USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=29 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 321 MET CE :methyl 158:sc= -12.6! (180deg=-11.6!) USER MOD Set 1.2: A 336 CYS SG : rot -105:sc= -1.41 USER MOD Set 2.1: A 283 SER OG : rot 60:sc= 0.966 USER MOD Set 2.2: A 319 TYR OH : rot 130:sc= 0.84 USER MOD Set 3.1: A 256 ASN : amide:sc= -3.23 K(o=-5.2,f=-7.2!) USER MOD Set 3.2: A 314 THR OG1 : rot 122:sc= -2 USER MOD Set 4.1: A 267 ASN : amide:sc= -5.62! C(o=-4.6!,f=-8.6!) USER MOD Set 4.2: A 269 THR OG1 : rot -104:sc= 0.995 USER MOD Set 5.1: A 255 SER OG : rot -160:sc= 0.0017 USER MOD Set 5.2: A 262 HIS : no HE2:sc= -9.81! C(o=-9.8!,f=-19!) USER MOD Single : A 251 HIS : no HE2:sc= -7.33! C(o=-7.3!,f=-8.4!) USER MOD Single : A 259 ASN : amide:sc= 0.599 K(o=0.6,f=-3.1!) USER MOD Single : A 260 SER OG : rot -59:sc= 1.04 USER MOD Single : A 266 TYR OH : rot 165:sc= -0.461 USER MOD Single : A 268 LYS NZ :NH3+ -143:sc= -4.63! (180deg=-5.73!) USER MOD Single : A 270 ASN : amide:sc= -0.17 X(o=-0.17,f=-0.17) USER MOD Single : A 276 ASN : amide:sc= -0.866 X(o=-0.87,f=-0.82) USER MOD Single : A 277 CYS SG : rot -78:sc= 0.0944 USER MOD Single : A 278 THR OG1 : rot 180:sc= -1.77! USER MOD Single : A 282 SER OG : rot 46:sc= -1.41! USER MOD Single : A 290 SER OG : rot 43:sc= 0.0428 USER MOD Single : A 292 LYS NZ :NH3+ -149:sc= -0.39 (180deg=-1.47!) USER MOD Single : A 293 MET CE :methyl -125:sc= -1.15 (180deg=-1.23) USER MOD Single : A 296 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 301 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 303 GLN : amide:sc= -0.0272 K(o=-0.027,f=-1.1) USER MOD Single : A 304 LYS NZ :NH3+ 170:sc= 0.249 (180deg=-0.227) USER MOD Single : A 311 SER OG : rot 180:sc= 0 USER MOD Single : A 317 SER OG : rot 170:sc= -1.07 USER MOD Single : A 318 ASN : amide:sc= -0.289 K(o=-0.29,f=-2.4!) USER MOD Single : A 320 THR OG1 : rot 180:sc= 0 USER MOD Single : A 322 LYS NZ :NH3+ 173:sc= -0.0711 (180deg=-0.144) USER MOD Single : A 325 ASN : amide:sc= -12.4! C(o=-12!,f=-10!) USER MOD Single : A 326 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 330 THR OG1 : rot 120:sc= -1.85 USER MOD Single : A 335 LYS NZ :NH3+ -179:sc= -2.98! (180deg=-3.02!) USER MOD Single : A 339 SER OG : rot 44:sc= 1.3 USER MOD Single : A 340 ASN : amide:sc= -0.958 K(o=-0.96,f=0) USER MOD Single : A 343 THR OG1 : rot 70:sc= 1.09 USER MOD Single : A 345 LYS NZ :NH3+ -132:sc= -0.0799 (180deg=-0.888) USER MOD Single : A 346 SER OG : rot -95:sc= -0.122 USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 249 3.362 -5.682 -0.609 1.00 15.23 N ATOM 43 CA LEU A 249 4.115 -6.912 -0.781 1.00 73.43 C ATOM 44 C LEU A 249 4.773 -7.293 0.546 1.00 12.04 C ATOM 45 O LEU A 249 5.194 -6.422 1.307 1.00 71.54 O ATOM 46 CB LEU A 249 5.103 -6.777 -1.941 1.00 63.32 C ATOM 47 CG LEU A 249 5.933 -5.492 -1.969 1.00 25.43 C ATOM 48 CD1 LEU A 249 6.511 -5.183 -0.586 1.00 71.11 C ATOM 49 CD2 LEU A 249 7.022 -5.566 -3.041 1.00 42.22 C ATOM 0 HA LEU A 249 3.449 -7.731 -1.053 1.00 73.43 H new ATOM 0 HB2 LEU A 249 5.786 -7.626 -1.911 1.00 63.32 H new ATOM 0 HB3 LEU A 249 4.547 -6.847 -2.876 1.00 63.32 H new ATOM 0 HG LEU A 249 5.274 -4.665 -2.235 1.00 25.43 H new ATOM 0 HD11 LEU A 249 7.097 -4.265 -0.633 1.00 71.11 H new ATOM 0 HD12 LEU A 249 5.698 -5.058 0.129 1.00 71.11 H new ATOM 0 HD13 LEU A 249 7.151 -6.006 -0.267 1.00 71.11 H new ATOM 0 HD21 LEU A 249 7.597 -4.640 -3.040 1.00 42.22 H new ATOM 0 HD22 LEU A 249 7.685 -6.405 -2.829 1.00 42.22 H new ATOM 0 HD23 LEU A 249 6.561 -5.705 -4.019 1.00 42.22 H new ATOM 61 N LEU A 250 4.841 -8.594 0.785 1.00 74.51 N ATOM 62 CA LEU A 250 5.440 -9.101 2.008 1.00 43.03 C ATOM 63 C LEU A 250 6.709 -9.884 1.662 1.00 13.33 C ATOM 64 O LEU A 250 6.635 -11.036 1.238 1.00 42.23 O ATOM 65 CB LEU A 250 4.419 -9.909 2.811 1.00 52.42 C ATOM 66 CG LEU A 250 4.866 -10.361 4.202 1.00 12.04 C ATOM 67 CD1 LEU A 250 6.376 -10.191 4.375 1.00 25.30 C ATOM 68 CD2 LEU A 250 4.079 -9.634 5.295 1.00 51.35 C ATOM 0 H LEU A 250 4.491 -9.313 0.152 1.00 74.51 H new ATOM 0 HA LEU A 250 5.739 -8.277 2.656 1.00 43.03 H new ATOM 0 HB2 LEU A 250 3.515 -9.310 2.919 1.00 52.42 H new ATOM 0 HB3 LEU A 250 4.149 -10.793 2.233 1.00 52.42 H new ATOM 0 HG LEU A 250 4.648 -11.424 4.301 1.00 12.04 H new ATOM 0 HD11 LEU A 250 6.667 -10.520 5.373 1.00 25.30 H new ATOM 0 HD12 LEU A 250 6.897 -10.790 3.629 1.00 25.30 H new ATOM 0 HD13 LEU A 250 6.641 -9.141 4.247 1.00 25.30 H new ATOM 0 HD21 LEU A 250 4.417 -9.974 6.274 1.00 51.35 H new ATOM 0 HD22 LEU A 250 4.243 -8.560 5.208 1.00 51.35 H new ATOM 0 HD23 LEU A 250 3.016 -9.850 5.183 1.00 51.35 H new ATOM 80 N HIS A 251 7.843 -9.227 1.857 1.00 14.24 N ATOM 81 CA HIS A 251 9.125 -9.847 1.572 1.00 44.31 C ATOM 82 C HIS A 251 9.689 -10.472 2.850 1.00 72.15 C ATOM 83 O HIS A 251 9.728 -9.827 3.896 1.00 14.01 O ATOM 84 CB HIS A 251 10.084 -8.841 0.931 1.00 21.13 C ATOM 85 CG HIS A 251 9.681 -8.407 -0.458 1.00 32.22 C ATOM 86 ND1 HIS A 251 10.453 -7.560 -1.232 1.00 45.53 N ATOM 87 CD2 HIS A 251 8.580 -8.713 -1.203 1.00 31.14 C ATOM 88 CE1 HIS A 251 9.835 -7.370 -2.389 1.00 3.23 C ATOM 89 NE2 HIS A 251 8.674 -8.085 -2.368 1.00 61.21 N ATOM 0 H HIS A 251 7.900 -8.271 2.209 1.00 14.24 H new ATOM 0 HA HIS A 251 8.992 -10.649 0.845 1.00 44.31 H new ATOM 0 HB2 HIS A 251 10.151 -7.961 1.570 1.00 21.13 H new ATOM 0 HB3 HIS A 251 11.080 -9.281 0.888 1.00 21.13 H new ATOM 0 HD1 HIS A 251 11.347 -7.151 -0.959 1.00 45.53 H new ATOM 0 HD2 HIS A 251 7.769 -9.357 -0.896 1.00 31.14 H new ATOM 0 HE1 HIS A 251 10.189 -6.757 -3.205 1.00 3.23 H new ATOM 97 N VAL A 252 10.112 -11.721 2.722 1.00 74.31 N ATOM 98 CA VAL A 252 10.671 -12.441 3.853 1.00 22.32 C ATOM 99 C VAL A 252 12.023 -13.037 3.455 1.00 41.11 C ATOM 100 O VAL A 252 12.385 -13.033 2.279 1.00 32.43 O ATOM 101 CB VAL A 252 9.677 -13.494 4.348 1.00 54.44 C ATOM 102 CG1 VAL A 252 10.159 -14.134 5.651 1.00 74.02 C ATOM 103 CG2 VAL A 252 8.280 -12.892 4.516 1.00 41.21 C ATOM 0 H VAL A 252 10.079 -12.253 1.852 1.00 74.31 H new ATOM 0 HA VAL A 252 10.847 -11.762 4.687 1.00 22.32 H new ATOM 0 HB VAL A 252 9.616 -14.278 3.593 1.00 54.44 H new ATOM 0 HG11 VAL A 252 9.434 -14.878 5.981 1.00 74.02 H new ATOM 0 HG12 VAL A 252 11.123 -14.615 5.485 1.00 74.02 H new ATOM 0 HG13 VAL A 252 10.264 -13.366 6.417 1.00 74.02 H new ATOM 0 HG21 VAL A 252 7.592 -13.661 4.869 1.00 41.21 H new ATOM 0 HG22 VAL A 252 8.319 -12.079 5.242 1.00 41.21 H new ATOM 0 HG23 VAL A 252 7.932 -12.506 3.558 1.00 41.21 H new ATOM 113 N GLU A 253 12.733 -13.534 4.457 1.00 31.10 N ATOM 114 CA GLU A 253 14.037 -14.132 4.226 1.00 10.01 C ATOM 115 C GLU A 253 14.078 -15.552 4.794 1.00 72.24 C ATOM 116 O GLU A 253 13.443 -15.838 5.808 1.00 41.32 O ATOM 117 CB GLU A 253 15.149 -13.270 4.826 1.00 44.30 C ATOM 118 CG GLU A 253 16.480 -14.026 4.844 1.00 15.35 C ATOM 119 CD GLU A 253 17.001 -14.252 3.424 1.00 3.11 C ATOM 120 OE1 GLU A 253 16.243 -14.103 2.454 1.00 4.31 O ATOM 121 OE2 GLU A 253 18.243 -14.594 3.347 