USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1024 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 41 SER OG : rot 165:sc= 0 USER MOD Set 1.2: A 44 ASN : amide:sc= -0.179 K(o=-1.9,f=-6.3!) USER MOD Set 1.3: A 119 SER OG : rot 114:sc= -1.71! USER MOD Set 2.1: A 112 TYR OH : rot -81:sc= 0.464 USER MOD Set 2.2: A 116 LYS NZ :NH3+ 151:sc= -0.04 (180deg=-0.897) USER MOD Set 3.1: A 19 MET CE :methyl -154:sc= -2.47 (180deg=-0.592) USER MOD Set 3.2: A 115 MET CE :methyl -111:sc= -2.75 (180deg=-2.89) USER MOD Set 4.1: A 31 GLN : amide:sc= -2.91! K(o=-3.2!,f=-4.7) USER MOD Set 4.2: A 34 LYS NZ :NH3+ 165:sc= -0.341 (180deg=-1.29) USER MOD Single : A 9 GLN : amide:sc= -0.0393 X(o=-0.039,f=-0.4) USER MOD Single : A 10 GLN : amide:sc= -0.506 X(o=-0.51,f=-0.42) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -120:sc= 0.013 (180deg=-0.595) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0206 USER MOD Single : A 55 LYS NZ :NH3+ 161:sc= 0.177 (180deg=0.0893) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 80 SER OG : rot 170:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 149:sc= -0.287 (180deg=-1.51!) USER MOD Single : A 88 SER OG : rot 180:sc= -0.917 USER MOD Single : A 89 TYR OH : rot -78:sc= 0.00113 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 73:sc= 0.692 USER MOD Single : A 93 THR OG1 : rot 76:sc= 0.539 USER MOD Single : A 94 HIS : no HD1:sc= -0.0284 X(o=-0.028,f=0) USER MOD Single : A 95 ASN : amide:sc= -0.105 K(o=-0.11,f=-1.4!) USER MOD Single : A 97 LYS NZ :NH3+ 167:sc= -0.0124 (180deg=-0.192) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -135:sc= 0.125 USER MOD Single : A 108 GLN :FLIP amide:sc= -1.25 F(o=-2.7!,f=-1.3) USER MOD Single : A 110 HIS : no HD1:sc= -0.157 X(o=-0.16,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 178:sc= -0.167 (180deg=-0.187) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 158:sc= -0.219 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 165:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.0462 K(o=-0.046,f=-0.6) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -18.624 8.744 1.625 1.00 0.00 N ATOM 78 CA GLN A 9 -18.826 8.021 0.375 1.00 0.00 C ATOM 79 C GLN A 9 -18.028 8.659 -0.758 1.00 0.00 C ATOM 80 O GLN A 9 -17.360 7.966 -1.524 1.00 0.00 O ATOM 81 CB GLN A 9 -20.312 7.991 0.014 1.00 0.00 C ATOM 82 CG GLN A 9 -20.594 7.385 -1.351 1.00 0.00 C ATOM 83 CD GLN A 9 -22.069 7.118 -1.578 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.928 7.794 -1.011 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.371 6.129 -2.411 1.00 0.00 N ATOM 0 HA GLN A 9 -18.472 6.999 0.514 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.850 7.423 0.773 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.704 9.008 0.039 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.227 8.058 -2.126 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -20.040 6.452 -1.451 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.627 5.595 -2.859 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.347 5.904 -2.603 1.00 0.00 H new ATOM 94 N GLN A 10 -18.104 9.982 -0.857 1.00 0.00 N ATOM 95 CA GLN A 10 -17.390 10.712 -1.897 1.00 0.00 C ATOM 96 C GLN A 10 -15.882 10.629 -1.683 1.00 0.00 C ATOM 97 O GLN A 10 -15.119 10.449 -2.632 1.00 0.00 O ATOM 98 CB GLN A 10 -17.834 12.176 -1.919 1.00 0.00 C ATOM 99 CG GLN A 10 -19.238 12.377 -2.464 1.00 0.00 C ATOM 100 CD GLN A 10 -19.528 11.503 -3.668 1.00 0.00 C ATOM 101 OE1 GLN A 10 -19.169 11.841 -4.796 1.00 0.00 O ATOM 102 NE2 GLN A 10 -20.181 10.370 -3.435 1.00 0.00 N ATOM 0 H GLN A 10 -18.653 10.570 -0.230 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.628 10.253 -2.856 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.785 12.577 -0.907 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.133 12.751 -2.524 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.963 12.160 -1.679 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.370 13.423 -2.739 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.460 10.128 -2.484 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.403 9.742 -4.207 1.00 0.00 H new ATOM 111 N ARG A 11 -15.459 10.761 -0.429 1.00 0.00 N ATOM 112 CA ARG A 11 -14.042 10.702 -0.091 1.00 0.00 C ATOM 113 C ARG A 11 -13.405 9.429 -0.639 1.00 0.00 C ATOM 114 O ARG A 11 -12.296 9.458 -1.173 1.00 0.00 O ATOM 115 CB ARG A 11 -13.856 10.767 1.426 1.00 0.00 C ATOM 116 CG ARG A 11 -12.536 11.389 1.851 1.00 0.00 C ATOM 117 CD ARG A 11 -12.624 12.907 1.896 1.00 0.00 C ATOM 118 NE ARG A 11 -11.573 13.492 2.724 1.00 0.00 N ATOM 119 CZ ARG A 11 -11.240 14.777 2.689 1.00 0.00 C ATOM 120 NH1 ARG A 11 -11.873 15.607 1.871 1.00 0.00 N ATOM 121 NH2 ARG A 11 -10.272 15.235 3.473 1.00 0.00 N ATOM 0 H ARG A 11 -16.077 10.909 0.369 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.548 11.560 -0.548 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.675 11.341 1.860 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -13.921 9.759 1.835 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.254 11.011 2.833 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -11.751 11.089 1.157 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -12.551 13.304 0.884 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.598 13.202 2.285 1.00 0.00 H new ATOM 0 HE ARG A 11 -11.067 12.880 3.364 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -12.617 15.259 1.267 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -11.615 16.594 1.846 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -9.783 14.600 4.103 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -10.017 16.222 3.445 1.00 0.00 H new ATOM 135 N VAL A 12 -14.113 8.313 -0.503 1.00 0.00 N ATOM 136 CA VAL A 12 -13.617 7.029 -0.985 1.00 0.00 C ATOM 137 C VAL A 12 -13.331 7.077 -2.481 1.00 0.00 C ATOM 138 O VAL A 12 -12.202 6.847 -2.917 1.00 0.00 O ATOM 139 CB VAL A 12 -14.622 5.897 -0.702 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.108 4.576 -1.253 1.00 0.00 C ATOM 141 CG2 VAL A 12 -14.898 5.790 0.790 1.00 0.00 C ATOM 0 H VAL A 12 -15.032 8.272 -0.063 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.691 6.826 -0.447 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.559 6.133 -1.206 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.832 3.788 -1.043 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -13.967 4.662 -2.330 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.157 4.330 -0.781 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.610 4.985 0.971 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -13.968 5.578 1.318 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.314 6.731 1.151 1.00 0.00 H new ATOM 151 N LYS A 13 -14.360 7.379 -3.266 1.00 0.00 N ATOM 152 CA LYS A 13 -14.220 7.460 -4.715 1.00 0.00 C ATOM 153 C LYS A 13 -12.946 8.205 -5.098 1.00 0.00 C ATOM 154 O LYS A 13 -12.221 7.791 -6.003 1.00 0.00 O ATOM 155 CB LYS A 13 -15.436 8.160 -5.327 1.00 0.00 C ATOM 156 CG LYS A 13 -15.377 8.268 -6.840 1.00 0.00 C ATOM 157 CD LYS A 13 -16.015 7.063 -7.511 1.00 0.00 C ATOM 158 CE LYS A 13 -15.622 6.968 -8.977 1.00 0.00 C ATOM 159 NZ LYS A 13 -16.585 6.141 -9.757 1.00 0.00 N ATOM 0 H LYS A 13 -15.301 7.572 -2.922 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.157 6.444 -5.106 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.338 7.617 -5.045 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.521 9.160 -4.903 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.887 9.176 -7.161 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.338 8.356 -7.159 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.712 6.154 -6.992 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.100 7.131 -7.428 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -15.573 7.969 -9.405 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -14.624 6.537 -9.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -16.282 6.101 -10.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -16.613 5.178 -9.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.533 6.566 -9.701 1.00 0.00 H new ATOM 173 N ARG A 14 -12.677 9.306 -4.403 1.00 0.00 N ATOM 174 CA ARG A 14 -11.490 10.108 -4.670 1.00 0.00 C ATOM 175 C ARG A 14 -10.277 9.217 -4.920 1.00 0.00 C ATOM 176 O ARG A 14 -9.440 9.515 -5.772 1.00 0.00 O ATOM 177 CB ARG A 14 -11.211 11.051 -3.499 1.00 0.00 C ATOM 178 CG ARG A 14 -10.080 12.032 -3.762 1.00 0.00 C ATOM 179 CD ARG A 14 -10.550 13.213 -4.596 1.00 0.00 C ATOM 180 NE ARG A 14 -11.302 14.180 -3.801 1.00 0.00 N ATOM 181 CZ ARG A 14 -12.302 14.909 -4.284 1.00 0.00 C ATOM 182 NH1 ARG A 14 -12.669 14.780 -5.551 1.00 0.00 N ATOM 183 NH2 ARG A 14 -12.938 15.768 -3.497 1.00 0.00 N ATOM 0 H ARG A 14 -13.266 9.663 -3.650 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.676 10.699 -5.567 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.119 11.609 -3.269 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.969 10.459 -2.617 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -9.680 12.391 -2.814 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -9.267 11.522 -4.278 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -9.688 13.706 -5.045 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -11.174 12.853 -5.414 1.00 0.00 H new ATOM 0 HE ARG A 14 -11.045 14.302 -2.821 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -12.183 14.120 -6.158 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -13.437 15.341 -5.919 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -12.659 15.869 -2.521 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -13.706 16.328 -3.868 1.00 0.00 H new ATOM 197 N TRP A 15 -10.188 8.124 -4.171 1.00 0.00 N ATOM 198 CA TRP A 15 -9.077 7.190 -4.310 1.00 0.00 C ATOM 199 C TRP A 15 -9.135 6.471 -5.654 1.00 0.00 C ATOM 200 O TRP A 15 -8.131 6.364 -6.355 1.00 0.00 O ATOM 201 CB TRP A 15 -9.095 6.170 -3.171 1.00 0.00 C ATOM 202 CG TRP A 15 -9.312 6.788 -1.823 1.00 0.00 C ATOM 203 CD1 TRP A 15 -8.927 8.036 -1.422 1.00 0.00 C ATOM 204 CD2 TRP A 15 -9.963 6.187 -0.699 1.00 0.00 C ATOM 205 NE1 TRP A 15 -9.300 8.246 -0.117 1.00 0.00 N ATOM 206 CE2 TRP A 15 -9.937 7.127 0.350 1.00 0.00 C ATOM 207 CE3 TRP A 15 -10.566 4.946 -0.476 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -10.491 6.863 1.600 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.115 4.686 0.765 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.076 5.641 1.790 1.00 0.00 C ATOM 0 H TRP A 15 -10.872 7.863 -3.461 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.149 7.759 -4.263 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -9.882 5.440 -3.359 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.151 5.626 -3.165 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.406 8.752 -2.040 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.130 9.098 0.418 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.602 4.204 -1.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -10.460 7.597 2.392 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.582 3.730 0.948 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -11.516 5.408 2.748 1.00 0.00 H new ATOM 221 N GLY A 16 -10.320 5.980 -6.006 1.00 0.00 N ATOM 222 CA GLY A 16 -10.486 5.277 -7.265 1.00 0.00 C ATOM 223 C GLY A 16 -9.642 5.870 -8.376 1.00 0.00 C ATOM 224 O GLY A 16 -9.012 5.141 -9.143 1.00 0.00 O ATOM 0 H GLY A 16 -11.167 6.056 -5.442 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.219 4.229 -7.130 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.536 5.304 -7.557 1.00 0.00 H new ATOM 228 N PHE A 17 -9.630 7.196 -8.465 1.00 0.00 N ATOM 229 CA PHE A 17 -8.858 7.886 -9.492 1.00 0.00 C ATOM 230 C PHE A 17 -7.432 7.348 -9.554 1.00 0.00 C ATOM 231 O PHE A 17 -6.954 6.946 -10.615 1.00 0.00 O ATOM 232 CB PHE A 17 -8.836 9.391 -9.217 1.00 0.00 C ATOM 233 CG PHE A 17 -10.203 10.014 -9.180 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.111 9.786 -10.201 1.00 0.00 C ATOM 235 CD2 PHE A 17 -10.579 10.828 -8.123 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.369 10.357 -10.169 1.00 0.00 C ATOM 237 CE2 PHE A 17 -11.835 11.401 -8.086 1.00 0.00 C ATOM 238 CZ PHE A 17 -12.731 11.166 -9.110 1.00 0.00 C ATOM 0 H PHE A 17 -10.146 7.814 -7.839 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.337 7.706 -10.454 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.338 9.571 -8.264 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.241 9.884 -9.986 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.832 9.155 -11.032 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -9.882 11.016 -7.320 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.068 10.171 -10.971 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.116 12.033 -7.256 1.00 0.00 H new ATOM 0 HZ PHE A 17 -13.713 11.614 -9.083 1.00 0.00 H new ATOM 248 N GLY A 18 -6.756 7.344 -8.409 1.00 0.00 N ATOM 249 CA GLY A 18 -5.391 6.855 -8.355 1.00 0.00 C ATOM 250 C GLY A 18 -4.800 6.938 -6.962 1.00 0.00 C ATOM 251 O GLY A 18 -5.399 7.524 -6.060 1.00 0.00 O ATOM 0 H GLY A 18 -7.130 7.671 -7.518 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.365 5.820 -8.696 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.774 7.433 -9.043 1.00 0.00 H new ATOM 255 N MET A 19 -3.622 6.349 -6.784 1.00 0.00 N ATOM 256 CA MET A 19 -2.951 6.359 -5.489 1.00 0.00 C ATOM 257 C MET A 19 -2.782 7.785 -4.976 1.00 0.00 C ATOM 258 O MET A 19 -3.005 8.061 -3.797 1.00 0.00 O ATOM 259 CB MET A 19 -1.585 5.677 -5.594 1.00 0.00 C ATOM 260 CG MET A 19 -1.103 5.079 -4.282 1.00 0.00 C ATOM 261 SD MET A 19 0.027 3.694 -4.524 1.00 0.00 S ATOM 262 CE MET A 19 1.301 4.466 -5.518 1.00 0.00 C ATOM 0 H MET A 19 -3.113 5.859 -7.519 1.00 0.00 H new ATOM 0 HA MET A 19 -3.571 5.808 -4.782 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.638 4.889 -6.345 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.851 6.403 -5.944 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.605 5.852 -3.696 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.963 4.744 -3.702 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.800 3.708 -6.122 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.850 5.212 -6.172 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.029 4.948 -4.866 1.00 0.00 H new ATOM 272 N ASP A 20 -2.386 8.687 -5.867 1.00 0.00 N ATOM 273 CA ASP A 20 -2.188 10.085 -5.504 1.00 0.00 C ATOM 274 C ASP A 20 -3.157 10.503 -4.402 1.00 0.00 C ATOM 275 O ASP A 20 -2.763 11.141 -3.426 1.00 0.00 O ATOM 276 CB ASP A 20 -2.371 10.984 -6.728 1.00 0.00 C ATOM 277 CG ASP A 20 -1.218 10.872 -7.706 1.00 0.00 C ATOM 278 OD1 ASP A 20 -0.944 9.747 -8.174 1.00 0.00 O ATOM 279 OD2 ASP A 20 -0.589 11.910 -8.002 1.00 0.00 O ATOM 0 H ASP A 20 -2.196 8.475 -6.846 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.170 10.196 -5.130 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.300 10.720 -7.234 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.469 12.020 -6.403 1.00 0.00 H new ATOM 284 N GLU A 21 -4.425 10.139 -4.566 1.00 0.00 N ATOM 285 CA GLU A 21 -5.449 10.478 -3.585 1.00 0.00 C ATOM 286 C GLU A 21 -5.373 9.550 -2.376 1.00 0.00 C ATOM 287 O GLU A 21 -5.068 9.984 -1.265 1.00 0.00 O ATOM 288 CB GLU A 21 -6.840 10.396 -4.218 1.00 0.00 C ATOM 289 CG GLU A 21 -7.009 11.292 -5.433 1.00 0.00 C ATOM 290 CD GLU A 21 -6.745 12.753 -5.122 1.00 0.00 C ATOM 291 OE1 GLU A 21 -6.859 13.136 -3.939 1.00 0.00 O ATOM 292 OE2 GLU A 21 -6.425 13.511 -6.060 1.00 0.00 O ATOM 0 H GLU A 21 -4.767 9.610 -5.368 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.270 11.499 -3.249 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.038 9.364 -4.508 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.586 10.666 -3.471 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.330 10.963 -6.219 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.022 11.184 -5.821 1.00 0.00 H new ATOM 299 N ALA A 22 -5.653 8.270 -2.601 1.00 0.00 N ATOM 300 CA ALA A 22 -5.616 7.281 -1.531 1.00 0.00 C ATOM 301 C ALA A 22 -4.486 7.576 -0.550 1.00 0.00 C ATOM 302 O ALA A 22 -4.577 7.248 0.634 1.00 0.00 O ATOM 303 CB ALA A 22 -5.462 5.882 -2.111 1.00 0.00 C ATOM 0 H ALA A 22 -5.908 7.894 -3.514 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.559 7.335 -0.986 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.436 5.153 -1.301 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.305 5.665 -2.767 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.535 5.824 -2.681 1.00 0.00 H new ATOM 309 N LEU A 23 -3.422 8.195 -1.049 1.00 0.00 N ATOM 310 CA LEU A 23 -2.274 8.534 -0.215 1.00 0.00 C ATOM 311 C LEU A 23 -2.549 9.788 0.608 1.00 0.00 C ATOM 312 O LEU A 23 -2.426 9.779 1.833 1.00 0.00 O ATOM 313 CB LEU A 23 -1.032 8.743 -1.084 1.00 0.00 C ATOM 314 CG LEU A 23 -0.594 7.545 -1.929 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.529 7.941 -2.874 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.160 6.393 -1.035 1.00 0.00 C ATOM 0 H LEU A 23 -3.330 8.472 -2.026 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.096 7.705 0.470 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.218 9.584 -1.752 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.203 9.027 -0.436 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.444 7.215 -2.526 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.828 7.076 -3.467 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.184 8.734 -3.537 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.382 8.297 -2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.148 5.549 -1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.676 6.711 -0.412 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.993 6.092 -0.399 1.00 0.00 H new ATOM 328 N LYS A 24 -2.925 10.865 -0.073 1.00 0.00 N ATOM 329 CA LYS A 24 -3.222 12.127 0.594 1.00 0.00 C ATOM 330 C LYS A 24 -4.088 11.899 1.829 1.00 0.00 C ATOM 331 O LYS A 24 -3.952 12.599 2.832 1.00 0.00 O ATOM 332 CB LYS A 24 -3.930 13.083 -0.369 1.00 0.00 C ATOM 333 CG LYS A 24 -5.444 12.970 -0.334 1.00 0.00 C ATOM 334 CD LYS A 24 -6.094 13.880 -1.363 1.00 0.00 C ATOM 335 CE LYS A 24 -6.354 15.267 -0.796 1.00 0.00 C ATOM 336 NZ LYS A 24 -7.350 15.236 0.310 1.00 0.00 N ATOM 0 H LYS A 24 -3.031 10.889 -1.087 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.279 12.573 0.910 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.645 14.107 -0.127 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.583 12.887 -1.383 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.737 11.937 -0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.806 13.227 0.661 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.450 13.959 -2.239 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.034 13.440 -1.697 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -5.419 15.691 -0.431 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.713 15.922 -1.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.168 15.826 0.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.665 14.257 0.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.914 15.603 1.180 1.00 0.00 H new ATOM 350 N ASP A 25 -4.977 10.916 1.748 1.00 0.00 N ATOM 351 CA ASP A 25 -5.864 10.594 2.860 1.00 0.00 C ATOM 352 C ASP A 25 -5.275 9.479 3.720 1.00 0.00 C ATOM 353 O ASP A 25 -4.599 8.575 3.229 1.00 0.00 O ATOM 354 CB ASP A 25 -7.241 10.180 2.339 1.00 0.00 C ATOM 355 CG ASP A 25 -8.175 11.361 2.169 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.750 12.373 1.574 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.332 11.274 2.631 1.00 0.00 O ATOM 0 H ASP A 25 -5.103 10.328 0.924 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.971 11.486 3.477 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.126 9.671 1.382 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.687 9.464 3.029 1.00 0.00 H new ATOM 362 N PRO A 26 -5.536 9.545 5.034 1.00 0.00 N ATOM 363 CA PRO A 26 -5.041 8.549 5.990 1.00 0.00 C ATOM 364 C PRO A 26 -5.722 7.195 5.822 1.00 0.00 C ATOM 365 O PRO A 26 -5.059 6.164 5.718 1.00 0.00 O ATOM 366 CB PRO A 26 -5.390 9.159 7.350 1.00 0.00 C ATOM 367 CG PRO A 26 -6.547 10.057 7.076 1.00 0.00 C ATOM 368 CD PRO A 26 -6.335 10.595 5.688 1.00 0.00 C ATOM 0 HA PRO A 26 -3.978 8.350 5.857 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.650 8.388 8.075 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.547 9.714 7.763 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.488 9.512 7.143 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.594 10.866 7.805 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.281 10.760 5.172 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.809 11.550 5.703 1.00 0.00 H new ATOM 376 N VAL A 27 -7.051 7.206 5.796 1.00 0.00 N ATOM 377 CA VAL A 27 -7.823 5.979 5.639 1.00 0.00 C ATOM 378 C VAL A 27 -7.483 5.280 4.328 1.00 0.00 C ATOM 379 O VAL A 27 -7.239 4.074 4.299 1.00 0.00 O ATOM 380 CB VAL A 27 -9.337 6.258 5.682 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.123 4.971 5.488 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.717 6.933 6.991 1.00 0.00 C ATOM 0 H VAL A 27 -7.615 8.051 5.882 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.558 5.330 6.473 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.588 6.935 4.865 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.191 5.188 5.521 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.872 4.533 4.522 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -9.871 4.268 6.282 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.790 7.123 7.004 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.453 6.283 7.825 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.180 7.877 7.083 1.00 0.00 H new ATOM 392 N GLY A 28 -7.468 6.046 3.241 1.00 0.00 N ATOM 393 CA GLY A 28 -7.157 5.484 1.940 1.00 0.00 C ATOM 394 C GLY A 28 -5.826 4.758 1.926 1.00 0.00 C ATOM 395 O GLY A 28 -5.633 3.817 1.156 1.00 0.00 O ATOM 0 H GLY A 28 -7.666 7.047 3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.948 4.793 1.648 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.140 6.282 1.197 1.00 0.00 H new ATOM 399 N ARG A 29 -4.906 5.196 2.779 1.00 0.00 N ATOM 400 CA ARG A 29 -3.585 4.584 2.859 1.00 0.00 C ATOM 401 C ARG A 29 -3.677 3.165 3.413 1.00 0.00 C ATOM 402 O ARG A 29 -3.142 2.225 2.827 1.00 0.00 O ATOM 403 CB ARG A 29 -2.661 5.428 3.739 1.00 0.00 C ATOM 404 CG ARG A 29 -1.843 6.446 2.962 1.00 0.00 C ATOM 405 CD ARG A 29 -1.015 7.321 3.890 1.00 0.00 C ATOM 406 NE ARG A 29 -0.081 6.536 4.693 1.00 0.00 N ATOM 407 CZ ARG A 29 0.597 7.029 5.723 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.445 8.299 6.074 1.00 0.00 N ATOM 409 NH2 ARG A 29 1.428 6.252 6.406 1.00 0.00 N ATOM 0 H ARG A 29 -5.051 5.972 3.424 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.172 4.537 1.851 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.260 5.949 4.485 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -1.984 4.767 4.279 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.184 5.929 2.264 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.509 7.072 2.368 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.461 8.052 3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.679 7.880 4.549 1.00 0.00 H new ATOM 0 HE ARG A 29 0.058 5.555 4.449 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.194 8.899 5.552 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.967 8.675 6.865 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.547 5.274 6.140 1.00 0.00 H new ATOM 0 HH22 ARG A 29 1.948 6.632 7.197 1.00 0.00 H new ATOM 423 N GLU A 30 -4.357 3.020 4.546 1.00 0.00 N ATOM 424 CA GLU A 30 -4.517 1.717 5.179 1.00 0.00 C ATOM 425 C GLU A 30 -5.466 0.834 4.374 1.00 0.00 C ATOM 426 O GLU A 30 -5.171 -0.331 4.108 1.00 0.00 O ATOM 427 CB GLU A 30 -5.041 1.879 6.607 1.00 0.00 C ATOM 428 CG GLU A 30 -6.550 2.041 6.687 1.00 0.00 C ATOM 429 CD GLU A 30 -7.041 2.235 8.108 1.00 0.00 C ATOM 430 OE1 GLU A 30 -7.106 3.399 8.559 1.00 0.00 O ATOM 431 OE2 GLU A 30 -7.361 1.226 8.770 1.00 0.00 O ATOM 0 H GLU A 30 -4.806 3.789 5.044 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.540 1.235 5.211 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.746 1.009 7.194 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.566 2.748 7.063 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -6.852 2.896 6.082 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.029 1.161 6.258 1.00 0.00 H new ATOM 438 N GLN A 31 -6.607 1.397 3.991 1.00 0.00 N ATOM 439 CA GLN A 31 -7.601 0.661 3.218 1.00 0.00 C ATOM 440 C GLN A 31 -6.966 0.012 1.993 1.00 0.00 C ATOM 441 O GLN A 31 -7.001 -1.209 1.836 1.00 0.00 O ATOM 442 CB GLN A 31 -8.735 1.593 2.787 1.00 0.00 C ATOM 443 CG GLN A 31 -9.593 2.082 3.941 1.00 0.00 C ATOM 444 CD GLN A 31 -10.301 0.952 4.662 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.146 0.266 4.086 1.00 0.00 O ATOM 446 NE2 GLN A 31 -9.960 0.752 5.930 1.00 0.00 N ATOM 0 H GLN A 31 -6.866 2.360 4.203 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.009 -0.126 3.853 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.310 2.454 2.271 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.369 1.072 2.069 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -8.967 2.624 4.650 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.333 2.788 3.565 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.255 1.344 6.368 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.404 0.006 6.466 1.00 0.00 H new ATOM 455 N PHE A 32 -6.385 0.836 1.127 1.00 0.00 N ATOM 456 CA PHE A 32 -5.743 0.342 -0.085 1.00 0.00 C ATOM 457 C PHE A 32 -4.732 -0.753 0.242 1.00 0.00 C ATOM 458 O PHE A 32 -4.600 -1.732 -0.493 1.00 0.00 O ATOM 459 CB PHE A 32 -5.049 1.489 -0.823 1.00 0.00 C ATOM 460 CG PHE A 32 -4.080 1.026 -1.874 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.499 0.199 -2.905 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.752 1.417 -1.832 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.610 -0.229 -3.872 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.858 0.993 -2.797 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.288 0.170 -3.819 1.00 0.00 C ATOM 0 H PHE A 32 -6.346 1.849 1.242 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.514 -0.081 -0.728 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -5.805 2.120 -1.290 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.519 2.108 -0.099 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.532 -0.114 -2.953 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.411 2.061 -1.035 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.948 -0.875 -4.669 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.825 1.305 -2.752 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.592 -0.161 -4.576 1.00 0.00 H new ATOM 475 N LEU A 33 -4.020 -0.580 1.350 1.00 0.00 N ATOM 476 CA LEU A 33 -3.019 -1.552 1.776 1.00 0.00 C ATOM 477 C LEU A 33 -3.666 -2.899 2.085 1.00 0.00 C ATOM 478 O LEU A 33 -3.288 -3.926 1.520 1.00 0.00 O ATOM 479 CB LEU A 33 -2.272 -1.038 3.008 1.00 0.00 C ATOM 480 CG LEU A 33 -1.646 -2.105 3.907 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.226 -2.415 3.459 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.662 -1.654 5.360 1.00 0.00 C ATOM 0 H LEU A 33 -4.117 0.224 1.970 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.310 -1.688 0.960 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.483 -0.364 2.675 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.964 -0.447 3.608 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.238 -3.016 3.823 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.203 -3.176 4.111 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.240 -2.782 2.433 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.378 -1.509 3.512 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.213 -2.425 5.985 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.094 -0.729 5.460 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.691 -1.484 5.677 1.00 0.00 H new ATOM 494 N LYS A 34 -4.644 -2.888 2.985 1.00 0.00 N ATOM 495 CA LYS A 34 -5.346 -4.107 3.367 1.00 0.00 C ATOM 496 C LYS A 34 -5.477 -5.055 2.179 1.00 0.00 C ATOM 497 O LYS A 34 -5.054 -6.209 2.244 1.00 0.00 O ATOM 498 CB LYS A 34 -6.733 -3.769 3.918 1.00 0.00 C ATOM 499 CG LYS A 34 -6.701 -2.842 5.121 1.00 0.00 C ATOM 500 CD LYS A 34 -7.971 -2.955 5.947 1.00 0.00 C ATOM 501 CE LYS A 34 -9.026 -1.962 5.485 1.00 0.00 C ATOM 502 NZ LYS A 34 -9.506 -2.263 4.108 1.00 0.00 N ATOM 0 H LYS A 34 -4.968 -2.048 3.463 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.764 -4.604 4.143 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.325 -3.306 3.129 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.239 -4.693 4.196 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.839 -3.082 5.743 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.575 -1.813 4.785 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.366 -3.968 5.872 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.740 -2.780 6.998 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -9.869 -1.980 6.176 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.613 -0.954 5.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -10.385 -1.739 3.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -8.782 -1.978 3.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.686 -3.283 4.019 1.00 0.00 H new ATOM 516 N PHE A 35 -6.064 -4.560 1.094 1.00 0.00 N ATOM 517 CA PHE A 35 -6.249 -5.363 -0.109 1.00 0.00 C ATOM 518 C PHE A 35 -4.930 -5.987 -0.554 1.00 0.00 C ATOM 519 O PHE A 35 -4.852 -7.192 -0.798 1.00 0.00 O ATOM 520 CB PHE A 35 -6.827 -4.505 -1.236 1.00 0.00 C ATOM 521 CG PHE A 35 -6.750 -5.159 -2.586 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.674 -6.123 -2.957 1.00 0.00 C ATOM 523 CD2 PHE A 35 -5.754 -4.810 -3.484 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.607 -6.726 -4.199 1.00 0.00 C ATOM 525 CE2 PHE A 35 -5.682 -5.410 -4.727 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.609 -6.370 -5.085 1.00 0.00 C ATOM 0 H PHE A 35 -6.420 -3.607 1.023 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.950 -6.165 0.123 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.869 -4.277 -1.010 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.293 -3.556 -1.270 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.456 -6.406 -2.268 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.026 -4.061 -3.210 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.334 -7.475 -4.476 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -4.901 -5.129 -5.418 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.553 -6.841 -6.055 1.00 0.00 H new ATOM 536 N LEU A 36 -3.896 -5.160 -0.659 1.00 0.00 N ATOM 537 CA LEU A 36 -2.579 -5.630 -1.076 1.00 0.00 C ATOM 538 C LEU A 36 -2.217 -6.933 -0.370 1.00 0.00 C ATOM 539 O LEU A 36 -1.885 -7.927 -1.014 1.00 0.00 O ATOM 540 CB LEU A 36 -1.520 -4.566 -0.782 1.00 0.00 C ATOM 541 CG LEU A 36 -1.855 -3.143 -1.231 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.690 -2.207 -0.952 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.217 -3.122 -2.709 1.00 0.00 C ATOM 0 H LEU A 36 -3.944 -4.160 -0.461 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.610 -5.817 -2.149 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.336 -4.553 0.292 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.589 -4.867 -1.261 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.717 -2.796 -0.661 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.947 -1.199 -1.278 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.477 -2.199 0.117 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.191 -2.551 -1.495 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.453 -2.102 -3.011 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.374 -3.489 -3.295 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.084 -3.760 -2.880 1.00 0.00 H new ATOM 555 N GLU A 37 -2.287 -6.919 0.958 1.00 0.00 N ATOM 556 CA GLU A 37 -1.968 -8.101 1.751 1.00 0.00 C ATOM 557 C GLU A 37 -2.435 -9.371 1.046 1.00 0.00 C ATOM 558 O GLU A 37 -1.696 -10.352 0.956 1.00 0.00 O ATOM 559 CB GLU A 37 -2.614 -8.005 3.134 1.00 0.00 C ATOM 560 CG GLU A 37 -2.179 -6.783 3.925 1.00 0.00 C ATOM 561 CD GLU A 37 -2.844 -6.702 5.286 1.00 0.00 C ATOM 562 OE1 GLU A 37 -2.853 -7.723 6.004 1.00 0.00 O ATOM 563 OE2 GLU A 37 -3.356 -5.616 5.632 1.00 0.00 O ATOM 0 H GLU A 37 -2.561 -6.104 1.506 