USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 758 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 320 THR OG1 : rot 180:sc= 0.00242 USER MOD Set 1.2: A 322 LYS NZ :NH3+ -172:sc= -4.27! (180deg=-4.61!) USER MOD Set 2.1: A 267 ASN : amide:sc= -2.18! C(o=-1.8!,f=-5.4!) USER MOD Set 2.2: A 269 THR OG1 : rot -135:sc= 0.397 USER MOD Set 3.1: A 256 ASN : amide:sc= -4.2! C(o=-6.9!,f=-9.3!) USER MOD Set 3.2: A 314 THR OG1 : rot 145:sc= -2.7! USER MOD Single : A 251 HIS : no HD1:sc= -0.196 X(o=-0.2,f=-0.047) USER MOD Single : A 255 SER OG : rot 180:sc= 0 USER MOD Single : A 259 ASN : amide:sc= -2.7! C(o=-2.7!,f=-6.1!) USER MOD Single : A 260 SER OG : rot 39:sc= 1.08 USER MOD Single : A 262 HIS : no HD1:sc= -0.0946 X(o=-0.095,f=-0.052) USER MOD Single : A 266 TYR OH : rot -15:sc= -1.47 USER MOD Single : A 268 LYS NZ :NH3+ -154:sc= -0.173 (180deg=-1.22) USER MOD Single : A 270 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 276 ASN : amide:sc= 0.512 K(o=0.51,f=-0.25) USER MOD Single : A 277 CYS SG : rot -79:sc= 0.00986 USER MOD Single : A 278 THR OG1 : rot 91:sc= -1.59! USER MOD Single : A 282 SER OG : rot 180:sc= 0 USER MOD Single : A 283 SER OG : rot 170:sc= 0 USER MOD Single : A 290 SER OG : rot 29:sc= 0.0782 USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 293 MET CE :methyl 143:sc= -3.09 (180deg=-5.38!) USER MOD Single : A 296 HIS : no HD1:sc=-0.00954 X(o=-0.0095,f=0) USER MOD Single : A 301 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 303 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 304 LYS NZ :NH3+ 169:sc= 0.424 (180deg=0.361) USER MOD Single : A 311 SER OG : rot 180:sc= 0 USER MOD Single : A 317 SER OG : rot 180:sc= -0.0265 USER MOD Single : A 318 ASN : amide:sc= -0.032 X(o=-0.032,f=-0.34) USER MOD Single : A 319 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 MET CE :methyl 157:sc= -7.84! (180deg=-11.4!) USER MOD Single : A 325 ASN : amide:sc= -12.3! C(o=-12!,f=-11!) USER MOD Single : A 326 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 330 THR OG1 : rot 180:sc= 0 USER MOD Single : A 335 LYS NZ :NH3+ 158:sc= -0.254 (180deg=-1.1) USER MOD Single : A 336 CYS SG : rot -71:sc= -3.78! USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 340 ASN : amide:sc= -1.96! C(o=-2!,f=-4!) USER MOD Single : A 343 THR OG1 : rot 56:sc= 0.946 USER MOD Single : A 345 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 346 SER OG : rot -98:sc= -0.281 USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 249 3.496 -6.362 -1.348 1.00 22.55 N ATOM 43 CA LEU A 249 4.590 -7.316 -1.272 1.00 32.23 C ATOM 44 C LEU A 249 5.002 -7.498 0.191 1.00 51.25 C ATOM 45 O LEU A 249 4.941 -6.555 0.978 1.00 11.01 O ATOM 46 CB LEU A 249 5.739 -6.887 -2.186 1.00 23.22 C ATOM 47 CG LEU A 249 6.942 -6.244 -1.493 1.00 45.35 C ATOM 48 CD1 LEU A 249 7.954 -5.728 -2.519 1.00 20.30 C ATOM 49 CD2 LEU A 249 6.496 -5.145 -0.527 1.00 31.13 C ATOM 0 HA LEU A 249 4.271 -8.292 -1.637 1.00 32.23 H new ATOM 0 HB2 LEU A 249 6.086 -7.762 -2.736 1.00 23.22 H new ATOM 0 HB3 LEU A 249 5.349 -6.183 -2.921 1.00 23.22 H new ATOM 0 HG LEU A 249 7.444 -7.009 -0.901 1.00 45.35 H new ATOM 0 HD11 LEU A 249 8.799 -5.276 -2.001 1.00 20.30 H new ATOM 0 HD12 LEU A 249 8.306 -6.558 -3.132 1.00 20.30 H new ATOM 0 HD13 LEU A 249 7.478 -4.983 -3.156 1.00 20.30 H new ATOM 0 HD21 LEU A 249 7.371 -4.705 -0.048 1.00 31.13 H new ATOM 0 HD22 LEU A 249 5.957 -4.374 -1.077 1.00 31.13 H new ATOM 0 HD23 LEU A 249 5.842 -5.572 0.233 1.00 31.13 H new ATOM 61 N LEU A 250 5.412 -8.717 0.509 1.00 3.43 N ATOM 62 CA LEU A 250 5.834 -9.034 1.863 1.00 4.11 C ATOM 63 C LEU A 250 7.243 -9.630 1.827 1.00 42.50 C ATOM 64 O LEU A 250 7.419 -10.796 1.477 1.00 3.51 O ATOM 65 CB LEU A 250 4.804 -9.933 2.549 1.00 72.34 C ATOM 66 CG LEU A 250 5.002 -10.158 4.049 1.00 2.10 C ATOM 67 CD1 LEU A 250 3.867 -9.522 4.853 1.00 0.34 C ATOM 68 CD2 LEU A 250 5.164 -11.646 4.364 1.00 74.40 C ATOM 0 H LEU A 250 5.461 -9.497 -0.147 1.00 3.43 H new ATOM 0 HA LEU A 250 5.885 -8.128 2.468 1.00 4.11 H new ATOM 0 HB2 LEU A 250 3.815 -9.502 2.394 1.00 72.34 H new ATOM 0 HB3 LEU A 250 4.810 -10.903 2.052 1.00 72.34 H new ATOM 0 HG LEU A 250 5.926 -9.663 4.349 1.00 2.10 H new ATOM 0 HD11 LEU A 250 4.032 -9.697 5.916 1.00 0.34 H new ATOM 0 HD12 LEU A 250 3.842 -8.449 4.661 1.00 0.34 H new ATOM 0 HD13 LEU A 250 2.917 -9.966 4.556 1.00 0.34 H new ATOM 0 HD21 LEU A 250 5.303 -11.778 5.437 1.00 74.40 H new ATOM 0 HD22 LEU A 250 4.272 -12.185 4.045 1.00 74.40 H new ATOM 0 HD23 LEU A 250 6.033 -12.037 3.835 1.00 74.40 H new ATOM 80 N HIS A 251 8.211 -8.802 2.194 1.00 54.25 N ATOM 81 CA HIS A 251 9.598 -9.232 2.207 1.00 24.05 C ATOM 82 C HIS A 251 9.777 -10.355 3.231 1.00 63.10 C ATOM 83 O HIS A 251 9.255 -10.277 4.342 1.00 53.13 O ATOM 84 CB HIS A 251 10.532 -8.046 2.459 1.00 62.40 C ATOM 85 CG HIS A 251 10.933 -7.304 1.207 1.00 54.44 C ATOM 86 ND1 HIS A 251 11.140 -5.935 1.180 1.00 34.53 N ATOM 87 CD2 HIS A 251 11.163 -7.752 -0.061 1.00 35.42 C ATOM 88 CE1 HIS A 251 11.477 -5.587 -0.053 1.00 24.24 C ATOM 89 NE2 HIS A 251 11.491 -6.715 -0.820 1.00 54.43 N ATOM 0 H HIS A 251 8.061 -7.836 2.484 1.00 54.25 H new ATOM 0 HA HIS A 251 9.868 -9.632 1.229 1.00 24.05 H new ATOM 0 HB2 HIS A 251 10.043 -7.350 3.141 1.00 62.40 H new ATOM 0 HB3 HIS A 251 11.431 -8.405 2.960 1.00 62.40 H new ATOM 0 HD2 HIS A 251 11.090 -8.778 -0.391 1.00 35.42 H new ATOM 0 HE1 HIS A 251 11.701 -4.586 -0.391 1.00 24.24 H new ATOM 0 HE2 HIS A 251 11.717 -6.754 -1.814 1.00 54.43 H new ATOM 97 N VAL A 252 10.518 -11.374 2.820 1.00 34.21 N ATOM 98 CA VAL A 252 10.772 -12.512 3.687 1.00 30.02 C ATOM 99 C VAL A 252 12.177 -13.052 3.414 1.00 42.02 C ATOM 100 O VAL A 252 12.584 -13.179 2.260 1.00 53.21 O ATOM 101 CB VAL A 252 9.679 -13.567 3.501 1.00 44.24 C ATOM 102 CG1 VAL A 252 10.016 -14.847 4.268 1.00 3.31 C ATOM 103 CG2 VAL A 252 8.313 -13.020 3.918 1.00 32.44 C ATOM 0 H VAL A 252 10.950 -11.435 1.898 1.00 34.21 H new ATOM 0 HA VAL A 252 10.738 -12.210 4.734 1.00 30.02 H new ATOM 0 HB VAL A 252 9.630 -13.816 2.441 1.00 44.24 H new ATOM 0 HG11 VAL A 252 9.223 -15.580 4.119 1.00 3.31 H new ATOM 0 HG12 VAL A 252 10.959 -15.253 3.902 1.00 3.31 H new ATOM 0 HG13 VAL A 252 10.106 -14.621 5.331 1.00 3.31 H new ATOM 0 HG21 VAL A 252 7.554 -13.789 3.776 1.00 32.44 H new ATOM 0 HG22 VAL A 252 8.343 -12.729 4.968 1.00 32.44 H new ATOM 0 HG23 VAL A 252 8.067 -12.151 3.308 1.00 32.44 H new ATOM 113 N GLU A 253 12.880 -13.356 4.495 1.00 45.42 N ATOM 114 CA GLU A 253 14.232 -13.879 4.386 1.00 14.00 C ATOM 115 C GLU A 253 14.280 -15.329 4.872 1.00 51.01 C ATOM 116 O GLU A 253 13.812 -15.636 5.967 1.00 23.22 O ATOM 117 CB GLU A 253 15.221 -13.008 5.162 1.00 43.41 C ATOM 118 CG GLU A 253 16.532 -13.756 5.412 1.00 20.21 C ATOM 119 CD GLU A 253 17.706 -12.782 5.527 1.00 23.24 C ATOM 120 OE1 GLU A 253 18.375 -12.738 6.571 1.00 54.41 O ATOM 121 OE2 GLU A 253 17.916 -12.055 4.483 1.00 51.22 O ATOM 0 H GLU A 253 12.539 -13.250 5.451 1.00 45.42 H new ATOM 0 HA GLU A 253 14.526 -13.858 3.337 1.00 14.00 H new ATOM 0 HB2 GLU A 253 15.421 -12.093 4.604 1.00 43.41 H new ATOM 0 HB3 GLU A 253 14.780 -12.711 6.114 1.00 43.41 H new ATOM 0 HG2 GLU A 253 16.451 -14.343 6.327 1.00 20.21 H new ATOM 0 HG3 GLU A 253 16.715 -14.458 4.598 1.00 20.21 H new ATOM 129 N VAL A 254 14.850 -16.182 4.033 1.00 13.12 N ATOM 130 CA VAL A 254 14.965 -17.592 4.364 1.00 61.24 C ATOM 131 C VAL A 254 16.415 -17.907 4.737 1.00 0.02 C ATOM 132 O VAL A 254 17.282 -17.978 3.868 1.00 63.41 O ATOM 133 CB VAL A 254 14.448 -18.445 3.204 1.00 70.45 C ATOM 134 CG1 VAL A 254 14.307 -19.910 3.621 1.00 33.40 C ATOM 135 CG2 VAL A 254 13.124 -17.898 2.668 1.00 54.50 C ATOM 0 H VAL A 254 15.237 -15.924 3.125 1.00 13.12 H new ATOM 0 HA VAL A 254 14.347 -17.833 5.229 1.00 61.24 H new ATOM 0 HB VAL A 254 15.181 -18.395 2.399 1.00 70.45 H new ATOM 0 HG11 VAL A 254 13.938 -20.494 2.778 1.00 33.40 H new ATOM 0 HG12 VAL A 254 15.278 -20.295 3.932 1.00 33.40 H new ATOM 0 HG13 VAL A 254 13.604 -19.986 4.451 1.00 33.40 H new ATOM 0 HG21 VAL A 254 12.779 -18.523 1.844 1.00 54.50 H new ATOM 0 HG22 VAL A 254 12.379 -17.903 3.464 1.00 54.50 H new ATOM 0 HG23 VAL A 254 13.269 -16.878 2.313 1.00 54.50 H new ATOM 145 N SER A 255 16.633 -18.087 6.032 1.00 42.24 N ATOM 146 CA SER A 255 17.963 -18.392 6.531 1.00 61.30 C ATOM 147 C SER A 255 18.360 -19.813 6.126 1.00 24.42 C ATOM 148 O SER A 255 19.193 -20.001 5.240 1.00 0.44 O ATOM 149 CB SER A 255 18.030 -18.235 8.051 1.00 20.24 C ATOM 150 OG SER A 255 18.866 -17.148 8.439 1.00 33.15 O ATOM 0 H SER A 255 15.911 -18.027 6.750 1.00 42.24 H new ATOM 0 HA SER A 255 18.665 -17.685 6.089 1.00 61.30 H new ATOM 0 HB2 SER A 255 17.025 -18.078 8.444 1.00 20.24 H new ATOM 0 HB3 SER A 255 18.405 -19.157 8.495 1.00 20.24 H new ATOM 0 HG SER A 255 18.881 -17.080 9.417 1.00 33.15 H new ATOM 156 N ASN A 256 17.746 -20.778 6.795 1.00 70.34 N ATOM 157 CA ASN A 256 18.025 -22.177 6.516 1.00 50.23 C ATOM 158 C ASN A 256 19.528 -22.430 6.652 1.00 13.44 C ATOM 159 O ASN A 256 20.240 -22.512 5.653 1.00 4.12 O ATOM 160 CB ASN A 256 17.611 -22.547 5.090 1.00 30.32 C ATOM 161 CG ASN A 256 18.166 -23.918 4.697 1.00 43.54 C ATOM 162 OD1 ASN A 256 18.915 -24.062 3.744 1.00 20.42 O ATOM 163 ND2 ASN A 256 17.759 -24.912 5.480 1.00 1.24 N ATOM 0 H ASN A 256 17.056 -20.619 7.529 1.00 70.34 H new ATOM 0 HA ASN A 256 17.459 -22.782 7.225 1.00 50.23 H new ATOM 0 HB2 ASN A 256 16.524 -22.555 5.014 1.00 30.32 H new ATOM 0 HB3 ASN A 256 17.974 -21.791 4.394 1.00 30.32 H new ATOM 0 HD21 ASN A 256 18.074 -25.865 5.300 1.00 1.24 H new ATOM 0 HD22 ASN A 256 17.131 -24.722 6.261 1.00 1.24 H new ATOM 170 N GLU A 257 19.965 -22.546 7.898 1.00 50.24 N ATOM 171 CA GLU A 257 21.370 -22.788 8.178 1.00 41.40 C ATOM 172 C GLU A 257 21.555 -24.167 8.813 1.00 71.43 C ATOM 173 O GLU A 257 20.643 -24.993 8.788 1.00 25.01 O ATOM 174 CB GLU A 257 21.947 -21.690 9.074 1.00 22.12 C ATOM 175 CG GLU A 257 21.305 -21.722 10.462 1.00 11.35 C ATOM 176 CD GLU A 257 21.297 -20.328 11.095 1.00 62.42 C ATOM 177 OE1 GLU A 257 22.336 -19.866 11.589 1.00 22.43 O ATOM 178 OE2 GLU A 257 20.160 -19.720 11.060 1.00 43.03 O ATOM 0 H GLU A 257 19.371 -22.477 8.724 1.00 50.24 H new ATOM 0 HA GLU A 257 21.917 -22.768 7.235 1.00 41.40 H new ATOM 0 HB2 GLU A 257 23.025 -21.819 9.165 1.00 22.12 H new ATOM 0 HB3 GLU A 257 21.780 -20.716 8.615 1.00 22.12 H new ATOM 0 HG2 GLU A 257 20.284 -22.097 10.386 1.00 11.35 H new ATOM 0 HG3 GLU A 257 21.851 -22.413 11.103 1.00 11.35 H new ATOM 186 N ASP A 258 22.741 -24.375 9.366 1.00 14.23 N ATOM 187 CA ASP A 258 23.057 -25.640 10.006 1.00 34.44 C ATOM 188 C ASP A 258 22.732 -25.547 11.499 1.00 63.12 C ATOM 189 O ASP A 258 23.390 -26.182 12.322 1.00 44.05 O ATOM 190 CB ASP A 258 24.543 -25.973 9.866 1.00 43.24 C ATOM 191 CG ASP A 258 24.922 -26.711 8.580 1.00 31.43 C ATOM 192 OD1 ASP A 258 24.157 -27.547 8.075 1.00 5.10 O ATOM 193 OD2 ASP A 258 26.071 -26.395 8.088 1.00 45.20 O ATOM 0 H ASP A 258 23.495 -23.688 9.384 1.00 14.23 H new ATOM 0 HA ASP A 258 22.466 -26.418 9.523 1.00 34.44 H new ATOM 0 HB2 ASP A 258 25.114 -25.046 9.917 1.00 43.24 H new ATOM 0 HB3 ASP A 258 24.846 -26.581 10.719 1.00 43.24 H new ATOM 199 N ASN A 259 21.718 -24.751 11.803 1.00 41.44 N ATOM 200 CA ASN A 259 21.299 -24.566 13.181 1.00 35.05 C ATOM 201 C ASN A 259 19.773 -24.645 13.261 1.00 74.24 C ATOM 202 O ASN A 259 19.227 -25.306 14.143 1.00 13.41 O ATOM 203 CB ASN A 259 21.729 -23.196 13.709 1.00 32.14 C ATOM 204 CG ASN A 259 23.226 -22.969 13.489 1.00 32.01 C ATOM 205 OD1 ASN A 259 23.963 -23.857 13.093 1.00 0.13 O ATOM 206 ND2 ASN A 259 23.632 -21.734 13.767 1.00 41.52 N ATOM 0 H ASN A 259 21.174 -24.227 11.118 1.00 41.44 H new ATOM 0 HA ASN A 259 21.765 -25.347 13.782 1.00 35.05 H new ATOM 0 HB2 ASN A 259 21.161 -22.414 13.206 1.00 32.14 H new ATOM 0 HB3 ASN A 259 21.499 -23.123 14.772 1.00 32.14 H new ATOM 0 HD21 ASN A 259 24.614 -21.482 13.652 1.00 41.52 H new ATOM 0 HD22 ASN A 259 22.962 -21.038 14.095 1.00 41.52 H new ATOM 213 N SER A 260 19.127 -23.963 12.326 1.00 3.43 N ATOM 214 CA SER A 260 17.675 -23.947 12.279 1.00 21.31 C ATOM 215 C SER A 260 17.197 -22.973 11.201 1.00 12.31 C ATOM 216 O SER A 260 18.005 -22.415 10.460 1.00 21.32 O ATOM 217 CB SER A 260 17.084 -23.567 13.638 1.00 30.41 C ATOM 218 OG SER A 260 16.918 -24.702 14.484 1.00 32.21 O ATOM 0 H SER A 260 19.583 -23.417 11.595 1.00 3.43 H new ATOM 0 HA SER A 260 17.330 -24.951 12.031 1.00 21.31 H new ATOM 0 HB2 SER A 260 17.735 -22.843 14.127 1.00 30.41 H new ATOM 0 HB3 SER A 260 16.120 -23.080 13.491 1.00 30.41 H new ATOM 0 HG SER A 260 17.680 -25.308 14.371 1.00 32.21 H new ATOM 224 N LEU A 261 15.885 -22.797 11.148 1.00 73.05 N ATOM 225 CA LEU A 261 15.289 -21.899 10.172 1.00 31.45 C ATOM 226 C LEU A 261 15.116 -20.514 10.799 1.00 21.54 C ATOM 227 O LEU A 261 15.247 -20.357 12.012 1.00 25.43 O ATOM 228 CB LEU A 261 13.990 -22.492 9.622 1.00 0.23 C ATOM 229 CG LEU A 261 14.144 -23.521 8.501 1.00 65.31 C ATOM 230 CD1 LEU A 261 12.805 -24.188 8.180 1.00 2.51 C ATOM 231 CD2 LEU A 261 14.782 -22.891 7.262 1.00 44.54 C ATOM 0 H LEU A 261 15.218 -23.261 11.765 1.00 73.05 H new ATOM 0 HA LEU A 261 15.947 -21.780 9.311 1.00 31.45 H new ATOM 0 HB2 LEU A 261 13.450 -22.959 10.445 1.00 0.23 H new ATOM 0 HB3 LEU A 261 13.368 -21.675 9.256 1.00 0.23 H new ATOM 0 HG LEU A 261 14.818 -24.304 8.847 1.00 65.31 H new ATOM 0 HD11 LEU A 261 12.943 -24.915 7.380 1.00 2.51 H new ATOM 0 HD12 LEU A 261 12.428 -24.694 9.069 1.00 2.51 H new ATOM 0 HD13 LEU A 261 12.088 -23.431 7.862 1.00 2.51 H new ATOM 0 HD21 LEU A 261 14.880 -23.644 6.480 1.00 44.54 H new ATOM 0 HD22 LEU A 261 14.153 -22.076 6.904 1.00 44.54 H new ATOM 0 HD23 LEU A 261 15.768 -22.503 7.518 1.00 44.54 H new ATOM 243 N HIS A 262 14.824 -19.545 9.944 1.00 21.35 N ATOM 244 CA HIS A 262 14.632 -18.179 10.399 1.00 10.24 C ATOM 245 C HIS A 262 13.926 -17.369 9.309 1.00 25.54 C ATOM 246 O HIS A 262 14.559 -16.928 8.351 1.00 10.03 O ATOM 247 CB HIS A 262 15.962 -17.558 10.832 1.00 71.12 C ATOM 248 CG HIS A 262 15.854 -16.649 12.032 1.00 14.44 C ATOM 249 ND1 HIS A 262 16.935 -16.338 12.838 1.00 45.14 N ATOM 250 CD2 HIS A 262 14.782 -15.986 12.555 1.00 51.03 C ATOM 251 CE1 HIS A 262 16.522 -15.525 13.799 1.00 72.24 C ATOM 252 NE2 HIS A 262 15.187 -15.309 13.622 1.00 52.41 N ATOM 0 H HIS A 262 14.716 -19.679 8.939 1.00 21.35 H new ATOM 0 HA HIS A 262 13.991 -18.173 11.280 1.00 10.24 H new ATOM 0 HB2 HIS A 262 16.668 -18.357 11.057 1.00 71.12 H new ATOM 0 HB3 HIS A 262 16.376 -16.993 9.997 1.00 71.12 H new ATOM 0 HD2 HIS A 262 13.775 -16.008 12.166 1.00 51.03 H new ATOM 0 HE1 HIS A 262 17.134 -15.107 14.584 1.00 72.24 H new ATOM 0 HE2 HIS A 262 14.597 -14.723 14.213 1.00 52.41 H new ATOM 260 N PHE A 263 12.625 -17.199 9.492 1.00 23.33 N ATOM 261 CA PHE A 263 11.827 -16.451 8.536 1.00 12.15 C ATOM 262 C PHE A 263 11.429 -15.086 9.103 1.00 24.43 C ATOM 263 O PHE A 263 10.507 -14.991 9.911 1.00 54.41 O ATOM 264 CB PHE A 263 10.561 -17.269 8.274 1.00 51.15 C ATOM 265 CG PHE A 263 10.830 -18.674 7.731 1.00 73.10 C ATOM 266 CD1 PHE A 263 11.093 -18.854 6.409 1.00 43.41 C ATOM 267 CD2 PHE A 263 10.805 -19.744 8.571 1.00 52.42 C ATOM 268 CE1 PHE A 263 11.343 -20.158 5.905 1.00 14.34 C ATOM 269 CE2 PHE A 263 11.054 -21.048 8.067 1.00 1.32 C ATOM 270 CZ PHE A 263 11.318 -21.227 6.745 1.00 32.21 C ATOM 0 H PHE A 263 12.104 -17.566 10.288 1.00 23.33 H new ATOM 0 HA PHE A 263 12.400 -16.283 7.624 1.00 12.15 H new ATOM 0 HB2 PHE A 263 9.995 -17.351 9.202 1.00 51.15 H new ATOM 0 HB3 PHE A 263 9.933 -16.730 7.564 1.00 51.15 H new ATOM 0 HD1 PHE A 263 11.112 -18.005 5.742 1.00 43.41 H new ATOM 0 HD2 PHE A 263 10.596 -19.602 9.621 1.00 52.42 H new ATOM 0 HE1 PHE A 263 11.553 -20.301 4.855 1.00 14.34 H new ATOM 0 HE2 PHE A 263 11.034 -21.898 8.734 1.00 1.32 H new ATOM 0 HZ PHE A 263 11.508 -22.219 6.362 1.00 32.21 H new ATOM 280 N ILE A 264 12.146 -14.065 8.658 1.00 52.22 N ATOM 281 CA ILE A 264 11.880 -12.710 9.111 1.00 75.04 C ATOM 282 C ILE A 264 11.003 -11.996 8.080 1.00 0.50 C ATOM 283 O ILE A 264 11.489 -11.575 7.031 1.00 2.45 O ATOM 284 CB ILE A 264 13.189 -11.980 9.416 1.00 61.10 C ATOM 285 CG1 ILE A 264 14.050 -12.784 10.393 1.00 52.41 C ATOM 286 CG2 ILE A 264 12.921 -10.561 9.922 1.00 73.23 C ATOM 287 CD1 ILE A 264 15.454 -12.186 10.506 1.00 13.13 C ATOM 0 H ILE A 264 12.911 -14.149 7.988 1.00 52.22 H new ATOM 0 HA ILE A 264 11.324 -12.724 10.049 1.00 75.04 H new ATOM 0 HB ILE A 264 13.754 -11.889 8.488 1.00 61.10 H new ATOM 0 HG12 ILE A 264 13.576 -12.797 11.375 1.00 52.41 H new ATOM 0 HG13 ILE A 264 14.117 -13.819 10.057 1.00 52.41 H new ATOM 0 HG21 ILE A 264 13.868 -10.064 10.131 1.00 73.23 H new ATOM 0 HG22 ILE A 264 12.377 -10.000 9.162 1.00 73.23 H new ATOM 0 HG23 ILE A 264 12.326 -10.606 10.834 1.00 73.23 H new ATOM 0 HD11 ILE A 264 16.045 -12.776 11.206 1.00 13.13 H new ATOM 0 HD12 ILE A 264 15.934 -12.196 9.527 1.00 13.13 H new ATOM 0 HD13 ILE A 264 15.384 -11.159 10.865 1.00 13.13 H new ATOM 299 N LEU A 265 9.726 -11.881 8.414 1.00 2.44 N ATOM 300 CA LEU A 265 8.777 -11.224 7.531 1.00 23.31 C ATOM 301 C LEU A 265 8.762 -9.724 7.831 1.00 74.12 C ATOM 302 O LEU A 265 8.787 -9.319 8.992 1.00 70.10 O ATOM 303 CB LEU A 265 7.402 -11.887 7.635 1.00 40.31 C ATOM 304 CG LEU A 265 7.402 -13.400 7.863 1.00 53.35 C ATOM 305 CD1 LEU A 265 6.200 -13.827 8.708 1.00 40.34 C ATOM 306 CD2 LEU A 265 7.465 -14.154 6.533 1.00 74.20 C ATOM 0 H LEU A 265 9.326 -12.232 9.284 1.00 2.44 H new ATOM 0 HA LEU A 265 9.082 -11.338 6.491 1.00 23.31 H new ATOM 0 HB2 LEU A 265 6.855 -11.417 8.452 1.00 40.31 H new ATOM 0 HB3 LEU A 265 6.850 -11.678 6.719 1.00 40.31 H new ATOM 0 HG LEU A 265 8.299 -13.661 8.424 1.00 53.35 H new ATOM 0 HD11 LEU A 265 6.224 -14.907 8.855 1.00 40.34 H new ATOM 0 HD12 LEU A 265 6.240 -13.328 9.676 1.00 40.34 H new ATOM 0 HD13 LEU A 265 5.278 -13.551 8.195 1.00 40.34 H new ATOM 0 HD21 LEU A 265 7.464 -15.227 6.723 1.00 74.20 H new ATOM 0 HD22 LEU A 265 6.599 -13.892 5.925 1.00 74.20 H new ATOM 0 HD23 LEU A 265 8.377 -13.880 6.003 1.00 74.20 H new ATOM 318 N TYR A 266 8.720 -8.940 6.763 1.00 32.35 N ATOM 319 CA TYR A 266 8.700 -7.494 6.898 1.00 43.54 C ATOM 320 C TYR A 266 7.509 -6.890 6.152 1.00 53.42 C ATOM 321 O TYR A 266 7.546 -6.741 4.931 1.00 4.14 O ATOM 322 CB TYR A 266 9.996 -6.993 6.255 1.00 34.13 C ATOM 323 CG TYR A 266 11.231 -7.816 6.624 1.00 5.12 C ATOM 324 CD1 TYR A 266 11.916 -7.547 7.792 1.00 3.10 C ATOM 325 CD2 TYR A 266 11.662 -8.827 5.789 1.00 33.24 C ATOM 326 CE1 TYR A 266 13.080 -8.321 8.139 1.00 35.43 C ATOM 327 CE2 TYR A 266 12.825 -9.602 6.137 1.00 51.33 C ATOM 328 CZ TYR A 266 13.476 -9.311 7.295 1.00 44.45 C ATOM 329 OH TYR A 266 14.575 -10.042 7.623 1.00 60.05 O ATOM 0 H TYR A 266 8.699 -9.279 5.801 1.00 32.35 H new ATOM 0 HA TYR A 266 8.614 -7.208 7.946 1.00 43.54 H new ATOM 0 HB2 TYR A 266 9.878 -6.999 5.171 1.00 34.13 H new ATOM 0 HB3 TYR A 266 10.160 -5.957 6.552 1.00 34.13 H new ATOM 0 HD1 TYR A 266 11.579 -6.756 8.446 1.00 3.10 H new ATOM 0 HD2 TYR A 266 11.127 -9.037 4.875 1.00 33.24 H new ATOM 0 HE1 TYR A 266 13.626 -8.120 9.049 1.00 35.43 H new ATOM 0 HE2 TYR A 266 13.172 -10.396 5.493 1.00 51.33 H new ATOM 0 HH TYR A 266 15.074 -9.583 8.331 1.00 60.05 H new ATOM 339 N ASN A 267 6.479 -6.558 6.917 1.00 41.02 N ATOM 340 CA ASN A 267 5.278 -5.974 6.344 1.00 45.44 C ATOM 341 C ASN A 267 5.601 -4.577 5.809 1.00 5.22 C ATOM 342 O ASN A 267 5.626 -3.609 6.567 1.00 3.45 O ATOM 343 CB ASN A 267 4.177 -5.834 7.396 1.00 3.05 C ATOM 344 CG ASN A 267 2.937 -5.159 6.807 1.00 44.31 C ATOM 345 OD1 ASN A 267 2.075 -5.790 6.219 1.00 31.42 O ATOM 346 ND2 ASN A 267 2.897 -3.843 6.996 1.00 53.11 N ATOM 0 H ASN A 267 6.452 -6.682 7.929 1.00 41.02 H new ATOM 0 HA ASN A 267 4.932 -6.631 5.546 1.00 45.44 H new ATOM 0 HB2 ASN A 267 3.911 -6.818 7.782 1.00 3.05 H new ATOM 0 HB3 ASN A 267 4.547 -5.250 8.239 1.00 3.05 H new ATOM 0 HD21 ASN A 267 2.110 -3.300 6.639 1.00 53.11 H new ATOM 0 HD22 ASN A 267 3.653 -3.377 7.498 1.00 53.11 H new ATOM 353 N LYS A 268 5.841 -4.517 4.508 1.00 52.15 N ATOM 354 CA LYS A 268 6.161 -3.255 3.863 1.00 42.32 C ATOM 355 C LYS A 268 4.941 -2.762 3.082 1.00 43.13 C ATOM 356 O LYS A 268 5.083 -2.085 2.064 1.00 21.43 O ATOM 357 CB LYS A 268 7.423 -3.394 3.009 1.00 71.42 C ATOM 358 CG LYS A 268 8.580 -3.967 3.830 1.00 42.31 C ATOM 359 CD LYS A 268 9.413 -2.847 4.458 1.00 62.33 C ATOM 360 CE LYS A 268 9.365 -2.919 5.985 1.00 2.12 C ATOM 361 NZ LYS A 268 10.650 -3.422 6.521 1.00 33.21 N ATOM 0 H LYS A 268 5.820 -5.322 3.882 1.00 52.15 H new ATOM 0 HA LYS A 268 6.391 -2.494 4.609 1.00 42.32 H new ATOM 0 HB2 LYS A 268 7.220 -4.043 2.157 1.00 71.42 H new ATOM 0 HB3 LYS A 268 7.704 -2.420 2.608 1.00 71.42 H new ATOM 0 HG2 LYS A 268 8.189 -4.617 4.613 1.00 42.31 H new ATOM 0 HG3 LYS A 268 9.214 -4.583 3.192 1.00 42.31 H new ATOM 0 HD2 LYS A 268 10.446 -2.923 4.119 1.00 62.33 H new ATOM 0 HD3 LYS A 268 9.039 -1.879 4.124 1.00 62.33 H new ATOM 0 HE2 LYS A 268 9.155 -1.931 6.395 1.00 2.12 H new ATOM 0 HE3 LYS A 268 8.552 -3.574 6.299 1.00 2.12 H new ATOM 0 HZ1 LYS A 268 10.488 -3.875 7.443 1.00 33.21 H new ATOM 0 HZ2 LYS A 268 11.054 -4.116 5.860 1.00 33.21 H new ATOM 0 HZ3 LYS A 268 11.312 -2.628 6.637 1.00 33.21 H new ATOM 374 N THR A 269 3.770 -3.120 3.588 1.00 64.24 N ATOM 375 CA THR A 269 2.527 -2.723 2.950 1.00 14.20 C ATOM 376 C THR A 269 2.104 -1.332 3.426 1.00 11.23 C ATOM 377 O THR A 269 2.887 -0.623 4.056 1.00 1.31 O ATOM 378 CB THR A 269 1.483 -3.805 3.234 1.00 62.35 C ATOM 379 OG1 THR A 269 1.515 -3.956 4.650 1.00 1.32 O ATOM 380 CG2 THR A 269 1.904 -5.178 2.704 1.00 42.54 C ATOM 0 H THR A 269 3.656 -3.681 4.432 1.00 64.24 H new ATOM 0 HA THR A 269 2.646 -2.641 1.870 1.00 14.20 H new ATOM 0 HB THR A 269 0.532 -3.518 2.785 1.00 62.35 H new ATOM 0 HG1 THR A 269 1.513 -4.909 4.877 1.00 1.32 H new ATOM 0 HG21 THR A 269 1.128 -5.909 2.932 1.00 42.54 H new ATOM 0 HG22 THR A 269 2.046 -5.124 1.625 1.00 42.54 H new ATOM 0 HG23 THR A 269 2.838 -5.480 3.178 1.00 42.54 H new ATOM 388 N ASN A 270 0.866 -0.983 3.107 1.00 2.13 N ATOM 389 CA ASN A 270 0.330 0.311 3.495 1.00 72.33 C ATOM 390 C ASN A 270 -0.394 0.177 4.836 1.00 4.02 C ATOM 391 O ASN A 270 -0.120 0.929 5.771 1.00 60.43 O ATOM 392 CB ASN A 270 -0.678 0.820 2.463 1.00 52.42 C ATOM 393 CG