USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 913 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 108 THR OG1 : rot 171:sc= 0.429 USER MOD Set 1.2: A 110 ASN :FLIP amide:sc= -12.2! C(o=-19!,f=-12!) USER MOD Set 2.1: A 40 HIS : no HD1:sc= -2.97 K(o=-4.7,f=-6.9!) USER MOD Set 2.2: A 74 SER OG : rot -17:sc= -1.71! USER MOD Set 3.1: A 11 LYS NZ :NH3+ -160:sc= -0.253 (180deg=-1.14) USER MOD Set 3.2: A 12 ASN :FLIP amide:sc= 0.926 F(o=-0.7,f=0.67) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 153:sc= 0.43 (180deg=-0.235!) USER MOD Single : A 2 CYS SG : rot -7:sc= -0.751! USER MOD Single : A 4 LYS NZ :NH3+ 155:sc= -1.15 (180deg=-1.83) USER MOD Single : A 7 MET CE :methyl -159:sc= -0.363 (180deg=-1.61!) USER MOD Single : A 19 LYS NZ :NH3+ -115:sc= 0.756 (180deg=-0.375) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.563 F(o=-2.4,f=-0.56) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.007 USER MOD Single : A 37 LYS NZ :NH3+ -143:sc= -1.21 (180deg=-1.78) USER MOD Single : A 41 TYR OH : rot 180:sc= -0.275 USER MOD Single : A 45 CYS SG : rot 45:sc= 0.806 USER MOD Single : A 47 GLN :FLIP amide:sc= -2.22! C(o=-4.6!,f=-2.2!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN :FLIP amide:sc= -0.171! C(o=-13!,f=-0.17!) USER MOD Single : A 66 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.545) USER MOD Single : A 67 HIS :FLIP no HD1:sc= -0.585 F(o=-1.5,f=-0.59) USER MOD Single : A 68 HIS : no HD1:sc= -0.221 X(o=-0.22,f=-0.19) USER MOD Single : A 70 THR OG1 : rot 124:sc= -4.76! USER MOD Single : A 77 TYR OH : rot -140:sc= -0.311 USER MOD Single : A 80 HIS : no HD1:sc= -0.0111 K(o=-0.011,f=-2!) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot -170:sc= -1.97 USER MOD Single : A 85 LYS NZ :NH3+ -162:sc= -0.208 (180deg=-0.99) USER MOD Single : A 89 SER OG : rot 5:sc= 0.337! USER MOD Single : A 90 LYS NZ :NH3+ -135:sc= -1.5! (180deg=-3.49!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 140:sc= -2.91 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.498! USER MOD Single : A 111 GLN : amide:sc= -0.16 K(o=-0.16,f=-2.7!) USER MOD Single : A 114 LYS NZ :NH3+ -108:sc= -0.0899 (180deg=-0.871) USER MOD Single : A 118 GLN : amide:sc= -4.55! C(o=-4.5!,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.607 -8.676 81.003 1.00 0.00 N ATOM 2 CA MET A 1 -11.446 -8.012 81.662 1.00 0.00 C ATOM 3 C MET A 1 -11.042 -8.808 82.909 1.00 0.00 C ATOM 4 O MET A 1 -11.854 -9.083 83.768 1.00 0.00 O ATOM 5 CB MET A 1 -11.841 -6.587 82.061 1.00 0.00 C ATOM 6 CG MET A 1 -12.154 -5.772 80.803 1.00 0.00 C ATOM 7 SD MET A 1 -13.758 -6.277 80.135 1.00 0.00 S ATOM 8 CE MET A 1 -13.856 -5.039 78.817 1.00 0.00 C ATOM 0 H1 MET A 1 -13.160 -7.968 80.479 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.263 -9.404 80.344 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.209 -9.120 81.726 1.00 0.00 H new ATOM 0 HA MET A 1 -10.602 -7.975 80.973 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.710 -6.610 82.718 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.032 -6.117 82.620 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.166 -4.708 81.041 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.374 -5.923 80.057 1.00 0.00 H new ATOM 0 HE1 MET A 1 -14.787 -5.168 78.265 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.829 -4.040 79.253 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.012 -5.162 78.139 1.00 0.00 H new ATOM 20 N CYS A 2 -9.792 -9.186 83.012 1.00 0.00 N ATOM 21 CA CYS A 2 -9.347 -9.972 84.202 1.00 0.00 C ATOM 22 C CYS A 2 -7.847 -9.766 84.441 1.00 0.00 C ATOM 23 O CYS A 2 -7.197 -10.584 85.064 1.00 0.00 O ATOM 24 CB CYS A 2 -9.610 -11.460 83.954 1.00 0.00 C ATOM 25 SG CYS A 2 -11.377 -11.726 83.668 1.00 0.00 S ATOM 0 H CYS A 2 -9.064 -8.985 82.326 1.00 0.00 H new ATOM 0 HA CYS A 2 -9.902 -9.633 85.077 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -9.037 -11.802 83.093 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -9.278 -12.046 84.811 1.00 0.00 H new ATOM 0 HG CYS A 2 -12.023 -10.618 83.881 1.00 0.00 H new ATOM 31 N ASP A 3 -7.286 -8.691 83.959 1.00 0.00 N ATOM 32 CA ASP A 3 -5.828 -8.462 84.173 1.00 0.00 C ATOM 33 C ASP A 3 -5.564 -8.200 85.653 1.00 0.00 C ATOM 34 O ASP A 3 -4.479 -8.424 86.150 1.00 0.00 O ATOM 35 CB ASP A 3 -5.367 -7.254 83.355 1.00 0.00 C ATOM 36 CG ASP A 3 -5.538 -7.547 81.865 1.00 0.00 C ATOM 37 OD1 ASP A 3 -4.673 -8.203 81.307 1.00 0.00 O ATOM 38 OD2 ASP A 3 -6.529 -7.109 81.305 1.00 0.00 O ATOM 0 H ASP A 3 -7.770 -7.966 83.430 1.00 0.00 H new ATOM 0 HA ASP A 3 -5.277 -9.346 83.854 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -5.946 -6.373 83.631 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -4.323 -7.031 83.574 1.00 0.00 H new ATOM 43 N LYS A 4 -6.545 -7.722 86.357 1.00 0.00 N ATOM 44 CA LYS A 4 -6.354 -7.436 87.803 1.00 0.00 C ATOM 45 C LYS A 4 -6.042 -8.737 88.554 1.00 0.00 C ATOM 46 O LYS A 4 -5.043 -8.843 89.230 1.00 0.00 O ATOM 47 CB LYS A 4 -7.625 -6.790 88.360 1.00 0.00 C ATOM 48 CG LYS A 4 -7.675 -5.320 87.928 1.00 0.00 C ATOM 49 CD LYS A 4 -9.051 -4.725 88.251 1.00 0.00 C ATOM 50 CE LYS A 4 -9.354 -4.909 89.739 1.00 0.00 C ATOM 51 NZ LYS A 4 -8.132 -4.609 90.540 1.00 0.00 N ATOM 0 H LYS A 4 -7.475 -7.516 85.993 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.517 -6.751 87.935 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.506 -7.319 87.995 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.637 -6.862 89.448 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -6.896 -4.755 88.440 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -7.477 -5.240 86.859 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.070 -3.666 87.994 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.819 -5.212 87.650 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.168 -4.249 90.039 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.684 -5.930 89.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -8.409 -4.319 91.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -7.535 -5.459 90.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -7.599 -3.840 90.086 1.00 0.00 H new ATOM 65 N GLU A 5 -6.877 -9.733 88.441 1.00 0.00 N ATOM 66 CA GLU A 5 -6.595 -11.015 89.156 1.00 0.00 C ATOM 67 C GLU A 5 -5.180 -11.494 88.794 1.00 0.00 C ATOM 68 O GLU A 5 -4.421 -11.918 89.643 1.00 0.00 O ATOM 69 CB GLU A 5 -7.629 -12.071 88.737 1.00 0.00 C ATOM 70 CG GLU A 5 -7.822 -13.104 89.856 1.00 0.00 C ATOM 71 CD GLU A 5 -6.461 -13.574 90.377 1.00 0.00 C ATOM 72 OE1 GLU A 5 -5.896 -12.882 91.208 1.00 0.00 O ATOM 73 OE2 GLU A 5 -6.012 -14.622 89.943 1.00 0.00 O ATOM 0 H GLU A 5 -7.735 -9.718 87.890 1.00 0.00 H new ATOM 0 HA GLU A 5 -6.659 -10.861 90.233 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.580 -11.589 88.511 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -7.300 -12.570 87.825 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -8.401 -12.667 90.670 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -8.391 -13.955 89.482 1.00 0.00 H new ATOM 80 N PHE A 6 -4.823 -11.415 87.539 1.00 0.00 N ATOM 81 CA PHE A 6 -3.457 -11.847 87.104 1.00 0.00 C ATOM 82 C PHE A 6 -2.438 -10.853 87.680 1.00 0.00 C ATOM 83 O PHE A 6 -1.523 -11.211 88.394 1.00 0.00 O ATOM 84 CB PHE A 6 -3.413 -11.808 85.567 1.00 0.00 C ATOM 85 CG PHE A 6 -2.350 -12.739 85.014 1.00 0.00 C ATOM 86 CD1 PHE A 6 -1.034 -12.693 85.494 1.00 0.00 C ATOM 87 CD2 PHE A 6 -2.689 -13.640 83.995 1.00 0.00 C ATOM 88 CE1 PHE A 6 -0.062 -13.550 84.957 1.00 0.00 C ATOM 89 CE2 PHE A 6 -1.719 -14.492 83.458 1.00 0.00 C ATOM 90 CZ PHE A 6 -0.406 -14.449 83.938 1.00 0.00 C ATOM 0 H PHE A 6 -5.422 -11.068 86.790 1.00 0.00 H new ATOM 0 HA PHE A 6 -3.226 -12.853 87.453 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -4.387 -12.089 85.167 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -3.214 -10.789 85.234 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -0.768 -11.998 86.277 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.702 -13.676 83.624 1.00 0.00 H new ATOM 0 HE1 PHE A 6 0.951 -13.517 85.329 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.984 -15.184 82.672 1.00 0.00 H new ATOM 0 HZ PHE A 6 0.343 -15.108 83.524 1.00 0.00 H new ATOM 100 N MET A 7 -2.615 -9.602 87.356 1.00 0.00 N ATOM 101 CA MET A 7 -1.708 -8.521 87.842 1.00 0.00 C ATOM 102 C MET A 7 -1.702 -8.454 89.376 1.00 0.00 C ATOM 103 O MET A 7 -0.671 -8.549 90.019 1.00 0.00 O ATOM 104 CB MET A 7 -2.251 -7.195 87.301 1.00 0.00 C ATOM 105 CG MET A 7 -1.312 -6.039 87.650 1.00 0.00 C ATOM 106 SD MET A 7 -2.260 -4.494 87.710 1.00 0.00 S ATOM 107 CE MET A 7 -3.297 -4.777 86.249 1.00 0.00 C ATOM 0 H MET A 7 -3.373 -9.274 86.757 1.00 0.00 H new ATOM 0 HA MET A 7 -0.691 -8.717 87.502 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.369 -7.260 86.219 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.240 -7.005 87.718 1.00 0.00 H new ATOM 0 HG2 MET A 7 -0.832 -6.222 88.612 1.00 0.00 H new ATOM 0 HG3 MET A 7 -0.518 -5.963 86.907 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.681 -3.824 85.885 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.703 -5.251 85.468 1.00 0.00 H new ATOM 0 HE3 MET A 7 -4.131 -5.426 86.515 1.00 0.00 H new ATOM 117 N TRP A 8 -2.849 -8.243 89.954 1.00 0.00 N ATOM 118 CA TRP A 8 -2.957 -8.106 91.433 1.00 0.00 C ATOM 119 C TRP A 8 -2.189 -9.211 92.170 1.00 0.00 C ATOM 120 O TRP A 8 -2.031 -9.156 93.372 1.00 0.00 O ATOM 121 CB TRP A 8 -4.435 -8.153 91.813 1.00 0.00 C ATOM 122 CG TRP A 8 -4.607 -7.675 93.215 1.00 0.00 C ATOM 123 CD1 TRP A 8 -4.886 -8.467 94.272 1.00 0.00 C ATOM 124 CD2 TRP A 8 -4.516 -6.315 93.732 1.00 0.00 C ATOM 125 NE1 TRP A 8 -4.974 -7.683 95.406 1.00 0.00 N ATOM 126 CE2 TRP A 8 -4.752 -6.349 95.126 1.00 0.00 C ATOM 127 CE3 TRP A 8 -4.254 -5.066 93.134 1.00 0.00 C ATOM 128 CZ2 TRP A 8 -4.729 -5.189 95.901 1.00 0.00 C ATOM 129 CZ3 TRP A 8 -4.230 -3.897 93.912 1.00 0.00 C ATOM 130 CH2 TRP A 8 -4.468 -3.958 95.293 1.00 0.00 C ATOM 0 H TRP A 8 -3.734 -8.158 89.455 1.00 0.00 H new ATOM 0 HA TRP A 8 -2.512 -7.156 91.730 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -5.016 -7.531 91.132 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -4.814 -9.171 91.716 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -5.019 -9.538 94.237 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -5.178 -8.045 96.337 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -4.071 -5.007 92.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -4.912 -5.242 96.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -4.027 -2.945 93.444 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -4.450 -3.055 95.885 1.00 0.00 H new ATOM 141 N ALA A 9 -1.709 -10.202 91.476 1.00 0.00 N ATOM 142 CA ALA A 9 -0.952 -11.287 92.169 1.00 0.00 C ATOM 143 C ALA A 9 0.538 -10.924 92.239 1.00 0.00 C ATOM 144 O ALA A 9 1.139 -10.948 93.295 1.00 0.00 O ATOM 145 CB ALA A 9 -1.133 -12.615 91.431 1.00 0.00 C ATOM 0 H ALA A 9 -1.805 -10.311 90.466 1.00 0.00 H new ATOM 0 HA ALA A 9 -1.340 -11.394 93.182 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.576 -13.397 91.947 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.191 -12.878 91.409 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.762 -12.518 90.411 1.00 0.00 H new ATOM 151 N LEU A 10 1.133 -10.567 91.130 1.00 0.00 N ATOM 152 CA LEU A 10 2.576 -10.179 91.144 1.00 0.00 C ATOM 153 C LEU A 10 2.762 -9.078 92.192 1.00 0.00 C ATOM 154 O LEU A 10 3.860 -8.639 92.478 1.00 0.00 O ATOM 155 CB LEU A 10 2.985 -9.619 89.765 1.00 0.00 C ATOM 156 CG LEU A 10 2.650 -10.615 88.642 1.00 0.00 C ATOM 157 CD1 LEU A 10 1.337 -10.213 87.963 1.00 0.00 C ATOM 158 CD2 LEU A 10 3.765 -10.590 87.593 1.00 0.00 C ATOM 0 H LEU A 10 0.683 -10.527 90.216 1.00 0.00 H new ATOM 0 HA LEU A 10 3.189 -11.050 91.375 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.469 -8.676 89.585 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.054 -9.405 89.758 1.00 0.00 H new ATOM 0 HG LEU A 10 2.554 -11.613 89.071 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.106 -10.923 87.169 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.532 -10.216 88.698 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.438 -9.214 87.539 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.530 -11.295 86.796 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.850 -9.586 87.176 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.709 -10.871 88.059 1.00 0.00 H new ATOM 170 N LYS A 11 1.665 -8.610 92.728 1.00 0.00 N ATOM 171 CA LYS A 11 1.685 -7.497 93.726 1.00 0.00 C ATOM 172 C LYS A 11 1.949 -7.999 95.154 1.00 0.00 C ATOM 173 O LYS A 11 3.053 -7.931 95.657 1.00 0.00 O ATOM 174 CB LYS A 11 0.309 -6.824 93.678 1.00 0.00 C ATOM 175 CG LYS A 11 0.215 -5.693 94.702 1.00 0.00 C ATOM 176 CD LYS A 11 -1.234 -5.604 95.182 1.00 0.00 C ATOM 177 CE LYS A 11 -1.368 -4.554 96.278 1.00 0.00 C ATOM 178 NZ LYS A 11 -0.229 -4.673 97.230 1.00 0.00 N ATOM 0 H LYS A 11 0.732 -8.961 92.510 1.00 0.00 H new ATOM 0 HA LYS A 11 2.491 -6.808 93.475 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.128 -6.430 92.678 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.468 -7.563 93.875 1.00 0.00 H new ATOM 0 HG2 LYS A 11 0.883 -5.884 95.542 1.00 0.00 H new ATOM 0 HG3 LYS A 11 0.526 -4.749 94.255 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.886 -5.351 94.346 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -1.559 -6.574 95.557 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -1.385 -3.556 95.839 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -2.312 -4.685 96.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.480 -4.216 98.