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.885 -8.148 1.867 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.698 -7.986 3.019 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.369 -8.902 3.703 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -1.097 -6.805 4.054 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.414 -5.884 3.356 1.00 0.00 H new ATOM 570 N SER A 38 -3.667 -9.346 0.548 1.00 0.00 N ATOM 571 CA SER A 38 -4.235 -10.496 -0.145 1.00 0.00 C ATOM 572 C SER A 38 -3.359 -10.908 -1.324 1.00 0.00 C ATOM 573 O SER A 38 -2.977 -12.071 -1.450 1.00 0.00 O ATOM 574 CB SER A 38 -5.649 -10.176 -0.633 1.00 0.00 C ATOM 575 OG SER A 38 -6.602 -10.372 0.398 1.00 0.00 O ATOM 0 H SER A 38 -4.291 -8.542 0.612 1.00 0.00 H new ATOM 0 HA SER A 38 -4.280 -11.327 0.559 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.692 -9.144 -0.981 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.895 -10.810 -1.485 1.00 0.00 H new ATOM 0 HG SER A 38 -7.497 -10.159 0.061 1.00 0.00 H new ATOM 581 N GLU A 39 -3.044 -9.945 -2.184 1.00 0.00 N ATOM 582 CA GLU A 39 -2.213 -10.207 -3.353 1.00 0.00 C ATOM 583 C GLU A 39 -0.732 -10.165 -2.989 1.00 0.00 C ATOM 584 O GLU A 39 0.132 -10.091 -3.863 1.00 0.00 O ATOM 585 CB GLU A 39 -2.508 -9.187 -4.455 1.00 0.00 C ATOM 586 CG GLU A 39 -1.990 -7.792 -4.147 1.00 0.00 C ATOM 587 CD GLU A 39 -2.032 -6.875 -5.354 1.00 0.00 C ATOM 588 OE1 GLU A 39 -3.147 -6.549 -5.811 1.00 0.00 O ATOM 589 OE2 GLU A 39 -0.951 -6.483 -5.840 1.00 0.00 O ATOM 0 H GLU A 39 -3.352 -8.977 -2.093 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.451 -11.206 -3.719 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.063 -9.533 -5.388 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.585 -9.139 -4.615 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.585 -7.357 -3.344 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.965 -7.861 -3.783 1.00 0.00 H new ATOM 596 N PHE A 40 -0.446 -10.213 -1.692 1.00 0.00 N ATOM 597 CA PHE A 40 0.930 -10.180 -1.210 1.00 0.00 C ATOM 598 C PHE A 40 1.684 -8.994 -1.804 1.00 0.00 C ATOM 599 O PHE A 40 2.840 -9.120 -2.210 1.00 0.00 O ATOM 600 CB PHE A 40 1.648 -11.484 -1.563 1.00 0.00 C ATOM 601 CG PHE A 40 0.887 -12.715 -1.160 1.00 0.00 C ATOM 602 CD1 PHE A 40 0.902 -13.155 0.154 1.00 0.00 C ATOM 603 CD2 PHE A 40 0.158 -13.432 -2.095 1.00 0.00 C ATOM 604 CE1 PHE A 40 0.203 -14.287 0.528 1.00 0.00 C ATOM 605 CE2 PHE A 40 -0.543 -14.564 -1.727 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.520 -14.993 -0.414 1.00 0.00 C ATOM 0 H PHE A 40 -1.149 -10.275 -0.956 1.00 0.00 H new ATOM 0 HA PHE A 40 0.907 -10.069 -0.126 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.826 -11.512 -2.638 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.624 -11.495 -1.078 1.00 0.00 H new ATOM 0 HD1 PHE A 40 1.466 -12.607 0.894 1.00 0.00 H new ATOM 0 HD2 PHE A 40 0.138 -13.102 -3.123 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.222 -14.619 1.555 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -1.109 -15.113 -2.465 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.066 -15.879 -0.125 1.00 0.00 H new ATOM 616 N SER A 41 1.022 -7.842 -1.851 1.00 0.00 N ATOM 617 CA SER A 41 1.628 -6.634 -2.399 1.00 0.00 C ATOM 618 C SER A 41 1.817 -5.580 -1.312 1.00 0.00 C ATOM 619 O SER A 41 2.570 -4.622 -1.484 1.00 0.00 O ATOM 620 CB SER A 41 0.762 -6.070 -3.527 1.00 0.00 C ATOM 621 OG SER A 41 1.222 -4.793 -3.933 1.00 0.00 O ATOM 0 H SER A 41 0.066 -7.720 -1.516 1.00 0.00 H new ATOM 0 HA SER A 41 2.607 -6.898 -2.799 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.777 -6.752 -4.377 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.273 -5.998 -3.194 1.00 0.00 H new ATOM 0 HG SER A 41 0.823 -4.561 -4.797 1.00 0.00 H new ATOM 627 N SER A 42 1.126 -5.765 -0.191 1.00 0.00 N ATOM 628 CA SER A 42 1.213 -4.829 0.924 1.00 0.00 C ATOM 629 C SER A 42 2.620 -4.250 1.038 1.00 0.00 C ATOM 630 O SER A 42 2.793 -3.058 1.293 1.00 0.00 O ATOM 631 CB SER A 42 0.828 -5.523 2.232 1.00 0.00 C ATOM 632 OG SER A 42 1.793 -6.495 2.597 1.00 0.00 O ATOM 0 H SER A 42 0.500 -6.554 -0.031 1.00 0.00 H new ATOM 0 HA SER A 42 0.516 -4.012 0.736 1.00 0.00 H new ATOM 0 HB2 SER A 42 0.735 -4.783 3.026 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.147 -5.997 2.122 1.00 0.00 H new ATOM 0 HG SER A 42 1.525 -6.923 3.437 1.00 0.00 H new ATOM 638 N GLU A 43 3.622 -5.103 0.847 1.00 0.00 N ATOM 639 CA GLU A 43 5.014 -4.676 0.929 1.00 0.00 C ATOM 640 C GLU A 43 5.294 -3.541 -0.052 1.00 0.00 C ATOM 641 O GLU A 43 5.778 -2.478 0.334 1.00 0.00 O ATOM 642 CB GLU A 43 5.949 -5.853 0.645 1.00 0.00 C ATOM 643 CG GLU A 43 5.651 -6.565 -0.664 1.00 0.00 C ATOM 644 CD GLU A 43 6.059 -8.025 -0.640 1.00 0.00 C ATOM 645 OE1 GLU A 43 5.976 -8.646 0.441 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.462 -8.547 -1.700 1.00 0.00 O ATOM 0 H GLU A 43 3.496 -6.093 0.635 1.00 0.00 H new ATOM 0 HA GLU A 43 5.197 -4.312 1.940 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.978 -5.493 0.627 1.00 0.00 H new ATOM 0 HB3 GLU A 43 5.876 -6.569 1.463 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.585 -6.493 -0.878 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.174 -6.059 -1.476 1.00 0.00 H new ATOM 653 N ASN A 44 4.987 -3.777 -1.324 1.00 0.00 N ATOM 654 CA ASN A 44 5.206 -2.776 -2.361 1.00 0.00 C ATOM 655 C ASN A 44 4.913 -1.374 -1.835 1.00 0.00 C ATOM 656 O ASN A 44 5.665 -0.433 -2.092 1.00 0.00 O ATOM 657 CB ASN A 44 4.326 -3.071 -3.577 1.00 0.00 C ATOM 658 CG ASN A 44 4.680 -4.387 -4.242 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.414 -5.201 -3.681 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.157 -4.602 -5.444 1.00 0.00 N ATOM 0 H ASN A 44 4.586 -4.652 -1.661 1.00 0.00 H new ATOM 0 HA ASN A 44 6.253 -2.821 -2.659 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.281 -3.093 -3.269 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.428 -2.262 -4.301 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.359 -5.470 -5.940 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.554 -3.899 -5.871 1.00 0.00 H new ATOM 667 N LEU A 45 3.817 -1.242 -1.097 1.00 0.00 N ATOM 668 CA LEU A 45 3.424 0.045 -0.534 1.00 0.00 C ATOM 669 C LEU A 45 4.145 0.305 0.785 1.00 0.00 C ATOM 670 O LEU A 45 4.822 1.321 0.944 1.00 0.00 O ATOM 671 CB LEU A 45 1.910 0.088 -0.317 1.00 0.00 C ATOM 672 CG LEU A 45 1.372 1.317 0.417 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.270 2.502 -0.530 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.019 1.014 1.044 1.00 0.00 C ATOM 0 H LEU A 45 3.184 -2.010 -0.874 1.00 0.00 H new ATOM 0 HA LEU A 45 3.706 0.825 -1.242 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.422 0.028 -1.290 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.618 -0.801 0.242 1.00 0.00 H new ATOM 0 HG LEU A 45 2.069 1.575 1.214 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.885 3.367 0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.257 2.734 -0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.594 2.256 -1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.349 1.900 1.562 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.688 0.730 0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.123 0.195 1.755 1.00 0.00 H new ATOM 686 N ARG A 46 3.998 -0.621 1.727 1.00 0.00 N ATOM 687 CA ARG A 46 4.636 -0.493 3.031 1.00 0.00 C ATOM 688 C ARG A 46 6.020 0.136 2.899 1.00 0.00 C ATOM 689 O ARG A 46 6.398 1.002 3.689 1.00 0.00 O ATOM 690 CB ARG A 46 4.748 -1.861 3.705 1.00 0.00 C ATOM 691 CG ARG A 46 3.451 -2.335 4.341 1.00 0.00 C ATOM 692 CD ARG A 46 3.703 -3.420 5.377 1.00 0.00 C ATOM 693 NE ARG A 46 4.140 -2.865 6.655 1.00 0.00 N ATOM 694 CZ ARG A 46 4.100 -3.537 7.800 1.00 0.00 C ATOM 695 NH1 ARG A 46 3.644 -4.782 7.826 1.00 0.00 N ATOM 696 NH2 ARG A 46 4.516 -2.964 8.922 1.00 0.00 N ATOM 0 H ARG A 46 3.442 -1.468 1.611 1.00 0.00 H new ATOM 0 HA ARG A 46 4.017 0.158 3.648 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.070 -2.595 2.966 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.523 -1.817 4.470 1.00 0.00 H new ATOM 0 HG2 ARG A 46 2.946 -1.492 4.811 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.783 -2.716 3.568 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.791 -3.998 5.526 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.460 -4.109 5.003 1.00 0.00 H new ATOM 0 HE ARG A 46 4.495 -1.909 6.669 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.323 -5.226 6.965 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.614 -5.296 8.707 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.867 -2.006 8.906 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.485 -3.481 9.801 1.00 0.00 H new ATOM 710 N PHE A 47 6.772 -0.306 1.897 1.00 0.00 N ATOM 711 CA PHE A 47 8.115 0.212 1.663 1.00 0.00 C ATOM 712 C PHE A 47 8.068 1.681 1.251 1.00 0.00 C ATOM 713 O PHE A 47 8.816 2.507 1.772 1.00 0.00 O ATOM 714 CB PHE A 47 8.820 -0.610 0.582 1.00 0.00 C ATOM 715 CG PHE A 47 9.958 0.116 -0.077 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.107 0.422 0.636 1.00 0.00 C ATOM 717 CD2 PHE A 47 9.880 0.492 -1.408 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.155 1.091 0.032 1.00 0.00 C ATOM 719 CE2 PHE A 47 10.925 1.161 -2.017 1.00 0.00 C ATOM 720 CZ PHE A 47 12.065 1.460 -1.296 1.00 0.00 C ATOM 0 H PHE A 47 6.474 -1.022 1.234 1.00 0.00 H new ATOM 0 HA PHE A 47 8.675 0.132 2.594 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.196 -1.532 1.025 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.093 -0.895 -0.178 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.184 0.135 1.674 1.00 0.00 H new ATOM 0 HD2 PHE A 47 8.992 0.260 -1.977 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.044 1.325 0.598 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.850 1.450 -3.055 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.884 1.981 -1.770 1.00 0.00 H new ATOM 730 N TRP A 48 7.183 1.997 0.312 1.00 0.00 N ATOM 731 CA TRP A 48 7.037 3.365 -0.171 1.00 0.00 C ATOM 732 C TRP A 48 6.857 4.336 0.991 1.00 0.00 C ATOM 733 O TRP A 48 7.680 5.229 1.200 1.00 0.00 O ATOM 734 CB TRP A 48 5.847 3.467 -1.126 1.00 0.00 C ATOM 735 CG TRP A 48 5.784 4.772 -1.860 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.551 5.152 -2.924 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.908 5.870 -1.582 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.204 6.420 -3.325 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.198 6.882 -2.518 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.906 6.096 -0.635 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.522 8.099 -2.531 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.236 7.305 -0.649 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.546 8.294 -1.593 1.00 0.00 C ATOM 0 H TRP A 48 6.556 1.325 -0.130 1.00 0.00 H new ATOM 0 HA TRP A 48 7.947 3.633 -0.707 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.900 2.654 -1.850 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.925 3.331 -0.561 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.318 4.545 -3.383 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.627 6.934 -4.098 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.659 5.339 0.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.760 8.863 -3.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.461 7.491 0.080 1.00 0.00 H new ATOM 0 HH2 TRP A 48 3.004 9.228 -1.579 1.00 0.00 H new ATOM 754 N LEU A 49 5.778 4.157 1.744 1.00 0.00 N ATOM 755 CA LEU A 49 5.490 5.018 2.886 1.00 0.00 C ATOM 756 C LEU A 49 6.718 5.167 3.778 1.00 0.00 C ATOM 757 O LEU A 49 7.088 6.276 4.162 1.00 0.00 O ATOM 758 CB LEU A 49 4.322 4.452 3.695 1.00 0.00 C ATOM 759 CG LEU A 49 2.969 4.414 2.984 1.00 0.00 C ATOM 760 CD1 LEU A 49 1.968 3.595 3.785 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.446 5.825 2.757 1.00 0.00 C ATOM 0 H LEU A 49 5.088 3.423 1.585 1.00 0.00 H new ATOM 0 HA LEU A 49 5.217 6.003 2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.577 3.438 4.003 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.216 5.044 4.604 1.00 0.00 H new ATOM 0 HG LEU A 49 3.104 3.937 2.013 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.011 3.579 3.264 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.338 2.576 3.896 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.837 4.043 4.770 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.482 5.779 2.250 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.327 6.328 3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.153 6.381 2.141 1.00 0.00 H new ATOM 773 N ALA A 50 7.346 4.042 4.103 1.00 0.00 N ATOM 774 CA ALA A 50 8.535 4.047 4.947 1.00 0.00 C ATOM 775 C ALA A 50 9.483 5.175 4.554 1.00 0.00 C ATOM 776 O ALA A 50 9.837 6.018 5.378 1.00 0.00 O ATOM 777 CB ALA A 50 9.246 2.705 4.865 1.00 0.00 C ATOM 0 H ALA A 50 7.051 3.115 3.795 1.00 0.00 H new ATOM 0 HA ALA A 50 8.219 4.216 5.976 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.132 2.723 5.500 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.574 1.916 5.202 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.543 2.513 3.834 1.00 0.00 H new ATOM 783 N VAL A 51 9.891 5.185 3.288 1.00 0.00 N ATOM 784 CA VAL A 51 10.797 6.210 2.785 1.00 0.00 C ATOM 785 C VAL A 51 10.252 7.607 3.058 1.00 0.00 C ATOM 786 O VAL A 51 10.963 8.472 3.570 1.00 0.00 O ATOM 787 CB VAL A 51 11.039 6.052 1.272 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.968 7.143 0.763 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.604 4.673 0.965 1.00 0.00 C ATOM 0 H VAL A 51 9.608 4.494 2.593 1.00 0.00 H new ATOM 0 HA VAL A 51 11.743 6.083 3.312 1.00 0.00 H new ATOM 0 HB VAL A 51 10.084 6.152 0.756 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.127 7.015 -0.308 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.519 8.119 0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.924 7.078 1.282 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.769 4.578 -0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.550 4.542 1.491 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.898 3.910 1.292 1.00 0.00 H new ATOM 799 N GLU A 52 8.986 7.821 2.714 1.00 0.00 N ATOM 800 CA GLU A 52 8.347 9.115 2.922 1.00 0.00 C ATOM 801 C GLU A 52 8.616 9.635 4.331 1.00 0.00 C ATOM 802 O GLU A 52 8.958 10.803 4.518 1.00 0.00 O ATOM 803 CB GLU A 52 6.839 9.007 2.686 1.00 0.00 C ATOM 804 CG GLU A 52 6.427 9.265 1.246 1.00 0.00 C ATOM 805 CD GLU A 52 4.944 9.545 1.105 1.00 0.00 C ATOM 806 OE1 GLU A 52 4.179 9.169 2.018 1.00 0.00 O ATOM 807 OE2 GLU A 52 4.548 10.140 0.081 1.00 0.00 O ATOM 0 H GLU A 52 8.383 7.116 2.290 1.00 0.00 H new ATOM 0 HA GLU A 52 8.771 9.820 2.207 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.505 8.011 2.978 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.327 9.718 3.334 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.992 10.112 0.857 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.689 8.400 0.636 1.00 0.00 H new ATOM 814 N ASP A 53 8.460 8.760 5.318 1.00 0.00 N ATOM 815 CA ASP A 53 8.687 9.129 6.710 1.00 0.00 C ATOM 816 C ASP A 53 10.179 9.246 7.005 1.00 0.00 C ATOM 817 O ASP A 53 10.613 10.149 7.721 1.00 0.00 O ATOM 818 CB ASP A 53 8.049 8.099 7.644 1.00 0.00 C ATOM 819 CG ASP A 53 6.562 7.939 7.399 1.00 0.00 C ATOM 820 OD1 ASP A 53 5.882 8.965 7.184 1.00 0.00 O ATOM 821 OD2 ASP A 53 6.077 6.789 7.423 1.00 0.00 O ATOM 0 H ASP A 53 8.177 7.790 5.180 1.00 0.00 H new ATOM 0 HA ASP A 53 8.224 10.100 6.883 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.542 7.136 7.510 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.214 8.400 8.679 1.00 0.00 H new ATOM 826 N LEU A 54 10.961 8.326 6.450 1.00 0.00 N ATOM 827 CA LEU A 54 12.405 8.324 6.654 1.00 0.00 C ATOM 828 C LEU A 54 12.936 9.746 6.802 1.00 0.00 C ATOM 829 O LEU A 54 13.415 10.135 7.868 1.00 0.00 O ATOM 830 CB LEU A 54 13.104 7.625 5.487 1.00 0.00 C ATOM 831 CG LEU A 54 14.628 7.529 5.578 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.039 6.701 6.786 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.201 6.932 4.301 1.00 0.00 C ATOM 0 H LEU A 54 10.619 7.572 5.855 1.00 0.00 H new ATOM 0 HA LEU A 54 12.616 7.780 7.574 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.701 6.616 5.400 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.847 8.151 4.568 1.00 0.00 H new ATOM 0 HG LEU A 54 15.030 8.535 5.698 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.126 6.643 6.835 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.659 7.169 7.694 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.626 5.696 6.696 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.286 6.871 4.383 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.792 5.933 4.151 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.936 7.564 3.453 1.00 0.00 H new ATOM 845 N LYS A 55 12.844 10.521 5.727 1.00 0.00 N ATOM 846 CA LYS A 55 13.311 11.902 5.736 1.00 0.00 C ATOM 847 C LYS A 55 12.741 12.662 6.930 1.00 0.00 C ATOM 848 O LYS A 55 13.446 13.428 7.586 1.00 0.00 O ATOM 849 CB LYS A 55 12.916 12.605 4.435 1.00 0.00 C ATOM 850 CG LYS A 55 11.415 12.743 4.251 1.00 0.00 C ATOM 851 CD LYS A 55 11.056 13.045 2.805 1.00 0.00 C ATOM 852 CE LYS A 55 10.926 11.770 1.986 1.00 0.00 C ATOM 853 NZ LYS A 55 11.044 12.035 0.525 1.00 0.00 N ATOM 0 H LYS A 55 12.450 10.216 4.837 1.00 0.00 H new ATOM 0 HA LYS A 55 14.398 11.890 5.820 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.369 13.596 4.415 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.328 12.050 3.592 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.923 11.822 4.564 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.040 13.539 4.894 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.118 13.599 2.770 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.821 13.685 2.365 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.697 11.063 2.290 1.00 0.00 H new ATOM 0 HE3 LYS A 55 9.964 11.301 2.