ASN A 270 0.034 1.482 1.281 1.00 33.11 C ATOM 394 OD1 ASN A 270 0.507 0.831 0.364 1.00 34.52 O ATOM 395 ND2 ASN A 270 0.084 2.809 1.354 1.00 75.15 N ATOM 0 H ASN A 270 0.219 -1.574 2.584 1.00 2.13 H new ATOM 0 HA ASN A 270 1.161 1.013 3.566 1.00 72.33 H new ATOM 0 HB2 ASN A 270 -1.289 -0.009 2.106 1.00 52.42 H new ATOM 0 HB3 ASN A 270 -1.354 1.535 2.932 1.00 52.42 H new ATOM 0 HD21 ASN A 270 0.539 3.344 0.614 1.00 75.15 H new ATOM 0 HD22 ASN A 270 -0.332 3.292 2.150 1.00 75.15 H new ATOM 402 N ILE A 271 -1.303 -0.785 4.889 1.00 62.34 N ATOM 403 CA ILE A 271 -2.068 -1.027 6.100 1.00 25.22 C ATOM 404 C ILE A 271 -1.125 -1.508 7.205 1.00 32.24 C ATOM 405 O ILE A 271 0.057 -1.744 6.959 1.00 34.43 O ATOM 406 CB ILE A 271 -3.227 -1.986 5.820 1.00 44.22 C ATOM 407 CG1 ILE A 271 -2.792 -3.441 6.005 1.00 3.05 C ATOM 408 CG2 ILE A 271 -3.820 -1.737 4.432 1.00 62.55 C ATOM 409 CD1 ILE A 271 -1.561 -3.758 5.154 1.00 62.21 C ATOM 0 H ILE A 271 -1.527 -1.407 4.112 1.00 62.34 H new ATOM 0 HA ILE A 271 -2.528 -0.103 6.451 1.00 25.22 H new ATOM 0 HB ILE A 271 -4.015 -1.791 6.547 1.00 44.22 H new ATOM 0 HG12 ILE A 271 -2.570 -3.627 7.056 1.00 3.05 H new ATOM 0 HG13 ILE A 271 -3.610 -4.107 5.730 1.00 3.05 H new ATOM 0 HG21 ILE A 271 -4.642 -2.431 4.258 1.00 62.55 H new ATOM 0 HG22 ILE A 271 -4.191 -0.714 4.373 1.00 62.55 H new ATOM 0 HG23 ILE A 271 -3.050 -1.888 3.675 1.00 62.55 H new ATOM 0 HD11 ILE A 271 -1.273 -4.798 5.304 1.00 62.21 H new ATOM 0 HD12 ILE A 271 -1.794 -3.594 4.102 1.00 62.21 H new ATOM 0 HD13 ILE A 271 -0.738 -3.107 5.449 1.00 62.21 H new ATOM 421 N ILE A 272 -1.684 -1.639 8.400 1.00 63.13 N ATOM 422 CA ILE A 272 -0.908 -2.088 9.544 1.00 41.34 C ATOM 423 C ILE A 272 -1.289 -3.531 9.878 1.00 65.52 C ATOM 424 O ILE A 272 -2.467 -3.885 9.867 1.00 4.01 O ATOM 425 CB ILE A 272 -1.075 -1.120 10.717 1.00 31.30 C ATOM 426 CG1 ILE A 272 -0.316 0.184 10.464 1.00 14.25 C ATOM 427 CG2 ILE A 272 -0.660 -1.779 12.034 1.00 30.11 C ATOM 428 CD1 ILE A 272 -1.199 1.199 9.735 1.00 0.44 C ATOM 0 H ILE A 272 -2.665 -1.442 8.600 1.00 63.13 H new ATOM 0 HA ILE A 272 0.156 -2.086 9.308 1.00 41.34 H new ATOM 0 HB ILE A 272 -2.131 -0.866 10.803 1.00 31.30 H new ATOM 0 HG12 ILE A 272 0.020 0.603 11.412 1.00 14.25 H new ATOM 0 HG13 ILE A 272 0.576 -0.019 9.872 1.00 14.25 H new ATOM 0 HG21 ILE A 272 -0.788 -1.070 12.852 1.00 30.11 H new ATOM 0 HG22 ILE A 272 -1.281 -2.656 12.214 1.00 30.11 H new ATOM 0 HG23 ILE A 272 0.386 -2.081 11.976 1.00 30.11 H new ATOM 0 HD11 ILE A 272 -0.636 2.117 9.567 1.00 0.44 H new ATOM 0 HD12 ILE A 272 -1.513 0.786 8.777 1.00 0.44 H new ATOM 0 HD13 ILE A 272 -2.078 1.418 10.341 1.00 0.44 H new ATOM 440 N ILE A 273 -0.269 -4.327 10.167 1.00 40.33 N ATOM 441 CA ILE A 273 -0.482 -5.724 10.503 1.00 22.14 C ATOM 442 C ILE A 273 -1.331 -5.815 11.773 1.00 2.30 C ATOM 443 O ILE A 273 -1.094 -5.086 12.736 1.00 73.45 O ATOM 444 CB ILE A 273 0.855 -6.461 10.604 1.00 44.30 C ATOM 445 CG1 ILE A 273 1.375 -6.845 9.217 1.00 4.12 C ATOM 446 CG2 ILE A 273 0.745 -7.673 11.531 1.00 3.10 C ATOM 447 CD1 ILE A 273 0.348 -7.691 8.462 1.00 44.45 C ATOM 0 H ILE A 273 0.707 -4.030 10.175 1.00 40.33 H new ATOM 0 HA ILE A 273 -1.037 -6.226 9.710 1.00 22.14 H new ATOM 0 HB ILE A 273 1.586 -5.784 11.046 1.00 44.30 H new ATOM 0 HG12 ILE A 273 1.599 -5.944 8.646 1.00 4.12 H new ATOM 0 HG13 ILE A 273 2.308 -7.401 9.315 1.00 4.12 H new ATOM 0 HG21 ILE A 273 1.709 -8.179 11.585 1.00 3.10 H new ATOM 0 HG22 ILE A 273 0.452 -7.343 12.528 1.00 3.10 H new ATOM 0 HG23 ILE A 273 -0.005 -8.362 11.142 1.00 3.10 H new ATOM 0 HD11 ILE A 273 0.742 -7.950 7.479 1.00 44.45 H new ATOM 0 HD12 ILE A 273 0.144 -8.603 9.024 1.00 44.45 H new ATOM 0 HD13 ILE A 273 -0.575 -7.123 8.344 1.00 44.45 H new ATOM 459 N PRO A 274 -2.328 -6.739 11.733 1.00 42.20 N ATOM 460 CA PRO A 274 -3.213 -6.934 12.868 1.00 33.03 C ATOM 461 C PRO A 274 -2.506 -7.695 13.991 1.00 24.41 C ATOM 462 O PRO A 274 -2.900 -7.604 15.152 1.00 33.25 O ATOM 463 CB PRO A 274 -4.413 -7.681 12.308 1.00 25.10 C ATOM 464 CG PRO A 274 -3.950 -8.283 10.991 1.00 34.31 C ATOM 465 CD PRO A 274 -2.637 -7.619 10.610 1.00 15.11 C ATOM 0 HA PRO A 274 -3.523 -5.994 13.325 1.00 33.03 H new ATOM 0 HB2 PRO A 274 -4.746 -8.457 12.997 1.00 25.10 H new ATOM 0 HB3 PRO A 274 -5.256 -7.007 12.155 1.00 25.10 H new ATOM 0 HG2 PRO A 274 -3.818 -9.361 11.089 1.00 34.31 H new ATOM 0 HG3 PRO A 274 -4.698 -8.123 10.214 1.00 34.31 H new ATOM 0 HD2 PRO A 274 -1.850 -8.357 10.457 1.00 15.11 H new ATOM 0 HD3 PRO A 274 -2.732 -7.057 9.681 1.00 15.11 H new ATOM 473 N GLY A 275 -1.472 -8.429 13.605 1.00 32.21 N ATOM 474 CA GLY A 275 -0.706 -9.206 14.565 1.00 43.23 C ATOM 475 C GLY A 275 -1.487 -10.440 15.020 1.00 64.44 C ATOM 476 O GLY A 275 -2.682 -10.556 14.753 1.00 21.23 O ATOM 0 H GLY A 275 -1.147 -8.502 12.641 1.00 32.21 H new ATOM 0 HA2 GLY A 275 0.239 -9.514 14.117 1.00 43.23 H new ATOM 0 HA3 GLY A 275 -0.463 -8.586 15.428 1.00 43.23 H new ATOM 480 N ASN A 276 -0.779 -11.332 15.698 1.00 12.21 N ATOM 481 CA ASN A 276 -1.391 -12.553 16.193 1.00 70.45 C ATOM 482 C ASN A 276 -1.708 -13.474 15.012 1.00 14.31 C ATOM 483 O ASN A 276 -2.746 -14.134 14.997 1.00 60.03 O ATOM 484 CB ASN A 276 -2.701 -12.256 16.925 1.00 4.04 C ATOM 485 CG ASN A 276 -2.980 -13.311 17.998 1.00 14.51 C ATOM 486 OD1 ASN A 276 -2.681 -13.138 19.168 1.00 12.22 O ATOM 487 ND2 ASN A 276 -3.570 -14.410 17.536 1.00 44.55 N ATOM 0 H ASN A 276 0.213 -11.233 15.916 1.00 12.21 H new ATOM 0 HA ASN A 276 -0.692 -13.025 16.883 1.00 70.45 H new ATOM 0 HB2 ASN A 276 -2.649 -11.269 17.385 1.00 4.04 H new ATOM 0 HB3 ASN A 276 -3.524 -12.232 16.211 1.00 4.04 H new ATOM 0 HD21 ASN A 276 -3.799 -15.172 18.174 1.00 44.55 H new ATOM 0 HD22 ASN A 276 -3.793 -14.490 16.544 1.00 44.55 H new ATOM 494 N CYS A 277 -0.796 -13.488 14.052 1.00 45.30 N ATOM 495 CA CYS A 277 -0.965 -14.316 12.870 1.00 30.12 C ATOM 496 C CYS A 277 -0.488 -15.731 13.203 1.00 35.32 C ATOM 497 O CYS A 277 -0.099 -16.008 14.336 1.00 24.25 O ATOM 498 CB CYS A 277 -0.228 -13.735 11.662 1.00 70.22 C ATOM 499 SG CYS A 277 -1.158 -12.311 10.986 1.00 34.45 S ATOM 0 H CYS A 277 0.063 -12.939 14.068 1.00 45.30 H new ATOM 0 HA CYS A 277 -2.018 -14.345 12.591 1.00 30.12 H new ATOM 0 HB2 CYS A 277 0.774 -13.420 11.954 1.00 70.22 H new ATOM 0 HB3 CYS A 277 -0.111 -14.500 10.895 1.00 70.22 H new ATOM 0 HG CYS A 277 -2.150 -12.743 10.265 1.00 34.45 H new ATOM 505 N THR A 278 -0.535 -16.590 12.195 1.00 14.31 N ATOM 506 CA THR A 278 -0.113 -17.969 12.367 1.00 73.43 C ATOM 507 C THR A 278 0.344 -18.557 11.030 1.00 34.42 C ATOM 508 O THR A 278 -0.480 -18.964 10.212 1.00 15.35 O ATOM 509 CB THR A 278 -1.269 -18.741 13.007 1.00 61.23 C ATOM 510 OG1 THR A 278 -1.806 -17.832 13.963 1.00 54.31 O ATOM 511 CG2 THR A 278 -0.787 -19.925 13.848 1.00 15.02 C ATOM 0 H THR A 278 -0.859 -16.357 11.256 1.00 14.31 H new ATOM 0 HA THR A 278 0.750 -18.039 13.029 1.00 73.43 H new ATOM 0 HB THR A 278 -1.942 -19.099 12.228 1.00 61.23 H new ATOM 0 HG1 THR A 278 -2.516 -17.301 13.546 1.00 54.31 H new ATOM 0 HG21 THR A 278 -1.646 -20.439 14.279 1.00 15.02 H new ATOM 0 HG22 THR A 278 -0.230 -20.617 13.216 1.00 15.02 H new ATOM 0 HG23 THR A 278 -0.141 -19.564 14.648 1.00 15.02 H new ATOM 519 N PHE A 279 1.656 -18.584 10.850 1.00 71.03 N ATOM 520 CA PHE A 279 2.232 -19.116 9.626 1.00 5.54 C ATOM 521 C PHE A 279 1.750 -20.545 9.369 1.00 42.54 C ATOM 522 O PHE A 279 1.247 -21.206 10.275 1.00 73.51 O ATOM 523 CB PHE A 279 3.750 -19.129 9.816 1.00 5.34 C ATOM 524 CG PHE A 279 4.541 -18.895 8.527 1.00 10.54 C ATOM 525 CD1 PHE A 279 4.137 -17.941 7.646 1.00 71.34 C ATOM 526 CD2 PHE A 279 5.648 -19.640 8.264 1.00 53.34 C ATOM 527 CE1 PHE A 279 4.871 -17.724 6.449 1.00 14.14 C ATOM 528 CE2 PHE A 279 6.381 -19.422 7.067 1.00 23.34 C ATOM 529 CZ PHE A 279 5.977 -18.469 6.186 1.00 44.04 C ATOM 0 H PHE A 279 2.337 -18.246 11.531 1.00 71.03 H new ATOM 0 HA PHE A 279 1.933 -18.502 8.776 1.00 5.54 H new ATOM 0 HB2 PHE A 279 4.022 -18.362 10.541 1.00 5.34 H new ATOM 0 HB3 PHE A 279 4.044 -20.088 10.242 1.00 5.34 H new ATOM 0 HD1 PHE A 279 3.259 -17.349 7.856 1.00 71.34 H new ATOM 0 HD2 PHE A 279 5.969 -20.397 8.965 1.00 53.34 H new ATOM 0 HE1 PHE A 279 4.550 -16.967 5.748 1.00 14.14 H new ATOM 0 HE2 PHE A 279 7.260 -20.014 6.857 1.00 23.34 H new ATOM 0 HZ PHE A 279 6.535 -18.304 5.276 1.00 44.04 H new ATOM 539 N GLU A 280 1.921 -20.978 8.128 1.00 22.04 N ATOM 540 CA GLU A 280 1.510 -22.316 7.740 1.00 33.40 C ATOM 541 C GLU A 280 2.319 -22.791 6.531 1.00 11.32 C ATOM 542 O GLU A 280 1.926 -22.562 5.388 1.00 2.43 O ATOM 543 CB GLU A 280 0.009 -22.365 7.448 1.00 34.43 C ATOM 544 CG GLU A 280 -0.404 -23.743 6.926 1.00 63.12 C ATOM 545 CD GLU A 280 -1.888 -24.006 7.186 1.00 74.22 C ATOM 546 OE1 GLU A 280 -2.274 -25.149 7.475 1.00 12.40 O ATOM 547 OE2 GLU A 280 -2.652 -22.972 7.079 1.00 32.12 O ATOM 0 H GLU A 280 2.338 -20.426 7.379 1.00 22.04 H new ATOM 0 HA GLU A 280 1.708 -22.991 8.573 1.00 33.40 H new ATOM 0 HB2 GLU A 280 -0.549 -22.134 8.355 1.00 34.43 H new ATOM 0 HB3 GLU A 280 -0.247 -21.602 6.713 1.00 34.43 H new ATOM 0 HG2 GLU A 280 -0.202 -23.806 5.857 1.00 63.12 H new ATOM 0 HG3 GLU A 280 0.196 -24.514 7.410 1.00 63.12 H new ATOM 555 N PHE A 281 3.434 -23.443 6.825 1.00 70.20 N ATOM 556 CA PHE A 281 4.302 -23.952 5.776 1.00 12.34 C ATOM 557 C PHE A 281 4.429 -25.474 5.860 1.00 24.15 C ATOM 558 O PHE A 281 4.273 -26.055 6.933 1.00 24.42 O ATOM 559 CB PHE A 281 5.680 -23.324 5.993 1.00 40.33 C ATOM 560 CG PHE A 281 6.216 -23.475 7.418 1.00 62.33 C ATOM 561 CD1 PHE A 281 5.734 -22.684 8.413 1.00 33.55 C ATOM 562 CD2 PHE A 281 7.175 -24.401 7.689 1.00 42.35 C ATOM 563 CE1 PHE A 281 6.231 -22.825 9.736 1.00 64.11 C ATOM 564 CE2 PHE A 281 7.673 -24.541 9.011 1.00 31.30 C ATOM 565 CZ PHE A 281 7.190 -23.751 10.007 1.00 44.52 C ATOM 0 H PHE A 281 3.757 -23.631 7.774 1.00 70.20 H new ATOM 0 HA PHE A 281 3.890 -23.702 4.798 1.00 12.34 H new ATOM 0 HB2 PHE A 281 6.388 -23.778 5.300 1.00 40.33 H new ATOM 0 HB3 PHE A 281 5.628 -22.264 5.746 1.00 40.33 H new ATOM 0 HD1 PHE A 281 4.973 -21.948 8.197 1.00 33.55 H new ATOM 0 HD2 PHE A 281 7.557 -25.030 6.898 1.00 42.35 H new ATOM 0 HE1 PHE A 281 5.848 -22.197 10.527 1.00 64.11 H new ATOM 0 HE2 PHE A 281 8.436 -25.275 9.226 1.00 31.30 H new ATOM 0 HZ PHE A 281 7.568 -23.859 11.013 1.00 44.52 H new ATOM 575 N SER A 282 4.712 -26.076 4.715 1.00 72.53 N ATOM 576 CA SER A 282 4.862 -27.520 4.645 1.00 20.12 C ATOM 577 C SER A 282 6.016 -27.882 3.707 1.00 13.45 C ATOM 578 O SER A 282 6.544 -27.020 3.007 1.00 50.25 O ATOM 579 CB SER A 282 3.567 -28.187 4.176 1.00 45.44 C ATOM 580 OG SER A 282 2.799 -27.328 3.337 1.00 70.32 O ATOM 0 H SER A 282 4.842 -25.590 3.827 1.00 72.53 H new ATOM 0 HA SER A 282 5.087 -27.889 5.646 1.00 20.12 H new ATOM 0 HB2 SER A 282 3.806 -29.103 3.636 1.00 45.44 H new ATOM 0 HB3 SER A 282 2.972 -28.474 5.043 1.00 45.44 H new ATOM 0 HG SER A 282 1.981 -27.790 3.057 1.00 70.32 H new ATOM 586 N SER A 283 6.373 -29.157 3.725 1.00 74.41 N ATOM 587 CA SER A 283 7.454 -29.644 2.885 1.00 51.42 C ATOM 588 C SER A 283 7.205 -31.105 2.505 1.00 51.42 C ATOM 589 O SER A 283 6.163 -31.667 2.837 1.00 74.14 O