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.021 -5.678 97.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.610 -4.208 96.828 1.00 0.00 H new ATOM 192 N ASN A 12 0.924 -8.446 95.826 1.00 0.00 N ATOM 193 CA ASN A 12 1.078 -8.892 97.242 1.00 0.00 C ATOM 194 C ASN A 12 1.707 -10.285 97.327 1.00 0.00 C ATOM 195 O ASN A 12 1.564 -10.975 98.316 1.00 0.00 O ATOM 196 CB ASN A 12 -0.306 -8.924 97.891 1.00 0.00 C ATOM 197 CG ASN A 12 -0.180 -8.660 99.392 1.00 0.00 C ATOM 198 OD1 ASN A 12 -0.577 -7.515 99.875 1.00 0.00 O flip ATOM 199 ND2 ASN A 12 0.286 -9.503 100.132 1.00 0.00 N flip ATOM 0 H ASN A 12 -0.022 -8.522 95.453 1.00 0.00 H new ATOM 0 HA ASN A 12 1.737 -8.195 97.759 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -0.950 -8.173 97.433 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -0.775 -9.893 97.721 1.00 0.00 H new ATOM 0 HD21 ASN A 12 0.596 -10.398 99.754 1.00 0.00 H new ATOM 0 HD22 ASN A 12 0.367 -9.316 101.131 1.00 0.00 H new ATOM 206 N GLY A 13 2.423 -10.695 96.325 1.00 0.00 N ATOM 207 CA GLY A 13 3.079 -12.023 96.385 1.00 0.00 C ATOM 208 C GLY A 13 2.047 -13.148 96.314 1.00 0.00 C ATOM 209 O GLY A 13 2.310 -14.257 96.738 1.00 0.00 O ATOM 0 H GLY A 13 2.583 -10.168 95.466 1.00 0.00 H new ATOM 0 HA2 GLY A 13 3.786 -12.121 95.561 1.00 0.00 H new ATOM 0 HA3 GLY A 13 3.652 -12.108 97.308 1.00 0.00 H new ATOM 213 N ASP A 14 0.892 -12.896 95.765 1.00 0.00 N ATOM 214 CA ASP A 14 -0.103 -13.989 95.651 1.00 0.00 C ATOM 215 C ASP A 14 0.439 -14.963 94.623 1.00 0.00 C ATOM 216 O ASP A 14 -0.179 -15.275 93.623 1.00 0.00 O ATOM 217 CB ASP A 14 -1.448 -13.449 95.196 1.00 0.00 C ATOM 218 CG ASP A 14 -1.667 -12.058 95.789 1.00 0.00 C ATOM 219 OD1 ASP A 14 -0.854 -11.190 95.522 1.00 0.00 O ATOM 220 OD2 ASP A 14 -2.637 -11.890 96.509 1.00 0.00 O ATOM 0 H ASP A 14 0.599 -11.991 95.396 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.257 -14.472 96.616 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.483 -13.401 94.108 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.247 -14.120 95.512 1.00 0.00 H new ATOM 225 N LEU A 15 1.621 -15.404 94.878 1.00 0.00 N ATOM 226 CA LEU A 15 2.326 -16.335 93.978 1.00 0.00 C ATOM 227 C LEU A 15 1.414 -17.510 93.603 1.00 0.00 C ATOM 228 O LEU A 15 1.547 -18.099 92.551 1.00 0.00 O ATOM 229 CB LEU A 15 3.587 -16.802 94.719 1.00 0.00 C ATOM 230 CG LEU A 15 4.453 -17.723 93.860 1.00 0.00 C ATOM 231 CD1 LEU A 15 3.855 -19.132 93.838 1.00 0.00 C ATOM 232 CD2 LEU A 15 4.556 -17.175 92.434 1.00 0.00 C ATOM 0 H LEU A 15 2.152 -15.147 95.710 1.00 0.00 H new ATOM 0 HA LEU A 15 2.603 -15.851 93.042 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.172 -15.933 95.021 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.298 -17.324 95.631 1.00 0.00 H new ATOM 0 HG LEU A 15 5.453 -17.768 94.291 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.478 -19.782 93.224 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.812 -19.525 94.854 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.849 -19.094 93.421 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.175 -17.840 91.832 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.560 -17.112 91.996 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.006 -16.182 92.457 1.00 0.00 H new ATOM 244 N ASP A 16 0.480 -17.845 94.442 1.00 0.00 N ATOM 245 CA ASP A 16 -0.446 -18.961 94.126 1.00 0.00 C ATOM 246 C ASP A 16 -1.346 -18.574 92.943 1.00 0.00 C ATOM 247 O ASP A 16 -1.790 -19.415 92.186 1.00 0.00 O ATOM 248 CB ASP A 16 -1.321 -19.238 95.343 1.00 0.00 C ATOM 249 CG ASP A 16 -0.449 -19.677 96.522 1.00 0.00 C ATOM 250 OD1 ASP A 16 0.739 -19.403 96.491 1.00 0.00 O ATOM 251 OD2 ASP A 16 -0.985 -20.282 97.438 1.00 0.00 O ATOM 0 H ASP A 16 0.317 -17.390 95.340 1.00 0.00 H new ATOM 0 HA ASP A 16 0.132 -19.848 93.866 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.883 -18.343 95.609 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.049 -20.014 95.109 1.00 0.00 H new ATOM 256 N GLU A 17 -1.637 -17.307 92.802 1.00 0.00 N ATOM 257 CA GLU A 17 -2.533 -16.854 91.693 1.00 0.00 C ATOM 258 C GLU A 17 -1.776 -16.835 90.354 1.00 0.00 C ATOM 259 O GLU A 17 -2.273 -17.315 89.347 1.00 0.00 O ATOM 260 CB GLU A 17 -3.051 -15.447 92.009 1.00 0.00 C ATOM 261 CG GLU A 17 -4.306 -15.536 92.886 1.00 0.00 C ATOM 262 CD GLU A 17 -4.047 -16.468 94.072 1.00 0.00 C ATOM 263 OE1 GLU A 17 -3.393 -16.036 95.007 1.00 0.00 O ATOM 264 OE2 GLU A 17 -4.513 -17.595 94.029 1.00 0.00 O ATOM 0 H GLU A 17 -1.292 -16.563 93.409 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.368 -17.550 91.608 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.279 -14.873 92.521 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.280 -14.918 91.084 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.581 -14.544 93.245 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -5.146 -15.906 92.298 1.00 0.00 H new ATOM 271 N VAL A 18 -0.585 -16.297 90.324 1.00 0.00 N ATOM 272 CA VAL A 18 0.182 -16.265 89.036 1.00 0.00 C ATOM 273 C VAL A 18 0.496 -17.704 88.627 1.00 0.00 C ATOM 274 O VAL A 18 0.500 -18.047 87.460 1.00 0.00 O ATOM 275 CB VAL A 18 1.523 -15.528 89.228 1.00 0.00 C ATOM 276 CG1 VAL A 18 1.485 -14.145 88.573 1.00 0.00 C ATOM 277 CG2 VAL A 18 1.814 -15.376 90.721 1.00 0.00 C ATOM 0 H VAL A 18 -0.111 -15.881 91.126 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.413 -15.753 88.280 1.00 0.00 H new ATOM 0 HB VAL A 18 2.310 -16.115 88.754 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.442 -13.645 88.722 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.295 -14.253 87.505 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.691 -13.550 89.025 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.762 -14.855 90.856 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.015 -14.803 91.191 1.00 0.00 H new ATOM 0 HG23 VAL A 18 1.873 -16.362 91.182 1.00 0.00 H new ATOM 287 N LYS A 19 0.779 -18.534 89.591 1.00 0.00 N ATOM 288 CA LYS A 19 1.117 -19.957 89.303 1.00 0.00 C ATOM 289 C LYS A 19 -0.062 -20.657 88.622 1.00 0.00 C ATOM 290 O LYS A 19 0.109 -21.608 87.888 1.00 0.00 O ATOM 291 CB LYS A 19 1.444 -20.659 90.624 1.00 0.00 C ATOM 292 CG LYS A 19 2.068 -22.033 90.354 1.00 0.00 C ATOM 293 CD LYS A 19 2.934 -22.447 91.552 1.00 0.00 C ATOM 294 CE LYS A 19 4.323 -21.806 91.437 1.00 0.00 C ATOM 295 NZ LYS A 19 5.277 -22.789 90.847 1.00 0.00 N ATOM 0 H LYS A 19 0.791 -18.284 90.580 1.00 0.00 H new ATOM 0 HA LYS A 19 1.976 -20.000 88.633 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.132 -20.048 91.208 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.537 -20.774 91.217 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.285 -22.773 90.185 1.00 0.00 H new ATOM 0 HG3 LYS A 19 2.674 -21.997 89.449 1.00 0.00 H new ATOM 0 HD2 LYS A 19 2.457 -22.137 92.482 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.026 -23.532 91.587 1.00 0.00 H new ATOM 0 HE2 LYS A 19 4.273 -20.913 90.814 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.672 -21.490 92.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 6.006 -23.030 91.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 4.763 -23.650 90.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 5.729 -22.373 90.008 1.00 0.00 H new ATOM 309 N ASP A 20 -1.253 -20.200 88.862 1.00 0.00 N ATOM 310 CA ASP A 20 -2.441 -20.841 88.235 1.00 0.00 C ATOM 311 C ASP A 20 -2.433 -20.600 86.720 1.00 0.00 C ATOM 312 O ASP A 20 -2.473 -21.527 85.933 1.00 0.00 O ATOM 313 CB ASP A 20 -3.718 -20.247 88.841 1.00 0.00 C ATOM 314 CG ASP A 20 -4.941 -20.942 88.238 1.00 0.00 C ATOM 315 OD1 ASP A 20 -4.940 -21.165 87.040 1.00 0.00 O ATOM 316 OD2 ASP A 20 -5.861 -21.237 88.985 1.00 0.00 O ATOM 0 H ASP A 20 -1.459 -19.406 89.468 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.409 -21.914 88.423 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.712 -20.373 89.924 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.762 -19.176 88.645 1.00 0.00 H new ATOM 321 N TYR A 21 -2.398 -19.364 86.305 1.00 0.00 N ATOM 322 CA TYR A 21 -2.407 -19.069 84.841 1.00 0.00 C ATOM 323 C TYR A 21 -1.178 -19.691 84.163 1.00 0.00 C ATOM 324 O TYR A 21 -1.285 -20.343 83.144 1.00 0.00 O ATOM 325 CB TYR A 21 -2.390 -17.552 84.633 1.00 0.00 C ATOM 326 CG TYR A 21 -3.728 -16.972 85.025 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.974 -16.614 86.356 1.00 0.00 C ATOM 328 CD2 TYR A 21 -4.723 -16.792 84.056 1.00 0.00 C ATOM 329 CE1 TYR A 21 -5.214 -16.076 86.718 1.00 0.00 C ATOM 330 CE2 TYR A 21 -5.963 -16.253 84.419 1.00 0.00 C ATOM 331 CZ TYR A 21 -6.209 -15.895 85.750 1.00 0.00 C ATOM 332 OH TYR A 21 -7.430 -15.364 86.107 1.00 0.00 O ATOM 0 H TYR A 21 -2.364 -18.546 86.913 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.307 -19.496 84.398 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.598 -17.102 85.231 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.173 -17.320 83.590 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -3.207 -16.753 87.103 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.534 -17.069 83.029 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -5.404 -15.800 87.745 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.730 -16.113 83.672 1.00 0.00 H new ATOM 0 HH TYR A 21 -8.005 -15.305 85.316 1.00 0.00 H new ATOM 342 N VAL A 22 -0.016 -19.480 84.712 1.00 0.00 N ATOM 343 CA VAL A 22 1.228 -20.038 84.103 1.00 0.00 C ATOM 344 C VAL A 22 1.252 -21.564 84.248 1.00 0.00 C ATOM 345 O VAL A 22 1.919 -22.253 83.502 1.00 0.00 O ATOM 346 CB VAL A 22 2.434 -19.398 84.795 1.00 0.00 C ATOM 347 CG1 VAL A 22 3.714 -20.178 84.476 1.00 0.00 C ATOM 348 CG2 VAL A 22 2.573 -17.962 84.287 1.00 0.00 C ATOM 0 H VAL A 22 0.129 -18.940 85.565 1.00 0.00 H new ATOM 0 HA VAL A 22 1.261 -19.811 83.037 1.00 0.00 H new ATOM 0 HB VAL A 22 2.284 -19.411 85.875 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.561 -19.708 84.977 1.00 0.00 H new ATOM 0 HG12 VAL A 22 3.611 -21.205 84.825 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.882 -20.176 83.399 1.00 0.00 H new ATOM 0 HG21 VAL A 22 3.428 -17.487 84.768 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.723 -17.971 83.207 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.667 -17.403 84.523 1.00 0.00 H new ATOM 358 N ALA A 23 0.525 -22.102 85.191 1.00 0.00 N ATOM 359 CA ALA A 23 0.507 -23.581 85.355 1.00 0.00 C ATOM 360 C ALA A 23 -0.100 -24.203 84.097 1.00 0.00 C ATOM 361 O ALA A 23 0.069 -25.375 83.828 1.00 0.00 O ATOM 362 CB ALA A 23 -0.345 -23.963 86.570 1.00 0.00 C ATOM 0 H ALA A 23 -0.054 -21.583 85.851 1.00 0.00 H new ATOM 0 HA ALA A 23 1.523 -23.946 85.506 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.353 -25.047 86.683 1.00 0.00 H new ATOM 0 HB2 ALA A 23 0.076 -23.508 87.467 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.365 -23.606 86.426 1.00 0.00 H new ATOM 368 N LYS A 24 -0.808 -23.422 83.325 1.00 0.00 N ATOM 369 CA LYS A 24 -1.429 -23.958 82.086 1.00 0.00 C ATOM 370 C LYS A 24 -0.343 -24.480 81.148 1.00 0.00 C ATOM 371 O LYS A 24 -0.166 -25.672 80.994 1.00 0.00 O ATOM 372 CB LYS A 24 -2.219 -22.849 81.389 1.00 0.00 C ATOM 373 CG LYS A 24 -3.618 -22.762 82.003 1.00 0.00 C ATOM 374 CD LYS A 24 -4.187 -21.353 81.804 1.00 0.00 C ATOM 375 CE LYS A 24 -4.344 -21.066 80.309 1.00 0.00 C ATOM 376 NZ LYS A 24 -5.202 -19.864 80.124 1.00 0.00 N ATOM 0 H LYS A 24 -0.982 -22.433 83.503 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.102 -24.775 82.345 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.702 -21.895 81.497 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -2.290 -23.054 80.321 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.275 -23.498 81.539 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.574 -22.999 83.066 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.152 -21.266 82.304 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.525 -20.616 82.258 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.367 -20.903 79.854 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.789 -21.925 79.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.310 -19.667 79.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.137 -20.037 80.