USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 967 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 109 MET CE :methyl -177:sc= -0.0271 (180deg=-0.0386) USER MOD Set 1.2: A 124 MET CE :methyl -159:sc= 0 (180deg=0) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -151:sc= -0.0877 (180deg=0) USER MOD Set 2.2: A 107 HIS : no HD1:sc= 0.56 K(o=1.1,f=-0.88) USER MOD Set 2.3: A 111 ASN : amide:sc= 0.613 K(o=1.1,f=-0.88) USER MOD Set 3.1: A 26 THR OG1 : rot -49:sc= 0.992 USER MOD Set 3.2: A 62 THR OG1 : rot -150:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.215 K(o=-0.22,f=-1.1) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0275 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0158) USER MOD Single : A 34 THR OG1 : rot 78:sc= 0.752 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 80:sc= 0.0985 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc=-0.00675 K(o=-0.0068,f=-0.6) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 MET CE :methyl -120:sc= -0.103 (180deg=-2.54!) USER MOD Single : A 53 ASN : amide:sc= -0.0412 X(o=-0.041,f=0) USER MOD Single : A 60 ASN : amide:sc= -1.19 K(o=-1.2,f=-4.6!) USER MOD Single : A 70 THR OG1 : rot 68:sc= 0.321 USER MOD Single : A 71 MET CE :methyl 176:sc= -0.948 (180deg=-1.09) USER MOD Single : A 72 MET CE :methyl 176:sc= 0 (180deg=-0.00299) USER MOD Single : A 97 ASN : amide:sc= 0.397 K(o=0.4,f=-3.1!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -63:sc= 0.312 USER MOD Single : A 110 THR OG1 : rot -68:sc= 0.543 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -61:sc= 0.419 USER MOD Single : A 135 GLN :FLIP amide:sc= -0.742 F(o=-2.8!,f=-0.74) USER MOD Single : A 137 ASN : amide:sc= -1.7 K(o=-1.7,f=-11!) USER MOD Single : A 138 TYR OH : rot 180:sc=-0.00586 USER MOD Single : A 143 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 144 MET CE :methyl 158:sc= -0.576 (180deg=-0.841) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -12.619 16.844 -0.315 1.00 0.00 N ATOM 59 CA THR A 5 -13.458 17.953 -0.650 1.00 0.00 C ATOM 60 C THR A 5 -14.826 17.401 -0.858 1.00 0.00 C ATOM 61 O THR A 5 -14.992 16.182 -0.866 1.00 0.00 O ATOM 62 CB THR A 5 -12.947 18.763 -1.805 1.00 0.00 C ATOM 63 OG1 THR A 5 -13.249 18.243 -3.091 1.00 0.00 O ATOM 64 CG2 THR A 5 -11.424 18.947 -1.704 1.00 0.00 C ATOM 0 HA THR A 5 -13.469 18.681 0.161 1.00 0.00 H new ATOM 0 HB THR A 5 -13.475 19.713 -1.720 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.879 18.835 -3.779 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.072 19.537 -2.550 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.181 19.463 -0.775 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.938 17.971 -1.715 1.00 0.00 H new ATOM 72 N GLU A 6 -15.868 18.243 -0.982 1.00 0.00 N ATOM 73 CA GLU A 6 -17.209 17.897 -1.336 1.00 0.00 C ATOM 74 C GLU A 6 -17.336 17.208 -2.651 1.00 0.00 C ATOM 75 O GLU A 6 -18.032 16.195 -2.688 1.00 0.00 O ATOM 76 CB GLU A 6 -18.108 19.140 -1.219 1.00 0.00 C ATOM 77 CG GLU A 6 -18.541 19.557 0.188 1.00 0.00 C ATOM 78 CD GLU A 6 -19.257 18.497 1.013 1.00 0.00 C ATOM 79 OE1 GLU A 6 -20.224 17.860 0.517 1.00 0.00 O ATOM 80 OE2 GLU A 6 -18.898 18.404 2.217 1.00 0.00 O ATOM 0 H GLU A 6 -15.762 19.245 -0.822 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.552 17.147 -0.623 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -17.584 19.980 -1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -19.006 18.965 -1.811 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.656 19.879 0.737 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -19.196 20.424 0.102 1.00 0.00 H new ATOM 87 N GLU A 7 -16.724 17.655 -3.762 1.00 0.00 N ATOM 88 CA GLU A 7 -16.668 17.104 -5.081 1.00 0.00 C ATOM 89 C GLU A 7 -16.114 15.721 -5.042 1.00 0.00 C ATOM 90 O GLU A 7 -16.663 14.746 -5.554 1.00 0.00 O ATOM 91 CB GLU A 7 -15.719 17.903 -5.989 1.00 0.00 C ATOM 92 CG GLU A 7 -16.364 19.074 -6.734 1.00 0.00 C ATOM 93 CD GLU A 7 -15.425 20.140 -7.279 1.00 0.00 C ATOM 94 OE1 GLU A 7 -14.201 19.862 -7.173 1.00 0.00 O ATOM 95 OE2 GLU A 7 -15.947 21.187 -7.746 1.00 0.00 O ATOM 0 H GLU A 7 -16.195 18.526 -3.724 1.00 0.00 H new ATOM 0 HA GLU A 7 -17.688 17.129 -5.465 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.898 18.286 -5.383 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -15.284 17.223 -6.721 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -16.940 18.671 -7.567 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -17.072 19.557 -6.060 1.00 0.00 H new ATOM 102 N GLN A 8 -14.993 15.509 -4.329 1.00 0.00 N ATOM 103 CA GLN A 8 -14.353 14.244 -4.146 1.00 0.00 C ATOM 104 C GLN A 8 -15.172 13.389 -3.241 1.00 0.00 C ATOM 105 O GLN A 8 -15.101 12.192 -3.514 1.00 0.00 O ATOM 106 CB GLN A 8 -12.970 14.403 -3.492 1.00 0.00 C ATOM 107 CG GLN A 8 -12.043 15.176 -4.431 1.00 0.00 C ATOM 108 CD GLN A 8 -10.701 15.586 -3.842 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.521 15.781 -2.641 1.00 0.00 O ATOM 110 NE2 GLN A 8 -9.675 15.859 -4.692 1.00 0.00 N ATOM 0 H GLN A 8 -14.505 16.267 -3.852 1.00 0.00 H new ATOM 0 HA GLN A 8 -14.246 13.792 -5.132 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.064 14.930 -2.543 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.546 13.423 -3.272 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.860 14.565 -5.315 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.562 16.074 -4.766 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.789 15.709 -5.694 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.791 16.214 -4.327 1.00 0.00 H new ATOM 119 N ILE A 9 -15.892 13.853 -2.204 1.00 0.00 N ATOM 120 CA ILE A 9 -16.782 13.023 -1.452 1.00 0.00 C ATOM 121 C ILE A 9 -17.983 12.611 -2.231 1.00 0.00 C ATOM 122 O ILE A 9 -18.276 11.425 -2.086 1.00 0.00 O ATOM 123 CB ILE A 9 -17.034 13.528 -0.063 1.00 0.00 C ATOM 124 CG1 ILE A 9 -15.745 13.629 0.770 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.248 12.759 0.484 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.024 13.947 2.239 1.00 0.00 C ATOM 0 H ILE A 9 -15.856 14.820 -1.882 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.264 12.081 -1.272 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.329 14.577 -0.023 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.197 12.689 0.702 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.103 14.403 0.349 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -18.467 13.097 1.497 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.112 12.942 -0.154 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.027 11.692 0.498 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.082 14.008 2.783 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -16.547 14.900 2.312 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -16.642 13.160 2.671 1.00 0.00 H new ATOM 138 N ALA A 10 -18.623 13.506 -3.004 1.00 0.00 N ATOM 139 CA ALA A 10 -19.681 13.152 -3.899 1.00 0.00 C ATOM 140 C ALA A 10 -19.325 12.299 -5.067 1.00 0.00 C ATOM 141 O ALA A 10 -20.150 11.534 -5.564 1.00 0.00 O ATOM 142 CB ALA A 10 -20.330 14.487 -4.302 1.00 0.00 C ATOM 0 H ALA A 10 -18.400 14.501 -3.007 1.00 0.00 H new ATOM 0 HA ALA A 10 -20.368 12.483 -3.381 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -21.154 14.298 -4.991 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -20.709 14.990 -3.413 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.588 15.120 -4.789 1.00 0.00 H new ATOM 148 N GLU A 11 -18.048 12.301 -5.488 1.00 0.00 N ATOM 149 CA GLU A 11 -17.538 11.301 -6.374 1.00 0.00 C ATOM 150 C GLU A 11 -17.447 9.982 -5.687 1.00 0.00 C ATOM 151 O GLU A 11 -17.761 8.946 -6.272 1.00 0.00 O ATOM 152 CB GLU A 11 -16.240 11.744 -7.069 1.00 0.00 C ATOM 153 CG GLU A 11 -16.010 11.200 -8.481 1.00 0.00 C ATOM 154 CD GLU A 11 -14.761 11.658 -9.219 1.00 0.00 C ATOM 155 OE1 GLU A 11 -13.629 11.231 -8.867 1.00 0.00 O ATOM 156 OE2 GLU A 11 -14.897 12.581 -10.066 1.00 0.00 O ATOM 0 H GLU A 11 -17.362 13.003 -5.211 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.249 11.169 -7.189 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -16.231 12.833 -7.116 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -15.398 11.445 -6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.985 10.112 -8.422 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -16.875 11.466 -9.088 1.00 0.00 H new ATOM 163 N PHE A 12 -17.129 9.786 -4.395 1.00 0.00 N ATOM 164 CA PHE A 12 -17.045 8.499 -3.779 1.00 0.00 C ATOM 165 C PHE A 12 -18.423 8.011 -3.489 1.00 0.00 C ATOM 166 O PHE A 12 -18.631 6.799 -3.512 1.00 0.00 O ATOM 167 CB PHE A 12 -16.256 8.372 -2.465 1.00 0.00 C ATOM 168 CG PHE A 12 -14.795 8.386 -2.758 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.103 7.391 -3.407 1.00 0.00 C ATOM 170 CD2 PHE A 12 -13.988 9.382 -2.260 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.774 7.479 -3.747 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.655 9.507 -2.573 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.011 8.530 -3.294 1.00 0.00 C ATOM 0 H PHE A 12 -16.923 10.553 -3.755 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.487 7.917 -4.512 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.511 9.193 -1.795 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.526 7.448 -1.954 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.635 6.487 -3.665 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.425 10.105 -1.587 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.327 6.720 -4.372 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.109 10.381 -2.249 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.952 8.585 -3.496 1.00 0.00 H new ATOM 183 N LYS A 13 -19.422 8.883 -3.265 1.00 0.00 N ATOM 184 CA LYS A 13 -20.830 8.661 -3.150 1.00 0.00 C ATOM 185 C LYS A 13 -21.259 8.204 -4.501 1.00 0.00 C ATOM 186 O LYS A 13 -21.950 7.187 -4.552 1.00 0.00 O ATOM 187 CB LYS A 13 -21.509 9.948 -2.651 1.00 0.00 C ATOM 188 CG LYS A 13 -22.978 9.733 -2.279 1.00 0.00 C ATOM 189 CD LYS A 13 -23.599 10.958 -1.607 1.00 0.00 C ATOM 190 CE LYS A 13 -25.109 11.165 -1.745 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.519 12.474 -1.192 1.00 0.00 N ATOM 0 H LYS A 13 -19.209 9.874 -3.150 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.112 7.904 -2.418 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.970 10.325 -1.782 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.442 10.713 -3.425 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.545 9.490 -3.178 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.058 8.876 -1.610 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -23.364 10.910 -0.544 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.103 11.844 -2.004 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -25.393 11.105 -2.796 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -25.638 10.366 -1.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.547 12.589 -1.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.268 12.519 -0.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.031 13.236 -1.705 1.00 0.00 H new ATOM 205 N GLU A 14 -20.883 8.797 -5.648 1.00 0.00 N ATOM 206 CA GLU A 14 -21.363 8.434 -6.946 1.00 0.00 C ATOM 207 C GLU A 14 -20.888 7.100 -7.409 1.00 0.00 C ATOM 208 O GLU A 14 -21.585 6.291 -8.020 1.00 0.00 O ATOM 209 CB GLU A 14 -21.107 9.550 -7.972 1.00 0.00 C ATOM 210 CG GLU A 14 -21.869 9.446 -9.295 1.00 0.00 C ATOM 211 CD GLU A 14 -21.742 10.740 -10.085 1.00 0.00 C ATOM 212 OE1 GLU A 14 -20.665 11.044 -10.665 1.00 0.00 O ATOM 213 OE2 GLU A 14 -22.843 11.344 -10.182 1.00 0.00 O ATOM 0 H GLU A 14 -20.213 9.566 -5.672 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.443 8.323 -6.853 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -21.357 10.504 -7.508 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.040 9.572 -8.193 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -21.479 8.615 -9.882 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -22.920 9.233 -9.101 1.00 0.00 H new ATOM 220 N ALA A 15 -19.654 6.763 -6.995 1.00 0.00 N ATOM 221 CA ALA A 15 -18.980 5.501 -6.992 1.00 0.00 C ATOM 222 C ALA A 15 -19.611 4.402 -6.209 1.00 0.00 C ATOM 223 O ALA A 15 -19.710 3.251 -6.632 1.00 0.00 O ATOM 224 CB ALA A 15 -17.490 5.543 -6.611 1.00 0.00 C ATOM 0 H ALA A 15 -19.046 7.484 -6.607 1.00 0.00 H new ATOM 0 HA ALA A 15 -19.081 5.265 -8.051 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.078 4.534 -6.641 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.952 6.175 -7.317 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.383 5.949 -5.605 1.00 0.00 H new ATOM 230 N PHE A 16 -20.081 4.697 -4.983 1.00 0.00 N ATOM 231 CA PHE A 16 -20.785 3.847 -4.074 1.00 0.00 C ATOM 232 C PHE A 16 -21.931 3.167 -4.741 1.00 0.00 C ATOM 233 O PHE A 16 -22.100 1.955 -4.863 1.00 0.00 O ATOM 234 CB PHE A 16 -21.205 4.604 -2.803 1.00 0.00 C ATOM 235 CG PHE A 16 -21.585 3.621 -1.749 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.885 3.174 -1.757 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.702 3.283 -0.750 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.305 2.370 -0.724 1.00 0.00 C ATOM 239 CE2 PHE A 16 -21.197 2.618 0.347 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.479 2.121 0.347 1.00 0.00 C ATOM 0 H PHE A 16 -19.952 5.630 -4.591 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.100 3.062 -3.754 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.386 5.232 -2.453 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -22.044 5.265 -3.020 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.559 3.448 -2.555 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.654 3.532 -0.825 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.291 1.931 -0.754 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.572 2.485 1.218 1.00 0.00 H new ATOM 0 HZ PHE A 16 -22.835 1.538 1.184 1.00 0.00 H new ATOM 250 N SER A 17 -22.738 4.051 -5.354 1.00 0.00 N ATOM 251 CA SER A 17 -23.942 3.706 -6.044 1.00 0.00 C ATOM 252 C SER A 17 -23.753 3.003 -7.345 1.00 0.00 C ATOM 253 O SER A 17 -24.626 2.387 -7.954 1.00 0.00 O ATOM 254 CB SER A 17 -24.857 4.930 -6.221 1.00 0.00 C ATOM 255 OG SER A 17 -24.990 5.823 -5.124 1.00 0.00 O ATOM 0 H SER A 17 -22.542 5.052 -5.369 1.00 0.00 H new ATOM 0 HA SER A 17 -24.424 2.977 -5.393 1.00 0.00 H new ATOM 0 HB2 SER A 17 -24.491 5.501 -7.075 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.852 4.569 -6.481 1.00 0.00 H new ATOM 0 HG SER A 17 -25.595 6.554 -5.369 1.00 0.00 H new ATOM 261 N LEU A 18 -22.501 2.967 -7.835 1.00 0.00 N ATOM 262 CA LEU A 18 -22.153 2.039 -8.865 1.00 0.00 C ATOM 263 C LEU A 18 -21.834 0.648 -8.435 1.00 0.00 C ATOM 264 O LEU A 18 -22.007 -0.312 -9.184 1.00 0.00 O ATOM 265 CB LEU A 18 -20.981 2.528 -9.732 1.00 0.00 C ATOM 266 CG LEU A 18 -21.018 2.330 -11.257 1.00 0.00 C ATOM 267 CD1 LEU A 18 -20.429 1.002 -11.761 1.00 0.00 C ATOM 268 CD2 LEU A 18 -22.389 2.437 -11.946 1.00 0.00 C ATOM 0 H LEU A 18 -21.740 3.571 -7.524 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.084 1.996 -9.431 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.864 3.596 -9.546 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -20.079 2.039 -9.363 1.00 0.00 H new ATOM 0 HG LEU A 18 -20.398 3.182 -11.533 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.503 0.960 -12.848 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -19.382 0.933 -11.465 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -20.984 0.170 -11.328 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -22.271 2.277 -13.018 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.061 1.682 -11.538 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -22.808 3.428 -11.771 1.00 0.00 H new ATOM 280 N PHE A 19 -21.454 0.470 -7.157 1.00 0.00 N ATOM 281 CA PHE A 19 -21.127 -0.836 -6.675 1.00 0.00 C ATOM 282 C PHE A 19 -22.244 -1.417 -5.878 1.00 0.00 C ATOM 283 O PHE A 19 -22.425 -2.631 -5.805 1.00 0.00 O ATOM 284 CB PHE A 19 -19.886 -0.782 -5.767 1.00 0.00 C ATOM 285 CG PHE A 19 -18.777 -0.005 -6.388 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.313 -0.196 -7.668 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.073 0.878 -5.603 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.283 0.545 -8.198 1.00 0.00 C ATOM 289 CE2 PHE A 19 -17.010 1.610 -6.076 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.610 1.420 -7.378 1.00 0.00 C ATOM 0 H PHE A 19 -21.374 1.217 -6.467 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.936 -1.457 -7.551 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.155 -0.331 -4.812 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.546 -1.796 -5.557 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.775 -0.957 -8.280 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.368 1.001 -4.571 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.008 0.442 -9.237 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.500 2.318 -5.440 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.759 1.964 -7.760 1.00 0.00 H new ATOM 300 N ASP A 20 -23.069 -0.566 -5.242 1.00 0.00 N ATOM 301 CA ASP A 20 -24.361 -0.862 -4.706 1.00 0.00 C ATOM 302 C ASP A 20 -25.332 -1.213 -5.780 1.00 0.00 C ATOM 303 O ASP A 20 -25.758 -0.329 -6.522 1.00 0.00 O ATOM 304 CB ASP A 20 -24.869 0.321 -3.864 1.00 0.00 C ATOM 305 CG ASP A 20 -26.081 -0.106 -3.049 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.393 -1.325 -3.109 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.566 0.746 -2.258 1.00 0.00 O ATOM 0 H ASP A 20 -22.809 0.409 -5.091 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.269 -1.735 -4.060 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.079 0.672 -3.200 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.133 1.155 -4.514 1.00 0.00 H new ATOM 312 N LYS A 21 -25.650 -2.509 -5.947 1.00 0.00 N ATOM 313 CA LYS A 21 -26.286 -2.852 -7.181 1.00 0.00 C ATOM 314 C LYS A 21 -27.775 -2.801 -7.208 1.00 0.00 C ATOM 315 O LYS A 21 -28.473 -2.405 -8.140 1.00 0.00 O ATOM 316 CB LYS A 21 -25.799 -4.247 -7.610 1.00 0.00 C ATOM 317 CG LYS A 21 -26.224 -4.693 -9.010 1.00 0.00 C ATOM 318 CD LYS A 21 -25.522 -3.972 -10.163 1.00 0.00 C ATOM 319 CE LYS A 21 -26.053 -4.428 -11.523 1.00 0.00 C ATOM 320 NZ LYS A 21 -25.460 -3.532 -12.541 1.00 0.00 N ATOM 0 H LYS A 21 -25.484 -3.268 -5.286 1.00 0.00 H new ATOM 0 HA LYS A 21 -25.992 -2.070 -7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.710 -4.264 -7.557 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.165 -4.978 -6.889 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -26.039 -5.763 -9.105 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -27.299 -4.545 -9.111 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -25.663 -2.896 -10.059 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -24.449 -4.159 -10.110 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -25.779 -5.465 -11.716 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -27.141 -4.375 -11.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -25.797 -3.809 -13.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -25.743 -2.550 -12.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -24.423 -3.607 -12.508 1.00 0.00 H new ATOM 334 N ASP A 22 -28.388 -3.216 -6.085 1.00 0.00 N ATOM 335 CA ASP A 22 -29.761 -3.032 -5.731 1.00 0.00 C ATOM 336 C ASP A 22 -30.109 -1.647 -5.304 1.00 0.00 C ATOM 337 O ASP A 22 -31.236 -1.184 -5.476 1.00 0.00 O ATOM 338 CB ASP A 22 -30.316 -4.154 -4.838 1.00 0.00 C ATOM 339 CG ASP A 22 -29.505 -4.371 -3.569 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.509 -3.637 -3.327 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.891 -5.352 -2.880 1.00 0.00 O ATOM 0 H ASP A 22 -27.877 -3.724 -5.363 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.313 -3.139 -6.665 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.345 -3.918 -4.567 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.342 -5.083 -5.408 1.00 0.00 H new ATOM 346 N GLY A 23 -29.095 -0.933 -4.784 1.00 0.00 N ATOM 347 CA GLY A 23 -29.198 0.419 -4.329 1.00 0.00 C ATOM 348 C GLY A 23 -30.008 0.613 -3.093 1.00 0.00 C ATOM 349 O GLY A 23 -30.954 1.395 -3.029 1.00 0.00 O ATOM 0 H GLY A 23 -28.157 -1.318 -4.676 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.194 0.803 -4.150 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -29.632 1.022 -5.127 1.00 0.00 H new ATOM 353 N ASP A 24 -29.682 -0.108 -2.005 1.00 0.00 N ATOM 354 CA ASP A 24 -30.218 0.044 -0.688 1.00 0.00 C ATOM 355 C ASP A 24 -29.429 1.026 0.108 1.00 0.00 C ATOM 356 O ASP A 24 -30.052 1.709 0.919 1.00 0.00 O ATOM 357 CB ASP A 24 -30.299 -1.284 0.084 1.00 0.00 C ATOM 358 CG ASP A 24 -28.972 -2.012 0.241 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.356 -2.313 -0.816 1.00 0.00 O ATOM 360 OD2 ASP A 24 -28.631 -2.394 1.392 1.00 0.00 O ATOM 0 H ASP A 24 -28.989 -0.855 -2.052 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.234 0.415 -0.825 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -30.709 -1.088 1.075 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.001 -1.943 -0.427 1.00 0.00 H new ATOM 365 N GLY A 25 -28.115 1.250 -0.077 1.00 0.00 N ATOM 366 CA GLY A 25 -27.307 2.157 0.677 1.00 0.00 C ATOM 367 C GLY A 25 -26.111 1.451 1.218 1.00 0.00 C ATOM 368 O GLY A 25 -25.109 2.043 1.618 1.00 0.00 O ATOM 0 H GLY A 25 -27.584 0.765 -0.801 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -26.993 2.988 0.045 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -27.889 2.581 1.495 1.00 0.00 H new ATOM 372 N THR A 26 -26.125 0.107 1.182 1.00 0.00 N ATOM 373 CA THR A 26 -25.089 -0.709 1.736 1.00 0.00 C ATOM 374 C THR A 26 -24.538 -1.551 0.637 1.00 0.00 C ATOM 375 O THR A 26 -25.171 -2.060 -0.287 1.00 0.00 O ATOM 376 CB THR A 26 -25.408 -1.372 3.043 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.278 -2.480 2.869 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.096 -0.430 4.046 1.00 0.00 C ATOM 0 H THR A 26 -26.880 -0.429 0.754 1.00 0.00 H new ATOM 0 HA THR A 26 -24.275 -0.082 2.100 1.00 0.00 H new ATOM 0 HB THR A 26 -24.440 -1.685 3.434 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.041 -2.213 2.314 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.300 -0.970 4.971 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.443 0.417 4.257 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.033 -0.069 3.622 1.00 0.00 H new ATOM 386 N ILE A 27 -23.214 -1.774 0.719 1.00 0.00 N ATOM 387 CA ILE A 27 -22.484 -2.741 -0.041 1.00 0.00 C ATOM 388 C ILE A 27 -22.415 -3.997 0.758 1.00 0.00 C ATOM 389 O ILE A 27 -21.896 -3.940 1.872 1.00 0.00 O ATOM 390 CB ILE A 27 -21.137 -2.336 -0.562 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.107 -0.830 -0.873 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.766 -3.237 -1.752 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.834 -0.502 -1.651 1.00 0.00 C ATOM 0 H ILE A 27 -22.617 -1.246 1.356 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.042 -2.874 -0.968 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.368 -2.485 0.196 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.985 -0.549 -1.454 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.140 -0.255 0.052 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.788 -2.948 -2.136 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.735 -4.277 -1.426 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.512 -3.126 -2.539 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.808 0.565 -1.874 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.963 -0.769 -1.053 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.821 -1.068 -2.583 1.00 0.00 H new ATOM 405 N THR A 28 -22.797 -5.177 0.236 1.00 0.00 N ATOM 406 CA THR A 28 -22.736 -6.453 0.878 1.00 0.00 C ATOM 407 C THR A 28 -21.363 -6.985 0.651 1.00 0.00 C ATOM 408 O THR A 28 -20.548 -6.409 -0.068 1.00 0.00 O ATOM 409 CB THR A 28 -23.754 -7.482 0.484 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.730 -7.770 -0.906 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.154 -6.953 0.843 1.00 0.00 C ATOM 0 H THR A 28 -23.178 -5.242 -0.708 1.00 0.00 H new ATOM 0 HA THR A 28 -22.979 -6.271 1.925 1.00 0.00 H new ATOM 0 HB THR A 28 -23.516 -8.400 1.021 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.409 -8.446 -1.112 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.905 -7.691 0.562 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.209 -6.769 1.916 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.340 -6.023 0.306 1.00 0.00 H new ATOM 419 N THR A 29 -21.000 -8.165 1.183 1.00 0.00 N ATOM 420 CA THR A 29 -19.866 -8.913 0.737 1.00 0.00 C ATOM 421 C THR A 29 -19.950 -9.280 -0.705 1.00 0.00 C ATOM 422 O THR A 29 -18.911 -9.198 -1.359 1.00 0.00 O ATOM 423 CB THR A 29 -19.657 -10.152 1.556 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.838 -10.937 1.630 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.155 -9.792 2.964 1.00 0.00 C ATOM 0 H THR A 29 -21.510 -8.612 1.945 1.00 0.00 H new ATOM 0 HA THR A 29 -19.010 -8.251 0.869 1.00 0.00 H new ATOM 0 HB THR A 29 -18.895 -10.752 1.058 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.666 -11.737 2.169 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.009 -10.704 3.543 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.209 -9.256 2.887 1.00 0.00 H new ATOM 0 HG23 THR A 29 -19.890 -9.160 3.462 1.00 0.00 H new ATOM 433 N LYS A 30 -21.133 -9.755 -1.133 1.00 0.00 N ATOM 434 CA LYS A 30 -21.314 -10.274 -2.453 1.00 0.00 C ATOM 435 C LYS A 30 -21.192 -9.258 -3.536 1.00 0.00 C ATOM 436 O LYS A 30 -20.792 -9.619 -4.641 1.00 0.00 O ATOM 437 CB LYS A 30 -22.705 -10.910 -2.616 1.00 0.00 C ATOM 438 CG LYS A 30 -23.109 -11.763 -1.412 1.00 0.00 C ATOM 439 CD LYS A 30 -24.253 -12.680 -1.851 1.00 0.00 C ATOM 440 CE LYS A 30 -24.932 -13.528 -0.774 1.00 0.00 C ATOM 441 NZ LYS A 30 -23.911 -14.396 -0.146 1.00 0.00 N ATOM 0 H LYS A 30 -21.974 -9.779 -0.556 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.510 -11.003 -2.557 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.445 -10.123 -2.763 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -22.714 -11.528 -3.514 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.262 -12.351 -1.059 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.424 -11.129 -0.583 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.017 -12.062 -2.324 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -23.869 -13.354 -2.617 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.397 -12.887 -0.025 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -25.725 -14.133 -1.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -24.368 -15.028 0.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -23.440 -14.964 -0.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -23.206 -13.806 0.341 1.00 0.00 H new ATOM 455 N GLU A 31 -21.517 -7.977 -3.286 1.00 0.00 N ATOM 456 CA GLU A 31 -21.287 -6.832 -4.111 1.00 0.00 C ATOM 457 C GLU A 31 -19.902 -6.282 -4.143 1.00 0.00 C ATOM 458 O GLU A 31 -19.413 -5.888 -5.200 1.00 0.00 O ATOM 459 CB GLU A 31 -22.214 -5.659 -3.752 1.00 0.00 C ATOM 460 CG GLU A 31 -23.692 -5.960 -4.004 1.00 0.00 C ATOM 461 CD GLU A 31 -24.569 -4.872 -3.401 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.456 -4.595 -2.177 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.453 -4.326 -4.115 1.00 0.00 O ATOM 0 H GLU A 31 -21.988 -7.721 -2.418 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.494 -7.246 -5.098 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.076 -5.404 -2.701 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.924 -4.784 -4.334 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.877 -6.032 -5.076 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.951 -6.926 -3.571 1.00 0.00 H new ATOM 470 N LEU A 32 -19.110 -6.251 -3.056 1.00 0.00 N ATOM 471 CA LEU A 32 -17.723 -5.943 -2.898 1.00 0.00 C ATOM 472 C LEU A 32 -16.876 -7.029 -3.469 1.00 0.00 C ATOM 473 O LEU A 32 -15.866 -6.708 -4.095 1.00 0.00 O ATOM 474 CB LEU A 32 -17.360 -5.936 -1.404 1.00 0.00 C ATOM 475 CG LEU A 32 -17.590 -4.627 -0.629 1.00 0.00 C ATOM 476 CD1 LEU A 32 -17.513 -5.025 0.855 1.00 0.00 C ATOM 477 CD2 LEU A 32 -16.558 -3.545 -0.990 1.00 0.00 C ATOM 0 H LEU A 32 -19.515 -6.480 -2.148 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.553 -4.983 -3.387 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.933 -6.723 -0.914 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.307 -6.203 -1.311 1.00 0.00 H new ATOM 0 HG LEU A 32 -18.551 -4.178 -0.879 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.668 -4.143 1.477 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -18.284 -5.763 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.532 -5.451 1.067 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -16.763 -2.641 -0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.556 -3.905 -0.754 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.622 -3.322 -2.055 1.00 0.00 H new ATOM 489 N GLY A 33 -17.272 -8.306 -3.325 1.00 0.00 N ATOM 490 CA GLY A 33 -16.699 -9.388 -4.064 1.00 0.00 C ATOM 491 C GLY A 33 -16.715 -9.211 -5.543 1.00 0.00 C ATOM 492 O GLY A 33 -15.728 -9.432 -6.243 1.00 0.00 O ATOM 0 H GLY A 33 -18.008 -8.594 -2.680 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.667 -9.525 -3.740 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.236 -10.304 -3.816 1.00 0.00 H new ATOM 496 N THR A 34 -17.877 -8.761 -6.050 1.00 0.00 N ATOM 497 CA THR A 34 -18.034 -8.610 -7.464 1.00 0.00 C ATOM 498 C THR A 34 -17.218 -7.474 -7.977 1.00 0.00 C ATOM 499 O THR A 34 -16.596 -7.551 -9.035 1.00 0.00 O ATOM 500 CB THR A 34 -19.459 -8.366 -7.863 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.218 -9.504 -7.481 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.584 -8.247 -9.391 1.00 0.00 C ATOM 0 H THR A 34 -18.693 -8.506 -5.494 1.00 0.00 H new ATOM 0 HA THR A 34 -17.698 -9.552 -7.898 1.00 0.00 H new ATOM 0 HB THR A 34 -19.805 -7.448 -7.388 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.389 -9.475 -6.516 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.626 -8.070 -9.658 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.973 -7.415 -9.742 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.242 -9.171 -9.857 1.00 0.00 H new ATOM 510 N VAL A 35 -17.121 -6.342 -7.256 1.00 0.00 N ATOM 511 CA VAL A 35 -16.173 -5.311 -7.544 1.00 0.00 C ATOM 512 C VAL A 35 -14.779 -5.821 -7.673 1.00 0.00 C ATOM 513 O VAL A 35 -14.007 -5.421 -8.543 1.00 0.00 O ATOM 514 CB VAL A 35 -16.259 -4.222 -6.515 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.165 -3.153 -6.677 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.651 -3.589 -6.671 1.00 0.00 C ATOM 0 H VAL A 35 -17.716 -6.139 -6.453 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.435 -4.900 -8.519 1.00 0.00 H new ATOM 0 HB VAL A 35 -16.107 -4.646 -5.522 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.281 -2.394 -5.904 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.184 -3.619 -6.584 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.254 -2.688 -7.659 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.769 -2.786 -5.943 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.756 -3.185 -7.678 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.416 -4.347 -6.503 1.00 0.00 H new ATOM 526 N MET A 36 -14.329 -6.710 -6.770 1.00 0.00 N ATOM 527 CA MET A 36 -13.017 -7.275 -6.832 1.00 0.00 C ATOM 528 C MET A 36 -12.881 -8.178 -8.010 1.00 0.00 C ATOM 529 O MET A 36 -11.887 -8.197 -8.733 1.00 0.00 O ATOM 530 CB MET A 36 -12.525 -7.900 -5.515 1.00 0.00 C ATOM 531 CG MET A 36 -12.466 -6.951 -4.316 1.00 0.00 C ATOM 532 SD MET A 36 -12.174 -7.858 -2.768 1.00 0.00 S ATOM 533 CE MET A 36 -11.843 -6.336 -1.835 1.00 0.00 C ATOM 0 H MET A 36 -14.886 -7.042 -5.983 1.00 0.00 H new ATOM 0 HA MET A 36 -12.332 -6.440 -6.979 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.179 -8.735 -5.263 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.529 -8.313 -5.679 1.00 0.00 H new ATOM 0 HG2 MET A 36 -11.672 -6.220 -4.467 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.401 -6.395 -4.243 1.00 0.00 H new ATOM 0 HE1 MET A 36 -11.621 -6.586 -0.798 1.00 0.00 H new ATOM 0 HE2 MET A 36 -10.990 -5.818 -2.274 1.00 0.00 H new ATOM 0 HE3 MET A 36 -12.719 -5.689 -1.872 1.00 0.00 H new ATOM 543 N ARG A 37 -13.892 -9.015 -8.302 1.00 0.00 N ATOM 544 CA ARG A 37 -13.897 -9.989 -9.349 1.00 0.00 C ATOM 545 C ARG A 37 -13.797 -9.351 -10.691 1.00 0.00 C ATOM 546 O ARG A 37 -13.138 -9.851 -11.602 1.00 0.00 O ATOM 547 CB ARG A 37 -15.183 -10.829 -9.270 1.00 0.00 C ATOM 548 CG ARG A 37 -15.042 -11.948 -8.237 1.00 0.00 C ATOM 549 CD ARG A 37 -14.264 -13.209 -8.622 1.00 0.00 C ATOM 550 NE ARG A 37 -14.483 -14.259 -7.587 1.00 0.00 N ATOM 551 CZ ARG A 37 -14.163 -15.580 -7.705 1.00 0.00 C ATOM 552 NH1 ARG A 37 -13.493 -16.157 -8.745 1.00 0.00 N ATOM 553 NH2 ARG A 37 -14.350 -16.358 -6.598 1.00 0.00 N ATOM 0 H ARG A 37 -14.763 -9.011 -7.771 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.026 -10.630 -9.215 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -16.025 -10.189 -9.006 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.403 -11.257 -10.248 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -14.567 -11.524 -7.352 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -16.046 -12.255 -7.943 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -14.592 -13.569 -9.597 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.201 -12.982 -8.707 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.911 -13.963 -6.710 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.182 -15.586 -9.531 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -13.303 -17.159 -8.736 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.713 -15.944 -5.739 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -14.127 -17.353 -6.630 1.00 0.00 H new ATOM 567 N SER A 38 -14.416 -8.166 -10.841 1.00 0.00 N ATOM 568 CA SER A 38 -14.391 -7.414 -12.057 1.00 0.00 C ATOM 569 C SER A 38 -13.063 -6.801 -12.340 1.00 0.00 C ATOM 570 O SER A 38 -12.793 -6.461 -13.491 1.00 0.00 O ATOM 571 CB SER A 38 -15.423 -6.274 -12.024 1.00 0.00 C ATOM 572 OG SER A 38 -16.704 -6.882 -12.097 1.00 0.00 O ATOM 0 H SER A 38 -14.949 -7.718 -10.095 1.00 0.00 H new ATOM 0 HA SER A 38 -14.624 -8.135 -12.841 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.324 -5.688 -11.110 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.271 -5.590 -12.859 1.00 0.00 H new ATOM 0 HG SER A 38 -16.958 -7.217 -11.212 1.00 0.00 H new ATOM 578 N LEU A 39 -12.176 -6.627 -11.344 1.00 0.00 N ATOM 579 CA LEU A 39 -10.824 -6.167 -11.404 1.00 0.00 C ATOM 580 C LEU A 39 -9.847 -7.250 -11.706 1.00 0.00 C ATOM 581 O LEU A 39 -8.643 -7.033 -11.836 1.00 0.00 O ATOM 582 CB LEU A 39 -10.393 -5.390 -10.148 1.00 0.00 C ATOM 583 CG LEU A 39 -11.104 -4.075 -9.789 1.00 0.00 C ATOM 584 CD1 LEU A 39 -10.666 -3.418 -8.469 1.00 0.00 C ATOM 585 CD2 LEU A 39 -11.002 -3.011 -10.895 1.00 0.00 C ATOM 0 H LEU A 39 -12.444 -6.835 -10.382 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.811 -5.471 -12.243 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.499 -6.062 -9.296 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.330 -5.169 -10.249 1.00 0.00 H new ATOM 0 HG LEU A 39 -12.135 -4.409 -9.669 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.231 -2.498 -8.315 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.855 -4.102 -7.642 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.602 -3.187 -8.513 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.524 -2.107 -10.580 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.953 -2.778 -11.081 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.456 -3.392 -11.810 1.00 0.00 H new ATOM 597 N GLY A 40 -10.311 -8.504 -11.847 1.00 0.00 N ATOM 598 CA GLY A 40 -9.525 -9.609 -12.301 1.00 0.00 C ATOM 599 C GLY A 40 -8.886 -10.287 -11.138 1.00 0.00 C ATOM 600 O GLY A 40 -7.815 -10.869 -11.303 1.00 0.00 O ATOM 0 H GLY A 40 -11.276 -8.759 -11.635 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.153 -10.315 -12.845 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.760 -9.262 -12.996 1.00 0.00 H new ATOM 604 N GLN A 41 -9.589 -10.171 -9.997 1.00 0.00 N ATOM 605 CA GLN A 41 -9.066 -10.820 -8.836 1.00 0.00 C ATOM 606 C GLN A 41 -9.984 -11.910 -8.400 1.00 0.00 C ATOM 607 O GLN A 41 -11.015 -12.031 -9.060 1.00 0.00 O ATOM 608 CB GLN A 41 -8.951 -9.819 -7.673 1.00 0.00 C ATOM 609 CG GLN A 41 -7.874 -8.752 -7.878 1.00 0.00 C ATOM 610 CD GLN A 41 -7.888 -7.718 -6.761 1.00 0.00 C ATOM 611 OE1 GLN A 41 -8.559 -6.689 -6.834 1.00 0.00 O ATOM 612 NE2 GLN A 41 -7.036 -7.985 -5.735 1.00 0.00 N ATOM 0 H GLN A 41 -10.465 -9.662 -9.878 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.086 -11.223 -9.091 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.914 -9.327 -7.533 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.736 -10.366 -6.755 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -6.894 -9.227 -7.922 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.031 -8.256 -8.836 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.504 -8.856 -5.727 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -6.929 -7.315 -4.974 1.00 0.00 H new ATOM 621 N ASN A 42 -9.637 -12.673 -7.348 1.00 0.00 N ATOM 622 CA ASN A 42 -10.434 -13.754 -6.858 1.00 0.00 C ATOM 623 C ASN A 42 -10.564 -13.649 -5.377 1.00 0.00 C ATOM 624 O ASN A 42 -9.747 -14.263 -4.693 1.00 0.00 O ATOM 625 CB ASN A 42 -9.792 -15.123 -7.141 1.00 0.00 C ATOM 626 CG ASN A 42 -9.697 -15.331 -8.646 1.00 0.00 C ATOM 627 OD1 ASN A 42 -10.590 -14.958 -9.405 1.00 0.00 O ATOM 628 ND2 ASN A 42 -8.542 -15.869 -9.121 1.00 0.00 N ATOM 0 H ASN A 42 -8.774 -12.533 -6.822 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.397 -13.685 -7.365 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.800 -15.172 -6.692 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.386 -15.917 -6.689 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.402 -15.970 -10.126 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.815 -16.171 -8.472 1.00 0.00 H new ATOM 635 N PRO A 43 -11.560 -13.053 -4.793 1.00 0.00 N ATOM 636 CA PRO A 43 -11.575 -12.994 -3.360 1.00 0.00 C ATOM 637 C PRO A 43 -12.155 -14.250 -2.806 1.00 0.00 C ATOM 638 O PRO A 43 -12.763 -15.028 -3.540 1.00 0.00 O ATOM 639 CB PRO A 43 -12.478 -11.817 -2.998 1.00 0.00 C ATOM 640 CG PRO A 43 -13.242 -11.528 -4.299 1.00 0.00 C ATOM 641 CD PRO A 43 -12.367 -12.039 -5.454 1.00 0.00 C ATOM 0 HA PRO A 43 -10.570 -12.877 -2.956 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.157 -12.069 -2.183 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.898 -10.953 -2.674 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.210 -12.029 -4.297 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -13.435 -10.460 -4.404 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.964 -12.457 -6.265 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -11.755 -11.246 -5.884 1.00 0.00 H new ATOM 649 N THR A 44 -11.966 -14.523 -1.503 1.00 0.00 N ATOM 650 CA THR A 44 -12.671 -15.536 -0.780 1.00 0.00 C ATOM 651 C THR A 44 -13.687 -14.878 0.088 1.00 0.00 C ATOM 652 O THR A 44 -13.643 -13.675 0.340 1.00 0.00 O ATOM 653 CB THR A 44 -11.777 -16.330 0.126 1.00 0.00 C ATOM 654 OG1 THR A 44 -10.913 -15.532 0.922 1.00 0.00 O ATOM 655 CG2 THR A 44 -10.827 -17.215 -0.699 1.00 0.00 C ATOM 0 H THR A 44 -11.293 -14.016 -0.928 1.00 0.00 H new ATOM 0 HA THR A 44 -13.111 -16.208 -1.517 1.00 0.00 H new ATOM 0 HB THR A 44 -12.464 -16.893 0.758 1.00 0.00 H new ATOM 0 HG1 THR A 44 -10.361 -16.112 1.488 1.00 0.00 H new ATOM 0 HG21 THR A 44 -10.185 -17.785 -0.027 1.00 0.00 H new ATOM 0 HG22 THR A 44 -11.410 -17.902 -1.313 1.00 0.00 H new ATOM 0 HG23 THR A 44 -10.212 -16.587 -1.343 1.00 0.00 H new ATOM 663 N GLU A 45 -14.730 -15.683 0.358 1.00 0.00 N ATOM 664 CA GLU A 45 -15.793 -15.228 1.200 1.00 0.00 C ATOM 665 C GLU A 45 -15.404 -14.856 2.589 1.00 0.00 C ATOM 666 O GLU A 45 -15.991 -13.898 3.091 1.00 0.00 O ATOM 667 CB GLU A 45 -16.748 -16.426 1.340 1.00 0.00 C ATOM 668 CG GLU A 45 -17.586 -16.756 0.103 1.00 0.00 C ATOM 669 CD GLU A 45 -18.815 -17.543 0.536 1.00 0.00 C ATOM 670 OE1 GLU A 45 -18.652 -18.705 0.993 1.00 0.00 O ATOM 671 OE2 GLU A 45 -19.918 -16.982 0.298 1.00 0.00 O ATOM 0 H GLU A 45 -14.838 -16.632 0.001 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.200 -14.329 0.738 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.161 -17.306 1.604 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.424 -16.233 2.173 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.885 -15.839 -0.405 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.997 -17.337 -0.607 1.00 0.00 H new ATOM 678 N ALA A 46 -14.379 -15.507 3.167 1.00 0.00 N ATOM 679 CA ALA A 46 -13.970 -15.128 4.484 1.00 0.00 C ATOM 680 C ALA A 46 -13.044 -13.961 4.501 1.00 0.00 C ATOM 681 O ALA A 46 -13.018 -13.296 5.536 1.00 0.00 O ATOM 682 CB ALA A 46 -13.392 -16.406 5.115 1.00 0.00 C ATOM 0 H ALA A 46 -13.850 -16.268 2.742 1.00 0.00 H new ATOM 0 HA ALA A 46 -14.810 -14.759 5.073 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.057 -16.191 6.130 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -14.161 -17.178 5.143 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -12.548 -16.756 4.520 1.00 0.00 H new ATOM 688 N GLU A 47 -12.156 -13.829 3.500 1.00 0.00 N ATOM 689 CA GLU A 47 -11.418 -12.623 3.289 1.00 0.00 C ATOM 690 C GLU A 47 -12.277 -11.408 3.199 1.00 0.00 C ATOM 691 O GLU A 47 -12.098 -10.373 3.839 1.00 0.00 O ATOM 692 CB GLU A 47 -10.348 -12.721 2.189 1.00 0.00 C ATOM 693 CG GLU A 47 -9.291 -11.634 2.394 1.00 0.00 C ATOM 694 CD GLU A 47 -8.224 -11.805 1.322 1.00 0.00 C ATOM 695 OE1 GLU A 47 -7.626 -12.912 1.259 1.00 0.00 O ATOM 696 OE2 GLU A 47 -7.932 -10.847 0.557 1.00 0.00 O ATOM 0 H GLU A 47 -11.947 -14.568 2.829 1.00 0.00 H new ATOM 0 HA GLU A 47 -10.840 -12.489 4.204 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.880 -13.705 2.211 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.811 -12.611 1.208 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.744 -10.645 2.326 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -8.849 -11.715 3.387 1.00 0.00 H new ATOM 703 N LEU A 48 -13.360 -11.447 2.402 1.00 0.00 N ATOM 704 CA LEU A 48 -14.375 -10.459 2.207 1.00 0.00 C ATOM 705 C LEU A 48 -15.149 -10.170 3.447 1.00 0.00 C ATOM 706 O LEU A 48 -15.434 -8.991 3.649 1.00 0.00 O ATOM 707 CB LEU A 48 -15.403 -11.042 1.223 1.00 0.00 C ATOM 708 CG LEU A 48 -15.050 -10.634 -0.217 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.734 -11.469 -1.312 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.372 -9.137 -0.357 1.00 0.00 C ATOM 0 H LEU A 48 -13.542 -12.270 1.828 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.879 -9.550 1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.422 -12.129 1.307 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.402 -10.686 1.475 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.990 -10.832 -0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.424 -11.107 -2.292 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.448 -12.515 -1.204 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.816 -11.377 -1.217 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -15.135 -8.807 -1.368 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -16.432 -8.973 -0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.778 -8.569 0.359 1.00 0.00 H new ATOM 722 N GLN A 49 -15.441 -11.122 4.350 1.00 0.00 N ATOM 723 CA GLN A 49 -16.224 -10.732 5.482 1.00 0.00 C ATOM 724 C GLN A 49 -15.423 -10.186 6.614 1.00 0.00 C ATOM 725 O GLN A 49 -15.922 -9.366 7.382 1.00 0.00 O ATOM 726 CB GLN A 49 -17.049 -11.957 5.910 1.00 0.00 C ATOM 727 CG GLN A 49 -18.161 -11.584 6.893 1.00 0.00 C ATOM 728 CD GLN A 49 -19.005 -12.838 7.072 1.00 0.00 C ATOM 729 OE1 GLN A 49 -20.070 -12.923 6.462 1.00 0.00 O ATOM 730 NE2 GLN A 49 -18.545 -13.832 7.877 1.00 0.00 N ATOM 0 H GLN A 49 -15.158 -12.101 4.307 1.00 0.00 H new ATOM 0 HA GLN A 49 -16.870 -9.904 5.191 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.487 -12.425 5.028 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.391 -12.695 6.370 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.745 -11.255 7.845 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.763 -10.761 6.507 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -17.656 -13.722 8.366 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -19.088 -14.687 7.992 1.00 0.00 H new ATOM 739 N ASP A 50 -14.150 -10.618 6.671 1.00 0.00 N ATOM 740 CA ASP A 50 -13.051 -9.993 7.340 1.00 0.00 C ATOM 741 C ASP A 50 -12.932 -8.530 7.088 1.00 0.00 C ATOM 742 O ASP A 50 -12.874 -7.709 8.002 1.00 0.00 O ATOM 743 CB ASP A 50 -11.689 -10.654 7.072 1.00 0.00 C ATOM 744 CG ASP A 50 -10.705 -10.496 8.223 1.00 0.00 C ATOM 745 OD1 ASP A 50 -10.951 -10.902 9.390 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.582 -10.052 7.862 1.00 0.00 O ATOM 0 H ASP A 50 -13.867 -11.481 6.207 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.306 -10.142 8.389 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.841 -11.715 6.876 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.255 -10.222 6.170 1.00 0.00 H new ATOM 751 N MET A 51 -13.067 -8.113 5.816 1.00 0.00 N ATOM 752 CA MET A 51 -12.988 -6.756 5.371 1.00 0.00 C ATOM 753 C MET A 51 -14.012 -5.912 6.048 1.00 0.00 C ATOM 754 O MET A 51 -13.728 -4.809 6.512 1.00 0.00 O ATOM 755 CB MET A 51 -13.350 -6.702 3.878 1.00 0.00 C ATOM 756 CG MET A 51 -13.227 -5.308 3.258 1.00 0.00 C ATOM 757 SD MET A 51 -13.648 -5.245 1.490 1.00 0.00 S ATOM 758 CE MET A 51 -12.787 -3.683 1.149 1.00 0.00 C ATOM 0 H MET A 51 -13.242 -8.765 5.051 1.00 0.00 H new ATOM 0 HA MET A 51 -11.980 -6.398 5.583 1.00 0.00 H new ATOM 0 HB2 MET A 51 -12.703 -7.389 3.333 1.00 0.00 H new ATOM 0 HB3 MET A 51 -14.373 -7.057 3.749 1.00 0.00 H new ATOM 0 HG2 MET A 51 -13.877 -4.622 3.800 1.00 0.00 H new ATOM 0 HG3 MET A 51 -12.206 -4.951 3.391 1.00 0.00 H new ATOM 0 HE1 MET A 51 -13.501 -2.946 0.781 1.00 0.00 H new ATOM 0 HE2 MET A 51 -12.325 -3.315 2.065 1.00 0.00 H new ATOM 0 HE3 MET A 51 -12.017 -3.849 0.396 1.00 0.00 H new ATOM 768 N ILE A 52 -15.195 -6.522 6.242 1.00 0.00 N ATOM 769 CA ILE A 52 -16.250 -5.853 6.938 1.00 0.00 C ATOM 770 C ILE A 52 -16.139 -5.924 8.422 1.00 0.00 C ATOM 771 O ILE A 52 -16.481 -4.966 9.114 1.00 0.00 O ATOM 772 CB ILE A 52 -17.608 -6.296 6.480 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.826 -6.199 4.961 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.684 -5.476 7.212 1.00 0.00 C ATOM 775 CD1 ILE A 52 -19.271 -6.532 4.591 1.00 0.00 C ATOM 0 H ILE A 52 -15.419 -7.464 5.922 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.129 -4.802 6.674 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.684 -7.355 6.726 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.582 -5.193 4.619 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -17.149 -6.883 4.449 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.672 -5.795 6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.593 -5.633 8.287 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.551 -4.418 6.987 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -19.397 -6.456 3.511 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -19.504 -7.547 4.913 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.944 -5.831 5.085 1.00 0.00 H new ATOM 787 N ASN A 53 -15.749 -7.041 9.062 1.00 0.00 N ATOM 788 CA ASN A 53 -15.612 -7.268 10.467 1.00 0.00 C ATOM 789 C ASN A 53 -14.601 -6.364 11.084 1.00 0.00 C ATOM 790 O ASN A 53 -14.688 -6.044 12.268 1.00 0.00 O ATOM 791 CB ASN A 53 -15.198 -8.728 10.715 1.00 0.00 C ATOM 792 CG ASN A 53 -15.295 -9.175 12.167 1.00 0.00 C ATOM 793 