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.272 11.150 0.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.143 12.410 0.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.799 12.730 0.358 1.00 0.00 H new ATOM 867 N LYS A 56 11.460 12.443 7.206 1.00 0.00 N ATOM 868 CA LYS A 56 10.794 13.104 8.323 1.00 0.00 C ATOM 869 C LYS A 56 11.503 12.797 9.638 1.00 0.00 C ATOM 870 O LYS A 56 11.666 13.674 10.486 1.00 0.00 O ATOM 871 CB LYS A 56 9.331 12.663 8.405 1.00 0.00 C ATOM 872 CG LYS A 56 8.557 12.882 7.116 1.00 0.00 C ATOM 873 CD LYS A 56 8.322 14.359 6.851 1.00 0.00 C ATOM 874 CE LYS A 56 8.115 14.634 5.369 1.00 0.00 C ATOM 875 NZ LYS A 56 7.650 16.027 5.123 1.00 0.00 N ATOM 0 H LYS A 56 10.862 11.813 6.672 1.00 0.00 H new ATOM 0 HA LYS A 56 10.834 14.180 8.152 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.293 11.606 8.667 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.840 13.209 9.211 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.106 12.445 6.282 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.599 12.365 7.173 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.449 14.695 7.410 1.00 0.00 H new ATOM 0 HD3 LYS A 56 9.174 14.935 7.213 1.00 0.00 H new ATOM 0 HE2 LYS A 56 9.049 14.463 4.834 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.385 13.931 4.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.521 16.175 4.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.746 16.183 5.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.358 16.698 5.483 1.00 0.00 H new ATOM 889 N ARG A 57 11.923 11.546 9.800 1.00 0.00 N ATOM 890 CA ARG A 57 12.615 11.124 11.012 1.00 0.00 C ATOM 891 C ARG A 57 13.806 12.032 11.303 1.00 0.00 C ATOM 892 O ARG A 57 14.375 12.657 10.407 1.00 0.00 O ATOM 893 CB ARG A 57 13.086 9.675 10.877 1.00 0.00 C ATOM 894 CG ARG A 57 11.952 8.663 10.879 1.00 0.00 C ATOM 895 CD ARG A 57 11.305 8.553 12.251 1.00 0.00 C ATOM 896 NE ARG A 57 10.140 9.424 12.378 1.00 0.00 N ATOM 897 CZ ARG A 57 8.955 9.007 12.810 1.00 0.00 C ATOM 898 NH1 ARG A 57 8.780 7.739 13.156 1.00 0.00 N ATOM 899 NH2 ARG A 57 7.942 9.860 12.898 1.00 0.00 N ATOM 0 H ARG A 57 11.796 10.808 9.108 1.00 0.00 H new ATOM 0 HA ARG A 57 11.914 11.196 11.844 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.653 9.571 9.952 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.768 9.446 11.696 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.202 8.955 10.144 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.333 7.688 10.576 1.00 0.00 H new ATOM 0 HD2 ARG A 57 11.006 7.520 12.429 1.00 0.00 H new ATOM 0 HD3 ARG A 57 12.035 8.810 13.018 1.00 0.00 H new ATOM 0 HE ARG A 57 10.242 10.406 12.121 1.00 0.00 H new ATOM 0 HH11 ARG A 57 9.556 7.081 13.091 1.00 0.00 H new ATOM 0 HH12 ARG A 57 7.869 7.422 13.487 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.073 10.836 12.634 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.032 9.539 13.230 1.00 0.00 H new ATOM 913 N PRO A 58 14.193 12.109 12.585 1.00 0.00 N ATOM 914 CA PRO A 58 15.320 12.938 13.023 1.00 0.00 C ATOM 915 C PRO A 58 16.662 12.390 12.549 1.00 0.00 C ATOM 916 O PRO A 58 16.786 11.203 12.246 1.00 0.00 O ATOM 917 CB PRO A 58 15.229 12.881 14.550 1.00 0.00 C ATOM 918 CG PRO A 58 14.524 11.601 14.840 1.00 0.00 C ATOM 919 CD PRO A 58 13.561 11.392 13.705 1.00 0.00 C ATOM 0 HA PRO A 58 15.266 13.948 12.616 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.219 12.900 15.007 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.679 13.735 14.946 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.230 10.774 14.910 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.998 11.652 15.793 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.428 10.334 13.481 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.575 11.795 13.935 1.00 0.00 H new ATOM 927 N ILE A 59 17.662 13.262 12.487 1.00 0.00 N ATOM 928 CA ILE A 59 18.995 12.865 12.051 1.00 0.00 C ATOM 929 C ILE A 59 19.455 11.601 12.770 1.00 0.00 C ATOM 930 O ILE A 59 19.980 10.676 12.150 1.00 0.00 O ATOM 931 CB ILE A 59 20.025 13.984 12.295 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.254 13.778 11.407 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.425 14.025 13.762 1.00 0.00 C ATOM 934 CD1 ILE A 59 22.271 12.826 11.995 1.00 0.00 C ATOM 0 H ILE A 59 17.575 14.248 12.733 1.00 0.00 H new ATOM 0 HA ILE A 59 18.931 12.669 10.981 1.00 0.00 H new ATOM 0 HB ILE A 59 19.570 14.940 12.036 1.00 0.00 H new ATOM 0 HG12 ILE A 59 20.932 13.399 10.437 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.730 14.742 11.230 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.153 14.821 13.918 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.543 14.214 14.374 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.865 13.069 14.046 1.00 0.00 H new ATOM 0 HD11 ILE A 59 23.115 12.728 11.312 1.00 0.00 H new ATOM 0 HD12 ILE A 59 22.622 13.213 12.952 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.811 11.850 12.146 1.00 0.00 H new ATOM 946 N LYS A 60 19.253 11.568 14.083 1.00 0.00 N ATOM 947 CA LYS A 60 19.643 10.417 14.889 1.00 0.00 C ATOM 948 C LYS A 60 18.940 9.152 14.407 1.00 0.00 C ATOM 949 O LYS A 60 19.461 8.047 14.554 1.00 0.00 O ATOM 950 CB LYS A 60 19.316 10.666 16.363 1.00 0.00 C ATOM 951 CG LYS A 60 17.839 10.906 16.626 1.00 0.00 C ATOM 952 CD LYS A 60 17.626 11.768 17.858 1.00 0.00 C ATOM 953 CE LYS A 60 17.752 13.248 17.532 1.00 0.00 C ATOM 954 NZ LYS A 60 17.057 14.099 18.537 1.00 0.00 N ATOM 0 H LYS A 60 18.821 12.326 14.612 1.00 0.00 H new ATOM 0 HA LYS A 60 20.719 10.277 14.781 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.646 9.809 16.950 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.884 11.529 16.712 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.388 11.390 15.760 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.332 9.950 16.757 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.639 11.569 18.276 1.00 0.00 H new ATOM 0 HD3 LYS A 60 18.356 11.499 18.622 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.806 13.522 17.491 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.334 13.439 16.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 17.166 15.101 18.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 16.046 13.855 18.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 17.472 13.936 19.476 1.00 0.00 H new ATOM 968 N GLU A 61 17.754 9.323 13.831 1.00 0.00 N ATOM 969 CA GLU A 61 16.981 8.193 13.327 1.00 0.00 C ATOM 970 C GLU A 61 16.976 8.174 11.801 1.00 0.00 C ATOM 971 O GLU A 61 16.150 7.505 11.180 1.00 0.00 O ATOM 972 CB GLU A 61 15.545 8.256 13.852 1.00 0.00 C ATOM 973 CG GLU A 61 15.435 8.042 15.352 1.00 0.00 C ATOM 974 CD GLU A 61 14.013 8.183 15.859 1.00 0.00 C ATOM 975 OE1 GLU A 61 13.113 7.529 15.293 1.00 0.00 O ATOM 976 OE2 GLU A 61 13.801 8.949 16.823 1.00 0.00 O ATOM 0 H GLU A 61 17.308 10.231 13.702 1.00 0.00 H new ATOM 0 HA GLU A 61 17.451 7.276 13.682 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.117 9.226 13.600 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.947 7.501 13.341 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.809 7.049 15.602 1.00 0.00 H new ATOM 0 HG3 GLU A 61 16.073 8.761 15.866 1.00 0.00 H new ATOM 983 N VAL A 62 17.904 8.914 11.203 1.00 0.00 N ATOM 984 CA VAL A 62 18.009 8.982 9.751 1.00 0.00 C ATOM 985 C VAL A 62 18.719 7.754 9.192 1.00 0.00 C ATOM 986 O VAL A 62 18.166 6.996 8.395 1.00 0.00 O ATOM 987 CB VAL A 62 18.764 10.247 9.301 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.504 9.992 7.997 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.804 11.418 9.158 1.00 0.00 C ATOM 0 H VAL A 62 18.594 9.475 11.702 1.00 0.00 H new ATOM 0 HA VAL A 62 16.991 9.018 9.362 1.00 0.00 H new ATOM 0 HB VAL A 62 19.499 10.501 10.065 1.00 0.00 H new ATOM 0 HG11 VAL A 62 20.031 10.897 7.695 1.00 0.00 H new ATOM 0 HG12 VAL A 62 20.222 9.184 8.138 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.790 9.712 7.222 1.00 0.00 H new ATOM 0 HG21 VAL A 62 18.355 12.303 8.839 1.00 0.00 H new ATOM 0 HG22 VAL A 62 17.044 11.177 8.415 1.00 0.00 H new ATOM 0 HG23 VAL A 62 17.325 11.615 10.117 1.00 0.00 H new ATOM 999 N PRO A 63 19.973 7.551 9.620 1.00 0.00 N ATOM 1000 CA PRO A 63 20.786 6.414 9.176 1.00 0.00 C ATOM 1001 C PRO A 63 20.278 5.087 9.729 1.00 0.00 C ATOM 1002 O PRO A 63 20.063 4.134 8.980 1.00 0.00 O ATOM 1003 CB PRO A 63 22.175 6.731 9.737 1.00 0.00 C ATOM 1004 CG PRO A 63 21.917 7.608 10.914 1.00 0.00 C ATOM 1005 CD PRO A 63 20.695 8.414 10.570 1.00 0.00 C ATOM 0 HA PRO A 63 20.765 6.296 8.093 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.701 5.822 10.028 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.796 7.235 8.996 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.753 7.015 11.814 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.770 8.257 11.111 1.00 0.00 H new ATOM 0 HD2 PRO A 63 20.094 8.630 11.453 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.959 9.372 10.122 1.00 0.00 H new ATOM 1013 N SER A 64 20.088 5.033 11.043 1.00 0.00 N ATOM 1014 CA SER A 64 19.608 3.821 11.696 1.00 0.00 C ATOM 1015 C SER A 64 18.461 3.196 10.908 1.00 0.00 C ATOM 1016 O SER A 64 18.358 1.974 10.803 1.00 0.00 O ATOM 1017 CB SER A 64 19.152 4.131 13.123 1.00 0.00 C ATOM 1018 OG SER A 64 20.261 4.273 13.994 1.00 0.00 O ATOM 0 H SER A 64 20.259 5.814 11.676 1.00 0.00 H new ATOM 0 HA SER A 64 20.431 3.108 11.732 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.562 5.047 13.128 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.503 3.332 13.482 1.00 0.00 H new ATOM 0 HG SER A 64 19.943 4.472 14.899 1.00 0.00 H new ATOM 1024 N ARG A 65 17.601 4.045 10.355 1.00 0.00 N ATOM 1025 CA ARG A 65 16.460 3.578 9.576 1.00 0.00 C ATOM 1026 C ARG A 65 16.889 3.182 8.166 1.00 0.00 C ATOM 1027 O ARG A 65 16.470 2.148 7.646 1.00 0.00 O ATOM 1028 CB ARG A 65 15.383 4.663 9.508 1.00 0.00 C ATOM 1029 CG ARG A 65 13.971 4.113 9.398 1.00 0.00 C ATOM 1030 CD ARG A 65 13.469 3.593 10.736 1.00 0.00 C ATOM 1031 NE ARG A 65 13.075 4.676 11.632 1.00 0.00 N ATOM 1032 CZ ARG A 65 12.975 4.541 12.949 1.00 0.00 C ATOM 1033 NH1 ARG A 65 13.238 3.374 13.521 1.00 0.00 N ATOM 1034 NH2 ARG A 65 12.611 5.574 13.698 1.00 0.00 N ATOM 0 H ARG A 65 17.672 5.060 10.432 1.00 0.00 H new ATOM 0 HA ARG A 65 16.049 2.699 10.072 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.452 5.288 10.398 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.581 5.306 8.651 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.302 4.894 9.036 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.949 3.309 8.663 1.00 0.00 H new ATOM 0 HD2 ARG A 65 12.619 2.931 10.572 1.00 0.00 H new ATOM 0 HD3 ARG A 65 14.250 2.997 11.209 1.00 0.00 H new ATOM 0 HE ARG A 65 12.865 5.587 11.224 1.00 0.00 H new ATOM 0 HH11 ARG A 65 13.518 2.577 12.949 1.00 0.00 H new ATOM 0 HH12 ARG A 65 13.160 3.273 14.533 1.00 0.00 H new ATOM 0 HH21 ARG A 65 12.408 6.473 13.262 1.00 0.00 H new ATOM 0 HH22 ARG A 65 12.535 5.469 14.710 1.00 0.00 H new ATOM 1048 N VAL A 66 17.726 4.013 7.553 1.00 0.00 N ATOM 1049 CA VAL A 66 18.212 3.750 6.204 1.00 0.00 C ATOM 1050 C VAL A 66 18.380 2.254 5.962 1.00 0.00 C ATOM 1051 O VAL A 66 17.669 1.664 5.150 1.00 0.00 O ATOM 1052 CB VAL A 66 19.557 4.455 5.945 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.232 3.881 4.708 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.353 5.956 5.803 1.00 0.00 C ATOM 0 H VAL A 66 18.081 4.874 7.969 1.00 0.00 H new ATOM 0 HA VAL A 66 17.465 4.145 5.516 1.00 0.00 H new ATOM 0 HB VAL A 66 20.210 4.279 6.800 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.181 4.391 4.541 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.414 2.816 4.854 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.586 4.024 3.842 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.313 6.438 5.620 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.683 6.155 4.967 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.917 6.352 6.720 1.00 0.00 H new ATOM 1064 N GLN A 67 19.325 1.648 6.673 1.00 0.00 N ATOM 1065 CA GLN A 67 19.586 0.220 6.534 1.00 0.00 C ATOM 1066 C GLN A 67 18.342 -0.596 6.870 1.00 0.00 C ATOM 1067 O GLN A 67 17.957 -1.494 6.121 1.00 0.00 O ATOM 1068 CB GLN A 67 20.745 -0.198 7.441 1.00 0.00 C ATOM 1069 CG GLN A 67 20.386 -0.213 8.919 1.00 0.00 C ATOM 1070 CD GLN A 67 21.590 -0.450 9.809 1.00 0.00 C ATOM 1071 OE1 GLN A 67 21.870 -1.582 10.206 1.00 0.00 O ATOM 1072 NE2 GLN A 67 22.310 0.619 10.129 1.00 0.00 N ATOM 0 H GLN A 67 19.922 2.123 7.350 1.00 0.00 H new ATOM 0 HA GLN A 67 19.857 0.025 5.496 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.085 -1.191 7.148 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.581 0.484 7.286 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.923 0.737 9.186 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.645 -0.992 9.101 1.00 0.00 H new ATOM 0 HE21 GLN A 67 22.042 1.538 9.778 1.00 0.00 H new ATOM 0 HE22 GLN A 67 23.131 0.521 10.726 1.00 0.00 H new ATOM 1081 N GLU A 68 17.718 -0.277 8.000 1.00 0.00 N ATOM 1082 CA GLU A 68 16.518 -0.982 8.434 1.00 0.00 C ATOM 1083 C GLU A 68 15.527 -1.130 7.282 1.00 0.00 C ATOM 1084 O GLU A 68 15.213 -2.242 6.858 1.00 0.00 O ATOM 1085 CB GLU A 68 15.857 -0.242 9.598 1.00 0.00 C ATOM 1086 CG GLU A 68 16.506 -0.521 10.943 1.00 0.00 C ATOM 1087 CD GLU A 68 16.691 -2.003 11.206 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.723 -2.765 11.005 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.803 -2.399 11.612 1.00 0.00 O ATOM 0 H GLU A 68 18.024 0.464 8.631 1.00 0.00 H new ATOM 0 HA GLU A 68 16.813 -1.977 8.767 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.892 0.830 9.403 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.805 -0.524 9.646 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.476 -0.025 10.984 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.893 -0.089 11.734 1.00 0.00 H new ATOM 1096 N ILE A 69 15.038 0.000 6.783 1.00 0.00 N ATOM 1097 CA ILE A 69 14.084 -0.003 5.681 1.00 0.00 C ATOM 1098 C ILE A 69 14.563 -0.894 4.540 1.00 0.00 C ATOM 1099 O ILE A 69 13.777 -1.624 3.936 1.00 0.00 O ATOM 1100 CB ILE A 69 13.844 1.419 5.140 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.284 2.320 6.243 1.00 0.00 C ATOM 1102 CG2 ILE A 69 12.898 1.380 3.949 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.648 3.779 6.073 1.00 0.00 C ATOM 0 H ILE A 69 15.286 0.929 7.124 1.00 0.00 H new ATOM 0 HA ILE A 69 13.147 -0.396 6.077 1.00 0.00 H new ATOM 0 HB ILE A 69 14.797 1.832 4.809 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.198 2.224 6.263 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.653 1.972 7.208 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.738 2.392 3.578 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.333 0.768 3.159 1.00 0.00 H new ATOM 0 HG23 ILE A 69 11.944 0.951 4.256 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.218 4.359 6.890 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.733 3.887 6.083 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.256 4.144 5.124 1.00 0.00 H new ATOM 1115 N TRP A 70 15.858 -0.832 4.253 1.00 0.00 N ATOM 1116 CA TRP A 70 16.443 -1.636 3.185 1.00 0.00 C ATOM 1117 C TRP A 70 16.570 -3.095 3.609 1.00 0.00 C ATOM 1118 O TRP A 70 16.733 -3.981 2.771 1.00 0.00 O ATOM 1119 CB TRP A 70 17.816 -1.083 2.798 1.00 0.00 C ATOM 1120 CG TRP A 70 18.848 -2.150 2.589 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.467 -2.891 3.554 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.382 -2.592 1.336 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.354 -3.768 2.977 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.320 -3.605 1.617 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.157 -2.233 0.004 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.031 -4.259 0.615 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 19.864 -2.884 -0.989 1.00 0.00 C ATOM 1128 CH2 TRP A 70 20.792 -3.888 -0.680 1.00 0.00 C ATOM 0 H TRP A 70 16.523 -0.234 4.744 1.00 0.00 H new ATOM 0 HA TRP A 70 15.781 -1.585 2.321 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.719 -0.497 1.884 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.159 -0.403 3.578 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.286 -2.801 4.615 1.00 0.00 H new ATOM 0 HE1 TRP A 70 20.942 -4.433 3.480 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.444 -1.461 -0.