1.00 11.33 O ATOM 0 H GLU A 253 12.430 -13.535 5.431 1.00 31.10 H new ATOM 0 HA GLU A 253 14.204 -14.187 3.150 1.00 10.01 H new ATOM 0 HB2 GLU A 253 15.256 -12.353 4.247 1.00 44.30 H new ATOM 0 HB3 GLU A 253 14.879 -12.977 5.841 1.00 44.30 H new ATOM 0 HG2 GLU A 253 17.215 -13.463 5.419 1.00 15.35 H new ATOM 0 HG3 GLU A 253 16.351 -14.985 5.345 1.00 15.35 H new ATOM 129 N VAL A 254 14.831 -16.405 4.115 1.00 73.24 N ATOM 130 CA VAL A 254 14.963 -17.789 4.538 1.00 15.24 C ATOM 131 C VAL A 254 16.445 -18.167 4.577 1.00 54.23 C ATOM 132 O VAL A 254 17.020 -18.540 3.556 1.00 43.03 O ATOM 133 CB VAL A 254 14.137 -18.697 3.624 1.00 3.15 C ATOM 134 CG1 VAL A 254 14.155 -20.142 4.127 1.00 54.10 C ATOM 135 CG2 VAL A 254 12.703 -18.181 3.488 1.00 4.34 C ATOM 0 H VAL A 254 15.356 -16.164 3.274 1.00 73.24 H new ATOM 0 HA VAL A 254 14.568 -17.920 5.546 1.00 15.24 H new ATOM 0 HB VAL A 254 14.593 -18.681 2.634 1.00 3.15 H new ATOM 0 HG11 VAL A 254 13.561 -20.767 3.460 1.00 54.10 H new ATOM 0 HG12 VAL A 254 15.182 -20.507 4.148 1.00 54.10 H new ATOM 0 HG13 VAL A 254 13.735 -20.183 5.132 1.00 54.10 H new ATOM 0 HG21 VAL A 254 12.138 -18.845 2.833 1.00 4.34 H new ATOM 0 HG22 VAL A 254 12.232 -18.153 4.470 1.00 4.34 H new ATOM 0 HG23 VAL A 254 12.716 -17.177 3.063 1.00 4.34 H new ATOM 145 N SER A 255 17.020 -18.057 5.765 1.00 31.31 N ATOM 146 CA SER A 255 18.424 -18.383 5.950 1.00 52.01 C ATOM 147 C SER A 255 18.636 -19.890 5.795 1.00 61.31 C ATOM 148 O SER A 255 19.429 -20.327 4.962 1.00 50.21 O ATOM 149 CB SER A 255 18.922 -17.915 7.318 1.00 3.34 C ATOM 150 OG SER A 255 20.108 -17.132 7.215 1.00 4.42 O ATOM 0 H SER A 255 16.539 -17.747 6.609 1.00 31.31 H new ATOM 0 HA SER A 255 19.000 -17.861 5.186 1.00 52.01 H new ATOM 0 HB2 SER A 255 18.143 -17.330 7.807 1.00 3.34 H new ATOM 0 HB3 SER A 255 19.114 -18.782 7.950 1.00 3.34 H new ATOM 0 HG SER A 255 20.567 -17.119 8.081 1.00 4.42 H new ATOM 156 N ASN A 256 17.913 -20.644 6.610 1.00 25.23 N ATOM 157 CA ASN A 256 18.013 -22.093 6.574 1.00 33.43 C ATOM 158 C ASN A 256 19.454 -22.509 6.877 1.00 35.33 C ATOM 159 O ASN A 256 20.191 -22.906 5.977 1.00 62.34 O ATOM 160 CB ASN A 256 17.644 -22.636 5.192 1.00 25.52 C ATOM 161 CG ASN A 256 18.021 -24.114 5.066 1.00 72.04 C ATOM 162 OD1 ASN A 256 18.534 -24.566 4.055 1.00 22.34 O ATOM 163 ND2 ASN A 256 17.738 -24.839 6.144 1.00 14.32 N ATOM 0 H ASN A 256 17.256 -20.279 7.299 1.00 25.23 H new ATOM 0 HA ASN A 256 17.324 -22.497 7.316 1.00 33.43 H new ATOM 0 HB2 ASN A 256 16.574 -22.514 5.023 1.00 25.52 H new ATOM 0 HB3 ASN A 256 18.156 -22.059 4.422 1.00 25.52 H new ATOM 0 HD21 ASN A 256 17.951 -25.837 6.158 1.00 14.32 H new ATOM 0 HD22 ASN A 256 17.308 -24.398 6.957 1.00 14.32 H new ATOM 170 N GLU A 257 19.811 -22.404 8.149 1.00 61.14 N ATOM 171 CA GLU A 257 21.151 -22.764 8.582 1.00 74.44 C ATOM 172 C GLU A 257 21.115 -24.061 9.393 1.00 64.34 C ATOM 173 O GLU A 257 20.084 -24.413 9.964 1.00 42.34 O ATOM 174 CB GLU A 257 21.790 -21.631 9.387 1.00 72.41 C ATOM 175 CG GLU A 257 20.787 -21.024 10.370 1.00 22.23 C ATOM 176 CD GLU A 257 21.463 -19.991 11.274 1.00 32.02 C ATOM 177 OE1 GLU A 257 22.697 -19.867 11.260 1.00 34.30 O ATOM 178 OE2 GLU A 257 20.658 -19.301 12.010 1.00 44.04 O ATOM 0 H GLU A 257 19.196 -22.075 8.893 1.00 61.14 H new ATOM 0 HA GLU A 257 21.766 -22.928 7.697 1.00 74.44 H new ATOM 0 HB2 GLU A 257 22.655 -22.010 9.932 1.00 72.41 H new ATOM 0 HB3 GLU A 257 22.154 -20.859 8.709 1.00 72.41 H new ATOM 0 HG2 GLU A 257 19.972 -20.553 9.820 1.00 22.23 H new ATOM 0 HG3 GLU A 257 20.346 -21.813 10.979 1.00 22.23 H new ATOM 186 N ASP A 258 22.255 -24.737 9.417 1.00 34.33 N ATOM 187 CA ASP A 258 22.367 -25.988 10.149 1.00 41.31 C ATOM 188 C ASP A 258 21.616 -25.866 11.476 1.00 30.32 C ATOM 189 O ASP A 258 20.705 -26.646 11.752 1.00 42.23 O ATOM 190 CB ASP A 258 23.829 -26.314 10.461 1.00 50.40 C ATOM 191 CG ASP A 258 24.684 -26.678 9.246 1.00 40.24 C ATOM 192 OD1 ASP A 258 25.658 -25.983 8.919 1.00 72.25 O ATOM 193 OD2 ASP A 258 24.310 -27.739 8.614 1.00 2.22 O ATOM 0 H ASP A 258 23.108 -24.442 8.942 1.00 34.33 H new ATOM 0 HA ASP A 258 21.945 -26.780 9.530 1.00 41.31 H new ATOM 0 HB2 ASP A 258 24.279 -25.455 10.959 1.00 50.40 H new ATOM 0 HB3 ASP A 258 23.858 -27.143 11.168 1.00 50.40 H new ATOM 199 N ASN A 259 22.026 -24.883 12.264 1.00 53.35 N ATOM 200 CA ASN A 259 21.403 -24.649 13.555 1.00 31.24 C ATOM 201 C ASN A 259 19.891 -24.845 13.431 1.00 74.15 C ATOM 202 O ASN A 259 19.329 -25.763 14.026 1.00 73.00 O ATOM 203 CB ASN A 259 21.656 -23.220 14.039 1.00 41.24 C ATOM 204 CG ASN A 259 23.139 -22.859 13.930 1.00 20.13 C ATOM 205 OD1 ASN A 259 23.704 -22.763 12.853 1.00 22.23 O ATOM 206 ND2 ASN A 259 23.736 -22.665 15.103 1.00 34.10 N ATOM 0 H ASN A 259 22.783 -24.239 12.033 1.00 53.35 H new ATOM 0 HA ASN A 259 21.833 -25.353 14.268 1.00 31.24 H new ATOM 0 HB2 ASN A 259 21.064 -22.522 13.448 1.00 41.24 H new ATOM 0 HB3 ASN A 259 21.329 -23.119 15.074 1.00 41.24 H new ATOM 0 HD21 ASN A 259 24.726 -22.420 15.137 1.00 34.10 H new ATOM 0 HD22 ASN A 259 23.204 -22.761 15.968 1.00 34.10 H new ATOM 213 N SER A 260 19.275 -23.967 12.652 1.00 33.24 N ATOM 214 CA SER A 260 17.838 -24.032 12.442 1.00 65.13 C ATOM 215 C SER A 260 17.424 -23.041 11.353 1.00 41.43 C ATOM 216 O SER A 260 18.275 -22.465 10.676 1.00 73.13 O ATOM 217 CB SER A 260 17.078 -23.745 13.738 1.00 23.10 C ATOM 218 OG SER A 260 16.610 -24.940 14.358 1.00 54.32 O ATOM 0 H SER A 260 19.744 -23.207 12.159 1.00 33.24 H new ATOM 0 HA SER A 260 17.584 -25.042 12.121 1.00 65.13 H new ATOM 0 HB2 SER A 260 17.729 -23.209 14.429 1.00 23.10 H new ATOM 0 HB3 SER A 260 16.232 -23.092 13.525 1.00 23.10 H new ATOM 0 HG SER A 260 16.017 -25.418 13.741 1.00 54.32 H new ATOM 224 N LEU A 261 16.117 -22.871 11.218 1.00 70.44 N ATOM 225 CA LEU A 261 15.579 -21.959 10.222 1.00 23.44 C ATOM 226 C LEU A 261 15.626 -20.531 10.768 1.00 45.33 C ATOM 227 O LEU A 261 15.758 -20.327 11.974 1.00 54.24 O ATOM 228 CB LEU A 261 14.182 -22.405 9.786 1.00 22.33 C ATOM 229 CG LEU A 261 14.127 -23.397 8.622 1.00 4.31 C ATOM 230 CD1 LEU A 261 12.689 -23.837 8.344 1.00 52.42 C ATOM 231 CD2 LEU A 261 14.801 -22.817 7.376 1.00 33.14 C ATOM 0 H LEU A 261 15.414 -23.349 11.782 1.00 70.44 H new ATOM 0 HA LEU A 261 16.190 -21.977 9.319 1.00 23.44 H new ATOM 0 HB2 LEU A 261 13.681 -22.854 10.644 1.00 22.33 H new ATOM 0 HB3 LEU A 261 13.609 -21.520 9.510 1.00 22.33 H new ATOM 0 HG LEU A 261 14.686 -24.288 8.906 1.00 4.31 H new ATOM 0 HD11 LEU A 261 12.678 -24.542 7.512 1.00 52.42 H new ATOM 0 HD12 LEU A 261 12.277 -24.317 9.232 1.00 52.42 H new ATOM 0 HD13 LEU A 261 12.085 -22.966 8.089 1.00 52.42 H new ATOM 0 HD21 LEU A 261 14.748 -23.541 6.563 1.00 33.14 H new ATOM 0 HD22 LEU A 261 14.290 -21.901 7.079 1.00 33.14 H new ATOM 0 HD23 LEU A 261 15.845 -22.595 7.597 1.00 33.14 H new ATOM 243 N HIS A 262 15.517 -19.578 9.853 1.00 30.32 N ATOM 244 CA HIS A 262 15.546 -18.175 10.227 1.00 15.43 C ATOM 245 C HIS A 262 14.678 -17.368 9.259 