USER MOD reduce.3.24.130724 H: found=0, std=0, add=625, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 621 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 30 TYR OH : rot 157:sc= 0.287 USER MOD Set 1.2: A 62 HIS : no HD1:sc= -0.0482 K(o=0.24,f=-1.9) USER MOD Set 2.1: A 49 HIS : no HD1:sc= -0.47 K(o=-1.3,f=-0.41) USER MOD Set 2.2: A 63 GLN : amide:sc= -0.822 K(o=-1.3,f=-3.4!) USER MOD Set 3.1: A 6 SER OG : rot 180:sc= 1.07 USER MOD Set 3.2: A 9 SER OG : rot 131:sc= 1.28 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -168:sc= -0.0193 (180deg=-0.177) USER MOD Single : A 12 SER OG : rot 180:sc= -0.0468 USER MOD Single : A 14 SER OG : rot 180:sc= 0.0184 USER MOD Single : A 15 GLN : amide:sc= -0.062 X(o=-0.062,f=-0.0027) USER MOD Single : A 20 MET CE :methyl -112:sc= -0.185 (180deg=-0.723) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0.416 K(o=0.42,f=-0.74) USER MOD Single : A 29 GLN : amide:sc= 0.915 K(o=0.92,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.424 X(o=-0.42,f=-0.92) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0.0526 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.256 USER MOD Single : A 50 GLN : amide:sc=-0.000567 K(o=-0.00057,f=-0.54) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 74 CYS SG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.577 X(o=-0.58,f=-1) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0.109 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.330 0.000 0.000 1.00 0.00 N ATOM 2 CA GLY A 1 2.071 0.001 -1.247 1.00 0.00 C ATOM 3 C GLY A 1 2.455 1.398 -1.693 1.00 0.00 C ATOM 4 O GLY A 1 3.397 1.989 -1.164 1.00 0.00 O ATOM 0 H1 GLY A 1 1.091 -0.978 0.261 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.911 0.427 0.750 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.455 0.551 -0.116 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.973 -0.600 -1.131 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.470 -0.472 -2.023 1.00 0.00 H new ATOM 8 N SER A 2 1.725 1.928 -2.668 1.00 0.00 N ATOM 9 CA SER A 2 1.997 3.263 -3.189 1.00 0.00 C ATOM 10 C SER A 2 0.850 4.216 -2.867 1.00 0.00 C ATOM 11 O SER A 2 1.070 5.383 -2.542 1.00 0.00 O ATOM 12 CB SER A 2 2.220 3.208 -4.701 1.00 0.00 C ATOM 13 OG SER A 2 3.593 3.359 -5.020 1.00 0.00 O ATOM 0 H SER A 2 0.940 1.454 -3.114 1.00 0.00 H new ATOM 0 HA SER A 2 2.902 3.636 -2.709 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.855 2.258 -5.091 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.642 3.995 -5.186 1.00 0.00 H new ATOM 0 HG SER A 2 3.709 3.319 -5.992 1.00 0.00 H new ATOM 19 N SER A 3 -0.376 3.709 -2.959 1.00 0.00 N ATOM 20 CA SER A 3 -1.559 4.515 -2.682 1.00 0.00 C ATOM 21 C SER A 3 -2.665 3.663 -2.068 1.00 0.00 C ATOM 22 O SER A 3 -3.108 3.912 -0.948 1.00 0.00 O ATOM 23 CB SER A 3 -2.063 5.178 -3.965 1.00 0.00 C ATOM 24 OG SER A 3 -2.090 6.589 -3.834 1.00 0.00 O ATOM 0 H SER A 3 -0.575 2.744 -3.223 1.00 0.00 H new ATOM 0 HA SER A 3 -1.281 5.289 -1.967 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.419 4.899 -4.799 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.063 4.812 -4.198 1.00 0.00 H new ATOM 0 HG SER A 3 -2.414 6.989 -4.668 1.00 0.00 H new ATOM 30 N GLY A 4 -3.108 2.654 -2.812 1.00 0.00 N ATOM 31 CA GLY A 4 -4.159 1.779 -2.326 1.00 0.00 C ATOM 32 C GLY A 4 -4.492 0.672 -3.307 1.00 0.00 C ATOM 33 O GLY A 4 -3.667 -0.205 -3.567 1.00 0.00 O ATOM 0 H GLY A 4 -2.758 2.427 -3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.852 1.339 -1.377 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.055 2.367 -2.129 1.00 0.00 H new ATOM 37 N SER A 5 -5.703 0.710 -3.852 1.00 0.00 N ATOM 38 CA SER A 5 -6.145 -0.301 -4.805 1.00 0.00 C ATOM 39 C SER A 5 -6.619 0.346 -6.103 1.00 0.00 C ATOM 40 O SER A 5 -7.690 0.951 -6.153 1.00 0.00 O ATOM 41 CB SER A 5 -7.271 -1.144 -4.202 1.00 0.00 C ATOM 42 OG SER A 5 -7.490 -0.804 -2.844 1.00 0.00 O ATOM 0 H SER A 5 -6.396 1.430 -3.650 1.00 0.00 H new ATOM 0 HA SER A 5 -5.297 -0.948 -5.030 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.188 -0.992 -4.771 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.019 -2.202 -4.280 1.00 0.00 H new ATOM 0 HG SER A 5 -8.215 -1.355 -2.482 1.00 0.00 H new ATOM 48 N SER A 6 -5.812 0.214 -7.151 1.00 0.00 N ATOM 49 CA SER A 6 -6.146 0.788 -8.449 1.00 0.00 C ATOM 50 C SER A 6 -5.756 -0.160 -9.579 1.00 0.00 C ATOM 51 O SER A 6 -4.618 -0.620 -9.654 1.00 0.00 O ATOM 52 CB SER A 6 -5.440 2.134 -8.632 1.00 0.00 C ATOM 53 OG SER A 6 -6.329 3.109 -9.149 1.00 0.00 O ATOM 0 H SER A 6 -4.923 -0.285 -7.126 1.00 0.00 H new ATOM 0 HA SER A 6 -7.224 0.943 -8.483 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.041 2.472 -7.676 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.593 2.015 -9.307 1.00 0.00 H new ATOM 0 HG SER A 6 -5.855 3.960 -9.256 1.00 0.00 H new ATOM 59 N GLY A 7 -6.712 -0.448 -10.458 1.00 0.00 N ATOM 60 CA GLY A 7 -6.451 -1.340 -11.573 1.00 0.00 C ATOM 61 C GLY A 7 -7.069 -0.847 -12.866 1.00 0.00 C ATOM 62 O GLY A 7 -6.398 -0.777 -13.896 1.00 0.00 O ATOM 0 H GLY A 7 -7.662 -0.079 -10.418 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.374 -1.446 -11.706 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.842 -2.331 -11.341 1.00 0.00 H new ATOM 66 N VAL A 8 -8.353 -0.506 -12.815 1.00 0.00 N ATOM 67 CA VAL A 8 -9.062 -0.018 -13.992 1.00 0.00 C ATOM 68 C VAL A 8 -8.453 1.284 -14.499 1.00 0.00 C ATOM 69 O VAL A 8 -8.571 1.618 -15.678 1.00 0.00 O ATOM 70 CB VAL A 8 -10.556 0.208 -13.693 1.00 0.00 C ATOM 71 CG1 VAL A 8 -11.307 0.562 -14.967 1.00 0.00 C ATOM 72 CG2 VAL A 8 -11.159 -1.023 -13.033 1.00 0.00 C ATOM 0 H VAL A 8 -8.923 -0.559 -11.971 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.965 -0.784 -14.761 1.00 0.00 H new ATOM 0 HB VAL A 8 -10.648 1.045 -13.001 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.361 0.718 -14.737 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.890 1.474 -15.394 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.209 -0.252 -15.685 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.215 -0.846 -12.829 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.057 -1.880 -13.699 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.638 -1.227 -12.098 1.00 0.00 H new ATOM 82 N SER A 9 -7.801 2.016 -13.601 1.00 0.00 N ATOM 83 CA SER A 9 -7.176 3.284 -13.957 1.00 0.00 C ATOM 84 C SER A 9 -5.925 3.056 -14.799 1.00 0.00 C ATOM 85 O SER A 9 -5.528 3.913 -15.588 1.00 0.00 O ATOM 86 CB SER A 9 -6.819 4.073 -12.696 1.00 0.00 C ATOM 87 OG SER A 9 -7.437 3.510 -11.551 1.00 0.00 O ATOM 0 H SER A 9 -7.692 1.752 -12.622 1.00 0.00 H new ATOM 0 HA SER A 9 -7.890 3.859 -14.547 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.737 4.081 -12.562 1.00 0.00 H new ATOM 0 HB3 SER A 9 -7.134 5.110 -12.811 1.00 0.00 H new ATOM 0 HG SER A 9 -6.770 3.394 -10.843 1.00 0.00 H new ATOM 93 N LYS A 10 -5.306 1.893 -14.625 1.00 0.00 N ATOM 94 CA LYS A 10 -4.100 1.548 -15.368 1.00 0.00 C ATOM 95 C LYS A 10 -4.404 0.517 -16.450 1.00 0.00 C ATOM 96 O LYS A 10 -3.517 -0.216 -16.889 1.00 0.00 O ATOM 97 CB LYS A 10 -3.029 1.006 -14.419 1.00 0.00 C ATOM 98 CG LYS A 10 -2.771 1.900 -13.218 1.00 0.00 C ATOM 99 CD LYS A 10 -1.321 2.349 -13.158 1.00 0.00 C ATOM 100 CE LYS A 10 -1.065 3.249 -11.959 1.00 0.00 C ATOM 101 NZ LYS A 10 -1.845 4.515 -12.039 1.00 0.00 N ATOM 0 H LYS A 10 -5.620 1.173 -13.975 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.727 2.453 -15.848 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -3.332 0.019 -14.068 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -2.098 0.876 -14.971 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -3.421 2.773 -13.267 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -3.025 1.364 -12.303 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -0.671 1.476 -13.104 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -1.066 2.881 -14.075 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -1.327 2.718 -11.044 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -0.002 3.481 -11.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -1.497 5.183 -11.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -1.733 4.933 -12.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -2.851 4.315 -11.866 1.00 0.00 H new ATOM 115 N TRP A 11 -5.660 0.468 -16.878 1.00 0.00 N ATOM 116 CA TRP A 11 -6.080 -0.472 -17.910 1.00 0.00 C ATOM 117 C TRP A 11 -5.550 -0.052 -19.277 1.00 0.00 C ATOM 118 O TRP A 11 -5.755 1.081 -19.711 1.00 0.00 O ATOM 119 CB TRP A 11 -7.606 -0.571 -17.950 1.00 0.00 C ATOM 120 CG TRP A 11 -8.143 -1.771 -17.231 1.00 0.00 C ATOM 121 CD1 TRP A 11 -7.563 -2.425 -16.181 1.00 0.00 C ATOM 122 CD2 TRP A 11 -9.365 -2.462 -17.510 1.00 0.00 C ATOM 123 NE1 TRP A 11 -8.351 -3.480 -15.791 1.00 0.00 N ATOM 124 CE2 TRP A 11 -9.463 -3.524 -16.590 1.00 0.00 C ATOM 125 CE3 TRP A 11 -10.388 -2.285 -18.446 1.00 0.00 C ATOM 126 CZ2 TRP A 11 -10.542 -4.404 -16.582 1.00 0.00 C ATOM 127 CZ3 TRP A 11 -11.457 -3.160 -18.437 1.00 0.00 C ATOM 128 CH2 TRP A 11 -11.529 -4.208 -17.510 1.00 0.00 C ATOM 0 H TRP A 11 -6.406 1.069 -16.526 1.00 0.00 H new ATOM 0 HA TRP A 11 -5.666 -1.450 -17.665 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -8.033 0.329 -17.508 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -7.934 -0.602 -18.989 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -6.623 -2.152 -15.725 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -8.142 -4.126 -15.030 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -10.343 -1.479 -19.163 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -10.598 -5.213 -15.869 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -12.252 -3.034 -19.158 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -12.379 -4.874 -17.528 1.00 0.00 H new ATOM 139 N SER A 12 -4.867 -0.973 -19.951 1.00 0.00 N ATOM 140 CA SER A 12 -4.304 -0.696 -21.267 1.00 0.00 C ATOM 141 C SER A 12 -5.394 -0.265 -22.244 1.00 0.00 C ATOM 142 O SER A 12 -6.583 -0.506 -22.034 