ATOM 590 CB SER A 283 8.805 -29.501 3.589 1.00 72.03 C ATOM 591 OG SER A 283 9.186 -30.699 4.260 1.00 41.11 O ATOM 0 H SER A 283 5.933 -29.869 4.308 1.00 74.41 H new ATOM 0 HA SER A 283 7.481 -29.040 1.978 1.00 51.42 H new ATOM 0 HB2 SER A 283 9.569 -29.236 2.858 1.00 72.03 H new ATOM 0 HB3 SER A 283 8.755 -28.683 4.308 1.00 72.03 H new ATOM 0 HG SER A 283 10.117 -30.625 4.558 1.00 41.11 H new ATOM 660 N VAL A 288 3.058 -30.043 7.474 1.00 34.23 N ATOM 661 CA VAL A 288 2.618 -28.682 7.732 1.00 60.41 C ATOM 662 C VAL A 288 2.816 -28.359 9.214 1.00 30.12 C ATOM 663 O VAL A 288 2.802 -29.256 10.056 1.00 3.10 O ATOM 664 CB VAL A 288 1.171 -28.504 7.269 1.00 13.51 C ATOM 665 CG1 VAL A 288 0.287 -29.644 7.779 1.00 42.20 C ATOM 666 CG2 VAL A 288 0.619 -27.145 7.706 1.00 2.03 C ATOM 0 HA VAL A 288 3.217 -27.972 7.162 1.00 60.41 H new ATOM 0 HB VAL A 288 1.162 -28.535 6.179 1.00 13.51 H new ATOM 0 HG11 VAL A 288 -0.736 -29.493 7.435 1.00 42.20 H new ATOM 0 HG12 VAL A 288 0.661 -30.594 7.397 1.00 42.20 H new ATOM 0 HG13 VAL A 288 0.305 -29.659 8.869 1.00 42.20 H new ATOM 0 HG21 VAL A 288 -0.411 -27.044 7.364 1.00 2.03 H new ATOM 0 HG22 VAL A 288 0.649 -27.072 8.793 1.00 2.03 H new ATOM 0 HG23 VAL A 288 1.225 -26.350 7.272 1.00 2.03 H new ATOM 676 N PHE A 289 2.995 -27.075 9.488 1.00 24.32 N ATOM 677 CA PHE A 289 3.196 -26.623 10.854 1.00 11.43 C ATOM 678 C PHE A 289 2.774 -25.161 11.015 1.00 53.30 C ATOM 679 O PHE A 289 3.126 -24.315 10.194 1.00 73.43 O ATOM 680 CB PHE A 289 4.692 -26.745 11.151 1.00 52.41 C ATOM 681 CG PHE A 289 5.012 -27.084 12.608 1.00 34.31 C ATOM 682 CD1 PHE A 289 4.916 -26.124 13.567 1.00 64.42 C ATOM 683 CD2 PHE A 289 5.391 -28.346 12.945 1.00 70.34 C ATOM 684 CE1 PHE A 289 5.213 -26.440 14.919 1.00 1.32 C ATOM 685 CE2 PHE A 289 5.688 -28.662 14.297 1.00 54.41 C ATOM 686 CZ PHE A 289 5.592 -27.702 15.256 1.00 45.33 C ATOM 0 H PHE A 289 3.005 -26.334 8.787 1.00 24.32 H new ATOM 0 HA PHE A 289 2.596 -27.224 11.537 1.00 11.43 H new ATOM 0 HB2 PHE A 289 5.118 -27.515 10.508 1.00 52.41 H new ATOM 0 HB3 PHE A 289 5.181 -25.806 10.891 1.00 52.41 H new ATOM 0 HD1 PHE A 289 4.614 -25.122 13.300 1.00 64.42 H new ATOM 0 HD2 PHE A 289 5.466 -29.108 12.184 1.00 70.34 H new ATOM 0 HE1 PHE A 289 5.138 -25.678 15.680 1.00 1.32 H new ATOM 0 HE2 PHE A 289 5.990 -29.664 14.564 1.00 54.41 H new ATOM 0 HZ PHE A 289 5.817 -27.942 16.285 1.00 45.33 H new ATOM 696 N SER A 290 2.025 -24.908 12.079 1.00 43.34 N ATOM 697 CA SER A 290 1.551 -23.563 12.357 1.00 5.35 C ATOM 698 C SER A 290 2.254 -23.007 13.598 1.00 70.10 C ATOM 699 O SER A 290 2.176 -23.595 14.676 1.00 60.15 O ATOM 700 CB SER A 290 0.034 -23.543 12.553 1.00 2.21 C ATOM 701 OG SER A 290 -0.398 -24.538 13.477 1.00 1.34 O ATOM 0 H SER A 290 1.735 -25.612 12.758 1.00 43.34 H new ATOM 0 HA SER A 290 1.788 -22.933 11.500 1.00 5.35 H new ATOM 0 HB2 SER A 290 -0.273 -22.560 12.910 1.00 2.21 H new ATOM 0 HB3 SER A 290 -0.458 -23.702 11.593 1.00 2.21 H new ATOM 0 HG SER A 290 0.317 -24.718 14.122 1.00 1.34 H new ATOM 707 N ILE A 291 2.924 -21.881 13.404 1.00 1.35 N ATOM 708 CA ILE A 291 3.640 -21.239 14.494 1.00 31.12 C ATOM 709 C ILE A 291 2.839 -20.031 14.983 1.00 11.22 C ATOM 710 O ILE A 291 2.386 -19.216 14.181 1.00 42.31 O ATOM 711 CB ILE A 291 5.069 -20.898 14.069 1.00 44.03 C ATOM 712 CG1 ILE A 291 5.990 -22.110 14.220 1.00 65.44 C ATOM 713 CG2 ILE A 291 5.594 -19.681 14.834 1.00 34.20 C ATOM 714 CD1 ILE A 291 7.254 -21.947 13.373 1.00 64.51 C ATOM 0 H ILE A 291 2.986 -21.396 12.509 1.00 1.35 H new ATOM 0 HA ILE A 291 3.738 -21.920 15.339 1.00 31.12 H new ATOM 0 HB ILE A 291 5.056 -20.633 13.012 1.00 44.03 H new ATOM 0 HG12 ILE A 291 6.264 -22.235 15.268 1.00 65.44 H new ATOM 0 HG13 ILE A 291 5.460 -23.014 13.919 1.00 65.44 H new ATOM 0 HG21 ILE A 291 6.612 -19.460 14.512 1.00 34.20 H new ATOM 0 HG22 ILE A 291 4.955 -18.821 14.632 1.00 34.20 H new ATOM 0 HG23 ILE A 291 5.589 -19.893 15.903 1.00 34.20 H new ATOM 0 HD11 ILE A 291 7.891 -22.822 13.499 1.00 64.51 H new ATOM 0 HD12 ILE A 291 6.978 -21.847 12.323 1.00 64.51 H new ATOM 0 HD13 ILE A 291 7.794 -21.056 13.693 1.00 64.51 H new ATOM 726 N LYS A 292 2.688 -19.953 16.297 1.00 22.52 N ATOM 727 CA LYS A 292 1.950 -18.858 16.903 1.00 73.43 C ATOM 728 C LYS A 292 2.802 -17.588 16.858 1.00 34.34 C ATOM 729 O LYS A 292 3.762 -17.454 17.615 1.00 62.22 O ATOM 730 CB LYS A 292 1.486 -19.239 18.310 1.00 15.32 C ATOM 731 CG LYS A 292 0.183 -20.040 18.260 1.00 11.22 C ATOM 732 CD LYS A 292 0.387 -21.374 17.539 1.00 10.31 C ATOM 733 CE LYS A 292 -0.538 -22.451 18.108 1.00 71.52 C ATOM 734 NZ LYS A 292 -1.848 -22.426 17.419 1.00 21.41 N ATOM 0 H LYS A 292 3.065 -20.631 16.959 1.00 22.52 H new ATOM 0 HA LYS A 292 1.041 -18.652 16.338 1.00 73.43 H new ATOM 0 HB2 LYS A 292 2.259 -19.826 18.805 1.00 15.32 H new ATOM 0 HB3 LYS A 292 1.340 -18.338 18.905 1.00 15.32 H new ATOM 0 HG2 LYS A 292 -0.176 -20.221 19.273 1.00 11.22 H new ATOM 0 HG3 LYS A 292 -0.585 -19.460 17.749 1.00 11.22 H new ATOM 0 HD2 LYS A 292 0.194 -21.249 16.474 1.00 10.31 H new ATOM 0 HD3 LYS A 292 1.425 -21.691 17.639 1.00 10.31 H new ATOM 0 HE2 LYS A 292 -0.078 -23.432 17.992 1.00 71.52 H new ATOM 0 HE3 LYS A 292 -0.679 -22.290 19.177 1.00 71.52 H new ATOM 0 HZ1 LYS A 292 -2.464 -23.163 17.817 1.00 21.41 H new ATOM 0 HZ2 LYS A 292 -2.292 -21.495 17.551 1.00 21.41 H new ATOM 0 HZ3 LYS A 292 -1.710 -22.602 16.403 1.00 21.41 H new ATOM 747 N MET A 293 2.419 -16.688 15.965 1.00 71.35 N ATOM 748 CA MET A 293 3.136 -15.434 15.812 1.00 53.34 C ATOM 749 C MET A 293 2.767 -14.452 16.926 1.00 54.15 C ATOM 750 O MET A 293 1.627 -14.431 17.387 1.00 33.31 O ATOM 751 CB MET A 293 2.799 -14.815 14.453 1.00 34.24 C ATOM 752 CG MET A 293 3.411 -15.631 13.313 1.00 54.35 C ATOM 753 SD MET A 293 2.770 -15.065 11.746 1.00 51.24 S ATOM 754 CE MET A 293 3.723 -13.569 11.543 1.00 64.53 C ATOM 0 H MET A 293 1.621 -16.802 15.340 1.00 71.35 H new ATOM 0 HA MET A 293 4.205 -15.639 15.873 1.00 53.34 H new ATOM 0 HB2 MET A 293 1.717 -14.766 14.330 1.00 34.24 H new ATOM 0 HB3 MET A 293 3.171 -13.791 14.413 1.00 34.24 H new ATOM 0 HG2 MET A 293 4.497 -15.535 13.328 1.00 54.35 H new ATOM 0 HG3 MET A 293 3.183 -16.688 13.448 1.00 54.35 H new ATOM 0 HE1 MET A 293 3.980 -13.441 10.491 1.00 64.53 H new ATOM 0 HE2 MET A 293 3.135 -12.715 11.879 1.00 64.53 H new ATOM 0 HE3 MET A 293 4.636 -13.636 12.134 1.00 64.53 H new ATOM 764 N GLY A 294 3.752 -13.662 17.325 1.00 24.12 N ATOM 765 CA GLY A 294 3.546 -12.680 18.376 1.00 34.43 C ATOM 766 C GLY A 294 2.346 -11.785 18.062 1.00 52.34 C ATOM 767 O GLY A 294 1.997 -11.594 16.898 1.00 60.34 O ATOM 0 H GLY A 294 4.696 -13.682 16.939 1.00 24.12 H new ATOM 0 HA2 GLY A 294 3.386 -13.188 19.327 1.00 34.43 H new ATOM 0 HA3 GLY A 294 4.441 -12.068 18.488 1.00 34.43 H new ATOM 771 N PRO A 295 1.731 -11.244 19.148 1.00 63.40 N ATOM 772 CA PRO A 295 0.578 -10.373 18.999 1.00 31.33 C ATOM 773 C PRO A 295 0.997 -8.988 18.504 1.00 4.34 C ATOM 774 O PRO A 295 0.238 -8.318 17.806 1.00 42.02 O ATOM 775 CB PRO A 295 -0.071 -10.342 20.373 1.00 11.04 C ATOM 776 CG PRO A 295 0.994 -10.816 21.348 1.00 21.44 C ATOM 777 CD PRO A 295 2.117 -11.448 20.541 1.00 13.24 C ATOM 0 HA PRO A 295 -0.126 -10.732 18.248 1.00 31.33 H new ATOM 0 HB2 PRO A 295 -0.409 -9.336 20.623 1.00 11.04 H new ATOM 0 HB3 PRO A 295 -0.947 -10.990 20.406 1.00 11.04 H new ATOM 0 HG2 PRO A 295 1.371 -9.980 21.937 1.00 21.44 H new ATOM 0 HG3 PRO A 295 0.575 -11.538 22.050 1.00 21.44 H new ATOM 0 HD2 PRO A 295 3.075 -10.977 20.760 1.00 13.24 H new ATOM 0 HD3 PRO A 295 2.223 -12.508 20.772 1.00 13.24 H new ATOM 785 N HIS A 296 2.205 -8.599 18.886 1.00 42.12 N ATOM 786 CA HIS A 296 2.735 -7.305 18.489 1.00 31.24 C ATOM 787 C HIS A 296 2.416 -7.050 17.015 1.00 61.11 C ATOM 788 O HIS A 296 2.439 -7.973 16.202 1.00 34.23 O ATOM 789 CB HIS A 296 4.231 -7.213 18.797 1.00 32.31 C ATOM 790 CG HIS A 296 4.542 -6.868 20.234 1.00 61.31 C ATOM 791 ND1 HIS A 296 5.761 -6.348 20.633 1.00 52.32 N ATOM 792 CD2 HIS A 296 3.781 -6.974 21.361 1.00 50.31 C ATOM 793 CE1 HIS A 296 5.724 -6.154 21.943 1.00 41.52 C ATOM 794 NE2 HIS A 296 4.496 -6.543 22.392 1.00 4.43 N ATOM 0 H HIS A 296 2.832 -9.157 19.466 1.00 42.12 H new ATOM 0 HA HIS A 296 2.255 -6.518 19.070 1.00 31.24 H new ATOM 0 HB2 HIS A 296 4.701 -8.166 18.553 1.00 32.31 H new ATOM 0 HB3 HIS A 296 4.680 -6.461 18.148 1.00 32.31 H new ATOM 0 HD2 HIS A 296 2.768 -7.346 21.406 1.00 50.31 H new ATOM 0 HE1 HIS A 296 6.525 -5.758 22.549 1.00 41.52 H new ATOM 0 HE2 HIS A 296 4.180 -6.508 23.361 1.00 4.43 H new ATOM 802 N GLU A 297 2.126 -5.793 16.714 1.00 4.43 N ATOM 803 CA GLU A 297 1.803 -5.404 15.352 1.00 63.21 C ATOM 804 C GLU A 297 3.064 -4.939 14.619 1.00 34.25 C ATOM 805 O GLU A 297 3.757 -4.035 15.083 1.00 63.31 O ATOM 806 CB GLU A 297 0.726 -4.318 15.332 1.00 33.33 C ATOM 807 CG GLU A 297 1.327 -2.944 15.632 1.00 12.34 C ATOM 808 CD GLU A 297 0.236 -1.938 16.006 1.00 51.15 C ATOM 809 OE1 GLU A 297 -0.958 -2.229 15.840 1.00 12.35 O ATOM 810 OE2 GLU A 297 0.666 -0.820 16.484 1.00 51.42 O ATOM 0 H GLU A 297 2.108 -5.030 17.391 1.00 4.43 H new ATOM 0 HA GLU A 297 1.404 -6.275 14.832 1.00 63.21 H new ATOM 0 HB2 GLU A 297 0.240 -4.301 14.357 1.00 33.33 H new ATOM 0 HB3 GLU A 297 -0.044 -4.551 16.068 1.00 33.33 H new ATOM 0 HG2 GLU A 297 2.045 -3.027 16.448 1.00 12.34 H new ATOM 0 HG3 GLU A 297 1.875 -2.585 14.761 1.00 12.34 H new ATOM 818 N ILE A 298 3.321 -5.578 13.488 1.00 65.12 N ATOM 819 CA ILE A 298 4.486 -5.241 12.687 1.00 61.21 C ATOM 820 C ILE A 298 4.374 -3.790 12.217 1.00 53.34 C ATOM 821 O ILE A 298 5.020 -2.902 12.771 1.00 10.00 O ATOM 822 CB ILE A 298 4.660 -6.246 11.546 1.00 44.41 C ATOM 823 CG1 ILE A 298 4.728 -7.677 12.081 1.00 31.33 C ATOM 824 CG2 ILE A 298 5.879 -5.896 10.689 1.00 12.01 C ATOM 825 CD1 ILE A 298 4.457 -8.692 10.969 1.00 63.13 C ATOM 0 H ILE A 298 2.743 -6.327 13.107 1.00 65.12 H new ATOM 0 HA ILE A 298 5.394 -5.313 13.286 1.00 61.21 H new ATOM 0 HB ILE A 298 3.784 -6.185 10.901 1.00 44.41 H new ATOM 0 HG12 ILE A 298 5.711 -7.861 12.514 1.00 31.33 H new ATOM 0 HG13 ILE A 298 3.998 -7.805 12.881 1.00 31.33 H new ATOM 0 HG21 ILE A 298 5.980 -6.625 9.885 1.00 12.01 H new ATOM 0 HG22 ILE A 298 5.750 -4.901 10.262 1.00 12.01 H new ATOM 0 HG23 ILE A 298 6.776 -5.912 11.308 1.00 12.01 H new ATOM 0 HD11 ILE A 298 4.511 -9.701 11.377 1.00 63.13 H new ATOM 0 HD12 ILE A 298 3.463 -8.521 10.555 1.00 63.13 H new ATOM 0 HD13 ILE A 298 5.203 -8.578 10.182 1.00 63.13 H new ATOM 837 N GLY A 299 3.548 -3.593 11.199 1.00 65.11 N ATOM 838 CA GLY A 299 3.343 -2.264 10.648 1.00 61.43 C ATOM 839 C GLY A 299 4.468 -1.892 9.680 1.00 61.42 C ATOM 840 O GLY A 299 5.342 -2.710 9.394 1.00 54.10 O ATOM 0 H GLY A 299 3.013 -4.331 10.742 1.00 65.11 H new ATOM 0 HA2 GLY A 299 2.385 -2.225 10.130 1.00 61.43 H new ATOM 0 HA3 GLY A 299 3.298 -1.534 11.456 1.00 61.43 H new ATOM 844 N ILE A 300 4.410 -0.658 9.202 1.00 63.01 N ATOM 845 CA ILE A 300 5.413 -0.168 8.272 1.00 4.30 C ATOM 846 C ILE A 300 6.763 -0.074 8.987 1.00 12.00 C ATOM 847 O ILE A 300 6.844 0.436 10.103 1.00 33.15 O ATOM 848 CB ILE A 300 4.960 1.150 7.640 1.00 74.52 C ATOM 849 CG1 ILE A 