ARG A 106 -33.142 -16.451 -10.074 1.00 0.00 C ATOM 1596 C ARG A 106 -33.502 -16.488 -8.582 1.00 0.00 C ATOM 1597 O ARG A 106 -34.636 -16.709 -8.213 1.00 0.00 O ATOM 1598 CB ARG A 106 -32.194 -17.597 -10.427 1.00 0.00 C ATOM 1599 CG ARG A 106 -32.788 -18.926 -9.956 1.00 0.00 C ATOM 1600 CD ARG A 106 -31.796 -20.057 -10.243 1.00 0.00 C ATOM 1601 NE ARG A 106 -32.294 -21.218 -9.457 1.00 0.00 N ATOM 1602 CZ ARG A 106 -33.274 -21.945 -9.915 1.00 0.00 C ATOM 1603 NH1 ARG A 106 -34.510 -21.615 -9.656 1.00 0.00 N ATOM 1604 NH2 ARG A 106 -33.020 -23.003 -10.636 1.00 0.00 N ATOM 0 H ARG A 106 -31.383 -15.355 -10.594 1.00 0.00 H new ATOM 0 HA ARG A 106 -34.081 -16.510 -10.625 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -32.027 -17.624 -11.504 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -31.223 -17.436 -9.958 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -33.007 -18.881 -8.889 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -33.732 -19.117 -10.467 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -31.759 -20.288 -11.308 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -30.786 -19.781 -9.942 1.00 0.00 H new ATOM 0 HE ARG A 106 -31.868 -21.445 -8.559 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -34.710 -20.787 -9.095 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -35.276 -22.185 -10.015 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -32.055 -23.261 -10.841 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -33.787 -23.572 -10.994 1.00 0.00 H new ATOM 1618 N HIS A 107 -32.542 -16.274 -7.727 1.00 0.00 N ATOM 1619 CA HIS A 107 -32.823 -16.298 -6.259 1.00 0.00 C ATOM 1620 C HIS A 107 -33.455 -14.974 -5.803 1.00 0.00 C ATOM 1621 O HIS A 107 -33.911 -14.848 -4.683 1.00 0.00 O ATOM 1622 CB HIS A 107 -31.459 -16.493 -5.599 1.00 0.00 C ATOM 1623 CG HIS A 107 -31.200 -17.964 -5.406 1.00 0.00 C ATOM 1624 ND1 HIS A 107 -31.928 -18.731 -4.509 1.00 0.00 N ATOM 1625 CD2 HIS A 107 -30.299 -18.821 -5.988 1.00 0.00 C ATOM 1626 CE1 HIS A 107 -31.456 -19.990 -4.576 1.00 0.00 C ATOM 1627 NE2 HIS A 107 -30.462 -20.098 -5.461 1.00 0.00 N ATOM 0 H HIS A 107 -31.572 -16.083 -7.979 1.00 0.00 H new ATOM 0 HA HIS A 107 -33.527 -17.087 -5.993 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -30.677 -16.053 -6.219 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -31.431 -15.979 -4.638 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -29.574 -18.546 -6.740 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -31.835 -20.812 -3.986 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -29.935 -20.938 -5.700 1.00 0.00 H new ATOM 1635 N VAL A 108 -33.484 -13.987 -6.657 1.00 0.00 N ATOM 1636 CA VAL A 108 -34.085 -12.678 -6.262 1.00 0.00 C ATOM 1637 C VAL A 108 -35.602 -12.707 -6.452 1.00 0.00 C ATOM 1638 O VAL A 108 -36.349 -12.293 -5.594 1.00 0.00 O ATOM 1639 CB VAL A 108 -33.449 -11.652 -7.198 1.00 0.00 C ATOM 1640 CG1 VAL A 108 -34.080 -10.278 -6.959 1.00 0.00 C ATOM 1641 CG2 VAL A 108 -31.947 -11.575 -6.924 1.00 0.00 C ATOM 0 H VAL A 108 -33.119 -14.029 -7.609 1.00 0.00 H new ATOM 0 HA VAL A 108 -33.903 -12.444 -5.213 1.00 0.00 H new ATOM 0 HB VAL A 108 -33.617 -11.953 -8.232 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -33.625 -9.547 -7.628 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -35.151 -10.331 -7.154 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -33.914 -9.976 -5.925 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -31.492 -10.843 -7.592 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -31.781 -11.275 -5.889 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -31.495 -12.552 -7.095 1.00 0.00 H new ATOM 1651 N MET A 109 -36.065 -13.190 -7.570 1.00 0.00 N ATOM 1652 CA MET A 109 -37.537 -13.235 -7.806 1.00 0.00 C ATOM 1653 C MET A 109 -38.153 -14.463 -7.131 1.00 0.00 C ATOM 1654 O MET A 109 -39.280 -14.435 -6.679 1.00 0.00 O ATOM 1655 CB MET A 109 -37.691 -13.322 -9.322 1.00 0.00 C ATOM 1656 CG MET A 109 -37.284 -11.989 -9.952 1.00 0.00 C ATOM 1657 SD MET A 109 -37.770 -11.973 -11.694 1.00 0.00 S ATOM 1658 CE MET A 109 -37.968 -10.183 -11.856 1.00 0.00 C ATOM 0 H MET A 109 -35.491 -13.555 -8.330 1.00 0.00 H new ATOM 0 HA MET A 109 -38.045 -12.364 -7.392 1.00 0.00 H new ATOM 0 HB2 MET A 109 -37.071 -14.127 -9.716 1.00 0.00 H new ATOM 0 HB3 MET A 109 -38.723 -13.559 -9.581 1.00 0.00 H new ATOM 0 HG2 MET A 109 -37.760 -11.164 -9.423 1.00 0.00 H new ATOM 0 HG3 MET A 109 -36.207 -11.846 -9.862 1.00 0.00 H new ATOM 0 HE1 MET A 109 -38.767 -9.968 -12.566 1.00 0.00 H new ATOM 0 HE2 MET A 109 -38.220 -9.756 -10.886 1.00 0.00 H new ATOM 0 HE3 MET A 109 -37.037 -9.745 -12.214 1.00 0.00 H new ATOM 1668 N THR A 110 -37.425 -15.540 -7.062 1.00 0.00 N ATOM 1669 CA THR A 110 -37.974 -16.770 -6.418 1.00 0.00 C ATOM 1670 C THR A 110 -38.168 -16.543 -4.913 1.00 0.00 C ATOM 1671 O THR A 110 -39.052 -17.108 -4.301 1.00 0.00 O ATOM 1672 CB THR A 110 -36.922 -17.850 -6.672 1.00 0.00 C ATOM 1673 OG1 THR A 110 -36.675 -17.948 -8.068 1.00 0.00 O ATOM 1674 CG2 THR A 110 -37.431 -19.192 -6.148 1.00 0.00 C ATOM 0 H THR A 110 -36.475 -15.625 -7.422 1.00 0.00 H new ATOM 0 HA THR A 110 -38.948 -17.048 -6.820 1.00 0.00 H new ATOM 0 HB THR A 110 -35.998 -17.587 -6.156 1.00 0.00 H new ATOM 0 HG1 THR A 110 -35.744 -17.705 -8.253 1.00 0.00 H new ATOM 0 HG21 THR A 110 -36.681 -19.962 -6.329 1.00 0.00 H new ATOM 0 HG22 THR A 110 -37.622 -19.116 -5.077 1.00 0.00 H new ATOM 0 HG23 THR A 110 -38.354 -19.457 -6.663 1.00 0.00 H new ATOM 1682 N ASN A 111 -37.348 -15.723 -4.313 1.00 0.00 N ATOM 1683 CA ASN A 111 -37.490 -15.466 -2.848 1.00 0.00 C ATOM 1684 C ASN A 111 -38.476 -14.319 -2.602 1.00 0.00 C ATOM 1685 O ASN A 111 -39.300 -14.382 -1.711 1.00 0.00 O ATOM 1686 CB ASN A 111 -36.089 -15.081 -2.376 1.00 0.00 C ATOM 1687 CG ASN A 111 -35.216 -16.333 -2.292 1.00 0.00 C ATOM 1688 OD1 ASN A 111 -35.060 -17.046 -3.264 1.00 0.00 O ATOM 1689 ND2 ASN A 111 -34.634 -16.633 -1.163 1.00 0.00 N ATOM 0 H ASN A 111 -36.588 -15.221 -4.771 1.00 0.00 H new ATOM 0 HA ASN A 111 -37.876 -16.334 -2.313 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -35.646 -14.362 -3.065 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -36.143 -14.596 -1.401 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -34.048 -17.466 -1.097 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -34.765 -16.035 -0.347 1.00 0.00 H new ATOM 1696 N LEU A 112 -38.400 -13.273 -3.384 1.00 0.00 N ATOM 1697 CA LEU A 112 -39.337 -12.123 -3.192 1.00 0.00 C ATOM 1698 C LEU A 112 -40.772 -12.633 -3.015 1.00 0.00 C ATOM 1699 O LEU A 112 -41.593 -11.999 -2.381 1.00 0.00 O ATOM 1700 CB LEU A 112 -39.215 -11.296 -4.470 1.00 0.00 C ATOM 1701 CG LEU A 112 -37.954 -10.432 -4.404 1.00 0.00 C ATOM 1702 CD1 LEU A 112 -37.636 -9.883 -5.797 1.00 0.00 C ATOM 1703 CD2 LEU A 112 -38.186 -9.268 -3.440 1.00 0.00 C ATOM 0 H LEU A 112 -37.731 -13.164 -4.146 1.00 0.00 H new ATOM 0 HA LEU A 112 -39.097 -11.538 -2.304 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -39.172 -11.954 -5.338 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -40.095 -10.664 -4.592 1.00 0.00 H new ATOM 0 HG LEU A 112 -37.118 -11.036 -4.053 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -36.738 -9.268 -5.749 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -37.472 -10.712 -6.486 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -38.472 -9.278 -6.149 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -37.289 -8.651 -3.392 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -39.022 -8.665 -3.793 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -38.413 -9.657 -2.447 1.00 0.00 H new ATOM 1715 N GLY A 113 -41.076 -13.776 -3.565 1.00 0.00 N ATOM 1716 CA GLY A 113 -42.452 -14.328 -3.424 1.00 0.00 C ATOM 1717 C GLY A 113 -43.040 -14.602 -4.808 1.00 0.00 C ATOM 1718 O GLY A 113 -44.215 -14.401 -5.044 1.00 0.00 O ATOM 0 H GLY A 113 -40.431 -14.352 -4.106 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -42.427 -15.248 -2.840 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -43.083 -13.623 -2.883 1.00 0.00 H new ATOM 1722 N GLU A 114 -42.236 -15.061 -5.728 1.00 0.00 N ATOM 1723 CA GLU A 114 -42.757 -15.346 -7.097 1.00 0.00 C ATOM 1724 C GLU A 114 -42.383 -16.769 -7.520 1.00 0.00 C ATOM 1725 O GLU A 114 -41.234 -17.163 -7.463 1.00 0.00 O ATOM 1726 CB GLU A 114 -42.077 -14.323 -8.002 1.00 0.00 C ATOM 1727 CG GLU A 114 -42.414 -12.912 -7.520 1.00 0.00 C ATOM 1728 CD GLU A 114 -41.676 -11.887 -8.383 1.00 0.00 C ATOM 1729 OE1 GLU A 114 -41.937 -11.849 -9.573 1.00 0.00 O ATOM 1730 OE2 GLU A 114 -40.865 -11.158 -7.837 1.00 0.00 O ATOM 0 H GLU A 114 -41.243 -15.251 -5.592 1.00 0.00 H new ATOM 0 HA GLU A 114 -43.844 -15.275 -7.147 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -40.998 -14.474 -7.992 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -42.408 -14.456 -9.032 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -43.489 -12.744 -7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -42.128 -12.796 -6.475 1.00 0.00 H new ATOM 1737 N LYS A 115 -43.343 -17.543 -7.945 1.00 0.00 N ATOM 1738 CA LYS A 115 -43.043 -18.940 -8.371 1.00 0.00 C ATOM 1739 C LYS A 115 -42.549 -18.956 -9.820 1.00 0.00 C ATOM 1740 O LYS A 115 -43.325 -19.019 -10.752 1.00 0.00 O ATOM 1741 CB LYS A 115 -44.373 -19.683 -8.249 1.00 0.00 C ATOM 1742 CG LYS A 115 -44.899 -19.560 -6.816 1.00 0.00 C ATOM 1743 CD LYS A 115 -44.484 -20.794 -6.011 1.00 0.00 C ATOM 1744 CE LYS A 115 -45.274 -20.839 -4.700 1.00 0.00 C ATOM 1745 NZ LYS A 115 -44.934 -19.570 -4.000 1.00 0.00 N ATOM 0 H LYS A 115 -44.323 -17.269 -8.016 1.00 0.00 H new ATOM 0 HA LYS A 115 -42.262 -19.399 -7.765 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -45.098 -19.270 -8.950 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -44.240 -20.733 -8.510 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -44.504 -18.658 -6.349 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -45.985 -19.466 -6.823 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -44.669 -21.698 -6.591 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -43.415 -20.762 -5.802 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -46.345 -20.911 -4.887 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -44.996 -21.706 -4.