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -4.759 -19.046 80.590 1.00 0.00 H new ATOM 390 N GLY A 25 0.382 -23.601 80.508 1.00 0.00 N ATOM 391 CA GLY A 25 1.444 -24.070 79.576 1.00 0.00 C ATOM 392 C GLY A 25 2.477 -22.970 79.314 1.00 0.00 C ATOM 393 O GLY A 25 2.437 -22.287 78.310 1.00 0.00 O ATOM 0 H GLY A 25 0.285 -22.589 80.590 1.00 0.00 H new ATOM 0 HA2 GLY A 25 1.940 -24.945 79.996 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.993 -24.381 78.634 1.00 0.00 H new ATOM 397 N GLU A 26 3.412 -22.825 80.204 1.00 0.00 N ATOM 398 CA GLU A 26 4.494 -21.806 80.039 1.00 0.00 C ATOM 399 C GLU A 26 3.996 -20.562 79.288 1.00 0.00 C ATOM 400 O GLU A 26 4.152 -20.443 78.089 1.00 0.00 O ATOM 401 CB GLU A 26 5.677 -22.423 79.286 1.00 0.00 C ATOM 402 CG GLU A 26 5.166 -23.313 78.153 1.00 0.00 C ATOM 403 CD GLU A 26 6.352 -23.818 77.328 1.00 0.00 C ATOM 404 OE1 GLU A 26 7.238 -23.025 77.052 1.00 0.00 O ATOM 405 OE2 GLU A 26 6.352 -24.988 76.981 1.00 0.00 O ATOM 0 H GLU A 26 3.478 -23.378 81.058 1.00 0.00 H new ATOM 0 HA GLU A 26 4.809 -21.492 81.034 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.313 -21.635 78.883 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.290 -23.008 79.971 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.608 -24.156 78.561 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.479 -22.753 77.518 1.00 0.00 H new ATOM 412 N ASP A 27 3.437 -19.622 79.997 1.00 0.00 N ATOM 413 CA ASP A 27 2.967 -18.357 79.358 1.00 0.00 C ATOM 414 C ASP A 27 3.624 -17.202 80.110 1.00 0.00 C ATOM 415 O ASP A 27 2.974 -16.270 80.538 1.00 0.00 O ATOM 416 CB ASP A 27 1.443 -18.248 79.469 1.00 0.00 C ATOM 417 CG ASP A 27 0.800 -19.534 78.947 1.00 0.00 C ATOM 418 OD1 ASP A 27 1.185 -19.972 77.875 1.00 0.00 O ATOM 419 OD2 ASP A 27 -0.065 -20.058 79.629 1.00 0.00 O ATOM 0 H ASP A 27 3.283 -19.675 81.004 1.00 0.00 H new ATOM 0 HA ASP A 27 3.233 -18.336 78.301 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.154 -18.080 80.507 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.086 -17.392 78.896 1.00 0.00 H new ATOM 424 N VAL A 28 4.911 -17.291 80.306 1.00 0.00 N ATOM 425 CA VAL A 28 5.634 -16.239 81.072 1.00 0.00 C ATOM 426 C VAL A 28 6.443 -15.344 80.131 1.00 0.00 C ATOM 427 O VAL A 28 7.648 -15.250 80.225 1.00 0.00 O ATOM 428 CB VAL A 28 6.555 -16.937 82.073 1.00 0.00 C ATOM 429 CG1 VAL A 28 5.704 -17.845 82.963 1.00 0.00 C ATOM 430 CG2 VAL A 28 7.586 -17.795 81.325 1.00 0.00 C ATOM 0 H VAL A 28 5.496 -18.054 79.965 1.00 0.00 H new ATOM 0 HA VAL A 28 4.922 -15.601 81.596 1.00 0.00 H new ATOM 0 HB VAL A 28 7.077 -16.192 82.673 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.345 -18.352 83.684 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.965 -17.245 83.493 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.195 -18.586 82.346 1.00 0.00 H new ATOM 0 HG21 VAL A 28 8.239 -18.289 82.045 1.00 0.00 H new ATOM 0 HG22 VAL A 28 7.069 -18.546 80.728 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.183 -17.159 80.671 1.00 0.00 H new ATOM 440 N ASN A 29 5.779 -14.673 79.231 1.00 0.00 N ATOM 441 CA ASN A 29 6.479 -13.774 78.289 1.00 0.00 C ATOM 442 C ASN A 29 5.426 -13.047 77.453 1.00 0.00 C ATOM 443 O ASN A 29 5.609 -12.796 76.277 1.00 0.00 O ATOM 444 CB ASN A 29 7.384 -14.594 77.379 1.00 0.00 C ATOM 445 CG ASN A 29 6.664 -15.874 76.965 1.00 0.00 C ATOM 446 OD1 ASN A 29 6.706 -16.916 77.747 1.00 0.00 O flip ATOM 447 ND2 ASN A 29 6.051 -15.927 75.916 1.00 0.00 N flip ATOM 0 H ASN A 29 4.767 -14.714 79.112 1.00 0.00 H new ATOM 0 HA ASN A 29 7.089 -13.054 78.834 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.652 -14.013 76.496 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.313 -14.837 77.895 1.00 0.00 H new ATOM 0 HD21 ASN A 29 6.017 -15.112 75.303 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.570 -16.786 75.649 1.00 0.00 H new ATOM 454 N ARG A 30 4.319 -12.714 78.062 1.00 0.00 N ATOM 455 CA ARG A 30 3.231 -12.006 77.336 1.00 0.00 C ATOM 456 C ARG A 30 3.162 -10.562 77.830 1.00 0.00 C ATOM 457 O ARG A 30 3.443 -10.281 78.980 1.00 0.00 O ATOM 458 CB ARG A 30 1.898 -12.704 77.627 1.00 0.00 C ATOM 459 CG ARG A 30 2.048 -14.214 77.399 1.00 0.00 C ATOM 460 CD ARG A 30 0.729 -14.796 76.886 1.00 0.00 C ATOM 461 NE ARG A 30 -0.421 -14.041 77.477 1.00 0.00 N ATOM 462 CZ ARG A 30 -0.517 -13.862 78.765 1.00 0.00 C ATOM 463 NH1 ARG A 30 0.279 -14.502 79.579 1.00 0.00 N ATOM 464 NH2 ARG A 30 -1.447 -13.081 79.244 1.00 0.00 N ATOM 0 H ARG A 30 4.123 -12.906 79.044 1.00 0.00 H new ATOM 0 HA ARG A 30 3.427 -12.021 76.264 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.591 -12.510 78.655 1.00 0.00 H new ATOM 0 HB3 ARG A 30 1.117 -12.304 76.980 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.844 -14.405 76.679 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.335 -14.704 78.329 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.694 -14.738 75.798 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.658 -15.851 77.151 1.00 0.00 H new ATOM 0 HE ARG A 30 -1.141 -13.661 76.862 1.00 0.00 H new ATOM 0 HH11 ARG A 30 0.979 -15.144 79.208 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.201 -14.359 80.586 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -2.096 -12.613 78.611 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -1.525 -12.939 80.251 1.00 0.00 H new ATOM 478 N THR A 31 2.776 -9.641 76.993 1.00 0.00 N ATOM 479 CA THR A 31 2.675 -8.233 77.464 1.00 0.00 C ATOM 480 C THR A 31 1.680 -8.196 78.624 1.00 0.00 C ATOM 481 O THR A 31 0.579 -8.701 78.526 1.00 0.00 O ATOM 482 CB THR A 31 2.197 -7.315 76.333 1.00 0.00 C ATOM 483 OG1 THR A 31 2.814 -7.705 75.114 1.00 0.00 O ATOM 484 CG2 THR A 31 2.584 -5.871 76.659 1.00 0.00 C ATOM 0 H THR A 31 2.529 -9.799 76.016 1.00 0.00 H new ATOM 0 HA THR A 31 3.654 -7.879 77.787 1.00 0.00 H new ATOM 0 HB THR A 31 1.114 -7.391 76.232 1.00 0.00 H new ATOM 0 HG1 THR A 31 2.507 -7.120 74.390 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.246 -5.214 75.858 1.00 0.00 H new ATOM 0 HG22 THR A 31 2.115 -5.571 77.596 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.667 -5.798 76.756 1.00 0.00 H new ATOM 492 N LEU A 32 2.068 -7.622 79.726 1.00 0.00 N ATOM 493 CA LEU A 32 1.160 -7.572 80.906 1.00 0.00 C ATOM 494 C LEU A 32 0.056 -6.537 80.680 1.00 0.00 C ATOM 495 O LEU A 32 -1.019 -6.851 80.208 1.00 0.00 O ATOM 496 CB LEU A 32 1.986 -7.195 82.144 1.00 0.00 C ATOM 497 CG LEU A 32 1.148 -7.353 83.422 1.00 0.00 C ATOM 498 CD1 LEU A 32 2.084 -7.527 84.622 1.00 0.00 C ATOM 499 CD2 LEU A 32 0.283 -6.104 83.636 1.00 0.00 C ATOM 0 H LEU A 32 2.979 -7.183 79.862 1.00 0.00 H new ATOM 0 HA LEU A 32 0.693 -8.546 81.052 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.872 -7.827 82.203 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.334 -6.166 82.056 1.00 0.00 H new ATOM 0 HG LEU A 32 0.504 -8.226 83.323 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.493 -7.639 85.531 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.700 -8.415 84.477 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.726 -6.651 84.713 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.309 -6.222 84.544 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.925 -5.229 83.733 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.383 -5.972 82.783 1.00 0.00 H new ATOM 511 N GLU A 33 0.312 -5.312 81.035 1.00 0.00 N ATOM 512 CA GLU A 33 -0.714 -4.245 80.872 1.00 0.00 C ATOM 513 C GLU A 33 -0.836 -3.850 79.393 1.00 0.00 C ATOM 514 O GLU A 33 -1.840 -4.110 78.759 1.00 0.00 O ATOM 515 CB GLU A 33 -0.291 -3.046 81.729 1.00 0.00 C ATOM 516 CG GLU A 33 -0.953 -1.760 81.233 1.00 0.00 C ATOM 517 CD GLU A 33 -2.461 -1.974 81.089 1.00 0.00 C ATOM 518 OE1 GLU A 33 -3.044 -2.573 81.976 1.00 0.00 O ATOM 519 OE2 GLU A 33 -3.006 -1.525 80.094 1.00 0.00 O ATOM 0 H GLU A 33 1.197 -5.000 81.435 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.691 -4.601 81.197 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.565 -3.223 82.769 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.793 -2.937 81.699 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.757 -0.947 81.932 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.525 -1.467 80.274 1.00 0.00 H new ATOM 526 N GLY A 34 0.167 -3.230 78.834 1.00 0.00 N ATOM 527 CA GLY A 34 0.085 -2.834 77.395 1.00 0.00 C ATOM 528 C GLY A 34 1.485 -2.855 76.786 1.00 0.00 C ATOM 529 O GLY A 34 1.654 -2.874 75.585 1.00 0.00 O ATOM 0 H GLY A 34 1.036 -2.981 79.306 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.570 -3.518 76.854 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.349 -1.838 77.304 1.00 0.00 H new ATOM 533 N GLY A 35 2.489 -2.856 77.614 1.00 0.00 N ATOM 534 CA GLY A 35 3.888 -2.880 77.098 1.00 0.00 C ATOM 535 C GLY A 35 4.820 -3.466 78.162 1.00 0.00 C ATOM 536 O GLY A 35 6.022 -3.494 77.995 1.00 0.00 O ATOM 0 H GLY A 35 2.403 -2.841 78.630 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.940 -3.476 76.187 1.00 0.00 H new ATOM 0 HA3 GLY A 35 4.207 -1.871 76.837 1.00 0.00 H new ATOM 540 N ARG A 36 4.275 -3.929 79.258 1.00 0.00 N ATOM 541 CA ARG A 36 5.135 -4.503 80.339 1.00 0.00 C ATOM 542 C ARG A 36 5.004 -6.037 80.370 1.00 0.00 C ATOM 543 O ARG A 36 4.257 -6.622 79.615 1.00 0.00 O ATOM 544 CB ARG A 36 4.707 -3.910 81.688 1.00 0.00 C ATOM 545 CG ARG A 36 4.200 -2.474 81.482 1.00 0.00 C ATOM 546 CD ARG A 36 4.226 -1.713 82.813 1.00 0.00 C ATOM 547 NE ARG A 36 2.955 -0.939 82.968 1.00 0.00 N ATOM 548 CZ ARG A 36 2.491 -0.208 81.986 1.00 0.00 C ATOM 549 NH1 ARG A 36 3.214 -0.015 80.916 1.00 0.00 N ATOM 550 NH2 ARG A 36 1.322 0.364 82.092 1.00 0.00 N ATOM 0 H ARG A 36 3.274 -3.935 79.452 1.00 0.00 H new ATOM 0 HA ARG A 36 6.177 -4.252 80.143 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.923 -4.523 82.134 1.00 0.00 H new ATOM 0 HB3 ARG A 36 5.548 -3.914 82.382 1.00 0.00 H new ATOM 0 HG2 ARG A 36 4.822 -1.962 80.748 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.186 -2.491 81.083 1.00 0.00 H new ATOM 0 HD2 ARG A 36 4.343 -2.411 83.642 1.00 0.00 H new ATOM 0 HD3 ARG A 36 5.081 -1.038 82.842 1.00 0.00 H new ATOM 0 HE ARG A 36 2.444 -0.981 83.850 1.00 0.00 H new ATOM 0 HH11 ARG A 36 4.141 -0.434 80.845 1.00 0.00 H new ATOM 0 HH12 ARG A 36 2.852 0.555 80.151 1.00 0.00 H new ATOM 0 HH21 ARG A 36 0.769 0.242 82.941 1.00 0.00 H new ATOM 0 HH22 ARG A 36 0.961 0.933 81.326 1.00 0.00 H new ATOM 564 N LYS A 37 5.744 -6.684 81.237 1.00 0.00 N ATOM 565 CA LYS A 37 5.697 -8.176 81.339 1.00 0.00 C ATOM 566 C LYS A 37 5.434 -8.552 82.817 1.00 0.00 C ATOM 567 O LYS A 37 5.317 -7.666 83.640 1.00 0.00 O ATOM 568 CB LYS A 37 7.038 -8.729 80.829 1.00 0.00 C ATOM 569 CG LYS A 37 8.089 -8.735 81.946 1.00 0.00 C ATOM 570 CD LYS A 37 8.281 -7.321 82.524 1.00 0.00 C ATOM 571 CE LYS A 37 8.753 -6.350 81.435 1.00 0.00 C ATOM 572 NZ LYS A 37 9.713 -7.030 80.521 1.00 0.00 N ATOM 0 H LYS A 37 6.388 -6.234 81.888 1.00 0.00 H new ATOM 0 HA LYS A 37 4.898 -8.606 80.734 1.00 0.00 H new ATOM 0 HB2 LYS A 37 6.898 -9.742 80.451 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.392 -8.123 79.995 1.00 0.00 H new ATOM 0 HG2 LYS A 37 7.781 -9.418 82.738 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.037 -9.106 81.557 1.00 0.00 H new ATOM 0 HD2 LYS A 37 7.343 -6.967 82.952 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.010 -7.350 83.334 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.897 -5.984 80.868 1.00 0.00 H new ATOM 0 HE3 LYS A 37 9.228 -5.482 81.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.456 -6.360 80.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.145 -7.839 81.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.209 -7.366 79.676 1.00 0.00 H new ATOM 586 N PRO A 38 5.306 -9.828 83.132 1.00 0.00 N ATOM 587 CA PRO A 38 5.006 -10.260 84.518 1.00 0.00 C ATOM 588 C PRO A 38 6.291 -10.398 85.364 1.00 0.00 C ATOM 589 O PRO A 38 6.361 -11.225 86.249 1.00 0.00 O ATOM 590 CB PRO A 38 4.356 -11.632 84.332 1.00 0.00 C ATOM 591 CG PRO A 38 4.760 -12.137 82.917 1.00 0.00 C ATOM 592 CD PRO A 38 5.407 -10.948 82.172 1.00 0.00 C ATOM 0 HA PRO A 38 4.377 -9.542 85.044 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.694 -12.327 85.101 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.272 -11.561 84.421 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.459 -12.970 82.991 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.887 -12.501 82.375 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.444 -11.157 81.910 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.882 -10.726 81.243 1.00 0.00 H new ATOM 600 N LEU A 39 7.299 -9.610 85.102 1.00 0.00 N ATOM 601 CA LEU A 39 8.575 -9.719 85.890 1.00 0.00 C ATOM 602 C LEU A 39 8.887 -8.365 86.533 1.00 0.00 C ATOM 603 O LEU A 39 9.648 -8.268 87.472 1.00 0.00 O ATOM 604 CB LEU A 39 9.716 -10.124 84.934 1.00 0.00 C ATOM 605 CG LEU A 39 11.039 -10.483 85.668 1.00 0.00 C ATOM 606 CD1 LEU A 39 10.792 -11.079 87.060 1.00 0.00 C ATOM 607 CD2 LEU A 39 11.800 -11.513 84.818 1.00 0.00 C ATOM 0 H LEU A 39 7.300 -8.893 84.377 1.00 0.00 H new ATOM 0 HA LEU A 39 8.472 -10.470 86.673 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.395 -10.980 84.340 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.905 -9.306 84.239 1.00 0.00 H new ATOM 0 HG LEU A 39 11.612 -9.565 85.799 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.747 -11.312 87.531 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.252 -10.358 87.674 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.201 -11.990 86.966 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.732 -11.778 85.316 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.188 -12.406 84.694 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.020 -11.086 83.840 1.00 0.00 H new ATOM 619 N HIS A 40 8.290 -7.322 86.033 1.00 0.00 N ATOM 620 CA HIS A 40 8.537 -5.970 86.609 1.00 0.00 C ATOM 621 C HIS A 40 7.763 -5.854 87.925 1.00 0.00 C ATOM 622 O HIS A 40 8.294 -5.430 88.930 1.00 0.00 O ATOM 623 CB HIS A 40 8.060 -4.907 85.614 1.00 0.00 C ATOM 624 CG HIS A 40 8.022 -3.558 86.275 1.00 0.00 C ATOM 625 ND1 HIS A 40 7.023 -3.201 87.165 1.00 0.00 N ATOM 626 CD2 HIS A 40 8.843 -2.463 86.172 1.00 0.00 C ATOM 627 CE1 HIS A 40 7.266 -1.937 87.559 1.00 0.00 C ATOM 628 NE2 HIS A 40 8.364 -1.440 86.983 1.00 0.00 N ATOM 0 H HIS A 40 7.639 -7.346 85.248 1.00 0.00 H new ATOM 0 HA HIS A 40 9.600 -5.821 86.800 1.00 0.00 H new ATOM 0 HB2 HIS A 40 8.727 -4.879 84.752 1.00 0.00 H new ATOM 0 HB3 HIS A 40 7.069 -5.166 85.241 1.00 0.00 H new ATOM 0 HD2 HIS A 40 9.727 -2.405 85.555 1.00 0.00 H new ATOM 0 HE1 HIS A 40 6.648 -1.391 88.256 1.00 0.00 H new ATOM 0 HE2 HIS A 40 8.765 -0.511 87.111 1.00 0.00 H new ATOM 636 N TYR A 41 6.520 -6.258 87.938 1.00 0.00 N ATOM 637 CA TYR A 41 5.728 -6.199 89.201 1.00 0.00 C ATOM 638 C TYR A 41 6.291 -7.233 90.164 1.00 0.00 C ATOM 639 O TYR A 41 6.376 -7.018 91.357 1.00 0.00 O ATOM 640 CB TYR A 41 4.267 -6.523 88.909 1.00 0.00 C ATOM 641 CG TYR A 41 3.762 -5.564 87.868 1.00 0.00 C ATOM 642 CD1 TYR A 41 4.103 -5.750 86.524 1.00 0.00 C ATOM 643 CD2 TYR A 41 2.969 -4.477 88.246 1.00 0.00 C ATOM 644 CE1 TYR A 41 3.650 -4.848 85.557 1.00 0.00 C ATOM 645 CE2 TYR A 41 