OD1 ASN A 53 -16.314 -9.433 12.804 1.00 0.00 O ATOM 794 ND2 ASN A 53 -14.050 -9.232 12.711 1.00 0.00 N ATOM 0 H ASN A 53 -15.503 -7.877 8.532 1.00 0.00 H new ATOM 0 HA ASN A 53 -16.577 -7.060 10.928 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.825 -9.379 10.105 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -14.172 -8.864 10.374 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -13.932 -9.498 13.689 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -13.234 -9.009 12.141 1.00 0.00 H new ATOM 801 N GLU A 54 -13.589 -5.904 10.327 1.00 0.00 N ATOM 802 CA GLU A 54 -12.730 -4.871 10.817 1.00 0.00 C ATOM 803 C GLU A 54 -13.404 -3.556 11.008 1.00 0.00 C ATOM 804 O GLU A 54 -13.108 -2.771 11.907 1.00 0.00 O ATOM 805 CB GLU A 54 -11.633 -4.645 9.763 1.00 0.00 C ATOM 806 CG GLU A 54 -10.627 -5.798 9.786 1.00 0.00 C ATOM 807 CD GLU A 54 -9.482 -5.478 8.835 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.288 -4.374 8.261 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.710 -6.449 8.611 1.00 0.00 O ATOM 0 H GLU A 54 -13.367 -6.241 9.390 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.363 -5.203 11.788 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.082 -4.565 8.773 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.121 -3.703 9.958 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.247 -5.945 10.797 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.113 -6.728 9.490 1.00 0.00 H new ATOM 816 N VAL A 55 -14.398 -3.220 10.165 1.00 0.00 N ATOM 817 CA VAL A 55 -15.027 -1.936 10.141 1.00 0.00 C ATOM 818 C VAL A 55 -16.360 -1.825 10.798 1.00 0.00 C ATOM 819 O VAL A 55 -16.890 -0.747 11.062 1.00 0.00 O ATOM 820 CB VAL A 55 -15.155 -1.193 8.845 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.818 -0.623 8.343 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.846 -2.072 7.789 1.00 0.00 C ATOM 0 H VAL A 55 -14.777 -3.868 9.474 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.244 -1.460 10.731 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.786 -0.324 9.031 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.977 -0.097 7.402 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -13.417 0.070 9.083 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -13.110 -1.438 8.188 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.931 -1.518 6.854 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.256 -2.974 7.624 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.841 -2.348 8.139 1.00 0.00 H new ATOM 832 N ASP A 56 -17.077 -2.901 11.165 1.00 0.00 N ATOM 833 CA ASP A 56 -18.476 -2.903 11.462 1.00 0.00 C ATOM 834 C ASP A 56 -18.706 -2.822 12.932 1.00 0.00 C ATOM 835 O ASP A 56 -19.213 -3.744 13.570 1.00 0.00 O ATOM 836 CB ASP A 56 -19.109 -4.180 10.884 1.00 0.00 C ATOM 837 CG ASP A 56 -20.627 -4.293 10.861 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.334 -3.297 10.552 1.00 0.00 O ATOM 839 OD2 ASP A 56 -21.083 -5.456 11.023 1.00 0.00 O ATOM 0 H ASP A 56 -16.655 -3.825 11.260 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.941 -2.029 11.007 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.753 -4.292 9.860 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.722 -5.027 11.450 1.00 0.00 H new ATOM 844 N ALA A 57 -18.423 -1.652 13.533 1.00 0.00 N ATOM 845 CA ALA A 57 -18.656 -1.403 14.922 1.00 0.00 C ATOM 846 C ALA A 57 -20.067 -0.997 15.175 1.00 0.00 C ATOM 847 O ALA A 57 -20.625 -0.945 16.270 1.00 0.00 O ATOM 848 CB ALA A 57 -17.608 -0.349 15.316 1.00 0.00 C ATOM 0 H ALA A 57 -18.020 -0.856 13.038 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.540 -2.293 15.541 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.720 -0.102 16.372 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.608 -0.746 15.140 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.752 0.549 14.716 1.00 0.00 H new ATOM 854 N ASP A 58 -20.813 -0.599 14.128 1.00 0.00 N ATOM 855 CA ASP A 58 -22.186 -0.202 14.118 1.00 0.00 C ATOM 856 C ASP A 58 -23.013 -1.426 14.313 1.00 0.00 C ATOM 857 O ASP A 58 -23.956 -1.513 15.098 1.00 0.00 O ATOM 858 CB ASP A 58 -22.593 0.559 12.845 1.00 0.00 C ATOM 859 CG ASP A 58 -22.308 -0.269 11.599 1.00 0.00 C ATOM 860 OD1 ASP A 58 -21.177 -0.813 11.493 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.233 -0.503 10.776 1.00 0.00 O ATOM 0 H ASP A 58 -20.408 -0.552 13.193 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.352 0.508 14.928 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.654 0.805 12.888 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.049 1.502 12.791 1.00 0.00 H new ATOM 866 N GLY A 59 -22.576 -2.474 13.591 1.00 0.00 N ATOM 867 CA GLY A 59 -23.097 -3.801 13.485 1.00 0.00 C ATOM 868 C GLY A 59 -24.275 -3.941 12.583 1.00 0.00 C ATOM 869 O GLY A 59 -25.290 -4.509 12.982 1.00 0.00 O ATOM 0 H GLY A 59 -21.747 -2.371 13.006 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.305 -4.460 13.129 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.376 -4.147 14.480 1.00 0.00 H new ATOM 873 N ASN A 60 -24.311 -3.460 11.327 1.00 0.00 N ATOM 874 CA ASN A 60 -25.280 -3.825 10.341 1.00 0.00 C ATOM 875 C ASN A 60 -24.933 -4.959 9.439 1.00 0.00 C ATOM 876 O ASN A 60 -25.713 -5.323 8.561 1.00 0.00 O ATOM 877 CB ASN A 60 -25.745 -2.608 9.523 1.00 0.00 C ATOM 878 CG ASN A 60 -24.621 -1.917 8.763 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.561 -2.524 8.621 1.00 0.00 O ATOM 880 ND2 ASN A 60 -24.893 -0.721 8.177 1.00 0.00 N ATOM 0 H ASN A 60 -23.630 -2.783 10.983 1.00 0.00 H new ATOM 0 HA ASN A 60 -26.101 -4.210 10.945 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.508 -2.928 8.814 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.215 -1.888 10.194 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -24.197 -0.276 7.579 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -25.793 -0.269 8.335 1.00 0.00 H new ATOM 887 N GLY A 61 -23.683 -5.437 9.581 1.00 0.00 N ATOM 888 CA GLY A 61 -23.060 -6.560 8.951 1.00 0.00 C ATOM 889 C GLY A 61 -22.471 -6.147 7.647 1.00 0.00 C ATOM 890 O GLY A 61 -21.554 -6.806 7.159 1.00 0.00 O ATOM 0 H GLY A 61 -23.033 -4.976 10.217 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -22.283 -6.967 9.598 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -23.792 -7.353 8.795 1.00 0.00 H new ATOM 894 N THR A 62 -23.028 -5.108 6.999 1.00 0.00 N ATOM 895 CA THR A 62 -22.636 -4.700 5.686 1.00 0.00 C ATOM 896 C THR A 62 -21.766 -3.493 5.759 1.00 0.00 C ATOM 897 O THR A 62 -21.600 -2.895 6.821 1.00 0.00 O ATOM 898 CB THR A 62 -23.792 -4.440 4.766 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.749 -3.542 5.308 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.586 -5.755 4.681 1.00 0.00 C ATOM 0 H THR A 62 -23.772 -4.536 7.400 1.00 0.00 H new ATOM 0 HA THR A 62 -22.083 -5.538 5.261 1.00 0.00 H new ATOM 0 HB THR A 62 -23.377 -4.049 3.837 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.637 -3.756 4.953 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.443 -5.621 4.021 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.944 -6.543 4.287 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.935 -6.034 5.675 1.00 0.00 H new ATOM 908 N ILE A 63 -21.187 -3.107 4.607 1.00 0.00 N ATOM 909 CA ILE A 63 -20.441 -1.892 4.498 1.00 0.00 C ATOM 910 C ILE A 63 -21.366 -0.812 4.053 1.00 0.00 C ATOM 911 O ILE A 63 -22.013 -0.852 3.007 1.00 0.00 O ATOM 912 CB ILE A 63 -19.252 -2.065 3.600 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.033 -2.417 4.469 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.844 -0.734 2.945 1.00 0.00 C ATOM 915 CD1 ILE A 63 -16.723 -2.759 3.762 1.00 0.00 C ATOM 0 H ILE A 63 -21.237 -3.644 3.742 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.028 -1.609 5.466 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.518 -2.819 2.859 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -17.843 -1.575 5.135 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -18.305 -3.265 5.097 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.980 -0.895 2.301 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.674 -0.352 2.350 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.589 -0.010 3.719 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -15.957 -2.984 4.504 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -16.872 -3.627 3.119 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.404 -1.910 3.157 1.00 0.00 H new ATOM 927 N ASP A 64 -21.493 0.313 4.779 1.00 0.00 N ATOM 928 CA ASP A 64 -22.319 1.465 4.595 1.00 0.00 C ATOM 929 C ASP A 64 -21.491 2.647 4.224 1.00 0.00 C ATOM 930 O ASP A 64 -20.265 2.555 4.219 1.00 0.00 O ATOM 931 CB ASP A 64 -23.180 1.718 5.844 1.00 0.00 C ATOM 932 CG ASP A 64 -22.455 1.632 7.179 1.00 0.00 C ATOM 933 OD1 ASP A 64 -22.106 0.523 7.664 1.00 0.00 O ATOM 934 OD2 ASP A 64 -22.286 2.690 7.842 1.00 0.00 O ATOM 0 H ASP A 64 -20.928 0.424 5.621 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.005 1.283 3.768 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -23.628 2.708 5.759 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -23.998 0.998 5.850 1.00 0.00 H new ATOM 939 N PHE A 65 -22.034 3.800 3.791 1.00 0.00 N ATOM 940 CA PHE A 65 -21.272 4.842 3.176 1.00 0.00 C ATOM 941 C PHE A 65 -20.328 5.639 4.008 1.00 0.00 C ATOM 942 O PHE A 65 -19.238 5.887 3.493 1.00 0.00 O ATOM 943 CB PHE A 65 -22.132 5.797 2.331 1.00 0.00 C ATOM 944 CG PHE A 65 -21.350 6.816 1.576 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.349 6.460 0.702 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.691 8.147 1.608 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.566 7.344 -0.002 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.934 9.068 0.924 1.00 0.00 C ATOM 949 CZ PHE A 65 -19.858 8.677 0.161 1.00 0.00 C ATOM 0 H PHE A 65 -23.028 4.013 3.871 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.619 4.233 2.550 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.720 5.210 1.625 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.837 6.308 2.986 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.164 5.406 0.558 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.554 8.469 2.171 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -18.767 7.010 -0.647 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.188 10.116 0.987 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.238 9.423 -0.313 1.00 0.00 H new ATOM 959 N PRO A 66 -20.429 6.085 5.225 1.00 0.00 N ATOM 960 CA PRO A 66 -19.298 6.592 5.947 1.00 0.00 C ATOM 961 C PRO A 66 -18.275 5.560 6.275 1.00 0.00 C ATOM 962 O PRO A 66 -17.083 5.860 6.227 1.00 0.00 O ATOM 963 CB PRO A 66 -19.898 7.195 7.215 1.00 0.00 C ATOM 964 CG PRO A 66 -21.256 6.515 7.451 1.00 0.00 C ATOM 965 CD PRO A 66 -21.634 6.043 6.039 1.00 0.00 C ATOM 0 HA PRO A 66 -18.750 7.313 5.341 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -19.236 7.035 8.066 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.022 8.272 7.106 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.178 5.683 8.151 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -21.992 7.207 7.859 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.041 5.032 6.069 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.406 6.685 5.614 1.00 0.00 H new ATOM 973 N GLU A 67 -18.753 4.340 6.580 1.00 0.00 N ATOM 974 CA GLU A 67 -17.993 3.161 6.858 1.00 0.00 C ATOM 975 C GLU A 67 -17.102 2.788 5.723 1.00 0.00 C ATOM 976 O GLU A 67 -15.896 2.592 5.863 1.00 0.00 O ATOM 977 CB GLU A 67 -18.885 1.974 7.258 1.00 0.00 C ATOM 978 CG GLU A 67 -17.989 0.920 7.911 1.00 0.00 C ATOM 979 CD GLU A 67 -19.009 -0.034 8.516 1.00 0.00 C ATOM 980 OE1 GLU A 67 -19.668 0.348 9.519 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.268 -1.163 8.018 1.00 0.00 O ATOM 0 H GLU A 67 -19.756 4.166 6.636 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.362 3.404 7.713 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.663 2.296 7.950 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -19.387 1.561 6.383 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.347 0.423 7.183 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -17.336 1.353 8.669 1.00 0.00 H new ATOM 988 N PHE A 68 -17.644 2.898 4.497 1.00 0.00 N ATOM 989 CA PHE A 68 -16.948 2.928 3.248 1.00 0.00 C ATOM 990 C PHE A 68 -15.960 4.036 3.124 1.00 0.00 C ATOM 991 O PHE A 68 -14.795 3.857 2.771 1.00 0.00 O ATOM 992 CB PHE A 68 -17.947 2.964 2.079 1.00 0.00 C ATOM 993 CG PHE A 68 -17.285 2.778 0.758 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.761 1.596 0.291 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.153 3.945 0.042 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.263 1.578 -0.991 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.635 3.921 -1.231 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.164 2.731 -1.734 1.00 0.00 C ATOM 0 H PHE A 68 -18.653 2.972 4.371 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.365 2.008 3.211 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.695 2.184 2.220 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.476 3.917 2.086 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.741 0.711 0.910 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.457 4.883 0.482 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.944 0.641 -1.422 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.599 4.822 -1.826 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.715 2.702 -2.716 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.345 5.279 3.463 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.634 6.487 3.181 1.00 0.00 C ATOM 1010 C LEU A 69 -14.395 6.489 4.009 1.00 0.00 C ATOM 1011 O LEU A 69 -13.296 6.884 3.622 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.484 7.731 3.491 1.00 0.00 C ATOM 1013 CG LEU A 69 -15.798 9.087 3.252 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -15.291 9.239 1.808 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.814 10.223 3.461 1.00 0.00 C ATOM 0 H LEU A 69 -17.214 5.451 3.969 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.391 6.526 2.119 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.388 7.691 2.884 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.798 7.683 4.534 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.962 9.135 3.949 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -14.815 10.212 1.690 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -14.568 8.453 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.131 9.160 1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -16.326 11.183 3.291 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -17.640 10.106 2.759 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -17.197 10.186 4.481 1.00 0.00 H new ATOM 1027 N THR A 70 -14.561 5.957 5.233 1.00 0.00 N ATOM 1028 CA THR A 70 -13.510 5.674 6.160 1.00 0.00 C ATOM 1029 C THR A 70 -12.470 4.730 5.662 1.00 0.00 C ATOM 1030 O THR A 70 -11.285 5.037 5.782 1.00 0.00 O ATOM 1031 CB THR A 70 -13.984 5.258 7.521 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.792 6.246 8.144 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.849 4.963 8.516 1.00 0.00 C ATOM 0 H THR A 70 -15.482 5.711 5.596 1.00 0.00 H new ATOM 0 HA THR A 70 -13.028 6.646 6.263 1.00 0.00 H new ATOM 0 HB THR A 70 -14.549 4.349 7.314 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.641 6.326 7.662 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.274 4.669 9.476 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.229 4.154 8.131 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.239 5.857 8.648 1.00 0.00 H new ATOM 1041 N MET A 71 -12.866 3.599 5.051 1.00 0.00 N ATOM 1042 CA MET A 71 -11.873 2.762 4.452 1.00 0.00 C ATOM 1043 C MET A 71 -11.242 3.309 3.218 1.00 0.00 C ATOM 1044 O MET A 71 -10.054 3.048 3.033 1.00 0.00 O ATOM 1045 CB MET A 71 -12.219 1.273 4.288 1.00 0.00 C ATOM 1046 CG MET A 71 -13.432 0.930 3.420 1.00 0.00 C ATOM 1047 SD MET A 71 -13.603 -0.852 3.102 1.00 0.00 S ATOM 1048 CE MET A 71 -13.658 -1.549 4.778 1.00 0.00 C ATOM 0 H MET A 71 -13.829 3.274 4.972 1.00 0.00 H new ATOM 0 HA MET A 71 -11.118 2.787 5.238 1.00 0.00 H new ATOM 0 HB2 MET A 71 -11.349 0.768 3.868 1.00 0.00 H new ATOM 0 HB3 MET A 71 -12.383 0.853 5.280 1.00 0.00 H new ATOM 0 HG2 MET A 71 -14.336 1.294 3.909 1.00 0.00 H new ATOM 0 HG3 MET A 71 -13.351 1.456 2.469 1.00 0.00 H new ATOM 0 HE1 MET A 71 -13.832 -2.623 4.720 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.709 -1.362 5.281 1.00 0.00 H new ATOM 0 HE3 MET A 71 -14.466 -1.081 5.341 1.00 0.00 H new ATOM 1058 N MET A 72 -11.901 4.196 2.452 1.00 0.00 N ATOM 1059 CA MET A 72 -11.194 4.854 1.397 1.00 0.00 C ATOM 1060 C MET A 72 -10.212 5.857 1.899 1.00 0.00 C ATOM 1061 O MET A 72 -9.075 5.766 1.439 1.00 0.00 O ATOM 1062 CB MET A 72 -12.102 5.499 0.337 1.00 0.00 C ATOM 1063 CG MET A 72 -13.010 4.526 -0.419 1.00 0.00 C ATOM 1064 SD MET A 72 -12.072 3.345 -1.434 1.00 0.00 S ATOM 1065 CE MET A 72 -12.344 1.833 -0.466 1.00 0.00 C ATOM 0 H MET A 72 -12.883 4.451 2.554 1.00 0.00 H new ATOM 0 HA MET A 72 -10.650 4.047 0.906 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.725 6.250 0.823 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.476 6.023 -0.385 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.625 3.978 0.295 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.690 5.090 -1.058 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.895 0.985 -0.983 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.886 1.943 0.517 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.414 1.663 -0.350 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.502 6.689 2.915 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.640 7.686 3.469 1.00 0.00 C ATOM 1077 C ALA A 73 -8.412 7.100 4.076 1.00 0.00 C ATOM 1078 O ALA A 73 -7.313 7.652 4.071 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.377 8.553 4.504 1.00 0.00 C ATOM 0 H ALA A 73 -11.408 6.661 3.383 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.330 8.319 2.637 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.693 9.301 4.906 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.220 9.052 4.026 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.741 7.922 5.315 1.00 0.00 H new ATOM 1234 N GLU A 83 1.415 9.302 -8.811 1.00 0.00 N ATOM 1235 CA GLU A 83 1.385 10.689 -9.157 1.00 0.00 C ATOM 1236 C GLU A 83 1.886 10.981 -10.530 1.00 0.00 C ATOM 1237 O GLU A 83 1.459 12.005 -11.062 1.00 0.00 O ATOM 1238 CB GLU A 83 2.030 11.600 -8.099 1.00 0.00 C ATOM 1239 CG GLU A 83 1.065 11.673 -6.914 1.00 0.00 C ATOM 1240 CD GLU A 83 1.599 12.604 -5.834 1.00 0.00 C ATOM 1241 OE1 GLU A 83 2.356 12.090 -4.967 1.00 0.00 O ATOM 1242 OE2 GLU A 83 1.514 13.850 -5.997 1.00 0.00 O ATOM 0 HA GLU A 83 0.324 10.937 -9.169 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.995 11.202 -7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 83 2.213 12.594 -8.507 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.091 12.025 -7.254 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.916 10.676 -6.499 1.00 0.00 H new ATOM 1249 N GLU A 84 2.610 10.057 -11.186 1.00 0.00 N ATOM 1250 CA GLU A 84 2.911 10.138 -12.581 1.00 0.00 C ATOM 1251 C GLU A 84 1.648 10.126 -13.373 1.00 0.00 C ATOM 1252 O GLU A 84 1.348 10.955 -14.230 1.00 0.00 O ATOM 1253 CB GLU A 84 3.807 8.967 -13.017 1.00 0.00 C ATOM 1254 CG GLU A 84 4.372 9.127 -14.430 1.00 0.00 C ATOM 1255 CD GLU A 84 5.211 7.965 -14.942 1.00 0.00 C ATOM 1256 OE1 GLU A 84 5.981 7.323 -14.178 1.00 0.00 O ATOM 1257 OE2 GLU A 84 5.195 7.638 -16.159 1.00 0.00 O ATOM 0 H GLU A 84 2.997 9.229 -10.733 1.00 0.00 H new ATOM 0 HA GLU A 84 3.447 11.070 -12.763 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.633 8.869 -12.312 1.00 0.00 H new ATOM 0 HB3 GLU A 84 3.233 8.042 -12.966 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.541 9.282 -15.118 1.00 0.00 H new ATOM 0 HG3 GLU A 84 4.981 10.031 -14.458 1.00 0.00 H new ATOM 1264 N ILE A 85 0.882 9.041 -13.165 1.00 0.00 N ATOM 1265 CA ILE A 85 -0.342 8.690 -13.816 1.00 0.00 C ATOM 1266 C ILE A 85 -1.489 9.587 -13.497 1.00 0.00 C ATOM 1267 O ILE A 85 -2.375 9.702 -14.342 1.00 0.00 O ATOM 1268 CB ILE A 85 -0.771 7.267 -13.616 1.00 0.00 C ATOM 1269 CG1 ILE A 85 -1.454 6.856 -12.300 1.00 0.00 C ATOM 1270 CG2 ILE A 85 0.485 6.431 -13.915 1.00 0.00 C ATOM 1271 CD1 ILE A 85 -1.337 5.373 -11.950 1.00 0.00 C ATOM 0 H ILE A 85 1.148 8.342 -12.472 1.00 0.00 H new ATOM 0 HA ILE A 85 -0.081 8.823 -14.866 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.611 7.091 -14.288 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.025 7.441 -11.487 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.510 7.118 -12.359 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.256 5.373 -13.791 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.809 6.615 -14.939 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.282 6.713 -13.227 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -1.849 5.180 -11.007 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.794 4.776 -12.739 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.285 5.104 -11.854 1.00 0.00 H new ATOM 1283 N ARG A 86 -1.560 10.063 -12.241 1.00 0.00 N ATOM 1284 CA ARG A 86 -2.566 11.041 -11.966 1.00 0.00 C ATOM 1285 C ARG A 86 -2.372 12.349 -12.652 1.00 0.00 C ATOM 1286 O ARG A 86 -3.295 12.918 -13.234 1.00 0.00 O ATOM 1287 CB ARG A 86 -2.613 11.224 -10.440 1.00 0.00 C ATOM 1288 CG ARG A 86 -3.379 10.023 -9.880 1.00 0.00 C ATOM 1289 CD ARG A 86 -3.704 10.048 -8.386 1.00 0.00 C ATOM 1290 NE ARG A 86 -4.344 8.762 -7.991 1.00 0.00 N ATOM 1291 CZ ARG A 86 -5.701 8.613 -8.002 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -6.684 9.468 -8.407 1.00 0.00 N ATOM 1293 NH2 ARG A 86 -6.141 7.419 -7.508 1.00 0.00 N ATOM 0 H ARG A 86 -0.962 9.793 -11.460 1.00 0.00 H new ATOM 0 HA ARG A 86 -3.511 10.673 -12.365 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.607 11.270 -10.024 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.110 12.158 -10.177 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.316 9.931 -10.430 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -2.799 9.124 -10.086 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.793 10.205 -7.808 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.371 10.881 -8.163 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.757 7.978 -7.707 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -6.440 10.388 -8.773 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -7.662 9.187 -8.343 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -5.470 6.728 -7.171 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -7.140 7.217 -7.476 1.00 0.00 H new ATOM 1307 N GLU A 87 -1.175 12.953 -12.752 1.00 0.00 N ATOM 1308 CA GLU A 87 -1.004 14.145 -13.524 1.00 0.00 C ATOM 1309 C GLU A 87 -0.829 13.849 -14.974 1.00 0.00 C ATOM 1310 O GLU A 87 -1.151 14.688 -15.814 1.00 0.00 O ATOM 1311 CB GLU A 87 0.082 14.994 -12.842 1.00 0.00 C ATOM 1312 CG GLU A 87 0.639 16.080 -13.765 1.00 0.00 C ATOM 1313 CD GLU A 87 1.720 16.902 -13.078 1.00 0.00 C ATOM 1314 OE1 GLU A 87 2.601 16.363 -12.356 1.00 0.00 O ATOM 1315 OE2 GLU A 87 1.717 18.155 -13.206 1.00 0.00 O ATOM 0 H GLU A 87 -0.325 12.617 -12.299 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.905 14.759 -13.537 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -0.333 15.459 -11.947 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.895 14.345 -12.517 1.00 0.00 H new ATOM 0 HG2 GLU A 87 1.048 15.619 -14.664 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.170 16.737 -14.084 1.00 0.00 H new ATOM 1322 N ALA A 88 -0.524 12.615 -15.412 1.00 0.00 N ATOM 1323 CA ALA A 88 -0.664 12.290 -16.798 1.00 0.00 C ATOM 1324 C ALA A 88 -2.095 12.263 -17.213 1.00 0.00 C ATOM 1325 O ALA A 88 -2.461 12.863 -18.222 1.00 0.00 O ATOM 1326 CB ALA A 88 0.087 10.977 -17.073 1.00 0.00 C ATOM 0 H ALA A 88 -0.187 11.855 -14.821 1.00 0.00 H new ATOM 0 HA ALA A 88 -0.213 13.068 -17.415 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -0.011 10.716 -18.127 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.141 11.102 -16.826 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -0.336 10.181 -16.461 1.00 0.00 H new ATOM 1332 N PHE A 89 -3.005 11.740 -16.371 1.00 0.00 N ATOM 1333 CA PHE A 89 -4.404 11.962 -16.566 1.00 0.00 C ATOM 1334 C PHE A 89 -4.931 13.356 -16.572 1.00 0.00 C ATOM 1335 O PHE A 89 -5.699 13.752 -17.448 1.00 0.00 O ATOM 1336 CB PHE A 89 -5.204 11.277 -15.446 1.00 0.00 C ATOM 1337 CG PHE A 89 -6.593 10.883 -15.814 1.00 0.00 C ATOM 1338 CD1 PHE A 89 -7.591 11.828 -15.768 1.00 0.00 C ATOM 1339 CD2 PHE A 89 -6.891 9.630 -16.295 1.00 0.00 C ATOM 1340 CE1 PHE A 89 -8.855 11.533 -16.221 1.00 0.00 C ATOM 1341 CE2 PHE A 89 -8.170 9.291 -16.670 1.00 0.00 C ATOM 1342 CZ PHE A 89 -9.132 10.273 -16.696 1.00 0.00 C ATOM 0 H PHE A 89 -2.774 11.167 -15.560 1.00 0.00 H new ATOM 0 HA PHE A 89 -4.526 11.570 -17.576 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -4.663 10.387 -15.126 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.248 11.949 -14.589 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -7.380 12.811 -15.373 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -6.103 8.896 -16.380 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -9.627 12.288 -16.204 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -8.414 8.274 -16.939 1.00 0.00 H new ATOM 0 HZ PHE A 89 -10.112 10.053 -17.092 1.00 0.00 H new ATOM 1352 N ARG A 90 -4.516 14.197 -15.608 1.00 0.00 N ATOM 1353 CA ARG A 90 -4.838 15.587 -15.504 1.00 0.00 C ATOM 1354 C ARG A 90 -4.407 16.432 -16.653 1.00 0.00 C ATOM 1355 O ARG A 90 -5.062 17.409 -17.013 1.00 0.00 O ATOM 1356 CB ARG A 90 -4.225 16.173 -14.221 1.00 0.00 C ATOM 1357 CG ARG A 90 -4.518 17.636 -13.885 1.00 0.00 C ATOM 1358 CD ARG A 90 -5.935 17.910 -13.375 1.00 0.00 C ATOM 1359 NE ARG A 90 -6.756 18.302 -14.556 1.00 0.00 N ATOM 1360 CZ ARG A 90 -8.014 18.828 -14.496 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -8.654 18.985 -13.301 1.00 0.00 N ATOM 1362 NH2 ARG A 90 -8.638 19.275 -15.625 1.00 0.00 N ATOM 0 H ARG A 90 -3.913 13.883 -14.848 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.928 15.615 -15.493 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -4.563 15.564 -13.382 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -3.143 16.056 -14.285 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.805 17.970 -13.131 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.345 18.240 -14.776 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.350 17.024 -12.894 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.929 18.704 -12.629 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.346 18.167 -15.480 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -8.192 18.708 -12.435 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.594 19.380 -13.274 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.164 19.218 -16.526 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -9.578 19.666 -15.567 1.00 0.00 H new ATOM 1376 N VAL A 91 -3.354 15.992 -17.366 1.00 0.00 N ATOM 1377 CA VAL A 91 -2.744 16.608 -18.503 1.00 0.00 C ATOM 1378 C VAL A 91 -3.675 16.425 -19.651 1.00 0.00 C ATOM 1379 O VAL A 91 -3.866 17.286 -20.509 1.00 0.00 O ATOM 1380 CB VAL A 91 -1.344 16.170 -18.817 1.00 0.00 C ATOM 1381 CG1 VAL A 91 -0.949 16.322 -20.296 1.00 0.00 C ATOM 1382 CG2 VAL A 91 -0.443 17.087 -17.973 1.00 0.00 C ATOM 0 H VAL A 91 -2.886 15.120 -17.120 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.596 17.663 -18.272 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.246 15.107 -18.598 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.077 15.983 -20.435 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -1.616 15.722 -20.914 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.028 17.369 -20.588 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.602 16.830 -18.146 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.613 18.126 -18.257 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.678 16.956 -16.917 1.00 0.00 H new ATOM 1392 N PHE A 92 -4.396 15.300 -19.800 1.00 0.00 N ATOM 1393 CA PHE A 92 -5.299 15.084 -20.888 1.00 0.00 C ATOM 1394 C PHE A 92 -6.651 15.670 -20.667 1.00 0.00 C ATOM 1395 O PHE A 92 -7.102 16.401 -21.547 1.00 0.00 O ATOM 1396 CB PHE A 92 -5.455 13.577 -21.156 1.00 0.00 C ATOM 1397 CG PHE A 92 -4.266 12.845 -21.675 1.00 0.00 C ATOM 1398 CD1 PHE A 92 -3.967 13.073 -22.998 1.00 0.00 C ATOM 1399 CD2 PHE A 92 -3.602 11.822 -21.039 1.00 0.00 C ATOM 1400 CE1 PHE A 92 -3.054 12.317 -23.694 1.00 0.00 C ATOM 1401 CE2 PHE A 92 -2.646 11.072 -21.682 1.00 0.00 C ATOM 1402 CZ PHE A 92 -2.404 11.314 -23.014 1.00 0.00 C ATOM 0 H PHE A 92 -4.350 14.519 -19.146 1.00 0.00 H new ATOM 0 HA PHE A 92 -4.858 15.592 -21.746 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.764 13.100 -20.226 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.269 13.444 -21.868 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.470 13.879 -23.511 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.838 11.602 -20.008 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -2.854 12.504 -24.739 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -2.096 10.308 -21.152 1.00 0.00 H new ATOM 0 HZ PHE A 92 -1.686 10.701 -23.539 1.00 0.00 H new ATOM 1412 N ASP A 93 -7.305 15.433 -19.516 1.00 0.00 N ATOM 1413 CA ASP A 93 -8.537 15.973 -19.031 1.00 0.00 C ATOM 1414 C ASP A 93 -8.543 17.463 -19.030 1.00 0.00 C ATOM 1415 O ASP A 93 -7.820 18.083 -18.252 1.00 0.00 O ATOM 1416 CB ASP A 93 -9.031 15.307 -17.736 1.00 0.00 C ATOM 1417 CG ASP A 93 -10.543 15.338 -17.564 1.00 0.00 C ATOM 1418 OD1 ASP A 93 -11.293 15.803 -18.464 1.00 0.00 O ATOM 1419 OD2 ASP A 93 -10.971 14.951 -16.444 1.00 0.00 O ATOM 0 H ASP A 93 -6.914 14.776 -18.841 1.00 0.00 H new ATOM 0 HA ASP A 93 -9.307 15.701 -19.754 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -8.695 14.270 -17.721 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -8.568 15.804 -16.884 1.00 0.00 H new ATOM 1424 N LYS A 94 -9.169 18.046 -20.068 1.00 0.00 N ATOM 1425 CA LYS A 94 -9.275 19.437 -20.385 1.00 0.00 C ATOM 1426 C LYS A 94 -10.239 20.128 -19.483 1.00 0.00 C ATOM 1427 O LYS A 94 -9.863 21.043 -18.753 1.00 0.00 O ATOM 1428 CB LYS A 94 -9.673 19.621 -21.859 1.00 0.00 C ATOM 1429 CG LYS A 94 -9.755 21.075 -22.327 1.00 0.00 C ATOM 1430 CD LYS A 94 -8.356 21.584 -22.681 1.00 0.00 C ATOM 1431 CE LYS A 94 -7.805 21.300 -24.080 1.00 0.00 C ATOM 1432 NZ LYS A 94 -6.441 21.869 -24.170 1.00 0.00 N ATOM 0 H LYS A 94 -9.654 17.476 -20.761 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.298 19.894 -20.230 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -8.952 19.094 -22.484 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.641 19.147 -22.021 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.410 21.151 -23.195 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -10.190 21.695 -21.543 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -8.350 22.664 -22.536 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -7.658 21.162 -21.958 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -7.781 20.226 -24.267 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -8.451 21.742 -24.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.241 22.136 -25.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.375 22.711 -23.