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 21.747 -5.033 0.852 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.699 -2.614 -2.022 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.328 -4.378 -1.479 1.00 0.00 H new ATOM 1139 N GLN A 71 16.494 -3.336 4.914 1.00 0.00 N ATOM 1140 CA GLN A 71 16.601 -4.689 5.448 1.00 0.00 C ATOM 1141 C GLN A 71 15.223 -5.322 5.607 1.00 0.00 C ATOM 1142 O GLN A 71 15.105 -6.486 5.986 1.00 0.00 O ATOM 1143 CB GLN A 71 17.326 -4.672 6.795 1.00 0.00 C ATOM 1144 CG GLN A 71 18.824 -4.438 6.677 1.00 0.00 C ATOM 1145 CD GLN A 71 19.607 -5.096 7.796 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.172 -5.113 8.947 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.770 -5.644 7.462 1.00 0.00 N ATOM 0 H GLN A 71 16.359 -2.613 5.620 1.00 0.00 H new ATOM 0 HA GLN A 71 17.176 -5.287 4.741 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.893 -3.892 7.421 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.154 -5.621 7.303 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.174 -4.823 5.719 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.022 -3.366 6.682 1.00 0.00 H new ATOM 0 HE21 GLN A 71 21.092 -5.607 6.495 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.341 -6.102 8.173 1.00 0.00 H new ATOM 1156 N GLU A 72 14.184 -4.546 5.314 1.00 0.00 N ATOM 1157 CA GLU A 72 12.813 -5.032 5.426 1.00 0.00 C ATOM 1158 C GLU A 72 12.271 -5.450 4.062 1.00 0.00 C ATOM 1159 O GLU A 72 11.667 -6.513 3.921 1.00 0.00 O ATOM 1160 CB GLU A 72 11.915 -3.954 6.036 1.00 0.00 C ATOM 1161 CG GLU A 72 10.646 -4.504 6.665 1.00 0.00 C ATOM 1162 CD GLU A 72 10.816 -4.824 8.137 1.00 0.00 C ATOM 1163 OE1 GLU A 72 10.992 -3.878 8.934 1.00 0.00 O ATOM 1164 OE2 GLU A 72 10.772 -6.020 8.493 1.00 0.00 O ATOM 0 H GLU A 72 14.265 -3.580 4.998 1.00 0.00 H new ATOM 0 HA GLU A 72 12.816 -5.905 6.079 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.479 -3.409 6.793 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.645 -3.237 5.261 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.842 -3.778 6.545 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.343 -5.406 6.134 1.00 0.00 H new ATOM 1171 N PHE A 73 12.492 -4.605 3.060 1.00 0.00 N ATOM 1172 CA PHE A 73 12.024 -4.885 1.707 1.00 0.00 C ATOM 1173 C PHE A 73 13.198 -4.996 0.738 1.00 0.00 C ATOM 1174 O PHE A 73 13.192 -5.828 -0.170 1.00 0.00 O ATOM 1175 CB PHE A 73 11.064 -3.789 1.240 1.00 0.00 C ATOM 1176 CG PHE A 73 10.196 -3.244 2.338 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.722 -2.394 3.297 1.00 0.00 C ATOM 1178 CD2 PHE A 73 8.854 -3.582 2.411 1.00 0.00 C ATOM 1179 CE1 PHE A 73 9.926 -1.892 4.309 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.053 -3.082 3.420 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.590 -2.235 4.370 1.00 0.00 C ATOM 0 H PHE A 73 12.992 -3.721 3.159 1.00 0.00 H new ATOM 0 HA PHE A 73 11.496 -5.839 1.721 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.641 -2.973 0.805 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.428 -4.187 0.449 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.766 -2.121 3.253 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.429 -4.244 1.671 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.349 -1.232 5.052 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.009 -3.353 3.466 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.966 -1.842 5.159 1.00 0.00 H new ATOM 1191 N LEU A 74 14.204 -4.151 0.938 1.00 0.00 N ATOM 1192 CA LEU A 74 15.385 -4.152 0.083 1.00 0.00 C ATOM 1193 C LEU A 74 16.403 -5.183 0.561 1.00 0.00 C ATOM 1194 O LEU A 74 17.577 -5.125 0.197 1.00 0.00 O ATOM 1195 CB LEU A 74 16.023 -2.761 0.059 1.00 0.00 C ATOM 1196 CG LEU A 74 15.059 -1.583 -0.083 1.00 0.00 C ATOM 1197 CD1 LEU A 74 15.805 -0.264 0.052 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.327 -1.650 -1.415 1.00 0.00 C ATOM 0 H LEU A 74 14.225 -3.457 1.685 1.00 0.00 H new ATOM 0 HA LEU A 74 15.072 -4.419 -0.926 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.593 -2.629 0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.735 -2.724 -0.766 1.00 0.00 H new ATOM 0 HG LEU A 74 14.321 -1.643 0.717 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.103 0.563 -0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.282 -0.214 1.031 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.565 -0.195 -0.726 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.645 -0.804 -1.498 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.050 -1.615 -2.230 1.00 0.00 H new ATOM 0 HD23 LEU A 74 13.760 -2.579 -1.472 1.00 0.00 H new ATOM 1210 N ALA A 75 15.943 -6.125 1.377 1.00 0.00 N ATOM 1211 CA ALA A 75 16.812 -7.172 1.901 1.00 0.00 C ATOM 1212 C ALA A 75 16.422 -8.538 1.347 1.00 0.00 C ATOM 1213 O ALA A 75 15.261 -8.797 1.029 1.00 0.00 O ATOM 1214 CB ALA A 75 16.765 -7.183 3.422 1.00 0.00 C ATOM 0 H ALA A 75 14.974 -6.185 1.690 1.00 0.00 H new ATOM 0 HA ALA A 75 17.832 -6.958 1.581 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.418 -7.969 3.801 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.100 -6.218 3.803 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.743 -7.369 3.753 1.00 0.00 H new ATOM 1220 N PRO A 76 17.413 -9.434 1.228 1.00 0.00 N ATOM 1221 CA PRO A 76 17.197 -10.789 0.712 1.00 0.00 C ATOM 1222 C PRO A 76 16.398 -11.656 1.678 1.00 0.00 C ATOM 1223 O PRO A 76 15.380 -12.239 1.307 1.00 0.00 O ATOM 1224 CB PRO A 76 18.618 -11.337 0.551 1.00 0.00 C ATOM 1225 CG PRO A 76 19.435 -10.564 1.527 1.00 0.00 C ATOM 1226 CD PRO A 76 18.821 -9.193 1.588 1.00 0.00 C ATOM 0 HA PRO A 76 16.619 -10.787 -0.212 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.656 -12.406 0.761 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.982 -11.199 -0.467 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.425 -11.040 2.508 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.476 -10.511 1.209 1.00 0.00 H new ATOM 0 HD2 PRO A 76 18.912 -8.756 2.582 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.302 -8.506 0.892 1.00 0.00 H new ATOM 1234 N GLY A 77 16.865 -11.737 2.920 1.00 0.00 N ATOM 1235 CA GLY A 77 16.181 -12.535 3.920 1.00 0.00 C ATOM 1236 C GLY A 77 15.177 -11.728 4.719 1.00 0.00 C ATOM 1237 O GLY A 77 15.137 -11.814 5.946 1.00 0.00 O ATOM 0 H GLY A 77 17.706 -11.264 3.251 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.669 -13.364 3.431 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.915 -12.969 4.598 1.00 0.00 H new ATOM 1241 N ALA A 78 14.365 -10.940 4.022 1.00 0.00 N ATOM 1242 CA ALA A 78 13.356 -10.114 4.674 1.00 0.00 C ATOM 1243 C ALA A 78 11.949 -10.552 4.280 1.00 0.00 C ATOM 1244 O ALA A 78 11.731 -11.144 3.222 1.00 0.00 O ATOM 1245 CB ALA A 78 13.571 -8.648 4.329 1.00 0.00 C ATOM 0 H ALA A 78 14.386 -10.856 3.006 1.00 0.00 H new ATOM 0 HA ALA A 78 13.459 -10.241 5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.811 -8.043 4.823 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.559 -8.336 4.667 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.498 -8.514 3.250 1.00 0.00 H new ATOM 1251 N PRO A 79 10.972 -10.257 5.149 1.00 0.00 N ATOM 1252 CA PRO A 79 9.569 -10.611 4.913 1.00 0.00 C ATOM 1253 C PRO A 79 8.947 -9.795 3.786 1.00 0.00 C ATOM 1254 O PRO A 79 8.380 -10.351 2.844 1.00 0.00 O ATOM 1255 CB PRO A 79 8.891 -10.285 6.247 1.00 0.00 C ATOM 1256 CG PRO A 79 9.755 -9.240 6.865 1.00 0.00 C ATOM 1257 CD PRO A 79 11.160 -9.554 6.429 1.00 0.00 C ATOM 0 HA PRO A 79 9.457 -11.651 4.606 1.00 0.00 H new ATOM 0 HB2 PRO A 79 7.875 -9.920 6.096 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.822 -11.168 6.882 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.458 -8.244 6.537 1.00 0.00 H new ATOM 0 HG3 PRO A 79 9.671 -9.256 7.952 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.754 -8.649 6.306 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.677 -10.178 7.158 1.00 0.00 H new ATOM 1265 N SER A 80 9.056 -8.475 3.887 1.00 0.00 N ATOM 1266 CA SER A 80 8.501 -7.582 2.876 1.00 0.00 C ATOM 1267 C SER A 80 9.474 -7.403 1.715 1.00 0.00 C ATOM 1268 O SER A 80 9.358 -6.461 0.933 1.00 0.00 O ATOM 1269 CB SER A 80 8.171 -6.221 3.493 1.00 0.00 C ATOM 1270 OG SER A 80 7.415 -6.370 4.682 1.00 0.00 O ATOM 0 H SER A 80 9.524 -7.999 4.659 1.00 0.00 H new ATOM 0 HA SER A 80 7.585 -8.032 2.494 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.094 -5.683 3.710 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.612 -5.619 2.776 1.00 0.00 H new ATOM 0 HG SER A 80 7.354 -5.507 5.141 1.00 0.00 H new ATOM 1276 N ALA A 81 10.434 -8.317 1.610 1.00 0.00 N ATOM 1277 CA ALA A 81 11.427 -8.263 0.544 1.00 0.00 C ATOM 1278 C ALA A 81 10.767 -8.020 -0.809 1.00 0.00 C ATOM 1279 O ALA A 81 10.083 -8.895 -1.342 1.00 0.00 O ATOM 1280 CB ALA A 81 12.239 -9.549 0.514 1.00 0.00 C ATOM 0 H ALA A 81 10.545 -9.103 2.250 1.00 0.00 H new ATOM 0 HA ALA A 81 12.097 -7.428 0.747 1.00 0.00 H new ATOM 0 HB1 ALA A 81 12.977 -9.495 -0.287 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.749 -9.680 1.469 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.574 -10.395 0.339 1.00 0.00 H new ATOM 1286 N ILE A 82 10.975 -6.829 -1.358 1.00 0.00 N ATOM 1287 CA ILE A 82 10.400 -6.472 -2.649 1.00 0.00 C ATOM 1288 C ILE A 82 11.392 -6.720 -3.780 1.00 0.00 C ATOM 1289 O ILE A 82 12.502 -7.200 -3.552 1.00 0.00 O ATOM 1290 CB ILE A 82 9.960 -4.996 -2.682 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.147 -4.081 -2.371 1.00 0.00 C ATOM 1292 CG2 ILE A 82 8.828 -4.759 -1.694 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.057 -2.728 -3.040 1.00 0.00 C ATOM 0 H ILE A 82 11.538 -6.094 -0.929 1.00 0.00 H new ATOM 0 HA ILE A 82 9.525 -7.106 -2.790 1.00 0.00 H new ATOM 0 HB ILE A 82 9.597 -4.762 -3.683 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.214 -3.940 -1.292 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.067 -4.573 -2.686 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.528 -3.712 -1.729 1.00 0.00 H new ATOM 0 HG22 ILE A 82 7.978 -5.389 -1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.166 -5.006 -0.688 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.931 -2.133 -2.776 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.021 -2.859 -4.122 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.155 -2.216 -2.706 1.00 0.00 H new ATOM 1305 N ASN A 83 10.985 -6.388 -5.001 1.00 0.00 N ATOM 1306 CA ASN A 83 11.839 -6.574 -6.169 1.00 0.00 C ATOM 1307 C ASN A 83 11.902 -5.299 -7.005 1.00 0.00 C ATOM 1308 O ASN A 83 10.872 -4.744 -7.390 1.00 0.00 O ATOM 1309 CB ASN A 83 11.324 -7.733 -7.024 1.00 0.00 C ATOM 1310 CG ASN A 83 12.259 -8.065 -8.171 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.479 -7.979 -8.037 1.00 0.00 O ATOM 1312 ND2 ASN A 83 11.688 -8.446 -9.308 1.00 0.00 N ATOM 0 H ASN A 83 10.069 -5.989 -5.207 1.00 0.00 H new ATOM 0 HA ASN A 83 12.844 -6.808 -5.819 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.196 -8.615 -6.396 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.341 -7.479 -7.422 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.266 -8.681 -10.115 1.00 0.00 H new ATOM 0 HD22 ASN A 83 10.672 -8.503 -9.374 1.00 0.00 H new ATOM 1319 N LEU A 84 13.117 -4.840 -7.282 1.00 0.00 N ATOM 1320 CA LEU A 84 13.316 -3.630 -8.073 1.00 0.00 C ATOM 1321 C LEU A 84 14.026 -3.949 -9.386 1.00 0.00 C ATOM 1322 O LEU A 84 14.627 -5.012 -9.536 1.00 0.00 O ATOM 1323 CB LEU A 84 14.126 -2.605 -7.279 1.00 0.00 C ATOM 1324 CG LEU A 84 13.507 -2.135 -5.962 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.540 -1.408 -5.115 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.305 -1.240 -6.226 1.00 0.00 C ATOM 0 H LEU A 84 13.979 -5.287 -6.971 1.00 0.00 H new ATOM 0 HA LEU A 84 12.336 -3.211 -8.303 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.105 -3.033 -7.065 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.291 -1.733 -7.912 1.00 0.00 H new ATOM 0 HG LEU A 84 13.167 -3.011 -5.410 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.081 -1.081 -4.182 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.369 -2.081 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.912 -0.540 -5.660 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.878 -0.915 -5.277 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.620 -0.368 -6.800 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.555 -1.795 -6.791 1.00 0.00 H new ATOM 1338 N ASP A 85 13.952 -3.019 -10.332 1.00 0.00 N ATOM 1339 CA ASP A 85 14.590 -3.199 -11.631 1.00 0.00 C ATOM 1340 C ASP A 85 16.068 -3.542 -11.468 1.00 0.00 C ATOM 1341 O ASP A 85 16.671 -3.256 -10.434 1.00 0.00 O ATOM 1342 CB ASP A 85 14.438 -1.934 -12.478 1.00 0.00 C ATOM 1343 CG ASP A 85 14.814 -2.160 -13.929 1.00 0.00 C ATOM 1344 OD1 ASP A 85 14.776 -3.325 -14.378 1.00 0.00 O ATOM 1345 OD2 ASP A 85 15.146 -1.172 -14.616 1.00 0.00 O ATOM 0 H ASP A 85 13.457 -2.134 -10.224 1.00 0.00 H new ATOM 0 HA ASP A 85 14.097 -4.028 -12.138 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.407 -1.585 -12.423 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.064 -1.145 -12.062 1.00 0.00 H new ATOM 1350 N SER A 86 16.645 -4.157 -12.496 1.00 0.00 N ATOM 1351 CA SER A 86 18.050 -4.543 -12.465 1.00 0.00 C ATOM 1352 C SER A 86 18.933 -3.351 -12.107 1.00 0.00 C ATOM 1353 O SER A 86 19.709 -3.403 -11.152 1.00 0.00 O ATOM 1354 CB SER A 86 18.473 -5.117 -13.818 1.00 0.00 C ATOM 1355 OG SER A 86 18.164 -6.497 -13.906 1.00 0.00 O ATOM 0 H SER A 86 16.160 -4.398 -13.360 1.00 0.00 H new ATOM 0 HA SER A 86 18.174 -5.308 -11.699 1.00 0.00 H new ATOM 0 HB2 SER A 86 17.969 -4.577 -14.619 1.00 0.00 H new ATOM 0 HB3 SER A 86 19.544 -4.971 -13.960 1.00 0.00 H new ATOM 0 HG SER A 86 18.443 -6.840 -14.781 1.00 0.00 H new ATOM 1361 N LYS A 87 18.809 -2.278 -12.880 1.00 0.00 N ATOM 1362 CA LYS A 87 19.594 -1.071 -12.646 1.00 0.00 C ATOM 1363 C LYS A 87 19.153 -0.376 -11.362 1.00 0.00 C ATOM 1364 O LYS A 87 19.983 0.066 -10.567 1.00 0.00 O ATOM 1365 CB LYS A 87 19.458 -0.112 -13.830 1.00 0.00 C ATOM 1366 CG LYS A 87 18.038 0.382 -14.053 1.00 0.00 C ATOM 1367 CD LYS A 87 17.982 1.448 -15.134 1.00 0.00 C ATOM 1368 CE LYS A 87 18.170 2.841 -14.554 1.00 0.00 C ATOM 1369 NZ LYS A 87 19.606 3.154 -14.316 1.00 0.00 N ATOM 0 H LYS A 87 18.172 -2.219 -13.675 1.00 0.00 H new ATOM 0 HA LYS A 87 20.639 -1.362 -12.540 1.00 0.00 H new ATOM 0 HB2 LYS A 87 20.111 0.746 -13.669 1.00 0.00 H new ATOM 0 HB3 LYS A 87 19.806 -0.612 -14.734 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.400 -0.456 -14.334 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.642 0.786 -13.121 1.00 0.00 H new ATOM 0 HD2 LYS A 87 18.756 1.255 -15.877 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.023 1.394 -15.650 1.00 0.00 H new ATOM 0 HE2 LYS A 87 17.746 3.578 -15.236 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.621 2.921 -13.