USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 982 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: B 14 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 36 ASN : amide:sc= -1.58 X(o=-1.6,f=-1.6) USER MOD Set 2.1: A 35 SER OG : rot -48:sc= 0.903 USER MOD Set 2.2: B 35 SER OG : rot -43:sc= 1 USER MOD Set 3.1: A 14 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 36 ASN : amide:sc= -1.66 X(o=-1.7,f=-1.6) USER MOD Single : A 5 SER OG : rot -118:sc= 0.694 USER MOD Single : A 7 THR OG1 : rot 171:sc= -0.917 USER MOD Single : A 8 THR OG1 : rot -170:sc= 0.868 USER MOD Single : A 23 HIS : no HD1:sc= -4.65! C(o=-4.6!,f=-5.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -120:sc= -0.422 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0848 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -4.9 K(o=-4.9,f=-8.7!) USER MOD Single : A 48 GLN : amide:sc= -3.93! K(o=-3.9!,f=-0.48) USER MOD Single : A 52 ASN : amide:sc= -2.85! C(o=-2.9!,f=-8!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -0.9 K(o=-0.9,f=-2.8!) USER MOD Single : A 64 SER OG : rot 106:sc= 0.646 USER MOD Single : B 5 SER OG : rot -121:sc= 0.556 USER MOD Single : B 7 THR OG1 : rot 180:sc= -1.02 USER MOD Single : B 8 THR OG1 : rot -172:sc= 0.766 USER MOD Single : B 23 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-5!) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -120:sc= -0.423 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 180:sc= -0.0988 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 ASN : amide:sc= -4.74 K(o=-4.7,f=-8.1!) USER MOD Single : B 48 GLN : amide:sc= -3.97! K(o=-4!,f=-0.53) USER MOD Single : B 52 ASN : amide:sc= -2.52! C(o=-2.5!,f=-9!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 180:sc= 0 USER MOD Single : B 63 ASN : amide:sc= -0.917 K(o=-0.92,f=-2.7!) USER MOD Single : B 64 SER OG : rot 106:sc= 0.682 USER MOD ----------------------------------------------------------------- ATOM 58 N SER A 5 14.196 -6.327 -4.004 1.00 0.00 N ATOM 59 CA SER A 5 12.986 -5.683 -3.424 1.00 0.00 C ATOM 60 C SER A 5 12.357 -4.740 -4.453 1.00 0.00 C ATOM 61 O SER A 5 13.010 -3.874 -5.000 1.00 0.00 O ATOM 62 CB SER A 5 13.379 -4.887 -2.179 1.00 0.00 C ATOM 63 OG SER A 5 12.499 -5.210 -1.111 1.00 0.00 O ATOM 0 HA SER A 5 12.264 -6.454 -3.153 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.407 -5.115 -1.898 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.336 -3.818 -2.389 1.00 0.00 H new ATOM 0 HG SER A 5 12.006 -4.408 -0.839 1.00 0.00 H new ATOM 69 N ASP A 6 11.088 -4.900 -4.711 1.00 0.00 N ATOM 70 CA ASP A 6 10.404 -4.013 -5.695 1.00 0.00 C ATOM 71 C ASP A 6 9.069 -3.560 -5.105 1.00 0.00 C ATOM 72 O ASP A 6 8.897 -3.528 -3.904 1.00 0.00 O ATOM 73 CB ASP A 6 10.177 -4.777 -7.006 1.00 0.00 C ATOM 74 CG ASP A 6 9.209 -5.941 -6.774 1.00 0.00 C ATOM 75 OD1 ASP A 6 9.114 -6.393 -5.645 1.00 0.00 O ATOM 76 OD2 ASP A 6 8.580 -6.361 -7.731 1.00 0.00 O ATOM 0 H ASP A 6 10.493 -5.609 -4.282 1.00 0.00 H new ATOM 0 HA ASP A 6 11.021 -3.139 -5.905 1.00 0.00 H new ATOM 0 HB2 ASP A 6 9.775 -4.104 -7.763 1.00 0.00 H new ATOM 0 HB3 ASP A 6 11.127 -5.153 -7.386 1.00 0.00 H new ATOM 81 N THR A 7 8.129 -3.191 -5.927 1.00 0.00 N ATOM 82 CA THR A 7 6.830 -2.719 -5.385 1.00 0.00 C ATOM 83 C THR A 7 5.922 -3.907 -5.052 1.00 0.00 C ATOM 84 O THR A 7 6.219 -5.041 -5.371 1.00 0.00 O ATOM 85 CB THR A 7 6.142 -1.823 -6.420 1.00 0.00 C ATOM 86 OG1 THR A 7 4.933 -1.313 -5.876 1.00 0.00 O ATOM 87 CG2 THR A 7 5.831 -2.638 -7.677 1.00 0.00 C ATOM 0 H THR A 7 8.204 -3.196 -6.944 1.00 0.00 H new ATOM 0 HA THR A 7 7.015 -2.154 -4.471 1.00 0.00 H new ATOM 0 HB THR A 7 6.803 -0.995 -6.679 1.00 0.00 H new ATOM 0 HG1 THR A 7 4.567 -0.630 -6.476 1.00 0.00 H new ATOM 0 HG21 THR A 7 5.342 -2.000 -8.413 1.00 0.00 H new ATOM 0 HG22 THR A 7 6.758 -3.029 -8.096 1.00 0.00 H new ATOM 0 HG23 THR A 7 5.171 -3.467 -7.419 1.00 0.00 H new ATOM 95 N THR A 8 4.810 -3.645 -4.415 1.00 0.00 N ATOM 96 CA THR A 8 3.864 -4.742 -4.058 1.00 0.00 C ATOM 97 C THR A 8 2.424 -4.255 -4.298 1.00 0.00 C ATOM 98 O THR A 8 1.888 -3.512 -3.499 1.00 0.00 O ATOM 99 CB THR A 8 4.043 -5.114 -2.585 1.00 0.00 C ATOM 100 OG1 THR A 8 5.421 -5.327 -2.314 1.00 0.00 O ATOM 101 CG2 THR A 8 3.262 -6.395 -2.283 1.00 0.00 C ATOM 0 H THR A 8 4.516 -2.712 -4.125 1.00 0.00 H new ATOM 0 HA THR A 8 4.064 -5.619 -4.674 1.00 0.00 H new ATOM 0 HB THR A 8 3.670 -4.304 -1.959 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.522 -5.715 -1.420 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.390 -6.660 -1.233 1.00 0.00 H new ATOM 0 HG22 THR A 8 2.204 -6.234 -2.491 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.635 -7.205 -2.910 1.00 0.00 H new ATOM 109 N PRO A 9 1.842 -4.675 -5.404 1.00 0.00 N ATOM 110 CA PRO A 9 0.472 -4.271 -5.772 1.00 0.00 C ATOM 111 C PRO A 9 -0.552 -4.736 -4.730 1.00 0.00 C ATOM 112 O PRO A 9 -0.916 -5.894 -4.673 1.00 0.00 O ATOM 113 CB PRO A 9 0.210 -4.965 -7.119 1.00 0.00 C ATOM 114 CG PRO A 9 1.470 -5.796 -7.475 1.00 0.00 C ATOM 115 CD PRO A 9 2.498 -5.579 -6.371 1.00 0.00 C ATOM 0 HA PRO A 9 0.377 -3.187 -5.828 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.667 -5.609 -7.053 1.00 0.00 H new ATOM 0 HB3 PRO A 9 0.006 -4.228 -7.896 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.219 -6.853 -7.561 1.00 0.00 H new ATOM 0 HG3 PRO A 9 1.873 -5.485 -8.439 1.00 0.00 H new ATOM 0 HD2 PRO A 9 2.777 -6.522 -5.902 1.00 0.00 H new ATOM 0 HD3 PRO A 9 3.413 -5.137 -6.766 1.00 0.00 H new ATOM 123 N CYS A 10 -1.037 -3.830 -3.925 1.00 0.00 N ATOM 124 CA CYS A 10 -2.060 -4.193 -2.899 1.00 0.00 C ATOM 125 C CYS A 10 -2.749 -2.920 -2.430 1.00 0.00 C ATOM 126 O CYS A 10 -2.146 -1.866 -2.377 1.00 0.00 O ATOM 127 CB CYS A 10 -1.407 -4.904 -1.713 1.00 0.00 C ATOM 128 SG CYS A 10 0.059 -3.998 -1.160 1.00 0.00 S ATOM 0 H CYS A 10 -0.767 -2.846 -3.933 1.00 0.00 H new ATOM 0 HA CYS A 10 -2.790 -4.873 -3.338 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -2.121 -4.987 -0.893 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -1.129 -5.919 -1.998 1.00 0.00 H new ATOM 133 N CYS A 11 -4.014 -2.992 -2.113 1.00 0.00 N ATOM 134 CA CYS A 11 -4.713 -1.758 -1.685 1.00 0.00 C ATOM 135 C CYS A 11 -4.630 -1.580 -0.167 1.00 0.00 C ATOM 136 O CYS A 11 -4.503 -2.531 0.579 1.00 0.00 O ATOM 137 CB CYS A 11 -6.167 -1.766 -2.149 1.00 0.00 C ATOM 138 SG CYS A 11 -7.074 -3.224 -1.607 1.00 0.00 S ATOM 0 H CYS A 11 -4.581 -3.839 -2.133 1.00 0.00 H new ATOM 0 HA CYS A 11 -4.212 -0.911 -2.153 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -6.667 -0.874 -1.772 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -6.195 -1.712 -3.237 1.00 0.00 H new ATOM 143 N PHE A 12 -4.688 -0.355 0.289 1.00 0.00 N ATOM 144 CA PHE A 12 -4.597 -0.090 1.753 1.00 0.00 C ATOM 145 C PHE A 12 -5.994 0.113 2.346 1.00 0.00 C ATOM 146 O PHE A 12 -6.316 -0.418 3.390 1.00 0.00 O ATOM 147 CB PHE A 12 -3.751 1.168 1.997 1.00 0.00 C ATOM 148 CG PHE A 12 -4.302 2.331 1.203 1.00 0.00 C ATOM 149 CD1 PHE A 12 -5.288 3.173 1.770 1.00 0.00 C ATOM 150 CD2 PHE A 12 -3.813 2.596 -0.095 1.00 0.00 C ATOM 151 CE1 PHE A 12 -5.791 4.269 1.033 1.00 0.00 C ATOM 152 CE2 PHE A 12 -4.314 3.695 -0.829 1.00 0.00 C ATOM 153 CZ PHE A 12 -5.304 4.530 -0.266 1.00 0.00 C ATOM 0 H PHE A 12 -4.795 0.475 -0.294 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.129 -0.948 2.236 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.748 1.413 3.059 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -2.716 0.980 1.710 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -5.656 2.978 2.766 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -3.056 1.959 -0.527 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -6.548 4.907 1.464 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -3.939 3.896 -1.822 1.00 0.00 H new ATOM 0 HZ PHE A 12 -5.688 5.368 -0.829 1.00 0.00 H new ATOM 163 N ALA A 13 -6.826 0.886 1.700 1.00 0.00 N ATOM 164 CA ALA A 13 -8.191 1.123 2.247 1.00 0.00 C ATOM 165 C ALA A 13 -9.219 0.348 1.440 1.00 0.00 C ATOM 166 O ALA A 13 -9.204 0.347 0.227 1.00 0.00 O ATOM 167 CB ALA A 13 -8.517 2.617 2.188 1.00 0.00 C ATOM 0 H ALA A 13 -6.620 1.361 0.821 1.00 0.00 H new ATOM 0 HA ALA A 13 -8.221 0.784 3.282 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -9.516 2.787 2.589 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -7.789 3.172 2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -8.478 2.957 1.153 1.00 0.00 H new ATOM 173 N TYR A 14 -10.114 -0.316 2.112 1.00 0.00 N ATOM 174 CA TYR A 14 -11.147 -1.097 1.385 1.00 0.00 C ATOM 175 C TYR A 14 -12.392 -0.227 1.206 1.00 0.00 C ATOM 176 O TYR A 14 -12.927 0.310 2.156 1.00 0.00 O ATOM 177 CB TYR A 14 -11.528 -2.384 2.150 1.00 0.00 C ATOM 178 CG TYR A 14 -10.550 -2.672 3.272 1.00 0.00 C ATOM 179 CD1 TYR A 14 -9.401 -3.459 3.029 1.00 0.00 C ATOM 180 CD2 TYR A 14 -10.786 -2.149 4.563 1.00 0.00 C ATOM 181 CE1 TYR A 14 -8.491 -3.722 4.076 1.00 0.00 C ATOM 182 CE2 TYR A 14 -9.875 -2.412 5.610 1.00 0.00 C ATOM 183 CZ TYR A 14 -8.727 -3.198 5.366 1.00 0.00 C ATOM 184 OH TYR A 14 -7.837 -3.452 6.390 1.00 0.00 O ATOM 0 H TYR A 14 -10.175 -0.351 3.130 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.740 -1.389 0.417 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -12.533 -2.282 2.559 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -11.549 -3.227 1.459 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.219 -3.859 2.042 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -11.664 -1.548 4.750 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -7.614 -4.324 3.890 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -10.056 -2.012 6.597 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.149 -3.016 7.210 1.00 0.00 H new ATOM 194 N ILE A 15 -12.858 -0.084 -0.004 1.00 0.00 N ATOM 195 CA ILE A 15 -14.068 0.750 -0.248 1.00 0.00 C ATOM 196 C ILE A 15 -15.202 0.280 0.663 1.00 0.00 C ATOM 197 O ILE A 15 -15.477 -0.898 0.770 1.00 0.00 O ATOM 198 CB ILE A 15 -14.498 0.609 -1.709 1.00 0.00 C ATOM 199 CG1 ILE A 15 -13.368 1.087 -2.623 1.00 0.00 C ATOM 200 CG2 ILE A 15 -15.748 1.457 -1.959 1.00 0.00 C ATOM 201 CD1 ILE A 15 -13.794 0.932 -4.085 1.00 0.00 C ATOM 0 H ILE A 15 -12.451 -0.510 -0.837 1.00 0.00 H new ATOM 0 HA ILE A 15 -13.839 1.794 -0.035 1.00 0.00 H new ATOM 0 HB ILE A 15 -14.720 -0.437 -1.921 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -13.131 2.129 -2.411 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -12.463 0.509 -2.433 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -16.054 1.356 -3.000 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -16.554 1.117 -1.309 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -15.527 2.503 -1.746 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -12.989 1.272 -4.737 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -14.010 -0.116 -4.292 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -14.687 1.529 -4.269 1.00 0.00 H new ATOM 213 N ALA A 16 -15.858 1.192 1.322 1.00 0.00 N ATOM 214 CA ALA A 16 -16.973 0.801 2.224 1.00 0.00 C ATOM 215 C ALA A 16 -18.236 0.581 1.392 1.00 0.00 C ATOM 216 O ALA A 16 -19.104 1.428 1.325 1.00 0.00 O ATOM 217 CB ALA A 16 -17.210 1.916 3.241 1.00 0.00 C ATOM 0 H ALA A 16 -15.669 2.193 1.274 1.00 0.00 H new ATOM 0 HA ALA A 16 -16.722 -0.120 2.751 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -18.027 1.635 3.905 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -16.304 2.073 3.826 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -17.468 2.837 2.718 1.00 0.00 H new ATOM 223 N ARG A 17 -18.339 -0.551 0.749 1.00 0.00 N ATOM 224 CA ARG A 17 -19.532 -0.841 -0.092 1.00 0.00 C ATOM 225 C ARG A 17 -19.241 -2.098 -0.930 1.00 0.00 C ATOM 226 O ARG A 17 -18.442 -2.043 -1.842 1.00 0.00 O ATOM 227 CB ARG A 17 -19.806 0.338 -1.031 1.00 0.00 C ATOM 228 CG ARG A 17 -21.015 1.125 -0.523 1.00 0.00 C ATOM 229 CD ARG A 17 -22.099 1.150 -1.601 1.00 0.00 C ATOM 230 NE ARG A 17 -23.087 2.221 -1.288 1.00 0.00 N ATOM 231 CZ ARG A 17 -24.310 2.132 -1.734 1.00 0.00 C ATOM 232 NH1 ARG A 17 -25.214 1.502 -1.035 1.00 0.00 N ATOM 233 NH2 ARG A 17 -24.629 2.674 -2.878 1.00 0.00 N ATOM 0 H ARG A 17 -17.640 -1.293 0.772 1.00 0.00 H new ATOM 0 HA ARG A 17 -20.403 -0.999 0.544 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -18.932 0.987 -1.082 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -19.993 -0.024 -2.042 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.403 0.668 0.387 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -20.718 2.142 -0.267 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -21.651 1.328 -2.578 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.599 0.183 -1.651 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.807 3.024 -0.725 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.964 1.080 -0.141 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -26.170 1.432 -1.383 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -23.922 3.167 -3.423 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -25.585 2.604 -3.226 1.00 0.00 H new ATOM 247 N PRO A 18 -19.887 -3.202 -0.609 1.00 0.00 N ATOM 248 CA PRO A 18 -19.671 -4.458 -1.346 1.00 0.00 C ATOM 249 C PRO A 18 -19.870 -4.235 -2.847 1.00 0.00 C ATOM 250 O PRO A 18 -20.975 -4.046 -3.316 1.00 0.00 O ATOM 251 CB PRO A 18 -20.730 -5.423 -0.792 1.00 0.00 C ATOM 252 CG PRO A 18 -21.495 -4.688 0.338 1.00 0.00 C ATOM 253 CD PRO A 18 -20.871 -3.295 0.489 1.00 0.00 C ATOM 0 HA PRO A 18 -18.660 -4.846 -1.221 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -21.417 -5.731 -1.581 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -20.259 -6.328 -0.409 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -22.555 -4.609 0.095 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -21.423 -5.243 1.273 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -21.626 -2.513 0.411 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -20.391 -3.179 1.461 1.00 0.00 H new ATOM 261 N LEU A 19 -18.805 -4.256 -3.603 1.00 0.00 N ATOM 262 CA LEU A 19 -18.931 -4.046 -5.074 1.00 0.00 C ATOM 263 C LEU A 19 -19.839 -5.135 -5.662 1.00 0.00 C ATOM 264 O LEU A 19 -19.896 -6.229 -5.138 1.00 0.00 O ATOM 265 CB LEU A 19 -17.553 -4.143 -5.742 1.00 0.00 C ATOM 266 CG LEU A 19 -16.530 -3.275 -5.000 1.00 0.00 C ATOM 267 CD1 LEU A 19 -15.203 -3.302 -5.761 1.00 0.00 C ATOM 268 CD2 LEU A 19 -17.034 -1.833 -4.917 1.00 0.00 C ATOM 0 H LEU A 19 -17.855 -4.409 -3.266 1.00 0.00 H new ATOM 0 HA LEU A 19 -19.354 -3.058 -5.256 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -17.219 -5.181 -5.750 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -17.624 -3.823 -6.781 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.389 -3.665 -3.992 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -14.471 -2.686 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -14.838 -4.327 -5.820 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.353 -2.911 -6.768 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -16.302 -1.222 -4.389 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -17.177 -1.439 -5.923 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -17.982 -1.809 -4.380 1.00 0.00 H new ATOM 280 N PRO A 20 -20.517 -4.818 -6.746 1.00 0.00 N ATOM 281 CA PRO A 20 -21.405 -5.787 -7.407 1.00 0.00 C ATOM 282 C PRO A 20 -20.599 -7.017 -7.831 1.00 0.00 C ATOM 283 O PRO A 20 -19.733 -6.941 -8.677 1.00 0.00 O ATOM 284 CB PRO A 20 -21.953 -5.047 -8.637 1.00 0.00 C ATOM 285 CG PRO A 20 -21.385 -3.604 -8.610 1.00 0.00 C ATOM 286 CD PRO A 20 -20.457 -3.490 -7.393 1.00 0.00 C ATOM 0 HA PRO A 20 -22.207 -6.136 -6.756 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -21.657 -5.557 -9.554 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -23.043 -5.030 -8.619 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -20.839 -3.391 -9.529 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -22.194 -2.876 -8.544 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -19.439 -3.242 -7.694 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -20.789 -2.704 -6.715 1.00 0.00 H new ATOM 294 N ARG A 21 -20.867 -8.148 -7.235 1.00 0.00 N ATOM 295 CA ARG A 21 -20.107 -9.384 -7.586 1.00 0.00 C ATOM 296 C ARG A 21 -20.070 -9.581 -9.104 1.00 0.00 C ATOM 297 O ARG A 21 -19.067 -9.980 -9.661 1.00 0.00 O ATOM 298 CB ARG A 21 -20.785 -10.593 -6.939 1.00 0.00 C ATOM 299 CG ARG A 21 -19.993 -11.859 -7.269 1.00 0.00 C ATOM 300 CD ARG A 21 -20.523 -12.469 -8.569 1.00 0.00 C ATOM 301 NE ARG A 21 -21.245 -13.736 -8.265 1.00 0.00 N ATOM 302 CZ ARG A 21 -21.735 -14.457 -9.236 1.00 0.00 C ATOM 303 NH1 ARG A 21 -22.908 -14.170 -9.733 1.00 0.00 N ATOM 304 NH2 ARG A 21 -21.055 -15.465 -9.709 1.00 0.00 N ATOM 0 H ARG A 21 -21.582 -8.270 -6.518 1.00 0.00 H new ATOM 0 HA ARG A 21 -19.085 -9.284 -7.219 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -20.841 -10.457 -5.859 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -21.809 -10.687 -7.302 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -18.934 -11.622 -7.371 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -20.081 -12.578 -6.455 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -21.192 -11.767 -9.066 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -19.698 -12.663 -9.255 1.00 0.00 H new ATOM 0 HE ARG A 21 -21.356 -14.040 -7.298 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -23.440 -13.383 -9.362 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -23.292 -14.733 -10.492 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -20.139 -15.690 -9.320 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -21.439 -16.028 -10.468 1.00 0.00 H new ATOM 318 N ALA A 22 -21.155 -9.318 -9.779 1.00 0.00 N ATOM 319 CA ALA A 22 -21.172 -9.507 -11.257 1.00 0.00 C ATOM 320 C ALA A 22 -20.360 -8.405 -11.937 1.00 0.00 C ATOM 321 O ALA A 22 -19.753 -8.617 -12.969 1.00 0.00 O ATOM 322 CB ALA A 22 -22.616 -9.458 -11.761 1.00 0.00 C ATOM 0 H ALA A 22 -22.028 -8.981 -9.373 1.00 0.00 H new ATOM 0 HA ALA A 22 -20.731 -10.475 -11.496 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -22.629 -9.596 -12.842 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -23.194 -10.251 -11.287 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -23.055 -8.492 -11.514 1.00 0.00 H new ATOM 328 N HIS A 23 -20.346 -7.229 -11.378 1.00 0.00 N ATOM 329 CA HIS A 23 -19.576 -6.121 -12.008 1.00 0.00 C ATOM 330 C HIS A 23 -18.075 -6.387 -11.878 1.00 0.00 C ATOM 331 O HIS A 23 -17.293 -5.942 -12.695 1.00 0.00 O ATOM 332 CB HIS A 23 -19.919 -4.798 -11.324 1.00 0.00 C ATOM 333 CG HIS A 23 -21.333 -4.408 -11.665 1.00 0.00 C ATOM 334 ND1 HIS A 23 -21.750 -3.083 -11.684 1.00 0.00 N ATOM 335 CD2 HIS A 23 -22.435 -5.156 -11.999 1.00 0.00 C ATOM 336 CE1 HIS A 23 -23.047 -3.071 -12.015 1.00 0.00 C ATOM 337 NE2 HIS A 23 -23.516 -4.311 -12.218 1.00 0.00 N ATOM 0 H HIS A 23 -20.832 -6.987 -10.515 1.00 0.00 H new ATOM 0 HA HIS A 23 -19.841 -6.063 -13.064 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -19.808 -4.895 -10.244 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -19.228 -4.019 -11.647 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -22.458 -6.233 -12.079 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -23.642 -2.174 -12.107 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -24.466 -4.577 -12.478 1.00 0.00 H new ATOM 345 N ILE A 24 -17.655 -7.105 -10.868 1.00 0.00 N ATOM 346 CA ILE A 24 -16.195 -7.372 -10.727 1.00 0.00 C ATOM 347 C ILE A 24 -15.793 -8.509 -11.665 1.00 0.00 C ATOM 348 O ILE A 24 -16.625 -9.241 -12.163 1.00 0.00 O ATOM 349 CB ILE A 24 -15.838 -7.786 -9.301 1.00 0.00 C ATOM 350 CG1 ILE A 24 -16.512 -6.875 -8.280 1.00 0.00 C ATOM 351 CG2 ILE A 24 -14.322 -7.691 -9.116 1.00 0.00 C ATOM 352 CD1 ILE A 24 -16.320 -7.463 -6.880 1.00 0.00 C ATOM 0 H ILE A 24 -18.250 -7.512 -10.146 1.00 0.00 H new ATOM 0 HA ILE A 24 -15.665 -6.453 -10.975 1.00 0.00 H new ATOM 0 HB ILE A 24 -16.184 -8.808 -9.143 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -16.084 -5.874 -8.329 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -17.574 -6.779 -8.505 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -14.060 -7.985 -8.100 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -13.827 -8.355 -9.825 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -13.998 -6.665 -9.292 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -16.799 -6.817 -6.145 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -16.768 -8.456 -6.838 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -15.255 -7.536 -6.659 1.00 0.00 H new ATOM 364 N LYS A 25 -14.521 -8.673 -11.898 1.00 0.00 N ATOM 365 CA LYS A 25 -14.063 -9.775 -12.788 1.00 0.00 C ATOM 366 C LYS A 25 -13.070 -10.667 -12.029 1.00 0.00 C ATOM 367 O LYS A 25 -13.148 -11.878 -12.085 1.00 0.00 O ATOM 368 CB LYS A 25 -13.399 -9.182 -14.037 1.00 0.00 C ATOM 369 CG LYS A 25 -12.777 -10.295 -14.884 1.00 0.00 C ATOM 370 CD LYS A 25 -12.598 -9.798 -16.320 1.00 0.00 C ATOM 371 CE LYS A 25 -12.526 -10.993 -17.271 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.100 -11.287 -17.591 1.00 0.00 N ATOM 0 H LYS A 25 -13.778 -8.091 -11.510 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.917 -10.379 -13.095 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -14.137 -8.636 -14.625 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.631 -8.466 -13.744 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.814 -10.590 -14.467 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.415 -11.178 -14.870 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.429 -9.149 -16.597 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.689 -9.202 -16.399 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.994 -11.864 -16.814 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.078 -10.778 -18.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.050 -12.100 -18.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.668 -10.457 -18.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.586 -11.510 -16.715 1.00 0.00 H new ATOM 386 N GLU A 26 -12.126 -10.085 -11.337 1.00 0.00 N ATOM 387 CA GLU A 26 -11.131 -10.894 -10.604 1.00 0.00 C ATOM 388 C GLU A 26 -10.777 -10.159 -9.308 1.00 0.00 C ATOM 389 O GLU A 26 -11.221 -9.056 -9.073 1.00 0.00 O ATOM 390 CB GLU A 26 -9.931 -11.068 -11.559 1.00 0.00 C ATOM 391 CG GLU A 26 -8.552 -10.934 -10.897 1.00 0.00 C ATOM 392 CD GLU A 26 -8.077 -12.307 -10.411 1.00 0.00 C ATOM 393 OE1 GLU A 26 -8.912 -13.186 -10.273 1.00 0.00 O ATOM 394 OE2 GLU A 26 -6.887 -12.455 -10.185 1.00 0.00 O ATOM 0 H GLU A 26 -12.008 -9.075 -11.253 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.492 -11.881 -10.314 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.998 -12.049 -12.028 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.009 -10.328 -12.355 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.836 -10.521 -11.607 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.606 -10.240 -10.059 1.00 0.00 H new ATOM 401 N TYR A 27 -9.970 -10.745 -8.479 1.00 0.00 N ATOM 402 CA TYR A 27 -9.575 -10.066 -7.230 1.00 0.00 C ATOM 403 C TYR A 27 -8.084 -10.317 -7.029 1.00 0.00 C ATOM 404 O TYR A 27 -7.480 -11.055 -7.784 1.00 0.00 O ATOM 405 CB TYR A 27 -10.404 -10.611 -6.057 1.00 0.00 C ATOM 406 CG TYR A 27 -9.991 -12.032 -5.735 1.00 0.00 C ATOM 407 CD1 TYR A 27 -10.534 -13.107 -6.476 1.00 0.00 C ATOM 408 CD2 TYR A 27 -9.056 -12.285 -4.706 1.00 0.00 C ATOM 409 CE1 TYR A 27 -10.144 -14.433 -6.185 1.00 0.00 C ATOM 410 CE2 TYR A 27 -8.665 -13.612 -4.417 1.00 0.00 C ATOM 411 CZ TYR A 27 -9.210 -14.686 -5.156 1.00 0.00 C ATOM 412 OH TYR A 27 -8.829 -15.982 -4.873 1.00 0.00 O ATOM 0 H TYR A 27 -9.566 -11.671 -8.616 1.00 0.00 H new ATOM 0 HA TYR A 27 -9.761 -8.993 -7.283 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -10.266 -9.978 -5.181 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -11.464 -10.582 -6.308 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -11.247 -12.914 -7.264 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -8.640 -11.464 -4.140 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -10.560 -15.254 -6.750 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -7.950 -13.805 -3.631 1.00 0.00 H new ATOM 0 HH TYR A 27 -8.180 -15.979 -4.139 1.00 0.00 H new ATOM 422 N PHE A 28 -7.473 -9.720 -6.047 1.00 0.00 N ATOM 423 CA PHE A 28 -6.021 -9.964 -5.872 1.00 0.00 C ATOM 424 C PHE A 28 -5.650 -9.934 -4.390 1.00 0.00 C ATOM 425 O PHE A 28 -5.270 -8.916 -3.856 1.00 0.00 O ATOM 426 CB PHE A 28 -5.225 -8.902 -6.642 1.00 0.00 C ATOM 427 CG PHE A 28 -3.744 -9.073 -6.381 1.00 0.00 C ATOM 428 CD1 PHE A 28 -2.982 -9.956 -7.178 1.00 0.00 C ATOM 429 CD2 PHE A 28 -3.128 -8.362 -5.328 1.00 0.00 C ATOM 430 CE1 PHE A 28 -1.603 -10.129 -6.919 1.00 0.00 C ATOM 431 CE2 PHE A 28 -1.752 -8.536 -5.068 1.00 0.00 C ATOM 432 CZ PHE A 28 -0.989 -9.421 -5.861 1.00 0.00 C ATOM 0 H PHE A 28 -7.905 -9.088 -5.373 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.776 -10.950 -6.266 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -5.427 -8.988 -7.710 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -5.543 -7.905 -6.337 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.453 -10.499 -7.985 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -3.710 -7.685 -4.721 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.019 -10.802 -7.529 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -1.282 -7.992 -4.262 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.063 -9.557 -5.659 1.00 0.00 H new ATOM 442 N TYR A 29 -5.745 -11.046 -3.722 1.00 0.00 N ATOM 443 CA TYR A 29 -5.388 -11.062 -2.283 1.00 0.00 C ATOM 444 C TYR A 29 -3.896 -10.791 -2.126 1.00 0.00 C ATOM 445 O TYR A 29 -3.061 -11.425 -2.740 1.00 0.00 O ATOM 446 CB TYR A 29 -5.732 -12.423 -1.682 1.00 0.00 C ATOM 447 CG TYR A 29 -5.330 -12.467 -0.227 1.00 0.00 C ATOM 448 CD1 TYR A 29 -6.171 -11.901 0.756 1.00 0.00 C ATOM 449 CD2 TYR A 29 -4.128 -13.104 0.153 1.00 0.00 C ATOM 450 CE1 TYR A 29 -5.809 -11.969 2.120 1.00 0.00 C ATOM 451 CE2 TYR A 29 -3.767 -13.176 1.517 1.00 0.00 C ATOM 452 CZ TYR A 29 -4.606 -12.609 2.500 1.00 0.00 C ATOM 453 OH TYR A 29 -4.257 -12.683 3.834 1.00 0.00 O ATOM 0 H TYR A 29 -6.053 -11.939 -4.108 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.952 -10.289 -1.761 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.801 -12.611 -1.777 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.219 -13.212 -2.233 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.091 -11.416 0.465 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.485 -13.536 -0.599 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.450 -11.533 2.872 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -2.849 -13.665 1.807 1.00 0.00 H new ATOM 0 HH TYR A 29 -3.403 -13.155 3.923 1.00 0.00 H new ATOM 463 N THR A 30 -3.564 -9.845 -1.303 1.00 0.00 N ATOM 464 CA THR A 30 -2.128 -9.505 -1.085 1.00 0.00 C ATOM 465 C THR A 30 -1.559 -10.375 0.041 1.00 0.00 C ATOM 466 O THR A 30 -2.275 -11.112 0.688 1.00 0.00 O ATOM 467 CB THR A 30 -2.006 -8.028 -0.703 1.00 0.00 C ATOM 468 OG1 THR A 30 -0.678 -7.752 -0.281 1.00 0.00 O ATOM 469 CG2 THR A 30 -2.978 -7.713 0.435 1.00 0.00 C ATOM 0 H THR A 30 -4.226 -9.286 -0.766 1.00 0.00 H new ATOM 0 HA THR A 30 -1.568 -9.690 -2.002 1.00 0.00 H new ATOM 0 HB THR A 30 -2.246 -7.410 -1.568 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.690 -7.424 0.642 1.00 0.00 H new ATOM 0 HG21 THR A 30 -2.891 -6.661 0.707 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.998 -7.921 0.111 1.00 0.00 H new ATOM 0 HG23 THR A 30 -2.739 -8.332 1.300 1.00 0.00 H new ATOM 477 N SER A 31 -0.276 -10.301 0.273 1.00 0.00 N ATOM 478 CA SER A 31 0.337 -11.128 1.351 1.00 0.00 C ATOM 479 C SER A 31 0.397 -10.324 2.653 1.00 0.00 C ATOM 480 O SER A 31 -0.346 -9.383 2.848 1.00 0.00 O ATOM 481 CB SER A 31 1.753 -11.534 0.936 1.00 0.00 C ATOM 482 OG SER A 31 1.725 -12.071 -0.377 1.00 0.00 O ATOM 0 H SER A 31 0.374 -9.703 -0.238 1.00 0.00 H new ATOM 0 HA SER A 31 -0.269 -12.020 1.509 1.00 0.00 H new ATOM 0 HB2 SER A 31 2.416 -10.670 0.973 1.00 0.00 H new ATOM 0 HB3 SER A 31 2.151 -12.271 1.634 1.00 0.00 H new ATOM 0 HG SER A 31 2.632 -12.330 -0.644 1.00 0.00 H new ATOM 488 N GLY A 32 1.274 -10.694 3.546 1.00 0.00 N ATOM 489 CA GLY A 32 1.380 -9.957 4.839 1.00 0.00 C ATOM 490 C GLY A 32 2.505 -8.923 4.755 1.00 0.00 C ATOM 491 O GLY A 32 3.168 -8.632 5.731 1.00 0.00 O ATOM 0 H GLY A 32 1.922 -11.474 3.437 1.00 0.00 H new ATOM 0 HA2 GLY A 32 0.435 -9.463 5.065 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.576 -10.656 5.652 1.00 0.00 H new ATOM 495 N LYS A 33 2.723 -8.362 3.598 1.00 0.00 N ATOM 496 CA LYS A 33 3.800 -7.343 3.456 1.00 0.00 C ATOM 497 C LYS A 33 3.203 -6.062 2.871 1.00 0.00 C ATOM 498 O LYS A 33 3.842 -5.349 2.123 1.00 0.00 O ATOM 499 CB LYS A 33 4.888 -7.873 2.522 1.00 0.00 C ATOM 500 CG LYS A 33 4.248 -8.427 1.246 1.00 0.00 C ATOM 501 CD LYS A 33 5.319 -9.105 0.390 1.00 0.00 C ATOM 502 CE LYS A 33 5.981 -10.226 1.194 1.00 0.00 C ATOM 503 NZ LYS A 33 6.444 -11.296 0.267 1.00 0.00 N ATOM 0 H LYS A 33 2.202 -8.565 2.745 1.00 0.00 H new ATOM 0 HA LYS A 33 4.237 -7.133 4.432 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.587 -7.075 2.273 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.461 -8.654 3.022 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.465 -9.141 1.500 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.775 -7.621 0.685 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.872 -9.510 -0.518 1.00 0.00 H new ATOM 0 HD3 LYS A 33 6.067 -8.375 0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.824 -9.832 1.761 1.00 0.00 H new ATOM 0 HE3 LYS A 33 5.275 -10.636 1.