2.513 -3.577 87.279 1.00 0.00 C ATOM 646 CZ TYR A 41 2.855 -3.762 85.934 1.00 0.00 C ATOM 647 OH TYR A 41 2.410 -2.872 84.979 1.00 0.00 O ATOM 0 H TYR A 41 6.020 -6.626 87.129 1.00 0.00 H new ATOM 0 HA TYR A 41 5.789 -5.201 89.635 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.170 -7.550 88.556 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.672 -6.441 89.819 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.716 -6.590 86.234 1.00 0.00 H new ATOM 0 HD2 TYR A 41 2.709 -4.333 89.284 1.00 0.00 H new ATOM 0 HE1 TYR A 41 3.914 -4.990 84.519 1.00 0.00 H new ATOM 0 HE2 TYR A 41 1.897 -2.739 87.569 1.00 0.00 H new ATOM 0 HH TYR A 41 1.869 -2.176 85.407 1.00 0.00 H new ATOM 657 N ALA A 42 6.707 -8.350 89.645 1.00 0.00 N ATOM 658 CA ALA A 42 7.300 -9.386 90.518 1.00 0.00 C ATOM 659 C ALA A 42 8.624 -8.837 91.023 1.00 0.00 C ATOM 660 O ALA A 42 8.846 -8.692 92.201 1.00 0.00 O ATOM 661 CB ALA A 42 7.547 -10.656 89.701 1.00 0.00 C ATOM 0 H ALA A 42 6.661 -8.588 88.654 1.00 0.00 H new ATOM 0 HA ALA A 42 6.637 -9.629 91.349 1.00 0.00 H new ATOM 0 HB1 ALA A 42 7.984 -11.422 90.342 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.602 -11.018 89.296 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.231 -10.434 88.882 1.00 0.00 H new ATOM 667 N ALA A 43 9.499 -8.507 90.127 1.00 0.00 N ATOM 668 CA ALA A 43 10.806 -7.942 90.535 1.00 0.00 C ATOM 669 C ALA A 43 10.568 -6.789 91.519 1.00 0.00 C ATOM 670 O ALA A 43 10.963 -6.844 92.664 1.00 0.00 O ATOM 671 CB ALA A 43 11.503 -7.395 89.288 1.00 0.00 C ATOM 0 H ALA A 43 9.365 -8.605 89.121 1.00 0.00 H new ATOM 0 HA ALA A 43 11.419 -8.709 91.009 1.00 0.00 H new ATOM 0 HB1 ALA A 43 12.469 -6.974 89.566 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.652 -8.202 88.571 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.885 -6.619 88.837 1.00 0.00 H new ATOM 677 N ASP A 44 9.934 -5.742 91.064 1.00 0.00 N ATOM 678 CA ASP A 44 9.675 -4.554 91.936 1.00 0.00 C ATOM 679 C ASP A 44 8.827 -4.902 93.171 1.00 0.00 C ATOM 680 O ASP A 44 8.873 -4.210 94.168 1.00 0.00 O ATOM 681 CB ASP A 44 8.964 -3.483 91.113 1.00 0.00 C ATOM 682 CG ASP A 44 9.918 -2.962 90.038 1.00 0.00 C ATOM 683 OD1 ASP A 44 11.068 -3.370 90.051 1.00 0.00 O ATOM 684 OD2 ASP A 44 9.485 -2.167 89.220 1.00 0.00 O ATOM 0 H ASP A 44 9.579 -5.656 90.112 1.00 0.00 H new ATOM 0 HA ASP A 44 10.636 -4.191 92.299 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.068 -3.897 90.651 1.00 0.00 H new ATOM 0 HB3 ASP A 44 8.642 -2.665 91.758 1.00 0.00 H new ATOM 689 N CYS A 45 8.050 -5.947 93.127 1.00 0.00 N ATOM 690 CA CYS A 45 7.215 -6.292 94.318 1.00 0.00 C ATOM 691 C CYS A 45 6.699 -7.721 94.180 1.00 0.00 C ATOM 692 O CYS A 45 5.512 -7.964 94.092 1.00 0.00 O ATOM 693 CB CYS A 45 6.027 -5.330 94.418 1.00 0.00 C ATOM 694 SG CYS A 45 5.687 -4.600 92.796 1.00 0.00 S ATOM 0 H CYS A 45 7.955 -6.574 92.328 1.00 0.00 H new ATOM 0 HA CYS A 45 7.823 -6.207 95.218 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.147 -5.862 94.779 1.00 0.00 H new ATOM 0 HB3 CYS A 45 6.244 -4.544 95.142 1.00 0.00 H new ATOM 0 HG CYS A 45 5.728 -5.527 91.886 1.00 0.00 H new ATOM 700 N GLY A 46 7.592 -8.666 94.156 1.00 0.00 N ATOM 701 CA GLY A 46 7.177 -10.093 94.020 1.00 0.00 C ATOM 702 C GLY A 46 7.529 -10.858 95.295 1.00 0.00 C ATOM 703 O GLY A 46 7.692 -12.062 95.276 1.00 0.00 O ATOM 0 H GLY A 46 8.598 -8.514 94.225 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.105 -10.153 93.833 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.676 -10.546 93.163 1.00 0.00 H new ATOM 707 N GLN A 47 7.689 -10.176 96.399 1.00 0.00 N ATOM 708 CA GLN A 47 8.076 -10.890 97.643 1.00 0.00 C ATOM 709 C GLN A 47 9.331 -11.691 97.306 1.00 0.00 C ATOM 710 O GLN A 47 9.752 -12.587 98.014 1.00 0.00 O ATOM 711 CB GLN A 47 6.929 -11.798 98.102 1.00 0.00 C ATOM 712 CG GLN A 47 5.905 -10.954 98.870 1.00 0.00 C ATOM 713 CD GLN A 47 5.518 -9.724 98.042 1.00 0.00 C ATOM 714 OE1 GLN A 47 5.169 -9.875 96.794 1.00 0.00 O flip ATOM 715 NE2 GLN A 47 5.533 -8.614 98.537 1.00 0.00 N flip ATOM 0 H GLN A 47 7.569 -9.167 96.490 1.00 0.00 H new ATOM 0 HA GLN A 47 8.278 -10.202 98.464 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.457 -12.273 97.242 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.312 -12.597 98.737 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.019 -11.550 99.088 1.00 0.00 H new ATOM 0 HG3 GLN A 47 6.322 -10.642 99.827 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.806 -8.494 99.513 1.00 0.00 H new ATOM 0 HE22 GLN A 47 5.273 -7.802 97.977 1.00 0.00 H new ATOM 724 N LEU A 48 9.931 -11.316 96.204 1.00 0.00 N ATOM 725 CA LEU A 48 11.189 -11.950 95.708 1.00 0.00 C ATOM 726 C LEU A 48 10.995 -13.440 95.405 1.00 0.00 C ATOM 727 O LEU A 48 11.923 -14.131 95.034 1.00 0.00 O ATOM 728 CB LEU A 48 12.292 -11.759 96.744 1.00 0.00 C ATOM 729 CG LEU A 48 12.830 -10.302 96.753 1.00 0.00 C ATOM 730 CD1 LEU A 48 12.151 -9.414 95.703 1.00 0.00 C ATOM 731 CD2 LEU A 48 12.612 -9.681 98.135 1.00 0.00 C ATOM 0 H LEU A 48 9.585 -10.566 95.606 1.00 0.00 H new ATOM 0 HA LEU A 48 11.471 -11.465 94.774 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.909 -12.011 97.733 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.111 -12.447 96.534 1.00 0.00 H new ATOM 0 HG LEU A 48 13.891 -10.355 96.511 1.00 0.00 H new ATOM 0 HD11 LEU A 48 12.566 -8.407 95.755 1.00 0.00 H new ATOM 0 HD12 LEU A 48 12.325 -9.828 94.710 1.00 0.00 H new ATOM 0 HD13 LEU A 48 11.079 -9.375 95.898 1.00 0.00 H new ATOM 0 HD21 LEU A 48 12.990 -8.659 98.138 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.547 -9.674 98.367 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.143 -10.267 98.885 1.00 0.00 H new ATOM 743 N GLU A 49 9.803 -13.923 95.528 1.00 0.00 N ATOM 744 CA GLU A 49 9.526 -15.356 95.205 1.00 0.00 C ATOM 745 C GLU A 49 8.881 -15.417 93.823 1.00 0.00 C ATOM 746 O GLU A 49 9.132 -16.307 93.035 1.00 0.00 O ATOM 747 CB GLU A 49 8.566 -15.960 96.234 1.00 0.00 C ATOM 748 CG GLU A 49 7.619 -14.872 96.731 1.00 0.00 C ATOM 749 CD GLU A 49 6.523 -15.500 97.592 1.00 0.00 C ATOM 750 OE1 GLU A 49 6.818 -16.459 98.284 1.00 0.00 O ATOM 751 OE2 GLU A 49 5.407 -15.011 97.542 1.00 0.00 O ATOM 0 H GLU A 49 8.993 -13.389 95.841 1.00 0.00 H new ATOM 0 HA GLU A 49 10.458 -15.921 95.224 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.999 -16.776 95.786 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.126 -16.381 97.069 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.171 -14.132 97.310 1.00 0.00 H new ATOM 0 HG3 GLU A 49 7.175 -14.348 95.885 1.00 0.00 H new ATOM 758 N ILE A 50 8.024 -14.472 93.548 1.00 0.00 N ATOM 759 CA ILE A 50 7.317 -14.449 92.241 1.00 0.00 C ATOM 760 C ILE A 50 8.305 -14.261 91.087 1.00 0.00 C ATOM 761 O ILE A 50 8.201 -14.922 90.077 1.00 0.00 O ATOM 762 CB ILE A 50 6.284 -13.317 92.234 1.00 0.00 C ATOM 763 CG1 ILE A 50 5.409 -13.435 93.511 1.00 0.00 C ATOM 764 CG2 ILE A 50 5.451 -13.406 90.946 1.00 0.00 C ATOM 765 CD1 ILE A 50 3.914 -13.292 93.210 1.00 0.00 C ATOM 0 H ILE A 50 7.783 -13.709 94.180 1.00 0.00 H new ATOM 0 HA ILE A 50 6.812 -15.405 92.104 1.00 0.00 H new ATOM 0 HB ILE A 50 6.767 -12.340 92.247 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.591 -14.400 93.985 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.708 -12.668 94.225 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.713 -12.604 90.934 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.107 -13.309 90.081 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.941 -14.368 90.908 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.346 -13.382 94.136 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.725 -12.317 92.762 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.606 -14.075 92.518 1.00 0.00 H new ATOM 777 N LEU A 51 9.261 -13.378 91.195 1.00 0.00 N ATOM 778 CA LEU A 51 10.198 -13.210 90.048 1.00 0.00 C ATOM 779 C LEU A 51 10.822 -14.571 89.715 1.00 0.00 C ATOM 780 O LEU A 51 10.742 -15.041 88.599 1.00 0.00 O ATOM 781 CB LEU A 51 11.320 -12.166 90.297 1.00 0.00 C ATOM 782 CG LEU A 51 11.552 -11.807 91.779 1.00 0.00 C ATOM 783 CD1 LEU A 51 10.289 -11.221 92.420 1.00 0.00 C ATOM 784 CD2 LEU A 51 12.028 -13.041 92.551 1.00 0.00 C ATOM 0 H LEU A 51 9.432 -12.781 92.004 1.00 0.00 H new ATOM 0 HA LEU A 51 9.611 -12.826 89.213 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.252 -12.548 89.880 1.00 0.00 H new ATOM 0 HB3 LEU A 51 11.077 -11.255 89.751 1.00 0.00 H new ATOM 0 HG LEU A 51 12.326 -11.041 91.824 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.489 -10.980 93.464 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.997 -10.316 91.888 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.481 -11.950 92.365 1.00 0.00 H new ATOM 0 HD21 LEU A 51 12.189 -12.777 93.596 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.273 -13.824 92.487 1.00 0.00 H new ATOM 0 HD23 LEU A 51 12.962 -13.402 92.120 1.00 0.00 H new ATOM 796 N GLU A 52 11.439 -15.208 90.663 1.00 0.00 N ATOM 797 CA GLU A 52 12.061 -16.534 90.387 1.00 0.00 C ATOM 798 C GLU A 52 11.041 -17.470 89.709 1.00 0.00 C ATOM 799 O GLU A 52 11.410 -18.344 88.954 1.00 0.00 O ATOM 800 CB GLU A 52 12.537 -17.154 91.712 1.00 0.00 C ATOM 801 CG GLU A 52 14.069 -17.078 91.807 1.00 0.00 C ATOM 802 CD GLU A 52 14.698 -18.229 91.014 1.00 0.00 C ATOM 803 OE1 GLU A 52 14.788 -18.110 89.803 1.00 0.00 O ATOM 804 OE2 GLU A 52 15.085 -19.206 91.633 1.00 0.00 O ATOM 0 H GLU A 52 11.542 -14.871 91.620 1.00 0.00 H new ATOM 0 HA GLU A 52 12.911 -16.401 89.717 1.00 0.00 H new ATOM 0 HB2 GLU A 52 12.086 -16.627 92.553 1.00 0.00 H new ATOM 0 HB3 GLU A 52 12.211 -18.192 91.775 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.419 -16.122 91.417 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.381 -17.130 92.850 1.00 0.00 H new ATOM 811 N PHE A 53 9.771 -17.315 89.991 1.00 0.00 N ATOM 812 CA PHE A 53 8.744 -18.218 89.379 1.00 0.00 C ATOM 813 C PHE A 53 8.625 -18.019 87.856 1.00 0.00 C ATOM 814 O PHE A 53 9.199 -18.756 87.082 1.00 0.00 O ATOM 815 CB PHE A 53 7.376 -17.968 90.014 1.00 0.00 C ATOM 816 CG PHE A 53 6.319 -18.719 89.230 1.00 0.00 C ATOM 817 CD1 PHE A 53 6.356 -20.117 89.163 1.00 0.00 C ATOM 818 CD2 PHE A 53 5.307 -18.015 88.564 1.00 0.00 C ATOM 819 CE1 PHE A 53 5.382 -20.812 88.433 1.00 0.00 C ATOM 820 CE2 PHE A 53 4.333 -18.710 87.835 1.00 0.00 C ATOM 821 CZ PHE A 53 4.371 -20.108 87.769 1.00 0.00 C ATOM 0 H PHE A 53 9.400 -16.602 90.619 1.00 0.00 H new ATOM 0 HA PHE A 53 9.071 -19.241 89.567 1.00 0.00 H new ATOM 0 HB2 PHE A 53 7.378 -18.298 91.053 1.00 0.00 H new ATOM 0 HB3 PHE A 53 7.153 -16.901 90.019 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.136 -20.661 89.675 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.278 -16.936 88.613 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.412 -21.890 88.383 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.552 -18.167 87.324 1.00 0.00 H new ATOM 0 HZ PHE A 53 3.620 -20.643 87.206 1.00 0.00 H new ATOM 831 N LEU A 54 7.833 -17.067 87.421 1.00 0.00 N ATOM 832 CA LEU A 54 7.630 -16.869 85.954 1.00 0.00 C ATOM 833 C LEU A 54 8.967 -16.692 85.232 1.00 0.00 C ATOM 834 O LEU A 54 9.034 -16.729 84.018 1.00 0.00 O ATOM 835 CB LEU A 54 6.685 -15.672 85.720 1.00 0.00 C ATOM 836 CG LEU A 54 7.372 -14.311 85.947 1.00 0.00 C ATOM 837 CD1 LEU A 54 8.139 -14.323 87.265 1.00 0.00 C ATOM 838 CD2 LEU A 54 8.327 -13.985 84.786 1.00 0.00 C ATOM 0 H LEU A 54 7.320 -16.420 88.020 1.00 0.00 H new ATOM 0 HA LEU A 54 7.164 -17.760 85.534 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.300 -15.713 84.701 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.828 -15.756 86.388 1.00 0.00 H new ATOM 0 HG LEU A 54 6.602 -13.540 85.990 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.620 -13.356 87.415 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.448 -14.516 88.086 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.897 -15.105 87.238 1.00 0.00 H new ATOM 0 HD21 LEU A 54 8.802 -13.020 84.965 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.092 -14.758 84.716 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.765 -13.945 83.853 1.00 0.00 H new ATOM 850 N LEU A 55 10.032 -16.534 85.959 1.00 0.00 N ATOM 851 CA LEU A 55 11.361 -16.385 85.304 1.00 0.00 C ATOM 852 C LEU A 55 12.010 -17.772 85.162 1.00 0.00 C ATOM 853 O LEU A 55 12.575 -18.094 84.137 1.00 0.00 O ATOM 854 CB LEU A 55 12.238 -15.469 86.165 1.00 0.00 C ATOM 855 CG LEU A 55 13.359 -14.834 85.332 1.00 0.00 C ATOM 856 CD1 LEU A 55 14.199 -13.939 86.248 1.00 0.00 C ATOM 857 CD2 LEU A 55 14.256 -15.922 84.734 1.00 0.00 C ATOM 0 H LEU A 55 10.043 -16.501 86.978 1.00 0.00 H new ATOM 0 HA LEU A 55 11.250 -15.944 84.313 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.624 -14.686 86.610 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.670 -16.041 86.986 1.00 0.00 H new ATOM 0 HG LEU A 55 12.923 -14.251 84.521 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.001 -13.479 85.671 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.567 -13.160 86.675 1.00 0.00 H new ATOM 0 HD13 LEU A 55 14.627 -14.540 87.051 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.047 -15.458 84.145 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.699 -16.511 85.537 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.661 -16.573 84.093 1.00 0.00 H new ATOM 869 N LEU A 56 11.922 -18.605 86.175 1.00 0.00 N ATOM 870 CA LEU A 56 12.533 -19.967 86.065 1.00 0.00 C ATOM 871 C LEU A 56 11.842 -20.729 84.934 1.00 0.00 C ATOM 872 O LEU A 56 12.461 -21.495 84.225 1.00 0.00 O ATOM 873 CB LEU A 56 12.440 -20.740 87.400 1.00 0.00 C ATOM 874 CG LEU A 56 11.055 -21.385 87.588 1.00 0.00 C ATOM 875 CD1 LEU A 56 11.051 -22.801 86.995 1.00 0.00 C ATOM 876 CD2 LEU A 56 10.745 -21.483 89.087 1.00 0.00 C ATOM 0 H LEU A 56 11.459 -18.403 87.061 1.00 0.00 H new ATOM 0 HA LEU A 56 13.594 -19.865 85.837 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.208 -21.513 87.428 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.641 -20.061 88.229 1.00 0.00 H new ATOM 0 HG LEU A 56 10.307 -20.774 87.083 1.00 0.00 H new ATOM 0 HD11 LEU A 56 10.067 -23.250 87.132 1.00 0.00 H new ATOM 0 HD12 LEU A 56 11.282 -22.750 85.931 1.00 0.00 H new ATOM 0 HD13 LEU A 56 11.801 -23.409 87.500 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.765 -21.939 89.227 1.00 0.00 H new ATOM 0 HD22 LEU A 56 11.503 -22.095 89.576 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.746 -20.485 89.525 1.00 0.00 H new ATOM 888 N LYS A 57 10.574 -20.495 84.733 1.00 0.00 N ATOM 889 CA LYS A 57 9.872 -21.177 83.615 1.00 0.00 C ATOM 890 C LYS A 57 10.477 -20.624 82.319 1.00 0.00 C ATOM 891 O LYS A 57 11.548 -21.024 81.913 1.00 0.00 O ATOM 892 CB LYS A 57 8.361 -20.884 83.687 1.00 0.00 C ATOM 893 CG LYS A 57 7.592 -21.808 82.725 1.00 0.00 C ATOM 894 CD LYS A 57 6.473 -22.539 83.483 1.00 0.00 C ATOM 895 CE LYS A 57 7.064 -23.678 84.320 1.00 0.00 C ATOM 896 NZ LYS A 57 7.264 -24.878 83.458 1.00 0.00 N ATOM 0 H LYS A 57 9.999 -19.865 85.292 1.00 0.00 H new ATOM 0 HA LYS A 57 9.994 -22.259 83.664 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.003 -21.030 84.706 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.173 -19.842 83.429 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.168 -21.224 81.908 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.274 -22.532 82.279 1.00 0.00 H new ATOM 0 HD2 LYS A 57 5.943 -21.839 84.129 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.744 -22.936 82.777 1.00 0.00 H new ATOM 0 HE2 LYS A 57 8.014 -23.368 84.756 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.397 -23.919 85.