1.00 0.00 O ATOM 143 CB SER A 12 -3.581 -1.932 -21.806 1.00 0.00 C ATOM 144 OG SER A 12 -2.177 -1.741 -21.805 1.00 0.00 O ATOM 0 H SER A 12 -4.691 -1.917 -19.607 1.00 0.00 H new ATOM 0 HA SER A 12 -3.588 0.120 -21.165 1.00 0.00 H new ATOM 0 HB2 SER A 12 -3.834 -2.800 -21.197 1.00 0.00 H new ATOM 0 HB3 SER A 12 -3.922 -2.144 -22.819 1.00 0.00 H new ATOM 0 HG SER A 12 -1.737 -2.545 -22.152 1.00 0.00 H new ATOM 150 N PRO A 13 -4.980 0.390 -23.339 1.00 0.00 N ATOM 151 CA PRO A 13 -5.904 0.869 -24.371 1.00 0.00 C ATOM 152 C PRO A 13 -6.525 -0.272 -25.169 1.00 0.00 C ATOM 153 O PRO A 13 -7.572 -0.107 -25.795 1.00 0.00 O ATOM 154 CB PRO A 13 -5.015 1.729 -25.272 1.00 0.00 C ATOM 155 CG PRO A 13 -3.642 1.184 -25.081 1.00 0.00 C ATOM 156 CD PRO A 13 -3.579 0.713 -23.654 1.00 0.00 C ATOM 0 HA PRO A 13 -6.749 1.408 -23.942 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -5.326 1.662 -26.315 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -5.066 2.781 -24.991 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -3.448 0.363 -25.772 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.889 1.948 -25.274 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.932 -0.158 -23.546 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -3.186 1.486 -22.993 1.00 0.00 H new ATOM 164 N SER A 14 -5.873 -1.431 -25.140 1.00 0.00 N ATOM 165 CA SER A 14 -6.360 -2.599 -25.864 1.00 0.00 C ATOM 166 C SER A 14 -7.213 -3.482 -24.959 1.00 0.00 C ATOM 167 O SER A 14 -8.081 -4.217 -25.430 1.00 0.00 O ATOM 168 CB SER A 14 -5.186 -3.406 -26.422 1.00 0.00 C ATOM 169 OG SER A 14 -3.961 -2.718 -26.235 1.00 0.00 O ATOM 0 H SER A 14 -5.007 -1.585 -24.623 1.00 0.00 H new ATOM 0 HA SER A 14 -6.978 -2.251 -26.691 1.00 0.00 H new ATOM 0 HB2 SER A 14 -5.141 -4.377 -25.929 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.342 -3.595 -27.484 1.00 0.00 H new ATOM 0 HG SER A 14 -3.226 -3.255 -26.598 1.00 0.00 H new ATOM 175 N GLN A 15 -6.959 -3.404 -23.656 1.00 0.00 N ATOM 176 CA GLN A 15 -7.703 -4.197 -22.684 1.00 0.00 C ATOM 177 C GLN A 15 -9.162 -3.757 -22.626 1.00 0.00 C ATOM 178 O GLN A 15 -10.072 -4.586 -22.630 1.00 0.00 O ATOM 179 CB GLN A 15 -7.065 -4.074 -21.300 1.00 0.00 C ATOM 180 CG GLN A 15 -5.881 -5.004 -21.091 1.00 0.00 C ATOM 181 CD GLN A 15 -6.187 -6.131 -20.124 1.00 0.00 C ATOM 182 OE1 GLN A 15 -5.401 -6.421 -19.222 1.00 0.00 O ATOM 183 NE2 GLN A 15 -7.334 -6.774 -20.309 1.00 0.00 N ATOM 0 H GLN A 15 -6.244 -2.800 -23.250 1.00 0.00 H new ATOM 0 HA GLN A 15 -7.670 -5.240 -23.000 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -6.739 -3.045 -21.150 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -7.819 -4.283 -20.541 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -5.581 -5.425 -22.051 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -5.034 -4.429 -20.717 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -7.955 -6.500 -21.070 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -7.594 -7.542 -19.690 1.00 0.00 H new ATOM 192 N VAL A 16 -9.378 -2.446 -22.570 1.00 0.00 N ATOM 193 CA VAL A 16 -10.727 -1.896 -22.512 1.00 0.00 C ATOM 194 C VAL A 16 -11.601 -2.462 -23.625 1.00 0.00 C ATOM 195 O VAL A 16 -12.808 -2.635 -23.455 1.00 0.00 O ATOM 196 CB VAL A 16 -10.711 -0.359 -22.617 1.00 0.00 C ATOM 197 CG1 VAL A 16 -12.128 0.193 -22.581 1.00 0.00 C ATOM 198 CG2 VAL A 16 -9.866 0.242 -21.505 1.00 0.00 C ATOM 0 H VAL A 16 -8.636 -1.746 -22.564 1.00 0.00 H new ATOM 0 HA VAL A 16 -11.144 -2.183 -21.547 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.263 -0.081 -23.571 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -12.097 1.280 -22.656 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -12.698 -0.213 -23.417 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -12.606 -0.092 -21.644 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -9.866 1.328 -21.595 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -10.281 -0.042 -20.538 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -8.844 -0.129 -21.584 1.00 0.00 H new ATOM 208 N VAL A 17 -10.983 -2.750 -24.767 1.00 0.00 N ATOM 209 CA VAL A 17 -11.704 -3.298 -25.909 1.00 0.00 C ATOM 210 C VAL A 17 -12.325 -4.648 -25.570 1.00 0.00 C ATOM 211 O VAL A 17 -13.445 -4.949 -25.984 1.00 0.00 O ATOM 212 CB VAL A 17 -10.779 -3.463 -27.130 1.00 0.00 C ATOM 213 CG1 VAL A 17 -11.542 -4.061 -28.301 1.00 0.00 C ATOM 214 CG2 VAL A 17 -10.160 -2.127 -27.513 1.00 0.00 C ATOM 0 H VAL A 17 -9.985 -2.613 -24.925 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.495 -2.589 -26.154 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.974 -4.148 -26.864 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -10.872 -4.170 -29.154 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -11.933 -5.039 -28.019 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -12.369 -3.404 -28.570 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.510 -2.262 -28.377 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.950 -1.418 -27.760 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -9.577 -1.743 -26.676 1.00 0.00 H new ATOM 224 N ASP A 18 -11.591 -5.458 -24.815 1.00 0.00 N ATOM 225 CA ASP A 18 -12.070 -6.777 -24.418 1.00 0.00 C ATOM 226 C ASP A 18 -13.274 -6.660 -23.487 1.00 0.00 C ATOM 227 O ASP A 18 -14.131 -7.543 -23.452 1.00 0.00 O ATOM 228 CB ASP A 18 -10.953 -7.564 -23.731 1.00 0.00 C ATOM 229 CG ASP A 18 -11.173 -9.062 -23.802 1.00 0.00 C ATOM 230 OD1 ASP A 18 -12.343 -9.494 -23.739 1.00 0.00 O ATOM 231 OD2 ASP A 18 -10.175 -9.803 -23.920 1.00 0.00 O ATOM 0 H ASP A 18 -10.662 -5.224 -24.465 1.00 0.00 H new ATOM 0 HA ASP A 18 -12.379 -7.310 -25.317 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -9.999 -7.317 -24.197 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -10.886 -7.258 -22.687 1.00 0.00 H new ATOM 236 N TRP A 19 -13.329 -5.567 -22.735 1.00 0.00 N ATOM 237 CA TRP A 19 -14.427 -5.336 -21.803 1.00 0.00 C ATOM 238 C TRP A 19 -15.733 -5.090 -22.551 1.00 0.00 C ATOM 239 O TRP A 19 -16.778 -5.627 -22.185 1.00 0.00 O ATOM 240 CB TRP A 19 -14.111 -4.146 -20.896 1.00 0.00 C ATOM 241 CG TRP A 19 -15.261 -3.743 -20.023 1.00 0.00 C ATOM 242 CD1 TRP A 19 -15.837 -4.486 -19.033 1.00 0.00 C ATOM 243 CD2 TRP A 19 -15.974 -2.502 -20.063 1.00 0.00 C ATOM 244 NE1 TRP A 19 -16.866 -3.782 -18.455 1.00 0.00 N ATOM 245 CE2 TRP A 19 -16.970 -2.562 -19.068 1.00 0.00 C ATOM 246 CE3 TRP A 19 -15.867 -1.346 -20.840 1.00 0.00 C ATOM 247 CZ2 TRP A 19 -17.851 -1.510 -18.833 1.00 0.00 C ATOM 248 CZ3 TRP A 19 -16.743 -0.303 -20.606 1.00 0.00 C ATOM 249 CH2 TRP A 19 -17.724 -0.390 -19.610 1.00 0.00 C ATOM 0 H TRP A 19 -12.627 -4.827 -22.752 1.00 0.00 H new ATOM 0 HA TRP A 19 -14.545 -6.229 -21.190 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -13.256 -4.395 -20.267 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -13.817 -3.297 -21.512 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -15.529 -5.481 -18.746 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -17.457 -4.114 -17.693 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -15.113 -1.269 -21.610 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -18.608 -1.575 -18.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -16.670 0.595 -21.202 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -18.393 0.443 -19.452 1.00 0.00 H new ATOM 260 N MET A 20 -15.665 -4.275 -23.598 1.00 0.00 N ATOM 261 CA MET A 20 -16.844 -3.959 -24.397 1.00 0.00 C ATOM 262 C MET A 20 -17.404 -5.214 -25.059 1.00 0.00 C ATOM 263 O MET A 20 -18.583 -5.270 -25.409 1.00 0.00 O ATOM 264 CB MET A 20 -16.499 -2.917 -25.463 1.00 0.00 C ATOM 265 CG MET A 20 -15.902 -1.640 -24.894 1.00 0.00 C ATOM 266 SD MET A 20 -17.113 -0.313 -24.746 1.00 0.00 S ATOM 267 CE MET A 20 -17.396 0.081 -26.471 1.00 0.00 C ATOM 0 H MET A 20 -14.807 -3.822 -23.913 1.00 0.00 H new ATOM 0 HA MET A 20 -17.605 -3.550 -23.732 1.00 0.00 H new ATOM 0 HB2 MET A 20 -15.795 -3.353 -26.171 1.00 0.00 H new ATOM 0 HB3 MET A 20 -17.401 -2.669 -26.022 1.00 0.00 H new ATOM 0 HG2 MET A 20 -15.476 -1.849 -23.913 1.00 0.00 H new ATOM 0 HG3 MET A 20 -15.083 -1.310 -25.534 1.00 0.00 H new ATOM 0 HE1 MET A 20 -17.000 1.073 -26.687 1.00 0.00 H new ATOM 0 HE2 MET A 20 -16.894 -0.655 -27.099 1.00 0.00 H new ATOM 0 HE3 MET A 20 -18.466 0.065 -26.677 1.00 0.00 H new ATOM 277 N LYS A 21 -16.551 -6.219 -25.228 1.00 0.00 N ATOM 278 CA LYS A 21 -16.961 -7.474 -25.847 1.00 0.00 C ATOM 279 C LYS A 21 -17.941 -8.227 -24.954 1.00 0.00 C ATOM 280 O LYS A 21 -18.583 -9.183 -25.388 1.00 0.00 O ATOM 281 CB LYS A 21 -15.738 -8.349 -26.131 1.00 0.00 C ATOM 282 CG LYS A 21 -14.740 -7.711 -27.081 1.00 0.00 C ATOM 283 CD LYS A 21 -13.956 -8.758 -27.854 1.00 0.00 C ATOM 284 CE LYS A 21 -13.548 -8.248 -29.228 1.00 0.00 C ATOM 285 NZ LYS A 21 -13.267 -9.364 -30.173 1.00 0.00 N ATOM 0 H LYS A 21 -15.572 -6.189 -24.945 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.460 -7.240 -26.787 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.237 -8.575 -25.190 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -16.071 -9.298 -26.551 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.266 -7.060 -27.780 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -14.051 -7.082 -26.517 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.066 -9.038 -27.290 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.560 -9.659 -27.964 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.342 -7.621 -29.633 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.662 -7.620 -29.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.992 -8.975 -31.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.492 -9.949 -29.