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 19.763 4.175 -14.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 19.867 2.875 -13.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 20.193 2.631 -14.997 1.00 0.00 H new ATOM 1383 N SER A 88 17.842 -0.284 -11.164 1.00 0.00 N ATOM 1384 CA SER A 88 17.291 0.359 -9.977 1.00 0.00 C ATOM 1385 C SER A 88 17.917 -0.212 -8.709 1.00 0.00 C ATOM 1386 O SER A 88 18.433 0.527 -7.870 1.00 0.00 O ATOM 1387 CB SER A 88 15.772 0.182 -9.933 1.00 0.00 C ATOM 1388 OG SER A 88 15.152 0.823 -11.035 1.00 0.00 O ATOM 0 H SER A 88 17.141 -0.647 -11.811 1.00 0.00 H new ATOM 0 HA SER A 88 17.525 1.422 -10.030 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.526 -0.880 -9.940 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.382 0.593 -9.002 1.00 0.00 H new ATOM 0 HG SER A 88 14.182 0.694 -10.985 1.00 0.00 H new ATOM 1394 N TYR A 89 17.869 -1.533 -8.576 1.00 0.00 N ATOM 1395 CA TYR A 89 18.429 -2.206 -7.410 1.00 0.00 C ATOM 1396 C TYR A 89 19.910 -1.876 -7.250 1.00 0.00 C ATOM 1397 O TYR A 89 20.360 -1.495 -6.170 1.00 0.00 O ATOM 1398 CB TYR A 89 18.241 -3.719 -7.528 1.00 0.00 C ATOM 1399 CG TYR A 89 18.466 -4.461 -6.230 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.626 -4.265 -5.141 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.520 -5.356 -6.092 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.828 -4.940 -3.952 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.729 -6.036 -4.908 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.881 -5.824 -3.841 1.00 0.00 C ATOM 1405 OH TYR A 89 19.086 -6.499 -2.660 1.00 0.00 O ATOM 0 H TYR A 89 17.448 -2.159 -9.262 1.00 0.00 H new ATOM 0 HA TYR A 89 17.899 -1.850 -6.527 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.231 -3.924 -7.884 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.929 -4.104 -8.281 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.801 -3.573 -5.225 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.187 -5.523 -6.925 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.165 -4.776 -3.115 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.552 -6.730 -4.818 1.00 0.00 H new ATOM 0 HH TYR A 89 19.515 -5.902 -2.012 1.00 0.00 H new ATOM 1415 N ASP A 90 20.662 -2.026 -8.335 1.00 0.00 N ATOM 1416 CA ASP A 90 22.093 -1.743 -8.318 1.00 0.00 C ATOM 1417 C ASP A 90 22.364 -0.341 -7.781 1.00 0.00 C ATOM 1418 O ASP A 90 23.261 -0.141 -6.962 1.00 0.00 O ATOM 1419 CB ASP A 90 22.679 -1.886 -9.724 1.00 0.00 C ATOM 1420 CG ASP A 90 22.427 -3.257 -10.320 1.00 0.00 C ATOM 1421 OD1 ASP A 90 22.373 -4.238 -9.549 1.00 0.00 O ATOM 1422 OD2 ASP A 90 22.283 -3.348 -11.557 1.00 0.00 O ATOM 0 H ASP A 90 20.305 -2.342 -9.237 1.00 0.00 H new ATOM 0 HA ASP A 90 22.573 -2.464 -7.657 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.246 -1.125 -10.374 1.00 0.00 H new ATOM 0 HB3 ASP A 90 23.753 -1.701 -9.688 1.00 0.00 H new ATOM 1427 N LYS A 91 21.582 0.627 -8.247 1.00 0.00 N ATOM 1428 CA LYS A 91 21.736 2.010 -7.813 1.00 0.00 C ATOM 1429 C LYS A 91 21.387 2.160 -6.336 1.00 0.00 C ATOM 1430 O LYS A 91 22.138 2.762 -5.568 1.00 0.00 O ATOM 1431 CB LYS A 91 20.848 2.931 -8.654 1.00 0.00 C ATOM 1432 CG LYS A 91 21.160 4.407 -8.475 1.00 0.00 C ATOM 1433 CD LYS A 91 22.251 4.866 -9.429 1.00 0.00 C ATOM 1434 CE LYS A 91 22.359 6.382 -9.463 1.00 0.00 C ATOM 1435 NZ LYS A 91 23.052 6.861 -10.691 1.00 0.00 N ATOM 0 H LYS A 91 20.835 0.479 -8.926 1.00 0.00 H new ATOM 0 HA LYS A 91 22.779 2.294 -7.952 1.00 0.00 H new ATOM 0 HB2 LYS A 91 20.961 2.669 -9.706 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.805 2.754 -8.392 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.257 4.994 -8.644 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.473 4.592 -7.447 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.206 4.439 -9.124 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.040 4.493 -10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.361 6.818 -9.415 1.00 0.00 H new ATOM 0 HE3 LYS A 91 22.900 6.727 -8.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 23.106 7.900 -10.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.013 6.465 -10.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 22.522 6.553 -11.531 1.00 0.00 H new ATOM 1449 N THR A 92 20.244 1.607 -5.943 1.00 0.00 N ATOM 1450 CA THR A 92 19.796 1.679 -4.558 1.00 0.00 C ATOM 1451 C THR A 92 20.822 1.058 -3.616 1.00 0.00 C ATOM 1452 O THR A 92 21.301 1.708 -2.687 1.00 0.00 O ATOM 1453 CB THR A 92 18.444 0.967 -4.367 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.484 1.482 -5.297 1.00 0.00 O ATOM 1455 CG2 THR A 92 17.931 1.151 -2.947 1.00 0.00 C ATOM 0 H THR A 92 19.611 1.104 -6.565 1.00 0.00 H new ATOM 0 HA THR A 92 19.678 2.736 -4.318 1.00 0.00 H new ATOM 0 HB THR A 92 18.590 -0.098 -4.548 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.692 1.154 -6.197 1.00 0.00 H new ATOM 0 HG21 THR A 92 16.975 0.639 -2.836 1.00 0.00 H new ATOM 0 HG22 THR A 92 18.650 0.732 -2.243 1.00 0.00 H new ATOM 0 HG23 THR A 92 17.800 2.214 -2.742 1.00 0.00 H new ATOM 1463 N THR A 93 21.156 -0.205 -3.862 1.00 0.00 N ATOM 1464 CA THR A 93 22.124 -0.915 -3.036 1.00 0.00 C ATOM 1465 C THR A 93 23.354 -0.054 -2.769 1.00 0.00 C ATOM 1466 O THR A 93 23.845 0.012 -1.641 1.00 0.00 O ATOM 1467 CB THR A 93 22.569 -2.233 -3.697 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.430 -3.068 -3.938 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.567 -2.970 -2.817 1.00 0.00 C ATOM 0 H THR A 93 20.770 -0.757 -4.628 1.00 0.00 H new ATOM 0 HA THR A 93 21.628 -1.141 -2.092 1.00 0.00 H new ATOM 0 HB THR A 93 23.052 -1.994 -4.645 1.00 0.00 H new ATOM 0 HG1 THR A 93 20.935 -2.730 -4.713 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.867 -3.898 -3.305 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.445 -2.343 -2.659 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.106 -3.198 -1.856 1.00 0.00 H new ATOM 1477 N HIS A 94 23.848 0.605 -3.812 1.00 0.00 N ATOM 1478 CA HIS A 94 25.020 1.463 -3.689 1.00 0.00 C ATOM 1479 C HIS A 94 24.699 2.708 -2.868 1.00 0.00 C ATOM 1480 O HIS A 94 25.466 3.100 -1.990 1.00 0.00 O ATOM 1481 CB HIS A 94 25.530 1.868 -5.073 1.00 0.00 C ATOM 1482 CG HIS A 94 26.655 2.856 -5.032 1.00 0.00 C ATOM 1483 ND1 HIS A 94 27.979 2.485 -4.932 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.647 4.209 -5.079 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.737 3.566 -4.918 1.00 0.00 C ATOM 1486 NE2 HIS A 94 27.953 4.626 -5.007 1.00 0.00 N ATOM 0 H HIS A 94 23.455 0.561 -4.752 1.00 0.00 H new ATOM 0 HA HIS A 94 25.798 0.900 -3.174 1.00 0.00 H new ATOM 0 HB2 HIS A 94 25.860 0.976 -5.605 1.00 0.00 H new ATOM 0 HB3 HIS A 94 24.705 2.293 -5.645 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.776 4.842 -5.158 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.814 3.581 -4.846 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.267 5.596 -5.020 1.00 0.00 H new ATOM 1494 N ASN A 95 23.559 3.327 -3.162 1.00 0.00 N ATOM 1495 CA ASN A 95 23.137 4.529 -2.452 1.00 0.00 C ATOM 1496 C ASN A 95 23.007 4.259 -0.956 1.00 0.00 C ATOM 1497 O ASN A 95 23.468 5.047 -0.130 1.00 0.00 O ATOM 1498 CB ASN A 95 21.804 5.033 -3.008 1.00 0.00 C ATOM 1499 CG ASN A 95 21.951 5.662 -4.380 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.033 6.115 -4.755 1.00 0.00 O ATOM 1501 ND2 ASN A 95 20.860 5.694 -5.137 1.00 0.00 N ATOM 0 H ASN A 95 22.912 3.016 -3.886 1.00 0.00 H new ATOM 0 HA ASN A 95 23.898 5.295 -2.601 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.100 4.203 -3.065 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.379 5.764 -2.320 1.00 0.00 H new ATOM 0 HD21 ASN A 95 20.898 6.106 -6.069 1.00 0.00 H new ATOM 0 HD22 ASN A 95 19.984 5.307 -4.786 1.00 0.00 H new ATOM 1508 N VAL A 96 22.376 3.140 -0.614 1.00 0.00 N ATOM 1509 CA VAL A 96 22.186 2.764 0.782 1.00 0.00 C ATOM 1510 C VAL A 96 23.453 3.012 1.594 1.00 0.00 C ATOM 1511 O VAL A 96 23.397 3.537 2.706 1.00 0.00 O ATOM 1512 CB VAL A 96 21.785 1.283 0.915 1.00 0.00 C ATOM 1513 CG1 VAL A 96 21.640 0.899 2.380 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.497 1.010 0.153 1.00 0.00 C ATOM 0 H VAL A 96 21.987 2.478 -1.285 1.00 0.00 H new ATOM 0 HA VAL A 96 21.380 3.386 1.171 1.00 0.00 H new ATOM 0 HB VAL A 96 22.574 0.670 0.480 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.356 -0.151 2.455 1.00 0.00 H new ATOM 0 HG12 VAL A 96 22.589 1.056 2.893 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.871 1.517 2.844 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.228 -0.041 0.258 1.00 0.00 H new ATOM 0 HG22 VAL A 96 19.697 1.631 0.556 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.642 1.244 -0.902 1.00 0.00 H new ATOM 1524 N LYS A 97 24.594 2.630 1.031 1.00 0.00 N ATOM 1525 CA LYS A 97 25.876 2.812 1.701 1.00 0.00 C ATOM 1526 C LYS A 97 25.887 4.103 2.514 1.00 0.00 C ATOM 1527 O LYS A 97 26.318 4.117 3.667 1.00 0.00 O ATOM 1528 CB LYS A 97 27.012 2.833 0.676 1.00 0.00 C ATOM 1529 CG LYS A 97 27.095 1.571 -0.165 1.00 0.00 C ATOM 1530 CD LYS A 97 27.901 0.488 0.531 1.00 0.00 C ATOM 1531 CE LYS A 97 28.065 -0.740 -0.351 1.00 0.00 C ATOM 1532 NZ LYS A 97 28.908 -0.456 -1.546 1.00 0.00 N ATOM 0 H LYS A 97 24.657 2.192 0.112 1.00 0.00 H new ATOM 0 HA LYS A 97 26.024 1.973 2.381 1.00 0.00 H new ATOM 0 HB2 LYS A 97 26.880 3.691 0.017 1.00 0.00 H new ATOM 0 HB3 LYS A 97 27.958 2.975 1.198 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.090 1.203 -0.370 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.551 1.803 -1.127 1.00 0.00 H new ATOM 0 HD2 LYS A 97 28.883 0.879 0.798 1.00 0.00 H new ATOM 0 HD3 LYS A 97 27.407 0.206 1.461 1.00 0.00 H new ATOM 0 HE2 LYS A 97 28.516 -1.546 0.228 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.084 -1.089 -0.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 29.179 -1.351 -2.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 28.370 0.126 -2.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.764 0.056 -1.253 1.00 0.00 H new ATOM 1546 N GLU A 98 25.410 5.184 1.906 1.00 0.00 N ATOM 1547 CA GLU A 98 25.365 6.479 2.575 1.00 0.00 C ATOM 1548 C GLU A 98 23.953 6.791 3.062 1.00 0.00 C ATOM 1549 O GLU A 98 23.016 6.936 2.276 1.00 0.00 O ATOM 1550 CB GLU A 98 25.847 7.583 1.631 1.00 0.00 C ATOM 1551 CG GLU A 98 25.109 7.613 0.303 1.00 0.00 C ATOM 1552 CD GLU A 98 25.679 8.638 -0.657 1.00 0.00 C ATOM 1553 OE1 GLU A 98 25.631 9.844 -0.336 1.00 0.00 O ATOM 1554 OE2 GLU A 98 26.173 8.235 -1.731 1.00 0.00 O ATOM 0 H GLU A 98 25.049 5.189 0.952 1.00 0.00 H new ATOM 0 HA GLU A 98 26.027 6.436 3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.730 8.548 2.124 1.00 0.00 H new ATOM 0 HB3 GLU A 98 26.912 7.449 1.442 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.155 6.626 -0.156 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.056 7.833 0.481 1.00 0.00 H new ATOM 1561 N PRO A 99 23.795 6.897 4.390 1.00 0.00 N ATOM 1562 CA PRO A 99 22.501 7.193 5.012 1.00 0.00 C ATOM 1563 C PRO A 99 22.043 8.623 4.744 1.00 0.00 C ATOM 1564 O PRO A 99 22.813 9.570 4.895 1.00 0.00 O ATOM 1565 CB PRO A 99 22.770 6.988 6.505 1.00 0.00 C ATOM 1566 CG PRO A 99 24.233 7.219 6.661 1.00 0.00 C ATOM 1567 CD PRO A 99 24.867 6.737 5.386 1.00 0.00 C ATOM 0 HA PRO A 99 21.705 6.561 4.618 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.192 7.686 7.111 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.492 5.983 6.823 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.446 8.275 6.828 1.00 0.00 H new ATOM 0 HG3 PRO A 99 24.624 6.676 7.521 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.747 7.326 5.127 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.190 5.699 5.465 1.00 0.00 H new ATOM 1575 N GLY A 100 20.782 8.771 4.347 1.00 0.00 N ATOM 1576 CA GLY A 100 20.244 10.089 4.065 1.00 0.00 C ATOM 1577 C GLY A 100 18.729 10.121 4.126 1.00 0.00 C ATOM 1578 O GLY A 100 18.111 9.292 4.794 1.00 0.00 O ATOM 0 H GLY A 100 20.124 8.002 4.216 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.649 10.804 4.781 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.572 10.408 3.076 1.00 0.00 H new ATOM 1582 N ARG A 101 18.131 11.082 3.429 1.00 0.00 N ATOM 1583 CA ARG A 101 16.680 11.221 3.409 1.00 0.00 C ATOM 1584 C ARG A 101 16.117 10.843 2.043 1.00 0.00 C ATOM 1585 O ARG A 101 15.051 10.234 1.946 1.00 0.00 O ATOM 1586 CB ARG A 101 16.279 12.655 3.760 1.00 0.00 C ATOM 1587 CG ARG A 101 16.681 13.074 5.164 1.00 0.00 C ATOM 1588 CD ARG A 101 16.095 14.428 5.531 1.00 0.00 C ATOM 1589 NE ARG A 101 16.863 15.091 6.582 1.00 0.00 N ATOM 1590 CZ ARG A 101 17.411 16.293 6.445 1.00 0.00 C ATOM 1591 NH1 ARG A 101 17.275 16.962 5.308 1.00 0.00 N ATOM 1592 NH2 ARG A 101 18.095 16.829 7.448 1.00 0.00 N ATOM 0 H ARG A 101 18.629 11.776 2.871 1.00 0.00 H new ATOM 0 HA ARG A 101 16.264 10.543 4.154 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.735 13.337 3.042 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.199 12.757 3.655 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.343 12.324 5.879 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.768 13.115 5.235 1.00 0.00 H new ATOM 0 HD2 ARG A 101 16.069 15.063 4.646 1.00 0.00 H new ATOM 0 HD3 ARG A 101 15.064 14.299 5.862 1.00 0.00 H new ATOM 0 HE ARG A 101 16.985 14.604 7.470 1.00 0.00 H new ATOM 0 HH11 ARG A 101 16.748 16.554 4.536 1.00 0.00 H new ATOM 0 HH12 ARG A 101 17.697 17.885 5.206 1.00 0.00 H new ATOM 0 HH21 ARG A 101 18.200 16.318 8.324 1.00 0.00 H new ATOM 0 HH22 ARG A 101 18.516 17.752 7.342 1.00 0.00 H new ATOM 1606 N TYR A 102 16.838 11.209 0.989 1.00 0.00 N ATOM 1607 CA TYR A 102 16.409 10.911 -0.372 1.00 0.00 C ATOM 1608 C TYR A 102 17.232 9.772 -0.966 1.00 0.00 C ATOM 1609 O TYR A 102 17.265 9.581 -2.182 1.00 0.00 O ATOM 1610 CB TYR A 102 16.532 12.157 -1.252 1.00 0.00 C ATOM 1611 CG TYR A 102 15.709 13.327 -0.762 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.322 13.310 -0.844 1.00 0.00 C ATOM 1613 CD2 TYR A 102 16.319 14.450 -0.216 1.00 0.00 C ATOM 1614 CE1 TYR A 102 13.567 14.377 -0.399 1.00 0.00 C ATOM 1615 CE2 TYR A 102 15.572 15.521 0.234 1.00 0.00 C ATOM 1616 CZ TYR A 102 14.196 15.480 0.140 1.00 0.00 C ATOM 1617 OH TYR A 102 13.447 16.545 0.586 1.00 0.00 O ATOM 0 H TYR A 102 17.723 11.713 1.051 1.00 0.00 H new ATOM 0 HA TYR A 102 15.365 10.600 -0.337 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.579 12.455 -1.301 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.224 11.907 -2.267 1.00 0.00 H new ATOM 0 HD1 TYR A 102 13.826 12.447 -1.263 1.00 0.00 H new ATOM 0 HD2 TYR A 102 17.396 14.486 -0.142 1.00 0.00 H new ATOM 0 HE1 TYR A 102 12.490 14.348 -0.473 1.00 0.00 H new ATOM 0 HE2 TYR A 102 16.062 16.386 0.657 1.00 0.00 H new ATOM 0 HH TYR A 102 14.043 17.239 0.937 1.00 0.00 H new ATOM 1627 N THR A 103 17.898 9.017 -0.098 1.00 0.00 N ATOM 1628 CA THR A 103 18.722 7.897 -0.535 1.00 0.00 C ATOM 1629 C THR A 103 17.912 6.909 -1.366 1.00 0.00 C ATOM 1630 O THR A 103 18.316 6.528 -2.464 1.00 0.00 O ATOM 1631 CB THR A 103 19.342 7.154 0.664 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.161 8.050 1.425 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.175 5.971 0.196 1.00 0.00 C ATOM 0 H THR A 103 17.883 9.161 0.912 1.00 0.00 H new ATOM 0 HA THR A 103 19.521 8.314 -1.148 1.00 0.00 H new ATOM 0 HB THR A 103 18.532 6.782 1.291 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.006 7.609 1.651 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.602 5.462 1.060 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.543 5.277 -0.358 1.00 0.00 H new ATOM 0 HG23 THR A 103 20.978 6.325 -0.451 1.00 0.00 H new ATOM 1641 N PHE A 104 16.765 6.497 -0.835 1.00 0.00 N ATOM 1642 CA PHE A 104 15.897 5.552 -1.528 1.00 0.00 C ATOM 1643 C PHE A 104 14.889 6.285 -2.409 1.00 0.00 C ATOM 1644 O PHE A 104 13.875 5.717 -2.813 1.00 0.00 O ATOM 1645 CB PHE A 104 15.162 4.667 -0.520 1.00 0.00 C ATOM 1646 CG PHE A 104 16.080 3.940 0.420 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.667 2.741 0.047 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.357 4.454 1.677 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.513 2.069 0.910 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.202 3.787 2.543 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.780 2.592 2.160 1.00 0.00 C ATOM 0 H PHE A 104 16.415 6.803 0.073 1.00 0.00 H new ATOM 0 HA PHE A 104 16.521 4.924 -2.164 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.475 5.284 0.060 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.558 3.939 -1.061 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.461 2.327 -0.929 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.907 5.387 1.983 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.965 1.136 0.607 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.411 4.200 3.519 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.439 2.068 2.836 1.00 0.00 H new ATOM 1661 N GLU A 105 15.176 7.550 -2.700 1.00 0.00 N ATOM 1662 CA GLU A 105 14.293 8.361 -3.530 1.00 0.00 C ATOM 1663 C GLU A 105 14.010 7.669 -4.861 1.00 0.00 C ATOM 1664 O GLU A 105 12.868 7.621 -5.317 1.00 0.00 O ATOM 1665 CB GLU A 105 14.914 9.737 -3.781 1.00 0.00 C ATOM 1666 CG GLU A 105 13.999 10.690 -4.532 1.00 0.00 C ATOM 1667 CD GLU A 105 14.121 10.551 -6.037 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.233 10.246 -6.517 1.00 0.00 O ATOM 1669 OE2 GLU A 105 13.104 10.749 -6.734 1.00 0.00 O ATOM 0 H GLU A 105 16.012 8.035 -2.374 1.00 0.00 H new ATOM 0 HA GLU A 105 13.350 8.487 -2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.184 10.184 -2.824 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.837 9.612 -4.347 1.00 0.00 H new ATOM 0 HG2 GLU A 105 12.966 10.505 -4.236 1.00 0.00 H new ATOM 0 HG3 GLU A 105 14.234 11.715 -4.245 1.00 0.00 H new ATOM 1676 N ASP A 106 15.059 7.135 -5.477 1.00 0.00 N ATOM 1677 CA ASP A 106 14.924 6.445 -6.755 1.00 0.00 C ATOM 1678 C ASP A 106 13.965 5.264 -6.637 1.00 0.00 C ATOM 1679 O ASP A 106 12.940 5.215 -7.315 1.00 0.00 O ATOM 1680 CB ASP A 106 16.291 5.961 -7.244 1.00 0.00 C ATOM 1681 CG ASP A 106 17.310 7.081 -7.316 1.00 0.00 C ATOM 1682 OD1 ASP A 106 17.590 7.697 -6.266 1.00 0.00 O ATOM 1683 OD2 ASP A 106 17.828 7.340 -8.422 1.00 0.00 O ATOM 0 H ASP A 106 16.011 7.166 -5.113 1.00 0.00 H new ATOM 0 HA ASP A 106 14.516 7.150 -7.479 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.658 5.182 -6.575 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.182 5.509 -8.230 1.00 0.00 H new ATOM 1688 N ALA A 107 14.306 4.315 -5.771 1.00 0.00 N ATOM 1689 CA ALA A 107 13.475 3.136 -5.564 1.00 0.00 C ATOM 1690 C ALA A 107 12.031 3.527 -5.268 1.00 0.00 C ATOM 1691 O ALA A 107 11.103 3.039 -5.912 1.00 0.00 O ATOM 1692 CB ALA A 107 14.036 2.288 -4.432 1.00 0.00 C ATOM 0 H ALA A 107 15.152 4.340 -5.202 1.00 0.00 H new ATOM 0 HA ALA A 107 13.484 2.549 -6.483 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.406 1.410 -4.288 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.048 1.971 -4.682 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.057 2.875 -3.514 1.00 0.00 H new ATOM 1698 N GLN A 108 11.850 4.409 -4.290 1.00 0.00 N ATOM 1699 CA GLN A 108 10.518 4.864 -3.910 1.00 0.00 C ATOM 1700 C GLN A 108 9.710 5.270 -5.137 1.00 0.00 C ATOM 1701 O GLN A 108 8.516 4.988 -5.227 1.00 0.00 O ATOM 1702 CB GLN A 108 10.616 6.040 -2.937 1.00 0.00 C ATOM 1703 CG GLN A 108 9.266 6.593 -2.512 1.00 0.00 C ATOM 1704 CD GLN A 108 9.384 7.679 -1.461 1.00 0.00 C ATOM 1705 OE1 GLN A 108 8.496 7.646 -0.474 1.00 0.00 O flip ATOM 1706 NE2 GLN A 108 10.263 8.537 -1.535 1.00 0.00 N flip ATOM 0 H GLN A 108 12.608 4.822 -3.747 1.00 0.00 H new ATOM 0 HA GLN A 108 10.006 4.037 -3.419 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.164 5.722 -2.050 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.196 6.838 -3.402 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.750 6.993 -3.385 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.652 5.781 -2.123 1.00 0.00 H new ATOM 0 HE21 GLN A 108 10.924 8.524 -2.311 1.00 0.00 H new ATOM 0 HE22 GLN A 108 10.330 9.261 -0.820 1.00 0.00 H new ATOM 1715 N GLU A 109 10.370 5.935 -6.081 1.00 0.00 N ATOM 1716 CA GLU A 109 9.712 6.381 -7.303 1.00 0.00 C ATOM 1717 C GLU A 109 9.311 5.191 -8.171 1.00 0.00 C ATOM 1718 O GLU A 109 8.179 5.109 -8.647 1.00 0.00 O ATOM 1719 CB GLU A 109 10.631 7.315 -8.092 1.00 0.00 C ATOM 1720 CG GLU A 109 10.274 7.419 -9.565 1.00 0.00 C ATOM 1721 CD GLU A 109 11.003 8.550 -10.264 1.00 0.00 C ATOM 1722 OE1 GLU A 109 12.226 8.688 -10.053 1.00 0.00 O ATOM 1723 OE2 GLU A 109 10.350 9.297 -11.023 1.00 0.00 O ATOM 0 H GLU A 109 11.359 6.176 -6.022 1.00 0.00 H new ATOM 0 HA GLU A 109 8.810 6.924 -7.022 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.593 8.309 -7.647 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.658 6.963 -8.000 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.512 6.478 -10.060 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.199 7.568 -9.665 1.00 0.00 H new ATOM 1730 N HIS A 110 10.249 4.271 -8.373 1.00 0.00 N ATOM 1731 CA HIS A 110 9.995 3.085 -9.183 1.00 0.00 C ATOM 1732 C HIS A 110 8.741 2.360 -8.706 1.00 0.00 C ATOM 1733 O HIS A 110 7.752 2.265 -9.434 1.00 0.00 O ATOM 1734 CB HIS A 110 11.196 2.140 -9.132 1.00 0.00 C ATOM 1735 CG HIS A 110 11.108 1.008 -10.108 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.337 1.160 -11.460 1.00 0.00 N ATOM 1737 CD2 HIS A 110 10.816 -0.301 -9.923 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.188 -0.006 -12.063 1.00 0.00 C ATOM 1739 NE2 HIS A 110 10.873 -0.909 -11.152 1.00 0.00 N ATOM 0 H HIS A 110 11.192 4.324 -7.987 1.00 0.00 H new ATOM 0 HA HIS A 110 9.838 3.405 -10.213 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.105 2.709 -9.329 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.286 1.734 -8.124 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.582 -0.778 -8.983 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.304 -0.190 -13.121 1.00 0.00 H new ATOM 0 HE2 HIS A 110 10.700 -1.898 -11.333 1.00 0.00 H new ATOM 1747 N ILE A 111 8.789 1.849 -7.480 1.00 0.00 N ATOM 1748 CA ILE A 111 7.656 1.132 -6.907 1.00 0.00 C ATOM 1749 C ILE A 111 6.378 1.958 -7.004 1.00 0.00 C ATOM 1750 O ILE A 111 5.299 1.423 -7.262 1.00 0.00 O ATOM 1751 CB ILE A 111 7.909 0.769 -5.432 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.146 -0.123 -5.308 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.689 0.076 -4.841 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.025 -1.432 -6.056 1.00 0.00 C ATOM 0 H ILE A 111 9.600 1.918 -6.865 1.00 0.00 H new ATOM 0 HA ILE A 111 7.537 0.215 -7.483 1.00 0.00 H new ATOM 0 HB ILE A 111 8.089 1.687 -4.873 1.00 0.00 H new ATOM 0 HG12 ILE A 111 10.014 0.420 -5.681 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.329 -0.332 -4.254 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.883 -0.175 -3.798 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.828 0.742 -4.900 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.482 -0.836 -5.401 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.938 -2.013 -5.923 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.177 -1.996 -5.668 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.873 -1.232 -7.117 1.00 0.00 H new ATOM 1766 N TYR A 112 6.506 3.263 -6.797 1.00 0.00 N ATOM 1767 CA TYR A 112 5.360 4.163 -6.860 1.00 0.00 C ATOM 1768 C TYR A 112 4.654 4.053 -8.208 1.00 0.00 C ATOM 1769 O TYR A 112 3.489 3.663 -8.282 1.00 0.00 O ATOM 1770 CB TYR A 112 5.806 5.607 -6.623 1.00 0.00 C ATOM 1771 CG TYR A 112 4.711 6.624 -6.853 1.00 0.00 C ATOM 1772 CD1 TYR A 112 3.815 6.950 -5.842 1.00 0.00 C ATOM 1773 CD2 TYR A 112 4.573 7.259 -8.081 1.00 0.00 C ATOM 1774 CE1 TYR A 112 2.813 7.878 -6.048 1.00 0.00 C ATOM 1775 CE2 TYR A 112 3.574 8.190 -8.295 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.697 8.496 -7.276 1.00 0.00 C ATOM 1777 OH TYR A 112 1.700 9.421 -7.486 1.00 0.00 O ATOM 0 H TYR A 112 7.392 3.722 -6.584 1.00 0.00 H new ATOM 0 HA TYR A 112 4.659 3.872 -6.078 1.00 0.00 H new ATOM 0 HB2 TYR A 112 6.170 5.703 -5.600 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.644 5.832 -7.282 1.00 0.00 H new ATOM 0 HD1 TYR A 112 3.904 6.470 -4.879 1.00 0.00 H new ATOM 0 HD2 TYR A 112 5.258 7.021 -8.882 1.00 0.00 H new ATOM 0 HE1 TYR A 112 2.124 8.119 -5.252 1.00 0.00 H new ATOM 0 HE2 TYR A 112 3.481 8.675 -9.255 1.00 0.00 H new ATOM 0 HH TYR A 112 0.861 8.957 -7.690 1.00 0.00 H new ATOM 1787 N LYS A 113 5.370 4.398 -9.273 1.00 0.00 N ATOM 1788 CA LYS A 113 4.815 4.336 -10.620 1.00 0.00 C ATOM 1789 C LYS A 113 4.271 2.943 -10.922 1.00 0.00 C ATOM 1790 O LYS A 113 3.372 2.782 -11.748 1.00 0.00 O ATOM 1791 CB LYS A 113 5.882 4.713 -11.651 1.00 0.00 C ATOM 1792 CG LYS A 113 6.560 6.042 -11.367 1.00 0.00 C ATOM 1793 CD LYS A 113 7.839 6.199 -12.173 1.00 0.00 C ATOM 1794 CE LYS A 113 8.907 5.215 -11.721 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.210 5.461 -12.400 1.00 0.00 N ATOM 0 H LYS A 113 6.336 4.723 -9.229 1.00 0.00 H new ATOM 0 HA LYS A 113 3.992 5.048 -10.680 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.638 3.928 -11.682 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.423 4.753 -12.639 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.877 6.858 -11.604 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.788 6.115 -10.304 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.625 6.045 -13.231 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.213 7.217 -12.069 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.039 5.293 -10.642 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.575 4.198 -11.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.921 4.792 -12.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.098 5.329 -13.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.523 6.434 -12.209 1.00 0.00 H new ATOM 1809 N LEU A 114 4.821 1.940 -10.247 1.00 0.00 N ATOM 1810 CA LEU A 114 4.389 0.560 -10.441 1.00 0.00 C ATOM 1811 C LEU A 114 2.983 0.347 -9.891 1.00 0.00 C ATOM 1812 O LEU A 114 2.029 0.172 -10.649 1.00 0.00 O ATOM 1813 CB LEU A 114 5.366 -0.401 -9.762 1.00 0.00 C ATOM 1814 CG LEU A 114 4.822 -1.793 -9.437 1.00 0.00 C ATOM 1815 CD1 LEU A 114 5.222 -2.788 -10.515 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.317 -2.254 -8.074 1.00 0.00 C ATOM 0 H LEU A 114 5.567 2.056 -9.561 1.00 0.00 H new ATOM 0 HA LEU A 114 4.374 0.357 -11.512 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.239 -0.515 -10.405 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.711 0.058 -8.835 1.00 0.00 H new ATOM 0 HG LEU A 114 3.734 -1.739 -9.407 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.826 -3.773 -10.266 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.818 -2.466 -11.475 1.00 0.00 H new ATOM 0 HD13 LEU A 114 6.309 -2.839 -10.577 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.920 -3.246 -7.859 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.406 -2.292 -8.076 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.980 -1.555 -7.309 1.00 0.00 H new ATOM 1828 N MET A 115 2.862 0.364 -8.568 1.00 0.00 N ATOM 1829 CA MET A 115 1.571 0.176 -7.916 1.00 0.00 C ATOM 1830 C MET A 115 0.471 0.924 -8.663 1.00 0.00 C ATOM 1831 O MET A 115 -0.654 0.439 -8.781 1.00 0.00 O ATOM 1832 CB MET A 115 1.634 0.654 -6.464 1.00 0.00 C ATOM 1833 CG MET A 115 2.715 -0.032 -5.645 1.00 0.00 C ATOM 1834 SD MET A 115 2.894 0.678 -3.997 1.00 0.00 S ATOM 1835 CE MET A 115 3.547 2.298 -4.395 1.00 0.00 C ATOM 0 H MET A 115 3.642 0.506 -7.926 1.00 0.00 H new ATOM 0 HA MET A 115 1.336 -0.888 -7.930 1.00 0.00 H new ATOM 0 HB2 MET A 115 1.808 1.730 -6.452 1.00 0.00 H new ATOM 0 HB3 MET A 115 0.667 0.482 -5.991 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.480 -1.093 -5.556 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.666 0.040 -6.173 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.584 2.364 -4.065 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.499 2.455 -5.473 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.956 3.062 -3.890 1.00 0.00 H new ATOM 1845 N LYS A 116 0.803 2.109 -9.165 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.155 2.925 -9.901 1.00 0.00 C ATOM 1847 C LYS A 116 -1.114 2.049 -10.701 1.00 0.00 C ATOM 1848 O LYS A 116 -2.298 1.951 -10.376 1.00 0.00 O ATOM 1849 CB LYS A 116 0.577 3.886 -10.839 1.00 0.00 C ATOM 1850 CG LYS A 116 1.259 5.037 -10.120 1.00 0.00 C ATOM 1851 CD LYS A 116 1.724 6.107 -11.094 1.00 0.00 C ATOM 1852 CE LYS A 116 0.686 7.208 -11.250 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.411 7.897 -9.959 1.00 0.00 N ATOM 0 H LYS A 116 1.730 2.526 -9.075 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.733 3.502 -9.179 1.00 0.00 H new ATOM 0 HB2 LYS A 116 1.323 3.329 -11.405 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.134 4.289 -11.560 1.00 0.00 H new ATOM 0 HG2 LYS A 116 0.570 5.476 -9.398 1.00 0.00 H new ATOM 0 HG3 LYS A 116 2.113 4.660 -9.557 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.662 6.537 -10.743 1.00 0.00 H new ATOM 0 HD3 LYS A 116 1.924 5.654 -12.065 1.00 0.00 H new ATOM 0 HE2 LYS A 116 1.035 7.935 -11.983 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -0.239 6.783 -11.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.126 8.880 -10.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -0.355 7.403 -9.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 1.270 7.890 -9.372 1.00 0.00 H new ATOM 1867 N SER A 117 -0.595 1.412 -11.746 1.00 0.00 N ATOM 1868 CA SER A 117 -1.407 0.546 -12.593 1.00 0.00 C ATOM 1869 C SER A 117 -1.065 -0.922 -12.354 1.00 0.00 C ATOM 1870 O SER A 117 -1.380 -1.785 -13.173 1.00 0.00 O ATOM 1871 CB SER A 117 -1.196 0.897 -14.067 1.00 0.00 C ATOM 1872 OG SER A 117 -2.029 1.974 -14.459 1.00 0.00 O ATOM 0 H SER A 117 0.383 1.479 -12.026 1.00 0.00 H new ATOM 0 HA SER A 117 -2.454 0.704 -12.335 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.152 1.161 -14.235 1.00 0.00 H new ATOM 0 HB3 SER A 117 -1.408 0.025 -14.686 1.00 0.00 H new ATOM 0 HG SER A 117 -1.874 2.180 -15.404 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.419 -1.196 -11.226 1.00 0.00 N ATOM 1879 CA ASP A 118 -0.035 -2.559 -10.877 1.00 0.00 C ATOM 1880 C ASP A 118 -1.045 -3.179 -9.917 1.00 0.00 C ATOM 1881 O ASP A 118 -1.777 -4.100 -10.279 1.00 0.00 O ATOM 1882 CB ASP A 118 1.359 -2.574 -10.250 1.00 0.00 C ATOM 1883 CG ASP A 118 2.459 -2.704 -11.285 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.767 -1.695 -11.953 1.00 0.00 O ATOM 1885 OD2 ASP A 118 3.010 -3.816 -11.429 1.00 0.00 O ATOM 0 H ASP A 118 -0.150 -0.493 -10.538 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.019 -3.151 -11.792 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.507 -1.657 -9.680 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.428 -3.402 -9.545 1.00 0.00 H new ATOM 1890 N SER A 119 -1.078 -2.668 -8.690 1.00 0.00 N ATOM 1891 CA SER A 119 -1.995 -3.175 -7.675 1.00 0.00 C ATOM 1892 C SER A 119 -3.280 -2.353 -7.644 1.00 0.00 C ATOM 1893 O SER A 119 -4.381 -2.899 -7.713 1.00 0.00 O ATOM 1894 CB SER A 119 -1.328 -3.152 -6.298 1.00 0.00 C ATOM 1895 OG SER A 119 -1.810 -4.205 -5.481 1.00 0.00 O ATOM 0 H SER A 119 -0.481 -1.904 -8.375 1.00 0.00 H new ATOM 0 HA SER A 119 -2.249 -4.204 -7.931 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.248 -3.241 -6.412 1.00 0.00 H new ATOM 0 HB3 SER A 119 -1.519 -2.195 -5.813 1.00 0.00 H new ATOM 0 HG SER A 119 -1.084 -4.838 -5.301 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.130 -1.037 -7.540 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.277 -0.138 -7.498 1.00 0.00 C ATOM 1903 C TYR A 120 -5.426 -0.681 -8.343 1.00 0.00 C ATOM 1904 O TYR A 120 -6.566 -0.792 -7.890 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.880 1.254 -7.992 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.492 