300 3.459 1.127 7.344 1.00 15.42 C ATOM 850 CG2 ILE A 300 5.785 1.472 6.392 1.00 33.13 C ATOM 851 CD1 ILE A 300 3.022 -0.244 6.824 1.00 3.22 C ATOM 0 H ILE A 300 3.684 0.017 9.441 1.00 63.01 H new ATOM 0 HA ILE A 300 5.537 -0.866 7.444 1.00 4.30 H new ATOM 0 HB ILE A 300 5.136 1.952 8.357 1.00 74.52 H new ATOM 0 HG12 ILE A 300 2.903 1.370 8.249 1.00 15.42 H new ATOM 0 HG13 ILE A 300 3.219 1.893 6.607 1.00 15.42 H new ATOM 0 HG21 ILE A 300 5.443 2.413 5.962 1.00 33.13 H new ATOM 0 HG22 ILE A 300 6.837 1.558 6.664 1.00 33.13 H new ATOM 0 HG23 ILE A 300 5.664 0.674 5.660 1.00 33.13 H new ATOM 0 HD11 ILE A 300 1.951 -0.232 6.622 1.00 3.22 H new ATOM 0 HD12 ILE A 300 3.562 -0.474 5.906 1.00 3.22 H new ATOM 0 HD13 ILE A 300 3.241 -1.004 7.574 1.00 3.22 H new ATOM 863 N LYS A 301 7.789 -0.574 8.314 1.00 11.03 N ATOM 864 CA LYS A 301 9.131 -0.553 8.871 1.00 33.04 C ATOM 865 C LYS A 301 9.238 -1.611 9.971 1.00 22.13 C ATOM 866 O LYS A 301 10.271 -1.724 10.630 1.00 71.42 O ATOM 867 CB LYS A 301 9.495 0.858 9.338 1.00 63.14 C ATOM 868 CG LYS A 301 9.052 1.905 8.314 1.00 10.21 C ATOM 869 CD LYS A 301 9.889 1.812 7.037 1.00 72.04 C ATOM 870 CE LYS A 301 10.364 3.196 6.590 1.00 1.13 C ATOM 871 NZ LYS A 301 9.263 3.935 5.933 1.00 61.03 N ATOM 0 H LYS A 301 7.718 -0.996 7.388 1.00 11.03 H new ATOM 0 HA LYS A 301 9.865 -0.811 8.107 1.00 33.04 H new ATOM 0 HB2 LYS A 301 9.022 1.061 10.299 1.00 63.14 H new ATOM 0 HB3 LYS A 301 10.572 0.928 9.492 1.00 63.14 H new ATOM 0 HG2 LYS A 301 7.999 1.761 8.074 1.00 10.21 H new ATOM 0 HG3 LYS A 301 9.147 2.902 8.744 1.00 10.21 H new ATOM 0 HD2 LYS A 301 10.750 1.166 7.209 1.00 72.04 H new ATOM 0 HD3 LYS A 301 9.299 1.353 6.244 1.00 72.04 H new ATOM 0 HE2 LYS A 301 10.725 3.759 7.451 1.00 1.13 H new ATOM 0 HE3 LYS A 301 11.203 3.094 5.902 1.00 1.13 H new ATOM 0 HZ1 LYS A 301 9.603 4.872 5.636 1.00 61.03 H new ATOM 0 HZ2 LYS A 301 8.938 3.405 5.100 1.00 61.03 H new ATOM 0 HZ3 LYS A 301 8.474 4.049 6.601 1.00 61.03 H new ATOM 884 N GLY A 302 8.157 -2.359 10.136 1.00 21.22 N ATOM 885 CA GLY A 302 8.117 -3.404 11.145 1.00 71.20 C ATOM 886 C GLY A 302 8.527 -4.754 10.553 1.00 72.13 C ATOM 887 O GLY A 302 8.256 -5.032 9.385 1.00 2.24 O ATOM 0 H GLY A 302 7.302 -2.262 9.588 1.00 21.22 H new ATOM 0 HA2 GLY A 302 8.784 -3.146 11.968 1.00 71.20 H new ATOM 0 HA3 GLY A 302 7.112 -3.475 11.560 1.00 71.20 H new ATOM 891 N GLN A 303 9.173 -5.558 11.385 1.00 50.52 N ATOM 892 CA GLN A 303 9.623 -6.872 10.958 1.00 11.42 C ATOM 893 C GLN A 303 8.863 -7.964 11.713 1.00 53.00 C ATOM 894 O GLN A 303 7.958 -7.670 12.493 1.00 50.13 O ATOM 895 CB GLN A 303 11.133 -7.023 11.149 1.00 3.24 C ATOM 896 CG GLN A 303 11.466 -7.430 12.586 1.00 1.13 C ATOM 897 CD GLN A 303 12.851 -6.923 12.993 1.00 65.43 C ATOM 898 OE1 GLN A 303 13.005 -5.873 13.594 1.00 21.12 O ATOM 899 NE2 GLN A 303 13.848 -7.727 12.632 1.00 44.51 N ATOM 0 H GLN A 303 9.395 -5.325 12.353 1.00 50.52 H new ATOM 0 HA GLN A 303 9.412 -6.979 9.894 1.00 11.42 H new ATOM 0 HB2 GLN A 303 11.518 -7.772 10.457 1.00 3.24 H new ATOM 0 HB3 GLN A 303 11.629 -6.083 10.909 1.00 3.24 H new ATOM 0 HG2 GLN A 303 10.714 -7.028 13.265 1.00 1.13 H new ATOM 0 HG3 GLN A 303 11.431 -8.516 12.678 1.00 1.13 H new ATOM 0 HE21 GLN A 303 13.649 -8.592 12.130 1.00 44.51 H new ATOM 0 HE22 GLN A 303 14.811 -7.478 12.857 1.00 44.51 H new ATOM 908 N LYS A 304 9.258 -9.202 11.455 1.00 51.13 N ATOM 909 CA LYS A 304 8.625 -10.340 12.100 1.00 0.40 C ATOM 910 C LYS A 304 9.661 -11.448 12.301 1.00 53.24 C ATOM 911 O LYS A 304 10.719 -11.434 11.673 1.00 33.45 O ATOM 912 CB LYS A 304 7.392 -10.785 11.311 1.00 22.43 C ATOM 913 CG LYS A 304 6.519 -11.727 12.144 1.00 45.11 C ATOM 914 CD LYS A 304 6.154 -11.092 13.487 1.00 4.40 C ATOM 915 CE LYS A 304 4.949 -11.793 14.116 1.00 60.32 C ATOM 916 NZ LYS A 304 4.574 -11.138 15.389 1.00 60.40 N ATOM 0 H LYS A 304 10.009 -9.442 10.808 1.00 51.13 H new ATOM 0 HA LYS A 304 8.259 -10.063 13.089 1.00 0.40 H new ATOM 0 HB2 LYS A 304 6.811 -9.912 11.014 1.00 22.43 H new ATOM 0 HB3 LYS A 304 7.704 -11.287 10.395 1.00 22.43 H new ATOM 0 HG2 LYS A 304 5.610 -11.969 11.593 1.00 45.11 H new ATOM 0 HG3 LYS A 304 7.048 -12.665 12.313 1.00 45.11 H new ATOM 0 HD2 LYS A 304 7.006 -11.149 14.164 1.00 4.40 H new ATOM 0 HD3 LYS A 304 5.930 -10.035 13.344 1.00 4.40 H new ATOM 0 HE2 LYS A 304 4.106 -11.769 13.426 1.00 60.32 H new ATOM 0 HE3 LYS A 304 5.184 -12.842 14.296 1.00 60.32 H new ATOM 0 HZ1 LYS A 304 3.653 -11.500 15.708 1.00 60.40 H new ATOM 0 HZ2 LYS A 304 5.295 -11.343 16.110 1.00 60.40 H new ATOM 0 HZ3 LYS A 304 4.511 -10.110 15.245 1.00 60.40 H new ATOM 929 N GLU A 305 9.320 -12.381 13.177 1.00 13.23 N ATOM 930 CA GLU A 305 10.207 -13.494 13.468 1.00 32.24 C ATOM 931 C GLU A 305 9.417 -14.804 13.517 1.00 12.43 C ATOM 932 O GLU A 305 8.517 -14.960 14.342 1.00 44.42 O ATOM 933 CB GLU A 305 10.966 -13.263 14.776 1.00 0.14 C ATOM 934 CG GLU A 305 12.277 -12.515 14.525 1.00 54.44 C ATOM 935 CD GLU A 305 12.738 -11.777 15.784 1.00 73.53 C ATOM 936 OE1 GLU A 305 12.811 -10.540 15.786 1.00 51.44 O ATOM 937 OE2 GLU A 305 13.025 -12.537 16.786 1.00 74.20 O ATOM 0 H GLU A 305 8.441 -12.389 13.695 1.00 13.23 H new ATOM 0 HA GLU A 305 10.943 -13.565 12.667 1.00 32.24 H new ATOM 0 HB2 GLU A 305 10.344 -12.692 15.466 1.00 0.14 H new ATOM 0 HB3 GLU A 305 11.175 -14.220 15.253 1.00 0.14 H new ATOM 0 HG2 GLU A 305 13.047 -13.219 14.210 1.00 54.44 H new ATOM 0 HG3 GLU A 305 12.143 -11.803 13.710 1.00 54.44 H new ATOM 945 N LEU A 306 9.781 -15.711 12.624 1.00 64.32 N ATOM 946 CA LEU A 306 9.118 -17.002 12.555 1.00 71.14 C ATOM 947 C LEU A 306 10.169 -18.113 12.592 1.00 72.52 C ATOM 948 O LEU A 306 10.209 -18.965 11.705 1.00 51.32 O ATOM 949 CB LEU A 306 8.197 -17.067 11.334 1.00 4.22 C ATOM 950 CG LEU A 306 6.807 -16.453 11.510 1.00 72.03 C ATOM 951 CD1 LEU A 306 6.091 -16.323 10.164 1.00 43.42 C ATOM 952 CD2 LEU A 306 5.981 -17.247 12.523 1.00 32.44 C ATOM 0 H LEU A 306 10.527 -15.578 11.941 1.00 64.32 H new ATOM 0 HA LEU A 306 8.472 -17.145 13.421 1.00 71.14 H new ATOM 0 HB2 LEU A 306 8.692 -16.565 10.503 1.00 4.22 H new ATOM 0 HB3 LEU A 306 8.077 -18.112 11.049 1.00 4.22 H new ATOM 0 HG LEU A 306 6.927 -15.446 11.910 1.00 72.03 H new ATOM 0 HD11 LEU A 306 5.105 -15.884 10.317 1.00 43.42 H new ATOM 0 HD12 LEU A 306 6.674 -15.683 9.502 1.00 43.42 H new ATOM 0 HD13 LEU A 306 5.983 -17.309 9.713 1.00 43.42 H new ATOM 0 HD21 LEU A 306 4.998 -16.789 12.629 1.00 32.44 H new ATOM 0 HD22 LEU A 306 5.868 -18.274 12.175 1.00 32.44 H new ATOM 0 HD23 LEU A 306 6.488 -17.245 13.488 1.00 32.44 H new ATOM 964 N TRP A 307 10.994 -18.070 13.628 1.00 51.55 N ATOM 965 CA TRP A 307 12.042 -19.062 13.792 1.00 62.20 C ATOM 966 C TRP A 307 11.376 -20.412 14.069 1.00 43.42 C ATOM 967 O TRP A 307 10.578 -20.535 14.996 1.00 74.20 O ATOM 968 CB TRP A 307 13.025 -18.645 14.887 1.00 4.23 C ATOM 969 CG TRP A 307 12.488 -18.826 16.308 1.00 31.32 C ATOM 970 CD1 TRP A 307 12.341 -19.967 16.995 1.00 32.43 C ATOM 971 CD2 TRP A 307 12.029 -17.783 17.194 1.00 61.03 C ATOM 972 NE1 TRP A 307 11.823 -19.737 18.254 1.00 51.04 N ATOM 973 CE2 TRP A 307 11.628 -18.366 18.378 1.00 35.40 C ATOM 974 CE3 TRP A 307 11.956 -16.392 17.000 1.00 22.33 C ATOM 975 CZ2 TRP A 307 11.125 -17.635 19.461 1.00 72.21 C ATOM 976 CZ3 TRP A 307 11.451 -15.676 18.092 1.00 5.30 C ATOM 977 CH2 TRP A 307 11.043 -16.248 19.291 1.00 72.00 C ATOM 0 H TRP A 307 10.957 -17.363 14.362 1.00 51.55 H new ATOM 0 HA TRP A 307 12.638 -19.147 12.883 1.00 62.20 H new ATOM 0 HB2 TRP A 307 13.941 -19.226 14.779 1.00 4.23 H new ATOM 0 HB3 TRP A 307 13.292 -17.598 14.741 1.00 4.23 H new ATOM 0 HD1 TRP A 307 12.596 -20.944 16.612 1.00 32.43 H new ATOM 0 HE1 TRP A 307 11.621 -20.443 18.962 1.00 51.04 H new ATOM 0 HE3 TRP A 307 12.265 -15.914 16.082 1.00 22.33 H new ATOM 0 HZ2 TRP A 307 10.817 -18.115 20.378 1.00 72.21 H new ATOM 0 HZ3 TRP A 307 11.373 -14.603 17.996 1.00 5.30 H new ATOM 0 HH2 TRP A 307 10.664 -15.625 20.088 1.00 72.00 H new ATOM 988 N PHE A 308 11.730 -21.389 13.248 1.00 71.35 N ATOM 989 CA PHE A 308 11.177 -22.725 13.392 1.00 34.12 C ATOM 990 C PHE A 308 12.287 -23.763 13.567 1.00 43.21 C ATOM 991 O PHE A 308 13.468 -23.439 13.447 1.00 21.54 O ATOM 992 CB PHE A 308 10.406 -23.032 12.107 1.00 41.35 C ATOM 993 CG PHE A 308 9.634 -24.352 12.144 1.00 62.35 C ATOM 994 CD1 PHE A 308 8.788 -24.617 13.175 1.00 42.21 C ATOM 995 CD2 PHE A 308 9.794 -25.262 11.145 1.00 43.31 C ATOM 996 CE1 PHE A 308 8.072 -25.842 13.209 1.00 32.32 C ATOM 997 CE2 PHE A 308 9.078 -26.487 11.179 1.00 30.23 C ATOM 998 CZ PHE A 308 8.232 -26.752 12.211 1.00 52.34 C ATOM 0 H PHE A 308 12.393 -21.282 12.480 1.00 71.35 H new ATOM 0 HA PHE A 308 10.535 -22.768 14.272 1.00 34.12 H new ATOM 0 HB2 PHE A 308 9.706 -22.219 11.913 1.00 41.35 H new ATOM 0 HB3 PHE A 308 11.107 -23.056 11.272 1.00 41.35 H new ATOM 0 HD1 PHE A 308 8.661 -23.895 13.968 1.00 42.21 H new ATOM 0 HD2 PHE A 308 10.466 -25.052 10.326 1.00 43.31 H new ATOM 0 HE1 PHE A 308 7.400 -26.052 14.028 1.00 32.32 H new ATOM 0 HE2 PHE A 308 9.205 -27.209 10.386 1.00 30.23 H new ATOM 0 HZ PHE A 308 7.688 -27.684 12.238 1.00 52.34 H new ATOM 1008 N PHE A 309 11.870 -24.988 13.847 1.00 75.51 N ATOM 1009 CA PHE A 309 12.814 -26.076 14.039 1.00 3.42 C ATOM 1010 C PHE A 309 12.198 -27.416 13.634 1.00 33.02 C ATOM 1011 O PHE A 309 10.978 -27.537 13.534 1.00 32.31 O ATOM 1012 CB PHE A 309 13.154 -26.114 15.530 1.00 4.14 C ATOM 1013 CG PHE A 309 12.012 -25.658 16.441 1.00 24.50 C ATOM 1014 CD1 PHE A 309 11.700 -24.338 16.531 1.00 1.15 C ATOM 1015 CD2 PHE A 309 11.309 -26.574 17.160 1.00 64.30 C ATOM 1016 CE1 PHE A 309 10.640 -23.915 17.377 1.00 61.24 C ATOM 1017 CE2 PHE A 309 10.249 -26.152 18.005 1.00 5.50 C ATOM 1018 CZ PHE A 309 9.937 -24.831 18.096 1.00 42.05 C ATOM 0 H PHE A 309 10.890 -25.252 13.946 1.00 75.51 H new ATOM 0 HA PHE A 309 13.699 -25.914 13.423 1.00 3.42 H new ATOM 0 HB2 PHE A 309 13.438 -27.131 15.802 1.00 4.14 H new ATOM 0 HB3 PHE A 309 14.023 -25.482 15.710 1.00 4.14 H new ATOM 0 HD1 PHE A 309 12.258 -23.611 15.959 1.00 1.15 H new ATOM 0 HD2 PHE A 309 11.557 -27.623 17.088 1.00 64.30 H new ATOM 0 HE1 PHE A 309 10.392 -22.866 17.449 1.00 61.24 H new ATOM 0 HE2 PHE A 309 9.691 -26.879 18.575 1.00 5.50 H new ATOM 0 HZ PHE A 309 9.131 -24.510 18.739 1.00 42.05 H new ATOM 1028 N PRO A 310 13.092 -28.415 13.406 1.00 3.32 N ATOM 1029 CA PRO A 310 14.520 -28.187 13.547 1.00 4.21 C ATOM 1030 C PRO A 310 15.066 -27.381 12.366 1.00 23.24 C ATOM 1031 O PRO A 310 15.864 -26.463 12.552 1.00 33.34 O ATOM 1032 CB PRO A 310 15.132 -29.574 13.653 1.00 73.42 C ATOM 1033 CG PRO A 310 14.088 -30.533 13.103 1.00 14.32 C ATOM 1034 CD PRO A 310 12.769 -29.782 13.010 1.00 63.13 C ATOM 0 HA PRO A 310 14.766 -27.590 14.425 1.00 4.21 H new ATOM 0 HB2 PRO A 310 16.059 -29.637 13.083 1.00 73.42 H new ATOM 0 HB3 PRO A 310 15.377 -29.815 14.687 1.00 73.42 H new ATOM 0 HG2 PRO A 310 14.387 -30.902 12.122 1.00 14.32 H new ATOM 0 HG3 PRO A 310 13.988 -31.402 13.753 1.00 14.32 H new ATOM 0 HD2 PRO A 310 12.364 -29.816 11.998 1.00 63.13 H new ATOM 0 HD3 PRO A 310 12.018 -30.218 13.669 1.00 63.13 H new ATOM 1042 N SER A 311 14.615 -27.754 11.178 1.00 52.11 N ATOM 1043 CA SER A 311 15.048 -27.077 9.967 1.00 31.40 C ATOM 1044 C SER A 311 14.383 -27.715 8.745 1.00 2.12 C ATOM 1045 O SER A 311 13.942 -28.862 8.802 1.00 42.34 O ATOM 1046 CB SER A 311 16.571 -27.121 9.826 1.00 33.32 C ATOM 1047 OG SER A 311 17.105 -28.388 10.201 1.00 21.11 O ATOM 0 H SER A 311 13.954 -28.516 11.028 1.00 52.11 H new ATOM 0 HA SER A 311 14.746 -26.032 10.033 1.00 31.40 H new ATOM 0 HB2 SER A 311 16.846 -26.903 8.794 1.00 33.32 H new ATOM 0 HB3 SER A 311 17.015 -26.342 10.446 1.00 33.32 H new ATOM 0 HG SER A 311 18.079 -28.377 10.096 1.00 21.11 H new ATOM 1053 N LEU A 312 14.332 -26.943 7.669 1.00 24.43 N ATOM 1054 CA LEU A 312 13.729 -27.418 6.436 1.00 70.33 C ATOM 1055 C LEU A 312 14.629 -27.046 5.256 1.00 3.52 C ATOM 1056 O LEU A 312 15.447 -26.133 5.359 1.00 2.31 O ATOM 1057 CB LEU A 312 12.296 -26.897 6.305 1.00 64.23 C ATOM 1058 CG LEU A 312 11.279 -27.478 7.289 1.00 52.13 C ATOM 1059 CD1 LEU A 312 10.768 -26.402 8.249 1.00 43.55 C ATOM 1060 CD2 LEU A 312 10.135 -28.174 6.548 1.00 64.22 C ATOM 0 H LEU A 312 14.698 -25.992 7.626 1.00 24.43 H new ATOM 0 HA LEU A 312 13.649 -28.505 6.445 1.00 70.33 H new ATOM 0 HB2 LEU A 312 12.312 -25.814 6.427 1.00 64.23 H new ATOM 0 HB3 LEU A 312 11.948 -27.099 5.292 1.00 64.23 H new ATOM 0 HG LEU A 312 11.781 -28.235 7.891 1.00 52.13 H new ATOM 0 HD11 LEU A 312 10.047 -26.842 8.938 1.00 43.55 H new ATOM 0 HD12 LEU A 312 11.605 -25.991 8.814 1.00 43.55 H new ATOM 0 HD13 LEU A 312 10.288 -25.605 7.681 1.00 43.55 H new ATOM 0 HD21 LEU A 312 9.426 -28.578 7.271 1.00 64.22 H new ATOM 0 HD22 LEU A 312 9.627 -27.455 5.905 1.00 64.22 H new ATOM 0 HD23 LEU A 312 10.536 -28.985 5.940 1.00 64.22 H new ATOM 1072 N PRO A 313 14.443 -27.790 4.133 1.00 25.35 N ATOM 1073 CA PRO A 313 15.229 -27.547 2.936 1.00 62.33 C ATOM 1074 C PRO A 313 14.756 -26.282 2.217 1.00 71.44 C ATOM 1075 O PRO A 313 13.584 -25.918 2.301 1.00 42.31 O ATOM 1076 CB PRO A 313 15.066 -28.804 2.096 1.00 31.04 C ATOM 1077 CG PRO A 313 13.831 -29.508 2.635 1.00 10.44 C ATOM 1078 CD PRO A 313 13.484 -28.879 3.975 1.00 21.42 C ATOM 0 HA PRO A 313 16.281 -27.363 3.154 1.00 62.33 H new ATOM 0 HB2 PRO A 313 14.945 -28.556 1.041 1.00 31.04 H new ATOM 0 HB3 PRO A 313 15.945 -29.443 2.175 1.00 31.04 H new ATOM 0 HG2 PRO A 313 12.999 -29.406 1.938 1.00 10.44 H new ATOM 0 HG3 PRO A 313 14.020 -30.575 2.752 1.00 10.44 H new ATOM 0 HD2 PRO A 313 12.459 -28.508 3.985 1.00 21.42 H new ATOM 0 HD3 PRO A 313 13.569 -29.602 4.786 1.00 21.42 H new ATOM 1086 N THR A 314 15.691 -25.648 1.526 1.00 65.05 N ATOM 1087 CA THR A 314 15.385 -24.432 0.792 1.00 12.31 C ATOM 1088 C THR A 314 15.995 -24.486 -0.610 1.00 31.12 C ATOM 1089 O THR A 314 16.904 -25.274 -0.865 1.00 31.40 O ATOM 1090 CB THR A 314 15.874 -23.243 1.622 1.00 31.10 C ATOM 1091 OG1 THR A 314 16.998 -23.755 2.333 1.00 71.13 O ATOM 1092 CG2 THR A 314 14.885 -22.850 2.722 1.00 62.34 C ATOM 0 H THR A 314 16.662 -25.954 1.459 1.00 65.05 H new ATOM 0 HA THR A 314 14.311 -24.322 0.640 1.00 12.31 H new ATOM 0 HB THR A 314 16.046 -22.389 0.967 1.00 31.10 H new ATOM 0 HG1 THR A 314 17.673 -23.051 2.429 1.00 71.13 H new ATOM 0 HG21 THR A 314 15.280 -22.002 3.281 1.00 62.34 H new ATOM 0 HG22 THR A 314 13.931 -22.575 2.272 1.00 62.34 H new ATOM 0 HG23 THR A 314 14.738 -23.693 3.398 1.00 62.34 H new ATOM 1100 N PRO A 315 15.457 -23.615 -1.505 1.00 75.41 N ATOM 1101 CA PRO A 315 14.382 -22.716 -1.121 1.00 3.31 C ATOM 1102 C PRO A 315 13.055 -23.467 -1.000 1.00 53.34 C ATOM 1103 O PRO A 315 13.003 -24.679 -1.201 1.00 72.12 O ATOM 1104 CB PRO A 315 14.363 -21.644 -2.198 1.00 53.33 C ATOM 1105 CG PRO A 315 15.110 -22.231 -3.385 1.00 35.44 C ATOM 1106 CD PRO A 315 15.855 -23.465 -2.902 1.00 14.03 C ATOM 0 HA PRO A 315 14.536 -22.271 -0.138 1.00 3.31 H new ATOM 0 HB2 PRO A 315 13.341 -21.383 -2.471 1.00 53.33 H new ATOM 0 HB3 PRO A 315 14.843 -20.730 -1.848 1.00 53.33 H new ATOM 0 HG2 PRO A 315 14.414 -22.493 -4.182 1.00 35.44 H new ATOM 0 HG3 PRO A 315 15.807 -21.501 -3.797 1.00 35.44 H new ATOM 0 HD2 PRO A 315 15.586 -24.344 -3.487 1.00 14.03 H new ATOM 0 HD3 PRO A 315 16.934 -23.338 -2.995 1.00 14.03 H new ATOM 1114 N LEU A 316 12.014 -22.715 -0.673 1.00 51.13 N ATOM 1115 CA LEU A 316 10.690 -23.294 -0.524 1.00 33.32 C ATOM 1116 C LEU A 316 9.866 -23.003 -1.780 1.00 33.14 C ATOM 1117 O LEU A 316 8.794 -22.404 -1.698 1.00 64.34 O ATOM 1118 CB LEU A 316 10.034 -22.805 0.769 1.00 32.42 C ATOM 1119 CG LEU A 316 10.805 -23.086 2.060 1.00 22.33 C ATOM 1120 CD1 LEU A 316 10.755 -21.881 3.002 1.00 65.52 C ATOM 1121 CD2 LEU A 316 10.298 -24.362 2.735 1.00 23.52 C ATOM 0 H LEU A 316 12.061 -21.710 -0.507 1.00 51.13 H new ATOM 0 HA LEU A 316 10.757 -24.378 -0.430 1.00 33.32 H new ATOM 0 HB2 LEU A 316 9.878 -21.729 0.689 1.00 32.42 H new ATOM 0 HB3 LEU A 316 9.049 -23.265 0.850 1.00 32.42 H new ATOM 0 HG LEU A 316 11.851 -23.251 1.803 1.00 22.33 H new ATOM 0 HD11 LEU A 316 11.311 -22.107 3.912 1.00 65.52 H new ATOM 0 HD12 LEU A 316 11.200 -21.016 2.510 1.00 65.52 H new ATOM 0 HD13 LEU A 316 9.718 -21.660 3.256 1.00 65.52 H new ATOM 0 HD21 LEU A 316 10.863 -24.539 3.650 1.00 23.52 H new ATOM 0 HD22 LEU A 316 9.241 -24.250 2.977 1.00 23.52 H new ATOM 0 HD23 LEU A 316 10.428 -25.207 2.059 1.00 23.52 H new ATOM 1133 N SER A 317 10.397 -23.441 -2.912 1.00 10.52 N ATOM 1134 CA SER A 317 9.724 -23.234 -4.183 1.00 60.40 C ATOM 1135 C SER A 317 8.640 -24.296 -4.380 1.00 21.25 C ATOM 1136 O SER A 317 8.908 -25.491 -4.263 1.00 0.00 O ATOM 1137 CB SER A 317 10.719 -23.270 -5.345 1.00 32.01 C ATOM 1138 OG SER A 317 10.947 -24.597 -5.812 1.00 3.05 O ATOM 0 H SER A 317 11.285 -23.938 -2.976 1.00 10.52 H new ATOM 0 HA SER A 317 9.260 -22.248 -4.168 1.00 60.40 H new ATOM 0 HB2 SER A 317 10.342 -22.657 -6.164 1.00 32.01 H new ATOM 0 HB3 SER A 317 11.664 -22.830 -5.027 1.00 32.01 H new ATOM 0 HG SER A 317 11.586 -24.577 -6.555 1.00 3.05 H new ATOM 1144 N ASN A 318 7.439 -23.822 -4.674 1.00 53.24 N ATOM 1145 CA ASN A 318 6.313 -24.715 -4.888 1.00 60.42 C ATOM 1146 C ASN A 318 5.744 -25.145 -3.534 1.00 62.04 C ATOM 1147 O ASN A 318 5.107 -26.192 -3.429 1.00 2.02 O ATOM 1148 CB ASN A 318 6.745 -25.975 -5.641 1.00 23.43 C ATOM 1149 CG ASN A 318 5.566 -26.598 -6.390 1.00 73.30 C ATOM 1150 OD1 ASN A 318 4.830 -25.936 -7.104 1.00 5.14 O ATOM 1151 ND2 ASN A 318 5.427 -27.906 -6.189 1.00 13.41 N ATOM 0 H ASN A 318 7.221 -22.830 -4.769 1.00 53.24 H new ATOM 0 HA ASN A 318 5.566 -24.181 -5.476 1.00 60.42 H new ATOM 0 HB2 ASN A 318 7.538 -25.727 -6.346 1.00 23.43 H new ATOM 0 HB3 ASN A 318 7.158 -26.699 -4.939 1.00 23.43 H new ATOM 0 HD21 ASN A 318 4.669 -28.414 -6.645 1.00 13.41 H new ATOM 0 HD22 ASN A 318 6.078 -28.400 -5.579 1.00 13.41 H new ATOM 1158 N TYR A 319 5.995 -24.315 -2.533 1.00 13.31 N ATOM 1159 CA TYR A 319 5.515 -24.596 -1.190 1.00 44.42 C ATOM 1160 C TYR A 319 4.276 -23.760 -0.865 1.00 34.24 C ATOM 1161 O TYR A 319 3.853 -22.931 -1.669 1.00 12.14 O ATOM 1162 CB TYR A 319 6.649 -24.193 -0.245 1.00 63.40 C ATOM 1163 CG TYR A 319 7.749 -25.248 -0.109 1.00 3.03 C ATOM 1164 CD1 TYR A 319 8.395 -25.721 -1.233 1.00 45.51 C ATOM 1165 CD2 TYR A 319 8.096 -25.727 1.138 1.00 14.24 C ATOM 1166 CE1 TYR A 319 9.431 -26.713 -1.105 1.00 32.11 C ATOM 1167 CE2 TYR A 319 9.131 -26.719 1.267 1.00 71.33 C ATOM 1168 CZ TYR A 319 9.747 -27.163 0.139 1.00 65.53 C ATOM 1169 OH TYR A 319 10.725 -28.101 0.260 1.00 43.12 O ATOM 0 H TYR A 319 6.524 -23.448 -2.624 1.00 13.31 H new ATOM 0 HA TYR A 319 5.241 -25.647 -1.092 1.00 44.42 H new ATOM 0 HB2 TYR A 319 7.093 -23.264 -0.602 1.00 63.40 H new ATOM 0 HB3 TYR A 319 6.232 -23.989 0.741 1.00 63.40 H new ATOM 0 HD1 TYR A 319 8.123 -25.347 -2.209 1.00 45.51 H new ATOM 0 HD2 TYR A 319 7.590 -25.357 2.018 1.00 14.24 H new ATOM 0 HE1 TYR A 319 9.945 -27.091 -1.976 1.00 32.11 H new ATOM 0 HE2 TYR A 319 9.412 -27.102 2.237 1.00 71.33 H new ATOM 0 HH TYR A 319 10.845 -28.328 1.206 1.00 43.12 H new ATOM 1179 N THR A 320 3.728 -24.008 0.316 1.00 11.21 N ATOM 1180 CA THR A 320 2.545 -23.289 0.758 1.00 50.21 C ATOM 1181 C THR A 320 2.943 -22.065 1.585 1.00 11.03 C ATOM 1182 O THR A 320 2.596 -20.937 1.238 1.00 22.02 O ATOM 1183 CB THR A 320 1.651 -24.271 1.517 1.00 32.01 C ATOM 1184 OG1 THR A 320 0.870 -24.889 0.498 1.00 52.32 O ATOM 1185 CG2 THR A 320 0.620 -23.563 2.399 1.00 71.22 C ATOM 0 H THR A 320 4.081 -24.697 0.980 1.00 11.21 H new ATOM 0 HA THR A 320 1.979 -22.900 -0.088 1.00 50.21 H new ATOM 0 HB THR A 320 2.270 -24.923 2.134 1.00 32.01 H new ATOM 0 HG1 THR A 320 0.263 -25.543 0.903 1.00 52.32 H new ATOM 0 HG21 THR A 320 0.012 -24.306 2.915 1.00 71.22 H new ATOM 0 HG22 THR A 320 1.134 -22.942 3.132 1.00 71.22 H new ATOM 0 HG23 THR A 320 -0.021 -22.937 1.778 1.00 71.22 H new ATOM 1193 N MET A 321 3.665 -22.329 2.664 1.00 22.31 N ATOM 1194 CA MET A 321 4.114 -21.263 3.544 1.00 61.52 C ATOM 1195 C MET A 321 3.150 -20.076 3.503 1.00 42.04 C ATOM 1196 O MET A 321 3.536 -18.972 3.122 1.00 11.30 O ATOM 1197 CB MET A 321 5.510 -20.803 3.118 1.00 73.42 C ATOM 1198 CG MET A 321 5.661 -20.849 1.596 1.00 41.20 C ATOM 1199 SD MET A 321 6.995 -19.779 1.083 1.00 32.00 S ATOM 1200 CE MET A 321 8.294 -20.367 2.156 1.00 22.22 C ATOM 0 H MET A 321 3.950 -23.266 2.949 1.00 22.31 H new ATOM 0 HA MET A 321 4.144 -21.647 4.564 1.00 61.52 H new ATOM 0 HB2 MET A 321 5.687 -19.788 3.474 1.00 73.42 H new ATOM 0 HB3 MET A 321 6.264 -21.439 3.581 1.00 73.42 H new ATOM 0 HG2 MET A 321 5.858 -21.871 1.272 1.00 41.20 H new ATOM 0 HG3 MET A 321 4.731 -20.538 1.120 1.00 41.20 H new ATOM 0 HE1 MET A 321 9.263 -20.125 1.720 1.00 22.22 H new ATOM 0 HE2 MET A 321 8.205 -19.889 3.131 1.00 22.22 H new ATOM 0 HE3 MET A 321 8.208 -21.447 2.273 1.00 22.22 H new ATOM 1210 N LYS A 322 1.915 -20.344 3.900 1.00 52.53 N ATOM 1211 CA LYS A 322 0.893 -19.311 3.913 1.00 53.21 C ATOM 1212 C LYS A 322 0.877 -18.632 5.284 1.00 30.53 C ATOM 1213 O LYS A 322 1.645 -19.001 6.172 1.00 40.43 O ATOM 1214 CB LYS A 322 -0.461 -19.891 3.498 1.00 22.23 C ATOM 1215 CG LYS A 322 -0.410 -20.435 2.069 1.00 24.21 C ATOM 1216 CD LYS A 322 -1.764 -21.012 1.653 1.00 13.01 C ATOM 1217 CE LYS A 322 -1.756 -21.423 0.179 1.00 1.33 C ATOM 1218 NZ LYS A 322 -0.407 -21.878 -0.224 1.00 62.41 N ATOM 0 H LYS A 322 1.599 -21.261 4.215 1.00 52.53 H new ATOM 0 HA LYS A 322 1.122 -18.540 3.178 1.00 53.21 H new ATOM 0 HB2 LYS A 322 -0.745 -20.689 4.185 1.00 22.23 H new ATOM 0 HB3 LYS A 322 -1.228 -19.120 3.570 1.00 22.23 H new ATOM 0 HG2 LYS A 322 -0.124 -19.638 1.383 1.00 24.21 H new ATOM 0 HG3 LYS A 322 0.356 -21.207 1.997 1.00 24.21 H new ATOM 0 HD2 LYS A 322 -2.001 -21.876 2.274 1.00 13.01 H new ATOM 0 HD3 LYS A 322 -2.546 -20.272 1.824 1.00 13.01 H new ATOM 0 HE2 LYS A 322 -2.480 -22.221 0.014 1.00 1.33 H new ATOM 0 HE3 LYS A 322 -2.063 -20.581 -0.441 1.00 1.33 H new ATOM 0 HZ1 LYS A 322 -0.383 -22.024 -1.253 1.00 62.41 H new ATOM 0 HZ2 LYS A 322 0.296 -21.158 0.040 1.00 62.41 H new ATOM 0 HZ3 LYS A 322 -0.184 -22.772 0.258 1.00 62.41 H new ATOM 1231 N VAL A 323 -0.006 -17.654 5.415 1.00 53.44 N ATOM 1232 CA VAL A 323 -0.132 -16.920 6.663 1.00 72.52 C ATOM 1233 C VAL A 323 -1.611 -16.641 6.938 1.00 50.30 