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 6.894 -12.058 0.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.630 -11.679 -0.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 7.132 -10.899 -0.405 1.00 0.00 H new ATOM 517 N CYS A 34 1.978 -5.770 3.206 1.00 0.00 N ATOM 518 CA CYS A 34 1.323 -4.542 2.673 1.00 0.00 C ATOM 519 C CYS A 34 0.715 -3.730 3.828 1.00 0.00 C ATOM 520 O CYS A 34 0.111 -2.699 3.616 1.00 0.00 O ATOM 521 CB CYS A 34 0.217 -4.959 1.701 1.00 0.00 C ATOM 522 SG CYS A 34 -0.366 -3.524 0.762 1.00 0.00 S ATOM 0 H CYS A 34 1.398 -6.332 3.830 1.00 0.00 H new ATOM 0 HA CYS A 34 2.060 -3.925 2.159 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.592 -5.722 1.018 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -0.612 -5.404 2.251 1.00 0.00 H new ATOM 527 N SER A 35 0.866 -4.185 5.049 1.00 0.00 N ATOM 528 CA SER A 35 0.291 -3.434 6.206 1.00 0.00 C ATOM 529 C SER A 35 -1.187 -3.143 5.939 1.00 0.00 C ATOM 530 O SER A 35 -1.750 -2.195 6.450 1.00 0.00 O ATOM 531 CB SER A 35 1.048 -2.120 6.391 1.00 0.00 C ATOM 532 OG SER A 35 0.521 -1.423 7.511 1.00 0.00 O ATOM 0 H SER A 35 1.362 -5.042 5.292 1.00 0.00 H new ATOM 0 HA SER A 35 0.385 -4.033 7.112 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.110 -2.317 6.539 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.960 -1.508 5.494 1.00 0.00 H new ATOM 0 HG SER A 35 -0.457 -1.403 7.453 1.00 0.00 H new ATOM 538 N ASN A 36 -1.814 -3.955 5.136 1.00 0.00 N ATOM 539 CA ASN A 36 -3.251 -3.742 4.820 1.00 0.00 C ATOM 540 C ASN A 36 -3.723 -4.869 3.896 1.00 0.00 C ATOM 541 O ASN A 36 -3.965 -4.639 2.729 1.00 0.00 O ATOM 542 CB ASN A 36 -3.430 -2.401 4.112 1.00 0.00 C ATOM 543 CG ASN A 36 -3.977 -1.371 5.100 1.00 0.00 C ATOM 544 OD1 ASN A 36 -3.365 -0.347 5.330 1.00 0.00 O ATOM 545 ND2 ASN A 36 -5.114 -1.600 5.699 1.00 0.00 N ATOM 0 H ASN A 36 -1.388 -4.763 4.682 1.00 0.00 H new ATOM 0 HA ASN A 36 -3.834 -3.741 5.741 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -2.477 -2.062 3.707 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -4.113 -2.511 3.270 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -5.488 -0.919 6.360 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -5.628 -2.460 5.506 1.00 0.00 H new ATOM 552 N PRO A 37 -3.841 -6.061 4.438 1.00 0.00 N ATOM 553 CA PRO A 37 -4.282 -7.217 3.649 1.00 0.00 C ATOM 554 C PRO A 37 -5.640 -6.924 3.018 1.00 0.00 C ATOM 555 O PRO A 37 -6.381 -6.081 3.482 1.00 0.00 O ATOM 556 CB PRO A 37 -4.386 -8.371 4.658 1.00 0.00 C ATOM 557 CG PRO A 37 -3.907 -7.838 6.032 1.00 0.00 C ATOM 558 CD PRO A 37 -3.556 -6.352 5.861 1.00 0.00 C ATOM 0 HA PRO A 37 -3.597 -7.455 2.835 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.413 -8.730 4.724 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.773 -9.214 4.340 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.687 -7.963 6.783 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.039 -8.399 6.378 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -4.155 -5.725 6.521 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.510 -6.162 6.103 1.00 0.00 H new ATOM 566 N ALA A 38 -5.972 -7.609 1.962 1.00 0.00 N ATOM 567 CA ALA A 38 -7.282 -7.369 1.293 1.00 0.00 C ATOM 568 C ALA A 38 -7.373 -8.257 0.060 1.00 0.00 C ATOM 569 O ALA A 38 -6.678 -9.245 -0.062 1.00 0.00 O ATOM 570 CB ALA A 38 -7.377 -5.889 0.865 1.00 0.00 C ATOM 0 H ALA A 38 -5.391 -8.328 1.530 1.00 0.00 H new ATOM 0 HA ALA A 38 -8.097 -7.600 1.979 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -8.335 -5.713 0.376 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -7.296 -5.250 1.744 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -6.568 -5.658 0.172 1.00 0.00 H new ATOM 576 N VAL A 39 -8.203 -7.890 -0.864 1.00 0.00 N ATOM 577 CA VAL A 39 -8.339 -8.668 -2.124 1.00 0.00 C ATOM 578 C VAL A 39 -8.666 -7.641 -3.190 1.00 0.00 C ATOM 579 O VAL A 39 -9.801 -7.259 -3.391 1.00 0.00 O ATOM 580 CB VAL A 39 -9.440 -9.733 -2.017 1.00 0.00 C ATOM 581 CG1 VAL A 39 -8.831 -11.028 -1.481 1.00 0.00 C ATOM 582 CG2 VAL A 39 -10.546 -9.272 -1.069 1.00 0.00 C ATOM 0 H VAL A 39 -8.806 -7.069 -0.802 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.427 -9.218 -2.356 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.869 -9.895 -3.006 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -9.607 -11.790 -1.402 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.052 -11.373 -2.161 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.399 -10.847 -0.497 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.316 -10.041 -1.007 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.127 -9.098 -0.078 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -10.985 -8.348 -1.444 1.00 0.00 H new ATOM 592 N VAL A 40 -7.652 -7.142 -3.817 1.00 0.00 N ATOM 593 CA VAL A 40 -7.841 -6.074 -4.822 1.00 0.00 C ATOM 594 C VAL A 40 -8.723 -6.559 -5.962 1.00 0.00 C ATOM 595 O VAL A 40 -8.377 -7.453 -6.706 1.00 0.00 O ATOM 596 CB VAL A 40 -6.455 -5.627 -5.301 1.00 0.00 C ATOM 597 CG1 VAL A 40 -6.461 -5.226 -6.776 1.00 0.00 C ATOM 598 CG2 VAL A 40 -6.037 -4.422 -4.465 1.00 0.00 C ATOM 0 H VAL A 40 -6.685 -7.432 -3.675 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.357 -5.219 -4.386 1.00 0.00 H new ATOM 0 HB VAL A 40 -5.761 -6.460 -5.187 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -5.459 -4.916 -7.073 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -6.773 -6.076 -7.383 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.155 -4.399 -6.925 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -5.052 -4.082 -4.784 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.760 -3.618 -4.599 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -6.000 -4.704 -3.413 1.00 0.00 H new ATOM 608 N PHE A 41 -9.855 -5.947 -6.111 1.00 0.00 N ATOM 609 CA PHE A 41 -10.759 -6.342 -7.199 1.00 0.00 C ATOM 610 C PHE A 41 -10.276 -5.763 -8.513 1.00 0.00 C ATOM 611 O PHE A 41 -9.446 -4.881 -8.575 1.00 0.00 O ATOM 612 CB PHE A 41 -12.171 -5.826 -6.917 1.00 0.00 C ATOM 613 CG PHE A 41 -12.913 -6.787 -6.017 1.00 0.00 C ATOM 614 CD1 PHE A 41 -12.880 -8.179 -6.271 1.00 0.00 C ATOM 615 CD2 PHE A 41 -13.691 -6.285 -4.952 1.00 0.00 C ATOM 616 CE1 PHE A 41 -13.620 -9.064 -5.453 1.00 0.00 C ATOM 617 CE2 PHE A 41 -14.439 -7.167 -4.144 1.00 0.00 C ATOM 618 CZ PHE A 41 -14.403 -8.557 -4.390 1.00 0.00 C ATOM 0 H PHE A 41 -10.190 -5.186 -5.520 1.00 0.00 H new ATOM 0 HA PHE A 41 -10.771 -7.430 -7.263 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -12.119 -4.844 -6.447 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -12.714 -5.703 -7.854 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -12.290 -8.565 -7.089 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -13.714 -5.223 -4.755 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -13.587 -10.127 -5.640 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -15.040 -6.778 -3.336 1.00 0.00 H new ATOM 0 HZ PHE A 41 -14.972 -9.232 -3.768 1.00 0.00 H new ATOM 628 N VAL A 42 -10.828 -6.269 -9.552 1.00 0.00 N ATOM 629 CA VAL A 42 -10.500 -5.818 -10.920 1.00 0.00 C ATOM 630 C VAL A 42 -11.825 -5.952 -11.677 1.00 0.00 C ATOM 631 O VAL A 42 -12.104 -6.970 -12.280 1.00 0.00 O ATOM 632 CB VAL A 42 -9.435 -6.714 -11.565 1.00 0.00 C ATOM 633 CG1 VAL A 42 -8.083 -6.003 -11.520 1.00 0.00 C ATOM 634 CG2 VAL A 42 -9.317 -8.062 -10.846 1.00 0.00 C ATOM 0 H VAL A 42 -11.526 -7.012 -9.515 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.093 -4.807 -10.932 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.735 -6.904 -12.596 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -7.323 -6.637 -11.978 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.148 -5.062 -12.067 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.812 -5.802 -10.484 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.553 -8.668 -11.332 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.040 -7.896 -9.805 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -10.274 -8.582 -10.889 1.00 0.00 H new ATOM 644 N THR A 43 -12.680 -4.977 -11.569 1.00 0.00 N ATOM 645 CA THR A 43 -14.036 -5.095 -12.197 1.00 0.00 C ATOM 646 C THR A 43 -14.030 -4.719 -13.673 1.00 0.00 C ATOM 647 O THR A 43 -13.025 -4.811 -14.347 1.00 0.00 O ATOM 648 CB THR A 43 -15.023 -4.194 -11.441 1.00 0.00 C ATOM 649 OG1 THR A 43 -14.857 -2.850 -11.866 1.00 0.00 O ATOM 650 CG2 THR A 43 -14.771 -4.286 -9.933 1.00 0.00 C ATOM 0 H THR A 43 -12.505 -4.102 -11.075 1.00 0.00 H new ATOM 0 HA THR A 43 -14.340 -6.140 -12.131 1.00 0.00 H new ATOM 0 HB THR A 43 -16.040 -4.524 -11.653 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.488 -2.275 -11.385 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.476 -3.643 -9.406 1.00 0.00 H new ATOM 0 HG22 THR A 43 -14.904 -5.317 -9.604 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.753 -3.964 -9.714 1.00 0.00 H new ATOM 658 N ARG A 44 -15.173 -4.328 -14.192 1.00 0.00 N ATOM 659 CA ARG A 44 -15.261 -3.974 -15.634 1.00 0.00 C ATOM 660 C ARG A 44 -14.118 -3.023 -15.994 1.00 0.00 C ATOM 661 O ARG A 44 -13.274 -3.345 -16.806 1.00 0.00 O ATOM 662 CB ARG A 44 -16.620 -3.324 -15.942 1.00 0.00 C ATOM 663 CG ARG A 44 -17.003 -2.326 -14.840 1.00 0.00 C ATOM 664 CD ARG A 44 -18.424 -2.618 -14.353 1.00 0.00 C ATOM 665 NE ARG A 44 -19.404 -1.914 -15.227 1.00 0.00 N ATOM 666 CZ ARG A 44 -19.970 -2.550 -16.214 1.00 0.00 C ATOM 667 NH1 ARG A 44 -20.744 -3.573 -15.973 1.00 0.00 N ATOM 668 NH2 ARG A 44 -19.756 -2.169 -17.443 1.00 0.00 N ATOM 0 H ARG A 44 -16.046 -4.241 -13.672 1.00 0.00 H new ATOM 0 HA ARG A 44 -15.174 -4.880 -16.234 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -16.575 -2.813 -16.904 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -17.387 -4.094 -16.026 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -16.301 -2.399 -14.009 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -16.941 -1.307 -15.221 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -18.612 -3.692 -14.369 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -18.540 -2.290 -13.320 1.00 0.00 H new ATOM 0 HE ARG A 44 -19.632 -0.935 -15.053 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -20.906 -3.875 -15.012 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -21.187 -4.071 -16.745 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -19.146 -1.374 -17.631 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -20.199 -2.666 -18.216 1.00 0.00 H new ATOM 682 N LYS A 45 -14.037 -1.884 -15.354 1.00 0.00 N ATOM 683 CA LYS A 45 -12.888 -0.976 -15.633 1.00 0.00 C ATOM 684 C LYS A 45 -11.630 -1.769 -15.275 1.00 0.00 C ATOM 685 O LYS A 45 -10.585 -1.637 -15.880 1.00 0.00 O ATOM 686 CB LYS A 45 -12.985 0.280 -14.763 1.00 0.00 C ATOM 687 CG LYS A 45 -13.623 1.412 -15.570 1.00 0.00 C ATOM 688 CD LYS A 45 -12.525 2.255 -16.223 1.00 0.00 C ATOM 689 CE LYS A 45 -13.017 2.775 -17.576 1.00 0.00 C ATOM 690 NZ LYS A 45 -11.869 3.339 -18.340 1.00 0.00 N ATOM 0 H LYS A 45 -14.706 -1.549 -14.661 1.00 0.00 H new ATOM 0 HA LYS A 45 -12.876 -0.653 -16.674 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.580 0.074 -13.873 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.993 0.577 -14.422 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.283 1.001 -16.334 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -14.237 2.035 -14.920 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -12.259 3.090 -15.575 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -11.624 1.657 -16.357 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -13.481 1.967 -18.141 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -13.780 3.540 -17.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -12.204 3.692 -19.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -11.445 4.121 -17.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.156 2.598 -18.493 1.00 0.00 H new ATOM 704 N ASN A 46 -11.772 -2.637 -14.306 1.00 0.00 N ATOM 705 CA ASN A 46 -10.664 -3.518 -13.879 1.00 0.00 C ATOM 706 C ASN A 46 -9.604 -2.751 -13.141 1.00 0.00 C ATOM 707 O ASN A 46 -8.531 -3.267 -12.892 1.00 0.00 O ATOM 708 CB ASN A 46 -10.050 -4.205 -15.099 1.00 0.00 C ATOM 709 CG ASN A 46 -10.159 -5.724 -14.957 1.00 0.00 C ATOM 710 OD1 ASN A 46 -11.067 -6.224 -14.328 1.00 0.00 O ATOM 711 ND2 ASN A 46 -9.269 -6.486 -15.532 1.00 0.00 N ATOM 0 H ASN A 46 -12.638 -2.769 -13.784 1.00 0.00 H new ATOM 0 HA ASN A 46 -11.072 -4.267 -13.200 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -10.561 -3.879 -16.005 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -9.004 -3.916 -15.201 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -9.338 -7.501 -15.452 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -8.505 -6.067 -16.062 1.00 0.00 H new ATOM 718 N ARG A 47 -9.901 -1.561 -12.702 1.00 0.00 N ATOM 719 CA ARG A 47 -8.901 -0.841 -11.878 1.00 0.00 C ATOM 720 C ARG A 47 -8.636 -1.783 -10.718 1.00 0.00 C ATOM 721 O ARG A 47 -9.459 -2.640 -10.460 1.00 0.00 O ATOM 722 CB ARG A 47 -9.488 0.472 -11.364 1.00 0.00 C ATOM 723 CG ARG A 47 -9.219 1.588 -12.377 1.00 0.00 C ATOM 724 CD ARG A 47 -8.798 2.859 -11.639 1.00 0.00 C ATOM 725 NE ARG A 47 -7.764 3.575 -12.439 1.00 0.00 N ATOM 726 CZ ARG A 47 -7.566 4.852 -12.258 1.00 0.00 C ATOM 727 NH1 ARG A 47 -8.262 5.723 -12.935 1.00 0.00 N ATOM 728 NH2 ARG A 47 -6.672 5.256 -11.397 1.00 0.00 N ATOM 0 H ARG A 47 -10.776 -1.066 -12.875 1.00 0.00 H new ATOM 0 HA ARG A 47 -7.998 -0.589 -12.434 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.561 0.364 -11.203 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.046 0.727 -10.401 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.436 1.282 -13.071 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.114 1.779 -12.970 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.662 3.504 -11.480 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -8.403 2.608 -10.655 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.211 3.066 -13.129 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.961 5.406 -13.606 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.107 6.721 -12.793 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -6.130 4.574 -10.867 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -6.516 6.254 -11.254 1.00 0.00 H new ATOM 742 N GLN A 48 -7.528 -1.708 -10.053 1.00 0.00 N ATOM 743 CA GLN A 48 -7.323 -2.686 -8.968 1.00 0.00 C ATOM 744 C GLN A 48 -7.987 -2.153 -7.713 1.00 0.00 C ATOM 745 O GLN A 48 -7.369 -1.622 -6.817 1.00 0.00 O ATOM 746 CB GLN A 48 -5.848 -2.981 -8.790 1.00 0.00 C ATOM 747 CG GLN A 48 -5.546 -4.224 -9.630 1.00 0.00 C ATOM 748 CD GLN A 48 -4.056 -4.563 -9.552 1.00 0.00 C ATOM 749 OE1 GLN A 48 -3.344 -4.452 -10.530 1.00 0.00 O ATOM 750 NE2 GLN A 48 -3.549 -4.972 -8.420 1.00 0.00 N ATOM 0 H GLN A 48 -6.777 -1.035 -10.206 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.786 -3.642 -9.212 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -5.242 -2.136 -9.117 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.612 -3.156 -7.740 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.138 -5.067 -9.272 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -5.833 -4.050 -10.667 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -4.146 -5.066 -7.598 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -2.556 -5.198 -8.358 1.00 0.00 H new ATOM 759 N VAL A 49 -9.274 -2.296 -7.698 1.00 0.00 N ATOM 760 CA VAL A 49 -10.111 -1.808 -6.575 1.00 0.00 C ATOM 761 C VAL A 49 -9.640 -2.435 -5.255 1.00 0.00 C ATOM 762 O VAL A 49 -8.541 -2.940 -5.153 1.00 0.00 O ATOM 763 CB VAL A 49 -11.602 -2.156 -6.815 1.00 0.00 C ATOM 764 CG1 VAL A 49 -12.450 -0.923 -6.498 1.00 0.00 C ATOM 765 CG2 VAL A 49 -11.893 -2.601 -8.285 1.00 0.00 C ATOM 0 H VAL A 49 -9.801 -2.748 -8.445 1.00 0.00 H new ATOM 0 HA VAL A 49 -10.009 -0.724 -6.516 1.00 0.00 H new ATOM 0 HB VAL A 49 -11.851 -2.995 -6.165 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -13.503 -1.153 -6.663 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.300 -0.636 -5.457 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -12.153 -0.100 -7.148 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -12.953 -2.832 -8.392 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.626 -1.795 -8.969 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -11.303 -3.487 -8.520 1.00 0.00 H new ATOM 775 N CYS A 50 -10.462 -2.382 -4.241 1.00 0.00 N ATOM 776 CA CYS A 50 -10.076 -2.942 -2.911 1.00 0.00 C ATOM 777 C CYS A 50 -11.251 -3.695 -2.296 1.00 0.00 C ATOM 778 O CYS A 50 -12.396 -3.327 -2.465 1.00 0.00 O ATOM 779 CB CYS A 50 -9.732 -1.777 -1.982 1.00 0.00 C ATOM 780 SG CYS A 50 -8.573 -2.274 -0.677 1.00 0.00 S ATOM 0 H CYS A 50 -11.395 -1.970 -4.277 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.231 -3.618 -3.038 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -9.297 -0.964 -2.564 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -10.645 -1.391 -1.529 1.00 0.00 H new ATOM 785 N ALA A 51 -10.974 -4.726 -1.556 1.00 0.00 N ATOM 786 CA ALA A 51 -12.066 -5.479 -0.895 1.00 0.00 C ATOM 787 C ALA A 51 -11.505 -6.150 0.332 1.00 0.00 C ATOM 788 O ALA A 51 -10.624 -6.979 0.275 1.00 0.00 O ATOM 789 CB ALA A 51 -12.663 -6.515 -1.840 1.00 0.00 C ATOM 0 H ALA A 51 -10.034 -5.081 -1.380 1.00 0.00 H new ATOM 0 HA ALA A 51 -12.865 -4.792 -0.615 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -13.462 -7.054 -1.331 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -13.066 -6.015 -2.720 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -11.888 -7.218 -2.145 1.00 0.00 H new ATOM 795 N ASN A 52 -12.018 -5.765 1.446 1.00 0.00 N ATOM 796 CA ASN A 52 -11.571 -6.319 2.735 1.00 0.00 C ATOM 797 C ASN A 52 -11.386 -7.838 2.647 1.00 0.00 C ATOM 798 O ASN A 52 -12.166 -8.509 2.003 1.00 0.00 O ATOM 799 CB ASN A 52 -12.681 -6.028 3.712 1.00 0.00 C ATOM 800 CG ASN A 52 -12.174 -6.137 5.154 1.00 0.00 C ATOM 801 OD1 ASN A 52 -12.665 -6.942 5.919 1.00 0.00 O ATOM 802 ND2 ASN A 52 -11.196 -5.371 5.556 1.00 0.00 N ATOM 0 H ASN A 52 -12.755 -5.064 1.521 1.00 0.00 H new ATOM 0 HA ASN A 52 -10.617 -5.882 3.030 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -13.076 -5.028 3.534 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -13.502 -6.727 3.556 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -10.846 -5.450 6.511 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -10.782 -4.694 4.915 1.00 0.00 H new ATOM 809 N PRO A 53 -10.362 -8.347 3.287 1.00 0.00 N ATOM 810 CA PRO A 53 -10.096 -9.782 3.257 1.00 0.00 C ATOM 811 C PRO A 53 -11.013 -10.530 4.241 1.00 0.00 C ATOM 812 O PRO A 53 -10.941 -11.737 4.359 1.00 0.00 O ATOM 813 CB PRO A 53 -8.647 -9.899 3.726 1.00 0.00 C ATOM 814 CG PRO A 53 -8.289 -8.571 4.438 1.00 0.00 C ATOM 815 CD PRO A 53 -9.385 -7.558 4.072 1.00 0.00 C ATOM 0 HA PRO A 53 -10.270 -10.211 2.270 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.529 -10.744 4.405 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -7.982 -10.074 2.881 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.239 -8.713 5.518 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.310 -8.213 4.118 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.844 -7.129 4.963 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -8.983 -6.729 3.490 1.00 0.00 H new ATOM 823 N GLU A 54 -11.855 -9.833 4.975 1.00 0.00 N ATOM 824 CA GLU A 54 -12.725 -10.549 5.960 1.00 0.00 C ATOM 825 C GLU A 54 -14.099 -9.876 6.120 1.00 0.00 C ATOM 826 O GLU A 54 -14.794 -10.120 7.087 1.00 0.00 O ATOM 827 CB GLU A 54 -12.024 -10.567 7.319 1.00 0.00 C ATOM 828 CG GLU A 54 -12.555 -11.735 8.152 1.00 0.00 C ATOM 829 CD GLU A 54 -11.781 -13.007 7.801 1.00 0.00 C ATOM 830 OE1 GLU A 54 -12.168 -13.670 6.853 1.00 0.00 O ATOM 831 OE2 GLU A 54 -10.817 -13.298 8.489 1.00 0.00 O ATOM 0 H GLU A 54 -11.974 -8.821 4.935 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.889 -11.560 5.586 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.947 -10.664 7.183 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.196 -9.626 7.841 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -12.450 -11.515 9.214 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -13.618 -11.879 7.959 1.00 0.00 H new ATOM 838 N LYS A 55 -14.513 -9.046 5.199 1.00 0.00 N ATOM 839 CA LYS A 55 -15.862 -8.398 5.344 1.00 0.00 C ATOM 840 C LYS A 55 -16.962 -9.313 4.776 1.00 0.00 C ATOM 841 O LYS A 55 -17.872 -8.859 4.110 1.00 0.00 O ATOM 842 CB LYS A 55 -15.898 -7.055 4.610 1.00 0.00 C ATOM 843 CG LYS A 55 -15.419 -5.943 5.546 1.00 0.00 C ATOM 844 CD LYS A 55 -16.564 -4.960 5.793 1.00 0.00 C ATOM 845 CE LYS A 55 -16.419 -4.349 7.187 1.00 0.00 C ATOM 846 NZ LYS A 55 -16.719 -2.891 7.125 1.00 0.00 N ATOM 0 H LYS A 55 -13.989 -8.788 4.363 1.00 0.00 H new ATOM 0 HA LYS A 55 -16.041 -8.232 6.406 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -15.264 -7.096 3.724 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -16.911 -6.844 4.267 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -15.080 -6.368 6.491 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.567 -5.424 5.106 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -16.553 -4.175 5.037 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -17.522 -5.472 5.707 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -17.098 -4.841 7.884 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.408 -4.507 7.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -16.620 -2.476 8.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.055 -2.427 6.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -17.692 -2.751 6.785 1.00 0.00 H new ATOM 860 N LYS A 56 -16.900 -10.590 5.055 1.00 0.00 N ATOM 861 CA LYS A 56 -17.948 -11.536 4.561 1.00 0.00 C ATOM 862 C LYS A 56 -18.161 -11.400 3.044 1.00 0.00 C ATOM 863 O LYS A 56 -17.549 -12.100 2.267 1.00 0.00 O ATOM 864 CB LYS A 56 -19.264 -11.256 5.294 1.00 0.00 C ATOM 865 CG LYS A 56 -19.442 -12.271 6.426 1.00 0.00 C ATOM 866 CD LYS A 56 -19.857 -13.622 5.839 1.00 0.00 C ATOM 867 CE LYS A 56 -21.176 -14.070 6.472 1.00 0.00 C ATOM 868 NZ LYS A 56 -21.289 -15.554 6.388 1.00 0.00 N ATOM 0 H LYS A 56 -16.161 -11.023 5.609 1.00 0.00 H new ATOM 0 HA LYS A 56 -17.614 -12.554 4.761 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -19.260 -10.243 5.696 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -20.101 -11.320 4.599 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -18.512 -12.375 6.985 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -20.198 -11.920 7.128 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -19.969 -13.542 4.758 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -19.081 -14.365 6.025 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -21.219 -13.750 7.513 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -22.016 -13.601 5.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -22.185 -15.859 6.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -21.266 -15.848 5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -20.495 -15.992 6.896 1.00 0.00 H new ATOM 882 N TRP A 57 -19.048 -10.529 2.626 1.00 0.00 N ATOM 883 CA TRP A 57 -19.343 -10.357 1.165 1.00 0.00 C ATOM 884 C TRP A 57 -18.058 -10.377 0.320 1.00 0.00 C ATOM 885 O TRP A 57 -18.026 -10.943 -0.755 1.00 0.00 O ATOM 886 CB TRP A 57 -20.104 -9.037 0.965 1.00 0.00 C ATOM 887 CG TRP A 57 -19.194 -7.886 1.150 1.00 0.00 C ATOM 888 CD1 TRP A 57 -19.155 -7.050 2.208 1.00 0.00 C ATOM 889 CD2 TRP A 57 -18.257 -7.388 0.190 1.00 0.00 C ATOM 890 NE1 TRP A 57 -18.215 -6.064 1.955 1.00 0.00 N ATOM 891 CE2 TRP A 57 -17.628 -6.233 0.716 1.00 0.00 C ATOM 892 CE3 TRP A 57 -17.897 -7.837 -1.093 1.00 0.00 C ATOM 893 CZ2 TRP A 57 -16.653 -5.543 -0.020 1.00 0.00 C ATOM 894 CZ3 TRP A 57 -16.943 -7.150 -1.842 1.00 0.00 C ATOM 895 CH2 TRP A 57 -16.316 -6.000 -1.310 1.00 0.00 C ATOM 0 H TRP A 57 -19.588 -9.921 3.242 1.00 0.00 H new ATOM 0 HA TRP A 57 -19.957 -11.193 0.829 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -20.539 -9.008 -0.034 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -20.929 -8.974 1.674 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -19.755 -7.135 3.102 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -17.986 -5.309 2.602 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -18.363 -8.721 -1.501 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -16.167 -4.673 0.396 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -16.682 -7.497 -2.831 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -15.577 -5.471 -1.893 1.00 0.00 H new ATOM 906 N VAL A 58 -17.009 -9.765 0.785 1.00 0.00 N ATOM 907 CA VAL A 58 -15.736 -9.750 -0.004 1.00 0.00 C ATOM 908 C VAL A 58 -15.371 -11.172 -0.453 1.00 0.00 C ATOM 909 O VAL A 58 -15.213 -11.434 -1.628 1.00 0.00 O ATOM 910 CB VAL A 58 -14.595 -9.164 0.843 1.00 0.00 C ATOM 911 CG1 VAL A 58 -14.617 -7.642 0.746 1.00 0.00 C ATOM 912 CG2 VAL A 58 -14.755 -9.578 2.301 1.00 0.00 C ATOM 0 H VAL A 58 -16.972 -9.272 1.677 1.00 0.00 H new ATOM 0 HA VAL A 58 -15.882 -9.127 -0.886 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.645 -9.544 0.466 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -13.808 -7.227 1.347 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -14.487 -7.342 -0.294 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -15.572 -7.268 1.115 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -13.941 -9.157 2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -15.707 -9.209 2.682 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -14.732 -10.665 2.375 1.00 0.00 H new ATOM 922 N ARG A 59 -15.238 -12.091 0.464 1.00 0.00 N ATOM 923 CA ARG A 59 -14.886 -13.484 0.076 1.00 0.00 C ATOM 924 C ARG A 59 -16.064 -14.111 -0.667 1.00 0.00 C ATOM 925 O ARG A 59 -15.893 -14.966 -1.515 1.00 0.00 O ATOM 926 CB ARG A 59 -14.582 -14.304 1.331 1.00 0.00 C ATOM 927 CG ARG A 59 -13.264 -13.827 1.944 1.00 0.00 C ATOM 928 CD ARG A 59 -13.074 -14.478 3.316 1.00 0.00 C ATOM 929 NE ARG A 59 -12.306 -15.745 3.162 1.00 0.00 N ATOM 930 CZ ARG A 59 -11.096 -15.837 3.644 1.00 0.00 C ATOM 931 NH1 ARG A 59 -10.819 -15.322 4.811 1.00 0.00 N ATOM 932 NH2 ARG A 59 -10.166 -16.443 2.960 1.00 0.00 N ATOM 0 H ARG A 59 -15.358 -11.936 1.465 1.00 0.00 H new ATOM 0 HA ARG A 59 -14.008 -13.473 -0.570 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -15.391 -14.197 2.053 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -14.517 -15.363 1.080 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -12.432 -14.085 1.289 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -13.268 -12.741 2.042 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -12.544 -13.798 3.983 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -14.043 -14.681 3.772 1.00 0.00 H new ATOM 0 HE ARG A 59 -12.725 -16.540 2.680 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -11.547 -14.848 5.345 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.874 -15.393 5.189 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.384 -16.845 2.048 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -9.221 -16.515 3.337 1.00 0.00 H new ATOM 946 N GLU A 60 -17.259 -13.684 -0.365 1.00 0.00 N ATOM 947 CA GLU A 60 -18.447 -14.247 -1.063 1.00 0.00 C ATOM 948 C GLU A 60 -18.290 -14.018 -2.566 1.00 0.00 C ATOM 949 O GLU A 60 -18.893 -14.696 -3.375 1.00 0.00 O ATOM 950 CB GLU A 60 -19.715 -13.549 -0.567 1.00 0.00 C ATOM 951 CG GLU A 60 -20.046 -14.030 0.846 1.00 0.00 C ATOM 952 CD GLU A 60 -20.811 -15.353 0.770 1.00 0.00 C ATOM 953 OE1 GLU A 60 -21.531 -15.543 -0.196 1.00 0.00 O ATOM 954 OE2 GLU A 60 -20.665 -16.153 1.680 1.00 0.00 O ATOM 0 H GLU A 60 -17.463 -12.970 0.334 1.00 0.00 H new ATOM 0 HA GLU A 60 -18.525 -15.314 -0.857 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -19.572 -12.468 -0.570 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -20.546 -13.763 -1.239 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -19.129 -14.161 1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -20.644 -13.281 1.365 1.00 0.00 H new ATOM 961 N TYR A 61 -17.473 -13.072 -2.949 1.00 0.00 N ATOM 962 CA TYR A 61 -17.266 -12.809 -4.397 1.00 0.00 C ATOM 963 C TYR A 61 -15.914 -13.386 -4.811 1.00 0.00 C ATOM 964 O TYR A 61 -15.713 -13.772 -5.945 1.00 0.00 O ATOM 965 CB TYR A 61 -17.288 -11.297 -4.658 1.00 0.00 C ATOM 966 CG TYR A 61 -18.576 -10.678 -4.137 1.00 0.00 C ATOM 967 CD1 TYR A 61 -19.736 -11.471 -3.940 1.00 0.00 C ATOM 968 CD2 TYR A 61 -18.625 -9.290 -3.876 1.00 0.00 C ATOM 969 CE1 TYR A 61 -20.930 -10.876 -3.474 1.00 0.00 C ATOM 970 CE2 TYR A 61 -19.822 -8.696 -3.418 1.00 0.00 C ATOM 971 CZ TYR A 61 -20.973 -9.488 -3.214 1.00 0.00 C ATOM 972 OH TYR A 61 -22.141 -8.906 -2.766 1.00 0.00 O ATOM 0 H TYR A 61 -16.941 -12.472 -2.319 1.00 0.00 H new ATOM 0 HA TYR A 61 -18.062 -13.277 -4.977 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -16.432 -10.827 -4.174 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -17.194 -11.106 -5.727 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -19.706 -12.531 -4.146 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -17.745 -8.682 -4.027 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -21.810 -11.482 -3.317 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -19.857 -7.634 -3.224 1.00 0.00 H new ATOM 0 HH TYR A 61 -21.999 -7.945 -2.636 1.00 0.00 H new ATOM 982 N ILE A 62 -14.987 -13.459 -3.895 1.00 0.00 N ATOM 983 CA ILE A 62 -13.652 -14.024 -4.235 1.00 0.00 C ATOM 984 C ILE A 62 -13.835 -15.452 -4.761 1.00 