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.748 21.160 -23.855 1.00 0.00 H new ATOM 1446 N ASP A 95 -11.494 19.645 -19.455 1.00 0.00 N ATOM 1447 CA ASP A 95 -12.580 20.126 -18.658 1.00 0.00 C ATOM 1448 C ASP A 95 -12.494 19.748 -17.219 1.00 0.00 C ATOM 1449 O ASP A 95 -13.047 20.408 -16.341 1.00 0.00 O ATOM 1450 CB ASP A 95 -13.875 19.806 -19.424 1.00 0.00 C ATOM 1451 CG ASP A 95 -14.248 18.354 -19.687 1.00 0.00 C ATOM 1452 OD1 ASP A 95 -14.164 17.559 -18.713 1.00 0.00 O ATOM 1453 OD2 ASP A 95 -14.500 17.833 -20.806 1.00 0.00 O ATOM 0 H ASP A 95 -11.770 18.854 -20.037 1.00 0.00 H new ATOM 0 HA ASP A 95 -12.546 21.209 -18.536 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -14.700 20.262 -18.876 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -13.817 20.309 -20.389 1.00 0.00 H new ATOM 1458 N GLY A 96 -11.823 18.611 -16.963 1.00 0.00 N ATOM 1459 CA GLY A 96 -11.645 18.280 -15.584 1.00 0.00 C ATOM 1460 C GLY A 96 -12.653 17.483 -14.829 1.00 0.00 C ATOM 1461 O GLY A 96 -12.624 17.312 -13.612 1.00 0.00 O ATOM 0 H GLY A 96 -11.431 17.966 -17.649 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.699 17.744 -15.509 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.522 19.221 -15.048 1.00 0.00 H new ATOM 1465 N ASN A 97 -13.671 17.047 -15.593 1.00 0.00 N ATOM 1466 CA ASN A 97 -14.758 16.220 -15.168 1.00 0.00 C ATOM 1467 C ASN A 97 -14.505 14.834 -14.684 1.00 0.00 C ATOM 1468 O ASN A 97 -15.458 14.243 -14.178 1.00 0.00 O ATOM 1469 CB ASN A 97 -15.874 16.090 -16.218 1.00 0.00 C ATOM 1470 CG ASN A 97 -15.661 15.342 -17.526 1.00 0.00 C ATOM 1471 OD1 ASN A 97 -14.600 14.832 -17.880 1.00 0.00 O ATOM 1472 ND2 ASN A 97 -16.811 15.278 -18.249 1.00 0.00 N ATOM 0 H ASN A 97 -13.738 17.292 -16.581 1.00 0.00 H new ATOM 0 HA ASN A 97 -15.031 16.805 -14.290 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -16.722 15.620 -15.720 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -16.180 17.103 -16.480 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -16.825 14.785 -19.142 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -17.659 15.723 -17.899 1.00 0.00 H new ATOM 1479 N GLY A 98 -13.265 14.330 -14.810 1.00 0.00 N ATOM 1480 CA GLY A 98 -12.884 12.988 -14.495 1.00 0.00 C ATOM 1481 C GLY A 98 -12.832 12.079 -15.675 1.00 0.00 C ATOM 1482 O GLY A 98 -12.134 11.076 -15.539 1.00 0.00 O ATOM 0 H GLY A 98 -12.484 14.891 -15.151 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -11.905 13.002 -14.017 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -13.588 12.583 -13.768 1.00 0.00 H new ATOM 1486 N TYR A 99 -13.458 12.415 -16.817 1.00 0.00 N ATOM 1487 CA TYR A 99 -13.440 11.489 -17.906 1.00 0.00 C ATOM 1488 C TYR A 99 -12.793 12.054 -19.123 1.00 0.00 C ATOM 1489 O TYR A 99 -12.924 13.221 -19.489 1.00 0.00 O ATOM 1490 CB TYR A 99 -14.848 10.999 -18.281 1.00 0.00 C ATOM 1491 CG TYR A 99 -15.621 10.494 -17.111 1.00 0.00 C ATOM 1492 CD1 TYR A 99 -15.491 9.166 -16.779 1.00 0.00 C ATOM 1493 CD2 TYR A 99 -16.350 11.365 -16.337 1.00 0.00 C ATOM 1494 CE1 TYR A 99 -15.970 8.705 -15.575 1.00 0.00 C ATOM 1495 CE2 TYR A 99 -16.986 10.866 -15.224 1.00 0.00 C ATOM 1496 CZ TYR A 99 -16.742 9.569 -14.836 1.00 0.00 C ATOM 1497 OH TYR A 99 -17.543 8.975 -13.837 1.00 0.00 O ATOM 0 H TYR A 99 -13.957 13.289 -16.984 1.00 0.00 H new ATOM 0 HA TYR A 99 -12.851 10.644 -17.549 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -15.398 11.816 -18.748 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -14.765 10.206 -19.024 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -15.012 8.483 -17.465 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -16.421 12.411 -16.595 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -15.749 7.707 -15.225 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -17.669 11.485 -14.661 1.00 0.00 H new ATOM 0 HH TYR A 99 -18.051 9.670 -13.369 1.00 0.00 H new ATOM 1507 N ILE A 100 -11.970 11.265 -19.837 1.00 0.00 N ATOM 1508 CA ILE A 100 -11.271 11.639 -21.028 1.00 0.00 C ATOM 1509 C ILE A 100 -12.138 11.329 -22.200 1.00 0.00 C ATOM 1510 O ILE A 100 -12.638 10.208 -22.275 1.00 0.00 O ATOM 1511 CB ILE A 100 -9.916 11.022 -21.212 1.00 0.00 C ATOM 1512 CG1 ILE A 100 -9.005 11.339 -20.015 1.00 0.00 C ATOM 1513 CG2 ILE A 100 -9.323 11.419 -22.574 1.00 0.00 C ATOM 1514 CD1 ILE A 100 -7.712 10.527 -19.969 1.00 0.00 C ATOM 0 H ILE A 100 -11.781 10.301 -19.563 1.00 0.00 H new ATOM 0 HA ILE A 100 -11.069 12.706 -20.935 1.00 0.00 H new ATOM 0 HB ILE A 100 -10.009 9.936 -21.231 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -8.753 12.399 -20.038 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -9.562 11.164 -19.095 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -8.340 10.962 -22.690 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -9.980 11.073 -23.372 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -9.228 12.504 -22.627 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -7.132 10.816 -19.093 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -7.951 9.465 -19.912 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -7.129 10.720 -20.870 1.00 0.00 H new ATOM 1526 N SER A 101 -12.522 12.314 -23.032 1.00 0.00 N ATOM 1527 CA SER A 101 -13.141 12.182 -24.314 1.00 0.00 C ATOM 1528 C SER A 101 -12.097 12.166 -25.377 1.00 0.00 C ATOM 1529 O SER A 101 -10.997 12.671 -25.161 1.00 0.00 O ATOM 1530 CB SER A 101 -14.214 13.269 -24.496 1.00 0.00 C ATOM 1531 OG SER A 101 -13.673 14.581 -24.448 1.00 0.00 O ATOM 0 H SER A 101 -12.385 13.293 -22.781 1.00 0.00 H new ATOM 0 HA SER A 101 -13.667 11.231 -24.392 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.717 13.122 -25.452 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.970 13.163 -23.718 1.00 0.00 H new ATOM 0 HG SER A 101 -13.292 14.745 -23.560 1.00 0.00 H new ATOM 1537 N ALA A 102 -12.360 11.562 -26.549 1.00 0.00 N ATOM 1538 CA ALA A 102 -11.416 11.424 -27.615 1.00 0.00 C ATOM 1539 C ALA A 102 -10.631 12.630 -28.002 1.00 0.00 C ATOM 1540 O ALA A 102 -9.405 12.667 -28.104 1.00 0.00 O ATOM 1541 CB ALA A 102 -12.084 10.839 -28.870 1.00 0.00 C ATOM 0 H ALA A 102 -13.269 11.152 -26.763 1.00 0.00 H new ATOM 0 HA ALA A 102 -10.681 10.743 -27.186 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -11.345 10.744 -29.665 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -12.496 9.857 -28.639 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -12.886 11.501 -29.197 1.00 0.00 H new ATOM 1547 N ALA A 103 -11.333 13.773 -28.082 1.00 0.00 N ATOM 1548 CA ALA A 103 -10.637 14.980 -28.405 1.00 0.00 C ATOM 1549 C ALA A 103 -9.656 15.463 -27.393 1.00 0.00 C ATOM 1550 O ALA A 103 -8.638 16.012 -27.814 1.00 0.00 O ATOM 1551 CB ALA A 103 -11.634 16.117 -28.681 1.00 0.00 C ATOM 0 H ALA A 103 -12.338 13.864 -27.931 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.057 14.712 -29.288 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -11.088 17.028 -28.925 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -12.276 15.843 -29.518 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -12.246 16.287 -27.795 1.00 0.00 H new ATOM 1557 N GLU A 104 -9.857 15.305 -26.073 1.00 0.00 N ATOM 1558 CA GLU A 104 -8.928 15.637 -25.037 1.00 0.00 C ATOM 1559 C GLU A 104 -7.670 14.839 -25.067 1.00 0.00 C ATOM 1560 O GLU A 104 -6.602 15.422 -24.892 1.00 0.00 O ATOM 1561 CB GLU A 104 -9.587 15.413 -23.665 1.00 0.00 C ATOM 1562 CG GLU A 104 -10.859 16.259 -23.585 1.00 0.00 C ATOM 1563 CD GLU A 104 -11.471 16.064 -22.206 1.00 0.00 C ATOM 1564 OE1 GLU A 104 -12.107 15.012 -21.932 1.00 0.00 O ATOM 1565 OE2 GLU A 104 -11.515 16.958 -21.319 1.00 0.00 O ATOM 0 H GLU A 104 -10.727 14.920 -25.705 1.00 0.00 H new ATOM 0 HA GLU A 104 -8.661 16.680 -25.206 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -9.826 14.358 -23.529 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.899 15.690 -22.866 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -10.628 17.311 -23.753 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.564 15.960 -24.360 1.00 0.00 H new ATOM 1572 N LEU A 105 -7.741 13.539 -25.404 1.00 0.00 N ATOM 1573 CA LEU A 105 -6.637 12.737 -25.830 1.00 0.00 C ATOM 1574 C LEU A 105 -5.927 13.150 -27.073 1.00 0.00 C ATOM 1575 O LEU A 105 -4.707 13.300 -27.101 1.00 0.00 O ATOM 1576 CB LEU A 105 -7.015 11.247 -25.767 1.00 0.00 C ATOM 1577 CG LEU A 105 -6.002 10.253 -26.358 1.00 0.00 C ATOM 1578 CD1 LEU A 105 -4.860 10.181 -25.331 1.00 0.00 C ATOM 1579 CD2 LEU A 105 -6.735 8.912 -26.533 1.00 0.00 C ATOM 0 H LEU A 105 -8.618 13.019 -25.377 1.00 0.00 H new ATOM 0 HA LEU A 105 -5.845 12.927 -25.106 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.182 10.982 -24.723 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.964 11.114 -26.286 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.596 10.535 -27.329 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -4.096 9.489 -25.684 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -4.422 11.171 -25.204 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -5.252 9.832 -24.375 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.050 8.175 -26.952 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -7.094 8.565 -25.564 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -7.581 9.045 -27.207 1.00 0.00 H new ATOM 1591 N ARG A 106 -6.642 13.454 -28.172 1.00 0.00 N ATOM 1592 CA ARG A 106 -6.167 13.798 -29.476 1.00 0.00 C ATOM 1593 C ARG A 106 -5.365 15.054 -29.486 1.00 0.00 C ATOM 1594 O ARG A 106 -4.277 15.113 -30.058 1.00 0.00 O ATOM 1595 CB ARG A 106 -7.335 14.044 -30.445 1.00 0.00 C ATOM 1596 CG ARG A 106 -6.941 14.015 -31.923 1.00 0.00 C ATOM 1597 CD ARG A 106 -8.144 14.324 -32.817 1.00 0.00 C ATOM 1598 NE ARG A 106 -8.684 15.677 -32.506 1.00 0.00 N ATOM 1599 CZ ARG A 106 -9.958 16.143 -32.658 1.00 0.00 C ATOM 1600 NH1 ARG A 106 -10.988 15.474 -33.254 1.00 0.00 N ATOM 1601 NH2 ARG A 106 -10.277 17.352 -32.111 1.00 0.00 N ATOM 0 H ARG A 106 -7.661 13.458 -28.139 1.00 0.00 H new ATOM 0 HA ARG A 106 -5.552 12.951 -29.781 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -8.102 13.290 -30.270 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -7.782 15.012 -30.219 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -6.150 14.743 -32.107 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -6.537 13.035 -32.176 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -7.849 14.275 -33.865 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -8.919 13.572 -32.668 1.00 0.00 H new ATOM 0 HE ARG A 106 -8.012 16.345 -32.129 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -10.837 14.539 -33.634 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -11.908 15.909 -33.319 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -9.571 17.884 -31.603 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -11.222 17.723 -32.210 1.00 0.00 H new ATOM 1615 N HIS A 107 -5.831 16.100 -28.781 1.00 0.00 N ATOM 1616 CA HIS A 107 -5.222 17.381 -28.595 1.00 0.00 C ATOM 1617 C HIS A 107 -3.853 17.416 -28.009 1.00 0.00 C ATOM 1618 O HIS A 107 -2.928 17.980 -28.591 1.00 0.00 O ATOM 1619 CB HIS A 107 -6.136 18.409 -27.907 1.00 0.00 C ATOM 1620 CG HIS A 107 -5.443 19.685 -27.530 1.00 0.00 C ATOM 1621 ND1 HIS A 107 -5.174 20.700 -28.426 1.00 0.00 N ATOM 1622 CD2 HIS A 107 -4.991 20.090 -26.313 1.00 0.00 C ATOM 1623 CE1 HIS A 107 -4.491 21.650 -27.733 1.00 0.00 C ATOM 1624 NE2 HIS A 107 -4.382 21.320 -26.459 1.00 0.00 N ATOM 0 H HIS A 107 -6.725 16.040 -28.293 1.00 0.00 H new ATOM 0 HA HIS A 107 -5.075 17.678 -29.633 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -6.968 18.642 -28.571 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -6.561 17.959 -27.010 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -5.092 19.542 -25.388 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -4.091 22.554 -28.167 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -3.934 21.868 -25.725 1.00 0.00 H new ATOM 1632 N VAL A 108 -3.750 16.623 -26.927 1.00 0.00 N ATOM 1633 CA VAL A 108 -2.489 16.405 -26.290 1.00 0.00 C ATOM 1634 C VAL A 108 -1.596 15.615 -27.184 1.00 0.00 C ATOM 1635 O VAL A 108 -0.441 15.984 -27.391 1.00 0.00 O ATOM 1636 CB VAL A 108 -2.478 15.619 -25.012 1.00 0.00 C ATOM 1637 CG1 VAL A 108 -1.097 15.270 -24.433 1.00 0.00 C ATOM 1638 CG2 VAL A 108 -3.283 16.428 -23.981 1.00 0.00 C ATOM 0 H VAL A 108 -4.535 16.136 -26.496 1.00 0.00 H new ATOM 0 HA VAL A 108 -2.177 17.426 -26.071 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.912 14.646 -25.243 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.222 14.702 -23.511 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -0.540 14.672 -25.155 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -0.548 16.188 -24.222 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.302 15.892 -23.032 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.816 17.402 -23.838 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.303 16.564 -24.341 1.00 0.00 H new ATOM 1648 N MET A 109 -2.070 14.519 -27.802 1.00 0.00 N ATOM 1649 CA MET A 109 -1.179 13.853 -28.701 1.00 0.00 C ATOM 1650 C MET A 109 -0.631 14.598 -29.869 1.00 0.00 C ATOM 1651 O MET A 109 0.561 14.541 -30.165 1.00 0.00 O ATOM 1652 CB MET A 109 -1.741 12.511 -29.201 1.00 0.00 C ATOM 1653 CG MET A 109 -2.098 11.468 -28.140 1.00 0.00 C ATOM 1654 SD MET A 109 -0.578 10.882 -27.334 1.00 0.00 S ATOM 1655 CE MET A 109 -0.133 9.610 -28.551 1.00 0.00 C ATOM 0 H MET A 109 -3.001 14.116 -27.694 1.00 0.00 H new ATOM 0 HA MET A 109 -0.323 13.724 -28.038 1.00 0.00 H new ATOM 0 HB2 MET A 109 -2.636 12.716 -29.788 1.00 0.00 H new ATOM 0 HB3 MET A 109 -1.010 12.069 -29.878 1.00 0.00 H new ATOM 0 HG2 MET A 109 -2.771 11.901 -27.400 1.00 0.00 H new ATOM 0 HG3 MET A 109 -2.625 10.632 -28.599 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.759 9.082 -28.215 1.00 0.00 H new ATOM 0 HE2 MET A 109 -0.956 8.903 -28.655 1.00 0.00 H new ATOM 0 HE3 MET A 109 0.065 10.081 -29.514 1.00 0.00 H new ATOM 1665 N THR A 110 -1.468 15.423 -30.524 1.00 0.00 N ATOM 1666 CA THR A 110 -1.087 16.377 -31.519 1.00 0.00 C ATOM 1667 C THR A 110 -0.114 17.400 -31.042 1.00 0.00 C ATOM 1668 O THR A 110 0.687 17.838 -31.866 1.00 0.00 O ATOM 1669 CB THR A 110 -2.237 16.955 -32.288 1.00 0.00 C ATOM 1670 OG1 THR A 110 -3.288 17.494 -31.500 1.00 0.00 O ATOM 1671 CG2 THR A 110 -2.801 15.790 -33.119 1.00 0.00 C ATOM 0 H THR A 110 -2.473 15.423 -30.347 1.00 0.00 H new ATOM 0 HA THR A 110 -0.534 15.788 -32.250 1.00 0.00 H new ATOM 0 HB THR A 110 -1.862 17.797 -32.870 1.00 0.00 H new ATOM 0 HG1 THR A 110 -3.750 16.768 -31.031 1.00 0.00 H new ATOM 0 HG21 THR A 110 -3.648 16.140 -33.709 1.00 0.00 H new ATOM 0 HG22 THR A 110 -2.027 15.410 -33.786 1.00 0.00 H new ATOM 0 HG23 THR A 110 -3.129 14.992 -32.452 1.00 0.00 H new ATOM 1679 N ASN A 111 -0.184 17.845 -29.775 1.00 0.00 N ATOM 1680 CA ASN A 111 0.711 18.822 -29.238 1.00 0.00 C ATOM 1681 C ASN A 111 2.099 18.281 -29.211 1.00 0.00 C ATOM 1682 O ASN A 111 3.114 18.905 -29.515 1.00 0.00 O ATOM 1683 CB ASN A 111 0.317 19.263 -27.818 1.00 0.00 C ATOM 1684 CG ASN A 111 -0.977 20.056 -27.704 1.00 0.00 C ATOM 1685 OD1 ASN A 111 -1.439 20.701 -28.644 1.00 0.00 O ATOM 1686 ND2 ASN A 111 -1.568 20.118 -26.480 1.00 0.00 N ATOM 0 H ASN A 111 -0.881 17.517 -29.106 1.00 0.00 H new ATOM 0 HA ASN A 111 0.654 19.695 -29.888 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.232 18.374 -27.193 1.00 0.00 H new ATOM 0 HB3 ASN A 111 1.127 19.866 -27.407 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -2.395 20.699 -26.342 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -1.185 19.583 -25.701 1.00 0.00 H new ATOM 1693 N LEU A 112 2.182 16.950 -29.036 1.00 0.00 N ATOM 1694 CA LEU A 112 3.466 16.319 -29.022 1.00 0.00 C ATOM 1695 C LEU A 112 4.147 16.051 -30.320 1.00 0.00 C ATOM 1696 O LEU A 112 5.369 15.985 -30.449 1.00 0.00 O ATOM 1697 CB LEU A 112 3.278 15.063 -28.155 1.00 0.00 C ATOM 1698 CG LEU A 112 2.685 15.331 -26.762 1.00 0.00 C ATOM 1699 CD1 LEU A 112 2.239 14.001 -26.131 1.00 0.00 C ATOM 1700 CD2 LEU A 112 3.594 16.107 -25.794 1.00 0.00 C ATOM 0 H LEU A 112 1.386 16.325 -28.908 1.00 0.00 H new ATOM 0 HA LEU A 112 4.186 17.030 -28.616 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.628 14.366 -28.684 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.244 14.571 -28.036 1.00 0.00 H new ATOM 0 HG LEU A 112 1.835 15.993 -26.927 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.818 