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.120 -9.949 -30.283 1.00 0.00 H new ATOM 299 N GLY A 22 -18.053 -7.788 -23.704 1.00 0.00 N ATOM 300 CA GLY A 22 -18.959 -8.431 -22.770 1.00 0.00 C ATOM 301 C GLY A 22 -20.072 -7.509 -22.313 1.00 0.00 C ATOM 302 O GLY A 22 -20.680 -7.730 -21.265 1.00 0.00 O ATOM 0 H GLY A 22 -17.533 -6.999 -23.321 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -19.393 -9.314 -23.239 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -18.397 -8.775 -21.902 1.00 0.00 H new ATOM 306 N LEU A 23 -20.339 -6.472 -23.099 1.00 0.00 N ATOM 307 CA LEU A 23 -21.385 -5.511 -22.769 1.00 0.00 C ATOM 308 C LEU A 23 -22.547 -5.611 -23.752 1.00 0.00 C ATOM 309 O LEU A 23 -22.610 -6.537 -24.561 1.00 0.00 O ATOM 310 CB LEU A 23 -20.819 -4.090 -22.773 1.00 0.00 C ATOM 311 CG LEU A 23 -19.549 -3.870 -21.950 1.00 0.00 C ATOM 312 CD1 LEU A 23 -19.136 -2.407 -21.986 1.00 0.00 C ATOM 313 CD2 LEU A 23 -19.757 -4.333 -20.515 1.00 0.00 C ATOM 0 H LEU A 23 -19.845 -6.275 -23.970 1.00 0.00 H new ATOM 0 HA LEU A 23 -21.757 -5.745 -21.771 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -20.613 -3.806 -23.805 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -21.589 -3.413 -22.403 1.00 0.00 H new ATOM 0 HG LEU A 23 -18.747 -4.463 -22.389 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -18.231 -2.270 -21.395 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -18.945 -2.108 -23.017 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -19.936 -1.793 -21.572 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -18.843 -4.169 -19.944 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -20.573 -3.767 -20.065 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -20.004 -5.395 -20.507 1.00 0.00 H new ATOM 325 N ASP A 24 -23.462 -4.651 -23.678 1.00 0.00 N ATOM 326 CA ASP A 24 -24.620 -4.629 -24.564 1.00 0.00 C ATOM 327 C ASP A 24 -24.191 -4.752 -26.023 1.00 0.00 C ATOM 328 O ASP A 24 -23.099 -4.323 -26.397 1.00 0.00 O ATOM 329 CB ASP A 24 -25.419 -3.341 -24.362 1.00 0.00 C ATOM 330 CG ASP A 24 -26.914 -3.589 -24.304 1.00 0.00 C ATOM 331 OD1 ASP A 24 -27.476 -4.063 -25.314 1.00 0.00 O ATOM 332 OD2 ASP A 24 -27.521 -3.311 -23.249 1.00 0.00 O ATOM 0 H ASP A 24 -23.424 -3.878 -23.014 1.00 0.00 H new ATOM 0 HA ASP A 24 -25.252 -5.482 -24.317 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -25.098 -2.859 -23.439 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -25.200 -2.650 -25.176 1.00 0.00 H new ATOM 337 N ASP A 25 -25.056 -5.341 -26.841 1.00 0.00 N ATOM 338 CA ASP A 25 -24.767 -5.520 -28.259 1.00 0.00 C ATOM 339 C ASP A 25 -24.715 -4.176 -28.978 1.00 0.00 C ATOM 340 O ASP A 25 -24.046 -4.034 -30.002 1.00 0.00 O ATOM 341 CB ASP A 25 -25.821 -6.419 -28.907 1.00 0.00 C ATOM 342 CG ASP A 25 -25.259 -7.764 -29.323 1.00 0.00 C ATOM 343 OD1 ASP A 25 -24.795 -8.513 -28.438 1.00 0.00 O ATOM 344 OD2 ASP A 25 -25.282 -8.067 -30.535 1.00 0.00 O ATOM 0 H ASP A 25 -25.963 -5.703 -26.547 1.00 0.00 H new ATOM 0 HA ASP A 25 -23.791 -5.996 -28.347 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -26.643 -6.573 -28.208 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -26.236 -5.916 -29.781 1.00 0.00 H new ATOM 349 N CYS A 26 -25.426 -3.194 -28.435 1.00 0.00 N ATOM 350 CA CYS A 26 -25.463 -1.860 -29.026 1.00 0.00 C ATOM 351 C CYS A 26 -24.123 -1.153 -28.857 1.00 0.00 C ATOM 352 O CYS A 26 -23.792 -0.237 -29.611 1.00 0.00 O ATOM 353 CB CYS A 26 -26.577 -1.028 -28.388 1.00 0.00 C ATOM 354 SG CYS A 26 -28.242 -1.503 -28.908 1.00 0.00 S ATOM 0 H CYS A 26 -25.984 -3.296 -27.587 1.00 0.00 H new ATOM 0 HA CYS A 26 -25.664 -1.967 -30.092 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -26.507 -1.117 -27.304 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -26.417 0.022 -28.632 1.00 0.00 H new ATOM 0 HG CYS A 26 -29.115 -0.745 -28.314 1.00 0.00 H new ATOM 360 N LEU A 27 -23.354 -1.583 -27.862 1.00 0.00 N ATOM 361 CA LEU A 27 -22.049 -0.990 -27.592 1.00 0.00 C ATOM 362 C LEU A 27 -20.939 -1.783 -28.275 1.00 0.00 C ATOM 363 O LEU A 27 -19.778 -1.713 -27.874 1.00 0.00 O ATOM 364 CB LEU A 27 -21.796 -0.931 -26.084 1.00 0.00 C ATOM 365 CG LEU A 27 -23.006 -0.591 -25.213 1.00 0.00 C ATOM 366 CD1 LEU A 27 -22.681 -0.801 -23.743 1.00 0.00 C ATOM 367 CD2 LEU A 27 -23.458 0.841 -25.463 1.00 0.00 C ATOM 0 H LEU A 27 -23.612 -2.340 -27.229 1.00 0.00 H new ATOM 0 HA LEU A 27 -22.047 0.023 -27.994 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -21.403 -1.896 -25.764 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -21.018 -0.191 -25.895 1.00 0.00 H new ATOM 0 HG LEU A 27 -23.823 -1.260 -25.482 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -23.554 -0.554 -23.139 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -22.407 -1.843 -23.576 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -21.849 -0.157 -23.459 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -24.320 1.065 -24.835 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -22.645 1.526 -25.222 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -23.733 0.958 -26.511 1.00 0.00 H new ATOM 379 N GLN A 28 -21.305 -2.534 -29.308 1.00 0.00 N ATOM 380 CA GLN A 28 -20.339 -3.338 -30.048 1.00 0.00 C ATOM 381 C GLN A 28 -19.766 -2.555 -31.224 1.00 0.00 C ATOM 382 O GLN A 28 -18.552 -2.520 -31.424 1.00 0.00 O ATOM 383 CB GLN A 28 -20.994 -4.626 -30.548 1.00 0.00 C ATOM 384 CG GLN A 28 -21.487 -5.532 -29.432 1.00 0.00 C ATOM 385 CD GLN A 28 -20.357 -6.088 -28.588 1.00 0.00 C ATOM 386 OE1 GLN A 28 -19.380 -6.623 -29.114 1.00 0.00 O ATOM 387 NE2 GLN A 28 -20.483 -5.964 -27.272 1.00 0.00 N ATOM 0 H GLN A 28 -22.263 -2.603 -29.652 1.00 0.00 H new ATOM 0 HA GLN A 28 -19.522 -3.592 -29.373 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -21.834 -4.369 -31.194 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -20.277 -5.174 -31.160 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -22.172 -4.975 -28.793 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -22.053 -6.358 -29.863 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -21.310 -5.514 -26.879 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -19.753 -6.319 -26.654 1.00 0.00 H new ATOM 396 N GLN A 29 -20.646 -1.929 -31.998 1.00 0.00 N ATOM 397 CA GLN A 29 -20.226 -1.147 -33.155 1.00 0.00 C ATOM 398 C GLN A 29 -19.223 -0.072 -32.750 1.00 0.00 C ATOM 399 O GLN A 29 -18.406 0.366 -33.561 1.00 0.00 O ATOM 400 CB GLN A 29 -21.439 -0.502 -33.828 1.00 0.00 C ATOM 401 CG GLN A 29 -22.178 0.482 -32.937 1.00 0.00 C ATOM 402 CD GLN A 29 -23.648 0.599 -33.289 1.00 0.00 C ATOM 403 OE1 GLN A 29 -24.009 0.741 -34.458 1.00 0.00 O ATOM 404 NE2 GLN A 29 -24.506 0.538 -32.277 1.00 0.00 N ATOM 0 H GLN A 29 -21.654 -1.948 -31.845 1.00 0.00 H new ATOM 0 HA GLN A 29 -19.743 -1.821 -33.862 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -21.112 0.014 -34.731 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -22.129 -1.285 -34.141 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -22.081 0.168 -31.898 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -21.710 1.463 -33.019 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -24.163 0.420 -31.324 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -25.508 0.610 -32.453 1.00 0.00 H new ATOM 413 N TYR A 30 -19.290 0.349 -31.492 1.00 0.00 N ATOM 414 CA TYR A 30 -18.389 1.375 -30.980 1.00 0.00 C ATOM 415 C TYR A 30 -17.002 0.799 -30.715 1.00 0.00 C ATOM 416 O TYR A 30 -16.003 1.520 -30.741 1.00 0.00 O ATOM 417 CB TYR A 30 -18.954 1.986 -29.697 1.00 0.00 C ATOM 418 CG TYR A 30 -20.347 2.553 -29.858 1.00 0.00 C ATOM 419 CD1 TYR A 30 -20.688 3.301 -30.977 1.00 0.00 C ATOM 420 CD2 TYR A 30 -21.321 2.340 -28.890 1.00 0.00 C ATOM 421 CE1 TYR A 30 -21.959 3.822 -31.128 1.00 0.00 C ATOM 422 CE2 TYR A 30 -22.594 2.856 -29.033 1.00 0.00 C ATOM 423 CZ TYR A 30 -22.908 3.597 -30.153 1.00 0.00 C ATOM 424 OH TYR A 30 -24.175 4.113 -30.300 1.00 0.00 O ATOM 0 H TYR A 30 -19.959 -0.004 -30.808 1.00 0.00 H new ATOM 0 HA TYR A 30 -18.300 2.155 -31.737 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -18.969 1.224 -28.918 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -18.286 2.777 -29.357 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -19.947 3.479 -31.743 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -21.078 1.761 -28.011 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -22.208 4.402 -32.004 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -23.340 2.680 -28.272 1.00 0.00 H new ATOM 0 HH TYR A 30 -24.807 3.586 -29.767 1.00 0.00 H new ATOM 434 N ILE A 31 -16.948 -0.504 -30.461 1.00 0.00 N ATOM 435 CA ILE A 31 -15.684 -1.178 -30.193 1.00 0.00 C ATOM 436 C ILE A 31 -14.659 -0.876 -31.281 1.00 0.00 C ATOM 437 O ILE A 31 -13.506 -0.555 -30.991 1.00 0.00 O ATOM 438 CB ILE A 31 -15.871 -2.703 -30.089 1.00 0.00 C ATOM 439 CG1 ILE A 31 -16.895 -3.040 -29.003 1.00 0.00 C ATOM 440 CG2 ILE A 31 -14.540 -3.381 -29.797 1.00 0.00 C ATOM 441 CD1 ILE A 31 -17.162 -4.523 -28.864 1.00 0.00 C ATOM 0 H ILE A 31 -17.765 -1.114 -30.435 1.00 0.00 H new ATOM 0 HA ILE A 31 -15.320 -0.799 -29.238 1.00 0.00 H new ATOM 0 HB ILE A 31 -16.245 -3.074 -31.043 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -16.541 -2.652 -28.048 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -17.832 -2.530 -29.227 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -14.688 -4.459 -29.726 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -13.837 -3.163 -30.601 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -14.140 -3.007 -28.854 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -17.897 -4.688 -28.076 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -17.546 -4.913 -29.806 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -16.235 -5.037 -28.609 1.00 0.00 H new ATOM 453 N LYS A 32 -15.086 -0.979 -32.535 1.00 0.00 N ATOM 454 CA LYS A 32 -14.207 -0.714 -33.667 1.00 0.00 C ATOM 455 C LYS A 32 -13.580 0.672 -33.557 1.00 0.00 C ATOM 456 O LYS A 32 -12.490 0.913 -34.074 1.00 0.00 O ATOM 457 CB LYS A 32 -14.985 -0.831 -34.981 1.00 0.00 C ATOM 458 CG LYS A 32 -15.431 -2.247 -35.299 1.00 0.00 C ATOM 459 CD LYS A 32 -15.741 -2.415 -36.777 1.00 0.00 C ATOM 460 CE LYS A 32 -17.204 -2.129 -37.077 1.00 0.00 C ATOM 461 NZ LYS A 32 -17.422 -1.794 -38.511 1.00 0.00 N ATOM 0 H LYS A 32 -16.037 -1.244 -32.793 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.409 -1.456 -33.657 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -15.862 -0.185 -34.933 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -14.362 -0.463 -35.796 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -14.650 -2.949 -35.008 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -16.315 -2.492 -34.711 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -15.111 -1.743 -37.360 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -15.497 -3.431 -37.088 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -17.806 -2.998 -36.812 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -17.547 -1.302 -36.