1.00 12.33 C ATOM 246 O HIS A 262 15.089 -17.092 8.133 1.00 3.35 O ATOM 247 CB HIS A 262 16.985 -17.661 10.302 1.00 71.51 C ATOM 248 CG HIS A 262 17.122 -16.178 10.054 1.00 33.04 C ATOM 249 ND1 HIS A 262 18.219 -15.622 9.421 1.00 41.25 N ATOM 250 CD2 HIS A 262 16.288 -15.143 10.361 1.00 43.21 C ATOM 251 CE1 HIS A 262 18.044 -14.310 9.355 1.00 72.21 C ATOM 252 NE2 HIS A 262 16.847 -14.015 9.939 1.00 71.23 N ATOM 0 H HIS A 262 15.408 -19.751 8.854 1.00 30.32 H new ATOM 0 HA HIS A 262 15.126 -18.053 11.226 1.00 15.43 H new ATOM 0 HB2 HIS A 262 17.392 -17.893 11.286 1.00 71.51 H new ATOM 0 HB3 HIS A 262 17.590 -18.198 9.572 1.00 71.51 H new ATOM 0 HD1 HIS A 262 19.026 -16.135 9.065 1.00 41.25 H new ATOM 0 HD2 HIS A 262 15.335 -15.227 10.862 1.00 43.21 H new ATOM 0 HE1 HIS A 262 18.729 -13.599 8.916 1.00 72.21 H new ATOM 260 N PHE A 263 13.493 -17.012 9.733 1.00 32.12 N ATOM 261 CA PHE A 263 12.563 -16.242 8.924 1.00 63.41 C ATOM 262 C PHE A 263 12.305 -14.868 9.544 1.00 52.32 C ATOM 263 O PHE A 263 12.012 -14.765 10.734 1.00 4.41 O ATOM 264 CB PHE A 263 11.250 -17.026 8.884 1.00 11.02 C ATOM 265 CG PHE A 263 11.324 -18.325 8.080 1.00 65.34 C ATOM 266 CD1 PHE A 263 11.241 -18.291 6.723 1.00 53.43 C ATOM 267 CD2 PHE A 263 11.475 -19.515 8.722 1.00 53.15 C ATOM 268 CE1 PHE A 263 11.310 -19.496 5.976 1.00 60.50 C ATOM 269 CE2 PHE A 263 11.544 -20.721 7.975 1.00 40.32 C ATOM 270 CZ PHE A 263 11.460 -20.686 6.618 1.00 63.11 C ATOM 0 H PHE A 263 13.155 -17.243 10.667 1.00 32.12 H new ATOM 0 HA PHE A 263 12.975 -16.089 7.927 1.00 63.41 H new ATOM 0 HB2 PHE A 263 10.947 -17.260 9.905 1.00 11.02 H new ATOM 0 HB3 PHE A 263 10.473 -16.391 8.458 1.00 11.02 H new ATOM 0 HD1 PHE A 263 11.122 -17.346 6.213 1.00 53.43 H new ATOM 0 HD2 PHE A 263 11.542 -19.543 9.800 1.00 53.15 H new ATOM 0 HE1 PHE A 263 11.243 -19.468 4.898 1.00 60.50 H new ATOM 0 HE2 PHE A 263 11.663 -21.666 8.485 1.00 40.32 H new ATOM 0 HZ PHE A 263 11.512 -21.603 6.050 1.00 63.11 H new ATOM 280 N ILE A 264 12.422 -13.846 8.709 1.00 40.14 N ATOM 281 CA ILE A 264 12.205 -12.482 9.160 1.00 54.24 C ATOM 282 C ILE A 264 11.271 -11.768 8.180 1.00 32.12 C ATOM 283 O ILE A 264 11.682 -11.399 7.081 1.00 24.32 O ATOM 284 CB ILE A 264 13.541 -11.767 9.367 1.00 2.31 C ATOM 285 CG1 ILE A 264 14.383 -12.475 10.431 1.00 14.20 C ATOM 286 CG2 ILE A 264 13.327 -10.288 9.697 1.00 75.14 C ATOM 287 CD1 ILE A 264 15.678 -11.708 10.706 1.00 54.22 C ATOM 0 H ILE A 264 12.664 -13.935 7.722 1.00 40.14 H new ATOM 0 HA ILE A 264 11.713 -12.476 10.133 1.00 54.24 H new ATOM 0 HB ILE A 264 14.100 -11.811 8.432 1.00 2.31 H new ATOM 0 HG12 ILE A 264 13.808 -12.567 11.353 1.00 14.20 H new ATOM 0 HG13 ILE A 264 14.619 -13.486 10.100 1.00 14.20 H new ATOM 0 HG21 ILE A 264 14.293 -9.803 9.839 1.00 75.14 H new ATOM 0 HG22 ILE A 264 12.796 -9.805 8.876 1.00 75.14 H new ATOM 0 HG23 ILE A 264 12.739 -10.200 10.611 1.00 75.14 H new ATOM 0 HD11 ILE A 264 16.257 -12.233 11.466 1.00 54.22 H new ATOM 0 HD12 ILE A 264 16.262 -11.639 9.788 1.00 54.22 H new ATOM 0 HD13 ILE A 264 15.439 -10.705 11.060 1.00 54.22 H new ATOM 299 N LEU A 265 10.031 -11.595 8.614 1.00 50.30 N ATOM 300 CA LEU A 265 9.035 -10.932 7.789 1.00 4.41 C ATOM 301 C LEU A 265 8.964 -9.452 8.174 1.00 72.54 C ATOM 302 O LEU A 265 8.812 -9.119 9.348 1.00 62.31 O ATOM 303 CB LEU A 265 7.692 -11.657 7.884 1.00 73.33 C ATOM 304 CG LEU A 265 7.760 -13.163 8.148 1.00 53.20 C ATOM 305 CD1 LEU A 265 7.758 -13.457 9.649 1.00 14.54 C ATOM 306 CD2 LEU A 265 6.634 -13.899 7.418 1.00 3.03 C ATOM 0 H LEU A 265 9.693 -11.902 9.526 1.00 50.30 H new ATOM 0 HA LEU A 265 9.320 -10.975 6.738 1.00 4.41 H new ATOM 0 HB2 LEU A 265 7.108 -11.195 8.680 1.00 73.33 H new ATOM 0 HB3 LEU A 265 7.148 -11.495 6.954 1.00 73.33 H new ATOM 0 HG LEU A 265 8.702 -13.538 7.748 1.00 53.20 H new ATOM 0 HD11 LEU A 265 7.807 -14.534 9.809 1.00 14.54 H new ATOM 0 HD12 LEU A 265 8.622 -12.982 10.114 1.00 14.54 H new ATOM 0 HD13 LEU A 265 6.844 -13.065 10.095 1.00 14.54 H new ATOM 0 HD21 LEU A 265 6.705 -14.967 7.622 1.00 3.03 H new ATOM 0 HD22 LEU A 265 5.670 -13.527 7.766 1.00 3.03 H new ATOM 0 HD23 LEU A 265 6.723 -13.728 6.345 1.00 3.03 H new ATOM 318 N TYR A 266 9.076 -8.605 7.162 1.00 44.24 N ATOM 319 CA TYR A 266 9.026 -7.169 7.379 1.00 44.10 C ATOM 320 C TYR A 266 7.786 -6.558 6.724 1.00 34.13 C ATOM 321 O TYR A 266 7.662 -6.556 5.500 1.00 25.24 O ATOM 322 CB TYR A 266 10.276 -6.597 6.707 1.00 25.05 C ATOM 323 CG TYR A 266 11.529 -7.456 6.891 1.00 43.23 C ATOM 324 CD1 TYR A 266 11.784 -8.499 6.024 1.00 72.14 C ATOM 325 CD2 TYR A 266 12.405 -7.187 7.923 1.00 20.40 C ATOM 326 CE1 TYR A 266 12.963 -9.307 6.196 1.00 31.41 C ATOM 327 CE2 TYR A 266 13.584 -7.996 8.095 1.00 2.35 C ATOM 328 CZ TYR A 266 13.805 -9.016 7.223 1.00 10.25 C ATOM 329 OH TYR A 266 14.919 -9.779 7.386 1.00 33.23 O ATOM 0 H TYR A 266 9.201 -8.885 6.189 1.00 44.24 H new ATOM 0 HA TYR A 266 8.983 -6.944 8.445 1.00 44.10 H new ATOM 0 HB2 TYR A 266 10.082 -6.480 5.641 1.00 25.05 H new ATOM 0 HB3 TYR A 266 10.468 -5.602 7.107 1.00 25.05 H new ATOM 0 HD1 TYR A 266 11.099 -8.709 5.216 1.00 72.14 H new ATOM 0 HD2 TYR A 266 12.206 -6.370 8.601 1.00 20.40 H new ATOM 0 HE1 TYR A 266 13.174 -10.126 5.524 1.00 31.41 H new ATOM 0 HE2 TYR A 266 14.277 -7.797 8.899 1.00 2.35 H new ATOM 0 HH TYR A 266 15.541 -9.324 7.991 1.00 33.23 H new ATOM 339 N ASN A 267 6.898 -6.055 7.569 1.00 55.53 N ATOM 340 CA ASN A 267 5.671 -5.442 7.088 1.00 72.25 C ATOM 341 C ASN A 267 5.997 -4.092 6.447 1.00 42.40 C ATOM 342 O ASN A 267 5.954 -3.058 7.113 1.00 72.23 O ATOM 343 CB ASN A 267 4.691 -5.196 8.236 1.00 33.12 C ATOM 344 CG ASN A 267 3.458 -4.431 7.751 1.00 51.02 C ATOM 345 OD1 ASN A 267 2.851 -4.755 6.743 1.00 1.02 O ATOM 346 ND2 ASN A 267 3.123 -3.400 8.522 1.00 71.25 N ATOM 0 H ASN A 267 7.004 -6.059 8.584 1.00 55.53 H new ATOM 0 HA ASN A 267 5.217 -6.120 6.365 1.00 72.25 H new ATOM 0 HB2 ASN A 267 4.385 -6.149 8.668 1.00 33.12 H new ATOM 0 HB3 ASN A 267 5.186 -4.632 9.026 1.00 33.12 H new ATOM 0 HD21 ASN A 267 2.315 -2.826 8.283 1.00 71.25 H new ATOM 0 HD22 ASN A 267 3.675 -3.184 9.352 1.00 71.25 H new ATOM 353 N LYS A 268 6.317 -4.144 5.162 1.00 13.12 N ATOM 354 CA LYS A 268 6.650 -2.937 4.424 1.00 23.44 C ATOM 355 C LYS A 268 5.407 -2.435 3.687 1.00 20.52 C ATOM 356 O LYS A 268 5.514 -1.843 2.615 1.00 51.23 O ATOM 357 CB LYS A 268 7.851 -3.184 3.508 1.00 34.33 C ATOM 358 CG LYS A 268 9.002 -3.837 4.277 1.00 54.14 C ATOM 359 CD LYS A 268 9.985 -2.783 4.791 1.00 72.24 C ATOM 360 CE LYS A 268 9.404 -2.030 5.989 1.00 51.43 C ATOM 361 NZ LYS A 268 10.487 -1.564 6.883 1.00 44.01 N ATOM 0 H LYS A 268 6.353 -5.003 4.613 1.00 13.12 H new ATOM 0 HA LYS A 268 6.957 -2.145 5.107 1.00 23.44 H new ATOM 0 HB2 LYS A 268 7.554 -3.825 2.678 1.00 34.33 H new ATOM 0 HB3 LYS A 268 8.185 -2.240 3.078 1.00 34.33 H new ATOM 0 HG2 LYS A 268 8.605 -4.409 5.116 1.00 54.14 H new ATOM 0 HG3 LYS A 268 9.524 -4.541 3.629 1.00 54.14 H new ATOM 0 HD2 LYS A 268 10.921 -3.262 