14.190 -25.143 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.484 13.533 -26.763 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.098 13.336 -26.039 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.081 16.242 -24.842 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.516 15.548 -25.633 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.831 17.082 -26.220 1.00 0.00 H new ATOM 1712 N GLY A 113 3.341 15.936 -31.390 1.00 0.00 N ATOM 1713 CA GLY A 113 3.728 15.641 -32.735 1.00 0.00 C ATOM 1714 C GLY A 113 3.173 14.341 -33.206 1.00 0.00 C ATOM 1715 O GLY A 113 3.374 13.963 -34.359 1.00 0.00 O ATOM 0 H GLY A 113 2.332 16.060 -31.305 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.387 16.440 -33.393 1.00 0.00 H new ATOM 0 HA3 GLY A 113 4.816 15.616 -32.801 1.00 0.00 H new ATOM 1719 N GLU A 114 2.468 13.599 -32.333 1.00 0.00 N ATOM 1720 CA GLU A 114 1.907 12.317 -32.627 1.00 0.00 C ATOM 1721 C GLU A 114 0.584 12.471 -33.296 1.00 0.00 C ATOM 1722 O GLU A 114 -0.471 12.475 -32.664 1.00 0.00 O ATOM 1723 CB GLU A 114 1.720 11.490 -31.344 1.00 0.00 C ATOM 1724 CG GLU A 114 2.961 11.219 -30.490 1.00 0.00 C ATOM 1725 CD GLU A 114 3.750 10.008 -30.967 1.00 0.00 C ATOM 1726 OE1 GLU A 114 4.138 9.989 -32.166 1.00 0.00 O ATOM 1727 OE2 GLU A 114 3.798 8.986 -30.232 1.00 0.00 O ATOM 0 H GLU A 114 2.281 13.907 -31.379 1.00 0.00 H new ATOM 0 HA GLU A 114 2.599 11.798 -33.290 1.00 0.00 H new ATOM 0 HB2 GLU A 114 0.987 12.000 -30.719 1.00 0.00 H new ATOM 0 HB3 GLU A 114 1.288 10.529 -31.623 1.00 0.00 H new ATOM 0 HG2 GLU A 114 3.607 12.097 -30.506 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.658 11.065 -29.454 1.00 0.00 H new ATOM 1734 N LYS A 115 0.590 12.683 -34.624 1.00 0.00 N ATOM 1735 CA LYS A 115 -0.620 13.181 -35.201 1.00 0.00 C ATOM 1736 C LYS A 115 -1.536 12.043 -35.491 1.00 0.00 C ATOM 1737 O LYS A 115 -1.299 11.215 -36.370 1.00 0.00 O ATOM 1738 CB LYS A 115 -0.398 13.978 -36.498 1.00 0.00 C ATOM 1739 CG LYS A 115 0.310 15.331 -36.394 1.00 0.00 C ATOM 1740 CD LYS A 115 0.633 16.000 -37.732 1.00 0.00 C ATOM 1741 CE LYS A 115 1.346 15.119 -38.760 1.00 0.00 C ATOM 1742 NZ LYS A 115 1.597 15.803 -40.048 1.00 0.00 N ATOM 0 H LYS A 115 1.371 12.524 -35.260 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.052 13.865 -34.471 1.00 0.00 H new ATOM 0 HB2 LYS A 115 0.176 13.352 -37.181 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.371 14.144 -36.959 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -0.315 16.006 -35.809 1.00 0.00 H new ATOM 0 HG3 LYS A 115 1.239 15.196 -35.840 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.298 16.359 -38.172 1.00 0.00 H new ATOM 0 HD3 LYS A 115 1.253 16.876 -37.539 1.00 0.00 H new ATOM 0 HE2 LYS A 115 2.296 14.784 -38.344 1.00 0.00 H new ATOM 0 HE3 LYS A 115 0.746 14.227 -38.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 2.082 15.152 -40.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 0.692 16.099 -40.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 2.194 16.639 -39.886 1.00 0.00 H new ATOM 1756 N LEU A 116 -2.654 11.895 -34.758 1.00 0.00 N ATOM 1757 CA LEU A 116 -3.568 10.810 -34.940 1.00 0.00 C ATOM 1758 C LEU A 116 -4.778 11.324 -35.641 1.00 0.00 C ATOM 1759 O LEU A 116 -4.932 12.544 -35.635 1.00 0.00 O ATOM 1760 CB LEU A 116 -3.961 10.318 -33.537 1.00 0.00 C ATOM 1761 CG LEU A 116 -2.807 9.839 -32.639 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -3.412 9.325 -31.322 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -1.838 8.812 -33.251 1.00 0.00 C ATOM 0 H LEU A 116 -2.929 12.545 -34.021 1.00 0.00 H new ATOM 0 HA LEU A 116 -3.127 10.003 -35.526 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.482 11.126 -33.024 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -4.672 9.499 -33.647 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.163 10.704 -32.482 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -2.614 8.979 -30.666 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -3.959 10.132 -30.834 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.093 8.500 -31.532 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -1.071 8.555 -32.520 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -2.389 7.914 -33.530 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -1.367 9.239 -34.136 1.00 0.00 H new ATOM 1775 N THR A 117 -5.459 10.365 -36.295 1.00 0.00 N ATOM 1776 CA THR A 117 -6.723 10.573 -36.930 1.00 0.00 C ATOM 1777 C THR A 117 -7.723 10.213 -35.885 1.00 0.00 C ATOM 1778 O THR A 117 -7.366 9.599 -34.880 1.00 0.00 O ATOM 1779 CB THR A 117 -7.035 9.892 -38.230 1.00 0.00 C ATOM 1780 OG1 THR A 117 -7.015 8.477 -38.114 1.00 0.00 O ATOM 1781 CG2 THR A 117 -6.007 10.343 -39.281 1.00 0.00 C ATOM 0 H THR A 117 -5.116 9.409 -36.385 1.00 0.00 H new ATOM 0 HA THR A 117 -6.729 11.608 -37.273 1.00 0.00 H new ATOM 0 HB THR A 117 -8.044 10.175 -38.530 1.00 0.00 H new ATOM 0 HG1 THR A 117 -6.120 8.184 -37.842 1.00 0.00 H new ATOM 0 HG21 THR A 117 -6.221 9.856 -40.232 1.00 0.00 H new ATOM 0 HG22 THR A 117 -6.065 11.424 -39.406 1.00 0.00 H new ATOM 0 HG23 THR A 117 -5.005 10.069 -38.951 1.00 0.00 H new ATOM 1789 N ASP A 118 -9.042 10.373 -36.093 1.00 0.00 N ATOM 1790 CA ASP A 118 -10.112 10.156 -35.170 1.00 0.00 C ATOM 1791 C ASP A 118 -10.345 8.687 -35.080 1.00 0.00 C ATOM 1792 O ASP A 118 -10.497 8.154 -33.982 1.00 0.00 O ATOM 1793 CB ASP A 118 -11.361 10.873 -35.710 1.00 0.00 C ATOM 1794 CG ASP A 118 -11.207 12.384 -35.628 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -11.010 12.901 -34.496 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -11.215 13.117 -36.653 1.00 0.00 O ATOM 0 H ASP A 118 -9.391 10.686 -36.999 1.00 0.00 H new ATOM 0 HA ASP A 118 -9.879 10.545 -34.179 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -11.534 10.578 -36.745 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -12.237 10.563 -35.140 1.00 0.00 H new ATOM 1801 N GLU A 119 -10.104 7.948 -36.179 1.00 0.00 N ATOM 1802 CA GLU A 119 -10.029 6.522 -36.118 1.00 0.00 C ATOM 1803 C GLU A 119 -8.939 5.857 -35.349 1.00 0.00 C ATOM 1804 O GLU A 119 -9.133 4.768 -34.810 1.00 0.00 O ATOM 1805 CB GLU A 119 -10.101 5.869 -37.509 1.00 0.00 C ATOM 1806 CG GLU A 119 -10.989 6.717 -38.421 1.00 0.00 C ATOM 1807 CD GLU A 119 -11.389 5.960 -39.680 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -10.471 5.584 -40.457 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -12.577 5.683 -39.995 1.00 0.00 O ATOM 0 H GLU A 119 -9.961 8.339 -37.110 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.917 6.343 -35.512 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.101 5.782 -37.935 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -10.502 4.859 -37.429 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -11.885 7.019 -37.878 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -10.461 7.629 -38.697 1.00 0.00 H new ATOM 1816 N GLU A 120 -7.734 6.439 -35.224 1.00 0.00 N ATOM 1817 CA GLU A 120 -6.654 6.074 -34.360 1.00 0.00 C ATOM 1818 C GLU A 120 -6.945 6.445 -32.946 1.00 0.00 C ATOM 1819 O GLU A 120 -6.571 5.697 -32.044 1.00 0.00 O ATOM 1820 CB GLU A 120 -5.379 6.816 -34.795 1.00 0.00 C ATOM 1821 CG GLU A 120 -4.788 6.253 -36.089 1.00 0.00 C ATOM 1822 CD GLU A 120 -3.768 7.273 -36.573 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -4.146 8.235 -37.293 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -2.595 7.034 -36.179 1.00 0.00 O ATOM 0 H GLU A 120 -7.493 7.252 -35.790 1.00 0.00 H new ATOM 0 HA GLU A 120 -6.521 4.994 -34.428 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -5.606 7.873 -34.933 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.635 6.751 -34.001 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.317 5.286 -35.913 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -5.566 6.097 -36.836 1.00 0.00 H new ATOM 1831 N VAL A 121 -7.612 7.574 -32.651 1.00 0.00 N ATOM 1832 CA VAL A 121 -8.053 7.924 -31.336 1.00 0.00 C ATOM 1833 C VAL A 121 -9.119 7.043 -30.783 1.00 0.00 C ATOM 1834 O VAL A 121 -9.120 6.616 -29.630 1.00 0.00 O ATOM 1835 CB VAL A 121 -8.409 9.378 -31.236 1.00 0.00 C ATOM 1836 CG1 VAL A 121 -8.867 9.789 -29.826 1.00 0.00 C ATOM 1837 CG2 VAL A 121 -7.283 10.291 -31.748 1.00 0.00 C ATOM 0 H VAL A 121 -7.854 8.271 -33.355 1.00 0.00 H new ATOM 0 HA VAL A 121 -7.191 7.746 -30.693 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.266 9.516 -31.895 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -9.110 10.851 -29.818 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.749 9.213 -29.548 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -8.066 9.595 -29.112 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -7.589 11.333 -31.655 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -6.382 10.123 -31.158 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -7.079 10.065 -32.795 1.00 0.00 H new ATOM 1847 N ASP A 122 -10.073 6.650 -31.646 1.00 0.00 N ATOM 1848 CA ASP A 122 -11.031 5.597 -31.517 1.00 0.00 C ATOM 1849 C ASP A 122 -10.453 4.314 -31.026 1.00 0.00 C ATOM 1850 O ASP A 122 -10.920 3.727 -30.051 1.00 0.00 O ATOM 1851 CB ASP A 122 -11.965 5.391 -32.722 1.00 0.00 C ATOM 1852 CG ASP A 122 -13.136 4.439 -32.521 1.00 0.00 C ATOM 1853 OD1 ASP A 122 -14.044 4.756 -31.707 1.00 0.00 O ATOM 1854 OD2 ASP A 122 -13.195 3.310 -33.076 1.00 0.00 O ATOM 0 H ASP A 122 -10.182 7.130 -32.539 1.00 0.00 H new ATOM 0 HA ASP A 122 -11.684 5.971 -30.729 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -12.362 6.363 -33.015 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -11.368 5.025 -33.557 1.00 0.00 H new ATOM 1859 N GLU A 123 -9.365 3.852 -31.667 1.00 0.00 N ATOM 1860 CA GLU A 123 -8.636 2.679 -31.296 1.00 0.00 C ATOM 1861 C GLU A 123 -8.052 2.754 -29.928 1.00 0.00 C ATOM 1862 O GLU A 123 -8.056 1.776 -29.182 1.00 0.00 O ATOM 1863 CB GLU A 123 -7.478 2.409 -32.271 1.00 0.00 C ATOM 1864 CG GLU A 123 -6.854 1.024 -32.084 1.00 0.00 C ATOM 1865 CD GLU A 123 -5.731 0.860 -33.098 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -4.644 1.478 -32.942 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -5.950 0.186 -34.140 1.00 0.00 O ATOM 0 H GLU A 123 -8.974 4.320 -32.485 1.00 0.00 H new ATOM 0 HA GLU A 123 -9.371 1.875 -31.325 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -7.842 2.503 -33.294 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -6.710 3.170 -32.134 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.468 0.916 -31.070 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -7.606 0.248 -32.223 1.00 0.00 H new ATOM 1874 N MET A 124 -7.546 3.921 -29.490 1.00 0.00 N ATOM 1875 CA MET A 124 -7.144 4.204 -28.148 1.00 0.00 C ATOM 1876 C MET A 124 -8.246 4.141 -27.147 1.00 0.00 C ATOM 1877 O MET A 124 -8.108 3.560 -26.071 1.00 0.00 O ATOM 1878 CB MET A 124 -6.337 5.501 -27.964 1.00 0.00 C ATOM 1879 CG MET A 124 -5.088 5.521 -28.847 1.00 0.00 C ATOM 1880 SD MET A 124 -4.273 7.146 -28.888 1.00 0.00 S ATOM 1881 CE MET A 124 -2.988 7.092 -27.606 1.00 0.00 C ATOM 0 H MET A 124 -7.410 4.716 -30.114 1.00 0.00 H new ATOM 0 HA MET A 124 -6.463 3.377 -27.945 1.00 0.00 H new ATOM 0 HB2 MET A 124 -6.966 6.358 -28.204 1.00 0.00 H new ATOM 0 HB3 MET A 124 -6.045 5.603 -26.919 1.00 0.00 H new ATOM 0 HG2 MET A 124 -4.381 4.775 -28.484 1.00 0.00 H new ATOM 0 HG3 MET A 124 -5.362 5.233 -29.862 1.00 0.00 H new ATOM 0 HE1 MET A 124 -2.719 8.108 -27.318 1.00 0.00 H new ATOM 0 HE2 MET A 124 -3.365 6.556 -26.735 1.00 0.00 H new ATOM 0 HE3 MET A 124 -2.108 6.580 -27.994 1.00 0.00 H new ATOM 1891 N ILE A 125 -9.415 4.744 -27.425 1.00 0.00 N ATOM 1892 CA ILE A 125 -10.586 4.720 -26.605 1.00 0.00 C ATOM 1893 C ILE A 125 -11.186 3.364 -26.455 1.00 0.00 C ATOM 1894 O ILE A 125 -11.639 2.874 -25.422 1.00 0.00 O ATOM 1895 CB ILE A 125 -11.628 5.714 -27.025 1.00 0.00 C ATOM 1896 CG1 ILE A 125 -11.216 7.186 -27.192 1.00 0.00 C ATOM 1897 CG2 ILE A 125 -12.807 5.625 -26.041 1.00 0.00 C ATOM 1898 CD1 ILE A 125 -10.851 7.871 -25.876 1.00 0.00 C ATOM 0 H ILE A 125 -9.550 5.284 -28.280 1.00 0.00 H new ATOM 0 HA ILE A 125 -10.223 5.021 -25.622 1.00 0.00 H new ATOM 0 HB ILE A 125 -11.874 5.416 -28.044 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -10.364 7.242 -27.870 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -12.034 7.733 -27.662 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -13.577 6.341 -26.329 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -13.223 4.618 -26.061 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -12.458 5.853 -25.034 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -10.571 8.906 -26.070 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -11.708 7.847 -25.203 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -10.013 7.349 -25.414 1.00 0.00 H new ATOM 1910 N ARG A 126 -11.253 2.592 -27.555 1.00 0.00 N ATOM 1911 CA ARG A 126 -11.756 1.257 -27.649 1.00 0.00 C ATOM 1912 C ARG A 126 -11.035 0.305 -26.759 1.00 0.00 C ATOM 1913 O ARG A 126 -11.648 -0.500 -26.059 1.00 0.00 O ATOM 1914 CB ARG A 126 -11.416 0.765 -29.066 1.00 0.00 C ATOM 1915 CG ARG A 126 -11.884 -0.590 -29.601 1.00 0.00 C ATOM 1916 CD ARG A 126 -11.346 -1.047 -30.958 1.00 0.00 C ATOM 1917 NE ARG A 126 -11.804 -0.021 -31.938 1.00 0.00 N ATOM 1918 CZ ARG A 126 -11.364 0.109 -33.223 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -10.345 -0.607 -33.784 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -11.797 1.159 -33.981 1.00 0.00 N ATOM 0 H ARG A 126 -10.925 2.935 -28.458 1.00 0.00 H new ATOM 0 HA ARG A 126 -12.815 1.282 -27.391 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -11.792 1.520 -29.757 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -10.329 0.773 -29.146 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -11.622 -1.349 -28.864 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -12.972 -0.568 -29.663 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -10.258 -1.118 -30.945 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -11.727 -2.035 -31.218 1.00 0.00 H new ATOM 0 HE ARG A 126 -12.509 0.643 -31.619 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -9.847 -1.305 -33.231 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -10.082 -0.444 -34.756 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -12.445 1.840 -33.586 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -11.472 1.262 -34.942 1.00 0.00 H new ATOM 1934 N GLU A 127 -9.693 0.397 -26.738 1.00 0.00 N ATOM 1935 CA GLU A 127 -8.902 -0.304 -25.774 1.00 0.00 C ATOM 1936 C GLU A 127 -9.078 0.244 -24.400 1.00 0.00 C ATOM 1937 O GLU A 127 -9.165 -0.518 -23.438 1.00 0.00 O ATOM 1938 CB GLU A 127 -7.439 -0.282 -26.249 1.00 0.00 C ATOM 1939 CG GLU A 127 -6.506 -0.991 -25.265 1.00 0.00 C ATOM 1940 CD GLU A 127 -5.182 -1.386 -25.904 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -4.386 -0.452 -26.188 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -4.997 -2.629 -26.004 1.00 0.00 O ATOM 0 H GLU A 127 -9.152 0.961 -27.394 1.00 0.00 H new ATOM 0 HA GLU A 127 -9.234 -1.340 -25.702 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -7.368 -0.761 -27.225 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -7.115 0.751 -26.376 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -6.315 -0.337 -24.414 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -7.000 -1.882 -24.878 1.00 0.00 H new ATOM 1949 N ALA A 128 -9.245 1.569 -24.242 1.00 0.00 N ATOM 1950 CA ALA A 128 -9.489 2.155 -22.960 1.00 0.00 C ATOM 1951 C ALA A 128 -10.755 1.770 -22.276 1.00 0.00 C ATOM 1952 O ALA A 128 -10.639 1.275 -21.156 1.00 0.00 O ATOM 1953 CB ALA A 128 -9.409 3.686 -23.082 1.00 0.00 C ATOM 0 H ALA A 128 -9.211 2.240 -25.009 1.00 0.00 H new ATOM 0 HA ALA A 128 -8.708 1.748 -22.318 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -9.594 4.139 -22.108 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.417 3.972 -23.432 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -10.159 4.034 -23.792 1.00 0.00 H new ATOM 1959 N ASP A 129 -11.950 1.962 -22.862 1.00 0.00 N ATOM 1960 CA ASP A 129 -13.244 1.918 -22.255 1.00 0.00 C ATOM 1961 C ASP A 129 -13.669 0.529 -21.921 1.00 0.00 C ATOM 1962 O ASP A 129 -13.753 -0.317 -22.810 1.00 0.00 O ATOM 1963 CB ASP A 129 -14.291 2.604 -23.150 1.00 0.00 C ATOM 1964 CG ASP A 129 -15.635 2.630 -22.436 1.00 0.00 C ATOM 1965 OD1 ASP A 129 -15.706 2.969 -21.225 1.00 0.00 O ATOM 1966 OD2 ASP A 129 -16.672 2.145 -22.963 1.00 0.00 O ATOM 0 H ASP A 129 -12.014 2.168 -23.859 1.00 0.00 H new ATOM 0 HA ASP A 129 -13.171 2.465 -21.315 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -13.973 3.620 -23.386 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -14.381 2.071 -24.096 1.00 0.00 H new ATOM 1971 N ILE A 130 -13.730 0.316 -20.595 1.00 0.00 N ATOM 1972 CA ILE A 130 -14.108 -0.907 -19.958 1.00 0.00 C ATOM 1973 C ILE A 130 -15.579 -0.997 -19.741 1.00 0.00 C ATOM 1974 O ILE A 130 -16.273 -1.947 -20.100 1.00 0.00 O ATOM 1975 CB ILE A 130 -13.308 -1.063 -18.698 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -11.863 -1.345 -19.144 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -13.836 -2.249 -17.873 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -10.858 -1.188 -18.004 1.00 0.00 C ATOM 0 H ILE A 130 -13.500 1.048 -19.923 1.00 0.00 H new ATOM 0 HA ILE A 130 -13.877 -1.746 -20.614 1.00 0.00 H new ATOM 0 HB ILE A 130 -13.374 -0.171 -18.076 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -11.800 -2.358 -19.543 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -11.597 -0.666 -19.954 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.246 -2.350 -16.962 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -14.880 -2.075 -17.612 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -13.757 -3.164 -18.460 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -9.854 -1.398 -18.373 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -10.898 -0.168 -17.622 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -11.104 -1.886 -17.203 1.00 0.00 H new ATOM 1990 N ASP A 131 -16.197 0.026 -19.124 1.00 0.00 N ATOM 1991 CA ASP A 131 -17.581 -0.091 -18.786 1.00 0.00 C ATOM 1992 C ASP A 131 -18.593 0.017 -19.875 1.00 0.00 C ATOM 1993 O ASP A 131 -19.641 -0.609 -19.726 1.00 0.00 O ATOM 1994 CB ASP A 131 -17.917 0.869 -17.632 1.00 0.00 C ATOM 1995 CG ASP A 131 -17.517 2.300 -17.959 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -18.024 2.936 -18.921 1.00 0.00 O ATOM 1997 OD2 ASP A 131 -16.692 2.869 -17.195 1.00 0.00 O ATOM 0 H ASP A 131 -15.755 0.908 -18.866 1.00 0.00 H new ATOM 0 HA ASP A 131 -17.676 -1.137 -18.495 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -18.986 0.828 -17.424 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -17.403 0.545 -16.727 1.00 0.00 H new ATOM 2002 N GLY A 132 -18.375 0.907 -20.860 1.00 0.00 N ATOM 2003 CA GLY A 132 -19.321 0.853 -21.930 1.00 0.00 C ATOM 2004 C GLY A 132 -19.658 2.208 -22.450 1.00 0.00 C ATOM 2005 O GLY A 132 -20.201 2.370 -23.542 1.00 0.00 O ATOM 0 H GLY A 132 -17.626 1.597 -20.921 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -18.918 0.245 -22.739 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -20.230 0.361 -21.585 1.00 0.00 H new ATOM 2009 N ASP A 133 -19.416 3.230 -21.610 1.00 0.00 N ATOM 2010 CA ASP A 133 -19.773 4.593 -21.853 1.00 0.00 C ATOM 2011 C ASP A 133 -19.107 5.378 -22.930 1.00 0.00 C ATOM 2012 O ASP A 133 -19.597 6.404 -23.399 1.00 0.00 O ATOM 2013 CB ASP A 133 -20.002 5.400 -20.563 1.00 0.00 C ATOM 2014 CG ASP A 133 -18.755 5.803 -19.789 1.00 0.00 C ATOM 2015 OD1 ASP A 133 -17.626 5.556 -20.290 1.00 0.00 O ATOM 2016 OD2 ASP A 133 -18.841 6.389 -18.678 1.00 0.00 O ATOM 0 H ASP A 133 -18.946 3.098 -20.714 1.00 0.00 H new ATOM 0 HA ASP A 133 -20.728 4.422 -22.350 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -20.553 6.305 -20.819 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -20.641 4.814 -19.902 1.00 0.00 H new ATOM 2021 N GLY A 134 -17.899 4.951 -23.339 1.00 0.00 N ATOM 2022 CA GLY A 134 -17.074 5.575 -24.326 1.00 0.00 C ATOM 2023 C GLY A 134 -16.126 6.560 -23.734 1.00 0.00 C ATOM 2024 O GLY A 134 -15.126 6.933 -24.345 1.00 0.00 O ATOM 0 H GLY A 134 -17.470 4.111 -22.952 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -16.512 4.810 -24.862 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -17.706 6.078 -25.058 1.00 0.00 H new ATOM 2028 N GLN A 135 -16.349 7.045 -22.499 1.00 0.00 N ATOM 2029 CA GLN A 135 -15.467 7.973 -21.861 1.00 0.00 C ATOM 2030 C GLN A 135 -14.558 7.288 -20.900 1.00 0.00 C ATOM 2031 O GLN A 135 -14.959 6.332 -20.237 1.00 0.00 O ATOM 2032 CB GLN A 135 -16.264 9.026 -21.074 1.00 0.00 C ATOM 2033 CG GLN A 135 -17.393 9.699 -21.856 1.00 0.00 C ATOM 2034 CD GLN A 135 -16.910 10.380 -23.129 1.00 0.00 C ATOM 2035 OE1 GLN A 135 -16.664 9.627 -24.235 1.00 0.00 O flip ATOM 2036 NE2 GLN A 135 -16.809 11.600 -23.248 1.00 0.00 N flip ATOM 0 H GLN A 135 -17.157 6.788 -21.933 1.00 0.00 H new ATOM 0 HA GLN A 135 -14.883 8.444 -22.652 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -16.688 8.552 -20.189 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -15.575 9.795 -20.725 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -18.145 8.953 -22.112 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -17.880 10.437 -21.218 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -16.984 12.207 -22.447 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -16.551 12.005 -24.148 1.00 0.00 H new ATOM 2045 N VAL A 136 -13.280 7.692 -20.794 1.00 0.00 N ATOM 2046 CA VAL A 136 -12.273 6.874 -20.192 1.00 0.00 C ATOM 2047 C VAL A 136 -11.995 7.491 -18.864 1.00 0.00 C ATOM 2048 O VAL A 136 -11.488 8.608 -18.771 1.00 0.00 O ATOM 2049 CB VAL A 136 -11.040 6.964 -21.041 1.00 0.00 C ATOM 2050 CG1 VAL A 136 -9.941 6.215 -20.269 1.00 0.00 C ATOM 2051 CG2 VAL A 136 -11.281 6.289 -22.402 1.00 0.00 C ATOM 0 H VAL A 136 -12.941 8.594 -21.129 1.00 0.00 H new ATOM 0 HA VAL A 136 -12.577 5.832 -20.096 1.00 0.00 H new ATOM 0 HB VAL A 136 -10.762 8.000 -21.234 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -9.012 6.245 -20.838 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -9.788 6.691 -19.300 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -10.243 5.178 -20.121 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -10.378 6.361 -23.009 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -11.532 5.239 -22.248 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -12.104 6.787 -22.915 1.00 0.00 H new ATOM 2061 N ASN A 137 -12.309 6.736 -17.796 1.00 0.00 N ATOM 2062 CA ASN A 137 -12.031 7.051 -16.430 1.00 0.00 C ATOM 2063 C ASN A 137 -10.636 6.746 -16.003 1.00 0.00 C ATOM 2064 O ASN A 137 -9.815 6.147 -16.696 1.00 0.00 O ATOM 2065 CB ASN A 137 -13.080 6.578 -15.409 1.00 0.00 C ATOM 2066 CG ASN A 137 -13.122 5.091 -15.089 1.00 0.00 C ATOM 2067 OD1 ASN A 137 -12.122 4.511 -14.669 1.00 0.00 O ATOM 2068 ND2 ASN A 137 -14.249 4.367 -15.326 1.00 0.00 N ATOM 0 H ASN A 137 -12.791 5.843 -17.896 1.00 0.00 H new ATOM 0 HA ASN A 137 -12.119 8.137 -16.422 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -12.912 7.119 -14.478 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -14.064 6.872 -15.775 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -14.254 3.361 -15.155 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -15.089 4.830 -15.674 1.00 0.00 H new ATOM 2075 N TYR A 138 -10.274 6.982 -14.730 1.00 0.00 N ATOM 2076 CA TYR A 138 -8.961 6.772 -14.203 1.00 0.00 C ATOM 2077 C TYR A 138 -8.533 5.352 -14.345 1.00 0.00 C ATOM 2078 O TYR A 138 -7.463 5.004 -14.843 1.00 0.00 O ATOM 2079 CB TYR A 138 -8.993 7.106 -12.702 1.00 0.00 C ATOM 2080 CG TYR A 138 -7.659 7.035 -12.043 1.00 0.00 C ATOM 2081 CD1 TYR A 138 -6.591 7.792 -12.463 1.00 0.00 C ATOM 2082 CD2 TYR A 138 -7.516 6.198 -10.961 1.00 0.00 C ATOM 2083 CE1 TYR A 138 -5.353 7.664 -11.878 1.00 0.00 C ATOM 2084 CE2 TYR A 138 -6.300 6.115 -10.325 1.00 0.00 C ATOM 2085 CZ TYR A 138 -5.210 6.785 -10.830 1.00 0.00 C ATOM 2086 OH TYR A 138 -3.922 6.515 -10.321 1.00 0.00 O ATOM 0 H TYR A 138 -10.929 7.337 -14.034 1.00 0.00 H new ATOM 0 HA TYR A 138 -8.263 7.404 -14.752 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -9.400 8.109 -12.571 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -9.673 6.418 -12.200 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -6.727 8.500 -13.267 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -8.353 5.610 -10.614 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -4.512 8.241 -12.234 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -6.200 5.523 -9.427 1.00 0.00 H new ATOM 0 HH TYR A 138 -3.990 5.875 -9.582 1.00 0.00 H new ATOM 2096 N GLU A 139 -9.342 4.401 -13.846 1.00 0.00 N ATOM 2097 CA GLU A 139 -9.164 2.992 -13.674 1.00 0.00 C ATOM 2098 C GLU A 139 -8.972 2.400 -15.028 1.00 0.00 C ATOM 2099 O GLU A 139 -8.009 1.670 -15.258 1.00 0.00 O ATOM 2100 CB GLU A 139 -10.417 2.396 -13.010 1.00 0.00 C ATOM 2101 CG GLU A 139 -10.473 0.867 -12.982 1.00 0.00 C ATOM 2102 CD GLU A 139 -11.681 0.343 -12.219 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -11.697 0.560 -10.978 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -12.561 -0.225 -12.919 1.00 0.00 O ATOM 0 H GLU A 139 -10.267 4.671 -13.512 1.00 0.00 H new ATOM 0 HA GLU A 139 -8.303 2.779 -13.040 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -10.477 2.765 -11.986 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -11.298 2.767 -13.534 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -10.500 0.489 -14.004 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.562 0.481 -12.524 1.00 0.00 H new ATOM 2111 N GLU A 140 -9.854 2.772 -15.973 1.00 0.00 N ATOM 2112 CA GLU A 140 -9.720 2.400 -17.347 1.00 0.00 C ATOM 2113 C GLU A 140 -8.491 2.882 -18.037 1.00 0.00 C ATOM 2114 O GLU A 140 -7.861 2.194 -18.839 1.00 0.00 O ATOM 2115 CB GLU A 140 -10.918 2.917 -18.160 1.00 0.00 C ATOM 2116 CG GLU A 140 -12.306 2.673 -17.563 1.00 0.00 C ATOM 2117 CD GLU A 140 -13.431 3.284 -18.385 1.00 0.00 C ATOM 2118 OE1 GLU A 140 -13.716 4.511 -18.419 1.00 0.00 O ATOM 2119 OE2 GLU A 140 -14.208 2.399 -18.834 1.00 0.00 O ATOM 0 H GLU A 140 -10.677 3.343 -15.779 1.00 0.00 H new ATOM 0 HA GLU A 140 -9.663 1.312 -17.310 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -10.793 3.990 -18.306 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -10.885 2.455 -19.147 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.472 1.599 -17.474 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -12.337 3.085 -16.554 1.00 0.00 H new ATOM 2126 N PHE A 141 -8.064 4.103 -17.668 1.00 0.00 N ATOM 2127 CA PHE A 141 -6.790 4.577 -18.112 1.00 0.00 C ATOM 2128 C PHE A 141 -5.584 3.915 -17.541 1.00 0.00 C ATOM 2129 O PHE A 141 -4.738 3.417 -18.282 1.00 0.00 O ATOM 2130 CB PHE A 141 -6.834 6.088 -17.832 1.00 0.00 C ATOM 2131 CG PHE A 141 -5.678 6.893 -18.317 1.00 0.00 C ATOM 2132 CD1 PHE A 141 -4.631 7.212 -17.484 1.00 0.00 C ATOM 2133 CD2 PHE A 141 -5.841 7.541 -19.519 1.00 0.00 C ATOM 2134 CE1 PHE A 141 -3.798 8.268 -17.767 1.00 0.00 C ATOM 2135 CE2 PHE A 141 -4.945 8.537 -19.829 1.00 0.00 C ATOM 2136 CZ PHE A 141 -4.051 9.010 -18.897 1.00 0.00 C ATOM 0 H PHE A 141 -8.586 4.749 -17.076 1.00 0.00 H new ATOM 0 HA PHE A 141 -6.658 4.328 -19.165 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.742 6.491 -18.282 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.921 6.232 -16.755 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -4.461 6.624 -16.594 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -6.642 7.278 -20.194 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -2.968 8.508 -17.120 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -4.943 8.956 -20.824 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.552 9.955 -19.051 1.00 0.00 H new ATOM 2146 N VAL A 142 -5.544 3.725 -16.210 1.00 0.00 N ATOM 2147 CA VAL A 142 -4.504 3.146 -15.417 1.00 0.00 C ATOM 2148 C VAL A 142 -4.257 1.730 -15.812 1.00 0.00 C ATOM 2149 O VAL A 142 -3.083 1.460 -16.058 1.00 0.00 O ATOM 2150 CB VAL A 142 -4.838 3.267 -13.960 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -3.827 2.441 -13.146 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -4.625 4.767 -13.696 1.00 0.00 C ATOM 0 H VAL A 142 -6.331 4.011 -15.627 1.00 0.00 H new ATOM 0 HA VAL A 142 -3.579 3.694 -15.596 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.835 2.917 -13.695 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.061 2.522 -12.085 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -3.882 1.396 -13.451 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -2.820 2.819 -13.325 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.840 4.987 -12.650 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -3.591 5.032 -13.917 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.293 5.347 -14.333 1.00 0.00 H new ATOM 2162 N GLN A 143 -5.325 0.948 -16.049 1.00 0.00 N ATOM 2163 CA GLN A 143 -5.290 -0.341 -16.667 1.00 0.00 C ATOM 2164 C GLN A 143 -4.371 -0.585 -17.814 1.00 0.00 C ATOM 2165 O GLN A 143 -3.628 -1.566 -17.840 1.00 0.00 O ATOM 2166 CB GLN A 143 -6.709 -0.733 -17.111 1.00 0.00 C ATOM 2167 CG GLN A 143 -6.875 -2.171 -17.606 1.00 0.00 C ATOM 2168 CD GLN A 143 -6.674 -3.144 -16.453 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -6.604 -2.778 -15.281 1.00 0.00 O ATOM 2170 NE2 GLN A 143 -6.662 -4.467 -16.770 1.00 0.00 N ATOM 0 H GLN A 143 -6.270 1.234 -15.793 1.00 0.00 H new ATOM 0 HA GLN A 143 -4.870 -0.955 -15.870 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -7.389 -0.576 -16.273 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.021 -0.056 -17.906 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -7.868 -2.304 -18.036 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -6.154 -2.378 -18.397 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -6.721 -4.758 -17.746 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -6.594 -5.168 -16.032 1.00 0.00 H new ATOM 2179 N MET A 144 -4.401 0.248 -18.869 1.00 0.00 N ATOM 2180 CA MET A 144 -3.508 0.244 -19.986 1.00 0.00 C ATOM 2181 C MET A 144 -2.072 0.458 -19.651 1.00 0.00 C ATOM 2182 O MET A 144 -1.162 -0.154 -20.209 1.00 0.00 O ATOM 2183 CB MET A 144 -3.898 1.287 -21.047 1.00 0.00 C ATOM 2184 CG MET A 144 -5.290 1.101 -21.654 1.00 0.00 C ATOM 2185 SD MET A 144 -5.707 2.387 -22.869 1.00 0.00 S ATOM 2186 CE MET A 144 -5.926 3.847 -21.811 1.00 0.00 C ATOM 0 H MET A 144 -5.106 0.982 -18.946 1.00 0.00 H new ATOM 0 HA MET A 144 -3.613 -0.769 -20.374 1.00 0.00 H new ATOM 0 HB2 MET A 144 -3.843 2.279 -20.598 1.00 0.00 H new ATOM 0 HB3 MET A 144 -3.161 1.260 -21.850 1.00 0.00 H new ATOM 0 HG2 MET A 144 -5.345 0.124 -22.133 1.00 0.00 H new ATOM 0 HG3 MET A 144 -6.033 1.107 -20.856 1.00 0.00 H new ATOM 0 HE1 MET A 144 -5.795 4.751 -22.406 1.00 0.00 H new ATOM 0 HE2 MET A 144 -6.927 3.838 -21.381 1.00 0.00 H new ATOM 0 HE3 MET A 144 -5.187 3.830 -21.010 1.00 0.00 H new ATOM 2196 N MET A 145 -1.771 1.335 -18.676 1.00 0.00 N ATOM 2197 CA MET A 145 -0.465 1.710 -18.231 1.00 0.00 C ATOM 2198 C MET A 145 0.190 0.608 -17.472 1.00 0.00 C ATOM 2199 O MET A 145 1.372 0.287 -17.588 1.00 0.00 O ATOM 2200 CB MET A 145 -0.658 3.049 -17.500 1.00 0.00 C ATOM 2201 CG MET A 145 -0.724 4.181 -18.527 1.00 0.00 C ATOM 2202 SD MET A 145 -0.837 5.808 -17.724 1.00 0.00 S ATOM 2203 CE MET A 145 -1.014 6.722 -19.283 1.00 0.00 C ATOM 0 H MET A 145 -2.503 1.821 -18.158 1.00 0.00 H new ATOM 0 HA MET A 145 0.252 1.867 -19.037 1.00 0.00 H new ATOM 0 HB2 MET A 145 -1.573 3.025 -16.909 1.00 0.00 H new ATOM 0 HB3 MET A 145 0.165 3.220 -16.806 1.00 0.00 H new ATOM 0 HG2 MET A 145 0.161 4.149 -19.162 1.00 0.00 H new ATOM 0 HG3 MET A 145 -1.587 4.034 -19.176 1.00 0.00 H new ATOM 0 HE1 MET A 145 -1.106 7.787 -19.072 1.00 0.00 H new ATOM 0 HE2 MET A 145 -0.137 6.550 -19.907 1.00 0.00 H new ATOM 0 HE3 MET A 145 -1.906 6.378 -19.807 1.00 0.00 H new