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -18.432 -1.606 -38.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -16.868 -0.949 -38.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -17.119 -2.593 -39.104 1.00 0.00 H new ATOM 475 N ASN A 33 -14.276 1.579 -32.880 1.00 0.00 N ATOM 476 CA ASN A 33 -13.786 2.941 -32.701 1.00 0.00 C ATOM 477 C ASN A 33 -12.852 3.030 -31.498 1.00 0.00 C ATOM 478 O ASN A 33 -11.944 3.860 -31.464 1.00 0.00 O ATOM 479 CB ASN A 33 -14.959 3.908 -32.523 1.00 0.00 C ATOM 480 CG ASN A 33 -15.816 4.013 -33.769 1.00 0.00 C ATOM 481 OD1 ASN A 33 -15.341 3.791 -34.883 1.00 0.00 O ATOM 482 ND2 ASN A 33 -17.086 4.354 -33.587 1.00 0.00 N ATOM 0 H ASN A 33 -15.181 1.396 -32.446 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.226 3.219 -33.594 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.576 3.576 -31.688 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -14.576 4.895 -32.264 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -17.711 4.441 -34.389 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -17.437 4.529 -32.645 1.00 0.00 H new ATOM 489 N PHE A 34 -13.082 2.168 -30.513 1.00 0.00 N ATOM 490 CA PHE A 34 -12.261 2.149 -29.307 1.00 0.00 C ATOM 491 C PHE A 34 -10.898 1.524 -29.587 1.00 0.00 C ATOM 492 O PHE A 34 -9.916 1.821 -28.907 1.00 0.00 O ATOM 493 CB PHE A 34 -12.971 1.375 -28.194 1.00 0.00 C ATOM 494 CG PHE A 34 -13.868 2.231 -27.347 1.00 0.00 C ATOM 495 CD1 PHE A 34 -14.850 3.016 -27.929 1.00 0.00 C ATOM 496 CD2 PHE A 34 -13.730 2.250 -25.969 1.00 0.00 C ATOM 497 CE1 PHE A 34 -15.677 3.805 -27.152 1.00 0.00 C ATOM 498 CE2 PHE A 34 -14.554 3.037 -25.186 1.00 0.00 C ATOM 499 CZ PHE A 34 -15.529 3.815 -25.779 1.00 0.00 C ATOM 0 H PHE A 34 -13.829 1.474 -30.526 1.00 0.00 H new ATOM 0 HA PHE A 34 -12.109 3.179 -28.984 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -13.561 0.574 -28.639 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -12.223 0.904 -27.556 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -14.971 3.011 -29.002 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -12.970 1.643 -25.501 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.438 4.413 -27.618 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -14.435 3.043 -24.113 1.00 0.00 H new ATOM 0 HZ PHE A 34 -16.175 4.430 -25.170 1.00 0.00 H new ATOM 509 N GLU A 35 -10.847 0.656 -30.593 1.00 0.00 N ATOM 510 CA GLU A 35 -9.604 -0.013 -30.962 1.00 0.00 C ATOM 511 C GLU A 35 -8.636 0.965 -31.621 1.00 0.00 C ATOM 512 O GLU A 35 -7.436 0.946 -31.347 1.00 0.00 O ATOM 513 CB GLU A 35 -9.889 -1.181 -31.908 1.00 0.00 C ATOM 514 CG GLU A 35 -9.382 -2.518 -31.394 1.00 0.00 C ATOM 515 CD GLU A 35 -7.870 -2.570 -31.295 1.00 0.00 C ATOM 516 OE1 GLU A 35 -7.197 -1.994 -32.176 1.00 0.00 O ATOM 517 OE2 GLU A 35 -7.359 -3.186 -30.336 1.00 0.00 O ATOM 0 H GLU A 35 -11.651 0.400 -31.166 1.00 0.00 H new ATOM 0 HA GLU A 35 -9.143 -0.397 -30.052 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -10.964 -1.249 -32.074 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -9.430 -0.975 -32.875 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -9.813 -2.713 -30.412 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -9.726 -3.312 -32.057 1.00 0.00 H new ATOM 524 N ARG A 36 -9.166 1.818 -32.492 1.00 0.00 N ATOM 525 CA ARG A 36 -8.349 2.802 -33.192 1.00 0.00 C ATOM 526 C ARG A 36 -8.061 4.004 -32.297 1.00 0.00 C ATOM 527 O ARG A 36 -7.008 4.631 -32.405 1.00 0.00 O ATOM 528 CB ARG A 36 -9.051 3.261 -34.471 1.00 0.00 C ATOM 529 CG ARG A 36 -8.102 3.498 -35.635 1.00 0.00 C ATOM 530 CD ARG A 36 -8.549 2.746 -36.879 1.00 0.00 C ATOM 531 NE ARG A 36 -7.907 3.258 -38.087 1.00 0.00 N ATOM 532 CZ ARG A 36 -7.964 2.645 -39.265 1.00 0.00 C ATOM 533 NH1 ARG A 36 -8.629 1.506 -39.392 1.00 0.00 N ATOM 534 NH2 ARG A 36 -7.354 3.173 -40.318 1.00 0.00 N ATOM 0 H ARG A 36 -10.158 1.847 -32.730 1.00 0.00 H new ATOM 0 HA ARG A 36 -7.402 2.331 -33.455 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -9.787 2.511 -34.760 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -9.597 4.182 -34.265 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -8.050 4.565 -35.852 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -7.097 3.180 -35.357 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -8.317 1.687 -36.766 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -9.631 2.826 -36.982 1.00 0.00 H new ATOM 0 HE ARG A 36 -7.387 4.133 -38.023 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -9.099 1.097 -38.584 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -8.671 1.038 -40.297 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -6.841 4.050 -40.224 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -7.398 2.702 -41.222 1.00 0.00 H new ATOM 548 N GLU A 37 -9.005 4.319 -31.415 1.00 0.00 N ATOM 549 CA GLU A 37 -8.852 5.447 -30.504 1.00 0.00 C ATOM 550 C GLU A 37 -7.907 5.097 -29.358 1.00 0.00 C ATOM 551 O GLU A 37 -7.338 5.979 -28.715 1.00 0.00 O ATOM 552 CB GLU A 37 -10.213 5.869 -29.946 1.00 0.00 C ATOM 553 CG GLU A 37 -11.059 6.653 -30.934 1.00 0.00 C ATOM 554 CD GLU A 37 -10.567 8.075 -31.124 1.00 0.00 C ATOM 555 OE1 GLU A 37 -9.475 8.251 -31.703 1.00 0.00 O ATOM 556 OE2 GLU A 37 -11.273 9.011 -30.693 1.00 0.00 O ATOM 0 H GLU A 37 -9.883 3.809 -31.312 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.424 6.278 -31.065 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -10.761 4.979 -29.637 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.058 6.474 -29.053 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -11.057 6.140 -31.896 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -12.092 6.673 -30.586 1.00 0.00 H new ATOM 563 N LYS A 38 -7.743 3.802 -29.109 1.00 0.00 N ATOM 564 CA LYS A 38 -6.867 3.332 -28.042 1.00 0.00 C ATOM 565 C LYS A 38 -7.308 3.888 -26.692 1.00 0.00 C ATOM 566 O LYS A 38 -6.481 4.325 -25.891 1.00 0.00 O ATOM 567 CB LYS A 38 -5.420 3.740 -28.326 1.00 0.00 C ATOM 568 CG LYS A 38 -4.922 3.306 -29.694 1.00 0.00 C ATOM 569 CD LYS A 38 -3.876 2.209 -29.584 1.00 0.00 C ATOM 570 CE LYS A 38 -3.336 1.815 -30.950 1.00 0.00 C ATOM 571 NZ LYS A 38 -1.890 2.143 -31.091 1.00 0.00 N ATOM 0 H LYS A 38 -8.206 3.059 -29.632 1.00 0.00 H new ATOM 0 HA LYS A 38 -6.931 2.244 -28.005 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.334 4.824 -28.245 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -4.774 3.311 -27.560 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.761 2.951 -30.292 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.498 4.163 -30.217 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -3.056 2.549 -28.952 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.312 1.336 -29.098 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.482 0.746 -31.104 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.902 2.329 -31.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -1.560 1.859 -32.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -1.753 3.167 -30.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -1.346 1.633 -30.366 1.00 0.00 H new ATOM 585 N ILE A 39 -8.613 3.867 -26.446 1.00 0.00 N ATOM 586 CA ILE A 39 -9.162 4.366 -25.191 1.00 0.00 C ATOM 587 C ILE A 39 -8.571 3.623 -23.998 1.00 0.00 C ATOM 588 O ILE A 39 -8.856 2.445 -23.784 1.00 0.00 O ATOM 589 CB ILE A 39 -10.696 4.233 -25.155 1.00 0.00 C ATOM 590 CG1 ILE A 39 -11.323 4.997 -26.323 1.00 0.00 C ATOM 591 CG2 ILE A 39 -11.241 4.742 -23.829 1.00 0.00 C ATOM 592 CD1 ILE A 39 -10.994 6.474 -26.325 1.00 0.00 C ATOM 0 H ILE A 39 -9.310 3.510 -27.099 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.895 5.421 -25.128 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.957 3.179 -25.252 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -10.982 4.556 -27.260 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -12.405 4.874 -26.288 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.326 4.641 -23.819 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.815 4.159 -23.013 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.973 5.791 -23.704 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -11.471 6.952 -27.180 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -11.359 6.929 -25.404 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -9.914 6.606 -26.392 1.00 0.00 H new ATOM 604 N SER A 40 -7.746 4.320 -23.223 1.00 0.00 N ATOM 605 CA SER A 40 -7.112 3.726 -22.052 1.00 0.00 C ATOM 606 C SER A 40 -8.028 3.814 -20.835 1.00 0.00 C ATOM 607 O SER A 40 -8.949 4.630 -20.795 1.00 0.00 O ATOM 608 CB SER A 40 -5.783 4.425 -21.756 1.00 0.00 C ATOM 609 OG SER A 40 -5.880 5.821 -21.980 1.00 0.00 O ATOM 0 H SER A 40 -7.501 5.297 -23.385 1.00 0.00 H new ATOM 0 HA SER A 40 -6.922 2.674 -22.266 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.493 4.239 -20.722 1.00 0.00 H new ATOM 0 HB3 SER A 40 -5.000 4.006 -22.387 1.00 0.00 H new ATOM 0 HG SER A 40 -5.019 6.245 -21.782 1.00 0.00 H new ATOM 615 N GLY A 41 -7.768 2.968 -19.844 1.00 0.00 N ATOM 616 CA GLY A 41 -8.577 2.965 -18.639 1.00 0.00 C ATOM 617 C GLY A 41 -8.627 4.325 -17.971 1.00 0.00 C ATOM 618 O GLY A 41 -9.687 4.770 -17.532 1.00 0.00 O ATOM 0 H GLY A 41 -7.011 2.284 -19.854 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.590 