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 7.665 -25.651 84.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 6.350 -25.178 83.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 7.917 -24.644 82.683 1.00 0.00 H new ATOM 910 N GLY A 58 9.840 -19.672 81.699 1.00 0.00 N ATOM 911 CA GLY A 58 10.435 -19.064 80.479 1.00 0.00 C ATOM 912 C GLY A 58 11.538 -18.113 80.950 1.00 0.00 C ATOM 913 O GLY A 58 12.356 -18.476 81.769 1.00 0.00 O ATOM 0 H GLY A 58 8.938 -19.290 81.983 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.842 -19.833 79.823 1.00 0.00 H new ATOM 0 HA3 GLY A 58 9.679 -18.526 79.907 1.00 0.00 H new ATOM 917 N ALA A 59 11.566 -16.894 80.487 1.00 0.00 N ATOM 918 CA ALA A 59 12.622 -15.971 80.986 1.00 0.00 C ATOM 919 C ALA A 59 12.591 -14.634 80.243 1.00 0.00 C ATOM 920 O ALA A 59 13.403 -14.370 79.382 1.00 0.00 O ATOM 921 CB ALA A 59 14.002 -16.630 80.847 1.00 0.00 C ATOM 0 H ALA A 59 10.920 -16.504 79.801 1.00 0.00 H new ATOM 0 HA ALA A 59 12.427 -15.768 82.039 1.00 0.00 H new ATOM 0 HB1 ALA A 59 14.769 -15.948 81.214 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.026 -17.551 81.430 1.00 0.00 H new ATOM 0 HB3 ALA A 59 14.192 -16.859 79.798 1.00 0.00 H new ATOM 927 N ASP A 60 11.685 -13.766 80.612 1.00 0.00 N ATOM 928 CA ASP A 60 11.627 -12.424 79.986 1.00 0.00 C ATOM 929 C ASP A 60 12.743 -11.597 80.628 1.00 0.00 C ATOM 930 O ASP A 60 12.843 -10.395 80.469 1.00 0.00 O ATOM 931 CB ASP A 60 10.259 -11.801 80.275 1.00 0.00 C ATOM 932 CG ASP A 60 10.104 -10.506 79.482 1.00 0.00 C ATOM 933 OD1 ASP A 60 10.618 -9.496 79.933 1.00 0.00 O ATOM 934 OD2 ASP A 60 9.473 -10.544 78.439 1.00 0.00 O ATOM 0 H ASP A 60 10.979 -13.937 81.328 1.00 0.00 H new ATOM 0 HA ASP A 60 11.758 -12.468 78.905 1.00 0.00 H new ATOM 0 HB2 ASP A 60 9.467 -12.500 80.007 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.159 -11.600 81.342 1.00 0.00 H new ATOM 939 N ILE A 61 13.573 -12.282 81.370 1.00 0.00 N ATOM 940 CA ILE A 61 14.717 -11.651 82.090 1.00 0.00 C ATOM 941 C ILE A 61 15.608 -10.888 81.122 1.00 0.00 C ATOM 942 O ILE A 61 16.322 -9.983 81.500 1.00 0.00 O ATOM 943 CB ILE A 61 15.535 -12.781 82.707 1.00 0.00 C ATOM 944 CG1 ILE A 61 16.672 -12.213 83.558 1.00 0.00 C ATOM 945 CG2 ILE A 61 16.127 -13.618 81.570 1.00 0.00 C ATOM 946 CD1 ILE A 61 17.603 -13.355 83.983 1.00 0.00 C ATOM 0 H ILE A 61 13.501 -13.290 81.511 1.00 0.00 H new ATOM 0 HA ILE A 61 14.344 -10.955 82.841 1.00 0.00 H new ATOM 0 HB ILE A 61 14.895 -13.391 83.344 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.228 -11.466 82.991 1.00 0.00 H new ATOM 0 HG13 ILE A 61 16.268 -11.711 84.437 1.00 0.00 H new ATOM 0 HG21 ILE A 61 16.717 -14.434 81.988 1.00 0.00 H new ATOM 0 HG22 ILE A 61 15.321 -14.028 80.962 1.00 0.00 H new ATOM 0 HG23 ILE A 61 16.765 -12.989 80.949 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.415 -12.955 84.590 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.041 -14.085 84.565 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.016 -13.837 83.097 1.00 0.00 H new ATOM 958 N ASN A 62 15.595 -11.271 79.885 1.00 0.00 N ATOM 959 CA ASN A 62 16.469 -10.600 78.891 1.00 0.00 C ATOM 960 C ASN A 62 15.661 -10.210 77.646 1.00 0.00 C ATOM 961 O ASN A 62 15.793 -9.125 77.115 1.00 0.00 O ATOM 962 CB ASN A 62 17.602 -11.572 78.514 1.00 0.00 C ATOM 963 CG ASN A 62 17.042 -12.983 78.272 1.00 0.00 C ATOM 964 OD1 ASN A 62 15.762 -13.203 78.394 1.00 0.00 O flip ATOM 965 ND2 ASN A 62 17.782 -13.898 77.974 1.00 0.00 N flip ATOM 0 H ASN A 62 15.015 -12.024 79.515 1.00 0.00 H new ATOM 0 HA ASN A 62 16.887 -9.687 79.316 1.00 0.00 H new ATOM 0 HB2 ASN A 62 18.110 -11.217 77.617 1.00 0.00 H new ATOM 0 HB3 ASN A 62 18.345 -11.601 79.311 1.00 0.00 H new ATOM 0 HD21 ASN A 62 18.784 -13.733 77.877 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.402 -14.832 77.821 1.00 0.00 H new ATOM 972 N ALA A 63 14.817 -11.085 77.196 1.00 0.00 N ATOM 973 CA ALA A 63 13.965 -10.827 75.986 1.00 0.00 C ATOM 974 C ALA A 63 13.747 -9.323 75.672 1.00 0.00 C ATOM 975 O ALA A 63 14.016 -8.902 74.558 1.00 0.00 O ATOM 976 CB ALA A 63 12.616 -11.504 76.193 1.00 0.00 C ATOM 0 H ALA A 63 14.670 -12.000 77.622 1.00 0.00 H new ATOM 0 HA ALA A 63 14.498 -11.237 75.128 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.983 -11.327 75.323 1.00 0.00 H new ATOM 0 HB2 ALA A 63 12.763 -12.576 76.323 1.00 0.00 H new ATOM 0 HB3 ALA A 63 12.135 -11.094 77.081 1.00 0.00 H new ATOM 982 N PRO A 64 13.257 -8.555 76.621 1.00 0.00 N ATOM 983 CA PRO A 64 12.990 -7.118 76.449 1.00 0.00 C ATOM 984 C PRO A 64 13.613 -6.503 75.196 1.00 0.00 C ATOM 985 O PRO A 64 14.771 -6.688 74.881 1.00 0.00 O ATOM 986 CB PRO A 64 13.523 -6.554 77.764 1.00 0.00 C ATOM 987 CG PRO A 64 13.397 -7.728 78.791 1.00 0.00 C ATOM 988 CD PRO A 64 12.963 -8.975 77.985 1.00 0.00 C ATOM 0 HA PRO A 64 11.939 -6.889 76.272 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.558 -6.228 77.663 1.00 0.00 H new ATOM 0 HB3 PRO A 64 12.946 -5.687 78.084 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.347 -7.904 79.296 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.664 -7.491 79.563 1.00 0.00 H new ATOM 0 HD2 PRO A 64 13.525 -9.864 78.271 1.00 0.00 H new ATOM 0 HD3 PRO A 64 11.907 -9.207 78.124 1.00 0.00 H new ATOM 996 N ASP A 65 12.789 -5.770 74.490 1.00 0.00 N ATOM 997 CA ASP A 65 13.193 -5.090 73.230 1.00 0.00 C ATOM 998 C ASP A 65 12.529 -3.715 73.206 1.00 0.00 C ATOM 999 O ASP A 65 13.115 -2.723 72.828 1.00 0.00 O ATOM 1000 CB ASP A 65 12.675 -5.901 72.042 1.00 0.00 C ATOM 1001 CG ASP A 65 13.556 -7.129 71.831 1.00 0.00 C ATOM 1002 OD1 ASP A 65 14.721 -7.063 72.180 1.00 0.00 O ATOM 1003 OD2 ASP A 65 13.047 -8.118 71.327 1.00 0.00 O ATOM 0 H ASP A 65 11.815 -5.612 74.750 1.00 0.00 H new ATOM 0 HA ASP A 65 14.278 -5.000 73.174 1.00 0.00 H new ATOM 0 HB2 ASP A 65 11.645 -6.208 72.221 1.00 0.00 H new ATOM 0 HB3 ASP A 65 12.673 -5.285 71.143 1.00 0.00 H new ATOM 1008 N LYS A 66 11.290 -3.667 73.617 1.00 0.00 N ATOM 1009 CA LYS A 66 10.545 -2.392 73.642 1.00 0.00 C ATOM 1010 C LYS A 66 10.886 -1.650 74.935 1.00 0.00 C ATOM 1011 O LYS A 66 10.894 -0.437 74.987 1.00 0.00 O ATOM 1012 CB LYS A 66 9.060 -2.712 73.596 1.00 0.00 C ATOM 1013 CG LYS A 66 8.268 -1.427 73.429 1.00 0.00 C ATOM 1014 CD LYS A 66 8.486 -0.846 72.030 1.00 0.00 C ATOM 1015 CE LYS A 66 7.304 0.054 71.665 1.00 0.00 C ATOM 1016 NZ LYS A 66 7.015 0.978 72.799 1.00 0.00 N ATOM 0 H LYS A 66 10.761 -4.477 73.941 1.00 0.00 H new ATOM 0 HA LYS A 66 10.811 -1.765 72.791 1.00 0.00 H new ATOM 0 HB2 LYS A 66 8.849 -3.391 72.770 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.759 -3.221 74.512 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.207 -1.622 73.588 1.00 0.00 H new ATOM 0 HG3 LYS A 66 8.575 -0.702 74.183 1.00 0.00 H new ATOM 0 HD2 LYS A 66 9.414 -0.275 72.002 1.00 0.00 H new ATOM 0 HD3 LYS A 66 8.584 -1.650 71.301 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.532 0.625 70.765 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.426 -0.553 71.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.453 1.783 72.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.481 0.470 73.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.909 1.326 73.200 1.00 0.00 H new ATOM 1030 N HIS A 67 11.196 -2.376 75.970 1.00 0.00 N ATOM 1031 CA HIS A 67 11.567 -1.726 77.253 1.00 0.00 C ATOM 1032 C HIS A 67 13.032 -1.319 77.177 1.00 0.00 C ATOM 1033 O HIS A 67 13.545 -0.650 78.051 1.00 0.00 O ATOM 1034 CB HIS A 67 11.386 -2.723 78.401 1.00 0.00 C ATOM 1035 CG HIS A 67 10.059 -2.485 79.062 1.00 0.00 C ATOM 1036 ND1 HIS A 67 9.648 -2.576 80.371 1.00 0.00 N flip ATOM 1037 CD2 HIS A 67 8.946 -2.085 78.343 1.00 0.00 C flip ATOM 1038 CE1 HIS A 67 8.300 -2.235 80.462 1.00 0.00 C flip ATOM 1039 NE2 HIS A 67 7.929 -1.947 79.212 1.00 0.00 N flip ATOM 0 H HIS A 67 11.208 -3.396 75.982 1.00 0.00 H new ATOM 0 HA HIS A 67 10.936 -0.854 77.427 1.00 0.00 H new ATOM 0 HB2 HIS A 67 11.439 -3.744 78.023 1.00 0.00 H new ATOM 0 HB3 HIS A 67 12.192 -2.610 79.126 1.00 0.00 H new ATOM 0 HD2 HIS A 67 8.902 -1.915 77.277 1.00 0.00 H new ATOM 0 HE1 HIS A 67 7.688 -2.209 81.351 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.987 -1.657 78.948 1.00 0.00 H new ATOM 1047 N HIS A 68 13.718 -1.735 76.147 1.00 0.00 N ATOM 1048 CA HIS A 68 15.153 -1.385 76.042 1.00 0.00 C ATOM 1049 C HIS A 68 15.798 -1.662 77.394 1.00 0.00 C ATOM 1050 O HIS A 68 16.838 -1.126 77.721 1.00 0.00 O ATOM 1051 CB HIS A 68 15.293 0.102 75.690 1.00 0.00 C ATOM 1052 CG HIS A 68 16.691 0.399 75.214 1.00 0.00 C ATOM 1053 ND1 HIS A 68 17.491 1.356 75.823 1.00 0.00 N ATOM 1054 CD2 HIS A 68 17.439 -0.110 74.181 1.00 0.00 C ATOM 1055 CE1 HIS A 68 18.659 1.393 75.157 1.00 0.00 C ATOM 1056 NE2 HIS A 68 18.682 0.519 74.147 1.00 0.00 N ATOM 0 H HIS A 68 13.346 -2.298 75.382 1.00 0.00 H new ATOM 0 HA HIS A 68 15.638 -1.973 75.263 1.00 0.00 H new ATOM 0 HB2 HIS A 68 14.574 0.368 74.915 1.00 0.00 H new ATOM 0 HB3 HIS A 68 15.062 0.712 76.563 1.00 0.00 H new ATOM 0 HD2 HIS A 68 17.113 -0.881 73.498 1.00 0.00 H new ATOM 0 HE1 HIS A 68 19.479 2.050 75.408 1.00 0.00 H new ATOM 0 HE2 HIS A 68 19.445 0.349 73.492 1.00 0.00 H new ATOM 1064 N ILE A 69 15.179 -2.501 78.190 1.00 0.00 N ATOM 1065 CA ILE A 69 15.765 -2.802 79.519 1.00 0.00 C ATOM 1066 C ILE A 69 15.314 -4.173 80.032 1.00 0.00 C ATOM 1067 O ILE A 69 14.298 -4.709 79.639 1.00 0.00 O ATOM 1068 CB ILE A 69 15.354 -1.696 80.519 1.00 0.00 C ATOM 1069 CG1 ILE A 69 16.613 -1.165 81.213 1.00 0.00 C ATOM 1070 CG2 ILE A 69 14.374 -2.226 81.574 1.00 0.00 C ATOM 1071 CD1 ILE A 69 17.304 -2.289 81.997 1.00 0.00 C ATOM 0 H ILE A 69 14.305 -2.981 77.975 1.00 0.00 H new ATOM 0 HA ILE A 69 16.850 -2.828 79.422 1.00 0.00 H new ATOM 0 HB ILE A 69 14.854 -0.900 79.968 1.00 0.00 H new ATOM 0 HG12 ILE A 69 17.299 -0.754 80.472 1.00 0.00 H new ATOM 0 HG13 ILE A 69 16.348 -0.351 81.888 1.00 0.00 H new ATOM 0 HG21 ILE A 69 14.107 -1.422 82.259 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.475 -2.596 81.082 1.00 0.00 H new ATOM 0 HG23 ILE A 69 14.843 -3.037 82.131 1.00 0.00 H new ATOM 0 HD11 ILE A 69 18.197 -1.897 82.485 1.00 0.00 H new ATOM 0 HD12 ILE A 69 16.621 -2.680 82.751 1.00 0.00 H new ATOM 0 HD13 ILE A 69 17.586 -3.089 81.313 1.00 0.00 H new ATOM 1083 N THR A 70 16.084 -4.711 80.924 1.00 0.00 N ATOM 1084 CA THR A 70 15.781 -6.016 81.540 1.00 0.00 C ATOM 1085 C THR A 70 15.333 -5.735 82.976 1.00 0.00 C ATOM 1086 O THR A 70 15.559 -4.653 83.478 1.00 0.00 O ATOM 1087 CB THR A 70 17.052 -6.869 81.469 1.00 0.00 C ATOM 1088 OG1 THR A 70 17.081 -7.798 82.542 1.00 0.00 O ATOM 1089 CG2 THR A 70 18.267 -5.946 81.528 1.00 0.00 C ATOM 0 H THR A 70 16.944 -4.280 81.262 1.00 0.00 H new ATOM 0 HA THR A 70 14.987 -6.564 81.033 1.00 0.00 H new ATOM 0 HB THR A 70 17.067 -7.432 80.536 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.178 -8.706 82.186 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.179 -6.541 81.478 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.239 -5.254 80.687 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.251 -5.383 82.461 1.00 0.00 H new ATOM 1097 N PRO A 71 14.640 -6.659 83.578 1.00 0.00 N ATOM 1098 CA PRO A 71 14.078 -6.447 84.927 1.00 0.00 C ATOM 1099 C PRO A 71 15.126 -6.380 86.054 1.00 0.00 C ATOM 1100 O PRO A 71 14.808 -5.931 87.137 1.00 0.00 O ATOM 1101 CB PRO A 71 13.122 -7.638 85.119 1.00 0.00 C ATOM 1102 CG PRO A 71 13.038 -8.361 83.749 1.00 0.00 C ATOM 1103 CD PRO A 71 14.323 -7.979 83.007 1.00 0.00 C ATOM 0 HA PRO A 71 13.589 -5.475 84.991 1.00 0.00 H new ATOM 0 HB2 PRO A 71 13.492 -8.312 85.891 1.00 0.00 H new ATOM 0 HB3 PRO A 71 12.137 -7.297 85.439 1.00 0.00 H new ATOM 0 HG2 PRO A 71 