5.077 1.00 72.24 H new ATOM 0 HD3 LYS A 268 10.219 -2.079 3.993 1.00 72.24 H new ATOM 0 HE2 LYS A 268 8.819 -1.178 5.642 1.00 51.43 H new ATOM 0 HE3 LYS A 268 8.724 -2.680 6.540 1.00 51.43 H new ATOM 0 HZ1 LYS A 268 10.177 -1.641 7.873 1.00 44.01 H new ATOM 0 HZ2 LYS A 268 11.333 -2.151 6.738 1.00 44.01 H new ATOM 0 HZ3 LYS A 268 10.713 -0.572 6.667 1.00 44.01 H new ATOM 374 N THR A 269 4.256 -2.691 4.292 1.00 62.11 N ATOM 375 CA THR A 269 2.994 -2.273 3.706 1.00 10.33 C ATOM 376 C THR A 269 2.465 -1.024 4.415 1.00 45.13 C ATOM 377 O THR A 269 2.623 -0.879 5.626 1.00 21.41 O ATOM 378 CB THR A 269 2.029 -3.459 3.765 1.00 3.31 C ATOM 379 OG1 THR A 269 1.559 -3.457 5.110 1.00 34.00 O ATOM 380 CG2 THR A 269 2.745 -4.803 3.622 1.00 21.45 C ATOM 0 H THR A 269 4.171 -3.183 5.182 1.00 62.11 H new ATOM 0 HA THR A 269 3.118 -1.988 2.661 1.00 10.33 H new ATOM 0 HB THR A 269 1.283 -3.360 2.977 1.00 3.31 H new ATOM 0 HG1 THR A 269 2.005 -4.170 5.614 1.00 34.00 H new ATOM 0 HG21 THR A 269 2.015 -5.611 3.671 1.00 21.45 H new ATOM 0 HG22 THR A 269 3.263 -4.839 2.664 1.00 21.45 H new ATOM 0 HG23 THR A 269 3.468 -4.918 4.430 1.00 21.45 H new ATOM 388 N ASN A 270 1.849 -0.153 3.629 1.00 22.10 N ATOM 389 CA ASN A 270 1.297 1.079 4.166 1.00 75.11 C ATOM 390 C ASN A 270 0.488 0.764 5.426 1.00 23.51 C ATOM 391 O ASN A 270 0.720 1.354 6.480 1.00 31.43 O ATOM 392 CB ASN A 270 0.359 1.747 3.158 1.00 3.21 C ATOM 393 CG ASN A 270 1.040 1.905 1.797 1.00 21.21 C ATOM 394 OD1 ASN A 270 0.599 1.379 0.788 1.00 14.15 O ATOM 395 ND2 ASN A 270 2.137 2.656 1.825 1.00 63.02 N ATOM 0 H ASN A 270 1.720 -0.276 2.625 1.00 22.10 H new ATOM 0 HA ASN A 270 2.126 1.751 4.389 1.00 75.11 H new ATOM 0 HB2 ASN A 270 -0.547 1.151 3.048 1.00 3.21 H new ATOM 0 HB3 ASN A 270 0.054 2.724 3.532 1.00 3.21 H new ATOM 0 HD21 ASN A 270 2.664 2.821 0.967 1.00 63.02 H new ATOM 0 HD22 ASN A 270 2.451 3.067 2.704 1.00 63.02 H new ATOM 402 N ILE A 271 -0.444 -0.166 5.276 1.00 65.24 N ATOM 403 CA ILE A 271 -1.287 -0.567 6.389 1.00 74.15 C ATOM 404 C ILE A 271 -0.416 -1.169 7.493 1.00 41.51 C ATOM 405 O ILE A 271 0.797 -1.293 7.333 1.00 44.51 O ATOM 406 CB ILE A 271 -2.401 -1.500 5.908 1.00 51.53 C ATOM 407 CG1 ILE A 271 -1.822 -2.730 5.206 1.00 3.42 C ATOM 408 CG2 ILE A 271 -3.398 -0.751 5.021 1.00 14.32 C ATOM 409 CD1 ILE A 271 -2.893 -3.803 5.008 1.00 34.52 C ATOM 0 H ILE A 271 -0.634 -0.653 4.400 1.00 65.24 H new ATOM 0 HA ILE A 271 -1.790 0.300 6.817 1.00 74.15 H new ATOM 0 HB ILE A 271 -2.949 -1.856 6.781 1.00 51.53 H new ATOM 0 HG12 ILE A 271 -1.409 -2.441 4.240 1.00 3.42 H new ATOM 0 HG13 ILE A 271 -1.000 -3.136 5.795 1.00 3.42 H new ATOM 0 HG21 ILE A 271 -4.179 -1.436 4.693 1.00 14.32 H new ATOM 0 HG22 ILE A 271 -3.846 0.066 5.587 1.00 14.32 H new ATOM 0 HG23 ILE A 271 -2.880 -0.348 4.151 1.00 14.32 H new ATOM 0 HD11 ILE A 271 -2.455 -4.666 4.507 1.00 34.52 H new ATOM 0 HD12 ILE A 271 -3.287 -4.107 5.978 1.00 34.52 H new ATOM 0 HD13 ILE A 271 -3.702 -3.401 4.398 1.00 34.52 H new ATOM 421 N ILE A 272 -1.069 -1.526 8.589 1.00 63.20 N ATOM 422 CA ILE A 272 -0.368 -2.112 9.720 1.00 55.44 C ATOM 423 C ILE A 272 -0.911 -3.519 9.977 1.00 14.32 C ATOM 424 O ILE A 272 -2.122 -3.734 9.955 1.00 32.35 O ATOM 425 CB ILE A 272 -0.450 -1.188 10.937 1.00 75.40 C ATOM 426 CG1 ILE A 272 0.318 0.112 10.692 1.00 60.31 C ATOM 427 CG2 ILE A 272 0.025 -1.906 12.202 1.00 2.30 C ATOM 428 CD1 ILE A 272 -0.275 1.262 11.508 1.00 33.44 C ATOM 0 H ILE A 272 -2.075 -1.421 8.718 1.00 63.20 H new ATOM 0 HA ILE A 272 0.694 -2.216 9.499 1.00 55.44 H new ATOM 0 HB ILE A 272 -1.495 -0.919 11.092 1.00 75.40 H new ATOM 0 HG12 ILE A 272 1.366 -0.025 10.959 1.00 60.31 H new ATOM 0 HG13 ILE A 272 0.289 0.361 9.631 1.00 60.31 H new ATOM 0 HG21 ILE A 272 -0.043 -1.228 13.053 1.00 2.30 H new ATOM 0 HG22 ILE A 272 -0.603 -2.779 12.383 1.00 2.30 H new ATOM 0 HG23 ILE A 272 1.060 -2.224 12.073 1.00 2.30 H new ATOM 0 HD11 ILE A 272 0.290 2.174 11.315 1.00 33.44 H new ATOM 0 HD12 ILE A 272 -1.316 1.412 11.222 1.00 33.44 H new ATOM 0 HD13 ILE A 272 -0.222 1.020 12.569 1.00 33.44 H new ATOM 440 N ILE A 273 0.011 -4.440 10.215 1.00 13.21 N ATOM 441 CA ILE A 273 -0.360 -5.820 10.477 1.00 72.15 C ATOM 442 C ILE A 273 -1.184 -5.887 11.764 1.00 20.21 C ATOM 443 O ILE A 273 -0.884 -5.193 12.734 1.00 22.12 O ATOM 444 CB ILE A 273 0.881 -6.715 10.493 1.00 10.42 C ATOM 445 CG1 ILE A 273 1.183 -7.259 9.096 1.00 60.43 C ATOM 446 CG2 ILE A 273 0.736 -7.834 11.526 1.00 61.10 C ATOM 447 CD1 ILE A 273 0.946 -6.190 8.027 1.00 33.23 C ATOM 0 H ILE A 273 1.014 -4.258 10.232 1.00 13.21 H new ATOM 0 HA ILE A 273 -0.990 -6.204 9.675 1.00 72.15 H new ATOM 0 HB ILE A 273 1.736 -6.109 10.793 1.00 10.42 H new ATOM 0 HG12 ILE A 273 2.217 -7.600 9.051 1.00 60.43 H new ATOM 0 HG13 ILE A 273 0.552 -8.125 8.895 1.00 60.43 H new ATOM 0 HG21 ILE A 273 1.631 -8.456 11.517 1.00 61.10 H new ATOM 0 HG22 ILE A 273 0.606 -7.400 12.517 1.00 61.10 H new ATOM 0 HG23 ILE A 273 -0.133 -8.445 11.281 1.00 61.10 H new ATOM 0 HD11 ILE A 273 1.168 -6.604 7.043 1.00 33.23 H new ATOM 0 HD12 ILE A 273 -0.095 -5.868 8.059 1.00 33.23 H new ATOM 0 HD13 ILE A 273 1.596 -5.336 8.217 1.00 33.23 H new ATOM 459 N PRO A 274 -2.233 -6.752 11.731 1.00 55.54 N ATOM 460 CA PRO A 274 -3.103 -6.918 12.883 1.00 63.31 C ATOM 461 C PRO A 274 -2.415 -7.741 13.974 1.00 21.40 C ATOM 462 O PRO A 274 -2.628 -7.505 15.162 1.00 4.32 O ATOM 463 CB PRO A 274 -4.356 -7.584 12.338 1.00 44.05 C ATOM 464 CG PRO A 274 -3.959 -8.185 10.999 1.00 71.21 C ATOM 465 CD PRO A 274 -2.619 -7.590 10.599 1.00 0.21 C ATOM 0 HA PRO A 274 -3.349 -5.971 13.364 1.00 63.31 H new ATOM 0 HB2 PRO A 274 -4.717 -8.354 13.020 1.00 44.05 H new ATOM 0 HB3 PRO A 274 -5.162 -6.860 12.218 1.00 44.05 H new ATOM 0 HG2 PRO A 274 -3.888 -9.270 11.074 1.00 71.21 H new ATOM 0 HG3 PRO A 274 -4.714 -7.967 10.244 1.00 71.21 H new ATOM 0 HD2 PRO A 274 -1.880 -8.369 10.413 1.00 0.21 H new ATOM 0 HD3 PRO A 274 -2.703 -7.005 9.683 1.00 0.21 H new ATOM 473 N GLY A 275 -1.604 -8.691 13.532 1.00 71.34 N ATOM 474 CA GLY A 275 -0.884 -9.551 14.456 1.00 44.34 C ATOM 475 C GLY A 275 -1.729 -10.764 14.849 1.00 51.22 C ATOM 476 O GLY A 275 -2.879 -10.886 14.429 1.00 0.35 O ATOM 0 H GLY A 275 -1.429 -8.884 12.546 1.00 71.34 H new ATOM 0 HA2 GLY A 275 0.047 -9.885 13.997 1.00 44.34 H new ATOM 0 HA3 GLY A 275 -0.615 -8.987 15.349 1.00 44.34 H new ATOM 480 N ASN A 276 -1.126 -11.630 15.649 1.00 34.45 N ATOM 481 CA ASN A 276 -1.810 -12.830 16.104 1.00 45.30 C ATOM 482 C ASN A 276 -2.051 -13.757 14.911 1.00 12.21 C ATOM 483 O ASN A 276 -2.998 -14.542 14.912 1.00 12.32 O ATOM 484 CB ASN A 276 -3.168 -12.490 16.721 1.00 5.41 C ATOM 485 CG ASN A 276 -3.589 -13.552 17.738 1.00 73.21 C ATOM 486 OD1 ASN A 276 -3.209 -13.525 18.897 1.00 61.22 O ATOM 487 ND2 ASN A 276 -4.394 -14.487 17.241 1.00 14.10 N ATOM 0 H ASN A 276 -0.172 -11.526 15.994 1.00 34.45 H new ATOM 0 HA ASN A 276 -1.184 -13.311 16.855 1.00 45.30 H new ATOM 0 HB2 ASN A 276 -3.117 -11.516 17.207 1.00 5.41 H