C ATOM 1234 O VAL A 323 -2.324 -16.141 6.069 1.00 31.01 O ATOM 1235 CB VAL A 323 0.717 -15.649 6.611 1.00 42.11 C ATOM 1236 CG1 VAL A 323 0.937 -15.079 8.013 1.00 12.35 C ATOM 1237 CG2 VAL A 323 2.052 -15.910 5.910 1.00 51.54 C ATOM 0 H VAL A 323 -0.642 -17.352 4.677 1.00 53.44 H new ATOM 0 HA VAL A 323 0.247 -17.513 7.495 1.00 72.52 H new ATOM 0 HB VAL A 323 0.172 -14.906 6.029 1.00 42.11 H new ATOM 0 HG11 VAL A 323 1.544 -14.176 7.947 1.00 12.35 H new ATOM 0 HG12 VAL A 323 -0.026 -14.838 8.463 1.00 12.35 H new ATOM 0 HG13 VAL A 323 1.450 -15.817 8.629 1.00 12.35 H new ATOM 0 HG21 VAL A 323 2.636 -14.990 5.886 1.00 51.54 H new ATOM 0 HG22 VAL A 323 2.604 -16.677 6.453 1.00 51.54 H new ATOM 0 HG23 VAL A 323 1.868 -16.249 4.891 1.00 51.54 H new ATOM 1247 N VAL A 324 -2.028 -16.975 8.150 1.00 30.03 N ATOM 1248 CA VAL A 324 -3.409 -16.766 8.551 1.00 70.02 C ATOM 1249 C VAL A 324 -3.475 -15.617 9.558 1.00 1.45 C ATOM 1250 O VAL A 324 -2.448 -15.048 9.925 1.00 25.33 O ATOM 1251 CB VAL A 324 -4.000 -18.070 9.091 1.00 11.44 C ATOM 1252 CG1 VAL A 324 -4.202 -19.088 7.967 1.00 2.24 C ATOM 1253 CG2 VAL A 324 -3.125 -18.648 10.205 1.00 62.21 C ATOM 0 H VAL A 324 -1.434 -17.389 8.868 1.00 30.03 H new ATOM 0 HA VAL A 324 -4.017 -16.480 7.693 1.00 70.02 H new ATOM 0 HB VAL A 324 -4.978 -17.844 9.516 1.00 11.44 H new ATOM 0 HG11 VAL A 324 -4.623 -20.005 8.378 1.00 2.24 H new ATOM 0 HG12 VAL A 324 -4.884 -18.678 7.223 1.00 2.24 H new ATOM 0 HG13 VAL A 324 -3.243 -19.307 7.498 1.00 2.24 H new ATOM 0 HG21 VAL A 324 -3.567 -19.574 10.571 1.00 62.21 H new ATOM 0 HG22 VAL A 324 -2.127 -18.851 9.816 1.00 62.21 H new ATOM 0 HG23 VAL A 324 -3.056 -17.931 11.023 1.00 62.21 H new ATOM 1263 N ASN A 325 -4.693 -15.309 9.978 1.00 54.54 N ATOM 1264 CA ASN A 325 -4.907 -14.237 10.936 1.00 63.23 C ATOM 1265 C ASN A 325 -5.360 -14.834 12.269 1.00 32.33 C ATOM 1266 O ASN A 325 -5.356 -16.052 12.442 1.00 61.23 O ATOM 1267 CB ASN A 325 -5.995 -13.276 10.454 1.00 40.13 C ATOM 1268 CG ASN A 325 -6.992 -13.991 9.540 1.00 53.54 C ATOM 1269 OD1 ASN A 325 -7.398 -13.486 8.506 1.00 52.23 O ATOM 1270 ND2 ASN A 325 -7.363 -15.190 9.977 1.00 71.51 N ATOM 0 H ASN A 325 -5.543 -15.783 9.672 1.00 54.54 H new ATOM 0 HA ASN A 325 -3.969 -13.692 11.048 1.00 63.23 H new ATOM 0 HB2 ASN A 325 -6.520 -12.855 11.312 1.00 40.13 H new ATOM 0 HB3 ASN A 325 -5.539 -12.443 9.919 1.00 40.13 H new ATOM 0 HD21 ASN A 325 -8.026 -15.747 9.438 1.00 71.51 H new ATOM 0 HD22 ASN A 325 -6.985 -15.554 10.852 1.00 71.51 H new ATOM 1277 N GLN A 326 -5.741 -13.949 13.179 1.00 62.13 N ATOM 1278 CA GLN A 326 -6.196 -14.373 14.492 1.00 72.44 C ATOM 1279 C GLN A 326 -7.535 -15.106 14.378 1.00 3.10 C ATOM 1280 O GLN A 326 -8.050 -15.622 15.369 1.00 50.24 O ATOM 1281 CB GLN A 326 -6.302 -13.183 15.446 1.00 12.25 C ATOM 1282 CG GLN A 326 -7.555 -12.355 15.154 1.00 52.12 C ATOM 1283 CD GLN A 326 -7.757 -11.271 16.215 1.00 64.20 C ATOM 1284 OE1 GLN A 326 -8.567 -11.394 17.119 1.00 62.12 O ATOM 1285 NE2 GLN A 326 -6.976 -10.206 16.055 1.00 31.24 N ATOM 0 H GLN A 326 -5.744 -12.940 13.032 1.00 62.13 H new ATOM 0 HA GLN A 326 -5.460 -15.063 14.905 1.00 72.44 H new ATOM 0 HB2 GLN A 326 -6.329 -13.539 16.476 1.00 12.25 H new ATOM 0 HB3 GLN A 326 -5.416 -12.555 15.349 1.00 12.25 H new ATOM 0 HG2 GLN A 326 -7.469 -11.894 14.170 1.00 52.12 H new ATOM 0 HG3 GLN A 326 -8.428 -13.008 15.125 1.00 52.12 H new ATOM 0 HE21 GLN A 326 -6.319 -10.168 15.276 1.00 31.24 H new ATOM 0 HE22 GLN A 326 -7.034 -9.428 16.712 1.00 31.24 H new ATOM 1294 N ASP A 327 -8.059 -15.128 13.162 1.00 55.03 N ATOM 1295 CA ASP A 327 -9.328 -15.789 12.906 1.00 51.32 C ATOM 1296 C ASP A 327 -9.065 -17.195 12.363 1.00 34.03 C ATOM 1297 O ASP A 327 -9.993 -17.987 12.206 1.00 55.33 O ATOM 1298 CB ASP A 327 -10.146 -15.025 11.863 1.00 53.12 C ATOM 1299 CG ASP A 327 -11.503 -14.515 12.352 1.00 11.44 C ATOM 1300 OD1 ASP A 327 -12.193 -13.761 11.650 1.00 11.43 O ATOM 1301 OD2 ASP A 327 -11.850 -14.928 13.524 1.00 15.21 O ATOM 0 H ASP A 327 -7.628 -14.699 12.343 1.00 55.03 H new ATOM 0 HA ASP A 327 -9.884 -15.827 13.843 1.00 51.32 H new ATOM 0 HB2 ASP A 327 -9.559 -14.175 11.515 1.00 53.12 H new ATOM 0 HB3 ASP A 327 -10.307 -15.675 11.003 1.00 53.12 H new ATOM 1307 N GLY A 328 -7.796 -17.463 12.093 1.00 54.23 N ATOM 1308 CA GLY A 328 -7.400 -18.760 11.571 1.00 1.23 C ATOM 1309 C GLY A 328 -7.809 -18.909 10.105 1.00 61.45 C ATOM 1310 O GLY A 328 -8.489 -19.868 9.741 1.00 41.34 O ATOM 0 H GLY A 328 -7.029 -16.804 12.226 1.00 54.23 H new ATOM 0 HA2 GLY A 328 -6.321 -18.880 11.665 1.00 1.23 H new ATOM 0 HA3 GLY A 328 -7.861 -19.550 12.163 1.00 1.23 H new ATOM 1314 N GLU A 329 -7.377 -17.948 9.302 1.00 53.30 N ATOM 1315 CA GLU A 329 -7.690 -17.960 7.883 1.00 31.40 C ATOM 1316 C GLU A 329 -6.568 -17.292 7.086 1.00 23.41 C ATOM 1317 O GLU A 329 -6.135 -16.191 7.421 1.00 42.23 O ATOM 1318 CB GLU A 329 -9.034 -17.282 7.612 1.00 51.43 C ATOM 1319 CG GLU A 329 -8.835 -15.911 6.961 1.00 22.21 C ATOM 1320 CD GLU A 329 -10.174 -15.305 6.538 1.00 75.44 C ATOM 1321 OE1 GLU A 329 -10.764 -15.742 5.538 1.00 70.11 O ATOM 1322 OE2 GLU A 329 -10.602 -14.348 7.289 1.00 45.42 O ATOM 0 H GLU A 329 -6.812 -17.155 9.607 1.00 53.30 H new ATOM 0 HA GLU A 329 -7.772 -18.997 7.558 1.00 31.40 H new ATOM 0 HB2 GLU A 329 -9.639 -17.913 6.961 1.00 51.43 H new ATOM 0 HB3 GLU A 329 -9.583 -17.169 8.547 1.00 51.43 H new ATOM 0 HG2 GLU A 329 -8.334 -15.242 7.660 1.00 22.21 H new ATOM 0 HG3 GLU A 329 -8.185 -16.008 6.091 1.00 22.21 H new ATOM 1330 N THR A 330 -6.129 -17.987 6.047 1.00 63.30 N ATOM 1331 CA THR A 330 -5.065 -17.475 5.200 1.00 70.13 C ATOM 1332 C THR A 330 -5.489 -16.157 4.550 1.00 51.32 C ATOM 1333 O THR A 330 -6.470 -16.113 3.809 1.00 43.05 O ATOM 1334 CB THR A 330 -4.702 -18.563 4.187 1.00 52.11 C ATOM 1335 OG1 THR A 330 -3.827 -19.428 4.905 1.00 35.43 O ATOM 1336 CG2 THR A 330 -3.841 -18.031 3.040 1.00 62.03 C ATOM 0 H THR A 330 -6.491 -18.900 5.772 1.00 63.30 H new ATOM 0 HA THR A 330 -4.173 -17.242 5.782 1.00 70.13 H new ATOM 0 HB THR A 330 -5.614 -19.001 3.783 1.00 52.11 H new ATOM 0 HG1 THR A 330 -3.544 -20.164 4.323 1.00 35.43 H new ATOM 0 HG21 THR A 330 -3.612 -18.843 2.350 1.00 62.03 H new ATOM 0 HG22 THR A 330 -4.384 -17.248 2.511 1.00 62.03 H new ATOM 0 HG23 THR A 330 -2.913 -17.623 3.441 1.00 62.03 H new ATOM 1344 N ILE A 331 -4.729 -15.114 4.851 1.00 32.02 N ATOM 1345 CA ILE A 331 -5.014 -13.798 4.306 1.00 41.24 C ATOM 1346 C ILE A 331 -4.133 -13.558 3.078 1.00 74.25 C ATOM 1347 O ILE A 331 -4.558 -12.911 2.122 1.00 41.24 O ATOM 1348 CB ILE A 331 -4.866 -12.726 5.387 1.00 4.22 C ATOM 1349 CG1 ILE A 331 -3.391 -12.418 5.655 1.00 11.23 C ATOM 1350 CG2 ILE A 331 -5.608 -13.128 6.663 1.00 14.10 C ATOM 1351 CD1 ILE A 331 -3.219 -11.674 6.981 1.00 4.12 C ATOM 0 H ILE A 331 -3.916 -15.154 5.466 1.00 32.02 H new ATOM 0 HA ILE A 331 -6.050 -13.740 3.973 1.00 41.24 H new ATOM 0 HB ILE A 331 -5.326 -11.808 5.023 1.00 4.22 H new ATOM 0 HG12 ILE A 331 -2.820 -13.346 5.678 1.00 11.23 H new ATOM 0 HG13 ILE A 331 -2.988 -11.816 4.841 1.00 11.23 H new ATOM 0 HG21 ILE A 331 -5.487 -12.349 7.415 1.00 14.10 H new ATOM 0 HG22 ILE A 331 -6.668 -13.258 6.442 1.00 14.10 H new ATOM 0 HG23 ILE A 331 -5.199 -14.065 7.042 1.00 14.10 H new ATOM 0 HD11 ILE A 331 -2.162 -11.467 7.148 1.00 4.12 H new ATOM 0 HD12 ILE A 331 -3.771 -10.735 6.946 1.00 4.12 H new ATOM 0 HD13 ILE A 331 -3.601 -12.289 7.796 1.00 4.12 H new ATOM 1363 N LEU A 332 -2.923 -14.093 3.143 1.00 31.23 N ATOM 1364 CA LEU A 332 -1.979 -13.946 2.049 1.00 51.34 C ATOM 1365 C LEU A 332 -1.372 -15.310 1.717 1.00 73.52 C ATOM 1366 O LEU A 332 -1.817 -16.334 2.235 1.00 43.23 O ATOM 1367 CB LEU A 332 -0.938 -12.874 2.379 1.00 14.13 C ATOM 1368 CG LEU A 332 -1.131 -11.519 1.696 1.00 42.34 C ATOM 1369 CD1 LEU A 332 -0.127 -10.492 2.222 1.00 2.53 C ATOM 1370 CD2 LEU A 332 -1.063 -11.658 0.173 1.00 12.15 C ATOM 0 H LEU A 332 -2.574 -14.630 3.937 1.00 31.23 H new ATOM 0 HA LEU A 332 -2.489 -13.597 1.151 1.00 51.34 H new ATOM 0 HB2 LEU A 332 -0.936 -12.718 3.458 1.00 14.13 H new ATOM 0 HB3 LEU A 332 0.047 -13.257 2.110 1.00 14.13 H new ATOM 0 HG LEU A 332 -2.127 -11.151 1.942 1.00 42.34 H new ATOM 0 HD11 LEU A 332 -0.286 -9.538 1.720 1.00 2.53 H new ATOM 0 HD12 LEU A 332 -0.265 -10.365 3.296 1.00 2.53 H new ATOM 0 HD13 LEU A 332 0.887 -10.841 2.026 1.00 2.53 H new ATOM 0 HD21 LEU A 332 -1.203 -10.680 -0.288 1.00 12.15 H new ATOM 0 HD22 LEU A 332 -0.090 -12.058 -0.113 1.00 12.15 H new ATOM 0 HD23 LEU A 332 -1.847 -12.335 -0.166 1.00 12.15 H new ATOM 1382 N VAL A 333 -0.366 -15.281 0.855 1.00 32.42 N ATOM 1383 CA VAL A 333 0.306 -16.504 0.448 1.00 1.52 C ATOM 1384 C VAL A 333 1.482 -16.153 -0.466 1.00 22.44 C ATOM 1385 O VAL A 333 1.286 -15.641 -1.567 1.00 24.23 O ATOM 1386 CB VAL A 333 -0.695 -17.459 -0.205 1.00 42.31 C ATOM 1387 CG1 VAL A 333 -1.862 -16.689 -0.826 1.00 33.02 C ATOM 1388 CG2 VAL A 333 -0.008 -18.345 -1.245 1.00 65.54 C ATOM 0 H VAL A 333 -0.000 -14.430 0.427 1.00 32.42 H new ATOM 0 HA VAL A 333 0.712 -17.024 1.315 1.00 1.52 H new ATOM 0 HB VAL A 333 -1.098 -18.107 0.574 1.00 42.31 H new ATOM 0 HG11 VAL A 333 -2.559 -17.391 -1.283 1.00 33.02 H new ATOM 0 HG12 VAL A 333 -2.376 -16.120 -0.051 1.00 33.02 H new ATOM 0 HG13 VAL A 333 -1.484 -16.006 -1.587 1.00 33.02 H new ATOM 0 HG21 VAL A 333 -0.742 -19.015 -1.694 1.00 65.54 H new ATOM 0 HG22 VAL A 333 0.435 -17.720 -2.020 1.00 65.54 H new ATOM 0 HG23 VAL A 333 0.773 -18.933 -0.763 1.00 65.54 H new ATOM 1398 N GLY A 334 2.678 -16.444 0.025 1.00 2.30 N ATOM 1399 CA GLY A 334 3.886 -16.166 -0.734 1.00 10.13 C ATOM 1400 C GLY A 334 3.904 -16.955 -2.045 1.00 14.34 C ATOM 1401 O GLY A 334 3.587 -18.143 -2.062 1.00 62.24 O ATOM 0 H GLY A 334 2.836 -16.869 0.939 1.00 2.30 H new ATOM 0 HA2 GLY A 334 3.948 -15.099 -0.947 1.00 10.13 H new ATOM 0 HA3 GLY A 334 4.762 -16.424 -0.138 1.00 10.13 H new ATOM 1405 N LYS A 335 4.277 -16.261 -3.110 1.00 75.43 N ATOM 1406 CA LYS A 335 4.340 -16.882 -4.423 1.00 34.25 C ATOM 1407 C LYS A 335 5.278 -18.089 -4.366 1.00 62.15 C ATOM 1408 O LYS A 335 5.220 -18.966 -5.227 1.00 50.22 O ATOM 1409 CB LYS A 335 4.726 -15.851 -5.485 1.00 22.31 C ATOM 1410 CG LYS A 335 6.234 -15.589 -5.472 1.00 34.23 C ATOM 1411 CD LYS A 335 6.602 -14.559 -4.402 1.00 55.44 C ATOM 1412 CE LYS A 335 8.074 -14.158 -4.511 1.00 41.20 C ATOM 1413 NZ LYS A 335 8.412 -13.798 -5.906 1.00 72.35 N ATOM 0 H LYS A 335 4.539 -15.275 -3.091 1.00 75.43 H new ATOM 0 HA LYS A 335 3.359 -17.255 -4.717 1.00 34.25 H new ATOM 0 HB2 LYS A 335 4.424 -16.207 -6.470 1.00 22.31 H new ATOM 0 HB3 LYS A 335 4.190 -14.919 -5.305 1.00 22.31 H new ATOM 0 HG2 LYS A 335 6.767 -16.521 -5.283 1.00 34.23 H new ATOM 0 HG3 LYS A 335 6.553 -15.232 -6.451 1.00 34.23 H new ATOM 0 HD2 LYS A 335 5.972 -13.676 -4.510 1.00 55.44 H new ATOM 0 HD3 LYS A 335 6.406 -14.971 -3.412 1.00 55.44 H new ATOM 0 HE2 LYS A 335 8.277 -13.314 -3.852 1.00 41.20 H new ATOM 0 HE3 LYS A 335 8.707 -14.981 -4.178 1.00 41.20 H new ATOM 0 HZ1 LYS A 335 9.258 -13.193 -5.913 1.00 72.35 H new ATOM 0 HZ2 LYS A 335 8.601 -14.663 -6.452 1.00 72.35 H new ATOM 0 HZ3 LYS A 335 7.615 -13.285 -6.335 1.00 72.35 H new ATOM 