2.647 -18.886 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -8.176 2.234 -17.937 1.00 0.00 H new ATOM 622 N ASP A 42 -7.477 4.986 -17.893 1.00 0.00 N ATOM 623 CA ASP A 42 -7.393 6.303 -17.272 1.00 0.00 C ATOM 624 C ASP A 42 -8.432 7.250 -17.866 1.00 0.00 C ATOM 625 O ASP A 42 -8.916 8.157 -17.190 1.00 0.00 O ATOM 626 CB ASP A 42 -5.991 6.887 -17.452 1.00 0.00 C ATOM 627 CG ASP A 42 -5.926 8.358 -17.092 1.00 0.00 C ATOM 628 OD1 ASP A 42 -6.137 8.688 -15.907 1.00 0.00 O ATOM 629 OD2 ASP A 42 -5.665 9.179 -17.996 1.00 0.00 O ATOM 0 H ASP A 42 -6.590 4.632 -18.252 1.00 0.00 H new ATOM 0 HA ASP A 42 -7.597 6.190 -16.207 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -5.287 6.333 -16.831 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -5.676 6.755 -18.487 1.00 0.00 H new ATOM 634 N GLN A 43 -8.768 7.032 -19.133 1.00 0.00 N ATOM 635 CA GLN A 43 -9.748 7.868 -19.817 1.00 0.00 C ATOM 636 C GLN A 43 -11.161 7.337 -19.602 1.00 0.00 C ATOM 637 O GLN A 43 -12.102 8.108 -19.409 1.00 0.00 O ATOM 638 CB GLN A 43 -9.438 7.932 -21.314 1.00 0.00 C ATOM 639 CG GLN A 43 -8.279 8.855 -21.656 1.00 0.00 C ATOM 640 CD GLN A 43 -8.733 10.144 -22.311 1.00 0.00 C ATOM 641 OE1 GLN A 43 -8.742 11.204 -21.683 1.00 0.00 O ATOM 642 NE2 GLN A 43 -9.113 10.062 -23.580 1.00 0.00 N ATOM 0 H GLN A 43 -8.377 6.285 -19.706 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.688 8.872 -19.397 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -9.210 6.928 -21.673 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -10.328 8.267 -21.847 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -7.726 9.089 -20.747 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -7.591 8.336 -22.323 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -9.090 9.164 -24.062 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -9.428 10.897 -24.073 1.00 0.00 H new ATOM 651 N LEU A 44 -11.304 6.017 -19.636 1.00 0.00 N ATOM 652 CA LEU A 44 -12.603 5.382 -19.444 1.00 0.00 C ATOM 653 C LEU A 44 -13.211 5.779 -18.102 1.00 0.00 C ATOM 654 O LEU A 44 -14.357 6.224 -18.035 1.00 0.00 O ATOM 655 CB LEU A 44 -12.467 3.861 -19.525 1.00 0.00 C ATOM 656 CG LEU A 44 -13.742 3.058 -19.266 1.00 0.00 C ATOM 657 CD1 LEU A 44 -14.564 2.934 -20.540 1.00 0.00 C ATOM 658 CD2 LEU A 44 -13.403 1.682 -18.712 1.00 0.00 C ATOM 0 H LEU A 44 -10.536 5.365 -19.795 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.267 5.724 -20.238 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -12.094 3.602 -20.516 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -11.711 3.545 -18.807 1.00 0.00 H new ATOM 0 HG LEU A 44 -14.338 3.590 -18.524 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -15.467 2.359 -20.336 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -14.838 3.928 -20.894 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -13.976 2.426 -21.304 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -14.323 1.125 -18.534 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -12.785 1.143 -19.430 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -12.858 1.791 -17.775 1.00 0.00 H new ATOM 670 N LEU A 45 -12.434 5.618 -17.037 1.00 0.00 N ATOM 671 CA LEU A 45 -12.894 5.962 -15.696 1.00 0.00 C ATOM 672 C LEU A 45 -13.401 7.400 -15.646 1.00 0.00 C ATOM 673 O LEU A 45 -14.265 7.736 -14.836 1.00 0.00 O ATOM 674 CB LEU A 45 -11.763 5.772 -14.683 1.00 0.00 C ATOM 675 CG LEU A 45 -12.027 4.764 -13.564 1.00 0.00 C ATOM 676 CD1 LEU A 45 -12.458 3.425 -14.142 1.00 0.00 C ATOM 677 CD2 LEU A 45 -10.790 4.598 -12.694 1.00 0.00 C ATOM 0 H LEU A 45 -11.483 5.252 -17.076 1.00 0.00 H new ATOM 0 HA LEU A 45 -13.719 5.297 -15.440 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -10.868 5.460 -15.222 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -11.542 6.738 -14.230 1.00 0.00 H new ATOM 0 HG LEU A 45 -12.837 5.145 -12.941 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -12.641 2.721 -13.331 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -13.371 3.556 -14.722 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -11.670 3.037 -14.788 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -10.996 3.877 -11.903 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.961 4.240 -13.305 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -10.526 5.558 -12.250 1.00 0.00 H new ATOM 689 N ARG A 46 -12.859 8.243 -16.518 1.00 0.00 N ATOM 690 CA ARG A 46 -13.257 9.645 -16.574 1.00 0.00 C ATOM 691 C ARG A 46 -13.940 9.964 -17.901 1.00 0.00 C ATOM 692 O ARG A 46 -13.872 11.092 -18.390 1.00 0.00 O ATOM 693 CB ARG A 46 -12.038 10.551 -16.385 1.00 0.00 C ATOM 694 CG ARG A 46 -11.068 10.518 -17.554 1.00 0.00 C ATOM 695 CD ARG A 46 -9.877 11.433 -17.315 1.00 0.00 C ATOM 696 NE ARG A 46 -9.794 12.495 -18.314 1.00 0.00 N ATOM 697 CZ ARG A 46 -9.041 13.580 -18.172 1.00 0.00 C ATOM 698 NH1 ARG A 46 -8.310 13.746 -17.078 1.00 0.00 N ATOM 699 NH2 ARG A 46 -9.018 14.503 -19.125 1.00 0.00 N ATOM 0 H ARG A 46 -12.143 7.980 -17.195 1.00 0.00 H new ATOM 0 HA ARG A 46 -13.966 9.828 -15.767 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.377 11.576 -16.234 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -11.511 10.253 -15.478 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -10.719 9.497 -17.710 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.584 10.821 -18.465 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -9.953 11.875 -16.322 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.959 10.846 -17.333 1.00 0.00 H new ATOM 0 HE ARG A 46 -10.344 12.398 -19.167 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.325 13.039 -16.343 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -7.733 14.580 -16.972 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.579 14.380 -19.968 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -8.439 15.336 -19.015 1.00 0.00 H new ATOM 713 N ILE A 47 -14.597 8.963 -18.477 1.00 0.00 N ATOM 714 CA ILE A 47 -15.292 9.137 -19.747 1.00 0.00 C ATOM 715 C ILE A 47 -16.551 9.981 -19.573 1.00 0.00 C ATOM 716 O ILE A 47 -17.325 9.776 -18.637 1.00 0.00 O ATOM 717 CB ILE A 47 -15.679 7.782 -20.367 1.00 0.00 C ATOM 718 CG1 ILE A 47 -16.214 7.980 -21.787 1.00 0.00 C ATOM 719 CG2 ILE A 47 -16.711 7.077 -19.500 1.00 0.00 C ATOM 720 CD1 ILE A 47 -15.322 7.391 -22.857 1.00 0.00 C ATOM 0 H ILE A 47 -14.663 8.024 -18.085 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.602 9.650 -20.417 1.00 0.00 H new ATOM 0 HB ILE A 47 -14.788 7.156 -20.418 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -17.203 7.527 -21.860 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -16.337 9.047 -21.975 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -16.974 6.121 -19.952 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.296 6.907 -18.506 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -17.603 7.698 -19.419 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -15.764 7.569 -23.837 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.340 7.861 -22.811 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -15.219 6.318 -22.695 1.00 0.00 H new ATOM 732 N THR A 48 -16.750 10.930 -20.482 1.00 0.00 N ATOM 733 CA THR A 48 -17.914 11.805 -20.430 1.00 0.00 C ATOM 734 C THR A 48 -18.675 11.787 -21.751 1.00 0.00 C ATOM 735 O THR A 48 -18.189 11.258 -22.752 1.00 0.00 O ATOM 736 CB THR A 48 -17.513 13.256 -20.102 1.00 0.00 C ATOM 737 OG1 THR A 48 -18.685 14.059 -19.922 1.00 0.00 O ATOM 738 CG2 THR A 48 -16.654 13.844 -21.210 1.00 0.00 C ATOM 0 H THR A 48 -16.120 11.112 -21.263 1.00 0.00 H new ATOM 0 HA THR A 48 -18.558 11.426 -19.637 1.00 0.00 H new ATOM 0 HB THR A 48 -16.932 13.250 -19.180 1.00 0.00 H new ATOM 0 HG1 THR A 48 -18.422 14.979 -19.712 1.00 0.00 H new ATOM 0 HG21 THR A 48 -16.384 14.869 -20.956 1.00 0.00 H new ATOM 0 HG22 THR A 48 -15.749 13.247 -21.324 1.00 0.00 H new ATOM 0 HG23 THR A 48 -17.213 13.838 -22.146 1.00 0.00 H new ATOM 746 N HIS A 49 -19.870 12.369 -21.749 1.00 0.00 N ATOM 747 CA HIS A 49 -20.697 12.421 -22.949 1.00 0.00 C ATOM 748 C HIS A 49 -19.912 12.991 -24.126 1.00 0.00 C ATOM 749 O HIS A 49 -20.058 12.536 -25.260 1.00 0.00 O ATOM 750 CB HIS A 49 -21.946 13.266 -22.697 1.00 0.00 C ATOM 751 CG HIS A 49 -23.103 12.480 -22.161 1.00 0.00 C ATOM 752 ND1 HIS A 49 -23.300 12.254 -20.815 1.00 0.00 N ATOM 753 CD2 HIS A 49 -24.128 11.866 -22.798 1.00 0.00 C ATOM 754 CE1 HIS A 49 -24.395 11.534 -20.647 1.00 0.00 C ATOM 755 NE2 HIS A 49 -24.917 11.286 -21.835 1.00 0.00 N ATOM 0 H HIS A 49 -20.287 12.811 -20.930 1.00 0.00 H new ATOM 0 HA HIS A 49 -21.000 11.403 -23.196 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -21.701 14.061 -21.993 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -22.244 13.746 -23.629 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -24.294 11.838 -23.865 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -24.795 11.204 -19.700 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -25.768 10.751 -22.009 1.00 0.00 H new ATOM 763 N GLN A 50 -19.080 13.990 -23.848 1.00 0.00 N ATOM 764 CA GLN A 50 -18.274 14.623 -24.885 1.00 0.00 C ATOM 765 C GLN A 50 -17.328 13.616 -25.530 1.00 0.00 C ATOM 766 O GLN A 50 -17.189 13.575 -26.752 1.00 0.00 O ATOM 767 CB GLN A 50 -17.474 15.788 -24.298 1.00 0.00 C ATOM 768 CG GLN A 50 -17.587 17.071 -25.106 1.00 0.00 C ATOM 769 CD GLN A 50 -18.938 17.741 -24.952 1.00 0.00 C ATOM 770 OE1 GLN A 50 -19.490 17.806 -23.853 1.00 0.00 O ATOM 771 NE2 GLN A 50 -19.479 18.244 -26.055 1.00 0.00 N ATOM 0 H GLN A 50 -18.947 14.378 -22.914 1.00 0.00 H new ATOM 0 HA GLN A 50 -18.948 15.004 -25.652 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -17.817 15.977 -23.281 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -16.425 15.501 -24.232 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -16.805 17.763 -24.793 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -17.414 16.849 -26.159 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -18.987 18.168 -26.945 