new ATOM 0 HB3 ASN A 276 -3.920 -12.415 15.935 1.00 5.41 H new ATOM 0 HD21 ASN A 276 -4.731 -15.241 17.840 1.00 14.10 H new ATOM 0 HD22 ASN A 276 -4.674 -14.450 16.261 1.00 14.10 H new ATOM 494 N CYS A 277 -1.178 -13.635 13.922 1.00 73.42 N ATOM 495 CA CYS A 277 -1.285 -14.453 12.725 1.00 1.22 C ATOM 496 C CYS A 277 -0.810 -15.867 13.065 1.00 4.33 C ATOM 497 O CYS A 277 -0.475 -16.153 14.214 1.00 61.43 O ATOM 498 CB CYS A 277 -0.499 -13.852 11.558 1.00 52.11 C ATOM 499 SG CYS A 277 -1.528 -12.619 10.680 1.00 4.43 S ATOM 0 H CYS A 277 -0.394 -12.983 13.925 1.00 73.42 H new ATOM 0 HA CYS A 277 -2.324 -14.489 12.398 1.00 1.22 H new ATOM 0 HB2 CYS A 277 0.412 -13.381 11.927 1.00 52.11 H new ATOM 0 HB3 CYS A 277 -0.194 -14.640 10.870 1.00 52.11 H new ATOM 0 HG CYS A 277 -2.377 -13.232 9.909 1.00 4.43 H new ATOM 505 N THR A 278 -0.795 -16.713 12.046 1.00 12.00 N ATOM 506 CA THR A 278 -0.367 -18.090 12.223 1.00 65.13 C ATOM 507 C THR A 278 0.159 -18.658 10.903 1.00 30.40 C ATOM 508 O THR A 278 -0.622 -19.059 10.041 1.00 64.11 O ATOM 509 CB THR A 278 -1.542 -18.881 12.800 1.00 53.04 C ATOM 510 OG1 THR A 278 -2.149 -17.979 13.721 1.00 4.01 O ATOM 511 CG2 THR A 278 -1.088 -20.054 13.671 1.00 41.04 C ATOM 0 H THR A 278 -1.072 -16.472 11.095 1.00 12.00 H new ATOM 0 HA THR A 278 0.464 -18.159 12.925 1.00 65.13 H new ATOM 0 HB THR A 278 -2.163 -19.254 11.985 1.00 53.04 H new ATOM 0 HG1 THR A 278 -2.922 -18.411 14.141 1.00 4.01 H new ATOM 0 HG21 THR A 278 -1.961 -20.581 14.055 1.00 41.04 H new ATOM 0 HG22 THR A 278 -0.484 -20.738 13.074 1.00 41.04 H new ATOM 0 HG23 THR A 278 -0.494 -19.680 14.505 1.00 41.04 H new ATOM 519 N PHE A 279 1.479 -18.675 10.787 1.00 74.23 N ATOM 520 CA PHE A 279 2.118 -19.188 9.587 1.00 53.24 C ATOM 521 C PHE A 279 1.647 -20.611 9.280 1.00 25.33 C ATOM 522 O PHE A 279 0.970 -21.234 10.096 1.00 15.12 O ATOM 523 CB PHE A 279 3.624 -19.208 9.856 1.00 53.34 C ATOM 524 CG PHE A 279 4.477 -18.813 8.648 1.00 14.43 C ATOM 525 CD1 PHE A 279 4.137 -17.727 7.902 1.00 63.40 C ATOM 526 CD2 PHE A 279 5.574 -19.547 8.322 1.00 51.55 C ATOM 527 CE1 PHE A 279 4.929 -17.361 6.782 1.00 51.24 C ATOM 528 CE2 PHE A 279 6.365 -19.180 7.201 1.00 5.10 C ATOM 529 CZ PHE A 279 6.026 -18.095 6.455 1.00 42.33 C ATOM 0 H PHE A 279 2.123 -18.342 11.504 1.00 74.23 H new ATOM 0 HA PHE A 279 1.866 -18.559 8.733 1.00 53.24 H new ATOM 0 HB2 PHE A 279 3.844 -18.530 10.681 1.00 53.34 H new ATOM 0 HB3 PHE A 279 3.912 -20.208 10.180 1.00 53.34 H new ATOM 0 HD1 PHE A 279 3.266 -17.144 8.162 1.00 63.40 H new ATOM 0 HD2 PHE A 279 5.844 -20.408 8.915 1.00 51.55 H new ATOM 0 HE1 PHE A 279 4.660 -16.499 6.189 1.00 51.24 H new ATOM 0 HE2 PHE A 279 7.236 -19.763 6.941 1.00 5.10 H new ATOM 0 HZ PHE A 279 6.628 -17.816 5.603 1.00 42.33 H new ATOM 539 N GLU A 280 2.026 -21.085 8.102 1.00 1.33 N ATOM 540 CA GLU A 280 1.652 -22.423 7.678 1.00 33.11 C ATOM 541 C GLU A 280 2.574 -22.901 6.555 1.00 72.33 C ATOM 542 O GLU A 280 2.239 -22.779 5.378 1.00 73.15 O ATOM 543 CB GLU A 280 0.186 -22.470 7.242 1.00 61.12 C ATOM 544 CG GLU A 280 -0.219 -23.888 6.833 1.00 12.31 C ATOM 545 CD GLU A 280 -1.742 -24.031 6.788 1.00 61.02 C ATOM 546 OE1 GLU A 280 -2.464 -23.105 7.187 1.00 62.22 O ATOM 547 OE2 GLU A 280 -2.170 -25.153 6.316 1.00 11.22 O ATOM 0 H GLU A 280 2.588 -20.566 7.428 1.00 1.33 H new ATOM 0 HA GLU A 280 1.766 -23.097 8.527 1.00 33.11 H new ATOM 0 HB2 GLU A 280 -0.451 -22.127 8.057 1.00 61.12 H new ATOM 0 HB3 GLU A 280 0.029 -21.788 6.406 1.00 61.12 H new ATOM 0 HG2 GLU A 280 0.201 -24.122 5.855 1.00 12.31 H new ATOM 0 HG3 GLU A 280 0.197 -24.607 7.539 1.00 12.31 H new ATOM 555 N PHE A 281 3.717 -23.436 6.958 1.00 40.11 N ATOM 556 CA PHE A 281 4.690 -23.933 6.000 1.00 52.01 C ATOM 557 C PHE A 281 4.868 -25.447 6.135 1.00 40.44 C ATOM 558 O PHE A 281 5.019 -25.961 7.241 1.00 23.45 O ATOM 559 CB PHE A 281 6.020 -23.245 6.315 1.00 55.13 C ATOM 560 CG PHE A 281 6.595 -23.601 7.687 1.00 60.22 C ATOM 561 CD1 PHE A 281 6.083 -23.028 8.809 1.00 74.22 C ATOM 562 CD2 PHE A 281 7.619 -24.491 7.785 1.00 50.14 C ATOM 563 CE1 PHE A 281 6.617 -23.359 10.082 1.00 12.12 C ATOM 564 CE2 PHE A 281 8.153 -24.822 9.058 1.00 2.40 C ATOM 565 CZ PHE A 281 7.641 -24.249 10.180 1.00 12.50 C ATOM 0 H PHE A 281 3.991 -23.536 7.935 1.00 40.11 H new ATOM 0 HA PHE A 281 4.354 -23.723 4.985 1.00 52.01 H new ATOM 0 HB2 PHE A 281 6.746 -23.512 5.548 1.00 55.13 H new ATOM 0 HB3 PHE A 281 5.881 -22.165 6.260 1.00 55.13 H new ATOM 0 HD1 PHE A 281 5.270 -22.321 8.732 1.00 74.22 H new ATOM 0 HD2 PHE A 281 8.026 -24.946 6.894 1.00 50.14 H new ATOM 0 HE1 PHE A 281 6.210 -22.904 10.973 1.00 12.12 H new ATOM 0 HE2 PHE A 281 8.966 -25.529 9.135 1.00 2.40 H new ATOM 0 HZ PHE A 281 8.047 -24.500 11.149 1.00 12.50 H new ATOM 575 N SER A 282 4.844 -26.117 4.992 1.00 21.11 N ATOM 576 CA SER A 282 5.001 -27.561 4.969 1.00 62.54 C ATOM 577 C SER A 282 6.092 -27.953 3.969 1.00 33.14 C ATOM 578 O SER A 282 6.788 -27.091 3.436 1.00 64.11 O ATOM 579 CB SER A 282 3.683 -28.253 4.614 1.00 23.00 C ATOM 580 OG SER A 282 3.637 -29.593 5.097 1.00 15.24 O ATOM 0 H SER A 282 4.718 -25.687 4.076 1.00 21.11 H new ATOM 0 HA SER A 282 5.295 -27.889 5.966 1.00 62.54 H new ATOM 0 HB2 SER A 282 2.852 -27.687 5.035 1.00 23.00 H new ATOM 0 HB3 SER A 282 3.553 -28.253 3.532 1.00 23.00 H new ATOM 0 HG SER A 282 3.949 -29.617 6.026 1.00 15.24 H new ATOM 586 N SER A 283 6.206 -29.254 3.746 1.00 34.13 N ATOM 587 CA SER A 283 7.200 -29.770 2.821 1.00 75.53 C ATOM 588 C SER A 283 6.654 -31.007 2.103 1.00 52.40 C ATOM 589 O SER A 283 5.679 -31.608 2.550 1.00 74.41 O ATOM 590 CB SER A 283 8.503 -30.110 3.546 1.00 44.15 C ATOM 591 OG SER A 283 9.408 -30.826 2.709 1.00 4.42 O ATOM 0 H SER A 283 5.626 -29.966 4.190 1.00 34.13 H new ATOM 0 HA SER A 283 7.417 -28.996 2.085 1.00 75.53 H new ATOM 0 HB2 SER A 283 8.977 -29.191 3.890 1.00 44.15 H new ATOM 0 HB3 SER A 283 8.281 -30.705 4.432 1.00 44.15 H new ATOM 0 HG SER A 283 9.623 -30.285 1.921 1.00 4.42 H new ATOM 660 N VAL A 288 2.913 -30.146 7.437 1.00 32.14 N ATOM 661 CA VAL A 288 2.726 -28.715 7.603 1.00 4.40 C ATOM 662 C VAL A 288 2.933 -28.345 9.073 1.00 13.52 C ATOM 663 O VAL A 288 2.910 -29.212 9.945 1.00 60.45 O ATOM 664 CB VAL A 288 1.354 -28.300 7.069 1.00 33.32 C ATOM 665 CG1 VAL A 288 0.234 -29.039 7.804 1.00 32.52 C ATOM 666 CG2 VAL A 288 1.164 -26.785 7.162 1.00 72.00 C ATOM 0 HA VAL A 288 3.465 -28.164 7.022 1.00 4.40 H new ATOM 0 HB VAL A 288 1.306 -28.579 6.016 1.00 33.32 H new ATOM 0 HG11 VAL A 288 -0.731 -28.726 7.406 1.00 32.52 H new ATOM 0 HG12 VAL A 288 0.354 -30.113 7.663 1.00 32.52 H new ATOM 0 HG13 VAL A 288 0.281 -28.805 8.868 1.00 32.52 H new ATOM 0 HG21 VAL A 288 0.181 -26.517 6.776 1.00 72.00 H new ATOM 0 HG22 VAL A 288 1.243 -26.472 8.203 1.00 72.00 H new ATOM 0 HG23 VAL A 288 1.933 -26.285 6.574 1.00 72.00 H new ATOM 676 N PHE A 289 3.129 -27.055 9.304 1.00 41.33 N ATOM 677 CA PHE A 289 3.339 -26.559 10.653 1.00 22.13 C ATOM 678 C PHE A 289 2.762 -25.152 10.817 