1426 N CYS A 336 6.122 -18.095 -3.345 1.00 33.43 N ATOM 1427 CA CYS A 336 7.072 -19.180 -3.165 1.00 75.31 C ATOM 1428 C CYS A 336 7.661 -19.534 -4.532 1.00 3.32 C ATOM 1429 O CYS A 336 7.133 -20.392 -5.236 1.00 62.55 O ATOM 1430 CB CYS A 336 6.425 -20.393 -2.492 1.00 11.52 C ATOM 1431 SG CYS A 336 4.674 -20.534 -3.006 1.00 2.13 S ATOM 0 H CYS A 336 6.168 -17.366 -2.633 1.00 33.43 H new ATOM 0 HA CYS A 336 7.871 -18.859 -2.497 1.00 75.31 H new ATOM 0 HB2 CYS A 336 6.966 -21.300 -2.761 1.00 11.52 H new ATOM 0 HB3 CYS A 336 6.488 -20.294 -1.408 1.00 11.52 H new ATOM 0 HG CYS A 336 3.985 -19.572 -2.468 1.00 2.13 H new ATOM 1437 N ALA A 337 8.748 -18.853 -4.866 1.00 21.44 N ATOM 1438 CA ALA A 337 9.415 -19.085 -6.135 1.00 43.35 C ATOM 1439 C ALA A 337 10.750 -19.790 -5.884 1.00 53.15 C ATOM 1440 O ALA A 337 11.064 -20.146 -4.750 1.00 33.41 O ATOM 1441 CB ALA A 337 9.588 -17.754 -6.871 1.00 62.53 C ATOM 0 H ALA A 337 9.183 -18.141 -4.279 1.00 21.44 H new ATOM 0 HA ALA A 337 8.814 -19.735 -6.771 1.00 43.35 H new ATOM 0 HB1 ALA A 337 10.089 -17.927 -7.824 1.00 62.53 H new ATOM 0 HB2 ALA A 337 8.610 -17.308 -7.051 1.00 62.53 H new ATOM 0 HB3 ALA A 337 10.189 -17.078 -6.263 1.00 62.53 H new ATOM 1447 N ASP A 338 11.499 -19.970 -6.962 1.00 62.01 N ATOM 1448 CA ASP A 338 12.793 -20.626 -6.873 1.00 34.20 C ATOM 1449 C ASP A 338 13.820 -19.643 -6.309 1.00 25.43 C ATOM 1450 O ASP A 338 14.798 -19.310 -6.977 1.00 30.32 O ATOM 1451 CB ASP A 338 13.277 -21.077 -8.252 1.00 64.41 C ATOM 1452 CG ASP A 338 14.586 -21.871 -8.250 1.00 53.20 C ATOM 1453 OD1 ASP A 338 15.452 -21.677 -9.116 1.00 54.21 O ATOM 1454 OD2 ASP A 338 14.700 -22.731 -7.296 1.00 31.24 O ATOM 0 H ASP A 338 11.235 -19.673 -7.901 1.00 62.01 H new ATOM 0 HA ASP A 338 12.687 -21.497 -6.226 1.00 34.20 H new ATOM 0 HB2 ASP A 338 12.500 -21.688 -8.712 1.00 64.41 H new ATOM 0 HB3 ASP A 338 13.405 -20.196 -8.882 1.00 64.41 H new ATOM 1460 N SER A 339 13.564 -19.207 -5.084 1.00 43.23 N ATOM 1461 CA SER A 339 14.455 -18.269 -4.423 1.00 1.24 C ATOM 1462 C SER A 339 13.965 -17.998 -2.999 1.00 4.34 C ATOM 1463 O SER A 339 12.762 -17.924 -2.756 1.00 32.14 O ATOM 1464 CB SER A 339 14.557 -16.959 -5.207 1.00 62.20 C ATOM 1465 OG SER A 339 15.838 -16.351 -5.065 1.00 51.54 O ATOM 0 H SER A 339 12.753 -19.486 -4.532 1.00 43.23 H new ATOM 0 HA SER A 339 15.449 -18.714 -4.381 1.00 1.24 H new ATOM 0 HB2 SER A 339 14.362 -17.152 -6.262 1.00 62.20 H new ATOM 0 HB3 SER A 339 13.788 -16.269 -4.861 1.00 62.20 H new ATOM 0 HG SER A 339 15.864 -15.518 -5.581 1.00 51.54 H new ATOM 1471 N ASN A 340 14.923 -17.857 -2.094 1.00 45.34 N ATOM 1472 CA ASN A 340 14.605 -17.595 -0.701 1.00 31.40 C ATOM 1473 C ASN A 340 13.659 -16.396 -0.615 1.00 11.01 C ATOM 1474 O ASN A 340 12.880 -16.282 0.330 1.00 12.01 O ATOM 1475 CB ASN A 340 15.866 -17.261 0.099 1.00 74.51 C ATOM 1476 CG ASN A 340 16.649 -18.530 0.442 1.00 44.11 C ATOM 1477 OD1 ASN A 340 16.278 -19.636 0.085 1.00 51.12 O ATOM 1478 ND2 ASN A 340 17.752 -18.309 1.153 1.00 75.23 N ATOM 0 H ASN A 340 15.920 -17.919 -2.299 1.00 45.34 H new ATOM 0 HA ASN A 340 14.142 -18.491 -0.287 1.00 31.40 H new ATOM 0 HB2 ASN A 340 16.497 -16.584 -0.476 1.00 74.51 H new ATOM 0 HB3 ASN A 340 15.592 -16.739 1.016 1.00 74.51 H new ATOM 0 HD21 ASN A 340 18.344 -19.091 1.432 1.00 75.23 H new ATOM 0 HD22 ASN A 340 18.005 -17.357 1.419 1.00 75.23 H new ATOM 1485 N GLU A 341 13.758 -15.532 -1.614 1.00 40.22 N ATOM 1486 CA GLU A 341 12.921 -14.345 -1.663 1.00 72.12 C ATOM 1487 C GLU A 341 11.449 -14.739 -1.805 1.00 63.25 C ATOM 1488 O GLU A 341 11.115 -15.633 -2.582 1.00 15.51 O ATOM 1489 CB GLU A 341 13.352 -13.417 -2.800 1.00 41.51 C ATOM 1490 CG GLU A 341 14.313 -12.339 -2.293 1.00 53.14 C ATOM 1491 CD GLU A 341 15.767 -12.795 -2.425 1.00 62.11 C ATOM 1492 OE1 GLU A 341 16.081 -13.958 -2.130 1.00 5.43 O ATOM 1493 OE2 GLU A 341 16.585 -11.894 -2.853 1.00 12.41 O ATOM 0 H GLU A 341 14.405 -15.630 -2.396 1.00 40.22 H new ATOM 0 HA GLU A 341 13.042 -13.800 -0.727 1.00 72.12 H new ATOM 0 HB2 GLU A 341 13.834 -13.998 -3.586 1.00 41.51 H new ATOM 0 HB3 GLU A 341 12.474 -12.947 -3.244 1.00 41.51 H new ATOM 0 HG2 GLU A 341 14.164 -11.419 -2.858 1.00 53.14 H new ATOM 0 HG3 GLU A 341 14.093 -12.112 -1.250 1.00 53.14 H new ATOM 1501 N ILE A 342 10.610 -14.054 -1.044 1.00 12.54 N ATOM 1502 CA ILE A 342 9.182 -14.321 -1.075 1.00 51.20 C ATOM 1503 C ILE A 342 8.418 -13.014 -0.852 1.00 71.11 C ATOM 1504 O ILE A 342 8.787 -12.213 0.006 1.00 62.44 O ATOM 1505 CB ILE A 342 8.821 -15.422 -0.076 1.00 71.34 C ATOM 1506 CG1 ILE A 342 9.667 -16.675 -0.312 1.00 62.03 C ATOM 1507 CG2 ILE A 342 7.322 -15.728 -0.115 1.00 1.51 C ATOM 1508 CD1 ILE A 342 9.341 -17.759 0.717 1.00 74.12 C ATOM 0 H ILE A 342 10.891 -13.314 -0.401 1.00 12.54 H new ATOM 0 HA ILE A 342 8.887 -14.701 -2.053 1.00 51.20 H new ATOM 0 HB ILE A 342 9.051 -15.062 0.927 1.00 71.34 H new ATOM 0 HG12 ILE A 342 9.486 -17.056 -1.317 1.00 62.03 H new ATOM 0 HG13 ILE A 342 10.725 -16.420 -0.254 1.00 62.03 H new ATOM 0 HG21 ILE A 342 7.092 -16.514 0.604 1.00 1.51 H new ATOM 0 HG22 ILE A 342 6.760 -14.829 0.138 1.00 1.51 H new ATOM 0 HG23 ILE A 342 7.044 -16.060 -1.116 1.00 1.51 H new ATOM 0 HD11 ILE A 342 9.956 -18.638 0.526 1.00 74.12 H new ATOM 0 HD12 ILE A 342 9.546 -17.383 1.719 1.00 74.12 H new ATOM 0 HD13 ILE A 342 8.288 -18.029 0.640 1.00 74.12 H new ATOM 1520 N THR A 343 7.367 -12.839 -1.639 1.00 55.11 N ATOM 1521 CA THR A 343 6.547 -11.643 -1.538 1.00 62.14 C ATOM 1522 C THR A 343 5.064 -12.003 -1.638 1.00 73.23 C ATOM 1523 O THR A 343 4.542 -12.203 -2.734 1.00 61.01 O ATOM 1524 CB THR A 343 7.008 -10.662 -2.618 1.00 4.22 C ATOM 1525 OG1 THR A 343 6.543 -11.240 -3.834 1.00 63.13 O ATOM 1526 CG2 THR A 343 8.530 -10.637 -2.775 1.00 41.20 C ATOM 0 H THR A 343 7.064 -13.505 -2.350 1.00 55.11 H new ATOM 0 HA THR A 343 6.667 -11.162 -0.568 1.00 62.14 H new ATOM 0 HB THR A 343 6.652 -9.661 -2.375 1.00 4.22 H new ATOM 0 HG1 THR A 343 5.576 -11.389 -3.777 1.00 63.13 H new ATOM 0 HG21 THR A 343 8.804 -9.925 -3.554 1.00 41.20 H new ATOM 0 HG22 THR A 343 8.988 -10.338 -1.832 1.00 41.20 H new ATOM 0 HG23 THR A 343 8.884 -11.630 -3.051 1.00 41.20 H new ATOM 1534 N LEU A 344 4.426 -12.075 -0.479 1.00 52.03 N ATOM 1535 CA LEU A 344 3.012 -12.408 -0.422 1.00 44.52 C ATOM 1536 C LEU A 344 2.229 -11.440 -1.312 1.00 61.42 C ATOM 1537 O LEU A 344 2.426 -10.228 -1.242 1.00 22.31 O ATOM 1538 CB LEU A 344 2.527 -12.438 1.029 1.00 63.35 C ATOM 1539 CG LEU A 344 2.741 -13.754 1.779 1.00 32.24 C ATOM 1540 CD1 LEU A 344 4.204 -14.196 1.707 1.00 52.33 C ATOM 1541 CD2 LEU A 344 2.245 -13.648 3.223 1.00 61.40 C ATOM 0 H LEU A 344 4.862 -11.909 0.428 1.00 52.03 H new ATOM 0 HA LEU A 344 2.840 -13.411 -0.812 1.00 44.52 H new ATOM 0 HB2 LEU A 344 3.033 -11.644 1.577 1.00 63.35 H new ATOM 0 HB3 LEU A 344 1.462 -12.205 1.041 1.00 63.35 H new ATOM 0 HG LEU A 344 2.148 -14.526 1.289 1.00 32.24 H new ATOM 0 HD11 LEU A 344 4.328 -15.134 2.248 1.00 52.33 H new ATOM 0 HD12 LEU A 344 4.490 -14.338 0.665 1.00 52.33 H new ATOM 0 HD13 LEU A 344 4.838 -13.431 2.156 1.00 52.33 H new ATOM 0 HD21 LEU A 344 2.409 -14.597 3.734 1.00 61.40 H new ATOM 0 HD22 LEU A 344 2.792 -12.859 3.739 1.00 61.40 H new ATOM 0 HD23 LEU A 344 1.181 -13.413 3.226 1.00 61.40 H new ATOM 1553 N LYS A 345 1.357 -12.013 -2.129 1.00 51.30 N ATOM 1554 CA LYS A 345 0.543 -11.217 -3.032 1.00 0.52 C ATOM 1555 C LYS A 345 -0.923 -11.306 -2.603 1.00 60.21 C ATOM 1556 O LYS A 345 -1.508 -10.315 -2.169 1.00 72.21 O ATOM 1557 CB LYS A 345 0.786 -11.636 -4.483 1.00 41.30 C ATOM 1558 CG LYS A 345 1.403 -13.034 -4.554 1.00 32.21 C ATOM 1559 CD LYS A 345 1.815 -13.380 -5.986 1.00 41.42 C ATOM 1560 CE LYS A 345 2.729 -12.300 -6.569 1.00 50.02 C ATOM 1561 NZ LYS A 345 1.998 -11.484 -7.565 1.00 21.43 N ATOM 0 H LYS A 345 1.197 -13.019 -2.184 1.00 51.30 H new ATOM 0 HA LYS A 345 0.828 -10.167 -2.976 1.00 0.52 H new ATOM 0 HB2 LYS A 345 -0.156 -11.622 -5.032 1.00 41.30 H new ATOM 0 HB3 LYS A 345 1.448 -10.918 -4.967 1.00 41.30 H new ATOM 0 HG2 LYS A 345 2.273 -13.085 -3.899 1.00 32.21 H new ATOM 0 HG3 LYS A 345 0.687 -13.770 -4.190 1.00 32.21 H new ATOM 0 HD2 LYS A 345 2.328 -14.342 -5.998 1.00 41.42 H new ATOM 0 HD3 LYS A 345 0.927 -13.485 -6.609 1.00 41.42 H new ATOM 0 HE2 LYS A 345 3.102 -11.660 -5.769 1.00 50.02 H new ATOM 0 HE3 LYS A 345 3.597 -12.764 -7.037 1.00 50.02 H new ATOM 0 HZ1 LYS A 345 2.633 -10.756 -7.951 1.00 21.43 H new ATOM 0 HZ2 LYS A 345 1.663 -12.096 -8.337 1.00 21.43 H new ATOM 0 HZ3 LYS A 345 1.183 -11.026 -7.108 1.00 21.43 H new ATOM 1574 N SER A 346 -1.474 -12.503 -2.740 1.00 30.33 N ATOM 1575 CA SER A 346 -2.860 -12.735 -2.372 1.00 35.31 C ATOM 1576 C SER A 346 -3.390 -13.980 -3.087 1.00 53.21 C ATOM 1577 O SER A 346 -3.137 -14.173 -4.275 1.00 41.41 O ATOM 1578 CB SER A 346 -3.729 -11.521 -2.706 1.00 34.14 C ATOM 1579 OG SER A 346 -3.365 -10.929 -3.950 1.00 24.25 O ATOM 0 H SER A 346 -0.986 -13.323 -3.101 1.00 30.33 H new ATOM 0 HA SER A 346 -2.906 -12.895 -1.295 1.00 35.31 H new ATOM 0 HB2 SER A 346 -4.776 -11.823 -2.741 1.00 34.14 H new ATOM 0 HB3 SER A 346 -3.637 -10.780 -1.912 1.00 34.14 H new ATOM 0 HG SER A 346 -2.779 -10.161 -3.788 1.00 24.25 H new ATOM 1585 N PRO A 347 -4.136 -14.814 -2.313 1.00 44.33 N ATOM 1586 CA PRO A 347 -4.703 -16.034 -2.860 1.00 74.21 C ATOM 1587 C PRO A 347 -5.909 -15.727 -3.751 1.00 21.11 C ATOM 1588 O PRO A 347 -5.929 -16.098 -4.924 1.00 13.05 O ATOM 1589 CB PRO A 347 -5.060 -16.880 -1.648 1.00 52.54 C ATOM 1590 CG PRO A 347 -5.111 -15.920 -0.471 1.00 2.42 C ATOM 1591 CD PRO A 347 -4.456 -14.617 -0.903 1.00 33.55 C ATOM 0 HA PRO A 347 -4.008 -16.566 -3.510 1.00 74.21 H new ATOM 0 HB2 PRO A 347 -6.020 -17.378 -1.788 1.00 52.54 H new ATOM 0 HB3 PRO A 347 -4.317 -17.660 -1.484 1.00 52.54 H new ATOM 0 HG2 PRO A 347 -6.143 -15.746 -0.165 1.00 2.42 H new ATOM 0 HG3 PRO A 347 -4.591 -16.342 0.389 1.00 2.42 H new ATOM 0 HD2 PRO A 347 -5.128 -13.770 -0.764 1.00 33.55 H new ATOM 0 HD3 PRO A 347 -3.559 -14.411 -0.318 1.00 33.55 H new ATOM 1599 N LEU A 348 -6.884 -15.052 -3.160 1.00 72.51 N ATOM 1600 CA LEU A 348 -8.090 -14.691 -3.885 1.00 73.15 C ATOM 1601 C LEU A 348 -8.130 -13.174 -4.077 1.00 0.44 C ATOM 1602 O LEU A 348 -8.115 -12.421 -3.104 1.00 23.34 O ATOM 1603 CB LEU A 348 -9.327 -15.255 -3.183 1.00 71.12 C ATOM 1604 CG LEU A 348 -10.669 -14.645 -3.595 1.00 23.40 C ATOM 1605 CD1 LEU A 348 -10.713 -14.385 -5.102 1.00 31.21 C ATOM 1606 CD2 LEU A 348 -11.834 -15.520 -3.130 1.00 34.33 C ATOM 0 H LEU A 348 -6.863 -14.746 -2.187 1.00 72.51 H new ATOM 0 HA LEU A 348 -8.085 -15.138 -4.879 1.00 73.15 H new ATOM 0 HB2 LEU A 348 -9.367 -16.329 -3.367 1.00 71.12 H new ATOM 0 HB3 LEU A 348 -9.204 -15.120 -2.108 1.00 71.12 H new ATOM 0 HG LEU A 348 -10.773 -13.680 -3.099 1.00 23.40 H new ATOM 0 HD11 LEU A 348 -11.677 -13.952 -5.368 1.00 31.21 H new ATOM 0 HD12 LEU A 348 -9.916 -13.693 -5.375 1.00 31.21 H new ATOM 0 HD13 LEU A 348 -10.577 -15.325 -5.637 1.00 31.21 H new ATOM 0 HD21 LEU A 348 -12.776 -15.064 -3.435 1.00 34.33 H new ATOM 0 HD22 LEU A 348 -11.747 -16.510 -3.579 1.00 34.33 H new ATOM 0 HD23 LEU A 348 -11.810 -15.611 -2.044 1.00 34.33 H new