0.00 C ATOM 985 O ILE A 62 -13.062 -15.931 -5.567 1.00 0.00 O ATOM 986 CB ILE A 62 -12.774 -14.035 -2.976 1.00 0.00 C ATOM 987 CG1 ILE A 62 -12.442 -12.596 -2.577 1.00 0.00 C ATOM 988 CG2 ILE A 62 -11.472 -14.794 -3.250 1.00 0.00 C ATOM 989 CD1 ILE A 62 -11.828 -12.588 -1.176 1.00 0.00 C ATOM 0 H ILE A 62 -15.097 -13.152 -2.928 1.00 0.00 H new ATOM 0 HA ILE A 62 -13.170 -13.417 -5.001 1.00 0.00 H new ATOM 0 HB ILE A 62 -13.315 -14.529 -2.169 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.747 -12.159 -3.294 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -13.344 -11.984 -2.595 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -10.856 -14.796 -2.351 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -11.702 -15.821 -3.535 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.930 -14.306 -4.060 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -11.590 -11.564 -0.889 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -12.539 -13.009 -0.465 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -10.917 -13.186 -1.175 1.00 0.00 H new ATOM 1001 N ASN A 63 -14.852 -16.135 -4.309 1.00 0.00 N ATOM 1002 CA ASN A 63 -15.083 -17.528 -4.782 1.00 0.00 C ATOM 1003 C ASN A 63 -16.175 -17.530 -5.853 1.00 0.00 C ATOM 1004 O ASN A 63 -16.071 -18.203 -6.860 1.00 0.00 O ATOM 1005 CB ASN A 63 -15.524 -18.401 -3.605 1.00 0.00 C ATOM 1006 CG ASN A 63 -15.577 -19.866 -4.043 1.00 0.00 C ATOM 1007 OD1 ASN A 63 -16.153 -20.186 -5.063 1.00 0.00 O ATOM 1008 ND2 ASN A 63 -14.994 -20.775 -3.310 1.00 0.00 N ATOM 0 H ASN A 63 -15.532 -15.788 -3.633 1.00 0.00 H new ATOM 0 HA ASN A 63 -14.159 -17.925 -5.204 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -14.830 -18.285 -2.773 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -16.504 -18.082 -3.250 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -15.022 -21.754 -3.594 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -14.510 -20.506 -2.453 1.00 0.00 H new ATOM 1015 N SER A 64 -17.225 -16.781 -5.645 1.00 0.00 N ATOM 1016 CA SER A 64 -18.324 -16.740 -6.650 1.00 0.00 C ATOM 1017 C SER A 64 -17.751 -16.371 -8.022 1.00 0.00 C ATOM 1018 O SER A 64 -18.333 -16.665 -9.047 1.00 0.00 O ATOM 1019 CB SER A 64 -19.357 -15.693 -6.232 1.00 0.00 C ATOM 1020 OG SER A 64 -20.251 -16.257 -5.283 1.00 0.00 O ATOM 0 H SER A 64 -17.368 -16.196 -4.822 1.00 0.00 H new ATOM 0 HA SER A 64 -18.800 -17.719 -6.707 1.00 0.00 H new ATOM 0 HB2 SER A 64 -18.856 -14.825 -5.804 1.00 0.00 H new ATOM 0 HB3 SER A 64 -19.910 -15.344 -7.104 1.00 0.00 H new ATOM 0 HG SER A 64 -20.050 -15.901 -4.392 1.00 0.00 H new ATOM 1026 N LEU A 65 -16.615 -15.729 -8.049 1.00 0.00 N ATOM 1027 CA LEU A 65 -16.009 -15.344 -9.354 1.00 0.00 C ATOM 1028 C LEU A 65 -15.755 -16.601 -10.188 1.00 0.00 C ATOM 1029 O LEU A 65 -14.898 -17.403 -9.873 1.00 0.00 O ATOM 1030 CB LEU A 65 -14.685 -14.617 -9.108 1.00 0.00 C ATOM 1031 CG LEU A 65 -14.956 -13.138 -8.829 1.00 0.00 C ATOM 1032 CD1 LEU A 65 -13.815 -12.560 -7.991 1.00 0.00 C ATOM 1033 CD2 LEU A 65 -15.053 -12.379 -10.154 1.00 0.00 C ATOM 0 H LEU A 65 -16.081 -15.455 -7.224 1.00 0.00 H new ATOM 0 HA LEU A 65 -16.690 -14.684 -9.891 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -14.163 -15.067 -8.264 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -14.035 -14.720 -9.977 1.00 0.00 H new ATOM 0 HG LEU A 65 -15.894 -13.036 -8.283 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -14.008 -11.506 -7.792 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -13.747 -13.101 -7.047 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -12.876 -12.661 -8.536 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -15.246 -11.325 -9.956 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -14.115 -12.480 -10.701 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -15.867 -12.791 -10.751 1.00 0.00 H new ATOM 1147 N SER B 5 -11.377 3.172 -3.810 1.00 0.00 N ATOM 1148 CA SER B 5 -10.126 2.611 -3.228 1.00 0.00 C ATOM 1149 C SER B 5 -9.562 1.530 -4.153 1.00 0.00 C ATOM 1150 O SER B 5 -10.246 0.600 -4.533 1.00 0.00 O ATOM 1151 CB SER B 5 -10.432 1.998 -1.860 1.00 0.00 C ATOM 1152 OG SER B 5 -9.482 2.465 -0.911 1.00 0.00 O ATOM 0 HA SER B 5 -9.392 3.409 -3.118 1.00 0.00 H new ATOM 0 HB2 SER B 5 -11.440 2.268 -1.545 1.00 0.00 H new ATOM 0 HB3 SER B 5 -10.398 0.910 -1.921 1.00 0.00 H new ATOM 0 HG SER B 5 -9.000 1.702 -0.528 1.00 0.00 H new ATOM 1158 N ASP B 6 -8.312 1.645 -4.511 1.00 0.00 N ATOM 1159 CA ASP B 6 -7.689 0.627 -5.404 1.00 0.00 C ATOM 1160 C ASP B 6 -6.315 0.256 -4.849 1.00 0.00 C ATOM 1161 O ASP B 6 -6.060 0.397 -3.671 1.00 0.00 O ATOM 1162 CB ASP B 6 -7.556 1.197 -6.823 1.00 0.00 C ATOM 1163 CG ASP B 6 -6.583 2.380 -6.823 1.00 0.00 C ATOM 1164 OD1 ASP B 6 -6.416 2.986 -5.779 1.00 0.00 O ATOM 1165 OD2 ASP B 6 -6.021 2.657 -7.870 1.00 0.00 O ATOM 0 H ASP B 6 -7.693 2.403 -4.222 1.00 0.00 H new ATOM 0 HA ASP B 6 -8.314 -0.265 -5.446 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -7.200 0.423 -7.503 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -8.532 1.518 -7.188 1.00 0.00 H new ATOM 1170 N THR B 7 -5.432 -0.232 -5.672 1.00 0.00 N ATOM 1171 CA THR B 7 -4.097 -0.628 -5.159 1.00 0.00 C ATOM 1172 C THR B 7 -3.175 0.591 -5.061 1.00 0.00 C ATOM 1173 O THR B 7 -3.497 1.668 -5.519 1.00 0.00 O ATOM 1174 CB THR B 7 -3.478 -1.664 -6.102 1.00 0.00 C ATOM 1175 OG1 THR B 7 -2.233 -2.100 -5.575 1.00 0.00 O ATOM 1176 CG2 THR B 7 -3.256 -1.036 -7.480 1.00 0.00 C ATOM 0 H THR B 7 -5.577 -0.373 -6.672 1.00 0.00 H new ATOM 0 HA THR B 7 -4.215 -1.056 -4.164 1.00 0.00 H new ATOM 0 HB THR B 7 -4.152 -2.515 -6.196 1.00 0.00 H new ATOM 0 HG1 THR B 7 -1.837 -2.764 -6.177 1.00 0.00 H new ATOM 0 HG21 THR B 7 -2.815 -1.775 -8.150 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.211 -0.702 -7.886 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.583 -0.183 -7.387 1.00 0.00 H new ATOM 1184 N THR B 8 -2.024 0.417 -4.467 1.00 0.00 N ATOM 1185 CA THR B 8 -1.061 1.549 -4.333 1.00 0.00 C ATOM 1186 C THR B 8 0.362 1.027 -4.599 1.00 0.00 C ATOM 1187 O THR B 8 0.953 0.402 -3.740 1.00 0.00 O ATOM 1188 CB THR B 8 -1.143 2.127 -2.919 1.00 0.00 C ATOM 1189 OG1 THR B 8 -2.501 2.383 -2.591 1.00 0.00 O ATOM 1190 CG2 THR B 8 -0.348 3.431 -2.855 1.00 0.00 C ATOM 0 H THR B 8 -1.708 -0.466 -4.067 1.00 0.00 H new ATOM 0 HA THR B 8 -1.306 2.331 -5.052 1.00 0.00 H new ATOM 0 HB THR B 8 -0.726 1.413 -2.209 1.00 0.00 H new ATOM 0 HG1 THR B 8 -2.546 2.866 -1.740 1.00 0.00 H new ATOM 0 HG21 THR B 8 -0.406 3.843 -1.848 1.00 0.00 H new ATOM 0 HG22 THR B 8 0.694 3.235 -3.107 1.00 0.00 H new ATOM 0 HG23 THR B 8 -0.764 4.146 -3.564 1.00 0.00 H new ATOM 1198 N PRO B 9 0.866 1.283 -5.789 1.00 0.00 N ATOM 1199 CA PRO B 9 2.210 0.825 -6.187 1.00 0.00 C ATOM 1200 C PRO B 9 3.299 1.428 -5.291 1.00 0.00 C ATOM 1201 O PRO B 9 3.658 2.580 -5.419 1.00 0.00 O ATOM 1202 CB PRO B 9 2.379 1.321 -7.633 1.00 0.00 C ATOM 1203 CG PRO B 9 1.093 2.098 -8.018 1.00 0.00 C ATOM 1204 CD PRO B 9 0.143 2.043 -6.829 1.00 0.00 C ATOM 0 HA PRO B 9 2.306 -0.257 -6.096 1.00 0.00 H new ATOM 0 HB2 PRO B 9 3.254 1.965 -7.717 1.00 0.00 H new ATOM 0 HB3 PRO B 9 2.535 0.481 -8.310 1.00 0.00 H new ATOM 0 HG2 PRO B 9 1.332 3.132 -8.269 1.00 0.00 H new ATOM 0 HG3 PRO B 9 0.628 1.655 -8.899 1.00 0.00 H new ATOM 0 HD2 PRO B 9 -0.110 3.044 -6.481 1.00 0.00 H new ATOM 0 HD3 PRO B 9 -0.793 1.553 -7.096 1.00 0.00 H new ATOM 1212 N CYS B 10 3.843 0.641 -4.401 1.00 0.00 N ATOM 1213 CA CYS B 10 4.931 1.140 -3.508 1.00 0.00 C ATOM 1214 C CYS B 10 5.655 -0.057 -2.909 1.00 0.00 C ATOM 1215 O CYS B 10 5.061 -1.088 -2.660 1.00 0.00 O ATOM 1216 CB CYS B 10 4.353 2.017 -2.394 1.00 0.00 C ATOM 1217 SG CYS B 10 2.935 1.202 -1.620 1.00 0.00 S ATOM 0 H CYS B 10 3.579 -0.333 -4.253 1.00 0.00 H new ATOM 0 HA CYS B 10 5.628 1.746 -4.087 1.00 0.00 H new ATOM 0 HB2 CYS B 10 5.119 2.216 -1.645 1.00 0.00 H new ATOM 0 HB3 CYS B 10 4.048 2.981 -2.802 1.00 0.00 H new ATOM 1222 N CYS B 11 6.941 0.051 -2.699 1.00 0.00 N ATOM 1223 CA CYS B 11 7.673 -1.115 -2.148 1.00 0.00 C ATOM 1224 C CYS B 11 7.692 -1.078 -0.617 1.00 0.00 C ATOM 1225 O CYS B 11 7.613 -0.031 -0.005 1.00 0.00 O ATOM 1226 CB CYS B 11 9.094 -1.177 -2.702 1.00 0.00 C ATOM 1227 SG CYS B 11 10.024 0.343 -2.435 1.00 0.00 S ATOM 0 H CYS B 11 7.503 0.882 -2.883 1.00 0.00 H new ATOM 0 HA CYS B 11 7.146 -2.017 -2.459 1.00 0.00 H new ATOM 0 HB2 CYS B 11 9.624 -2.007 -2.234 1.00 0.00 H new ATOM 0 HB3 CYS B 11 9.052 -1.387 -3.771 1.00 0.00 H new ATOM 1232 N PHE B 12 7.780 -2.228 0.002 1.00 0.00 N ATOM 1233 CA PHE B 12 7.788 -2.285 1.492 1.00 0.00 C ATOM 1234 C PHE B 12 9.223 -2.405 2.012 1.00 0.00 C ATOM 1235 O PHE B 12 9.609 -1.733 2.948 1.00 0.00 O ATOM 1236 CB PHE B 12 6.971 -3.496 1.968 1.00 0.00 C ATOM 1237 CG PHE B 12 7.480 -4.760 1.311 1.00 0.00 C ATOM 1238 CD1 PHE B 12 8.504 -5.515 1.926 1.00 0.00 C ATOM 1239 CD2 PHE B 12 6.907 -5.204 0.098 1.00 0.00 C ATOM 1240 CE1 PHE B 12 8.964 -6.707 1.320 1.00 0.00 C ATOM 1241 CE2 PHE B 12 7.364 -6.397 -0.504 1.00 0.00 C ATOM 1242 CZ PHE B 12 8.393 -7.148 0.106 1.00 0.00 C ATOM 0 H PHE B 12 7.847 -3.133 -0.464 1.00 0.00 H new ATOM 0 HA PHE B 12 7.345 -1.368 1.879 1.00 0.00 H new ATOM 0 HB2 PHE B 12 7.040 -3.587 3.052 1.00 0.00 H new ATOM 0 HB3 PHE B 12 5.918 -3.351 1.727 1.00 0.00 H new ATOM 0 HD1 PHE B 12 8.935 -5.182 2.858 1.00 0.00 H new ATOM 0 HD2 PHE B 12 6.119 -4.631 -0.369 1.00 0.00 H new ATOM 0 HE1 PHE B 12 9.752 -7.280 1.786 1.00 0.00 H new ATOM 0 HE2 PHE B 12 6.926 -6.735 -1.432 1.00 0.00 H new ATOM 0 HZ PHE B 12 8.743 -8.059 -0.356 1.00 0.00 H new ATOM 1252 N ALA B 13 10.017 -3.261 1.427 1.00 0.00 N ATOM 1253 CA ALA B 13 11.418 -3.423 1.911 1.00 0.00 C ATOM 1254 C ALA B 13 12.384 -2.774 0.935 1.00 0.00 C ATOM 1255 O ALA B 13 12.288 -2.945 -0.263 1.00 0.00 O ATOM 1256 CB ALA B 13 11.748 -4.909 2.044 1.00 0.00 C ATOM 0 H ALA B 13 9.757 -3.853 0.638 1.00 0.00 H new ATOM 0 HA ALA B 13 11.515 -2.941 2.884 1.00 0.00 H new ATOM 0 HB1 ALA B 13 12.773 -5.024 2.398 1.00 0.00 H new ATOM 0 HB2 ALA B 13 11.064 -5.371 2.756 1.00 0.00 H new ATOM 0 HB3 ALA B 13 11.643 -5.393 1.073 1.00 0.00 H new ATOM 1262 N TYR B 14 13.319 -2.027 1.446 1.00 0.00 N ATOM 1263 CA TYR B 14 14.298 -1.360 0.550 1.00 0.00 C ATOM 1264 C TYR B 14 15.533 -2.251 0.412 1.00 0.00 C ATOM 1265 O TYR B 14 16.135 -2.651 1.389 1.00 0.00 O ATOM 1266 CB TYR B 14 14.722 0.020 1.100 1.00 0.00 C ATOM 1267 CG TYR B 14 13.819 0.467 2.234 1.00 0.00 C ATOM 1268 CD1 TYR B 14 12.651 1.215 1.959 1.00 0.00 C ATOM 1269 CD2 TYR B 14 14.143 0.129 3.567 1.00 0.00 C ATOM 1270 CE1 TYR B 14 11.809 1.623 3.018 1.00 0.00 C ATOM 1271 CE2 TYR B 14 13.302 0.538 4.625 1.00 0.00 C ATOM 1272 CZ TYR B 14 12.135 1.285 4.351 1.00 0.00 C ATOM 1273 OH TYR B 14 11.313 1.685 5.384 1.00 0.00 O ATOM 0 H TYR B 14 13.447 -1.850 2.442 1.00 0.00 H new ATOM 0 HA TYR B 14 13.826 -1.205 -0.420 1.00 0.00 H new ATOM 0 HB2 TYR B 14 15.753 -0.028 1.451 1.00 0.00 H new ATOM 0 HB3 TYR B 14 14.693 0.757 0.298 1.00 0.00 H new ATOM 0 HD1 TYR B 14 12.403 1.474 0.940 1.00 0.00 H new ATOM 0 HD2 TYR B 14 15.035 -0.443 3.777 1.00 0.00 H new ATOM 0 HE1 TYR B 14 10.916 2.193 2.809 1.00 0.00 H new ATOM 0 HE2 TYR B 14 13.551 0.280 5.644 1.00 0.00 H new ATOM 0 HH TYR B 14 11.681 1.369 6.236 1.00 0.00 H new ATOM 1283 N ILE B 15 15.916 -2.568 -0.795 1.00 0.00 N ATOM 1284 CA ILE B 15 17.110 -3.433 -1.000 1.00 0.00 C ATOM 1285 C ILE B 15 18.301 -2.845 -0.242 1.00 0.00 C ATOM 1286 O ILE B 15 18.576 -1.665 -0.322 1.00 0.00 O ATOM 1287 CB ILE B 15 17.442 -3.503 -2.493 1.00 0.00 C ATOM 1288 CG1 ILE B 15 16.256 -4.101 -3.253 1.00 0.00 C ATOM 1289 CG2 ILE B 15 18.676 -4.383 -2.703 1.00 0.00 C ATOM 1290 CD1 ILE B 15 16.582 -4.155 -4.747 1.00 0.00 C ATOM 0 H ILE B 15 15.451 -2.263 -1.650 1.00 0.00 H new ATOM 0 HA ILE B 15 16.899 -4.435 -0.628 1.00 0.00 H new ATOM 0 HB ILE B 15 17.644 -2.499 -2.865 1.00 0.00 H new ATOM 0 HG12 ILE B 15 16.040 -5.102 -2.881 1.00 0.00 H new ATOM 0 HG13 ILE B 15 15.363 -3.499 -3.086 1.00 0.00 H new ATOM 0 HG21 ILE B 15 18.911 -4.432 -3.766 1.00 0.00 H new ATOM 0 HG22 ILE B 15 19.522 -3.958 -2.163 1.00 0.00 H new ATOM 0 HG23 ILE B 15 18.475 -5.387 -2.329 1.00 0.00 H new ATOM 0 HD11 ILE B 15 15.737 -4.581 -5.289 1.00 0.00 H new ATOM 0 HD12 ILE B 15 16.777 -3.147 -5.114 1.00 0.00 H new ATOM 0 HD13 ILE B 15 17.464 -4.775 -4.905 1.00 0.00 H new ATOM 1302 N ALA B 16 19.004 -3.658 0.492 1.00 0.00 N ATOM 1303 CA ALA B 16 20.176 -3.149 1.254 1.00 0.00 C ATOM 1304 C ALA B 16 21.380 -3.054 0.316 1.00 0.00 C ATOM 1305 O ALA B 16 22.245 -3.906 0.310 1.00 0.00 O ATOM 1306 CB ALA B 16 20.486 -4.110 2.399 1.00 0.00 C ATOM 0 H ALA B 16 18.818 -4.655 0.598 1.00 0.00 H new ATOM 0 HA ALA B 16 19.956 -2.162 1.661 1.00 0.00 H new ATOM 0 HB1 ALA B 16 21.344 -3.742 2.961 1.00 0.00 H new ATOM 0 HB2 ALA B 16 19.622 -4.179 3.060 1.00 0.00 H new ATOM 0 HB3 ALA B 16 20.713 -5.096 1.995 1.00 0.00 H new ATOM 1312 N ARG B 17 21.433 -2.024 -0.486 1.00 0.00 N ATOM 1313 CA ARG B 17 22.566 -1.861 -1.437 1.00 0.00 C ATOM 1314 C ARG B 17 22.216 -0.733 -2.424 1.00 0.00 C ATOM 1315 O ARG B 17 21.357 -0.914 -3.264 1.00 0.00 O ATOM 1316 CB ARG B 17 22.783 -3.163 -2.217 1.00 0.00 C ATOM 1317 CG ARG B 17 24.027 -3.876 -1.684 1.00 0.00 C ATOM 1318 CD ARG B 17 25.036 -4.058 -2.820 1.00 0.00 C ATOM 1319 NE ARG B 17 26.047 -5.079 -2.426 1.00 0.00 N ATOM 1320 CZ ARG B 17 27.238 -5.059 -2.960 1.00 0.00 C ATOM 1321 NH1 ARG B 17 28.183 -4.342 -2.419 1.00 0.00 N ATOM 1322 NH2 ARG B 17 27.482 -5.758 -4.035 1.00 0.00 N ATOM 0 H ARG B 17 20.733 -1.283 -0.522 1.00 0.00 H new ATOM 0 HA ARG B 17 23.476 -1.618 -0.888 1.00 0.00 H new ATOM 0 HB2 ARG B 17 21.910 -3.809 -2.118 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.901 -2.948 -3.279 1.00 0.00 H new ATOM 0 HG2 ARG B 17 24.473 -3.296 -0.876 1.00 0.00 H new ATOM 0 HG3 ARG B 17 23.753 -4.845 -1.267 1.00 0.00 H new ATOM 0 HD2 ARG B 17 24.523 -4.370 -3.730 1.00 0.00 H new ATOM 0 HD3 ARG B 17 25.527 -3.110 -3.040 1.00 0.00 H new ATOM 0 HE ARG B 17 25.808 -5.794 -1.739 1.00 0.00 H new ATOM 0 HH11 ARG B 17 27.992 -3.797 -1.578 1.00 0.00 H new ATOM 0 HH12 ARG B 17 29.114 -4.326 -2.836 1.00 0.00 H new ATOM 0 HH21 ARG B 17 26.742 -6.319 -4.457 1.00 0.00 H new ATOM 0 HH22 ARG B 17 28.412 -5.743 -4.453 1.00 0.00 H new ATOM 1336 N PRO B 18 22.875 0.402 -2.305 1.00 0.00 N ATOM 1337 CA PRO B 18 22.606 1.542 -3.197 1.00 0.00 C ATOM 1338 C PRO B 18 22.705 1.108 -4.660 1.00 0.00 C ATOM 1339 O PRO B 18 23.776 0.848 -5.171 1.00 0.00 O ATOM 1340 CB PRO B 18 23.696 2.570 -2.855 1.00 0.00 C ATOM 1341 CG PRO B 18 24.535 1.998 -1.685 1.00 0.00 C ATOM 1342 CD PRO B 18 23.930 0.643 -1.299 1.00 0.00 C ATOM 0 HA PRO B 18 21.604 1.950 -3.063 1.00 0.00 H new ATOM 0 HB2 PRO B 18 24.329 2.759 -3.722 1.00 0.00 H new ATOM 0 HB3 PRO B 18 23.248 3.523 -2.574 1.00 0.00 H new ATOM 0 HG2 PRO B 18 25.577 1.881 -1.983 1.00 0.00 H new ATOM 0 HG3 PRO B 18 24.521 2.680 -0.835 1.00 0.00 H new ATOM 0 HD2 PRO B 18 24.682 -0.146 -1.317 1.00 0.00 H new ATOM 0 HD3 PRO B 18 23.517 0.667 -0.290 1.00 0.00 H new ATOM 1350 N LEU B 19 21.592 1.031 -5.339 1.00 0.00 N ATOM 1351 CA LEU B 19 21.619 0.613 -6.771 1.00 0.00 C ATOM 1352 C LEU B 19 22.482 1.603 -7.568 1.00 0.00 C ATOM 1353 O LEU B 19 22.569 2.760 -7.208 1.00 0.00 O ATOM 1354 CB LEU B 19 20.197 0.621 -7.349 1.00 0.00 C ATOM 1355 CG LEU B 19 19.234 -0.132 -6.426 1.00 0.00 C ATOM 1356 CD1 LEU B 19 17.857 -0.204 -7.091 1.00 0.00 C ATOM 1357 CD2 LEU B 19 19.749 -1.550 -6.180 1.00 0.00 C ATOM 0 H LEU B 19 20.666 1.239 -4.965 1.00 0.00 H new ATOM 0 HA LEU B 19 22.033 -0.393 -6.841 1.00 0.00 H new ATOM 0 HB2 LEU B 19 19.857 1.649 -7.477 1.00 0.00 H new ATOM 0 HB3 LEU B 19 20.198 0.160 -8.337 1.00 0.00 H new ATOM 0 HG LEU B 19 19.162 0.393 -5.474 1.00 0.00 H new ATOM 0 HD11 LEU B 19 17.166 -0.739 -6.440 1.00 0.00 H new ATOM 0 HD12 LEU B 19 17.484 0.805 -7.265 1.00 0.00 H new ATOM 0 HD13 LEU B 19 17.939 -0.730 -8.042 1.00 0.00 H new ATOM 0 HD21 LEU B 19 19.059 -2.079 -5.523 1.00 0.00 H new ATOM 0 HD22 LEU B 19 19.824 -2.080 -7.130 1.00 0.00 H new ATOM 0 HD23 LEU B 19 20.732 -1.504 -5.712 1.00 0.00 H new ATOM 1369 N PRO B 20 23.087 1.132 -8.640 1.00 0.00 N ATOM 1370 CA PRO B 20 23.927 1.992 -9.490 1.00 0.00 C ATOM 1371 C PRO B 20 23.093 3.154 -10.034 1.00 0.00 C ATOM 1372 O PRO B 20 22.190 2.965 -10.821 1.00 0.00 O ATOM 1373 CB PRO B 20 24.397 1.080 -10.634 1.00 0.00 C ATOM 1374 CG PRO B 20 23.834 -0.340 -10.365 1.00 0.00 C ATOM 1375 CD PRO B 20 22.988 -0.274 -9.086 1.00 0.00 C ATOM 0 HA PRO B 20 24.767 2.426 -8.948 1.00 0.00 H new ATOM 0 HB2 PRO B 20 24.043 1.457 -11.594 1.00 0.00 H new ATOM 0 HB3 PRO B 20 25.486 1.057 -10.683 1.00 0.00 H new ATOM 0 HG2 PRO B 20 23.229 -0.677 -11.207 1.00 0.00 H new ATOM 0 HG3 PRO B 20 24.646 -1.058 -10.249 1.00 0.00 H new ATOM 0 HD2 PRO B 20 21.953 -0.555 -9.281 1.00 0.00 H new ATOM 0 HD3 PRO B 20 23.366 -0.958 -8.326 1.00 0.00 H new ATOM 1383 N ARG B 21 23.379 4.354 -9.608 1.00 0.00 N ATOM 1384 CA ARG B 21 22.594 5.534 -10.084 1.00 0.00 C ATOM 1385 C ARG B 21 22.455 5.513 -11.610 1.00 0.00 C ATOM 1386 O ARG B 21 21.415 5.838 -12.148 1.00 0.00 O ATOM 1387 CB ARG B 21 23.310 6.818 -9.662 1.00 0.00 C ATOM 1388 CG ARG B 21 22.491 8.030 -10.112 1.00 0.00 C ATOM 1389 CD ARG B 21 22.929 8.448 -11.517 1.00 0.00 C ATOM 1390 NE ARG B 21 23.663 9.743 -11.443 1.00 0.00 N ATOM 1391 CZ ARG B 21 24.085 10.317 -12.537 1.00 0.00 C ATOM 1392 NH1 ARG B 21 25.221 9.957 -13.067 1.00 0.00 N ATOM 1393 NH2 ARG B 21 23.368 11.252 -13.100 1.00 0.00 N ATOM 0 H ARG B 21 24.126 4.571 -8.948 1.00 0.00 H new ATOM 0 HA ARG B 21 21.599 5.494 -9.641 1.00 0.00 H new ATOM 0 HB2 ARG B 21 23.441 6.835 -8.580 1.00 0.00 H new ATOM 0 HB3 ARG B 21 24.306 6.854 -10.104 1.00 0.00 H new ATOM 0 HG2 ARG B 21 21.429 7.786 -10.108 1.00 0.00 H new ATOM 0 HG3 ARG B 21 22.631 8.856 -9.415 1.00 0.00 H new ATOM 0 HD2 ARG B 21 23.567 7.680 -11.954 1.00 0.00 H new ATOM 0 HD3 ARG B 21 22.059 8.547 -12.166 1.00 0.00 H new ATOM 0 HE ARG B 21 23.836 10.181 -10.538 1.00 0.00 H new ATOM 0 HH11 ARG B 21 25.780 9.226 -12.627 1.00 0.00 H new ATOM 0 HH12 ARG B 21 25.550 10.406 -13.922 1.00 0.00 H new ATOM 0 HH21 ARG B 21 22.480 11.533 -12.685 1.00 0.00 H new ATOM 0 HH22 ARG B 21 23.696 11.701 -13.955 1.00 0.00 H new ATOM 1407 N ALA B 22 23.491 5.148 -12.313 1.00 0.00 N ATOM 1408 CA ALA B 22 23.407 5.128 -13.803 1.00 0.00 C ATOM 1409 C ALA B 22 22.548 3.949 -14.265 1.00 0.00 C ATOM 1410 O ALA B 22 21.855 4.029 -15.260 1.00 0.00 O ATOM 1411 CB ALA B 22 24.812 4.997 -14.391 1.00 0.00 C ATOM 0 H ALA B 22 24.390 4.863 -11.923 1.00 0.00 H new ATOM 0 HA ALA B 22 22.951 6.057 -14.146 1.00 0.00 H new ATOM 0 HB1 ALA B 22 24.751 4.982 -15.479 1.00 0.00 H new ATOM 0 HB2 ALA B 22 25.420 5.844 -14.073 1.00 0.00 H new ATOM 0 HB3 ALA B 22 25.268 4.071 -14.041 1.00 0.00 H new ATOM 1417 N HIS B 23 22.589 2.854 -13.560 1.00 0.00 N ATOM 1418 CA HIS B 23 21.777 1.674 -13.972 1.00 0.00 C ATOM 1419 C HIS B 23 20.288 1.968 -13.777 1.00 0.00 C ATOM 1420 O HIS B 23 19.452 1.419 -14.468 1.00 0.00 O ATOM 1421 CB HIS B 23 22.171 0.463 -13.127 1.00 0.00 C ATOM 1422 CG HIS B 23 23.564 0.025 -13.496 1.00 0.00 C ATOM 1423 ND1 HIS B 23 23.988 -1.291 -13.354 1.00 0.00 N ATOM 1424 CD2 HIS B 23 24.639 0.714 -14.002 1.00 0.00 C ATOM 1425 CE1 HIS B 23 25.261 -1.354 -13.763 1.00 0.00 C ATOM 1426 NE2 HIS B 23 25.709 -0.157 -14.169 1.00 0.00 N ATOM 0 H HIS B 23 23.149 2.724 -12.717 1.00 0.00 H new ATOM 0 HA HIS B 23 21.965 1.463 -15.025 1.00 0.00 H new ATOM 0 HB2 HIS B 23 22.126 0.715 -12.068 1.00 0.00 H new ATOM 0 HB3 HIS B 23 21.467 -0.353 -13.290 1.00 0.00 H new ATOM 0 HD2 HIS B 23 24.651 1.769 -14.234 1.00 0.00 H new ATOM 0 HE1 HIS B 23 25.854 -2.257 -13.766 1.00 0.00 H new ATOM 0 HE2 HIS B 23 26.638 0.067 -14.525 1.00 0.00 H new ATOM 1434 N ILE B 24 19.938 2.824 -12.852 1.00 0.00 N ATOM 1435 CA ILE B 24 18.490 3.121 -12.649 1.00 0.00 C ATOM 1436 C ILE B 24 18.018 4.117 -13.707 1.00 0.00 C ATOM 1437 O ILE B 24 18.809 4.756 -14.372 1.00 0.00 O ATOM 1438 CB ILE B 24 18.239 3.734 -11.275 1.00 0.00 C ATOM 1439 CG1 ILE B 24 19.023 2.988 -10.198 1.00 0.00 C ATOM 1440 CG2 ILE B 24 16.746 3.655 -10.952 1.00 0.00 C ATOM 1441 CD1 ILE B 24 18.842 3.709 -8.859 1.00 0.00 C ATOM 0 H ILE B 24 20.581 3.323 -12.237 1.00 0.00 H new ATOM 0 HA ILE B 24 17.944 2.181 -12.728 1.00 0.00 H new ATOM 0 HB ILE B 24 18.568 4.773 -11.292 1.00 0.00 H new ATOM 0 HG12 ILE B 24 18.672 1.959 -10.122 1.00 0.00 H new ATOM 0 HG13 ILE B 24 20.079 2.946 -10.463 1.00 0.00 H new ATOM 0 HG21 ILE B 24 16.562 4.092 -9.971 1.00 0.00 H new ATOM 0 HG22 ILE B 24 16.181 4.204 -11.705 1.00 0.00 H new ATOM 0 HG23 ILE B 24 16.429 2.612 -10.950 1.00 0.00 H new ATOM 0 HD11 ILE B 24 19.399 3.182 -8.084 1.00 0.00 H new ATOM 0 HD12 ILE B 24 19.214 4.730 -8.943 1.00 0.00 H new ATOM 0 HD13 ILE B 24 17.784 3.728 -8.596 1.00 0.00 H new ATOM 1453 N LYS B 25 16.731 4.265 -13.857 1.00 0.00 N ATOM 1454 CA LYS B 25 16.203 5.232 -14.860 1.00 0.00 C ATOM 1455 C LYS B 25 15.259 6.229 -14.172 1.00 0.00 C ATOM 1456 O LYS B 25 15.328 7.420 -14.402 1.00 0.00 O ATOM 1457 CB LYS B 25 15.446 4.471 -15.955 1.00 0.00 C ATOM 1458 CG LYS B 25 14.827 5.463 -16.942 1.00 0.00 C ATOM 1459 CD LYS B 25 14.538 4.754 -18.267 1.00 0.00 C ATOM 1460 CE LYS B 25 14.381 5.795 -19.378 1.00 0.00 C ATOM 1461 NZ LYS B 25 12.933 6.042 -19.628 1.00 0.00 N ATOM 0 H LYS B 25 16.022 3.758 -13.328 1.00 0.00 H new ATOM 0 HA LYS B 25 17.033 5.778 -15.308 1.00 0.00 H new ATOM 0 HB2 LYS B 25 16.125 3.798 -16.479 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.667 3.853 -15.509 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.906 5.875 -16.530 1.00 0.00 H new ATOM 0 HG3 LYS B 25 15.506 6.300 -17.106 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.349 4.067 -18.509 1.00 0.00 H new ATOM 0 HD3 LYS B 25 13.630 4.157 -18.182 1.00 0.00 H new ATOM 0 HE2 LYS B 25 14.875 6.724 -19.093 1.00 0.00 H new ATOM 0 HE3 LYS B 25 14.864 5.444 -20.290 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 12.827 6.749 -20.383 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 12.474 5.155 -19.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 12.486 6.395 -18.758 1.00 0.00 H new ATOM 1475 N GLU B 26 14.358 5.752 -13.350 1.00 0.00 N ATOM 1476 CA GLU B 26 13.398 6.654 -12.679 1.00 0.00 C ATOM 1477 C GLU B 26 13.152 6.114 -11.262 1.00 0.00 C ATOM 1478 O GLU B 26 13.619 5.053 -10.910 1.00 0.00 O ATOM 1479 CB GLU B 26 12.127 6.641 -13.561 1.00 0.00 C ATOM 1480 CG GLU B 26 10.806 6.670 -12.780 1.00 0.00 C ATOM 1481 CD GLU B 26 10.399 8.118 -12.492 1.00 0.00 C ATOM 1482 OE1 GLU B 26 11.261 8.978 -12.548 1.00 0.00 O ATOM 1483 OE2 GLU B 26 9.232 8.339 -12.210 1.00 0.00 O ATOM 0 H GLU B 26 14.253 4.764 -13.119 1.00 0.00 H new ATOM 0 HA GLU B 26 13.749 7.680 -12.572 1.00 0.00 H new ATOM 0 HB2 GLU B 26 12.157 7.501 -14.231 1.00 0.00 H new ATOM 0 HB3 GLU B 26 12.144 5.749 -14.187 1.00 0.00 H new ATOM 0 HG2 GLU B 26 10.024 6.171 -13.353 1.00 0.00 H new ATOM 0 HG3 GLU B 26 10.915 6.121 -11.844 1.00 0.00 H new ATOM 1490 N TYR B 27 12.399 6.810 -10.468 1.00 0.00 N ATOM 1491 CA TYR B 27 12.095 6.312 -9.111 1.00 0.00 C ATOM 1492 C TYR B 27 10.620 6.590 -8.854 1.00 0.00 C ATOM 1493 O TYR B 27 9.964 7.218 -9.663 1.00 0.00 O ATOM 1494 CB TYR B 27 12.983 7.014 -8.073 1.00 0.00 C ATOM 1495 CG TYR B 27 12.597 8.471 -7.949 1.00 0.00 C ATOM 1496 CD1 TYR B 27 13.092 9.419 -8.872 1.00 0.00 C ATOM 1497 CD2 TYR B 27 11.735 8.883 -6.907 1.00 0.00 C ATOM 1498 CE1 TYR B 27 12.726 10.779 -8.754 1.00 0.00 C ATOM 1499 CE2 TYR B 27 11.368 10.242 -6.790 1.00 0.00 C ATOM 1500 CZ TYR B 27 11.864 11.190 -7.713 1.00 0.00 C ATOM 1501 OH TYR B 27 11.504 12.517 -7.598 1.00 0.00 O ATOM 0 H TYR B 27 11.979 7.709 -10.704 1.00 0.00 H new ATOM 0 HA TYR B 27 12.297 5.244 -9.030 1.00 0.00 H new ATOM 0 HB2 TYR B 27 12.883 6.521 -7.106 1.00 0.00 H new ATOM 0 HB3 TYR B 27 14.030 6.932 -8.365 1.00 0.00 H new ATOM 0 HD1 TYR B 27 13.750 9.104 -9.668 1.00 0.00 H new ATOM 0 HD2 TYR B 27 11.357 8.159 -6.201 1.00 0.00 H new ATOM 0 HE1 TYR B 27 13.105 11.504 -9.459 1.00 0.00 H new ATOM 0 HE2 TYR B 27 10.708 10.557 -5.995 1.00 0.00 H new ATOM 0 HH TYR B 27 10.906 12.628 -6.830 1.00 0.00 H new ATOM 1511 N PHE B 28 10.080 6.142 -7.759 1.00 0.00 N ATOM 1512 CA PHE B 28 8.644 6.412 -7.525 1.00 0.00 C ATOM 1513 C PHE B 28 8.375 6.594 -6.034 1.00 0.00 C ATOM 1514 O PHE B 28 8.037 5.663 -5.335 1.00 0.00 O ATOM 1515 CB PHE B 28 7.805 5.254 -8.083 1.00 0.00 C ATOM 1516 CG PHE B 28 6.345 5.467 -7.751 1.00 0.00 C ATOM 1517 CD1 PHE B 28 5.527 6.233 -8.610 1.00 0.00 C ATOM 1518 CD2 PHE B 28 5.805 4.915 -6.568 1.00 0.00 C ATOM 1519 CE1 PHE B 28 4.169 6.448 -8.285 1.00 0.00 C ATOM 1520 CE2 PHE B 28 4.450 5.132 -6.241 1.00 0.00 C ATOM 1521 CZ PHE B 28 3.631 5.901 -7.099 1.00 0.00 C ATOM 0 H PHE B 28 10.560 5.612 -7.032 1.00 0.00 H new ATOM 0 HA PHE B 28 8.365 7.333 -8.038 1.00 0.00 H new ATOM 0 HB2 PHE B 28 7.935 5.187 -9.163 1.00 0.00 H new ATOM 0 HB3 PHE B 28 8.148 4.309 -7.662 1.00 0.00 H new ATOM 0 HD1 PHE B 28 5.939 6.654 -9.515 1.00 0.00 H new ATOM 0 HD2 PHE B 28 6.430 4.326 -5.913 1.00 0.00 H new ATOM 0 HE1 PHE B 28 3.542 7.031 -8.944 1.00 0.00 H new ATOM 0 HE2 PHE B 28 4.039 4.711 -5.336 1.00 0.00 H new ATOM 0 HZ PHE B 28 2.594 6.070 -6.848 1.00 0.00 H new ATOM 1531 N TYR B 29 8.510 7.789 -5.539 1.00 0.00 N ATOM 1532 CA TYR B 29 8.254 8.010 -4.095 1.00 0.00 C ATOM 1533 C TYR B 29 6.778 7.771 -3.800 1.00 0.00 C ATOM 1534 O TYR B 29 5.901 8.318 -4.438 1.00 0.00 O ATOM 1535 CB TYR B 29 8.632 9.440 -3.717 1.00 0.00 C ATOM 1536 CG TYR B 29 8.330 9.692 -2.259 1.00 0.00 C ATOM 1537 CD1 TYR B 29 9.238 9.267 -1.265 1.00 0.00 C ATOM 1538 CD2 TYR B 29 7.152 10.382 -1.893 1.00 0.00 C ATOM 1539 CE1 TYR B 29 8.967 9.529 0.096 1.00 0.00 C ATOM 1540 CE2 TYR B 29 6.884 10.647 -0.532 1.00 0.00 C ATOM 1541 CZ TYR B 29 7.791 10.220 0.463 1.00 0.00 C ATOM 1542 OH TYR B 29 7.532 10.485 1.792 1.00 0.00 O ATOM 0 H TYR B 29 8.785 8.616 -6.068 1.00 0.00 H new ATOM 0 HA TYR B 29 8.857 7.316 -3.509 1.00 0.00 H new ATOM 0 HB2 TYR B 29 9.692 9.607 -3.910 1.00 0.00 H new ATOM 0 HB3 TYR B 29 8.080 10.146 -4.337 1.00 0.00 H new ATOM 0 HD1 TYR B 29 10.139 8.742 -1.545 1.00 0.00 H new ATOM 0 HD2 TYR B 29 6.457 10.706 -2.654 1.00 0.00 H new ATOM 0 HE1 TYR B 29 9.660 9.201 0.857 1.00 0.00 H new ATOM 0 HE2 TYR B 29 5.985 11.176 -0.252 1.00 0.00 H new ATOM 0 HH TYR B 29 6.683 10.968 1.870 1.00 0.00 H new ATOM 1552 N THR B 30 6.507 6.952 -2.832 1.00 0.00 N ATOM 1553 CA THR B 30 5.091 6.653 -2.471 1.00 0.00 C ATOM 1554 C THR B 30 4.596 7.677 -1.444 1.00 0.00 C ATOM 1555 O THR B 30 5.350 8.494 -0.956 1.00 0.00 O ATOM 1556 CB THR B 30 5.002 5.245 -1.876 1.00 0.00 C ATOM 1557 OG1 THR B 30 3.707 5.039 -1.330 1.00 0.00 O ATOM 1558 CG2 THR B 30 6.051 5.090 -0.774 1.00 0.00 C ATOM 0 H THR B 30 7.207 6.470 -2.268 1.00 0.00 H new ATOM 0 HA THR B 30 4.469 6.709 -3.365 1.00 0.00 H new ATOM 0 HB THR B 30 5.185 4.509 -2.659 1.00 0.00 H new ATOM 0 HG1 THR B 30 3.783 4.845 -0.372 1.00 0.00 H new ATOM 0 HG21 THR B 30 5.988 4.088 -0.350 1.00 0.00 H new ATOM 0 HG22 THR B 30 7.045 5.245 -1.194 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.869 5.827 0.008 1.00 0.00 H new ATOM 1566 N SER B 31 3.332 7.641 -1.118 1.00 0.00 N ATOM 1567 CA SER B 31 2.788 8.616 -0.129 1.00 0.00 C ATOM 1568 C SER B 31 2.821 8.004 1.274 1.00 0.00 C ATOM 1569 O SER B 31 3.579 7.096 1.550 1.00 0.00 O ATOM 1570 CB SER B 31 1.347 8.966 -0.500 1.00 0.00 C ATOM 1571 OG SER B 31 1.284 9.313 -1.875 1.00 0.00 O ATOM 0 H SER B 31 2.653 6.979 -1.493 1.00 0.00 H new ATOM 0 HA SER B 31 3.398 9.519 -0.141 1.00 0.00 H new ATOM 0 HB2 SER B 31 0.692 8.119 -0.297 1.00 0.00 H new ATOM 0 HB3 SER B 31 0.994 9.796 0.112 1.00 0.00 H new ATOM 0 HG SER B 31 0.360 9.536 -2.114 1.00 0.00 H new ATOM 1577 N GLY B 32 2.003 8.500 2.164 1.00 0.00 N ATOM 1578 CA GLY B 32 1.988 7.955 3.552 1.00 0.00 C ATOM 1579 C GLY B 32 0.865 6.925 3.691 1.00 0.00 C ATOM 1580 O GLY B 32 0.272 6.777 4.742 1.00 0.00 O ATOM 0 H GLY B 32 1.345 9.259 1.989 1.00 0.00 H new ATOM 0 HA2 GLY B 32 2.948 7.493 3.782 1.00 0.00 H new ATOM 0 HA3 GLY B 32 1.843 8.763 4.269 1.00 0.00 H new ATOM 1584 N LYS B 33 0.571 6.208 2.642 1.00 0.00 N ATOM 1585 CA LYS B 33 -0.509 5.184 2.717 1.00 0.00 C ATOM 1586 C LYS B 33 0.053 3.831 2.279 1.00 0.00 C ATOM 1587 O LYS B 33 -0.632 3.023 1.682 1.00 0.00 O ATOM 1588 CB LYS B 33 -1.661 5.586 1.795 1.00 0.00 C ATOM 1589 CG LYS B 33 -1.112 5.948 0.413 1.00 0.00 C ATOM 1590 CD LYS B 33 -2.241 6.507 -0.454 1.00 0.00 C ATOM 1591 CE LYS B 33 -2.840 7.744 0.221 1.00 0.00 C ATOM 1592 NZ LYS B 33 -3.375 8.667 -0.819 1.00 0.00 N ATOM 0 H LYS B 33 1.032 6.287 1.736 1.00 0.00 H new ATOM 0 HA LYS B 33 -0.878 5.113 3.740 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.375 4.767 1.710 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -2.199 6.435 2.217 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -0.314 6.684 0.508 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -0.678 5.067 -0.060 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -1.860 6.767 -1.442 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.012 5.750 -0.599 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -3.636 7.449 0.905 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.080 8.251 0.816 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.782 9.507 -0.361 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.605 8.958 -1.454 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.112 8.181 -1.368 1.00 0.00 H new ATOM 1606 N CYS B 34 1.300 3.582 2.570 