12.966 -9.441 83.879 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.155 -8.047 83.193 1.00 0.00 H new ATOM 0 HD2 PRO A 71 15.122 -8.699 83.182 1.00 0.00 H new ATOM 0 HD3 PRO A 71 14.170 -7.929 81.929 1.00 0.00 H new ATOM 1111 N LEU A 72 16.351 -6.811 85.875 1.00 0.00 N ATOM 1112 CA LEU A 72 17.277 -6.702 87.040 1.00 0.00 C ATOM 1113 C LEU A 72 17.318 -5.240 87.492 1.00 0.00 C ATOM 1114 O LEU A 72 17.317 -4.948 88.676 1.00 0.00 O ATOM 1115 CB LEU A 72 18.729 -7.160 86.750 1.00 0.00 C ATOM 1116 CG LEU A 72 18.882 -8.097 85.537 1.00 0.00 C ATOM 1117 CD1 LEU A 72 17.769 -9.148 85.476 1.00 0.00 C ATOM 1118 CD2 LEU A 72 18.918 -7.278 84.247 1.00 0.00 C ATOM 0 H LEU A 72 16.734 -7.213 85.019 1.00 0.00 H new ATOM 0 HA LEU A 72 16.886 -7.371 87.807 1.00 0.00 H new ATOM 0 HB2 LEU A 72 19.348 -6.277 86.589 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.118 -7.666 87.633 1.00 0.00 H new ATOM 0 HG LEU A 72 19.823 -8.635 85.650 1.00 0.00 H new ATOM 0 HD11 LEU A 72 17.918 -9.786 84.605 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.794 -9.757 86.380 1.00 0.00 H new ATOM 0 HD13 LEU A 72 16.802 -8.650 85.400 1.00 0.00 H new ATOM 0 HD21 LEU A 72 19.026 -7.948 83.394 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.991 -6.713 84.149 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.762 -6.589 84.277 1.00 0.00 H new ATOM 1130 N LEU A 73 17.350 -4.313 86.572 1.00 0.00 N ATOM 1131 CA LEU A 73 17.389 -2.878 86.986 1.00 0.00 C ATOM 1132 C LEU A 73 16.041 -2.485 87.566 1.00 0.00 C ATOM 1133 O LEU A 73 15.934 -1.544 88.328 1.00 0.00 O ATOM 1134 CB LEU A 73 17.733 -1.991 85.795 1.00 0.00 C ATOM 1135 CG LEU A 73 19.080 -2.440 85.224 1.00 0.00 C ATOM 1136 CD1 LEU A 73 18.874 -3.624 84.270 1.00 0.00 C ATOM 1137 CD2 LEU A 73 19.724 -1.272 84.478 1.00 0.00 C ATOM 0 H LEU A 73 17.351 -4.482 85.566 1.00 0.00 H new ATOM 0 HA LEU A 73 18.160 -2.744 87.745 1.00 0.00 H new ATOM 0 HB2 LEU A 73 16.957 -2.063 85.033 1.00 0.00 H new ATOM 0 HB3 LEU A 73 17.782 -0.947 86.103 1.00 0.00 H new ATOM 0 HG LEU A 73 19.734 -2.756 86.037 1.00 0.00 H new ATOM 0 HD11 LEU A 73 19.837 -3.938 83.867 1.00 0.00 H new ATOM 0 HD12 LEU A 73 18.419 -4.453 84.812 1.00 0.00 H new ATOM 0 HD13 LEU A 73 18.220 -3.323 83.452 1.00 0.00 H new ATOM 0 HD21 LEU A 73 20.684 -1.587 84.069 1.00 0.00 H new ATOM 0 HD22 LEU A 73 19.070 -0.954 83.666 1.00 0.00 H new ATOM 0 HD23 LEU A 73 19.878 -0.441 85.166 1.00 0.00 H new ATOM 1149 N SER A 74 15.006 -3.195 87.238 1.00 0.00 N ATOM 1150 CA SER A 74 13.689 -2.845 87.810 1.00 0.00 C ATOM 1151 C SER A 74 13.778 -2.938 89.342 1.00 0.00 C ATOM 1152 O SER A 74 13.343 -2.053 90.058 1.00 0.00 O ATOM 1153 CB SER A 74 12.624 -3.793 87.258 1.00 0.00 C ATOM 1154 OG SER A 74 11.348 -3.390 87.728 1.00 0.00 O ATOM 0 H SER A 74 15.015 -3.995 86.605 1.00 0.00 H new ATOM 0 HA SER A 74 13.409 -1.828 87.535 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.642 -3.784 86.168 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.833 -4.816 87.572 1.00 0.00 H new ATOM 0 HG SER A 74 11.457 -2.790 88.495 1.00 0.00 H new ATOM 1160 N ALA A 75 14.359 -3.994 89.851 1.00 0.00 N ATOM 1161 CA ALA A 75 14.489 -4.132 91.341 1.00 0.00 C ATOM 1162 C ALA A 75 15.537 -3.145 91.881 1.00 0.00 C ATOM 1163 O ALA A 75 15.424 -2.646 92.981 1.00 0.00 O ATOM 1164 CB ALA A 75 14.904 -5.561 91.695 1.00 0.00 C ATOM 0 H ALA A 75 14.748 -4.764 89.307 1.00 0.00 H new ATOM 0 HA ALA A 75 13.524 -3.909 91.797 1.00 0.00 H new ATOM 0 HB1 ALA A 75 14.997 -5.655 92.777 1.00 0.00 H new ATOM 0 HB2 ALA A 75 14.149 -6.259 91.333 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.862 -5.788 91.227 1.00 0.00 H new ATOM 1170 N VAL A 76 16.556 -2.871 91.115 1.00 0.00 N ATOM 1171 CA VAL A 76 17.621 -1.930 91.569 1.00 0.00 C ATOM 1172 C VAL A 76 16.979 -0.695 92.218 1.00 0.00 C ATOM 1173 O VAL A 76 17.086 -0.490 93.411 1.00 0.00 O ATOM 1174 CB VAL A 76 18.474 -1.559 90.347 1.00 0.00 C ATOM 1175 CG1 VAL A 76 19.386 -0.357 90.635 1.00 0.00 C ATOM 1176 CG2 VAL A 76 19.337 -2.773 89.981 1.00 0.00 C ATOM 0 H VAL A 76 16.699 -3.262 90.184 1.00 0.00 H new ATOM 0 HA VAL A 76 18.261 -2.391 92.321 1.00 0.00 H new ATOM 0 HB VAL A 76 17.812 -1.283 89.526 1.00 0.00 H new ATOM 0 HG11 VAL A 76 19.974 -0.125 89.747 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.777 0.506 90.903 1.00 0.00 H new ATOM 0 HG13 VAL A 76 20.056 -0.598 91.460 1.00 0.00 H new ATOM 0 HG21 VAL A 76 19.953 -2.534 89.114 1.00 0.00 H new ATOM 0 HG22 VAL A 76 19.980 -3.030 90.823 1.00 0.00 H new ATOM 0 HG23 VAL A 76 18.692 -3.620 89.745 1.00 0.00 H new ATOM 1186 N TYR A 77 16.306 0.119 91.459 1.00 0.00 N ATOM 1187 CA TYR A 77 15.654 1.319 92.057 1.00 0.00 C ATOM 1188 C TYR A 77 14.425 0.875 92.860 1.00 0.00 C ATOM 1189 O TYR A 77 13.359 1.452 92.754 1.00 0.00 O ATOM 1190 CB TYR A 77 15.233 2.271 90.933 1.00 0.00 C ATOM 1191 CG TYR A 77 16.101 2.024 89.718 1.00 0.00 C ATOM 1192 CD1 TYR A 77 17.367 2.618 89.626 1.00 0.00 C ATOM 1193 CD2 TYR A 77 15.642 1.195 88.687 1.00 0.00 C ATOM 1194 CE1 TYR A 77 18.170 2.383 88.502 1.00 0.00 C ATOM 1195 CE2 TYR A 77 16.447 0.960 87.566 1.00 0.00 C ATOM 1196 CZ TYR A 77 17.710 1.554 87.474 1.00 0.00 C ATOM 1197 OH TYR A 77 18.507 1.315 86.371 1.00 0.00 O ATOM 0 H TYR A 77 16.178 0.008 90.453 1.00 0.00 H new ATOM 0 HA TYR A 77 16.348 1.833 92.721 1.00 0.00 H new ATOM 0 HB2 TYR A 77 14.184 2.115 90.683 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.332 3.306 91.261 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.723 3.256 90.421 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.667 0.737 88.757 1.00 0.00 H new ATOM 0 HE1 TYR A 77 19.145 2.842 88.430 1.00 0.00 H new ATOM 0 HE2 TYR A 77 16.093 0.320 86.772 1.00 0.00 H new ATOM 0 HH TYR A 77 17.954 1.314 85.562 1.00 0.00 H new ATOM 1207 N GLU A 78 14.568 -0.149 93.662 1.00 0.00 N ATOM 1208 CA GLU A 78 13.411 -0.640 94.476 1.00 0.00 C ATOM 1209 C GLU A 78 13.814 -0.756 95.946 1.00 0.00 C ATOM 1210 O GLU A 78 12.999 -0.608 96.835 1.00 0.00 O ATOM 1211 CB GLU A 78 13.004 -2.032 93.984 1.00 0.00 C ATOM 1212 CG GLU A 78 11.559 -2.323 94.390 1.00 0.00 C ATOM 1213 CD GLU A 78 10.613 -1.583 93.448 1.00 0.00 C ATOM 1214 OE1 GLU A 78 11.023 -1.297 92.335 1.00 0.00 O ATOM 1215 OE2 GLU A 78 9.494 -1.313 93.852 1.00 0.00 O ATOM 0 H GLU A 78 15.437 -0.668 93.790 1.00 0.00 H new ATOM 0 HA GLU A 78 12.585 0.064 94.372 1.00 0.00 H new ATOM 0 HB2 GLU A 78 13.105 -2.089 92.900 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.669 -2.786 94.406 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.366 -3.395 94.349 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.387 -2.007 95.419 1.00 0.00 H new ATOM 1222 N GLY A 79 15.052 -1.070 96.208 1.00 0.00 N ATOM 1223 CA GLY A 79 15.486 -1.254 97.619 1.00 0.00 C ATOM 1224 C GLY A 79 15.319 -2.733 97.943 1.00 0.00 C ATOM 1225 O GLY A 79 15.689 -3.205 99.003 1.00 0.00 O ATOM 0 H GLY A 79 15.780 -1.207 95.507 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.523 -0.945 97.747 1.00 0.00 H new ATOM 0 HA3 GLY A 79 14.885 -0.641 98.291 1.00 0.00 H new ATOM 1229 N HIS A 80 14.766 -3.474 97.017 1.00 0.00 N ATOM 1230 CA HIS A 80 14.570 -4.930 97.235 1.00 0.00 C ATOM 1231 C HIS A 80 15.894 -5.630 96.951 1.00 0.00 C ATOM 1232 O HIS A 80 16.493 -6.230 97.822 1.00 0.00 O ATOM 1233 CB HIS A 80 13.497 -5.440 96.264 1.00 0.00 C ATOM 1234 CG HIS A 80 12.144 -5.339 96.920 1.00 0.00 C ATOM 1235 ND1 HIS A 80 11.317 -6.438 97.092 1.00 0.00 N ATOM 1236 CD2 HIS A 80 11.474 -4.276 97.475 1.00 0.00 C ATOM 1237 CE1 HIS A 80 10.211 -6.017 97.728 1.00 0.00 C ATOM 1238 NE2 HIS A 80 10.254 -4.707 97.986 1.00 0.00 N ATOM 0 H HIS A 80 14.441 -3.126 96.115 1.00 0.00 H new ATOM 0 HA HIS A 80 14.251 -5.130 98.258 1.00 0.00 H new ATOM 0 HB2 HIS A 80 13.513 -4.854 95.345 1.00 0.00 H new ATOM 0 HB3 HIS A 80 13.703 -6.474 95.986 1.00 0.00 H new ATOM 0 HD2 HIS A 80 11.839 -3.260 97.509 1.00 0.00 H new ATOM 0 HE1 HIS A 80 9.387 -6.660 97.998 1.00 0.00 H new ATOM 0 HE2 HIS A 80 9.545 -4.144 98.456 1.00 0.00 H new ATOM 1246 N VAL A 81 16.350 -5.529 95.731 1.00 0.00 N ATOM 1247 CA VAL A 81 17.645 -6.155 95.336 1.00 0.00 C ATOM 1248 C VAL A 81 17.887 -7.475 96.070 1.00 0.00 C ATOM 1249 O VAL A 81 18.979 -8.018 96.058 1.00 0.00 O ATOM 1250 CB VAL A 81 18.783 -5.148 95.560 1.00 0.00 C ATOM 1251 CG1 VAL A 81 18.881 -4.238 94.326 1.00 0.00 C ATOM 1252 CG2 VAL A 81 18.464 -4.281 96.784 1.00 0.00 C ATOM 0 H VAL A 81 15.872 -5.031 94.980 1.00 0.00 H new ATOM 0 HA VAL A 81 17.608 -6.408 94.276 1.00 0.00 H new ATOM 0 HB VAL A 81 19.721 -5.680 95.720 1.00 0.00 H new ATOM 0 HG11 VAL A 81 19.685 -3.516 94.469 1.00 0.00 H new ATOM 0 HG12 VAL A 81 19.089 -4.843 93.443 1.00 0.00 H new ATOM 0 HG13 VAL A 81 17.938 -3.708 94.189 1.00 0.00 H new ATOM 0 HG21 VAL A 81 19.271 -3.566 96.944 1.00 0.00 H new ATOM 0 HG22 VAL A 81 17.531 -3.743 96.616 1.00 0.00 H new ATOM 0 HG23 VAL A 81 18.363 -4.917 97.664 1.00 0.00 H new ATOM 1262 N SER A 82 16.858 -8.042 96.633 1.00 0.00 N ATOM 1263 CA SER A 82 17.005 -9.376 97.261 1.00 0.00 C ATOM 1264 C SER A 82 16.887 -10.341 96.088 1.00 0.00 C ATOM 1265 O SER A 82 17.311 -11.477 96.124 1.00 0.00 O ATOM 1266 CB SER A 82 15.889 -9.616 98.288 1.00 0.00 C ATOM 1267 OG SER A 82 16.422 -9.488 99.603 1.00 0.00 O ATOM 0 H SER A 82 15.923 -7.637 96.684 1.00 0.00 H new ATOM 0 HA SER A 82 17.942 -9.491 97.806 1.00 0.00 H new ATOM 0 HB2 SER A 82 15.082 -8.899 98.139 1.00 0.00 H new ATOM 0 HB3 SER A 82 15.462 -10.609 98.152 1.00 0.00 H new ATOM 0 HG SER A 82 15.711 -9.639 100.260 1.00 0.00 H new ATOM 1273 N CYS A 83 16.310 -9.826 95.030 1.00 0.00 N ATOM 1274 CA CYS A 83 16.127 -10.601 93.778 1.00 0.00 C ATOM 1275 C CYS A 83 17.415 -10.525 92.954 1.00 0.00 C ATOM 1276 O CYS A 83 18.018 -11.532 92.648 1.00 0.00 O ATOM 1277 CB CYS A 83 14.969 -9.984 92.983 1.00 0.00 C ATOM 1278 SG CYS A 83 14.849 -8.214 93.358 1.00 0.00 S ATOM 0 H CYS A 83 15.950 -8.872 94.988 1.00 0.00 H new ATOM 0 HA CYS A 83 15.903 -11.643 94.005 1.00 0.00 H new ATOM 0 HB2 CYS A 83 15.130 -10.130 91.915 1.00 0.00 H new ATOM 0 HB3 CYS A 83 14.034 -10.484 93.236 1.00 0.00 H new ATOM 0 HG CYS A 83 13.750 -7.737 92.854 1.00 0.00 H new ATOM 1284 N VAL A 84 17.852 -9.338 92.591 1.00 0.00 N ATOM 1285 CA VAL A 84 19.108 -9.223 91.788 1.00 0.00 C ATOM 1286 C VAL A 84 20.090 -10.293 92.259 1.00 0.00 C ATOM 1287 O VAL A 84 20.684 -11.003 91.470 1.00 0.00 O ATOM 1288 CB VAL A 84 19.754 -7.850 91.989 1.00 0.00 C ATOM 1289 CG1 VAL A 84 18.838 -6.754 91.442 1.00 0.00 C ATOM 1290 CG2 VAL A 84 20.009 -7.620 93.478 1.00 0.00 C ATOM 0 H VAL A 84 17.395 -8.454 92.815 1.00 0.00 H new ATOM 0 HA VAL A 84 18.865 -9.352 90.733 1.00 0.00 H new ATOM 0 HB VAL A 84 20.701 -7.817 91.451 1.00 0.00 H new ATOM 0 HG11 VAL A 84 19.306 -5.781 91.590 1.00 0.00 H new ATOM 0 HG12 VAL A 84 18.670 -6.918 90.378 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.884 -6.781 91.968 1.00 0.00 H new ATOM 0 HG21 VAL A 84 20.469 -6.642 93.622 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.064 -7.659 94.019 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.676 -8.394 93.857 1.00 0.00 H new ATOM 1300 N LYS A 85 20.252 -10.421 93.545 1.00 0.00 N ATOM 1301 CA LYS A 85 21.184 -11.450 94.072 1.00 0.00 C ATOM 1302 C LYS A 85 20.847 -12.805 93.423 1.00 0.00 C ATOM 1303 O LYS A 85 21.600 -13.327 92.622 1.00 0.00 O ATOM 1304 CB LYS A 85 21.015 -11.536 95.600 1.00 0.00 C ATOM 1305 CG LYS A 85 22.302 -11.075 96.309 1.00 0.00 C ATOM 1306 CD LYS A 85 22.412 -9.547 96.250 1.00 0.00 C ATOM 1307 CE LYS A 85 23.750 -9.101 96.848 1.00 0.00 C ATOM 1308 NZ LYS A 85 24.053 -9.918 98.057 1.00 0.00 N ATOM 0 H LYS A 85 19.779 -9.858 94.252 1.00 0.00 H new ATOM 0 HA LYS A 85 22.216 -11.188 93.839 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.176 -10.915 95.915 1.00 0.00 H new ATOM 0 HB3 LYS A 85 20.780 -12.560 95.889 1.00 0.00 H new ATOM 0 HG2 LYS A 85 22.295 -11.408 97.347 1.00 0.00 H new ATOM 0 HG3 LYS A 85 23.172 -11.529 95.834 1.00 0.00 H new ATOM 0 HD2 LYS A 85 22.333 -9.207 95.217 1.00 0.00 H new ATOM 0 HD3 LYS A 85 21.588 -9.092 96.799 1.00 0.00 H new ATOM 0 HE2 LYS A 85 24.545 -9.214 96.111 1.00 0.00 H new ATOM 0 HE3 LYS A 85 23.708 -8.044 97.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 24.776 -9.436 98.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 23.188 -10.037 98.