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -45.113 -19.677 -2.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -43.930 -19.347 -4.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -45.521 -18.798 -4.376 1.00 0.00 H new ATOM 1759 N LEU A 116 -41.259 -18.897 -10.016 1.00 0.00 N ATOM 1760 CA LEU A 116 -40.714 -18.909 -11.406 1.00 0.00 C ATOM 1761 C LEU A 116 -39.815 -20.130 -11.609 1.00 0.00 C ATOM 1762 O LEU A 116 -39.677 -20.963 -10.736 1.00 0.00 O ATOM 1763 CB LEU A 116 -39.899 -17.623 -11.522 1.00 0.00 C ATOM 1764 CG LEU A 116 -40.831 -16.417 -11.427 1.00 0.00 C ATOM 1765 CD1 LEU A 116 -40.274 -15.422 -10.407 1.00 0.00 C ATOM 1766 CD2 LEU A 116 -40.928 -15.741 -12.797 1.00 0.00 C ATOM 0 H LEU A 116 -40.560 -18.841 -9.276 1.00 0.00 H new ATOM 0 HA LEU A 116 -41.501 -18.963 -12.158 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -39.152 -17.581 -10.730 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -39.360 -17.606 -12.470 1.00 0.00 H new ATOM 0 HG LEU A 116 -41.821 -16.746 -11.111 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -40.939 -14.561 -10.338 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -40.202 -15.903 -9.432 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -39.284 -15.092 -10.723 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -41.593 -14.880 -12.732 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -39.938 -15.412 -13.111 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -41.323 -16.450 -13.525 1.00 0.00 H new ATOM 1778 N THR A 117 -39.201 -20.243 -12.757 1.00 0.00 N ATOM 1779 CA THR A 117 -38.310 -21.413 -13.011 1.00 0.00 C ATOM 1780 C THR A 117 -37.107 -20.995 -13.870 1.00 0.00 C ATOM 1781 O THR A 117 -36.951 -19.843 -14.222 1.00 0.00 O ATOM 1782 CB THR A 117 -39.187 -22.424 -13.754 1.00 0.00 C ATOM 1783 OG1 THR A 117 -38.423 -23.591 -14.040 1.00 0.00 O ATOM 1784 CG2 THR A 117 -39.691 -21.809 -15.060 1.00 0.00 C ATOM 0 H THR A 117 -39.277 -19.579 -13.527 1.00 0.00 H new ATOM 0 HA THR A 117 -37.903 -21.830 -12.090 1.00 0.00 H new ATOM 0 HB THR A 117 -40.041 -22.690 -13.131 1.00 0.00 H new ATOM 0 HG1 THR A 117 -38.239 -23.634 -15.002 1.00 0.00 H new ATOM 0 HG21 THR A 117 -40.315 -22.532 -15.586 1.00 0.00 H new ATOM 0 HG22 THR A 117 -40.277 -20.917 -14.840 1.00 0.00 H new ATOM 0 HG23 THR A 117 -38.841 -21.539 -15.687 1.00 0.00 H new ATOM 1792 N ASP A 118 -36.255 -21.927 -14.200 1.00 0.00 N ATOM 1793 CA ASP A 118 -35.053 -21.597 -15.029 1.00 0.00 C ATOM 1794 C ASP A 118 -35.465 -21.061 -16.405 1.00 0.00 C ATOM 1795 O ASP A 118 -34.775 -20.259 -17.002 1.00 0.00 O ATOM 1796 CB ASP A 118 -34.316 -22.924 -15.182 1.00 0.00 C ATOM 1797 CG ASP A 118 -33.551 -23.239 -13.895 1.00 0.00 C ATOM 1798 OD1 ASP A 118 -32.713 -22.437 -13.516 1.00 0.00 O ATOM 1799 OD2 ASP A 118 -33.818 -24.276 -13.309 1.00 0.00 O ATOM 0 H ASP A 118 -36.337 -22.908 -13.932 1.00 0.00 H new ATOM 0 HA ASP A 118 -34.439 -20.825 -14.566 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -35.026 -23.722 -15.400 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -33.626 -22.873 -16.024 1.00 0.00 H new ATOM 1804 N GLU A 119 -36.572 -21.506 -16.913 1.00 0.00 N ATOM 1805 CA GLU A 119 -37.024 -21.036 -18.258 1.00 0.00 C ATOM 1806 C GLU A 119 -37.396 -19.547 -18.216 1.00 0.00 C ATOM 1807 O GLU A 119 -37.092 -18.798 -19.122 1.00 0.00 O ATOM 1808 CB GLU A 119 -38.255 -21.888 -18.584 1.00 0.00 C ATOM 1809 CG GLU A 119 -37.812 -23.274 -19.068 1.00 0.00 C ATOM 1810 CD GLU A 119 -37.006 -23.974 -17.972 1.00 0.00 C ATOM 1811 OE1 GLU A 119 -37.565 -24.212 -16.913 1.00 0.00 O ATOM 1812 OE2 GLU A 119 -35.843 -24.257 -18.207 1.00 0.00 O ATOM 0 H GLU A 119 -37.191 -22.178 -16.459 1.00 0.00 H new ATOM 0 HA GLU A 119 -36.242 -21.141 -19.010 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -38.886 -21.985 -17.701 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -38.855 -21.399 -19.352 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -38.684 -23.873 -19.330 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -37.209 -23.178 -19.971 1.00 0.00 H new ATOM 1819 N GLU A 120 -38.057 -19.117 -17.176 1.00 0.00 N ATOM 1820 CA GLU A 120 -38.450 -17.679 -17.085 1.00 0.00 C ATOM 1821 C GLU A 120 -37.212 -16.792 -16.919 1.00 0.00 C ATOM 1822 O GLU A 120 -36.977 -15.889 -17.694 1.00 0.00 O ATOM 1823 CB GLU A 120 -39.343 -17.591 -15.849 1.00 0.00 C ATOM 1824 CG GLU A 120 -40.621 -18.400 -16.081 1.00 0.00 C ATOM 1825 CD GLU A 120 -41.512 -17.675 -17.091 1.00 0.00 C ATOM 1826 OE1 GLU A 120 -41.125 -17.595 -18.245 1.00 0.00 O ATOM 1827 OE2 GLU A 120 -42.568 -17.207 -16.693 1.00 0.00 O ATOM 0 H GLU A 120 -38.342 -19.696 -16.386 1.00 0.00 H new ATOM 0 HA GLU A 120 -38.961 -17.336 -17.985 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -38.812 -17.972 -14.977 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -39.592 -16.550 -15.641 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -40.372 -19.395 -16.450 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -41.155 -18.533 -15.140 1.00 0.00 H new ATOM 1834 N VAL A 121 -36.420 -17.040 -15.913 1.00 0.00 N ATOM 1835 CA VAL A 121 -35.200 -16.208 -15.700 1.00 0.00 C ATOM 1836 C VAL A 121 -34.355 -16.162 -16.977 1.00 0.00 C ATOM 1837 O VAL A 121 -33.945 -15.112 -17.425 1.00 0.00 O ATOM 1838 CB VAL A 121 -34.434 -16.906 -14.578 1.00 0.00 C ATOM 1839 CG1 VAL A 121 -33.066 -16.245 -14.402 1.00 0.00 C ATOM 1840 CG2 VAL A 121 -35.225 -16.795 -13.273 1.00 0.00 C ATOM 0 H VAL A 121 -36.564 -17.782 -15.229 1.00 0.00 H new ATOM 0 HA VAL A 121 -35.447 -15.177 -15.447 1.00 0.00 H new ATOM 0 HB VAL A 121 -34.298 -17.957 -14.833 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -32.521 -16.744 -13.601 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -32.501 -16.326 -15.331 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -33.200 -15.193 -14.149 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -34.678 -17.293 -12.473 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -35.362 -15.744 -13.019 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -36.199 -17.269 -13.396 1.00 0.00 H new ATOM 1850 N ASP A 122 -34.088 -17.297 -17.562 1.00 0.00 N ATOM 1851 CA ASP A 122 -33.265 -17.322 -18.808 1.00 0.00 C ATOM 1852 C ASP A 122 -33.910 -16.457 -19.897 1.00 0.00 C ATOM 1853 O ASP A 122 -33.239 -15.747 -20.619 1.00 0.00 O ATOM 1854 CB ASP A 122 -33.245 -18.787 -19.238 1.00 0.00 C ATOM 1855 CG ASP A 122 -32.384 -18.939 -20.493 1.00 0.00 C ATOM 1856 OD1 ASP A 122 -32.612 -18.198 -21.436 1.00 0.00 O ATOM 1857 OD2 ASP A 122 -31.514 -19.792 -20.492 1.00 0.00 O ATOM 0 H ASP A 122 -34.403 -18.209 -17.232 1.00 0.00 H new ATOM 0 HA ASP A 122 -32.263 -16.926 -18.643 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -32.848 -19.407 -18.435 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -34.260 -19.133 -19.436 1.00 0.00 H new ATOM 1862 N GLU A 123 -35.204 -16.521 -20.027 1.00 0.00 N ATOM 1863 CA GLU A 123 -35.891 -15.712 -21.077 1.00 0.00 C ATOM 1864 C GLU A 123 -35.759 -14.211 -20.782 1.00 0.00 C ATOM 1865 O GLU A 123 -35.692 -13.398 -21.683 1.00 0.00 O ATOM 1866 CB GLU A 123 -37.356 -16.143 -21.007 1.00 0.00 C ATOM 1867 CG GLU A 123 -38.048 -15.821 -22.334 1.00 0.00 C ATOM 1868 CD GLU A 123 -37.522 -16.755 -23.425 1.00 0.00 C ATOM 1869 OE1 GLU A 123 -37.676 -17.956 -23.274 1.00 0.00 O ATOM 1870 OE2 GLU A 123 -36.975 -16.254 -24.393 1.00 0.00 O ATOM 0 H GLU A 123 -35.819 -17.098 -19.453 1.00 0.00 H new ATOM 0 HA GLU A 123 -35.459 -15.873 -22.064 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -37.422 -17.211 -20.800 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -37.859 -15.628 -20.188 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -39.127 -15.937 -22.231 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -37.864 -14.783 -22.610 1.00 0.00 H new ATOM 1877 N MET A 124 -35.726 -13.840 -19.532 1.00 0.00 N ATOM 1878 CA MET A 124 -35.606 -12.393 -19.188 1.00 0.00 C ATOM 1879 C MET A 124 -34.188 -11.888 -19.472 1.00 0.00 C ATOM 1880 O MET A 124 -33.996 -10.784 -19.941 1.00 0.00 O ATOM 1881 CB MET A 124 -35.920 -12.315 -17.695 1.00 0.00 C ATOM 1882 CG MET A 124 -37.337 -12.834 -17.447 1.00 0.00 C ATOM 1883 SD MET A 124 -38.278 -11.599 -16.517 1.00 0.00 S ATOM 1884 CE MET A 124 -37.196 -11.530 -15.070 1.00 0.00 C ATOM 0 H MET A 124 -35.777 -14.474 -18.734 1.00 0.00 H new ATOM 0 HA MET A 124 -36.280 -11.773 -19.779 1.00 0.00 H new ATOM 0 HB2 MET A 124 -35.200 -12.906 -17.129 1.00 0.00 H new ATOM 0 HB3 MET A 124 -35.831 -11.286 -17.347 1.00 0.00 H new ATOM 0 HG2 MET A 124 -37.830 -13.044 -18.396 1.00 0.00 H new ATOM 0 HG3 MET A 124 -37.300 -13.772 -16.893 1.00 0.00 H new ATOM 0 HE1 MET A 124 -37.623 -10.855 -14.328 1.00 0.00 H new ATOM 0 HE2 MET A 124 -37.100 -12.527 -14.640 1.00 0.00 H new ATOM 0 HE3 MET A 124 -36.212 -11.167 -15.368 1.00 0.00 H new ATOM 1894 N ILE A 125 -33.192 -12.688 -19.199 1.00 0.00 N ATOM 1895 CA ILE A 125 -31.791 -12.245 -19.463 1.00 0.00 C ATOM 1896 C ILE A 125 -31.539 -12.177 -20.972 1.00 0.00 C ATOM 1897 O ILE A 125 -30.718 -11.415 -21.441 1.00 0.00 O ATOM 1898 CB ILE A 125 -30.904 -13.310 -18.817 1.00 0.00 C ATOM 1899 CG1 ILE A 125 -31.084 -13.268 -17.296 1.00 0.00 C ATOM 1900 CG2 ILE A 125 -29.439 -13.039 -19.168 1.00 0.00 C ATOM 1901 CD1 ILE A 125 -30.557 -11.937 -16.751 1.00 0.00 C ATOM 0 H ILE A 125 -33.286 -13.625 -18.807 1.00 0.00 H new ATOM 0 HA ILE A 125 -31.588 -11.253 -19.059 1.00 0.00 H new ATOM 0 HB ILE A 125 -31.188 -14.294 -19.189 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -32.137 -13.385 -17.041 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -30.550 -14.098 -16.834 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -28.808 -13.799 -18.707 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -29.312 -13.070 -20.250 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -29.152 -12.055 -18.797 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -30.686 -11.910 -15.669 