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -20.387 18.707 -26.012 1.00 0.00 H new ATOM 780 N GLU A 51 -16.679 12.805 -24.700 1.00 0.00 N ATOM 781 CA GLU A 51 -15.745 11.798 -25.191 1.00 0.00 C ATOM 782 C GLU A 51 -16.467 10.755 -26.039 1.00 0.00 C ATOM 783 O GLU A 51 -16.044 10.443 -27.153 1.00 0.00 O ATOM 784 CB GLU A 51 -15.034 11.117 -24.020 1.00 0.00 C ATOM 785 CG GLU A 51 -13.765 11.829 -23.582 1.00 0.00 C ATOM 786 CD GLU A 51 -12.620 10.870 -23.317 1.00 0.00 C ATOM 787 OE1 GLU A 51 -12.078 10.310 -24.294 1.00 0.00 O ATOM 788 OE2 GLU A 51 -12.266 10.679 -22.135 1.00 0.00 O ATOM 0 H GLU A 51 -16.783 12.826 -23.685 1.00 0.00 H new ATOM 0 HA GLU A 51 -15.004 12.298 -25.815 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.719 11.059 -23.174 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.788 10.093 -24.301 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.467 12.540 -24.353 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -13.969 12.404 -22.679 1.00 0.00 H new ATOM 795 N LEU A 52 -17.557 10.217 -25.503 1.00 0.00 N ATOM 796 CA LEU A 52 -18.338 9.207 -26.209 1.00 0.00 C ATOM 797 C LEU A 52 -18.762 9.711 -27.585 1.00 0.00 C ATOM 798 O LEU A 52 -18.734 8.966 -28.564 1.00 0.00 O ATOM 799 CB LEU A 52 -19.573 8.825 -25.391 1.00 0.00 C ATOM 800 CG LEU A 52 -19.319 7.954 -24.160 1.00 0.00 C ATOM 801 CD1 LEU A 52 -20.621 7.675 -23.425 1.00 0.00 C ATOM 802 CD2 LEU A 52 -18.640 6.652 -24.559 1.00 0.00 C ATOM 0 H LEU A 52 -17.920 10.463 -24.582 1.00 0.00 H new ATOM 0 HA LEU A 52 -17.711 8.325 -26.342 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -20.068 9.741 -25.068 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -20.270 8.301 -26.045 1.00 0.00 H new ATOM 0 HG LEU A 52 -18.655 8.496 -23.486 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -20.420 7.054 -22.552 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -21.067 8.617 -23.105 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -21.310 7.154 -24.090 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.467 6.045 -23.671 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -19.279 6.106 -25.253 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -17.687 6.871 -25.040 1.00 0.00 H new ATOM 814 N GLU A 53 -19.152 10.980 -27.651 1.00 0.00 N ATOM 815 CA GLU A 53 -19.580 11.583 -28.908 1.00 0.00 C ATOM 816 C GLU A 53 -18.447 11.574 -29.929 1.00 0.00 C ATOM 817 O GLU A 53 -18.675 11.383 -31.124 1.00 0.00 O ATOM 818 CB GLU A 53 -20.060 13.017 -28.674 1.00 0.00 C ATOM 819 CG GLU A 53 -21.212 13.428 -29.575 1.00 0.00 C ATOM 820 CD GLU A 53 -21.422 14.929 -29.606 1.00 0.00 C ATOM 821 OE1 GLU A 53 -21.245 15.575 -28.552 1.00 0.00 O ATOM 822 OE2 GLU A 53 -21.764 15.458 -30.684 1.00 0.00 O ATOM 0 H GLU A 53 -19.180 11.610 -26.849 1.00 0.00 H new ATOM 0 HA GLU A 53 -20.406 10.991 -29.303 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -20.368 13.123 -27.634 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.226 13.701 -28.831 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -21.022 13.071 -30.587 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -22.127 12.944 -29.232 1.00 0.00 H new ATOM 829 N ASP A 54 -17.225 11.782 -29.451 1.00 0.00 N ATOM 830 CA ASP A 54 -16.055 11.797 -30.321 1.00 0.00 C ATOM 831 C ASP A 54 -15.853 10.438 -30.983 1.00 0.00 C ATOM 832 O ASP A 54 -15.622 10.352 -32.190 1.00 0.00 O ATOM 833 CB ASP A 54 -14.807 12.182 -29.526 1.00 0.00 C ATOM 834 CG ASP A 54 -13.612 12.452 -30.419 1.00 0.00 C ATOM 835 OD1 ASP A 54 -12.872 11.494 -30.724 1.00 0.00 O ATOM 836 OD2 ASP A 54 -13.416 13.621 -30.812 1.00 0.00 O ATOM 0 H ASP A 54 -17.019 11.943 -28.465 1.00 0.00 H new ATOM 0 HA ASP A 54 -16.222 12.540 -31.101 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.019 13.069 -28.930 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -14.562 11.381 -28.829 1.00 0.00 H new ATOM 841 N LEU A 55 -15.939 9.379 -30.187 1.00 0.00 N ATOM 842 CA LEU A 55 -15.764 8.023 -30.695 1.00 0.00 C ATOM 843 C LEU A 55 -16.804 7.704 -31.764 1.00 0.00 C ATOM 844 O LEU A 55 -16.565 6.890 -32.655 1.00 0.00 O ATOM 845 CB LEU A 55 -15.863 7.011 -29.552 1.00 0.00 C ATOM 846 CG LEU A 55 -14.812 7.139 -28.449 1.00 0.00 C ATOM 847 CD1 LEU A 55 -15.456 6.995 -27.079 1.00 0.00 C ATOM 848 CD2 LEU A 55 -13.713 6.103 -28.637 1.00 0.00 C ATOM 0 H LEU A 55 -16.129 9.433 -29.186 1.00 0.00 H new ATOM 0 HA LEU A 55 -14.774 7.956 -31.146 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -16.850 7.101 -29.098 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -15.797 6.008 -29.974 1.00 0.00 H new ATOM 0 HG LEU A 55 -14.363 8.130 -28.514 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -14.693 7.089 -26.307 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -16.205 7.775 -26.945 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -15.932 6.018 -27.002 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -12.974 6.209 -27.843 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -14.145 5.103 -28.599 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -13.232 6.254 -29.603 1.00 0.00 H new ATOM 860 N GLY A 56 -17.961 8.352 -31.669 1.00 0.00 N ATOM 861 CA GLY A 56 -19.020 8.126 -32.635 1.00 0.00 C ATOM 862 C GLY A 56 -20.372 7.929 -31.978 1.00 0.00 C ATOM 863 O GLY A 56 -21.411 8.077 -32.621 1.00 0.00 O ATOM 0 H GLY A 56 -18.184 9.030 -30.940 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -19.072 8.974 -33.318 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -18.779 7.248 -33.234 1.00 0.00 H new ATOM 867 N VAL A 57 -20.359 7.592 -30.692 1.00 0.00 N ATOM 868 CA VAL A 57 -21.594 7.374 -29.947 1.00 0.00 C ATOM 869 C VAL A 57 -22.420 8.652 -29.866 1.00 0.00 C ATOM 870 O VAL A 57 -22.227 9.473 -28.970 1.00 0.00 O ATOM 871 CB VAL A 57 -21.306 6.870 -28.520 1.00 0.00 C ATOM 872 CG1 VAL A 57 -22.598 6.467 -27.825 1.00 0.00 C ATOM 873 CG2 VAL A 57 -20.324 5.710 -28.552 1.00 0.00 C ATOM 0 H VAL A 57 -19.508 7.464 -30.145 1.00 0.00 H new ATOM 0 HA VAL A 57 -22.159 6.614 -30.486 1.00 0.00 H new ATOM 0 HB VAL A 57 -20.854 7.682 -27.951 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -22.375 6.114 -26.818 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -23.264 7.328 -27.768 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -23.082 5.670 -28.390 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -20.133 5.367 -27.535 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -20.745 4.893 -29.137 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -19.389 6.037 -29.007 1.00 0.00 H new ATOM 883 N SER A 58 -23.344 8.814 -30.809 1.00 0.00 N ATOM 884 CA SER A 58 -24.199 9.994 -30.847 1.00 0.00 C ATOM 885 C SER A 58 -25.492 9.753 -30.074 1.00 0.00 C ATOM 886 O SER A 58 -26.076 10.682 -29.515 1.00 0.00 O ATOM 887 CB SER A 58 -24.519 10.371 -32.294 1.00 0.00 C ATOM 888 OG SER A 58 -23.768 11.501 -32.705 1.00 0.00 O ATOM 0 H SER A 58 -23.519 8.142 -31.556 1.00 0.00 H new ATOM 0 HA SER A 58 -23.662 10.817 -30.375 1.00 0.00 H new ATOM 0 HB2 SER A 58 -24.301 9.528 -32.949 1.00 0.00 H new ATOM 0 HB3 SER A 58 -25.584 10.583 -32.391 1.00 0.00 H new ATOM 0 HG SER A 58 -23.989 11.721 -33.634 1.00 0.00 H new ATOM 894 N ARG A 59 -25.933 8.500 -30.046 1.00 0.00 N ATOM 895 CA ARG A 59 -27.157 8.135 -29.344 1.00 0.00 C ATOM 896 C ARG A 59 -27.044 8.452 -27.855 1.00 0.00 C ATOM 897 O ARG A 59 -25.949 8.682 -27.341 1.00 0.00 O ATOM 898 CB ARG A 59 -27.458 6.648 -29.538 1.00 0.00 C ATOM 899 CG ARG A 59 -28.433 6.367 -30.670 1.00 0.00 C ATOM 900 CD ARG A 59 -29.827 6.065 -30.142 1.00 0.00 C ATOM 901 NE ARG A 59 -30.557 5.150 -31.016 1.00 0.00 N ATOM 902 CZ ARG A 59 -31.627 4.464 -30.633 1.00 0.00 C ATOM 903 NH1 ARG A 59 -32.091 4.588 -29.397 1.00 0.00 N ATOM 904 NH2 ARG A 59 -32.237 3.651 -31.486 1.00 0.00 N ATOM 0 H ARG A 59 -25.460 7.720 -30.502 1.00 0.00 H new ATOM 0 HA ARG A 59 -27.975 8.721 -29.763 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -26.525 6.120 -29.734 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -27.865 6.244 -28.611 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -28.474 7.227 -31.338 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -28.075 5.523 -31.259 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -29.751 5.631 -29.145 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -30.386 6.995 -30.043 1.00 0.00 H new ATOM 0 HE ARG A 59 -30.226 5.032 -31.974 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -31.626 5.212 -28.738 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -32.913 4.060 -29.106 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -31.884 3.552 -32.438 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -33.059 3.125 -31.190 1.00 0.00 H new ATOM 918 N ILE A 60 -28.183 8.464 -27.170 1.00 0.00 N ATOM 919 CA ILE A 60 -28.211 8.752 -25.742 1.00 0.00 C ATOM 920 C ILE A 60 -28.340 7.471 -24.925 1.00 0.00 C ATOM 921 O ILE A 60 -27.553 7.222 -24.012 1.00 0.00 O ATOM 922 CB ILE A 60 -29.373 9.696 -25.381 1.00 0.00 C ATOM 923 CG1 ILE A 60 -29.255 11.007 -26.160 1.00 0.00 C ATOM 924 CG2 ILE A 60 -29.393 9.963 -23.883 1.00 0.00 C ATOM 925 CD1 ILE A 60 -28.003 11.793 -25.835 1.00 0.00 C ATOM 0 H ILE A 60 -29.098 8.278 -27.581 1.00 0.00 H new ATOM 0 HA ILE A 60 -27.267 9.241 -25.500 1.00 0.00 H new ATOM 0 HB ILE A 60 -30.311 9.215 -25.657 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -29.270 10.788 -27.228 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -30.127 11.625 -25.949 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -30.220 10.632 -23.644 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -29.520 9.022 -23.347 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -28.453 10.427 -23.583 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -27.986 12.710 -26.424 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -27.995 12.043 -24.774 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -27.125 11.193 -26.073 1.00 0.00 H new ATOM 937 N GLY A 61 -29.337 6.658 -25.261 1.00 0.00 N ATOM 938 