1.00 51.43 C ATOM 679 O PHE A 289 2.962 -24.291 9.961 1.00 61.44 O ATOM 680 CB PHE A 289 4.851 -26.507 10.880 1.00 4.32 C ATOM 681 CG PHE A 289 5.278 -26.837 12.312 1.00 74.40 C ATOM 682 CD1 PHE A 289 4.966 -25.988 13.328 1.00 61.05 C ATOM 683 CD2 PHE A 289 5.968 -27.980 12.569 1.00 30.51 C ATOM 684 CE1 PHE A 289 5.362 -26.295 14.656 1.00 12.12 C ATOM 685 CE2 PHE A 289 6.364 -28.287 13.898 1.00 73.31 C ATOM 686 CZ PHE A 289 6.052 -27.438 14.913 1.00 2.05 C ATOM 0 H PHE A 289 3.147 -26.338 8.579 1.00 41.33 H new ATOM 0 HA PHE A 289 2.842 -27.212 11.370 1.00 22.13 H new ATOM 0 HB2 PHE A 289 5.335 -27.206 10.198 1.00 4.32 H new ATOM 0 HB3 PHE A 289 5.212 -25.511 10.625 1.00 4.32 H new ATOM 0 HD1 PHE A 289 4.417 -25.081 13.124 1.00 61.05 H new ATOM 0 HD2 PHE A 289 6.215 -28.655 11.763 1.00 30.51 H new ATOM 0 HE1 PHE A 289 5.115 -25.620 15.463 1.00 12.12 H new ATOM 0 HE2 PHE A 289 6.913 -29.195 14.102 1.00 73.31 H new ATOM 0 HZ PHE A 289 6.352 -27.672 15.924 1.00 2.05 H new ATOM 696 N SER A 290 2.057 -24.960 11.922 1.00 32.51 N ATOM 697 CA SER A 290 1.449 -23.672 12.209 1.00 60.23 C ATOM 698 C SER A 290 2.074 -23.067 13.467 1.00 31.24 C ATOM 699 O SER A 290 1.965 -23.635 14.553 1.00 2.12 O ATOM 700 CB SER A 290 -0.066 -23.803 12.379 1.00 62.53 C ATOM 701 OG SER A 290 -0.416 -24.913 13.202 1.00 54.23 O ATOM 0 H SER A 290 1.893 -25.676 12.630 1.00 32.51 H new ATOM 0 HA SER A 290 1.636 -23.010 11.364 1.00 60.23 H new ATOM 0 HB2 SER A 290 -0.462 -22.887 12.817 1.00 62.53 H new ATOM 0 HB3 SER A 290 -0.532 -23.916 11.400 1.00 62.53 H new ATOM 0 HG SER A 290 0.187 -24.952 13.973 1.00 54.23 H new ATOM 707 N ILE A 291 2.715 -21.923 13.280 1.00 53.12 N ATOM 708 CA ILE A 291 3.357 -21.235 14.387 1.00 41.44 C ATOM 709 C ILE A 291 2.532 -20.003 14.764 1.00 54.12 C ATOM 710 O ILE A 291 2.198 -19.188 13.905 1.00 73.21 O ATOM 711 CB ILE A 291 4.815 -20.917 14.047 1.00 72.53 C ATOM 712 CG1 ILE A 291 5.723 -22.108 14.361 1.00 32.14 C ATOM 713 CG2 ILE A 291 5.277 -19.641 14.753 1.00 23.41 C ATOM 714 CD1 ILE A 291 7.085 -21.954 13.681 1.00 14.14 C ATOM 0 H ILE A 291 2.804 -21.455 12.378 1.00 53.12 H new ATOM 0 HA ILE A 291 3.391 -21.878 15.266 1.00 41.44 H new ATOM 0 HB ILE A 291 4.884 -20.734 12.975 1.00 72.53 H new ATOM 0 HG12 ILE A 291 5.858 -22.192 15.439 1.00 32.14 H new ATOM 0 HG13 ILE A 291 5.248 -23.030 14.026 1.00 32.14 H new ATOM 0 HG21 ILE A 291 6.316 -19.438 14.494 1.00 23.41 H new ATOM 0 HG22 ILE A 291 4.654 -18.804 14.437 1.00 23.41 H new ATOM 0 HG23 ILE A 291 5.190 -19.770 15.832 1.00 23.41 H new ATOM 0 HD11 ILE A 291 7.711 -22.814 13.921 1.00 14.14 H new ATOM 0 HD12 ILE A 291 6.948 -21.895 12.601 1.00 14.14 H new ATOM 0 HD13 ILE A 291 7.568 -21.044 14.036 1.00 14.14 H new ATOM 726 N LYS A 292 2.226 -19.906 16.049 1.00 1.13 N ATOM 727 CA LYS A 292 1.446 -18.787 16.551 1.00 71.32 C ATOM 728 C LYS A 292 2.298 -17.517 16.507 1.00 15.14 C ATOM 729 O LYS A 292 3.234 -17.366 17.290 1.00 23.32 O ATOM 730 CB LYS A 292 0.885 -19.105 17.938 1.00 0.54 C ATOM 731 CG LYS A 292 -0.364 -19.982 17.837 1.00 32.24 C ATOM 732 CD LYS A 292 -0.020 -21.363 17.275 1.00 53.34 C ATOM 733 CE LYS A 292 -0.938 -22.438 17.860 1.00 53.30 C ATOM 734 NZ LYS A 292 -0.870 -22.428 19.338 1.00 33.24 N ATOM 0 H LYS A 292 2.504 -20.584 16.758 1.00 1.13 H new ATOM 0 HA LYS A 292 0.578 -18.611 15.915 1.00 71.32 H new ATOM 0 HB2 LYS A 292 1.644 -19.614 18.533 1.00 0.54 H new ATOM 0 HB3 LYS A 292 0.642 -18.178 18.457 1.00 0.54 H new ATOM 0 HG2 LYS A 292 -0.818 -20.089 18.822 1.00 32.24 H new ATOM 0 HG3 LYS A 292 -1.102 -19.498 17.197 1.00 32.24 H new ATOM 0 HD2 LYS A 292 -0.114 -21.351 16.189 1.00 53.34 H new ATOM 0 HD3 LYS A 292 1.018 -21.604 17.502 1.00 53.34 H new ATOM 0 HE2 LYS A 292 -1.964 -22.264 17.536 1.00 53.30 H new ATOM 0 HE3 LYS A 292 -0.646 -23.418 17.483 1.00 53.30 H new ATOM 0 HZ1 LYS A 292 -1.027 -23.391 19.699 1.00 33.24 H new ATOM 0 HZ2 LYS A 292 0.067 -22.093 19.640 1.00 33.24 H new ATOM 0 HZ3 LYS A 292 -1.602 -21.793 19.715 1.00 33.24 H new ATOM 747 N MET A 293 1.942 -16.635 15.584 1.00 34.55 N ATOM 748 CA MET A 293 2.662 -15.383 15.429 1.00 55.03 C ATOM 749 C MET A 293 2.308 -14.404 16.550 1.00 15.00 C ATOM 750 O MET A 293 1.148 -14.301 16.946 1.00 35.31 O ATOM 751 CB MET A 293 2.313 -14.758 14.076 1.00 33.34 C ATOM 752 CG MET A 293 3.034 -15.480 12.936 1.00 30.55 C ATOM 753 SD MET A 293 2.542 -14.788 11.367 1.00 53.03 S ATOM 754 CE MET A 293 3.516 -13.292 11.369 1.00 72.24 C ATOM 0 H MET A 293 1.165 -16.763 14.936 1.00 34.55 H new ATOM 0 HA MET A 293 3.731 -15.591 15.479 1.00 55.03 H new ATOM 0 HB2 MET A 293 1.236 -14.805 13.917 1.00 33.34 H new ATOM 0 HB3 MET A 293 2.590 -13.704 14.076 1.00 33.34 H new ATOM 0 HG2 MET A 293 4.113 -15.388 13.061 1.00 30.55 H new ATOM 0 HG3 MET A 293 2.800 -16.544 12.963 1.00 30.55 H new ATOM 0 HE1 MET A 293 2.863 -12.432 11.221 1.00 72.24 H new ATOM 0 HE2 MET A 293 4.033 -13.196 12.324 1.00 72.24 H new ATOM 0 HE3 MET A 293 4.248 -13.334 10.563 1.00 72.24 H new ATOM 764 N GLY A 294 3.329 -13.709 17.030 1.00 74.40 N ATOM 765 CA GLY A 294 3.140 -12.742 18.098 1.00 71.22 C ATOM 766 C GLY A 294 1.817 -11.991 17.930 1.00 23.42 C ATOM 767 O GLY A 294 1.397 -11.709 16.809 1.00 23.31 O ATOM 0 H GLY A 294 4.290 -13.796 16.699 1.00 74.40 H new ATOM 0 HA2 GLY A 294 3.153 -13.252 19.061 1.00 71.22 H new ATOM 0 HA3 GLY A 294 3.967 -12.032 18.101 1.00 71.22 H new ATOM 771 N PRO A 295 1.181 -11.681 19.092 1.00 62.34 N ATOM 772 CA PRO A 295 -0.085 -10.969 19.084 1.00 0.32 C ATOM 773 C PRO A 295 0.121 -9.487 18.761 1.00 22.51 C ATOM 774 O PRO A 295 -0.791 -8.822 18.274 1.00 15.34 O ATOM 775 CB PRO A 295 -0.674 -11.199 20.466 1.00 0.14 C ATOM 776 CG PRO A 295 0.486 -11.636 21.346 1.00 32.31 C ATOM 777 CD PRO A 295 1.649 -11.999 20.438 1.00 71.55 C ATOM 0 HA PRO A 295 -0.764 -11.328 18.311 1.00 0.32 H new ATOM 0 HB2 PRO A 295 -1.135 -10.289 20.851 1.00 0.14 H new ATOM 0 HB3 PRO A 295 -1.452 -11.962 20.437 1.00 0.14 H new ATOM 0 HG2 PRO A 295 0.770 -10.835 22.028 1.00 32.31 H new ATOM 0 HG3 PRO A 295 0.199 -12.490 21.959 1.00 32.31 H new ATOM 0 HD2 PRO A 295 2.543 -11.429 20.692 1.00 71.55 H new ATOM 0 HD3 PRO A 295 1.908 -13.054 20.528 1.00 71.55 H new ATOM 785 N HIS A 296 1.326 -9.015 19.045 1.00 40.02 N ATOM 786 CA HIS A 296 1.664 -7.625 18.790 1.00 13.23 C ATOM 787 C HIS A 296 1.883 -7.416 17.291 1.00 71.15 C ATOM 788 O HIS A 296 2.449 -8.276 16.617 1.00 54.44 O ATOM 789 CB HIS A 296 2.868 -7.196 19.631 1.00 51.31 C ATOM 790 CG HIS A 296 2.555 -6.997 21.095 1.00 44.11 C ATOM 791 ND1 HIS A 296 2.405 -8.051 21.979 1.00 4.12 N ATOM 792 CD2 HIS A 296 2.367 -5.857 21.819 1.00 5.43 C ATOM 793 CE1 HIS A 296 2.138 -7.556 23.179 1.00 44.43 C ATOM 794 NE2 HIS A 296 2.115 -6.196 23.077 1.00 12.44 N ATOM 0 H HIS A 296 2.080 -9.570 19.449 1.00 40.02 H new ATOM 0 HA HIS A 296 0.836 -6.984 19.093 1.00 13.23 H new ATOM 0 HB2 HIS A 296 3.651 -7.948 19.536 1.00 51.31 H new ATOM 0 HB3 HIS A 296 3.268 -6.267 19.226 1.00 51.31 H new ATOM 0 HD2 HIS A 296 