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -29.499 -11.838 -16.992 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -31.110 -11.114 -17.203 1.00 0.00 H new ATOM 1913 N ARG A 126 -32.242 -12.970 -21.732 1.00 0.00 N ATOM 1914 CA ARG A 126 -32.048 -12.955 -23.211 1.00 0.00 C ATOM 1915 C ARG A 126 -32.651 -11.682 -23.811 1.00 0.00 C ATOM 1916 O ARG A 126 -32.042 -11.021 -24.628 1.00 0.00 O ATOM 1917 CB ARG A 126 -32.788 -14.194 -23.715 1.00 0.00 C ATOM 1918 CG ARG A 126 -32.558 -14.354 -25.219 1.00 0.00 C ATOM 1919 CD ARG A 126 -31.336 -15.245 -25.457 1.00 0.00 C ATOM 1920 NE ARG A 126 -31.330 -15.508 -26.922 1.00 0.00 N ATOM 1921 CZ ARG A 126 -31.561 -16.712 -27.371 1.00 0.00 C ATOM 1922 NH1 ARG A 126 -30.711 -17.674 -27.124 1.00 0.00 N ATOM 1923 NH2 ARG A 126 -32.639 -16.955 -28.064 1.00 0.00 N ATOM 0 H ARG A 126 -32.943 -13.629 -21.393 1.00 0.00 H new ATOM 0 HA ARG A 126 -30.995 -12.966 -23.493 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -32.436 -15.080 -23.187 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -33.854 -14.102 -23.508 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -33.439 -14.794 -25.688 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -32.405 -13.378 -25.680 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -30.418 -14.749 -25.141 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -31.408 -16.173 -24.890 1.00 0.00 H new ATOM 0 HE ARG A 126 -31.145 -14.747 -27.576 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -29.869 -17.483 -26.581 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -30.890 -18.615 -27.474 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -33.302 -16.204 -28.256 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -32.819 -17.896 -28.414 1.00 0.00 H new ATOM 1937 N GLU A 127 -33.844 -11.329 -23.412 1.00 0.00 N ATOM 1938 CA GLU A 127 -34.477 -10.093 -23.963 1.00 0.00 C ATOM 1939 C GLU A 127 -33.761 -8.850 -23.425 1.00 0.00 C ATOM 1940 O GLU A 127 -33.718 -7.821 -24.067 1.00 0.00 O ATOM 1941 CB GLU A 127 -35.924 -10.131 -23.469 1.00 0.00 C ATOM 1942 CG GLU A 127 -36.653 -11.315 -24.109 1.00 0.00 C ATOM 1943 CD GLU A 127 -38.132 -11.276 -23.720 1.00 0.00 C ATOM 1944 OE1 GLU A 127 -38.577 -10.238 -23.259 1.00 0.00 O ATOM 1945 OE2 GLU A 127 -38.796 -12.284 -23.896 1.00 0.00 O ATOM 0 H GLU A 127 -34.406 -11.840 -22.731 1.00 0.00 H new ATOM 0 HA GLU A 127 -34.420 -10.050 -25.051 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -35.946 -10.221 -22.383 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -36.430 -9.199 -23.722 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -36.550 -11.276 -25.193 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -36.204 -12.252 -23.780 1.00 0.00 H new ATOM 1952 N ALA A 128 -33.198 -8.942 -22.250 1.00 0.00 N ATOM 1953 CA ALA A 128 -32.485 -7.767 -21.669 1.00 0.00 C ATOM 1954 C ALA A 128 -31.068 -7.664 -22.244 1.00 0.00 C ATOM 1955 O ALA A 128 -30.480 -6.601 -22.282 1.00 0.00 O ATOM 1956 CB ALA A 128 -32.434 -8.038 -20.166 1.00 0.00 C ATOM 0 H ALA A 128 -33.201 -9.779 -21.667 1.00 0.00 H new ATOM 0 HA ALA A 128 -32.988 -6.827 -21.898 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -31.923 -7.216 -19.665 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -33.449 -8.125 -19.777 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -31.894 -8.967 -19.982 1.00 0.00 H new ATOM 1962 N ASP A 129 -30.512 -8.758 -22.692 1.00 0.00 N ATOM 1963 CA ASP A 129 -29.133 -8.711 -23.261 1.00 0.00 C ATOM 1964 C ASP A 129 -29.188 -8.358 -24.753 1.00 0.00 C ATOM 1965 O ASP A 129 -29.041 -9.210 -25.608 1.00 0.00 O ATOM 1966 CB ASP A 129 -28.567 -10.117 -23.057 1.00 0.00 C ATOM 1967 CG ASP A 129 -27.042 -10.080 -23.207 1.00 0.00 C ATOM 1968 OD1 ASP A 129 -26.528 -9.035 -23.570 1.00 0.00 O ATOM 1969 OD2 ASP A 129 -26.416 -11.099 -22.958 1.00 0.00 O ATOM 0 H ASP A 129 -30.951 -9.679 -22.689 1.00 0.00 H new ATOM 0 HA ASP A 129 -28.514 -7.954 -22.780 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -28.837 -10.490 -22.069 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -28.998 -10.804 -23.785 1.00 0.00 H new ATOM 1974 N ILE A 130 -29.400 -7.106 -25.068 1.00 0.00 N ATOM 1975 CA ILE A 130 -29.466 -6.693 -26.503 1.00 0.00 C ATOM 1976 C ILE A 130 -28.312 -7.317 -27.294 1.00 0.00 C ATOM 1977 O ILE A 130 -28.521 -8.057 -28.233 1.00 0.00 O ATOM 1978 CB ILE A 130 -29.340 -5.171 -26.482 1.00 0.00 C ATOM 1979 CG1 ILE A 130 -30.504 -4.576 -25.685 1.00 0.00 C ATOM 1980 CG2 ILE A 130 -29.378 -4.632 -27.914 1.00 0.00 C ATOM 1981 CD1 ILE A 130 -29.980 -3.484 -24.754 1.00 0.00 C ATOM 0 H ILE A 130 -29.530 -6.352 -24.394 1.00 0.00 H new ATOM 0 HA ILE A 130 -30.388 -7.021 -26.982 1.00 0.00 H new ATOM 0 HB ILE A 130 -28.395 -4.893 -26.015 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -31.250 -4.163 -26.364 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -30.998 -5.356 -25.106 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -29.288 -3.546 -27.896 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -28.551 -5.056 -28.484 