CA GLY A 61 -29.550 5.411 -24.550 1.00 0.00 C ATOM 939 C GLY A 61 -28.322 4.522 -24.560 1.00 0.00 C ATOM 940 O GLY A 61 -28.162 3.662 -23.693 1.00 0.00 O ATOM 0 H GLY A 61 -30.001 6.841 -26.013 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -29.830 5.627 -23.519 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -30.386 4.877 -25.002 1.00 0.00 H new ATOM 944 N HIS A 62 -27.453 4.726 -25.545 1.00 0.00 N ATOM 945 CA HIS A 62 -26.234 3.934 -25.666 1.00 0.00 C ATOM 946 C HIS A 62 -25.098 4.561 -24.863 1.00 0.00 C ATOM 947 O HIS A 62 -24.319 3.857 -24.221 1.00 0.00 O ATOM 948 CB HIS A 62 -25.827 3.807 -27.134 1.00 0.00 C ATOM 949 CG HIS A 62 -26.903 3.240 -28.007 1.00 0.00 C ATOM 950 ND1 HIS A 62 -27.034 3.557 -29.343 1.00 0.00 N ATOM 951 CD2 HIS A 62 -27.903 2.371 -27.729 1.00 0.00 C ATOM 952 CE1 HIS A 62 -28.068 2.908 -29.848 1.00 0.00 C ATOM 953 NE2 HIS A 62 -28.612 2.181 -28.890 1.00 0.00 N ATOM 0 H HIS A 62 -27.570 5.433 -26.271 1.00 0.00 H new ATOM 0 HA HIS A 62 -26.434 2.940 -25.265 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -25.545 4.790 -27.511 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -24.943 3.174 -27.204 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -28.106 1.912 -26.772 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -28.410 2.963 -30.871 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -29.427 1.576 -28.995 1.00 0.00 H new ATOM 961 N GLN A 63 -25.011 5.886 -24.906 1.00 0.00 N ATOM 962 CA GLN A 63 -23.969 6.606 -24.183 1.00 0.00 C ATOM 963 C GLN A 63 -24.020 6.287 -22.693 1.00 0.00 C ATOM 964 O GLN A 63 -22.985 6.196 -22.033 1.00 0.00 O ATOM 965 CB GLN A 63 -24.117 8.114 -24.399 1.00 0.00 C ATOM 966 CG GLN A 63 -23.337 8.637 -25.594 1.00 0.00 C ATOM 967 CD GLN A 63 -23.220 10.148 -25.599 1.00 0.00 C ATOM 968 OE1 GLN A 63 -22.429 10.723 -24.851 1.00 0.00 O ATOM 969 NE2 GLN A 63 -24.010 10.801 -26.444 1.00 0.00 N ATOM 0 H GLN A 63 -25.649 6.483 -25.433 1.00 0.00 H new ATOM 0 HA GLN A 63 -23.003 6.283 -24.572 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -25.172 8.352 -24.532 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -23.784 8.636 -23.502 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -22.339 8.199 -25.591 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -23.825 8.311 -26.512 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -24.651 10.284 -27.046 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -23.976 11.819 -26.491 1.00 0.00 H new ATOM 978 N GLU A 64 -25.230 6.119 -22.169 1.00 0.00 N ATOM 979 CA GLU A 64 -25.415 5.810 -20.756 1.00 0.00 C ATOM 980 C GLU A 64 -25.236 4.317 -20.497 1.00 0.00 C ATOM 981 O GLU A 64 -24.806 3.910 -19.417 1.00 0.00 O ATOM 982 CB GLU A 64 -26.802 6.257 -20.291 1.00 0.00 C ATOM 983 CG GLU A 64 -26.905 7.751 -20.029 1.00 0.00 C ATOM 984 CD GLU A 64 -26.468 8.129 -18.627 1.00 0.00 C ATOM 985 OE1 GLU A 64 -26.515 7.256 -17.735 1.00 0.00 O ATOM 986 OE2 GLU A 64 -26.079 9.298 -18.423 1.00 0.00 O ATOM 0 H GLU A 64 -26.097 6.192 -22.702 1.00 0.00 H new ATOM 0 HA GLU A 64 -24.658 6.352 -20.190 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -27.537 5.978 -21.046 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -27.061 5.718 -19.380 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -26.291 8.286 -20.754 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -27.935 8.073 -20.184 1.00 0.00 H new ATOM 993 N LEU A 65 -25.570 3.506 -21.495 1.00 0.00 N ATOM 994 CA LEU A 65 -25.447 2.057 -21.376 1.00 0.00 C ATOM 995 C LEU A 65 -24.040 1.664 -20.939 1.00 0.00 C ATOM 996 O LEU A 65 -23.865 0.806 -20.072 1.00 0.00 O ATOM 997 CB LEU A 65 -25.786 1.386 -22.708 1.00 0.00 C ATOM 998 CG LEU A 65 -27.209 0.842 -22.843 1.00 0.00 C ATOM 999 CD1 LEU A 65 -27.488 0.428 -24.280 1.00 0.00 C ATOM 1000 CD2 LEU A 65 -27.424 -0.330 -21.897 1.00 0.00 C ATOM 0 H LEU A 65 -25.928 3.827 -22.395 1.00 0.00 H new ATOM 0 HA LEU A 65 -26.151 1.718 -20.616 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -25.616 2.106 -23.508 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -25.088 0.564 -22.866 1.00 0.00 H new ATOM 0 HG LEU A 65 -27.907 1.634 -22.573 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -28.505 0.043 -24.357 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -27.376 1.291 -24.936 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -26.783 -0.348 -24.578 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -28.442 -0.704 -22.007 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -26.717 -1.125 -22.136 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -27.267 -0.002 -20.870 1.00 0.00 H new ATOM 1012 N ILE A 66 -23.040 2.297 -21.542 1.00 0.00 N ATOM 1013 CA ILE A 66 -21.648 2.015 -21.212 1.00 0.00 C ATOM 1014 C ILE A 66 -21.288 2.563 -19.836 1.00 0.00 C ATOM 1015 O ILE A 66 -20.626 1.892 -19.042 1.00 0.00 O ATOM 1016 CB ILE A 66 -20.689 2.615 -22.258 1.00 0.00 C ATOM 1017 CG1 ILE A 66 -21.083 2.159 -23.664 1.00 0.00 C ATOM 1018 CG2 ILE A 66 -19.253 2.218 -21.949 1.00 0.00 C ATOM 1019 CD1 ILE A 66 -20.310 2.852 -24.764 1.00 0.00 C ATOM 0 H ILE A 66 -23.167 3.009 -22.262 1.00 0.00 H new ATOM 0 HA ILE A 66 -21.537 0.931 -21.209 1.00 0.00 H new ATOM 0 HB ILE A 66 -20.762 3.702 -22.215 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -20.928 1.083 -23.745 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -22.148 2.340 -23.810 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -18.587 2.649 -22.697 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -18.978 2.588 -20.961 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -19.164 1.132 -21.967 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -20.642 2.479 -25.733 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -20.484 3.927 -24.710 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -19.246 2.651 -24.643 1.00 0.00 H new ATOM 1031 N LEU A 67 -21.729 3.784 -19.557 1.00 0.00 N ATOM 1032 CA LEU A 67 -21.455 4.423 -18.274 1.00 0.00 C ATOM 1033 C LEU A 67 -21.994 3.582 -17.121 1.00 0.00 C ATOM 1034 O LEU A 67 -21.284 3.308 -16.155 1.00 0.00 O ATOM 1035 CB LEU A 67 -22.075 5.821 -18.235 1.00 0.00 C ATOM 1036 CG LEU A 67 -21.573 6.807 -19.289 1.00 0.00 C ATOM 1037 CD1 LEU A 67 -22.521 7.990 -19.408 1.00 0.00 C ATOM 1038 CD2 LEU A 67 -20.167 7.281 -18.950 1.00 0.00 C ATOM 0 H LEU A 67 -22.278 4.352 -20.202 1.00 0.00 H new ATOM 0 HA LEU A 67 -20.374 4.509 -18.162 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -23.155 5.721 -18.345 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -21.893 6.250 -17.249 1.00 0.00 H new ATOM 0 HG LEU A 67 -21.541 6.295 -20.251 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -22.147 8.681 -20.163 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -23.510 7.636 -19.698 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -22.586 8.502 -18.448 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -19.826 7.982 -19.711 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -20.174 7.775 -17.979 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -19.493 6.425 -18.917 1.00 0.00 H new ATOM 1050 N GLU A 68 -23.255 3.175 -17.232 1.00 0.00 N ATOM 1051 CA GLU A 68 -23.889 2.364 -16.199 1.00 0.00 C ATOM 1052 C GLU A 68 -23.040 1.138 -15.873 1.00 0.00 C ATOM 1053 O GLU A 68 -23.057 0.640 -14.748 1.00 0.00 O ATOM 1054 CB GLU A 68 -25.285 1.926 -16.648 1.00 0.00 C ATOM 1055 CG GLU A 68 -26.072 1.203 -15.568 1.00 0.00 C ATOM 1056 CD GLU A 68 -27.370 0.616 -16.087 1.00 0.00 C ATOM 1057 OE1 GLU A 68 -27.942 1.191 -17.037 1.00 0.00 O ATOM 1058 OE2 GLU A 68 -27.814 -0.417 -15.544 1.00 0.00 O ATOM 0 H GLU A 68 -23.857 3.393 -18.026 1.00 0.00 H new ATOM 0 HA GLU A 68 -23.979 2.973 -15.299 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -25.846 2.803 -16.969 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -25.190 1.273 -17.516 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -25.459 0.405 -15.149 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -26.290 1.897 -14.756 1.00 0.00 H new ATOM 1065 N ALA A 69 -22.299 0.658 -16.865 1.00 0.00 N ATOM 1066 CA ALA A 69 -21.442 -0.508 -16.684 1.00 0.00 C ATOM 1067 C ALA A 69 -20.124 -0.123 -16.022 1.00 0.00 C ATOM 1068 O ALA A 69 -19.541 -0.908 -15.274 1.00 0.00 O ATOM 1069 CB ALA A 69 -21.185 -1.187 -18.022 1.00 0.00 C ATOM 0 H ALA A 69 -22.274 1.058 -17.803 1.00 0.00 H new ATOM 0 HA ALA A 69 -21.957 -1.208 -16.027 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -20.544 -2.056 -17.872 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -22.133 -1.506 -18.456 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -20.694 -0.486 -18.697 1.00 0.00 H new ATOM 1075 N VAL A 70 -19.658 1.090 -16.302 1.00 0.00 N ATOM 1076 CA VAL A 70 -18.408 1.580 -15.732 1.00 0.00 C ATOM 1077 C VAL A 70 -18.528 1.767 -14.224 1.00 0.00 C ATOM 1078 O VAL A 70 -17.578 1.521 -13.481 1.00 0.00 O ATOM 1079 CB VAL A 70 -17.985 2.915 -16.373 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -16.697 3.424 -15.744 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -17.828 2.758 -17.877 1.00 0.00 C ATOM 0 H VAL A 70 -20.127 1.752 -16.920 1.00 0.00 H new ATOM 0 HA VAL A 70 -17.647 0.828 -15.942 1.00 0.00 H new ATOM 0 HB VAL A 70 -18.767 3.651 -16.188 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.413 4.368 -16.209 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -16.850 3.577 -14.676 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -15.904 2.692 -15.896 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.529 3.711 -18.313 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -17.066 2.008 -18.087 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -18.777 2.442 -18.311 1.00 0.00 H new ATOM 1091 N ASP A 71 -19.701 2.203 -13.779 1.00 0.00 N ATOM 1092 CA ASP A 71 -19.946 2.422 -12.358 1.00 0.00 C ATOM 1093 C ASP A 71 -19.619 1.169 -11.551 1.00 0.00 C ATOM 1094 O ASP A 71 -19.248 1.252 -10.379 1.00 0.00 O ATOM 1095 CB ASP A 71 -21.402 2.827 -12.126 1.00 0.00 C ATOM 1096 