2.379 -7.188 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -4.096 2.620 -5.879 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.467 3.201 -7.739 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -4.653 3.646 -5.141 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.029 4.231 -7.010 1.00 0.00 C ATOM 1911 CZ TYR A 120 -5.619 4.449 -5.711 1.00 0.00 C ATOM 1912 OH TYR A 120 -6.176 5.473 -4.980 1.00 0.00 O ATOM 0 H TYR A 120 -2.225 -0.569 -7.483 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.612 -0.067 -6.463 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.794 1.345 -7.961 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -4.179 1.359 -9.035 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -3.339 1.994 -5.430 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.791 3.032 -8.755 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -4.334 3.819 -4.124 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.785 4.862 -7.454 1.00 0.00 H new ATOM 0 HH TYR A 120 -6.554 6.142 -5.589 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.120 -1.028 -9.602 1.00 0.00 N ATOM 1923 CA PRO A 121 -6.112 -1.567 -10.538 1.00 0.00 C ATOM 1924 C PRO A 121 -6.947 -2.683 -9.919 1.00 0.00 C ATOM 1925 O PRO A 121 -8.171 -2.583 -9.837 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.258 -2.111 -11.686 1.00 0.00 C ATOM 1927 CG PRO A 121 -4.005 -1.306 -11.639 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.783 -0.923 -10.209 1.00 0.00 C ATOM 0 HA PRO A 121 -6.834 -0.811 -10.847 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -5.051 -3.173 -11.557 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.765 -1.999 -12.644 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.162 -1.883 -12.019 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.093 -0.419 -12.266 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.070 -1.589 -9.723 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.384 0.088 -10.124 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.276 -3.745 -9.485 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.957 -4.881 -8.874 1.00 0.00 C ATOM 1938 C ARG A 122 -7.756 -4.442 -7.650 1.00 0.00 C ATOM 1939 O ARG A 122 -8.945 -4.738 -7.534 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.944 -5.956 -8.476 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.104 -6.462 -9.638 1.00 0.00 C ATOM 1942 CD ARG A 122 -3.879 -7.220 -9.152 1.00 0.00 C ATOM 1943 NE ARG A 122 -3.374 -8.148 -10.160 1.00 0.00 N ATOM 1944 CZ ARG A 122 -2.686 -9.246 -9.868 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -2.422 -9.552 -8.605 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -2.261 -10.042 -10.841 1.00 0.00 N ATOM 0 H ARG A 122 -5.262 -3.843 -9.545 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.648 -5.296 -9.608 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.283 -5.554 -7.709 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.475 -6.797 -8.030 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.709 -7.113 -10.269 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.791 -5.620 -10.256 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.095 -6.510 -8.887 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -4.130 -7.771 -8.245 1.00 0.00 H new ATOM 0 HE ARG A 122 -3.560 -7.942 -11.142 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -2.748 -8.943 -7.854 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.893 -10.396 -8.385 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -2.463 -9.811 -11.814 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.733 -10.885 -10.616 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.094 -3.736 -6.740 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.741 -3.258 -5.524 1.00 0.00 C ATOM 1962 C PHE A 123 -9.181 -2.836 -5.804 1.00 0.00 C ATOM 1963 O PHE A 123 -10.106 -3.243 -5.101 1.00 0.00 O ATOM 1964 CB PHE A 123 -6.960 -2.083 -4.933 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.721 -1.323 -3.885 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.230 -1.972 -2.772 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -7.929 0.041 -4.013 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.931 -1.276 -1.806 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.629 0.743 -3.050 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.132 0.084 -1.946 1.00 0.00 C ATOM 0 H PHE A 123 -6.109 -3.482 -6.822 1.00 0.00 H new ATOM 0 HA PHE A 123 -7.754 -4.076 -4.804 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.033 -2.456 -4.498 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -6.684 -1.400 -5.736 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.077 -3.035 -2.658 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -7.540 0.562 -4.875 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.321 -1.794 -0.943 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.782 1.806 -3.161 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.681 0.630 -1.193 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.361 -2.018 -6.836 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.687 -1.541 -7.209 1.00 0.00 C ATOM 1982 C ILE A 124 -11.573 -2.691 -7.674 1.00 0.00 C ATOM 1983 O ILE A 124 -12.719 -2.819 -7.242 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.610 -0.483 -8.326 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.780 0.717 -7.865 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.008 -0.041 -8.734 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -9.122 1.469 -9.001 1.00 0.00 C ATOM 0 H ILE A 124 -8.606 -1.672 -7.428 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.122 -1.087 -6.319 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.122 -0.927 -9.194 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.422 1.401 -7.311 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -9.010 0.372 -7.174 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.937 0.707 -9.524 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.570 -0.901 -9.098 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.520 0.389 -7.873 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.551 2.306 -8.600 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.453 0.799 -9.542 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -9.887 1.844 -9.680 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.035 -3.527 -8.557 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.778 -4.667 -9.080 1.00 0.00 C ATOM 2001 C ARG A 125 -12.482 -5.420 -7.955 1.00 0.00 C ATOM 2002 O ARG A 125 -13.681 -5.687 -8.029 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.838 -5.613 -9.831 1.00 0.00 C ATOM 2004 CG ARG A 125 -10.083 -4.945 -10.969 1.00 0.00 C ATOM 2005 CD ARG A 125 -11.012 -4.581 -12.116 1.00 0.00 C ATOM 2006 NE ARG A 125 -11.640 -3.276 -11.920 1.00 0.00 N ATOM 2007 CZ ARG A 125 -11.122 -2.137 -12.365 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -9.974 -2.142 -13.029 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -11.752 -0.990 -12.147 1.00 0.00 N ATOM 0 H ARG A 125 -10.088 -3.436 -8.925 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.533 -4.291 -9.770 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.120 -6.033 -9.127 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.417 -6.446 -10.230 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.588 -4.046 -10.601 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.302 -5.613 -11.330 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -10.450 -4.576 -13.050 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -11.784 -5.344 -12.213 1.00 0.00 H new ATOM 0 HE ARG A 125 -12.525 -3.238 -11.414 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -9.487 -3.022 -13.199 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -9.578 -1.266 -13.370 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -12.635 -0.982 -11.637 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.353 -0.116 -12.489 1.00 0.00 H new ATOM 2023 N SER A 126 -11.728 -5.760 -6.915 1.00 0.00 N ATOM 2024 CA SER A 126 -12.278 -6.486 -5.776 1.00 0.00 C ATOM 2025 C SER A 126 -13.398 -5.689 -5.114 1.00 0.00 C ATOM 2026 O SER A 126 -13.312 -4.468 -4.981 1.00 0.00 O ATOM 2027 CB SER A 126 -11.179 -6.786 -4.756 1.00 0.00 C ATOM 2028 OG SER A 126 -11.529 -7.890 -3.938 1.00 0.00 O ATOM 0 H SER A 126 -10.734 -5.544 -6.837 1.00 0.00 H new ATOM 0 HA SER A 126 -12.691 -7.426 -6.141 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.244 -6.996 -5.275 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.007 -5.908 -4.133 1.00 0.00 H new ATOM 0 HG SER A 126 -10.809 -8.062 -3.296 1.00 0.00 H new ATOM 2034 N SER A 127 -14.449 -6.389 -4.699 1.00 0.00 N ATOM 2035 CA SER A 127 -15.589 -5.747 -4.054 1.00 0.00 C ATOM 2036 C SER A 127 -15.149 -4.985 -2.808 1.00 0.00 C ATOM 2037 O SER A 127 -15.682 -3.919 -2.499 1.00 0.00 O ATOM 2038 CB SER A 127 -16.644 -6.790 -3.681 1.00 0.00 C ATOM 2039 OG SER A 127 -17.252 -7.338 -4.839 1.00 0.00 O ATOM 0 H SER A 127 -14.535 -7.401 -4.798 1.00 0.00 H new ATOM 0 HA SER A 127 -16.022 -5.038 -4.759 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.182 -7.586 -3.098 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.405 -6.332 -3.049 1.00 0.00 H new ATOM 0 HG SER A 127 -17.921 -8.003 -4.574 1.00 0.00 H new ATOM 2045 N ALA A 128 -14.172 -5.538 -2.097 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.659 -4.911 -0.886 1.00 0.00 C ATOM 2047 C ALA A 128 -13.626 -3.392 -1.026 1.00 0.00 C ATOM 2048 O ALA A 128 -13.949 -2.666 -0.086 1.00 0.00 O ATOM 2049 CB ALA A 128 -12.270 -5.443 -0.564 1.00 0.00 C ATOM 0 H ALA A 128 -13.720 -6.420 -2.339 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.331 -5.160 -0.065 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.899 -4.966 0.343 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.319 -6.521 -0.413 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.595 -5.223 -1.391 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.235 -2.920 -2.204 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.157 -1.488 -2.466 1.00 0.00 C ATOM 2057 C TYR A 129 -14.550 -0.885 -2.612 1.00 0.00 C ATOM 2058 O TYR A 129 -14.884 0.100 -1.953 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.339 -1.223 -3.731 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.605 0.130 -4.352 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -11.894 1.253 -3.948 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -13.566 0.284 -5.343 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -12.134 2.491 -4.512 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -13.812 1.518 -5.914 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.094 2.619 -5.494 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.335 3.850 -6.059 1.00 0.00 O ATOM 0 H TYR A 129 -12.967 -3.508 -2.993 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.663 -1.015 -1.617 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.279 -1.301 -3.491 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.558 -1.999 -4.464 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.141 1.157 -3.180 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.131 -0.576 -5.673 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -11.573 3.354 -4.186 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -14.562 1.620 -6.685 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.853 3.736 -6.883 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.359 -1.483 -3.480 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.717 -1.006 -3.713 1.00 0.00 C ATOM 2078 C GLN A 130 -17.492 -0.908 -2.404 1.00 0.00 C ATOM 2079 O GLN A 130 -18.214 0.061 -2.170 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.447 -1.935 -4.684 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.766 -2.058 -6.038 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.190 -0.970 -7.005 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.374 -0.651 -7.119 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.222 -0.393 -7.708 1.00 0.00 N ATOM 0 H GLN A 130 -15.098 -2.299 -4.034 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.655 -0.010 -4.152 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.527 -2.925 -4.236 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.463 -1.568 -4.830 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.685 -2.017 -5.902 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.996 -3.032 -6.469 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.254 -0.689 -7.582 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -16.447 0.346 -8.374 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.338 -1.919 -1.554 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.026 -1.946 -0.268 1.00 0.00 C ATOM 2095 C GLU A 131 -18.129 -0.543 0.324 1.00 0.00 C ATOM 2096 O GLU A 131 -19.220 -0.073 0.648 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.294 -2.870 0.707 1.00 0.00 C ATOM 2098 CG GLU A 131 -17.109 -4.284 0.183 1.00 0.00 C ATOM 2099 CD GLU A 131 -17.071 -5.318 1.292 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -16.434 -5.050 2.332 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -17.680 -6.394 1.119 1.00 0.00 O ATOM 0 H GLU A 131 -16.744 -2.729 -1.732 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.034 -2.327 -0.432 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.316 -2.445 0.933 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.849 -2.909 1.644 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.922 -4.522 -0.503 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.183 -4.337 -0.390 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.986 0.119 0.462 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.946 1.469 1.015 1.00 0.00 C ATOM 2110 C LEU A 132 -17.852 2.408 0.226 1.00 0.00 C ATOM 2111 O LEU A 132 -18.737 3.054 0.790 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.512 2.001 1.010 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.426 1.010 1.430 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.056 1.669 1.390 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -14.715 0.461 2.820 1.00 0.00 C ATOM 0 H LEU A 132 -16.075 -0.256 0.199 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.307 1.425 2.043 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.282 2.357 0.006 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.464 2.864 1.674 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.427 0.179 0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.296 0.948 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -12.847 2.013 0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -13.041 2.519 2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -13.932 -0.243 3.103 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.742 1.282 3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -15.678 -0.050 2.817 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.628 2.478 -1.081 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.427 3.336 -1.950 1.00 0.00 C ATOM 2129 C LEU A 133 -19.909 3.234 -1.603 1.00 0.00 C ATOM 2130 O LEU A 133 -20.542 4.226 -1.243 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.206 2.959 -3.415 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.065 3.683 -4.131 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -16.694 2.956 -5.414 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.450 5.125 -4.425 1.00 0.00 C ATOM 0 H LEU A 133 -16.900 1.951 -1.563 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.108 4.367 -1.795 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.019 1.886 -3.469 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.130 3.149 -3.961 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.194 3.687 -3.475 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -15.881 3.485 -5.910 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.375 1.941 -5.178 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.560 2.920 -6.075 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.626 5.625 -4.935 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.335 5.143 -5.061 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -17.665 5.642 -3.490 1.00 0.00 H new