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -30.322 -4.910 -28.383 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -30.809 -3.061 -24.187 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -29.251 -3.912 -24.066 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -29.506 -2.700 -25.344 1.00 0.00 H new ATOM 1993 N ASP A 131 -27.095 -7.023 -26.926 1.00 0.00 N ATOM 1994 CA ASP A 131 -25.934 -7.601 -27.668 1.00 0.00 C ATOM 1995 C ASP A 131 -25.879 -9.122 -27.474 1.00 0.00 C ATOM 1996 O ASP A 131 -25.368 -9.842 -28.310 1.00 0.00 O ATOM 1997 CB ASP A 131 -24.697 -6.937 -27.060 1.00 0.00 C ATOM 1998 CG ASP A 131 -24.638 -7.226 -25.559 1.00 0.00 C ATOM 1999 OD1 ASP A 131 -24.573 -8.392 -25.202 1.00 0.00 O ATOM 2000 OD2 ASP A 131 -24.657 -6.278 -24.791 1.00 0.00 O ATOM 0 H ASP A 131 -26.853 -6.410 -26.147 1.00 0.00 H new ATOM 0 HA ASP A 131 -26.005 -7.422 -28.741 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -23.796 -7.310 -27.547 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -24.729 -5.861 -27.231 1.00 0.00 H new ATOM 2005 N GLY A 132 -26.393 -9.615 -26.383 1.00 0.00 N ATOM 2006 CA GLY A 132 -26.361 -11.085 -26.147 1.00 0.00 C ATOM 2007 C GLY A 132 -24.911 -11.539 -25.989 1.00 0.00 C ATOM 2008 O GLY A 132 -24.384 -12.264 -26.810 1.00 0.00 O ATOM 0 H GLY A 132 -26.833 -9.065 -25.645 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -26.932 -11.334 -25.252 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -26.830 -11.609 -26.980 1.00 0.00 H new ATOM 2012 N ASP A 133 -24.257 -11.111 -24.944 1.00 0.00 N ATOM 2013 CA ASP A 133 -22.835 -11.518 -24.739 1.00 0.00 C ATOM 2014 C ASP A 133 -22.721 -12.531 -23.589 1.00 0.00 C ATOM 2015 O ASP A 133 -21.908 -13.430 -23.626 1.00 0.00 O ATOM 2016 CB ASP A 133 -22.098 -10.222 -24.392 1.00 0.00 C ATOM 2017 CG ASP A 133 -22.563 -9.718 -23.027 1.00 0.00 C ATOM 2018 OD1 ASP A 133 -22.221 -10.346 -22.039 1.00 0.00 O ATOM 2019 OD2 ASP A 133 -23.256 -8.716 -22.992 1.00 0.00 O ATOM 0 H ASP A 133 -24.643 -10.499 -24.225 1.00 0.00 H new ATOM 0 HA ASP A 133 -22.417 -12.003 -25.621 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -21.022 -10.396 -24.380 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -22.290 -9.467 -25.154 1.00 0.00 H new ATOM 2024 N GLY A 134 -23.528 -12.392 -22.567 1.00 0.00 N ATOM 2025 CA GLY A 134 -23.447 -13.353 -21.428 1.00 0.00 C ATOM 2026 C GLY A 134 -24.254 -12.825 -20.238 1.00 0.00 C ATOM 2027 O GLY A 134 -24.897 -13.577 -19.533 1.00 0.00 O ATOM 0 H GLY A 134 -24.233 -11.661 -22.473 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -23.830 -14.326 -21.735 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -22.407 -13.498 -21.137 1.00 0.00 H new ATOM 2031 N GLN A 135 -24.228 -11.537 -20.006 1.00 0.00 N ATOM 2032 CA GLN A 135 -25.002 -10.977 -18.857 1.00 0.00 C ATOM 2033 C GLN A 135 -25.656 -9.642 -19.255 1.00 0.00 C ATOM 2034 O GLN A 135 -25.333 -9.061 -20.271 1.00 0.00 O ATOM 2035 CB GLN A 135 -23.968 -10.787 -17.721 1.00 0.00 C ATOM 2036 CG GLN A 135 -23.183 -9.475 -17.906 1.00 0.00 C ATOM 2037 CD GLN A 135 -22.367 -9.532 -19.196 1.00 0.00 C ATOM 2038 OE1 GLN A 135 -21.635 -10.476 -19.425 1.00 0.00 O ATOM 2039 NE2 GLN A 135 -22.459 -8.554 -20.056 1.00 0.00 N ATOM 0 H GLN A 135 -23.709 -10.854 -20.557 1.00 0.00 H new ATOM 0 HA GLN A 135 -25.814 -11.634 -18.544 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -24.478 -10.778 -16.758 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -23.277 -11.630 -17.708 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -23.872 -8.631 -17.939 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -22.522 -9.314 -17.055 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -23.073 -7.762 -19.864 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -21.917 -8.582 -20.920 1.00 0.00 H new ATOM 2048 N VAL A 136 -26.574 -9.159 -18.459 1.00 0.00 N ATOM 2049 CA VAL A 136 -27.248 -7.867 -18.795 1.00 0.00 C ATOM 2050 C VAL A 136 -26.453 -6.694 -18.215 1.00 0.00 C ATOM 2051 O VAL A 136 -25.858 -6.797 -17.161 1.00 0.00 O ATOM 2052 CB VAL A 136 -28.630 -7.945 -18.138 1.00 0.00 C ATOM 2053 CG1 VAL A 136 -29.507 -6.805 -18.656 1.00 0.00 C ATOM 2054 CG2 VAL A 136 -29.289 -9.285 -18.476 1.00 0.00 C ATOM 0 H VAL A 136 -26.886 -9.600 -17.594 1.00 0.00 H new ATOM 0 HA VAL A 136 -27.319 -7.712 -19.872 1.00 0.00 H new ATOM 0 HB VAL A 136 -28.518 -7.859 -17.057 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -30.490 -6.861 -18.188 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -29.043 -5.849 -18.412 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -29.614 -6.891 -19.737 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -30.271 -9.336 -18.007 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -29.398 -9.374 -19.557 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -28.667 -10.100 -18.105 1.00 0.00 H new ATOM 2064 N ASN A 137 -26.443 -5.579 -18.891 1.00 0.00 N ATOM 2065 CA ASN A 137 -25.692 -4.401 -18.371 1.00 0.00 C ATOM 2066 C ASN A 137 -26.675 -3.318 -17.906 1.00 0.00 C ATOM 2067 O ASN A 137 -27.863 -3.406 -18.143 1.00 