1.00 0.00 N ATOM 1607 CA CYS B 34 1.924 2.289 2.172 1.00 0.00 C ATOM 1608 C CYS B 34 2.611 1.644 3.386 1.00 0.00 C ATOM 1609 O CYS B 34 3.207 0.590 3.281 1.00 0.00 O ATOM 1610 CB CYS B 34 2.962 2.559 1.080 1.00 0.00 C ATOM 1611 SG CYS B 34 3.491 1.005 0.317 1.00 0.00 S ATOM 0 H CYS B 34 1.917 4.223 3.069 1.00 0.00 H new ATOM 0 HA CYS B 34 1.157 1.611 1.799 1.00 0.00 H new ATOM 0 HB2 CYS B 34 2.539 3.219 0.322 1.00 0.00 H new ATOM 0 HB3 CYS B 34 3.823 3.074 1.506 1.00 0.00 H new ATOM 1616 N SER B 35 2.541 2.267 4.539 1.00 0.00 N ATOM 1617 CA SER B 35 3.197 1.683 5.748 1.00 0.00 C ATOM 1618 C SER B 35 4.655 1.349 5.426 1.00 0.00 C ATOM 1619 O SER B 35 5.256 0.482 6.027 1.00 0.00 O ATOM 1620 CB SER B 35 2.459 0.412 6.169 1.00 0.00 C ATOM 1621 OG SER B 35 3.065 -0.122 7.336 1.00 0.00 O ATOM 0 H SER B 35 2.059 3.152 4.693 1.00 0.00 H new ATOM 0 HA SER B 35 3.163 2.405 6.564 1.00 0.00 H new ATOM 0 HB2 SER B 35 1.409 0.635 6.361 1.00 0.00 H new ATOM 0 HB3 SER B 35 2.487 -0.322 5.363 1.00 0.00 H new ATOM 0 HG SER B 35 4.040 -0.081 7.246 1.00 0.00 H new ATOM 1627 N ASN B 36 5.222 2.037 4.475 1.00 0.00 N ATOM 1628 CA ASN B 36 6.636 1.775 4.096 1.00 0.00 C ATOM 1629 C ASN B 36 7.040 2.757 2.992 1.00 0.00 C ATOM 1630 O ASN B 36 7.204 2.361 1.856 1.00 0.00 O ATOM 1631 CB ASN B 36 6.774 0.345 3.575 1.00 0.00 C ATOM 1632 CG ASN B 36 7.393 -0.537 4.661 1.00 0.00 C ATOM 1633 OD1 ASN B 36 6.803 -1.514 5.075 1.00 0.00 O ATOM 1634 ND2 ASN B 36 8.565 -0.228 5.142 1.00 0.00 N ATOM 0 H ASN B 36 4.762 2.774 3.941 1.00 0.00 H new ATOM 0 HA ASN B 36 7.280 1.903 4.966 1.00 0.00 H new ATOM 0 HB2 ASN B 36 5.797 -0.045 3.288 1.00 0.00 H new ATOM 0 HB3 ASN B 36 7.398 0.331 2.681 1.00 0.00 H new ATOM 0 HD21 ASN B 36 8.988 -0.808 5.867 1.00 0.00 H new ATOM 0 HD22 ASN B 36 9.059 0.593 4.793 1.00 0.00 H new ATOM 1641 N PRO B 37 7.189 4.014 3.350 1.00 0.00 N ATOM 1642 CA PRO B 37 7.571 5.044 2.376 1.00 0.00 C ATOM 1643 C PRO B 37 8.886 4.657 1.703 1.00 0.00 C ATOM 1644 O PRO B 37 9.660 3.886 2.232 1.00 0.00 O ATOM 1645 CB PRO B 37 7.736 6.329 3.202 1.00 0.00 C ATOM 1646 CG PRO B 37 7.354 5.998 4.669 1.00 0.00 C ATOM 1647 CD PRO B 37 6.999 4.505 4.733 1.00 0.00 C ATOM 0 HA PRO B 37 6.833 5.168 1.584 1.00 0.00 H new ATOM 0 HB2 PRO B 37 8.763 6.690 3.146 1.00 0.00 H new ATOM 0 HB3 PRO B 37 7.098 7.121 2.810 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.183 6.223 5.340 1.00 0.00 H new ATOM 0 HG3 PRO B 37 6.509 6.606 4.991 1.00 0.00 H new ATOM 0 HD2 PRO B 37 7.644 3.974 5.434 1.00 0.00 H new ATOM 0 HD3 PRO B 37 5.973 4.356 5.069 1.00 0.00 H new ATOM 1655 N ALA B 38 9.143 5.187 0.541 1.00 0.00 N ATOM 1656 CA ALA B 38 10.408 4.851 -0.173 1.00 0.00 C ATOM 1657 C ALA B 38 10.411 5.553 -1.526 1.00 0.00 C ATOM 1658 O ALA B 38 9.701 6.513 -1.741 1.00 0.00 O ATOM 1659 CB ALA B 38 10.484 3.324 -0.393 1.00 0.00 C ATOM 0 H ALA B 38 8.531 5.840 0.052 1.00 0.00 H new ATOM 0 HA ALA B 38 11.264 5.176 0.419 1.00 0.00 H new ATOM 0 HB1 ALA B 38 11.408 3.077 -0.915 1.00 0.00 H new ATOM 0 HB2 ALA B 38 10.465 2.816 0.571 1.00 0.00 H new ATOM 0 HB3 ALA B 38 9.632 3.000 -0.991 1.00 0.00 H new ATOM 1665 N VAL B 39 11.183 5.056 -2.443 1.00 0.00 N ATOM 1666 CA VAL B 39 11.227 5.644 -3.808 1.00 0.00 C ATOM 1667 C VAL B 39 11.478 4.472 -4.734 1.00 0.00 C ATOM 1668 O VAL B 39 12.599 4.059 -4.961 1.00 0.00 O ATOM 1669 CB VAL B 39 12.334 6.698 -3.939 1.00 0.00 C ATOM 1670 CG1 VAL B 39 11.783 8.057 -3.511 1.00 0.00 C ATOM 1671 CG2 VAL B 39 13.526 6.333 -3.054 1.00 0.00 C ATOM 0 H VAL B 39 11.797 4.253 -2.304 1.00 0.00 H new ATOM 0 HA VAL B 39 10.300 6.165 -4.047 1.00 0.00 H new ATOM 0 HB VAL B 39 12.666 6.738 -4.976 1.00 0.00 H new ATOM 0 HG11 VAL B 39 12.565 8.811 -3.601 1.00 0.00 H new ATOM 0 HG12 VAL B 39 10.943 8.327 -4.151 1.00 0.00 H new ATOM 0 HG13 VAL B 39 11.448 8.004 -2.475 1.00 0.00 H new ATOM 0 HG21 VAL B 39 14.302 7.091 -3.159 1.00 0.00 H new ATOM 0 HG22 VAL B 39 13.205 6.284 -2.014 1.00 0.00 H new ATOM 0 HG23 VAL B 39 13.922 5.364 -3.358 1.00 0.00 H new ATOM 1681 N VAL B 40 10.425 3.896 -5.212 1.00 0.00 N ATOM 1682 CA VAL B 40 10.553 2.697 -6.064 1.00 0.00 C ATOM 1683 C VAL B 40 11.357 3.013 -7.316 1.00 0.00 C ATOM 1684 O VAL B 40 10.958 3.798 -8.151 1.00 0.00 O ATOM 1685 CB VAL B 40 9.141 2.194 -6.384 1.00 0.00 C ATOM 1686 CG1 VAL B 40 9.052 1.590 -7.786 1.00 0.00 C ATOM 1687 CG2 VAL B 40 8.784 1.121 -5.362 1.00 0.00 C ATOM 0 H VAL B 40 9.468 4.208 -5.047 1.00 0.00 H new ATOM 0 HA VAL B 40 11.099 1.909 -5.546 1.00 0.00 H new ATOM 0 HB VAL B 40 8.452 3.038 -6.343 1.00 0.00 H new ATOM 0 HG11 VAL B 40 8.034 1.247 -7.970 1.00 0.00 H new ATOM 0 HG12 VAL B 40 9.320 2.345 -8.525 1.00 0.00 H new ATOM 0 HG13 VAL B 40 9.739 0.747 -7.863 1.00 0.00 H new ATOM 0 HG21 VAL B 40 7.782 0.744 -5.565 1.00 0.00 H new ATOM 0 HG22 VAL B 40 9.500 0.302 -5.429 1.00 0.00 H new ATOM 0 HG23 VAL B 40 8.814 1.549 -4.360 1.00 0.00 H new ATOM 1697 N PHE B 41 12.480 2.381 -7.454 1.00 0.00 N ATOM 1698 CA PHE B 41 13.309 2.619 -8.644 1.00 0.00 C ATOM 1699 C PHE B 41 12.742 1.868 -9.831 1.00 0.00 C ATOM 1700 O PHE B 41 11.910 0.992 -9.717 1.00 0.00 O ATOM 1701 CB PHE B 41 14.739 2.140 -8.386 1.00 0.00 C ATOM 1702 CG PHE B 41 15.538 3.215 -7.689 1.00 0.00 C ATOM 1703 CD1 PHE B 41 15.486 4.555 -8.141 1.00 0.00 C ATOM 1704 CD2 PHE B 41 16.384 2.868 -6.614 1.00 0.00 C ATOM 1705 CE1 PHE B 41 16.274 5.545 -7.509 1.00 0.00 C ATOM 1706 CE2 PHE B 41 17.177 3.854 -5.991 1.00 0.00 C ATOM 1707 CZ PHE B 41 17.123 5.193 -6.435 1.00 0.00 C ATOM 0 H PHE B 41 12.857 1.707 -6.787 1.00 0.00 H new ATOM 0 HA PHE B 41 13.313 3.688 -8.858 1.00 0.00 H new ATOM 0 HB2 PHE B 41 14.722 1.237 -7.775 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.217 1.877 -9.330 1.00 0.00 H new ATOM 0 HD1 PHE B 41 14.845 4.822 -8.968 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.424 1.846 -6.268 1.00 0.00 H new ATOM 0 HE1 PHE B 41 16.227 6.570 -7.847 1.00 0.00 H new ATOM 0 HE2 PHE B 41 17.827 3.584 -5.172 1.00 0.00 H new ATOM 0 HZ PHE B 41 17.729 5.947 -5.955 1.00 0.00 H new ATOM 1717 N VAL B 42 13.222 2.224 -10.965 1.00 0.00 N ATOM 1718 CA VAL B 42 12.802 1.594 -12.236 1.00 0.00 C ATOM 1719 C VAL B 42 14.073 1.611 -13.090 1.00 0.00 C ATOM 1720 O VAL B 42 14.313 2.533 -13.842 1.00 0.00 O ATOM 1721 CB VAL B 42 11.697 2.410 -12.920 1.00 0.00 C ATOM 1722 CG1 VAL B 42 10.353 1.711 -12.714 1.00 0.00 C ATOM 1723 CG2 VAL B 42 11.611 3.827 -12.359 1.00 0.00 C ATOM 0 H VAL B 42 13.921 2.959 -11.076 1.00 0.00 H new ATOM 0 HA VAL B 42 12.395 0.594 -12.087 1.00 0.00 H new ATOM 0 HB VAL B 42 11.938 2.478 -13.981 1.00 0.00 H new ATOM 0 HG11 VAL B 42 9.565 2.288 -13.198 1.00 0.00 H new ATOM 0 HG12 VAL B 42 10.392 0.712 -13.149 1.00 0.00 H new ATOM 0 HG13 VAL B 42 10.143 1.634 -11.647 1.00 0.00 H new ATOM 0 HG21 VAL B 42 10.817 4.373 -12.869 1.00 0.00 H new ATOM 0 HG22 VAL B 42 11.394 3.783 -11.292 1.00 0.00 H new ATOM 0 HG23 VAL B 42 12.561 4.338 -12.515 1.00 0.00 H new ATOM 1733 N THR B 43 14.933 0.650 -12.907 1.00 0.00 N ATOM 1734 CA THR B 43 16.246 0.668 -13.633 1.00 0.00 C ATOM 1735 C THR B 43 16.146 0.082 -15.038 1.00 0.00 C ATOM 1736 O THR B 43 15.101 0.078 -15.653 1.00 0.00 O ATOM 1737 CB THR B 43 17.284 -0.120 -12.821 1.00 0.00 C ATOM 1738 OG1 THR B 43 17.100 -1.511 -13.042 1.00 0.00 O ATOM 1739 CG2 THR B 43 17.131 0.183 -11.328 1.00 0.00 C ATOM 0 H THR B 43 14.790 -0.149 -12.289 1.00 0.00 H new ATOM 0 HA THR B 43 16.549 1.710 -13.738 1.00 0.00 H new ATOM 0 HB THR B 43 18.283 0.176 -13.142 1.00 0.00 H new ATOM 0 HG1 THR B 43 17.763 -2.015 -12.526 1.00 0.00 H new ATOM 0 HG21 THR B 43 17.873 -0.382 -10.764 1.00 0.00 H new ATOM 0 HG22 THR B 43 17.279 1.249 -11.156 1.00 0.00 H new ATOM 0 HG23 THR B 43 16.131 -0.102 -10.999 1.00 0.00 H new ATOM 1747 N ARG B 44 17.259 -0.383 -15.567 1.00 0.00 N ATOM 1748 CA ARG B 44 17.263 -0.945 -16.946 1.00 0.00 C ATOM 1749 C ARG B 44 16.104 -1.933 -17.092 1.00 0.00 C ATOM 1750 O ARG B 44 15.211 -1.730 -17.891 1.00 0.00 O ATOM 1751 CB ARG B 44 18.607 -1.630 -17.233 1.00 0.00 C ATOM 1752 CG ARG B 44 19.054 -2.469 -16.030 1.00 0.00 C ATOM 1753 CD ARG B 44 20.503 -2.125 -15.681 1.00 0.00 C ATOM 1754 NE ARG B 44 21.424 -2.943 -16.519 1.00 0.00 N ATOM 1755 CZ ARG B 44 21.912 -2.449 -17.624 1.00 0.00 C ATOM 1756 NH1 ARG B 44 22.693 -1.403 -17.582 1.00 0.00 N ATOM 1757 NH2 ARG B 44 21.615 -2.996 -18.770 1.00 0.00 N ATOM 0 H ARG B 44 18.163 -0.394 -15.095 1.00 0.00 H new ATOM 0 HA ARG B 44 17.134 -0.141 -17.670 1.00 0.00 H new ATOM 0 HB2 ARG B 44 18.516 -2.266 -18.113 1.00 0.00 H new ATOM 0 HB3 ARG B 44 19.363 -0.878 -17.460 1.00 0.00 H new ATOM 0 HG2 ARG B 44 18.406 -2.273 -15.175 1.00 0.00 H new ATOM 0 HG3 ARG B 44 18.966 -3.531 -16.260 1.00 0.00 H new ATOM 0 HD2 ARG B 44 20.687 -1.064 -15.850 1.00 0.00 H new ATOM 0 HD3 ARG B 44 20.689 -2.317 -14.624 1.00 0.00 H new ATOM 0 HE ARG B 44 21.673 -3.889 -16.229 1.00 0.00 H new ATOM 0 HH11 ARG B 44 22.921 -0.973 -16.686 1.00 0.00 H new ATOM 0 HH12 ARG B 44 23.075 -1.017 -18.445 1.00 0.00 H new ATOM 0 HH21 ARG B 44 21.001 -3.810 -18.803 1.00 0.00 H new ATOM 0 HH22 ARG B 44 21.996 -2.610 -19.634 1.00 0.00 H new ATOM 1771 N LYS B 45 16.062 -2.963 -16.286 1.00 0.00 N ATOM 1772 CA LYS B 45 14.901 -3.894 -16.358 1.00 0.00 C ATOM 1773 C LYS B 45 13.666 -3.051 -16.033 1.00 0.00 C ATOM 1774 O LYS B 45 12.584 -3.261 -16.545 1.00 0.00 O ATOM 1775 CB LYS B 45 15.058 -5.016 -15.329 1.00 0.00 C ATOM 1776 CG LYS B 45 15.645 -6.255 -16.009 1.00 0.00 C ATOM 1777 CD LYS B 45 14.509 -7.173 -16.463 1.00 0.00 C ATOM 1778 CE LYS B 45 14.910 -7.880 -17.759 1.00 0.00 C ATOM 1779 NZ LYS B 45 13.716 -8.541 -18.358 1.00 0.00 N ATOM 0 H LYS B 45 16.771 -3.196 -15.591 1.00 0.00 H new ATOM 0 HA LYS B 45 14.822 -4.360 -17.340 1.00 0.00 H new ATOM 0 HB2 LYS B 45 15.709 -4.691 -14.517 1.00 0.00 H new ATOM 0 HB3 LYS B 45 14.091 -5.255 -14.886 1.00 0.00 H new ATOM 0 HG2 LYS B 45 16.253 -5.960 -16.864 1.00 0.00 H new ATOM 0 HG3 LYS B 45 16.302 -6.785 -15.319 1.00 0.00 H new ATOM 0 HD2 LYS B 45 14.290 -7.908 -15.688 1.00 0.00 H new ATOM 0 HD3 LYS B 45 13.599 -6.593 -16.619 1.00 0.00 H new ATOM 0 HE2 LYS B 45 15.331 -7.161 -18.462 1.00 0.00 H new ATOM 0 HE3 LYS B 45 15.685 -8.620 -17.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 13.990 -9.021 -19.239 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 13.333 -9.238 -17.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 12.990 -7.825 -18.565 1.00 0.00 H new ATOM 1793 N ASN B 46 13.868 -2.058 -15.207 1.00 0.00 N ATOM 1794 CA ASN B 46 12.787 -1.117 -14.836 1.00 0.00 C ATOM 1795 C ASN B 46 11.781 -1.766 -13.929 1.00 0.00 C ATOM 1796 O ASN B 46 10.725 -1.214 -13.685 1.00 0.00 O ATOM 1797 CB ASN B 46 12.090 -0.607 -16.098 1.00 0.00 C ATOM 1798 CG ASN B 46 12.199 0.917 -16.177 1.00 0.00 C ATOM 1799 OD1 ASN B 46 13.143 1.497 -15.685 1.00 0.00 O ATOM 1800 ND2 ASN B 46 11.267 1.593 -16.791 1.00 0.00 N ATOM 0 H ASN B 46 14.766 -1.861 -14.765 1.00 0.00 H new ATOM 0 HA ASN B 46 13.237 -0.282 -14.299 1.00 0.00 H new ATOM 0 HB2 ASN B 46 12.543 -1.058 -16.981 1.00 0.00 H new ATOM 0 HB3 ASN B 46 11.042 -0.905 -16.090 1.00 0.00 H new ATOM 0 HD21 ASN B 46 11.333 2.609 -16.857 1.00 0.00 H new ATOM 0 HD22 ASN B 46 10.472 1.106 -17.205 1.00 0.00 H new ATOM 1807 N ARG B 47 12.112 -2.884 -13.347 1.00 0.00 N ATOM 1808 CA ARG B 47 11.170 -3.475 -12.364 1.00 0.00 C ATOM 1809 C ARG B 47 10.980 -2.378 -11.334 1.00 0.00 C ATOM 1810 O ARG B 47 11.815 -1.499 -11.254 1.00 0.00 O ATOM 1811 CB ARG B 47 11.795 -4.705 -11.711 1.00 0.00 C ATOM 1812 CG ARG B 47 11.465 -5.952 -12.535 1.00 0.00 C ATOM 1813 CD ARG B 47 11.100 -7.105 -11.600 1.00 0.00 C ATOM 1814 NE ARG B 47 10.019 -7.922 -12.220 1.00 0.00 N ATOM 1815 CZ ARG B 47 9.839 -9.159 -11.847 1.00 0.00 C ATOM 1816 NH1 ARG B 47 10.492 -10.121 -12.439 1.00 0.00 N ATOM 1817 NH2 ARG B 47 9.006 -9.434 -10.880 1.00 0.00 N ATOM 0 H ARG B 47 12.975 -3.403 -13.506 1.00 0.00 H new ATOM 0 HA ARG B 47 10.233 -3.797 -12.818 1.00 0.00 H new ATOM 0 HB2 ARG B 47 12.875 -4.581 -11.639 1.00 0.00 H new ATOM 0 HB3 ARG B 47 11.419 -4.819 -10.694 1.00 0.00 H new ATOM 0 HG2 ARG B 47 10.636 -5.744 -13.212 1.00 0.00 H new ATOM 0 HG3 ARG B 47 12.320 -6.228 -13.153 1.00 0.00 H new ATOM 0 HD2 ARG B 47 11.976 -7.725 -11.410 1.00 0.00 H new ATOM 0 HD3 ARG B 47 10.770 -6.716 -10.637 1.00 0.00 H new ATOM 0 HE ARG B 47 9.419 -7.514 -12.937 1.00 0.00 H new ATOM 0 HH11 ARG B 47 11.144 -9.906 -13.194 1.00 0.00 H new ATOM 0 HH12 ARG B 47 10.351 -11.088 -12.147 1.00 0.00 H new ATOM 0 HH21 ARG B 47 8.496 -8.682 -10.417 1.00 0.00 H new ATOM 0 HH22 ARG B 47 8.865 -10.401 -10.588 1.00 0.00 H new ATOM 1831 N GLN B 48 9.919 -2.351 -10.595 1.00 0.00 N ATOM 1832 CA GLN B 48 9.781 -1.230 -9.646 1.00 0.00 C ATOM 1833 C GLN B 48 10.527 -1.583 -8.374 1.00 0.00 C ATOM 1834 O GLN B 48 9.973 -1.981 -7.375 1.00 0.00 O ATOM 1835 CB GLN B 48 8.318 -0.908 -9.415 1.00 0.00 C ATOM 1836 CG GLN B 48 7.957 0.209 -10.397 1.00 0.00 C ATOM 1837 CD GLN B 48 6.473 0.562 -10.268 1.00 0.00 C ATOM 1838 OE1 GLN B 48 5.698 0.319 -11.172 1.00 0.00 O ATOM 1839 NE2 GLN B 48 6.042 1.126 -9.173 1.00 0.00 N ATOM 0 H GLN B 48 9.162 -3.034 -10.604 1.00 0.00 H new ATOM 0 HA GLN B 48 10.224 -0.320 -10.052 1.00 0.00 H new ATOM 0 HB2 GLN B 48 7.696 -1.787 -9.583 1.00 0.00 H new ATOM 0 HB3 GLN B 48 8.149 -0.590 -8.386 1.00 0.00 H new ATOM 0 HG2 GLN B 48 8.567 1.090 -10.198 1.00 0.00 H new ATOM 0 HG3 GLN B 48 8.176 -0.107 -11.417 1.00 0.00 H new ATOM 0 HE21 GLN B 48 6.692 1.330 -8.414 1.00 0.00 H new ATOM 0 HE22 GLN B 48 5.055 1.363 -9.076 1.00 0.00 H new ATOM 1848 N VAL B 49 11.812 -1.446 -8.463 1.00 0.00 N ATOM 1849 CA VAL B 49 12.725 -1.775 -7.341 1.00 0.00 C ATOM 1850 C VAL B 49 12.342 -0.966 -6.094 1.00 0.00 C ATOM 1851 O VAL B 49 11.248 -0.453 -5.986 1.00 0.00 O ATOM 1852 CB VAL B 49 14.194 -1.474 -7.729 1.00 0.00 C ATOM 1853 CG1 VAL B 49 15.066 -2.654 -7.296 1.00 0.00 C ATOM 1854 CG2 VAL B 49 14.382 -1.247 -9.262 1.00 0.00 C ATOM 0 H VAL B 49 12.287 -1.106 -9.300 1.00 0.00 H new ATOM 0 HA VAL B 49 12.631 -2.839 -7.122 1.00 0.00 H new ATOM 0 HB VAL B 49 14.484 -0.552 -7.225 1.00 0.00 H new ATOM 0 HG11 VAL B 49 16.104 -2.456 -7.563 1.00 0.00 H new ATOM 0 HG12 VAL B 49 14.988 -2.788 -6.217 1.00 0.00 H new ATOM 0 HG13 VAL B 49 14.728 -3.560 -7.799 1.00 0.00 H new ATOM 0 HG21 VAL B 49 15.431 -1.040 -9.473 1.00 0.00 H new ATOM 0 HG22 VAL B 49 14.072 -2.141 -9.803 1.00 0.00 H new ATOM 0 HG23 VAL B 49 13.774 -0.401 -9.582 1.00 0.00 H new ATOM 1864 N CYS B 50 13.235 -0.872 -5.143 1.00 0.00 N ATOM 1865 CA CYS B 50 12.936 -0.129 -3.882 1.00 0.00 C ATOM 1866 C CYS B 50 14.147 0.700 -3.463 1.00 0.00 C ATOM 1867 O CYS B 50 15.281 0.313 -3.665 1.00 0.00 O ATOM 1868 CB CYS B 50 12.662 -1.149 -2.777 1.00 0.00 C ATOM 1869 SG CYS B 50 11.589 -0.469 -1.480 1.00 0.00 S ATOM 