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 24.408 -10.851 97.765 1.00 0.00 H new ATOM 1322 N LEU A 86 19.720 -13.378 93.770 1.00 0.00 N ATOM 1323 CA LEU A 86 19.311 -14.695 93.193 1.00 0.00 C ATOM 1324 C LEU A 86 18.998 -14.548 91.691 1.00 0.00 C ATOM 1325 O LEU A 86 18.763 -15.516 90.999 1.00 0.00 O ATOM 1326 CB LEU A 86 18.111 -15.207 94.030 1.00 0.00 C ATOM 1327 CG LEU A 86 16.865 -15.591 93.204 1.00 0.00 C ATOM 1328 CD1 LEU A 86 16.365 -14.421 92.349 1.00 0.00 C ATOM 1329 CD2 LEU A 86 17.154 -16.816 92.323 1.00 0.00 C ATOM 0 H LEU A 86 19.058 -12.983 94.438 1.00 0.00 H new ATOM 0 HA LEU A 86 20.113 -15.431 93.248 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.431 -16.076 94.605 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.831 -14.436 94.748 1.00 0.00 H new ATOM 0 HG LEU A 86 16.073 -15.845 93.909 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.487 -14.733 91.783 1.00 0.00 H new ATOM 0 HD12 LEU A 86 16.101 -13.584 92.996 1.00 0.00 H new ATOM 0 HD13 LEU A 86 17.151 -14.113 91.659 1.00 0.00 H new ATOM 0 HD21 LEU A 86 16.263 -17.070 91.749 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.973 -16.588 91.640 1.00 0.00 H new ATOM 0 HD23 LEU A 86 17.432 -17.660 92.954 1.00 0.00 H new ATOM 1341 N LEU A 87 18.997 -13.344 91.182 1.00 0.00 N ATOM 1342 CA LEU A 87 18.692 -13.143 89.731 1.00 0.00 C ATOM 1343 C LEU A 87 19.906 -13.508 88.844 1.00 0.00 C ATOM 1344 O LEU A 87 19.852 -14.476 88.112 1.00 0.00 O ATOM 1345 CB LEU A 87 18.287 -11.686 89.493 1.00 0.00 C ATOM 1346 CG LEU A 87 16.986 -11.631 88.681 1.00 0.00 C ATOM 1347 CD1 LEU A 87 16.563 -10.174 88.489 1.00 0.00 C ATOM 1348 CD2 LEU A 87 17.205 -12.283 87.312 1.00 0.00 C ATOM 0 H LEU A 87 19.194 -12.491 91.706 1.00 0.00 H new ATOM 0 HA LEU A 87 17.869 -13.804 89.457 1.00 0.00 H new ATOM 0 HB2 LEU A 87 18.152 -11.177 90.447 1.00 0.00 H new ATOM 0 HB3 LEU A 87 19.080 -11.161 88.961 1.00 0.00 H new ATOM 0 HG LEU A 87 16.204 -12.169 89.217 1.00 0.00 H new ATOM 0 HD11 LEU A 87 15.639 -10.136 87.912 1.00 0.00 H new ATOM 0 HD12 LEU A 87 16.402 -9.711 89.462 1.00 0.00 H new ATOM 0 HD13 LEU A 87 17.346 -9.635 87.955 1.00 0.00 H new ATOM 0 HD21 LEU A 87 16.280 -12.243 86.738 1.00 0.00 H new ATOM 0 HD22 LEU A 87 17.989 -11.748 86.776 1.00 0.00 H new ATOM 0 HD23 LEU A 87 17.503 -13.323 87.448 1.00 0.00 H new ATOM 1360 N LEU A 88 20.991 -12.754 88.869 1.00 0.00 N ATOM 1361 CA LEU A 88 22.142 -13.126 87.982 1.00 0.00 C ATOM 1362 C LEU A 88 22.694 -14.490 88.382 1.00 0.00 C ATOM 1363 O LEU A 88 23.451 -15.101 87.656 1.00 0.00 O ATOM 1364 CB LEU A 88 23.259 -12.061 87.978 1.00 0.00 C ATOM 1365 CG LEU A 88 24.114 -12.071 89.260 1.00 0.00 C ATOM 1366 CD1 LEU A 88 23.224 -12.041 90.498 1.00 0.00 C ATOM 1367 CD2 LEU A 88 25.024 -13.311 89.306 1.00 0.00 C ATOM 0 H LEU A 88 21.124 -11.924 89.447 1.00 0.00 H new ATOM 0 HA LEU A 88 21.760 -13.178 86.962 1.00 0.00 H new ATOM 0 HB2 LEU A 88 23.906 -12.226 87.117 1.00 0.00 H new ATOM 0 HB3 LEU A 88 22.811 -11.075 87.856 1.00 0.00 H new ATOM 0 HG LEU A 88 24.740 -11.179 89.249 1.00 0.00 H new ATOM 0 HD11 LEU A 88 23.846 -12.049 91.393 1.00 0.00 H new ATOM 0 HD12 LEU A 88 22.615 -11.137 90.487 1.00 0.00 H new ATOM 0 HD13 LEU A 88 22.574 -12.916 90.500 1.00 0.00 H new ATOM 0 HD21 LEU A 88 25.617 -13.294 90.221 1.00 0.00 H new ATOM 0 HD22 LEU A 88 24.412 -14.213 89.287 1.00 0.00 H new ATOM 0 HD23 LEU A 88 25.689 -13.306 88.443 1.00 0.00 H new ATOM 1379 N SER A 89 22.301 -14.986 89.512 1.00 0.00 N ATOM 1380 CA SER A 89 22.777 -16.327 89.937 1.00 0.00 C ATOM 1381 C SER A 89 22.401 -17.322 88.837 1.00 0.00 C ATOM 1382 O SER A 89 22.821 -18.461 88.834 1.00 0.00 O ATOM 1383 CB SER A 89 22.081 -16.720 91.237 1.00 0.00 C ATOM 1384 OG SER A 89 22.183 -18.124 91.419 1.00 0.00 O ATOM 0 H SER A 89 21.669 -14.522 90.164 1.00 0.00 H new ATOM 0 HA SER A 89 23.855 -16.322 90.099 1.00 0.00 H new ATOM 0 HB2 SER A 89 22.537 -16.199 92.079 1.00 0.00 H new ATOM 0 HB3 SER A 89 21.033 -16.421 91.207 1.00 0.00 H new ATOM 0 HG SER A 89 22.743 -18.506 90.711 1.00 0.00 H new ATOM 1390 N LYS A 90 21.603 -16.873 87.905 1.00 0.00 N ATOM 1391 CA LYS A 90 21.162 -17.739 86.780 1.00 0.00 C ATOM 1392 C LYS A 90 21.745 -17.173 85.482 1.00 0.00 C ATOM 1393 O LYS A 90 21.925 -17.871 84.505 1.00 0.00 O ATOM 1394 CB LYS A 90 19.624 -17.712 86.750 1.00 0.00 C ATOM 1395 CG LYS A 90 19.080 -18.021 85.349 1.00 0.00 C ATOM 1396 CD LYS A 90 17.791 -18.852 85.461 1.00 0.00 C ATOM 1397 CE LYS A 90 16.814 -18.210 86.460 1.00 0.00 C ATOM 1398 NZ LYS A 90 17.008 -18.809 87.813 1.00 0.00 N ATOM 0 H LYS A 90 21.233 -15.923 87.879 1.00 0.00 H new ATOM 0 HA LYS A 90 21.504 -18.767 86.897 1.00 0.00 H new ATOM 0 HB2 LYS A 90 19.233 -18.440 87.461 1.00 0.00 H new ATOM 0 HB3 LYS A 90 19.271 -16.732 87.070 1.00 0.00 H new ATOM 0 HG2 LYS A 90 18.879 -17.093 84.814 1.00 0.00 H new ATOM 0 HG3 LYS A 90 19.826 -18.567 84.772 1.00 0.00 H new ATOM 0 HD2 LYS A 90 17.318 -18.932 84.482 1.00 0.00 H new ATOM 0 HD3 LYS A 90 18.033 -19.865 85.782 1.00 0.00 H new ATOM 0 HE2 LYS A 90 16.978 -17.133 86.502 1.00 0.00 H new ATOM 0 HE3 LYS A 90 15.787 -18.363 86.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.082 -19.027 88.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 17.565 -19.683 87.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.513 -18.134 88.422 1.00 0.00 H new ATOM 1412 N GLY A 91 22.055 -15.906 85.485 1.00 0.00 N ATOM 1413 CA GLY A 91 22.639 -15.254 84.282 1.00 0.00 C ATOM 1414 C GLY A 91 22.293 -13.759 84.296 1.00 0.00 C ATOM 1415 O GLY A 91 22.882 -12.978 85.016 1.00 0.00 O ATOM 0 H GLY A 91 21.926 -15.286 86.284 1.00 0.00 H new ATOM 0 HA2 GLY A 91 23.721 -15.388 84.271 1.00 0.00 H new ATOM 0 HA3 GLY A 91 22.250 -15.720 83.377 1.00 0.00 H new ATOM 1419 N ALA A 92 21.325 -13.371 83.514 1.00 0.00 N ATOM 1420 CA ALA A 92 20.893 -11.938 83.459 1.00 0.00 C ATOM 1421 C ALA A 92 22.075 -10.976 83.416 1.00 0.00 C ATOM 1422 O ALA A 92 21.883 -9.779 83.358 1.00 0.00 O ATOM 1423 CB ALA A 92 20.055 -11.627 84.700 1.00 0.00 C ATOM 0 H ALA A 92 20.803 -13.994 82.898 1.00 0.00 H new ATOM 0 HA ALA A 92 20.317 -11.801 82.544 1.00 0.00 H new ATOM 0 HB1 ALA A 92 19.735 -10.586 84.671 1.00 0.00 H new ATOM 0 HB2 ALA A 92 19.179 -12.276 84.720 1.00 0.00 H new ATOM 0 HB3 ALA A 92 20.653 -11.798 85.595 1.00 0.00 H new ATOM 1429 N ASP A 93 23.283 -11.446 83.436 1.00 0.00 N ATOM 1430 CA ASP A 93 24.415 -10.492 83.393 1.00 0.00 C ATOM 1431 C ASP A 93 24.068 -9.298 84.301 1.00 0.00 C ATOM 1432 O ASP A 93 23.722 -9.480 85.451 1.00 0.00 O ATOM 1433 CB ASP A 93 24.593 -10.035 81.947 1.00 0.00 C ATOM 1434 CG ASP A 93 25.253 -11.155 81.137 1.00 0.00 C ATOM 1435 OD1 ASP A 93 26.413 -11.438 81.389 1.00 0.00 O ATOM 1436 OD2 ASP A 93 24.588 -11.710 80.278 1.00 0.00 O ATOM 0 H ASP A 93 23.534 -12.434 83.480 1.00 0.00 H new ATOM 0 HA ASP A 93 25.341 -10.949 83.741 1.00 0.00 H new ATOM 0 HB2 ASP A 93 23.626 -9.779 81.513 1.00 0.00 H new ATOM 0 HB3 ASP A 93 25.207 -9.135 81.911 1.00 0.00 H new ATOM 1441 N LYS A 94 24.120 -8.088 83.807 1.00 0.00 N ATOM 1442 CA LYS A 94 23.745 -6.925 84.672 1.00 0.00 C ATOM 1443 C LYS A 94 23.515 -5.679 83.812 1.00 0.00 C ATOM 1444 O LYS A 94 22.752 -4.803 84.167 1.00 0.00 O ATOM 1445 CB LYS A 94 24.827 -6.663 85.733 1.00 0.00 C ATOM 1446 CG LYS A 94 26.128 -6.159 85.092 1.00 0.00 C ATOM 1447 CD LYS A 94 26.934 -7.335 84.520 1.00 0.00 C ATOM 1448 CE LYS A 94 27.135 -7.137 83.012 1.00 0.00 C ATOM 1449 NZ LYS A 94 28.001 -8.223 82.473 1.00 0.00 N ATOM 0 H LYS A 94 24.402 -7.854 82.855 1.00 0.00 H new ATOM 0 HA LYS A 94 22.817 -7.164 85.191 1.00 0.00 H new ATOM 0 HB2 LYS A 94 24.464 -5.927 86.451 1.00 0.00 H new ATOM 0 HB3 LYS A 94 25.024 -7.580 86.288 1.00 0.00 H new ATOM 0 HG2 LYS A 94 25.898 -5.447 84.299 1.00 0.00 H new ATOM 0 HG3 LYS A 94 26.724 -5.628 85.834 1.00 0.00 H new ATOM 0 HD2 LYS A 94 27.900 -7.404 85.020 1.00 0.00 H new ATOM 0 HD3 LYS A 94 26.411 -8.273 84.707 1.00 0.00 H new ATOM 0 HE2 LYS A 94 26.171 -7.141 82.503 1.00 0.00 H new ATOM 0 HE3 LYS A 94 27.592 -6.166 82.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 28.135 -8.085 81.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 28.925 -8.199 82.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 27.548 -9.144 82.642 1.00 0.00 H new ATOM 1463 N THR A 95 24.158 -5.601 82.685 1.00 0.00 N ATOM 1464 CA THR A 95 23.980 -4.428 81.787 1.00 0.00 C ATOM 1465 C THR A 95 23.826 -4.946 80.359 1.00 0.00 C ATOM 1466 O THR A 95 24.349 -4.381 79.419 1.00 0.00 O ATOM 1467 CB THR A 95 25.218 -3.531 81.867 1.00 0.00 C ATOM 1468 OG1 THR A 95 25.652 -3.443 83.217 1.00 0.00 O ATOM 1469 CG2 THR A 95 24.881 -2.134 81.342 1.00 0.00 C ATOM 0 H THR A 95 24.808 -6.308 82.342 1.00 0.00 H new ATOM 0 HA THR A 95 23.102 -3.854 82.083 1.00 0.00 H new ATOM 0 HB THR A 95 26.014 -3.959 81.257 1.00 0.00 H new ATOM 0 HG1 THR A 95 26.631 -3.474 83.249 1.00 0.00 H new ATOM 0 HG21 THR A 95 25.766 -1.500 81.401 1.00 0.00 H new ATOM 0 HG22 THR A 95 24.554 -2.204 80.305 1.00 0.00 H new ATOM 0 HG23 THR A 95 24.083 -1.701 81.946 1.00 0.00 H new ATOM 1477 N VAL A 96 23.133 -6.034 80.200 1.00 0.00 N ATOM 1478 CA VAL A 96 22.963 -6.621 78.853 1.00 0.00 C ATOM 1479 C VAL A 96 21.968 -5.776 78.043 1.00 0.00 C ATOM 1480 O VAL A 96 21.691 -6.073 76.896 1.00 0.00 O ATOM 1481 CB VAL A 96 22.470 -8.075 79.026 1.00 0.00 C ATOM 1482 CG1 VAL A 96 21.432 -8.440 77.963 1.00 0.00 C ATOM 1483 CG2 VAL A 96 23.660 -9.035 78.907 1.00 0.00 C ATOM 0 H VAL A 96 22.674 -6.544 80.954 1.00 0.00 H new ATOM 0 HA VAL A 96 23.905 -6.627 78.305 1.00 0.00 H new ATOM 0 HB VAL A 96 22.007 -8.160 80.009 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.105 -9.469 78.112 1.00 0.00 H new ATOM 0 HG12 VAL A 96 20.575 -7.771 78.046 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.875 -8.340 76.972 1.00 0.00 H new ATOM 0 HG21 VAL A 96 23.313 -10.061 79.029 1.00 0.00 H new ATOM 0 HG22 VAL A 96 24.122 -8.922 77.926 1.00 0.00 H new ATOM 0 HG23 VAL A 96 24.392 -8.805 79.681 1.00 0.00 H new ATOM 1493 N LYS A 97 21.436 -4.716 78.610 1.00 0.00 N ATOM 1494 CA LYS A 97 20.482 -3.878 77.822 1.00 0.00 C ATOM 1495 C LYS A 97 20.270 -2.478 78.442 1.00 0.00 C ATOM 1496 O LYS A 97 19.594 -1.649 77.864 1.00 0.00 O ATOM 1497 CB LYS A 97 19.139 -4.602 77.731 1.00 0.00 C ATOM 1498 CG LYS A 97 18.434 -4.226 76.420 1.00 0.00 C ATOM 1499 CD LYS A 97 18.933 -5.125 75.282 1.00 0.00 C ATOM 1500 CE LYS A 97 18.153 -4.812 74.002 1.00 0.00 C ATOM 1501 NZ LYS A 97 18.761 -5.545 72.853 1.00 0.00 N ATOM 0 H LYS A 97 21.618 -4.402 79.563 1.00 0.00 H new ATOM 0 HA LYS A 97 20.912 -3.731 76.831 1.00 0.00 H new ATOM 0 HB2 LYS A 97 19.293 -5.680 77.776 1.00 0.00 H new ATOM 0 HB3 LYS A 97 18.512 -4.334 78.582 1.00 0.00 H new ATOM 0 HG2 LYS A 97 17.355 -4.333 76.533 1.00 0.00 H new ATOM 0 HG3 LYS A 97 18.627 -3.180 76.180 1.00 0.00 H new ATOM 0 HD2 LYS A 97 19.999 -4.965 75.119 1.00 0.00 H new ATOM 0 HD3 LYS A 97 18.806 -6.174 75.551 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.109 -5.102 74.120 1.00 0.00 H new ATOM 0 HE3 LYS A 97 18.166 -3.739 73.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 18.230 -5.331 71.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 19.751 -5.247 72.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 18.727 -6.568 73.037 1.00 0.00 H new ATOM 1515 N GLY A 98 20.817 -2.193 79.593 1.00 0.00 N ATOM 1516 CA GLY A 98 20.608 -0.834 80.188 1.00 0.00 C ATOM 1517 C GLY A 98 21.398 0.197 79.378 1.00 0.00 C ATOM 1518 O GLY A 98 22.172 -0.165 78.517 1.00 0.00 O ATOM 0 H GLY A 98 21.393 -2.830 80.144 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.548 -0.582 80.185 1.00 0.00 H new ATOM 0 HA3 GLY A 98 20.935 -0.825 81.228 1.00 0.00 H new ATOM 1522 N PRO A 99 21.191 1.455 79.688 1.00 0.00 N ATOM 1523 CA PRO A 99 21.890 2.564 79.010 1.00 0.00 C ATOM 1524 C PRO A 99 23.343 2.202 78.749 1.00 0.00 C ATOM 1525 O PRO A 99 23.749 1.967 77.628 1.00 0.00 O ATOM 1526 CB PRO A 99 21.761 3.721 80.011 1.00 0.00 C ATOM 1527 CG PRO A 99 20.513 3.405 80.870 1.00 0.00 C ATOM 1528 CD PRO A 99 20.262 1.889 80.751 1.00 0.00 C ATOM 0 HA PRO A 99 21.476 2.810 78.032 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.653 3.800 80.633 1.00 0.00 H new ATOM 0 HB3 PRO A 99 21.648 4.674 79.494 1.00 0.00 H new ATOM 0 HG2 PRO A 99 20.677 3.689 81.909 1.00 0.00 H new ATOM 0 HG3 PRO A 99 19.649 3.969 80.518 1.00 0.00 H new ATOM 0 HD2 PRO A 99 20.464 1.376 81.691 1.00 0.00 H new ATOM 0 HD3 PRO A 99 19.226 1.675 80.487 1.00 0.00 H new ATOM 1536 N ASP A 100 24.125 2.150 79.772 1.00 0.00 N ATOM 1537 CA ASP A 100 25.549 1.797 79.600 1.00 0.00 C ATOM 1538 C ASP A 100 26.052 1.284 80.935 1.00 0.00 C ATOM 1539 O ASP A 100 25.421 0.467 81.575 1.00 0.00 O ATOM 1540 CB ASP A 100 26.336 3.043 79.179 1.00 0.00 C ATOM 1541 CG ASP A 100 27.723 2.637 78.677 1.00 0.00 C ATOM 1542 OD1 ASP A 100 27.954 1.448 78.530 1.00 0.00 O ATOM 1543 OD2 ASP A 100 28.530 3.521 78.444 1.00 0.00 O ATOM 0 H ASP A 100 23.838 2.339 80.733 1.00 0.00 H new ATOM 0 HA ASP A 100 25.676 1.036 78.830 1.00 0.00 H new ATOM 0 HB2 ASP A 100 25.798 3.576 78.396 1.00 0.00 H new ATOM 0 HB3 ASP A 100 26.431 3.727 80.023 1.00 0.00 H new ATOM 1548 N GLY A 101 27.159 1.770 81.385 1.00 0.00 N ATOM 1549 CA GLY A 101 27.671 1.314 82.699 1.00 0.00 C ATOM 1550 C GLY A 101 26.627 1.650 83.775 1.00 0.00 C ATOM 1551 O GLY A 101 26.816 1.391 84.952 1.00 0.00 O ATOM 0 H GLY A 101 27.735 2.462 80.905 1.00 0.00 H new ATOM 0 HA2 GLY A 101 27.862 0.241 82.679 1.00 0.00 H new ATOM 0 HA3 GLY A 101 28.619 1.802 82.926 1.00 0.00 H new ATOM 1555 N LEU A 102 25.513 2.222 83.383 1.00 0.00 N ATOM 1556 CA LEU A 102 24.488 2.563 84.407 1.00 0.00 C ATOM 1557 C LEU A 102 24.199 1.340 85.233 1.00 0.00 C ATOM 1558 O LEU A 102 24.563 1.257 86.383 1.00 0.00 O ATOM 1559 CB LEU A 102 23.159 3.026 83.799 1.00 0.00 C ATOM 1560 CG LEU A 102 22.248 3.520 84.945 1.00 0.00 C ATOM 1561 CD1 LEU A 102 21.104 4.363 84.387 1.00 0.00 C ATOM 1562 CD2 LEU A 102 21.650 2.335 85.718 1.00 0.00 C ATOM 0 H LEU A 102 25.277 2.461 82.420 1.00 0.00 H new ATOM 0 HA LEU A 102 24.898 3.382 84.999 1.00 0.00 H new ATOM 0 HB2 LEU A 102 23.329 3.825 83.078 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.682 2.207 83.261 1.00 0.00 H new ATOM 0 HG LEU A 102 22.860 4.121 85.618 1.00 0.00 H new ATOM 0 HD11 LEU A 102 20.470 4.704 85.206 1.00 0.00 H new ATOM 0 HD12 LEU A 102 21.511 5.226 83.860 1.00 0.00 H new ATOM 0 HD13 LEU A 102 20.512 3.762 83.697 1.00 0.00 H new ATOM 0 HD21 LEU A 102 21.013 2.708 86.520 1.00 0.00 H new ATOM 0 HD22 LEU A 102 21.058 1.720 85.040 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.454 1.735 86.144 1.00 0.00 H new ATOM 1574 N THR A 103 23.497 0.403 84.667 1.00 0.00 N ATOM 1575 CA THR A 103 23.138 -0.796 85.446 1.00 0.00 C ATOM 1576 C THR A 103 23.092 -0.404 86.914 1.00 0.00 C ATOM 1577 O THR A 103 22.162 0.234 87.375 1.00 0.00 O ATOM 1578 CB THR A 103 24.194 -1.888 85.230 1.00 0.00 C ATOM 1579 OG1 THR A 103 24.245 -2.730 86.370 1.00 0.00 O ATOM 1580 