0.00 O ATOM 2068 CB ASN A 137 -24.860 -3.906 -19.555 1.00 0.00 C ATOM 2069 CG ASN A 137 -23.554 -3.303 -19.042 1.00 0.00 C ATOM 2070 OD1 ASN A 137 -22.762 -3.982 -18.424 1.00 0.00 O ATOM 2071 ND2 ASN A 137 -23.294 -2.046 -19.273 1.00 0.00 N ATOM 0 H ASN A 137 -26.921 -5.432 -19.780 1.00 0.00 H new ATOM 0 HA ASN A 137 -25.065 -4.651 -17.515 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -24.650 -4.731 -20.236 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -25.420 -3.161 -20.121 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -22.425 -1.634 -18.934 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -23.960 -1.475 -19.793 1.00 0.00 H new ATOM 2078 N TYR A 138 -26.192 -2.305 -17.239 1.00 0.00 N ATOM 2079 CA TYR A 138 -27.110 -1.226 -16.753 1.00 0.00 C ATOM 2080 C TYR A 138 -27.802 -0.534 -17.936 1.00 0.00 C ATOM 2081 O TYR A 138 -29.002 -0.342 -17.937 1.00 0.00 O ATOM 2082 CB TYR A 138 -26.208 -0.243 -16.002 1.00 0.00 C ATOM 2083 CG TYR A 138 -27.064 0.727 -15.224 1.00 0.00 C ATOM 2084 CD1 TYR A 138 -27.840 1.691 -15.908 1.00 0.00 C ATOM 2085 CD2 TYR A 138 -27.093 0.668 -13.810 1.00 0.00 C ATOM 2086 CE1 TYR A 138 -28.646 2.598 -15.179 1.00 0.00 C ATOM 2087 CE2 TYR A 138 -27.899 1.575 -13.081 1.00 0.00 C ATOM 2088 CZ TYR A 138 -28.676 2.540 -13.767 1.00 0.00 C ATOM 2089 OH TYR A 138 -29.462 3.423 -13.055 1.00 0.00 O ATOM 0 H TYR A 138 -25.207 -2.175 -17.009 1.00 0.00 H new ATOM 0 HA TYR A 138 -27.902 -1.619 -16.116 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -25.545 -0.784 -15.326 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -25.574 0.297 -16.706 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -27.818 1.735 -16.987 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -26.501 -0.069 -13.288 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -29.238 3.335 -15.702 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -27.921 1.531 -12.002 1.00 0.00 H new ATOM 0 HH TYR A 138 -29.367 3.245 -12.096 1.00 0.00 H new ATOM 2099 N GLU A 139 -27.061 -0.159 -18.941 1.00 0.00 N ATOM 2100 CA GLU A 139 -27.692 0.518 -20.115 1.00 0.00 C ATOM 2101 C GLU A 139 -28.738 -0.402 -20.756 1.00 0.00 C ATOM 2102 O GLU A 139 -29.808 0.028 -21.135 1.00 0.00 O ATOM 2103 CB GLU A 139 -26.544 0.782 -21.087 1.00 0.00 C ATOM 2104 CG GLU A 139 -27.047 1.647 -22.244 1.00 0.00 C ATOM 2105 CD GLU A 139 -25.856 2.141 -23.068 1.00 0.00 C ATOM 2106 OE1 GLU A 139 -24.735 1.837 -22.695 1.00 0.00 O ATOM 2107 OE2 GLU A 139 -26.086 2.815 -24.059 1.00 0.00 O ATOM 0 H GLU A 139 -26.051 -0.290 -19.003 1.00 0.00 H new ATOM 0 HA GLU A 139 -28.206 1.437 -19.834 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -25.725 1.284 -20.572 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -26.151 -0.161 -21.467 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -27.725 1.071 -22.874 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -27.613 2.495 -21.859 1.00 0.00 H new ATOM 2114 N GLU A 140 -28.437 -1.665 -20.874 1.00 0.00 N ATOM 2115 CA GLU A 140 -29.413 -2.613 -21.484 1.00 0.00 C ATOM 2116 C GLU A 140 -30.614 -2.806 -20.547 1.00 0.00 C ATOM 2117 O GLU A 140 -31.698 -3.145 -20.976 1.00 0.00 O ATOM 2118 CB GLU A 140 -28.645 -3.925 -21.641 1.00 0.00 C ATOM 2119 CG GLU A 140 -27.489 -3.733 -22.628 1.00 0.00 C ATOM 2120 CD GLU A 140 -26.826 -5.085 -22.905 1.00 0.00 C ATOM 2121 OE1 GLU A 140 -26.296 -5.664 -21.970 1.00 0.00 O ATOM 2122 OE2 GLU A 140 -26.863 -5.518 -24.044 1.00 0.00 O ATOM 0 H GLU A 140 -27.556 -2.083 -20.574 1.00 0.00 H new ATOM 0 HA GLU A 140 -29.802 -2.251 -22.436 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -28.260 -4.250 -20.674 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -29.314 -4.708 -21.998 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -27.858 -3.300 -23.557 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -26.759 -3.035 -22.219 1.00 0.00 H new ATOM 2129 N PHE A 141 -30.424 -2.588 -19.270 1.00 0.00 N ATOM 2130 CA PHE A 141 -31.555 -2.755 -18.305 1.00 0.00 C ATOM 2131 C PHE A 141 -32.488 -1.547 -18.380 1.00 0.00 C ATOM 2132 O PHE A 141 -33.658 -1.631 -18.065 1.00 0.00 O ATOM 2133 CB PHE A 141 -30.888 -2.845 -16.927 1.00 0.00 C ATOM 2134 CG PHE A 141 -31.944 -2.825 -15.838 1.00 0.00 C ATOM 2135 CD1 PHE A 141 -32.597 -1.614 -15.504 1.00 0.00 C ATOM 2136 CD2 PHE A 141 -32.277 -4.019 -15.152 1.00 0.00 C ATOM 2137 CE1 PHE A 141 -33.580 -1.595 -14.486 1.00 0.00 C ATOM 2138 CE2 PHE A 141 -33.261 -3.999 -14.134 1.00 0.00 C ATOM 2139 CZ PHE A 141 -33.912 -2.788 -13.802 1.00 0.00 C ATOM 0 H PHE A 141 -29.537 -2.302 -18.854 1.00 0.00 H new ATOM 0 HA PHE A 141 -32.161 -3.636 -18.518 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -30.299 -3.760 -16.858 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -30.199 -2.011 -16.792 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -32.345 -0.703 -16.027 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -31.781 -4.944 -15.405 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -34.076 -0.670 -14.231 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -33.515 -4.909 -13.611 1.00 0.00 H new ATOM 0 HZ PHE A 141 -34.663 -2.774 -13.026 1.00 0.00 H new ATOM 2149 N VAL A 142 -31.979 -0.423 -18.797 1.00 0.00 N ATOM 2150 CA VAL A 142 -32.835 0.791 -18.898 1.00 0.00 C ATOM 2151 C VAL A 142 -33.658 0.747 -20.189 1.00 0.00 C ATOM 2152 O VAL A 142 -34.698 1.364 -20.295 1.00 0.00 O ATOM 2153 CB VAL A 142 -31.853 1.958 -18.924 1.00 0.00 C ATOM 2154 CG1 VAL A 142 -32.622 3.272 -19.057 1.00 0.00 C ATOM 2155 CG2 VAL A 142 -31.045 1.970 -17.623 1.00 0.00 C ATOM 0 H VAL A 142 -31.006 -0.292 -19.073 1.00 0.00 H new ATOM 0 HA VAL A 142 -33.544 0.873 -18.074 1.00 0.00 H new ATOM 0 HB VAL A 142 -31.178 1.846 -19.773 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -31.919 4.105 -19.075 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -33.199 3.264 -19.982 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -33.297 3.386 -18.209 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -30.342 2.803 -17.639 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -31.721 2.082 -16.776 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -30.495 1.034 -17.527 1.00 0.00 H new ATOM 2165 N GLN A 143 -33.202 0.016 -21.168 1.00 0.00 N ATOM 2166 CA GLN A 143 -33.958 -0.070 -22.451 1.00 0.00 C ATOM 2167 C GLN A 143 -34.971 -1.218 -22.395 1.00 0.00 C ATOM 2168 O GLN A 143 -36.025 -1.158 -22.996 1.00 0.00 O ATOM 2169 CB GLN A 143 -32.901 -0.342 -23.520 1.00 0.00 C ATOM 2170 CG GLN A 143 -32.365 0.984 -24.059 1.00 0.00 C ATOM 2171 CD GLN A 143 -31.002 1.280 -23.428 1.00 0.00 C ATOM 2172 OE1 GLN A 143 -30.097 0.469 -23.496 1.00 0.00 O ATOM 2173 NE2 GLN A 143 -30.815 2.416 -22.816 1.00 0.00 N ATOM 0 H GLN A 143 -32.339 -0.526 -21.136 1.00 0.00 H new ATOM 0 HA GLN A 143 -34.521 0.840 -22.657 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -32.086 -0.931 -23.099 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -33.332 -0.928 -24.331 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -32.272 0.937 -25.144 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -33.064 1.789 -23.834 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -31.574 3.096 -22.759 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -29.910 2.625 -22.394 1.00 0.00 H new ATOM 2182 N MET A 144 -34.660 -2.266 -21.678 1.00 0.00 N ATOM 2183 CA MET A 144 -35.609 -3.415 -21.590 1.00 0.00 C ATOM 2184 C MET A 144 -36.680 -3.138 -20.530 1.00 0.00 C ATOM 2185 O MET A 144 -37.754 -3.706 -20.558 1.00 0.00 O ATOM 2186 CB MET A 144 -34.746 -4.616 -21.187 1.00 0.00 C ATOM 2187 CG MET A 144 -34.224 -4.427 -19.758 1.00 0.00 C ATOM 2188 SD MET A 144 -35.416 -5.121 -18.582 1.00 0.00 S ATOM 2189 CE MET A 144 -34.461 -4.813 -17.074 1.00 0.00 C ATOM 0 H MET A 144 -33.793 -2.376 -21.151 1.00 0.00 H new ATOM 0 HA MET A 144 -36.133 -3.590 -22.530 1.00 0.00 H new ATOM 0 HB2 MET A 144 -35.331 -5.533 -21.251 1.00 0.00 H new ATOM 0 HB3 MET A 144 -33.910 -4.722 -21.878 1.00 0.00 H new ATOM 0 HG2 MET A 144 -33.257 -4.918 -19.645 1.00 0.00 H new ATOM 0 HG3 MET A 144 -34.070 -3.368 -19.553 1.00 0.00 H new ATOM 0 HE1 MET A 144 -34.979 -5.249 -16.220 1.00 0.00 H new ATOM 0 HE2 MET A 144 -33.474 -5.265 -17.170 1.00 0.00 H new ATOM 0 HE3 MET A 144 -34.355 -3.739 -16.924 1.00 0.00 H new ATOM 2199 N MET A 145 -36.396 -2.269 -19.599 1.00 0.00 N ATOM 2200 CA MET A 145 -37.401 -1.958 -18.541 1.00 0.00 C ATOM 2201 C MET A 145 -38.553 -1.145 -19.137 1.00 0.00 C ATOM 2202 O MET A 145 -39.679 -1.223 -18.688 1.00 0.00 O ATOM 2203 CB MET A 145 -36.642 -1.131 -17.503 1.00 0.00 C ATOM 2204 CG MET A 145 -37.559 -0.837 -16.314 1.00 0.00 C ATOM 2205 SD MET A 145 -38.121 -2.395 -15.581 1.00 0.00 S ATOM 2206 CE MET A 145 -36.490 -3.054 -15.158 1.00 0.00 C ATOM 0 H MET A 145 -35.514 -1.762 -19.524 1.00 0.00 H new ATOM 0 HA MET A 145 -37.836 -2.857 -18.104 1.00 0.00 H new ATOM 0 HB2 MET A 145 -35.757 -1.672 -17.168 1.00 0.00 H new ATOM 0 HB3 MET A 145 -36.296 -0.198 -17.948 1.00 0.00 H new ATOM 0 HG2 MET A 145 -37.027 -0.244 -15.570 1.00 0.00 H new ATOM 0 HG3 MET A 145 -38.416 -0.247 -16.640 1.00 0.00 H new ATOM 0 HE1 MET A 145 -36.458 -4.120 -15.384 1.00 0.00 H new ATOM 0 HE2 MET A 145 -35.727 -2.537 -15.740 1.00 0.00 H new ATOM 0 HE3 MET A 145 -36.301 -2.903 -14.095 1.00 0.00 H new ATOM 2216 N THR A 146 -38.277 -0.366 -20.146 1.00 0.00 N ATOM 2217 CA THR A 146 -39.352 0.455 -20.772 1.00 0.00 C ATOM 2218 C THR A 146 -39.551 0.044 -22.238 1.00 0.00 C ATOM 2219 O THR A 146 -39.497 0.863 -23.133 1.00 0.00 O ATOM 2220 CB THR A 146 -38.847 1.894 -20.683 1.00 0.00 C ATOM 2221 OG1 THR A 146 -37.628 2.009 -21.405 1.00 0.00 O ATOM 2222 CG2 THR A 146 -38.610 2.263 -19.218 1.00 0.00 C ATOM 0 H THR A 146 -37.353 -0.262 -20.565 1.00 0.00 H new ATOM 0 HA THR A 146 -40.314 0.326 -20.275 1.00 0.00 H new ATOM 0 HB THR A 146 -39.589 2.569 -21.109 1.00 0.00 H new ATOM 0 HG1 THR A 146 -36.880 1.751 -20.827 1.00 0.00 H new ATOM 0 HG21 THR A 146 -38.250 3.290 -19.155 1.00 0.00 H new ATOM 0 HG22 THR A 146 -39.544 2.172 -18.664 1.00 0.00 H new ATOM 0 HG23 THR A 146 -37.867 1.591 -18.789 1.00 0.00 H new