CG ASP A 71 -21.565 3.745 -10.930 1.00 0.00 C ATOM 1097 OD1 ASP A 71 -20.738 4.668 -10.775 1.00 0.00 O ATOM 1098 OD2 ASP A 71 -22.517 3.539 -10.149 1.00 0.00 O ATOM 0 H ASP A 71 -20.497 2.412 -14.381 1.00 0.00 H new ATOM 0 HA ASP A 71 -19.295 3.229 -12.022 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -21.784 3.325 -13.017 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -22.006 1.932 -11.978 1.00 0.00 H new ATOM 1103 N LEU A 72 -19.759 0.010 -12.184 1.00 0.00 N ATOM 1104 CA LEU A 72 -19.480 -1.261 -11.525 1.00 0.00 C ATOM 1105 C LEU A 72 -17.980 -1.532 -11.477 1.00 0.00 C ATOM 1106 O LEU A 72 -17.485 -2.184 -10.558 1.00 0.00 O ATOM 1107 CB LEU A 72 -20.193 -2.403 -12.252 1.00 0.00 C ATOM 1108 CG LEU A 72 -21.701 -2.507 -12.021 1.00 0.00 C ATOM 1109 CD1 LEU A 72 -22.391 -3.075 -13.252 1.00 0.00 C ATOM 1110 CD2 LEU A 72 -21.995 -3.365 -10.799 1.00 0.00 C ATOM 0 H LEU A 72 -20.064 -0.076 -13.153 1.00 0.00 H new ATOM 0 HA LEU A 72 -19.853 -1.201 -10.502 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -20.016 -2.293 -13.322 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -19.733 -3.344 -11.948 1.00 0.00 H new ATOM 0 HG LEU A 72 -22.092 -1.506 -11.840 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -23.464 -3.142 -13.070 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -22.208 -2.422 -14.105 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -21.996 -4.069 -13.464 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -23.073 -3.428 -10.650 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -21.590 -4.366 -10.951 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -21.532 -2.917 -9.920 1.00 0.00 H new ATOM 1122 N LEU A 73 -17.261 -1.024 -12.473 1.00 0.00 N ATOM 1123 CA LEU A 73 -15.815 -1.209 -12.544 1.00 0.00 C ATOM 1124 C LEU A 73 -15.115 -0.463 -11.413 1.00 0.00 C ATOM 1125 O LEU A 73 -14.084 -0.908 -10.907 1.00 0.00 O ATOM 1126 CB LEU A 73 -15.285 -0.725 -13.895 1.00 0.00 C ATOM 1127 CG LEU A 73 -15.063 -1.805 -14.954 1.00 0.00 C ATOM 1128 CD1 LEU A 73 -14.770 -1.174 -16.306 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -13.930 -2.733 -14.540 1.00 0.00 C ATOM 0 H LEU A 73 -17.655 -0.481 -13.242 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.604 -2.273 -12.438 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.984 0.010 -14.295 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.340 -0.208 -13.728 1.00 0.00 H new ATOM 0 HG LEU A 73 -15.976 -2.395 -15.041 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.615 -1.958 -17.047 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -15.612 -0.551 -16.607 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.872 -0.560 -16.234 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.786 -3.495 -15.306 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.012 -2.157 -14.424 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -14.180 -3.212 -13.593 1.00 0.00 H new ATOM 1141 N CYS A 74 -15.682 0.672 -11.020 1.00 0.00 N ATOM 1142 CA CYS A 74 -15.113 1.480 -9.947 1.00 0.00 C ATOM 1143 C CYS A 74 -15.607 1.002 -8.585 1.00 0.00 C ATOM 1144 O CYS A 74 -14.860 1.003 -7.607 1.00 0.00 O ATOM 1145 CB CYS A 74 -15.471 2.954 -10.145 1.00 0.00 C ATOM 1146 SG CYS A 74 -14.274 4.106 -9.432 1.00 0.00 S ATOM 0 H CYS A 74 -16.535 1.054 -11.428 1.00 0.00 H new ATOM 0 HA CYS A 74 -14.029 1.370 -9.979 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -15.561 3.155 -11.213 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -16.449 3.142 -9.702 1.00 0.00 H new ATOM 0 HG CYS A 74 -14.662 5.327 -9.652 1.00 0.00 H new ATOM 1152 N ALA A 75 -16.871 0.597 -8.530 1.00 0.00 N ATOM 1153 CA ALA A 75 -17.466 0.116 -7.289 1.00 0.00 C ATOM 1154 C ALA A 75 -16.832 -1.200 -6.850 1.00 0.00 C ATOM 1155 O ALA A 75 -16.816 -1.528 -5.663 1.00 0.00 O ATOM 1156 CB ALA A 75 -18.969 -0.048 -7.452 1.00 0.00 C ATOM 0 H ALA A 75 -17.503 0.592 -9.330 1.00 0.00 H new ATOM 0 HA ALA A 75 -17.276 0.857 -6.513 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -19.399 -0.408 -6.517 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -19.414 0.913 -7.710 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -19.173 -0.767 -8.246 1.00 0.00 H new ATOM 1162 N LEU A 76 -16.312 -1.951 -7.815 1.00 0.00 N ATOM 1163 CA LEU A 76 -15.678 -3.233 -7.528 1.00 0.00 C ATOM 1164 C LEU A 76 -14.235 -3.037 -7.075 1.00 0.00 C ATOM 1165 O LEU A 76 -13.696 -3.845 -6.321 1.00 0.00 O ATOM 1166 CB LEU A 76 -15.718 -4.132 -8.765 1.00 0.00 C ATOM 1167 CG LEU A 76 -16.900 -5.098 -8.854 1.00 0.00 C ATOM 1168 CD1 LEU A 76 -17.258 -5.372 -10.307 1.00 0.00 C ATOM 1169 CD2 LEU A 76 -16.584 -6.397 -8.128 1.00 0.00 C ATOM 0 H LEU A 76 -16.317 -1.694 -8.802 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.232 -3.712 -6.720 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.726 -3.497 -9.651 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -14.796 -4.713 -8.797 1.00 0.00 H new ATOM 0 HG LEU A 76 -17.760 -4.634 -8.370 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -18.101 -6.061 -10.350 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -17.528 -4.437 -10.798 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -16.401 -5.814 -10.816 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -17.437 -7.072 -8.202 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -15.711 -6.865 -8.582 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -16.378 -6.186 -7.079 1.00 0.00 H new ATOM 1181 N ASN A 77 -13.615 -1.957 -7.540 1.00 0.00 N ATOM 1182 CA ASN A 77 -12.235 -1.653 -7.181 1.00 0.00 C ATOM 1183 C ASN A 77 -12.143 -1.161 -5.740 1.00 0.00 C ATOM 1184 O ASN A 77 -11.374 -1.693 -4.939 1.00 0.00 O ATOM 1185 CB ASN A 77 -11.659 -0.600 -8.130 1.00 0.00 C ATOM 1186 CG ASN A 77 -10.950 -1.218 -9.319 1.00 0.00 C ATOM 1187 OD1 ASN A 77 -9.842 -0.817 -9.673 1.00 0.00 O ATOM 1188 ND2 ASN A 77 -11.589 -2.202 -9.942 1.00 0.00 N ATOM 0 H ASN A 77 -14.047 -1.278 -8.166 1.00 0.00 H new ATOM 0 HA ASN A 77 -11.652 -2.570 -7.270 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -12.464 0.044 -8.485 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -10.961 0.034 -7.584 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -11.162 -2.657 -10.749 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -12.507 -2.502 -9.614 1.00 0.00 H new ATOM 1195 N SER A 78 -12.933 -0.141 -5.417 1.00 0.00 N ATOM 1196 CA SER A 78 -12.939 0.425 -4.074 1.00 0.00 C ATOM 1197 C SER A 78 -13.153 -0.663 -3.026 1.00 0.00 C ATOM 1198 O SER A 78 -12.567 -0.623 -1.945 1.00 0.00 O ATOM 1199 CB SER A 78 -14.032 1.489 -3.951 1.00 0.00 C ATOM 1200 OG SER A 78 -13.553 2.761 -4.352 1.00 0.00 O ATOM 0 H SER A 78 -13.577 0.310 -6.067 1.00 0.00 H new ATOM 0 HA SER A 78 -11.968 0.889 -3.898 1.00 0.00 H new ATOM 0 HB2 SER A 78 -14.887 1.209 -4.566 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.382 1.537 -2.920 1.00 0.00 H new ATOM 0 HG SER A 78 -14.271 3.423 -4.266 1.00 0.00 H new ATOM 1206 N GLY A 79 -13.998 -1.635 -3.355 1.00 0.00 N ATOM 1207 CA GLY A 79 -14.276 -2.720 -2.433 1.00 0.00 C ATOM 1208 C GLY A 79 -13.039 -3.533 -2.105 1.00 0.00 C ATOM 1209 O GLY A 79 -11.920 -3.175 -2.473 1.00 0.00 O ATOM 0 H GLY A 79 -14.495 -1.690 -4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.694 -2.312 -1.512 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -15.033 -3.374 -2.865 1.00 0.00 H new ATOM 1213 N PRO A 80 -13.234 -4.654 -1.396 1.00 0.00 N ATOM 1214 CA PRO A 80 -12.137 -5.543 -1.001 1.00 0.00 C ATOM 1215 C PRO A 80 -11.535 -6.283 -2.191 1.00 0.00 C ATOM 1216 O PRO A 80 -12.239 -6.982 -2.920 1.00 0.00 O ATOM 1217 CB PRO A 80 -12.806 -6.528 -0.041 1.00 0.00 C ATOM 1218 CG PRO A 80 -14.240 -6.534 -0.442 1.00 0.00 C ATOM 1219 CD PRO A 80 -14.541 -5.142 -0.924 1.00 0.00 C ATOM 0 HA PRO A 80 -11.306 -4.994 -0.558 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -12.367 -7.522 -0.125 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -12.686 -6.213 0.996 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -14.422 -7.267 -1.228 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -14.879 -6.803 0.399 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -15.281 -5.145 -1.724 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -14.938 -4.517 -0.124 1.00 0.00 H new ATOM 1227 N SER A 81 -10.229 -6.126 -2.381 1.00 0.00 N ATOM 1228 CA SER A 81 -9.533 -6.777 -3.484 1.00 0.00 C ATOM 1229 C SER A 81 -8.602 -7.871 -2.970 1.00 0.00 C ATOM 1230 O SER A 81 -8.042 -7.762 -1.879 1.00 0.00 O ATOM 1231 CB SER A 81 -8.734 -5.750 -4.289 1.00 0.00 C ATOM 1232 OG SER A 81 -9.587 -4.766 -4.849 1.00 0.00 O ATOM 0 H SER A 81 -9.631 -5.553 -1.785 1.00 0.00 H new ATOM 0 HA SER A 81 -10.281 -7.235 -4.132 1.00 0.00 H new ATOM 0 HB2 SER A 81 -7.996 -5.272 -3.644 1.00 0.00 H new ATOM 0 HB3 SER A 81 -8.184 -6.254 -5.084 1.00 0.00 H new ATOM 0 HG SER A 81 -9.053 -4.121 -5.357 1.00 0.00 H new ATOM 1238 N SER A 82 -8.444 -8.926 -3.763 1.00 0.00 N ATOM 1239 CA SER A 82 -7.585 -10.043 -3.387 1.00 0.00 C ATOM 1240 C SER A 82 -8.104 -10.727 -2.126 1.00 0.00 C ATOM 1241 O SER A 82 -9.176 -10.395 -1.623 1.00 0.00 O ATOM 1242 CB SER A 82 -6.151 -9.558 -3.164 1.00 0.00 C ATOM 1243 OG SER A 82 -5.242 -10.645 -3.148 1.00 0.00 O ATOM 0 H SER A 82 -8.899 -9.031 -4.670 1.00 0.00 H new ATOM 0 HA SER A 82 -7.594 -10.767 -4.202 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.873 -8.859 -3.953 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.090 -9.015 -2.221 1.00 0.00 H new ATOM 0 HG SER A 82 -4.333 -10.309 -3.006 1.00 0.00 H new ATOM 1249 N GLY A 83 -7.334 -11.686 -1.621 1.00 0.00 N ATOM 1250 CA GLY A 83 -7.732 -12.403 -0.423 1.00 0.00 C ATOM 1251 C GLY A 83 -7.002 -11.917 0.813 1.00 0.00 C ATOM 1252 O GLY A 83 -5.787 -11.720 0.787 1.00 0.00 O ATOM 0 H GLY A 83 -6.442 -11.979 -2.020 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.806 -12.289 -0.275 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.540 -13.467 -0.560 1.00 0.00 H new TER 1256 GLY A 83