CG2 THR A 103 25.568 -1.249 85.002 1.00 0.00 C ATOM 0 H THR A 103 23.161 0.420 83.704 1.00 0.00 H new ATOM 0 HA THR A 103 22.170 -1.182 85.128 1.00 0.00 H new ATOM 0 HB THR A 103 23.925 -2.477 84.353 1.00 0.00 H new ATOM 0 HG1 THR A 103 24.918 -3.428 86.231 1.00 0.00 H new ATOM 0 HG21 THR A 103 26.312 -2.031 84.850 1.00 0.00 H new ATOM 0 HG22 THR A 103 25.529 -0.608 84.121 1.00 0.00 H new ATOM 0 HG23 THR A 103 25.841 -0.653 85.873 1.00 0.00 H new ATOM 1588 N ALA A 104 24.088 -0.764 87.645 1.00 0.00 N ATOM 1589 CA ALA A 104 24.116 -0.428 89.088 1.00 0.00 C ATOM 1590 C ALA A 104 24.926 0.859 89.341 1.00 0.00 C ATOM 1591 O ALA A 104 24.720 1.553 90.326 1.00 0.00 O ATOM 1592 CB ALA A 104 24.750 -1.607 89.833 1.00 0.00 C ATOM 0 H ALA A 104 24.898 -1.284 87.307 1.00 0.00 H new ATOM 0 HA ALA A 104 23.101 -0.250 89.444 1.00 0.00 H new ATOM 0 HB1 ALA A 104 24.784 -1.387 90.900 1.00 0.00 H new ATOM 0 HB2 ALA A 104 24.155 -2.505 89.666 1.00 0.00 H new ATOM 0 HB3 ALA A 104 25.763 -1.769 89.464 1.00 0.00 H new ATOM 1598 N LEU A 105 25.877 1.164 88.492 1.00 0.00 N ATOM 1599 CA LEU A 105 26.747 2.360 88.714 1.00 0.00 C ATOM 1600 C LEU A 105 25.969 3.683 88.813 1.00 0.00 C ATOM 1601 O LEU A 105 25.950 4.313 89.848 1.00 0.00 O ATOM 1602 CB LEU A 105 27.730 2.489 87.561 1.00 0.00 C ATOM 1603 CG LEU A 105 28.399 1.145 87.256 1.00 0.00 C ATOM 1604 CD1 LEU A 105 29.469 1.371 86.188 1.00 0.00 C ATOM 1605 CD2 LEU A 105 29.056 0.584 88.526 1.00 0.00 C ATOM 0 H LEU A 105 26.089 0.631 87.648 1.00 0.00 H new ATOM 0 HA LEU A 105 27.247 2.195 89.668 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.210 2.850 86.674 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.490 3.230 87.808 1.00 0.00 H new ATOM 0 HG LEU A 105 27.653 0.433 86.903 1.00 0.00 H new ATOM 0 HD11 LEU A 105 29.958 0.425 85.957 1.00 0.00 H new ATOM 0 HD12 LEU A 105 29.004 1.770 85.286 1.00 0.00 H new ATOM 0 HD13 LEU A 105 30.209 2.080 86.559 1.00 0.00 H new ATOM 0 HD21 LEU A 105 29.529 -0.372 88.299 1.00 0.00 H new ATOM 0 HD22 LEU A 105 29.809 1.285 88.886 1.00 0.00 H new ATOM 0 HD23 LEU A 105 28.297 0.440 89.295 1.00 0.00 H new ATOM 1617 N GLU A 106 25.381 4.137 87.734 1.00 0.00 N ATOM 1618 CA GLU A 106 24.665 5.448 87.772 1.00 0.00 C ATOM 1619 C GLU A 106 23.295 5.248 88.419 1.00 0.00 C ATOM 1620 O GLU A 106 22.505 6.163 88.531 1.00 0.00 O ATOM 1621 CB GLU A 106 24.561 6.005 86.327 1.00 0.00 C ATOM 1622 CG GLU A 106 23.168 6.578 86.009 1.00 0.00 C ATOM 1623 CD GLU A 106 23.070 8.024 86.498 1.00 0.00 C ATOM 1624 OE1 GLU A 106 23.488 8.289 87.613 1.00 0.00 O ATOM 1625 OE2 GLU A 106 22.565 8.841 85.746 1.00 0.00 O ATOM 0 H GLU A 106 25.366 3.659 86.833 1.00 0.00 H new ATOM 0 HA GLU A 106 25.209 6.178 88.371 1.00 0.00 H new ATOM 0 HB2 GLU A 106 25.310 6.784 86.188 1.00 0.00 H new ATOM 0 HB3 GLU A 106 24.793 5.210 85.618 1.00 0.00 H new ATOM 0 HG2 GLU A 106 22.985 6.536 84.935 1.00 0.00 H new ATOM 0 HG3 GLU A 106 22.399 5.971 86.487 1.00 0.00 H new ATOM 1632 N ALA A 107 23.017 4.049 88.862 1.00 0.00 N ATOM 1633 CA ALA A 107 21.703 3.779 89.507 1.00 0.00 C ATOM 1634 C ALA A 107 21.620 4.348 90.933 1.00 0.00 C ATOM 1635 O ALA A 107 20.619 4.930 91.294 1.00 0.00 O ATOM 1636 CB ALA A 107 21.481 2.270 89.590 1.00 0.00 C ATOM 0 H ALA A 107 23.645 3.247 88.804 1.00 0.00 H new ATOM 0 HA ALA A 107 20.942 4.265 88.896 1.00 0.00 H new ATOM 0 HB1 ALA A 107 20.519 2.069 90.062 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.488 1.845 88.586 1.00 0.00 H new ATOM 0 HB3 ALA A 107 22.277 1.817 90.181 1.00 0.00 H new ATOM 1642 N THR A 108 22.596 4.145 91.785 1.00 0.00 N ATOM 1643 CA THR A 108 22.405 4.658 93.175 1.00 0.00 C ATOM 1644 C THR A 108 23.702 4.806 93.975 1.00 0.00 C ATOM 1645 O THR A 108 24.771 5.061 93.458 1.00 0.00 O ATOM 1646 CB THR A 108 21.534 3.640 93.893 1.00 0.00 C ATOM 1647 OG1 THR A 108 21.209 4.114 95.191 1.00 0.00 O ATOM 1648 CG2 THR A 108 22.319 2.333 94.002 1.00 0.00 C ATOM 0 H THR A 108 23.477 3.669 91.591 1.00 0.00 H new ATOM 0 HA THR A 108 21.968 5.654 93.105 1.00 0.00 H new ATOM 0 HB THR A 108 20.609 3.480 93.339 1.00 0.00 H new ATOM 0 HG1 THR A 108 20.534 3.528 95.594 1.00 0.00 H new ATOM 0 HG21 THR A 108 21.713 1.586 94.515 1.00 0.00 H new ATOM 0 HG22 THR A 108 22.569 1.974 93.004 1.00 0.00 H new ATOM 0 HG23 THR A 108 23.236 2.505 94.566 1.00 0.00 H new ATOM 1656 N ASP A 109 23.566 4.624 95.269 1.00 0.00 N ATOM 1657 CA ASP A 109 24.714 4.713 96.203 1.00 0.00 C ATOM 1658 C ASP A 109 24.522 3.679 97.323 1.00 0.00 C ATOM 1659 O ASP A 109 25.383 3.499 98.160 1.00 0.00 O ATOM 1660 CB ASP A 109 24.794 6.119 96.806 1.00 0.00 C ATOM 1661 CG ASP A 109 26.050 6.235 97.678 1.00 0.00 C ATOM 1662 OD1 ASP A 109 27.090 5.755 97.254 1.00 0.00 O ATOM 1663 OD2 ASP A 109 25.950 6.801 98.754 1.00 0.00 O ATOM 0 H ASP A 109 22.676 4.412 95.720 1.00 0.00 H new ATOM 0 HA ASP A 109 25.640 4.511 95.664 1.00 0.00 H new ATOM 0 HB2 ASP A 109 24.820 6.865 96.012 1.00 0.00 H new ATOM 0 HB3 ASP A 109 23.905 6.321 97.403 1.00 0.00 H new ATOM 1668 N ASN A 110 23.411 2.970 97.328 1.00 0.00 N ATOM 1669 CA ASN A 110 23.216 1.928 98.382 1.00 0.00 C ATOM 1670 C ASN A 110 24.076 0.738 97.965 1.00 0.00 C ATOM 1671 O ASN A 110 24.193 0.425 96.800 1.00 0.00 O ATOM 1672 CB ASN A 110 21.735 1.541 98.522 1.00 0.00 C ATOM 1673 CG ASN A 110 21.145 1.257 97.152 1.00 0.00 C ATOM 1674 OD1 ASN A 110 21.903 0.720 96.252 1.00 0.00 O flip ATOM 1675 ND2 ASN A 110 19.987 1.529 96.902 1.00 0.00 N flip ATOM 0 H ASN A 110 22.647 3.068 96.659 1.00 0.00 H new ATOM 0 HA ASN A 110 23.514 2.298 99.363 1.00 0.00 H new ATOM 0 HB2 ASN A 110 21.638 0.662 99.159 1.00 0.00 H new ATOM 0 HB3 ASN A 110 21.183 2.347 99.006 1.00 0.00 H new ATOM 0 HD21 ASN A 110 19.397 1.952 97.618 1.00 0.00 H new ATOM 0 HD22 ASN A 110 19.606 1.334 95.976 1.00 0.00 H new ATOM 1682 N GLN A 111 24.750 0.149 98.898 1.00 0.00 N ATOM 1683 CA GLN A 111 25.719 -0.947 98.590 1.00 0.00 C ATOM 1684 C GLN A 111 25.074 -2.279 98.124 1.00 0.00 C ATOM 1685 O GLN A 111 25.781 -3.222 97.833 1.00 0.00 O ATOM 1686 CB GLN A 111 26.566 -1.148 99.852 1.00 0.00 C ATOM 1687 CG GLN A 111 27.287 -2.485 99.828 1.00 0.00 C ATOM 1688 CD GLN A 111 28.399 -2.445 100.877 1.00 0.00 C ATOM 1689 OE1 GLN A 111 28.782 -1.386 101.333 1.00 0.00 O ATOM 1690 NE2 GLN A 111 28.935 -3.556 101.287 1.00 0.00 N ATOM 0 H GLN A 111 24.675 0.380 99.889 1.00 0.00 H new ATOM 0 HA GLN A 111 26.321 -0.645 97.733 1.00 0.00 H new ATOM 0 HB2 GLN A 111 27.294 -0.341 99.935 1.00 0.00 H new ATOM 0 HB3 GLN A 111 25.927 -1.093 100.733 1.00 0.00 H new ATOM 0 HG2 GLN A 111 26.591 -3.296 100.042 1.00 0.00 H new ATOM 0 HG3 GLN A 111 27.704 -2.675 98.839 1.00 0.00 H new ATOM 0 HE21 GLN A 111 28.616 -4.447 100.906 1.00 0.00 H new ATOM 0 HE22 GLN A 111 29.675 -3.537 101.989 1.00 0.00 H new ATOM 1699 N ALA A 112 23.777 -2.388 98.020 1.00 0.00 N ATOM 1700 CA ALA A 112 23.190 -3.694 97.557 1.00 0.00 C ATOM 1701 C ALA A 112 23.156 -3.740 96.023 1.00 0.00 C ATOM 1702 O ALA A 112 23.444 -4.747 95.390 1.00 0.00 O ATOM 1703 CB ALA A 112 21.767 -3.842 98.099 1.00 0.00 C ATOM 0 H ALA A 112 23.104 -1.650 98.229 1.00 0.00 H new ATOM 0 HA ALA A 112 23.809 -4.510 97.929 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.346 -4.789 97.761 1.00 0.00 H new ATOM 0 HB2 ALA A 112 21.789 -3.822 99.189 1.00 0.00 H new ATOM 0 HB3 ALA A 112 21.151 -3.020 97.734 1.00 0.00 H new ATOM 1709 N ILE A 113 22.827 -2.637 95.438 1.00 0.00 N ATOM 1710 CA ILE A 113 22.770 -2.524 93.953 1.00 0.00 C ATOM 1711 C ILE A 113 24.177 -2.667 93.405 1.00 0.00 C ATOM 1712 O ILE A 113 24.466 -3.478 92.538 1.00 0.00 O ATOM 1713 CB ILE A 113 22.279 -1.111 93.625 1.00 0.00 C ATOM 1714 CG1 ILE A 113 20.752 -1.064 93.566 1.00 0.00 C ATOM 1715 CG2 ILE A 113 22.853 -0.642 92.288 1.00 0.00 C ATOM 1716 CD1 ILE A 113 20.170 -1.024 94.985 1.00 0.00 C ATOM 0 H ILE A 113 22.587 -1.779 95.935 1.00 0.00 H new ATOM 0 HA ILE A 113 22.117 -3.286 93.527 1.00 0.00 H new ATOM 0 HB ILE A 113 22.622 -0.447 94.418 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.429 -0.186 93.007 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.374 -1.937 93.034 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.494 0.364 92.071 1.00 0.00 H new ATOM 0 HG22 ILE A 113 23.942 -0.635 92.342 1.00 0.00 H new ATOM 0 HG23 ILE A 113 22.533 -1.320 91.497 1.00 0.00 H new ATOM 0 HD11 ILE A 113 19.082 -0.991 94.931 1.00 0.00 H new ATOM 0 HD12 ILE A 113 20.479 -1.916 95.530 1.00 0.00 H new ATOM 0 HD13 ILE A 113 20.535 -0.137 95.503 1.00 0.00 H new ATOM 1728 N LYS A 114 25.045 -1.858 93.907 1.00 0.00 N ATOM 1729 CA LYS A 114 26.444 -1.883 93.453 1.00 0.00 C ATOM 1730 C LYS A 114 26.964 -3.310 93.614 1.00 0.00 C ATOM 1731 O LYS A 114 27.995 -3.676 93.082 1.00 0.00 O ATOM 1732 CB LYS A 114 27.229 -0.852 94.279 1.00 0.00 C ATOM 1733 CG LYS A 114 26.254 0.266 94.704 1.00 0.00 C ATOM 1734 CD LYS A 114 26.930 1.643 94.657 1.00 0.00 C ATOM 1735 CE LYS A 114 27.085 2.109 93.202 1.00 0.00 C ATOM 1736 NZ LYS A 114 28.517 2.012 92.808 1.00 0.00 N ATOM 0 H LYS A 114 24.840 -1.166 94.628 1.00 0.00 H new ATOM 0 HA LYS A 114 26.554 -1.611 92.403 1.00 0.00 H new ATOM 0 HB2 LYS A 114 27.672 -1.324 95.156 1.00 0.00 H new ATOM 0 HB3 LYS A 114 28.049 -0.439 93.692 1.00 0.00 H new ATOM 0 HG2 LYS A 114 25.385 0.263 94.046 1.00 0.00 H new ATOM 0 HG3 LYS A 114 25.891 0.071 95.713 1.00 0.00 H new ATOM 0 HD2 LYS A 114 26.337 2.366 95.217 1.00 0.00 H new ATOM 0 HD3 LYS A 114 27.908 1.593 95.136 1.00 0.00 H new ATOM 0 HE2 LYS A 114 26.472 1.494 92.543 1.00 0.00 H new ATOM 0 HE3 LYS A 114 26.735 3.136 93.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 28.922 2.967 92.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 29.038 1.469 93.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 28.592 1.533 91.888 1.00 0.00 H new ATOM 1750 N ALA A 115 26.224 -4.136 94.309 1.00 0.00 N ATOM 1751 CA ALA A 115 26.645 -5.550 94.456 1.00 0.00 C ATOM 1752 C ALA A 115 26.590 -6.206 93.077 1.00 0.00 C ATOM 1753 O ALA A 115 27.412 -7.040 92.744 1.00 0.00 O ATOM 1754 CB ALA A 115 25.705 -6.292 95.411 1.00 0.00 C ATOM 0 H ALA A 115 25.352 -3.888 94.777 1.00 0.00 H new ATOM 0 HA ALA A 115 27.654 -5.593 94.865 1.00 0.00 H new ATOM 0 HB1 ALA A 115 26.028 -7.328 95.508 1.00 0.00 H new ATOM 0 HB2 ALA A 115 25.727 -5.812 96.389 1.00 0.00 H new ATOM 0 HB3 ALA A 115 24.689 -6.264 95.016 1.00 0.00 H new ATOM 1760 N LEU A 116 25.632 -5.836 92.256 1.00 0.00 N ATOM 1761 CA LEU A 116 25.571 -6.454 90.899 1.00 0.00 C ATOM 1762 C LEU A 116 26.714 -5.915 90.031 1.00 0.00 C ATOM 1763 O LEU A 116 27.098 -6.538 89.058 1.00 0.00 O ATOM 1764 CB LEU A 116 24.230 -6.142 90.219 1.00 0.00 C ATOM 1765 CG LEU A 116 23.288 -7.362 90.283 1.00 0.00 C ATOM 1766 CD1 LEU A 116 22.052 -7.090 89.432 1.00 0.00 C ATOM 1767 CD2 LEU A 116 23.987 -8.625 89.748 1.00 0.00 C ATOM 0 H LEU A 116 24.907 -5.149 92.464 1.00 0.00 H new ATOM 0 HA LEU A 116 25.668 -7.534 91.010 1.00 0.00 H new ATOM 0 HB2 LEU A 116 23.760 -5.288 90.706 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.400 -5.862 89.179 1.00 0.00 H new ATOM 0 HG LEU A 116 23.009 -7.526 91.324 1.00 0.00 H new ATOM 0 HD11 LEU A 116 21.384 -7.950 89.475 1.00 0.00 H new ATOM 0 HD12 LEU A 116 21.535 -6.210 89.813 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.353 -6.915 88.399 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.302 -9.471 89.804 1.00 0.00 H new ATOM 0 HD22 LEU A 116 24.283 -8.465 88.711 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.871 -8.834 90.350 1.00 0.00 H new ATOM 1779 N LEU A 117 27.269 -4.773 90.361 1.00 0.00 N ATOM 1780 CA LEU A 117 28.391 -4.246 89.524 1.00 0.00 C ATOM 1781 C LEU A 117 29.649 -5.033 89.888 1.00 0.00 C ATOM 1782 O LEU A 117 30.726 -4.799 89.383 1.00 0.00 O ATOM 1783 CB LEU A 117 28.568 -2.731 89.765 1.00 0.00 C ATOM 1784 CG LEU A 117 29.683 -2.426 90.783 1.00 0.00 C ATOM 1785 CD1 LEU A 117 31.054 -2.401 90.089 1.00 0.00 C ATOM 1786 CD2 LEU A 117 29.430 -1.048 91.403 1.00 0.00 C ATOM 0 H LEU A 117 27.000 -4.194 91.157 1.00 0.00 H new ATOM 0 HA LEU A 117 28.182 -4.373 88.462 1.00 0.00 H new ATOM 0 HB2 LEU A 117 28.798 -2.240 88.820 1.00 0.00 H new ATOM 0 HB3 LEU A 117 27.628 -2.310 90.122 1.00 0.00 H new ATOM 0 HG LEU A 117 29.680 -3.202 91.548 1.00 0.00 H new ATOM 0 HD11 LEU A 117 31.830 -2.184 90.823 1.00 0.00 H new ATOM 0 HD12 LEU A 117 31.248 -3.371 89.632 1.00 0.00 H new ATOM 0 HD13 LEU A 117 31.058 -1.630 89.319 1.00 0.00 H new ATOM 0 HD21 LEU A 117 30.215 -0.824 92.125 1.00 0.00 H new ATOM 0 HD22 LEU A 117 29.431 -0.291 90.619 1.00 0.00 H new ATOM 0 HD23 LEU A 117 28.463 -1.047 91.906 1.00 0.00 H new ATOM 1798 N GLN A 118 29.491 -6.001 90.748 1.00 0.00 N ATOM 1799 CA GLN A 118 30.642 -6.855 91.152 1.00 0.00 C ATOM 1800 C GLN A 118 31.106 -7.677 89.946 1.00 0.00 C ATOM 1801 O GLN A 118 30.578 -7.460 88.868 1.00 0.00 O ATOM 1802 CB GLN A 118 30.204 -7.812 92.273 1.00 0.00 C ATOM 1803 CG GLN A 118 29.294 -8.917 91.705 1.00 0.00 C ATOM 1804 CD GLN A 118 30.145 -10.042 91.108 1.00 0.00 C ATOM 1805 OE1 GLN A 118 31.077 -10.510 91.731 1.00 0.00 O ATOM 1806 NE2 GLN A 118 29.862 -10.501 89.918 1.00 0.00 N ATOM 1807 OXT GLN A 118 31.986 -8.506 90.120 1.00 0.00 O ATOM 0 H GLN A 118 28.604 -6.239 91.192 1.00 0.00 H new ATOM 0 HA GLN A 118 31.456 -6.223 91.508 1.00 0.00 H new ATOM 0 HB2 GLN A 118 31.080 -8.259 92.743 1.00 0.00 H new ATOM 0 HB3 GLN A 118 29.675 -7.258 93.048 1.00 0.00 H new ATOM 0 HG2 GLN A 118 28.654 -9.313 92.493 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.638 -8.502 90.940 1.00 0.00 H new ATOM 0 HE21 GLN A 118 29.080 -10.110 89.393 1.00 0.00 H new ATOM 0 HE22 GLN A 118 30.423 -11.251 89.514 1.00 0.00 H new TER 1816 GLN A 118