0 H CYS B 50 14.168 -1.282 -5.187 1.00 0.00 H new ATOM 0 HA CYS B 50 12.079 0.525 -4.043 1.00 0.00 H new ATOM 0 HB2 CYS B 50 12.195 -2.034 -3.208 1.00 0.00 H new ATOM 0 HB3 CYS B 50 13.606 -1.469 -2.336 1.00 0.00 H new ATOM 1874 N ALA B 51 13.915 1.820 -2.845 1.00 0.00 N ATOM 1875 CA ALA B 51 15.044 2.658 -2.371 1.00 0.00 C ATOM 1876 C ALA B 51 14.560 3.493 -1.212 1.00 0.00 C ATOM 1877 O ALA B 51 13.685 4.322 -1.328 1.00 0.00 O ATOM 1878 CB ALA B 51 15.569 3.550 -3.491 1.00 0.00 C ATOM 0 H ALA B 51 12.986 2.193 -2.647 1.00 0.00 H new ATOM 0 HA ALA B 51 15.867 2.018 -2.053 1.00 0.00 H new ATOM 0 HB1 ALA B 51 16.396 4.154 -3.118 1.00 0.00 H new ATOM 0 HB2 ALA B 51 15.917 2.930 -4.317 1.00 0.00 H new ATOM 0 HB3 ALA B 51 14.770 4.204 -3.840 1.00 0.00 H new ATOM 1884 N ASN B 52 15.129 3.241 -0.086 1.00 0.00 N ATOM 1885 CA ASN B 52 14.756 3.954 1.149 1.00 0.00 C ATOM 1886 C ASN B 52 14.593 5.465 0.888 1.00 0.00 C ATOM 1887 O ASN B 52 15.346 6.038 0.126 1.00 0.00 O ATOM 1888 CB ASN B 52 15.889 3.707 2.125 1.00 0.00 C ATOM 1889 CG ASN B 52 15.499 4.184 3.522 1.00 0.00 C ATOM 1890 OD1 ASN B 52 16.055 5.134 4.035 1.00 0.00 O ATOM 1891 ND2 ASN B 52 14.581 3.530 4.180 1.00 0.00 N ATOM 0 H ASN B 52 15.865 2.545 0.036 1.00 0.00 H new ATOM 0 HA ASN B 52 13.801 3.598 1.536 1.00 0.00 H new ATOM 0 HB2 ASN B 52 16.131 2.644 2.151 1.00 0.00 H new ATOM 0 HB3 ASN B 52 16.785 4.230 1.792 1.00 0.00 H new ATOM 0 HD21 ASN B 52 14.330 3.817 5.126 1.00 0.00 H new ATOM 0 HD22 ASN B 52 14.115 2.732 3.748 1.00 0.00 H new ATOM 1898 N PRO B 53 13.598 6.070 1.505 1.00 0.00 N ATOM 1899 CA PRO B 53 13.329 7.501 1.309 1.00 0.00 C ATOM 1900 C PRO B 53 14.322 8.372 2.087 1.00 0.00 C ATOM 1901 O PRO B 53 14.265 9.585 2.021 1.00 0.00 O ATOM 1902 CB PRO B 53 11.929 7.707 1.897 1.00 0.00 C ATOM 1903 CG PRO B 53 11.595 6.456 2.742 1.00 0.00 C ATOM 1904 CD PRO B 53 12.661 5.395 2.431 1.00 0.00 C ATOM 0 HA PRO B 53 13.414 7.779 0.259 1.00 0.00 H new ATOM 0 HB2 PRO B 53 11.900 8.606 2.513 1.00 0.00 H new ATOM 0 HB3 PRO B 53 11.195 7.841 1.103 1.00 0.00 H new ATOM 0 HG2 PRO B 53 11.594 6.699 3.804 1.00 0.00 H new ATOM 0 HG3 PRO B 53 10.600 6.083 2.499 1.00 0.00 H new ATOM 0 HD2 PRO B 53 13.168 5.065 3.337 1.00 0.00 H new ATOM 0 HD3 PRO B 53 12.219 4.510 1.973 1.00 0.00 H new ATOM 1912 N GLU B 54 15.209 7.784 2.853 1.00 0.00 N ATOM 1913 CA GLU B 54 16.150 8.628 3.649 1.00 0.00 C ATOM 1914 C GLU B 54 17.530 7.972 3.804 1.00 0.00 C ATOM 1915 O GLU B 54 18.289 8.334 4.682 1.00 0.00 O ATOM 1916 CB GLU B 54 15.548 8.851 5.039 1.00 0.00 C ATOM 1917 CG GLU B 54 16.123 10.131 5.645 1.00 0.00 C ATOM 1918 CD GLU B 54 15.309 11.335 5.165 1.00 0.00 C ATOM 1919 OE1 GLU B 54 15.624 11.853 4.106 1.00 0.00 O ATOM 1920 OE2 GLU B 54 14.389 11.720 5.866 1.00 0.00 O ATOM 0 H GLU B 54 15.321 6.776 2.960 1.00 0.00 H new ATOM 0 HA GLU B 54 16.289 9.570 3.119 1.00 0.00 H new ATOM 0 HB2 GLU B 54 14.463 8.925 4.969 1.00 0.00 H new ATOM 0 HB3 GLU B 54 15.769 8.000 5.683 1.00 0.00 H new ATOM 0 HG2 GLU B 54 16.099 10.073 6.733 1.00 0.00 H new ATOM 0 HG3 GLU B 54 17.167 10.246 5.355 1.00 0.00 H new ATOM 1927 N LYS B 55 17.883 7.030 2.971 1.00 0.00 N ATOM 1928 CA LYS B 55 19.237 6.396 3.107 1.00 0.00 C ATOM 1929 C LYS B 55 20.291 7.218 2.344 1.00 0.00 C ATOM 1930 O LYS B 55 21.156 6.671 1.689 1.00 0.00 O ATOM 1931 CB LYS B 55 19.215 4.965 2.563 1.00 0.00 C ATOM 1932 CG LYS B 55 18.812 4.000 3.679 1.00 0.00 C ATOM 1933 CD LYS B 55 19.979 3.060 3.985 1.00 0.00 C ATOM 1934 CE LYS B 55 19.931 2.654 5.459 1.00 0.00 C ATOM 1935 NZ LYS B 55 20.234 1.202 5.585 1.00 0.00 N ATOM 0 H LYS B 55 17.305 6.672 2.210 1.00 0.00 H new ATOM 0 HA LYS B 55 19.497 6.372 4.165 1.00 0.00 H new ATOM 0 HB2 LYS B 55 18.512 4.891 1.733 1.00 0.00 H new ATOM 0 HB3 LYS B 55 20.197 4.698 2.174 1.00 0.00 H new ATOM 0 HG2 LYS B 55 18.535 4.557 4.574 1.00 0.00 H new ATOM 0 HG3 LYS B 55 17.936 3.425 3.378 1.00 0.00 H new ATOM 0 HD2 LYS B 55 19.924 2.175 3.351 1.00 0.00 H new ATOM 0 HD3 LYS B 55 20.925 3.553 3.763 1.00 0.00 H new ATOM 0 HE2 LYS B 55 20.652 3.238 6.031 1.00 0.00 H new ATOM 0 HE3 LYS B 55 18.946 2.868 5.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 20.201 0.926 6.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 19.530 0.653 5.052 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 21.183 1.011 5.204 1.00 0.00 H new ATOM 1949 N LYS B 56 20.239 8.522 2.445 1.00 0.00 N ATOM 1950 CA LYS B 56 21.245 9.388 1.756 1.00 0.00 C ATOM 1951 C LYS B 56 21.359 9.040 0.262 1.00 0.00 C ATOM 1952 O LYS B 56 20.695 9.628 -0.565 1.00 0.00 O ATOM 1953 CB LYS B 56 22.607 9.209 2.432 1.00 0.00 C ATOM 1954 CG LYS B 56 22.856 10.372 3.395 1.00 0.00 C ATOM 1955 CD LYS B 56 23.225 11.625 2.596 1.00 0.00 C ATOM 1956 CE LYS B 56 24.582 12.152 3.070 1.00 0.00 C ATOM 1957 NZ LYS B 56 24.680 13.608 2.769 1.00 0.00 N ATOM 0 H LYS B 56 19.535 9.029 2.981 1.00 0.00 H new ATOM 0 HA LYS B 56 20.918 10.425 1.834 1.00 0.00 H new ATOM 0 HB2 LYS B 56 22.635 8.263 2.973 1.00 0.00 H new ATOM 0 HB3 LYS B 56 23.396 9.170 1.680 1.00 0.00 H new ATOM 0 HG2 LYS B 56 21.965 10.559 3.995 1.00 0.00 H new ATOM 0 HG3 LYS B 56 23.659 10.119 4.087 1.00 0.00 H new ATOM 0 HD2 LYS B 56 23.265 11.392 1.532 1.00 0.00 H new ATOM 0 HD3 LYS B 56 22.460 12.391 2.726 1.00 0.00 H new ATOM 0 HE2 LYS B 56 24.697 11.982 4.141 1.00 0.00 H new ATOM 0 HE3 LYS B 56 25.388 11.612 2.573 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 25.601 13.968 3.090 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 24.588 13.758 1.744 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 23.919 14.117 3.262 1.00 0.00 H new ATOM 1971 N TRP B 57 22.220 8.113 -0.086 1.00 0.00 N ATOM 1972 CA TRP B 57 22.420 7.737 -1.523 1.00 0.00 C ATOM 1973 C TRP B 57 21.084 7.648 -2.280 1.00 0.00 C ATOM 1974 O TRP B 57 20.986 8.051 -3.422 1.00 0.00 O ATOM 1975 CB TRP B 57 23.168 6.396 -1.585 1.00 0.00 C ATOM 1976 CG TRP B 57 22.273 5.289 -1.181 1.00 0.00 C ATOM 1977 CD1 TRP B 57 22.305 4.609 -0.017 1.00 0.00 C ATOM 1978 CD2 TRP B 57 21.277 4.668 -2.000 1.00 0.00 C ATOM 1979 NE1 TRP B 57 21.354 3.601 -0.070 1.00 0.00 N ATOM 1980 CE2 TRP B 57 20.685 3.604 -1.277 1.00 0.00 C ATOM 1981 CE3 TRP B 57 20.832 4.938 -3.306 1.00 0.00 C ATOM 1982 CZ2 TRP B 57 19.668 2.822 -1.846 1.00 0.00 C ATOM 1983 CZ3 TRP B 57 19.831 4.161 -3.888 1.00 0.00 C ATOM 1984 CH2 TRP B 57 19.244 3.100 -3.163 1.00 0.00 C ATOM 0 H TRP B 57 22.800 7.594 0.573 1.00 0.00 H new ATOM 0 HA TRP B 57 23.009 8.514 -2.010 1.00 0.00 H new ATOM 0 HB2 TRP B 57 23.537 6.224 -2.596 1.00 0.00 H new ATOM 0 HB3 TRP B 57 24.038 6.427 -0.929 1.00 0.00 H new ATOM 0 HD1 TRP B 57 22.961 4.815 0.816 1.00 0.00 H new ATOM 0 HE1 TRP B 57 21.172 2.942 0.687 1.00 0.00 H new ATOM 0 HE3 TRP B 57 21.269 5.754 -3.863 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 19.216 2.018 -1.284 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 19.504 4.371 -4.896 1.00 0.00 H new ATOM 0 HH2 TRP B 57 18.469 2.500 -3.618 1.00 0.00 H new ATOM 1995 N VAL B 58 20.064 7.123 -1.668 1.00 0.00 N ATOM 1996 CA VAL B 58 18.747 7.010 -2.374 1.00 0.00 C ATOM 1997 C VAL B 58 18.354 8.356 -2.990 1.00 0.00 C ATOM 1998 O VAL B 58 18.117 8.452 -4.175 1.00 0.00 O ATOM 1999 CB VAL B 58 17.651 6.564 -1.403 1.00 0.00 C ATOM 2000 CG1 VAL B 58 17.655 5.038 -1.303 1.00 0.00 C ATOM 2001 CG2 VAL B 58 17.893 7.158 -0.018 1.00 0.00 C ATOM 0 H VAL B 58 20.078 6.766 -0.713 1.00 0.00 H new ATOM 0 HA VAL B 58 18.852 6.266 -3.163 1.00 0.00 H new ATOM 0 HB VAL B 58 16.687 6.913 -1.775 1.00 0.00 H new ATOM 0 HG11 VAL B 58 16.876 4.717 -0.612 1.00 0.00 H new ATOM 0 HG12 VAL B 58 17.467 4.608 -2.287 1.00 0.00 H new ATOM 0 HG13 VAL B 58 18.625 4.700 -0.938 1.00 0.00 H new ATOM 0 HG21 VAL B 58 17.105 6.831 0.661 1.00 0.00 H new ATOM 0 HG22 VAL B 58 18.859 6.821 0.359 1.00 0.00 H new ATOM 0 HG23 VAL B 58 17.888 8.246 -0.083 1.00 0.00 H new ATOM 2011 N ARG B 59 18.275 9.392 -2.200 1.00 0.00 N ATOM 2012 CA ARG B 59 17.892 10.719 -2.750 1.00 0.00 C ATOM 2013 C ARG B 59 19.013 11.228 -3.652 1.00 0.00 C ATOM 2014 O ARG B 59 18.784 11.956 -4.597 1.00 0.00 O ATOM 2015 CB ARG B 59 17.667 11.703 -1.600 1.00 0.00 C ATOM 2016 CG ARG B 59 16.396 11.318 -0.841 1.00 0.00 C ATOM 2017 CD ARG B 59 16.291 12.152 0.436 1.00 0.00 C ATOM 2018 NE ARG B 59 15.504 13.387 0.160 1.00 0.00 N ATOM 2019 CZ ARG B 59 14.329 13.548 0.704 1.00 0.00 C ATOM 2020 NH1 ARG B 59 14.133 13.204 1.947 1.00 0.00 N ATOM 2021 NH2 ARG B 59 13.351 14.055 0.005 1.00 0.00 N ATOM 0 H ARG B 59 18.460 9.375 -1.197 1.00 0.00 H new ATOM 0 HA ARG B 59 16.972 10.628 -3.327 1.00 0.00 H new ATOM 0 HB2 ARG B 59 18.523 11.693 -0.926 1.00 0.00 H new ATOM 0 HB3 ARG B 59 17.579 12.718 -1.988 1.00 0.00 H new ATOM 0 HG2 ARG B 59 15.521 11.484 -1.469 1.00 0.00 H new ATOM 0 HG3 ARG B 59 16.415 10.257 -0.594 1.00 0.00 H new ATOM 0 HD2 ARG B 59 15.812 11.571 1.224 1.00 0.00 H new ATOM 0 HD3 ARG B 59 17.286 12.415 0.794 1.00 0.00 H new ATOM 0 HE ARG B 59 15.884 14.107 -0.455 1.00 0.00 H new ATOM 0 HH11 ARG B 59 14.898 12.809 2.494 1.00 0.00 H new ATOM 0 HH12 ARG B 59 13.214 13.330 2.372 1.00 0.00 H new ATOM 0 HH21 ARG B 59 13.505 14.325 -0.966 1.00 0.00 H new ATOM 0 HH22 ARG B 59 12.432 14.181 0.430 1.00 0.00 H new ATOM 2035 N GLU B 60 20.227 10.839 -3.374 1.00 0.00 N ATOM 2036 CA GLU B 60 21.363 11.287 -4.223 1.00 0.00 C ATOM 2037 C GLU B 60 21.103 10.847 -5.665 1.00 0.00 C ATOM 2038 O GLU B 60 21.649 11.399 -6.600 1.00 0.00 O ATOM 2039 CB GLU B 60 22.662 10.657 -3.719 1.00 0.00 C ATOM 2040 CG GLU B 60 23.081 11.327 -2.408 1.00 0.00 C ATOM 2041 CD GLU B 60 23.832 12.623 -2.716 1.00 0.00 C ATOM 2042 OE1 GLU B 60 24.487 12.676 -3.744 1.00 0.00 O ATOM 2043 OE2 GLU B 60 23.741 13.542 -1.917 1.00 0.00 O ATOM 0 H GLU B 60 20.480 10.230 -2.595 1.00 0.00 H new ATOM 0 HA GLU B 60 21.454 12.372 -4.177 1.00 0.00 H new ATOM 0 HB2 GLU B 60 22.523 9.587 -3.564 1.00 0.00 H new ATOM 0 HB3 GLU B 60 23.448 10.772 -4.466 1.00 0.00 H new ATOM 0 HG2 GLU B 60 22.203 11.539 -1.798 1.00 0.00 H new ATOM 0 HG3 GLU B 60 23.715 10.655 -1.830 1.00 0.00 H new ATOM 2050 N TYR B 61 20.266 9.861 -5.852 1.00 0.00 N ATOM 2051 CA TYR B 61 19.961 9.392 -7.229 1.00 0.00 C ATOM 2052 C TYR B 61 18.581 9.911 -7.630 1.00 0.00 C ATOM 2053 O TYR B 61 18.301 10.128 -8.792 1.00 0.00 O ATOM 2054 CB TYR B 61 19.971 7.858 -7.272 1.00 0.00 C ATOM 2055 CG TYR B 61 21.294 7.313 -6.756 1.00 0.00 C ATOM 2056 CD1 TYR B 61 22.461 8.119 -6.752 1.00 0.00 C ATOM 2057 CD2 TYR B 61 21.365 5.975 -6.306 1.00 0.00 C ATOM 2058 CE1 TYR B 61 23.686 7.589 -6.289 1.00 0.00 C ATOM 2059 CE2 TYR B 61 22.593 5.445 -5.849 1.00 0.00 C ATOM 2060 CZ TYR B 61 23.752 6.252 -5.839 1.00 0.00 C ATOM 2061 OH TYR B 61 24.950 5.733 -5.393 1.00 0.00 O ATOM 0 H TYR B 61 19.781 9.361 -5.107 1.00 0.00 H new ATOM 0 HA TYR B 61 20.714 9.767 -7.922 1.00 0.00 H new ATOM 0 HB2 TYR B 61 19.151 7.467 -6.669 1.00 0.00 H new ATOM 0 HB3 TYR B 61 19.806 7.517 -8.294 1.00 0.00 H new ATOM 0 HD1 TYR B 61 22.413 9.139 -7.103 1.00 0.00 H new ATOM 0 HD2 TYR B 61 20.480 5.357 -6.311 1.00 0.00 H new ATOM 0 HE1 TYR B 61 24.572 8.206 -6.279 1.00 0.00 H new ATOM 0 HE2 TYR B 61 22.645 4.422 -5.507 1.00 0.00 H new ATOM 0 HH TYR B 61 24.821 4.801 -5.119 1.00 0.00 H new ATOM 2071 N ILE B 62 17.717 10.119 -6.672 1.00 0.00 N ATOM 2072 CA ILE B 62 16.358 10.635 -6.998 1.00 0.00 C ATOM 2073 C ILE B 62 16.498 11.974 -7.731 1.00 0.00 C ATOM 2074 O ILE B 62 15.670 12.338 -8.543 1.00 0.00 O ATOM 2075 CB ILE B 62 15.567 10.828 -5.697 1.00 0.00 C ATOM 2076 CG1 ILE B 62 15.270 9.461 -5.076 1.00 0.00 C ATOM 2077 CG2 ILE B 62 14.246 11.546 -5.987 1.00 0.00 C ATOM 2078 CD1 ILE B 62 14.753 9.653 -3.649 1.00 0.00 C ATOM 0 H ILE B 62 17.894 9.954 -5.681 1.00 0.00 H new ATOM 0 HA ILE B 62 15.829 9.927 -7.636 1.00 0.00 H new ATOM 0 HB ILE B 62 16.159 11.429 -5.007 1.00 0.00 H new ATOM 0 HG12 ILE B 62 14.530 8.930 -5.675 1.00 0.00 H new ATOM 0 HG13 ILE B 62 16.172 8.849 -5.069 1.00 0.00 H new ATOM 0 HG21 ILE B 62 13.692 11.678 -5.058 1.00 0.00 H new ATOM 0 HG22 ILE B 62 14.451 12.521 -6.429 1.00 0.00 H new ATOM 0 HG23 ILE B 62 13.653 10.951 -6.681 1.00 0.00 H new ATOM 0 HD11 ILE B 62 14.541 8.680 -3.205 1.00 0.00 H new ATOM 0 HD12 ILE B 62 15.509 10.166 -3.054 1.00 0.00 H new ATOM 0 HD13 ILE B 62 13.841 10.249 -3.670 1.00 0.00 H new ATOM 2090 N ASN B 63 17.539 12.709 -7.448 1.00 0.00 N ATOM 2091 CA ASN B 63 17.731 14.021 -8.127 1.00 0.00 C ATOM 2092 C ASN B 63 18.749 13.866 -9.258 1.00 0.00 C ATOM 2093 O ASN B 63 18.575 14.390 -10.340 1.00 0.00 O ATOM 2094 CB ASN B 63 18.246 15.047 -7.115 1.00 0.00 C ATOM 2095 CG ASN B 63 18.262 16.435 -7.757 1.00 0.00 C ATOM 2096 OD1 ASN B 63 18.766 16.607 -8.849 1.00 0.00 O ATOM 2097 ND2 ASN B 63 17.724 17.441 -7.122 1.00 0.00 N ATOM 0 H ASN B 63 18.264 12.457 -6.776 1.00 0.00 H new ATOM 0 HA ASN B 63 16.780 14.360 -8.538 1.00 0.00 H new ATOM 0 HB2 ASN B 63 17.610 15.052 -6.230 1.00 0.00 H new ATOM 0 HB3 ASN B 63 19.249 14.776 -6.785 1.00 0.00 H new ATOM 0 HD21 ASN B 63 17.727 18.370 -7.543 1.00 0.00 H new ATOM 0 HD22 ASN B 63 17.301 17.298 -6.205 1.00 0.00 H new ATOM 2104 N SER B 64 19.813 13.148 -9.018 1.00 0.00 N ATOM 2105 CA SER B 64 20.841 12.959 -10.078 1.00 0.00 C ATOM 2106 C SER B 64 20.180 12.402 -11.342 1.00 0.00 C ATOM 2107 O SER B 64 20.690 12.546 -12.436 1.00 0.00 O ATOM 2108 CB SER B 64 21.906 11.976 -9.586 1.00 0.00 C ATOM 2109 OG SER B 64 22.857 12.665 -8.788 1.00 0.00 O ATOM 0 H SER B 64 20.014 12.684 -8.132 1.00 0.00 H new ATOM 0 HA SER B 64 21.306 13.918 -10.305 1.00 0.00 H new ATOM 0 HB2 SER B 64 21.440 11.179 -9.007 1.00 0.00 H new ATOM 0 HB3 SER B 64 22.401 11.506 -10.435 1.00 0.00 H new ATOM 0 HG SER B 64 22.719 12.438 -7.845 1.00 0.00 H new ATOM 2115 N LEU B 65 19.049 11.768 -11.201 1.00 0.00 N ATOM 2116 CA LEU B 65 18.358 11.205 -12.395 1.00 0.00 C ATOM 2117 C LEU B 65 18.041 12.333 -13.379 1.00 0.00 C ATOM 2118 O LEU B 65 17.204 13.175 -13.124 1.00 0.00 O ATOM 2119 CB LEU B 65 17.057 10.527 -11.960 1.00 0.00 C ATOM 2120 CG LEU B 65 17.353 9.101 -11.495 1.00 0.00 C ATOM 2121 CD1 LEU B 65 16.273 8.651 -10.508 1.00 0.00 C ATOM 2122 CD2 LEU B 65 17.363 8.161 -12.702 1.00 0.00 C ATOM 0 H LEU B 65 18.574 11.615 -10.312 1.00 0.00 H new ATOM 0 HA LEU B 65 19.005 10.472 -12.877 1.00 0.00 H new ATOM 0 HB2 LEU B 65 16.591 11.094 -11.154 1.00 0.00 H new ATOM 0 HB3 LEU B 65 16.349 10.511 -12.788 1.00 0.00 H new ATOM 0 HG LEU B 65 18.327 9.074 -11.006 1.00 0.00 H new ATOM 0 HD11 LEU B 65 16.484 7.634 -10.176 1.00 0.00 H new ATOM 0 HD12 LEU B 65 16.266 9.319 -9.647 1.00 0.00 H new ATOM 0 HD13 LEU B 65 15.299 8.678 -10.997 1.00 0.00 H new ATOM 0 HD21 LEU B 65 17.574 7.145 -12.370 1.00 0.00 H new ATOM 0 HD22 LEU B 65 16.390 8.188 -13.192 1.00 0.00 H new ATOM 0 HD23 LEU B 65 18.132 8.480 -13.405 1.00 0.00 H new