2.415 -4.849 21.434 1.00 5.43 H new ATOM 0 HE1 HIS A 296 1.969 -8.128 24.079 1.00 44.43 H new ATOM 0 HE2 HIS A 296 1.934 -5.546 23.842 1.00 12.44 H new ATOM 802 N GLU A 297 1.423 -6.269 16.812 1.00 63.41 N ATOM 803 CA GLU A 297 1.562 -5.937 15.404 1.00 11.33 C ATOM 804 C GLU A 297 3.041 -5.837 15.025 1.00 31.25 C ATOM 805 O GLU A 297 3.915 -6.133 15.839 1.00 71.01 O ATOM 806 CB GLU A 297 0.822 -4.639 15.072 1.00 25.12 C ATOM 807 CG GLU A 297 -0.648 -4.724 15.487 1.00 23.04 C ATOM 808 CD GLU A 297 -1.462 -3.594 14.854 1.00 74.40 C ATOM 809 OE1 GLU A 297 -2.494 -3.856 14.218 1.00 14.31 O ATOM 810 OE2 GLU A 297 -0.989 -2.409 15.042 1.00 32.21 O ATOM 0 H GLU A 297 0.954 -5.558 17.374 1.00 63.41 H new ATOM 0 HA GLU A 297 1.110 -6.736 14.816 1.00 11.33 H new ATOM 0 HB2 GLU A 297 1.300 -3.803 15.583 1.00 25.12 H new ATOM 0 HB3 GLU A 297 0.891 -4.440 14.002 1.00 25.12 H new ATOM 0 HG2 GLU A 297 -1.060 -5.687 15.185 1.00 23.04 H new ATOM 0 HG3 GLU A 297 -0.727 -4.670 16.573 1.00 23.04 H new ATOM 818 N ILE A 298 3.276 -5.420 13.790 1.00 13.22 N ATOM 819 CA ILE A 298 4.634 -5.278 13.294 1.00 51.33 C ATOM 820 C ILE A 298 4.949 -3.793 13.102 1.00 45.01 C ATOM 821 O ILE A 298 5.688 -3.205 13.890 1.00 44.10 O ATOM 822 CB ILE A 298 4.833 -6.117 12.030 1.00 70.00 C ATOM 823 CG1 ILE A 298 4.904 -7.608 12.367 1.00 2.34 C ATOM 824 CG2 ILE A 298 6.061 -5.647 11.248 1.00 71.15 C ATOM 825 CD1 ILE A 298 4.557 -8.463 11.147 1.00 33.25 C ATOM 0 H ILE A 298 2.549 -5.176 13.118 1.00 13.22 H new ATOM 0 HA ILE A 298 5.348 -5.665 14.021 1.00 51.33 H new ATOM 0 HB ILE A 298 3.966 -5.974 11.385 1.00 70.00 H new ATOM 0 HG12 ILE A 298 5.905 -7.858 12.718 1.00 2.34 H new ATOM 0 HG13 ILE A 298 4.215 -7.834 13.181 1.00 2.34 H new ATOM 0 HG21 ILE A 298 6.180 -6.260 10.354 1.00 71.15 H new ATOM 0 HG22 ILE A 298 5.931 -4.604 10.958 1.00 71.15 H new ATOM 0 HG23 ILE A 298 6.949 -5.742 11.873 1.00 71.15 H new ATOM 0 HD11 ILE A 298 4.615 -9.518 11.414 1.00 33.25 H new ATOM 0 HD12 ILE A 298 3.546 -8.228 10.814 1.00 33.25 H new ATOM 0 HD13 ILE A 298 5.262 -8.253 10.343 1.00 33.25 H new ATOM 837 N GLY A 299 4.374 -3.229 12.050 1.00 33.51 N ATOM 838 CA GLY A 299 4.584 -1.825 11.745 1.00 42.43 C ATOM 839 C GLY A 299 5.138 -1.648 10.329 1.00 30.14 C ATOM 840 O GLY A 299 5.638 -2.600 9.731 1.00 15.22 O ATOM 0 H GLY A 299 3.762 -3.720 11.398 1.00 33.51 H new ATOM 0 HA2 GLY A 299 3.643 -1.284 11.841 1.00 42.43 H new ATOM 0 HA3 GLY A 299 5.276 -1.392 12.467 1.00 42.43 H new ATOM 844 N ILE A 300 5.031 -0.424 9.835 1.00 53.32 N ATOM 845 CA ILE A 300 5.514 -0.110 8.501 1.00 64.21 C ATOM 846 C ILE A 300 7.025 -0.347 8.442 1.00 31.03 C ATOM 847 O ILE A 300 7.562 -0.696 7.392 1.00 52.41 O ATOM 848 CB ILE A 300 5.098 1.306 8.099 1.00 51.10 C ATOM 849 CG1 ILE A 300 3.626 1.347 7.683 1.00 0.52 C ATOM 850 CG2 ILE A 300 6.017 1.859 7.008 1.00 4.34 C ATOM 851 CD1 ILE A 300 3.147 2.790 7.505 1.00 61.44 C ATOM 0 H ILE A 300 4.617 0.363 10.335 1.00 53.32 H new ATOM 0 HA ILE A 300 5.057 -0.772 7.765 1.00 64.21 H new ATOM 0 HB ILE A 300 5.206 1.954 8.969 1.00 51.10 H new ATOM 0 HG12 ILE A 300 3.492 0.798 6.751 1.00 0.52 H new ATOM 0 HG13 ILE A 300 3.017 0.848 8.437 1.00 0.52 H new ATOM 0 HG21 ILE A 300 5.699 2.867 6.741 1.00 4.34 H new ATOM 0 HG22 ILE A 300 7.043 1.888 7.376 1.00 4.34 H new ATOM 0 HG23 ILE A 300 5.965 1.217 6.129 1.00 4.34 H new ATOM 0 HD11 ILE A 300 2.098 2.791 7.209 1.00 61.44 H new ATOM 0 HD12 ILE A 300 3.260 3.329 8.445 1.00 61.44 H new ATOM 0 HD13 ILE A 300 3.742 3.278 6.733 1.00 61.44 H new ATOM 863 N LYS A 301 7.668 -0.148 9.584 1.00 75.23 N ATOM 864 CA LYS A 301 9.106 -0.336 9.675 1.00 15.24 C ATOM 865 C LYS A 301 9.401 -1.567 10.535 1.00 42.42 C ATOM 866 O LYS A 301 10.470 -2.165 10.422 1.00 72.05 O ATOM 867 CB LYS A 301 9.781 0.942 10.177 1.00 25.35 C ATOM 868 CG LYS A 301 9.810 2.013 9.085 1.00 21.40 C ATOM 869 CD LYS A 301 10.459 1.476 7.808 1.00 63.32 C ATOM 870 CE LYS A 301 11.042 2.615 6.968 1.00 32.54 C ATOM 871 NZ LYS A 301 11.714 2.079 5.763 1.00 32.15 N ATOM 0 H LYS A 301 7.220 0.141 10.453 1.00 75.23 H new ATOM 0 HA LYS A 301 9.530 -0.527 8.689 1.00 15.24 H new ATOM 0 HB2 LYS A 301 9.247 1.321 11.049 1.00 25.35 H new ATOM 0 HB3 LYS A 301 10.798 0.718 10.499 1.00 25.35 H new ATOM 0 HG2 LYS A 301 8.794 2.345 8.869 1.00 21.40 H new ATOM 0 HG3 LYS A 301 10.362 2.884 9.439 1.00 21.40 H new ATOM 0 HD2 LYS A 301 11.248 0.769 8.066 1.00 63.32 H new ATOM 0 HD3 LYS A 301 9.720 0.929 7.223 1.00 63.32 H new ATOM 0 HE2 LYS A 301 10.248 3.301 6.674 1.00 32.54 H new ATOM 0 HE3 LYS A 301 11.753 3.187 7.564 1.00 32.54 H new ATOM 0 HZ1 LYS A 301 12.104 2.865 5.204 1.00 32.15 H new ATOM 0 HZ2 LYS A 301 12.485 1.442 6.050 1.00 32.15 H new ATOM 0 HZ3 LYS A 301 11.026 1.553 5.187 1.00 32.15 H new ATOM 884 N GLY A 302 8.435 -1.908 11.375 1.00 43.10 N ATOM 885 CA GLY A 302 8.579 -3.057 12.253 1.00 14.42 C ATOM 886 C GLY A 302 8.807 -4.338 11.448 1.00 55.51 C ATOM 887 O GLY A 302 8.572 -4.366 10.241 1.00 75.21 O ATOM 0 H GLY A 302 7.550 -1.409 11.466 1.00 43.10 H new ATOM 0 HA2 GLY A 302 9.416 -2.897 12.933 1.00 14.42 H new ATOM 0 HA3 GLY A 302 7.685 -3.164 12.867 1.00 14.42 H new ATOM 891 N GLN A 303 9.261 -5.366 12.148 1.00 5.15 N ATOM 892 CA GLN A 303 9.524 -6.646 11.514 1.00 73.42 C ATOM 893 C GLN A 303 8.892 -7.780 12.325 1.00 42.14 C ATOM 894 O GLN A 303 8.265 -7.537 13.354 1.00 2.45 O ATOM 895 CB GLN A 303 11.026 -6.872 11.334 1.00 3.14 C ATOM 896 CG GLN A 303 11.711 -7.101 12.683 1.00 4.32 C ATOM 897 CD GLN A 303 13.157 -6.602 12.655 1.00 5.22 C ATOM 898 OE1 GLN A 303 13.735 -6.351 11.610 1.00 72.10 O ATOM 899 NE2 GLN A 303 13.708 -6.472 13.859 1.00 64.12 N ATOM 0 H GLN A 303 9.454 -5.339 13.149 1.00 5.15 H new ATOM 0 HA GLN A 303 9.071 -6.637 10.523 1.00 73.42 H new ATOM 0 HB2 GLN A 303 11.193 -7.733 10.686 1.00 3.14 H new ATOM 0 HB3 GLN A 303 11.470 -6.009 10.838 1.00 3.14 H new ATOM 0 HG2 GLN A 303 11.159 -6.584 13.468 1.00 4.32 H new ATOM 0 HG3 GLN A 303 11.694 -8.163 12.928 1.00 4.32 H new ATOM 0 HE21 GLN A 303 13.168 -6.699 14.694 1.00 64.12 H new ATOM 0 HE22 GLN A 303 14.670 -6.145 13.947 1.00 64.12 H new ATOM 908 N LYS A 304 9.079 -8.994 11.829 1.00 24.42 N ATOM 909 CA LYS A 304 8.536 -10.166 12.495 1.00 72.12 C ATOM 910 C LYS A 304 9.520 -11.329 12.356 1.00 44.11 C ATOM 911 O LYS A 304 10.186 -11.464 11.330 1.00 32.33 O ATOM 912 CB LYS A 304 7.135 -10.480 11.967 1.00 75.31 C ATOM 913 CG LYS A 304 6.420 -11.486 12.872 1.00 65.41 C ATOM 914 CD LYS A 304 5.974 -10.828 14.179 1.00 50.33 C ATOM 915 CE LYS A 304 4.708 -11.493 14.723 1.00 2.32 C ATOM 916 NZ LYS A 304 4.096 -10.655 15.779 1.00 70.21 N ATOM 0 H LYS A 304 9.599 -9.192 10.974 1.00 24.42 H new ATOM 0 HA LYS A 304 8.415 -9.976 13.562 1.00 72.12 H new ATOM 0 HB2 LYS A 304 6.551 -9.561 11.906 1.00 75.31 H new ATOM 0 HB3 LYS A 304 7.205 -10.881 10.956 1.00 75.31 H new ATOM 0 HG2 LYS A 304 5.554 -11.896 12.353 1.00 65.41 H new ATOM 0 HG3 LYS A 304 7.085 -12.321 13.090 1.00 65.41 H new ATOM 0 HD2 LYS A 304 6.773 -10.899 14.917 1.00 50.33 H new ATOM 0 HD3 LYS A 304 5.789 -9.767 14.012 1.00 50.33 H new ATOM 0 HE2 LYS A 304 3.994 -11.647 13.914 1.00 2.32 H new ATOM 0 HE3 LYS A 304 4.951 -12.476 15.126 1.00 2.32 H new ATOM 0 HZ1 LYS A 304 3.156 -11.030 16.018 1.00 70.21 H new ATOM 0 HZ2 LYS A 304 4.700 -10.668 16.626 1.00 70.21 H new ATOM 0 HZ3 LYS A 304 4.002 -9.678 15.436 1.00 70.21 H new ATOM 929 N GLU A 305 9.582 -12.139 13.403 1.00 50.52 N ATOM 930 CA GLU A 305 10.474 -13.285 13.411 1.00 61.45 C ATOM 931 C GLU A 305 9.668 -14.585 13.400 1.00 35.55 C ATOM 932 O GLU A 305 8.607 -14.667 14.018 1.00 1.04 O ATOM 933 CB GLU A 305 11.420 -13.236 14.612 1.00 31.31 C ATOM 934 CG GLU A 305 12.562 -12.248 14.371 1.00 43.53 C ATOM 935 CD GLU A 305 12.393 -10.993 15.230 1.00 34.24 C ATOM 936 OE1 GLU A 305 13.375 -10.285 15.494 1.00 45.42 O ATOM 937 OE2 GLU A 305 11.187 -10.764 15.628 1.00 1.12 O ATOM 0 H GLU A 305 9.028 -12.024 14.252 1.00 50.52 H new ATOM 0 HA GLU A 305 11.085 -13.251 12.509 1.00 61.45 H new ATOM 0 HB2 GLU A 305 10.866 -12.946 15.504 1.00 31.31 H new ATOM 0 HB3 GLU A 305 11.827 -14.230 14.799 1.00 31.31 H new ATOM 0 HG2 GLU A 305 13.515 -12.725 14.601 1.00 43.53 H new ATOM 0 HG3 GLU A 305 12.591 -11.970 13.317 1.00 43.53 H new ATOM 945 N LEU A 306 10.201 -15.570 12.692 1.00 12.11 N ATOM 946 CA LEU A 306 9.544 -16.862 12.593 1.00 32.24 C ATOM 947 C LEU A 306 10.597 -17.970 12.645 1.00 63.40 C ATOM 948 O LEU A 306 10.752 -18.730 11.690 1.00 53.11 O ATOM 949 CB LEU A 306 8.654 -16.917 11.350 1.00 33.12 C ATOM 950 CG LEU A 306 7.256 -16.313 11.499 1.00 73.21 C ATOM 951 CD1 LEU A 306 6.399 -16.604 10.265 1.00 0.51 C ATOM 952 CD2 LEU A 306 6.585 -16.793 12.788 1.00 45.11 C ATOM 0 H LEU A 306 11.081 -15.499 12.181 1.00 12.11 H new ATOM 0 HA LEU A 306 8.877 -17.016 13.441 1.00 32.24 H new ATOM 0 HB2 LEU A 306 9.166 -16.402 10.538 1.00 33.12 H new ATOM 0 HB3 LEU A 306 8.548 -17.959 11.049 1.00 33.12 H new ATOM 0 HG LEU A 306 7.358 -15.230 11.573 1.00 73.21 H new ATOM 0 HD11 LEU A 306 5.411 -16.164 10.397 1.00 0.51 H new ATOM 0 HD12 LEU A 306 6.873 -16.174 9.383 1.00 0.51 H new ATOM 0 HD13 LEU A 306 6.302 -17.682 10.135 1.00 0.51 H new ATOM 0 HD21 LEU A 306 5.593 -16.349 12.869 1.00 45.11 H new ATOM 0 HD22 LEU A 306 6.496 -17.879 12.769 1.00 45.11 H new ATOM 0 HD23 LEU A 306 7.188 -16.493 13.645 1.00 45.11 H new ATOM 964 N TRP A 307 11.295 -18.028 13.770 1.00 40.22 N ATOM 965 CA TRP A 307 12.330 -19.030 13.958 1.00 34.55 C ATOM 966 C TRP A 307 11.650 -20.397 14.065 1.00 72.00 C ATOM 967 O TRP A 307 10.852 -20.628 14.972 1.00 73.31 O ATOM 968 CB TRP A 307 13.199 -18.699 15.173 1.00 63.12 C ATOM 969 CG TRP A 307 14.351 -17.739 14.870 1.00 41.32 C ATOM 970 CD1 TRP A 307 15.456 -17.976 14.150 1.00 61.50 C ATOM 971 CD2 TRP A 307 14.467 -16.369 15.310 1.00 22.24 C ATOM 972 NE1 TRP A 307 16.273 -16.865 14.095 1.00 74.24 N ATOM 973 CE2 TRP A 307 15.652 -15.857 14.823 1.00 51.24 C ATOM 974 CE3 TRP A 307 13.599 -15.589 16.095 1.00 25.31 C ATOM 975 CZ2 TRP A 307 16.077 -14.545 15.065 1.00 63.21 C ATOM 976 CZ3 TRP A 307 14.039 -14.281 16.328 1.00 1.42 C ATOM 977 CH2 TRP A 307 15.229 -13.750 15.844 1.00 0.35 C ATOM 0 H TRP A 307 11.164 -17.397 14.561 1.00 40.22 H new ATOM 0 HA TRP A 307 13.012 -19.045 13.108 1.00 34.55 H new ATOM 0 HB2 TRP A 307 12.570 -18.262 15.949 1.00 63.12 H new ATOM 0 HB3 TRP A 307 13.608 -19.625 15.578 1.00 63.12 H new ATOM 0 HD1 TRP A 307 15.679 -18.919 13.672 1.00 61.50 H new ATOM 0 HE1 TRP A 307 17.167 -16.796 13.610 1.00 74.24 H new ATOM 0 HE3 TRP A 307 12.667 -15.969 16.487 1.00 25.31 H new ATOM 0 HZ2 TRP A 307 17.009 -14.167 14.672 1.00 63.21 H new ATOM 0 HZ3 TRP A 307 13.409 -13.639 16.926 1.00 1.42 H new ATOM 0 HH2 TRP A 307 15.498 -12.728 16.068 1.00 0.35 H new ATOM 988 N PHE A 308 11.991 -21.267 13.126 1.00 41.13 N ATOM 989 CA PHE A 308 11.424 -22.604 13.103 1.00 73.45 C ATOM 990 C PHE A 308 12.488 -23.657 13.420 1.00 72.02 C ATOM 991 O PHE A 308 13.679 -23.352 13.445 1.00 22.34 O ATOM 992 CB PHE A 308 10.895 -22.841 11.686 1.00 21.55 C ATOM 993 CG PHE A 308 9.792 -21.870 11.263 1.00 12.53 C ATOM 994 CD1 PHE A 308 9.205 -21.063 12.188 1.00 50.33 C ATOM 995 CD2 PHE A 308 9.398 -21.812 9.963 1.00 71.41 C ATOM 996 CE1 PHE A 308 8.181 -20.161 11.795 1.00 40.21 C ATOM 997 CE2 PHE A 308 8.374 -20.910 9.570 1.00 32.51 C ATOM 998 CZ PHE A 308 7.787 -20.104 10.495 1.00 50.35 C ATOM 0 H PHE A 308 12.653 -21.072 12.375 1.00 41.13 H new ATOM 0 HA PHE A 308 10.636 -22.687 13.851 1.00 73.45 H new ATOM 0 HB2 PHE A 308 11.724 -22.762 10.982 1.00 21.55 H new ATOM 0 HB3 PHE A 308 10.514 -23.860 11.617 1.00 21.55 H new ATOM 0 HD1 PHE A 308 9.518 -21.108 13.221 1.00 50.33 H new ATOM 0 HD2 PHE A 308 9.864 -22.452 9.229 1.00 71.41 H new ATOM 0 HE1 PHE A 308 7.715 -19.520 12.529 1.00 40.21 H new ATOM 0 HE2 PHE A 308 8.062 -20.864 8.537 1.00 32.51 H new ATOM 0 HZ PHE A 308 7.008 -19.418 10.197 1.00 50.35 H new ATOM 1008 N PHE A 309 12.019 -24.874 13.654 1.00 63.03 N ATOM 1009 CA PHE A 309 12.916 -25.973 13.968 1.00 33.43 C ATOM 1010 C PHE A 309 12.286 -27.318 13.598 1.00 52.31 C ATOM 1011 O PHE A 309 11.070 -27.415 13.441 1.00 32.43 O ATOM 1012 CB PHE A 309 13.157 -25.936 15.479 1.00 40.44 C ATOM 1013 CG PHE A 309 11.950 -25.459 16.290 1.00 63.32 C ATOM 1014 CD1 PHE A 309 11.640 -24.136 16.334 1.00 4.22 C ATOM 1015 CD2 PHE A 309 11.187 -26.359 16.966 1.00 25.42 C ATOM 1016 CE1 PHE A 309 10.520 -23.694 17.087 1.00 44.30 C ATOM 1017 CE2 PHE A 309 10.068 -25.917 17.719 1.00 74.30 C ATOM 1018 CZ PHE A 309 9.758 -24.594 17.763 1.00 14.15 C ATOM 0 H PHE A 309 11.030 -25.123 13.632 1.00 63.03 H new ATOM 0 HA PHE A 309 13.843 -25.869 13.405 1.00 33.43 H new ATOM 0 HB2 PHE A 309 13.437 -26.934 15.816 1.00 40.44 H new ATOM 0 HB3 PHE A 309 14.003 -25.280 15.686 1.00 40.44 H new ATOM 0 HD1 PHE A 309 12.245 -23.421 15.796 1.00 4.22 H new ATOM 0 HD2 PHE A 309 11.432 -27.410 16.930 1.00 25.42 H new ATOM 0 HE1 PHE A 309 10.274 -22.643 17.123 1.00 44.30 H new ATOM 0 HE2 PHE A 309 9.463 -26.632 18.257 1.00 74.30 H new ATOM 0 HZ PHE A 309 8.906 -24.258 18.335 1.00 14.15 H new ATOM 1028 N PRO A 310 13.165 -28.347 13.465 1.00 33.12 N ATOM 1029 CA PRO A 310 14.589 -28.146 13.668 1.00 3.22 C ATOM 1030 C PRO A 310 15.214 -27.413 12.479 1.00 24.32 C ATOM 1031 O PRO A 310 16.065 -26.543 12.659 1.00 23.42 O ATOM 1032 CB PRO A 310 15.158 -29.540 13.873 1.00 64.33 C ATOM 1033 CG PRO A 310 14.119 -30.500 13.318 1.00 71.45 C ATOM 1034 CD PRO A 310 12.827 -29.725 13.120 1.00 53.22 C ATOM 0 HA PRO A 310 14.806 -27.512 14.528 1.00 3.22 H new ATOM 0 HB2 PRO A 310 16.110 -29.653 13.355 1.00 64.33 H new ATOM 0 HB3 PRO A 310 15.345 -29.734 14.929 1.00 64.33 H new ATOM 0 HG2 PRO A 310 14.458 -30.925 12.373 1.00 71.45 H new ATOM 0 HG3 PRO A 310 13.963 -31.333 14.004 1.00 71.45 H new ATOM 0 HD2 PRO A 310 12.474 -29.800 12.092 1.00 53.22 H new ATOM 0 HD3 PRO A 310 12.032 -30.110 13.759 1.00 53.22 H new ATOM 1042 N SER A 311 14.768 -27.792 11.291 1.00 40.03 N ATOM 1043 CA SER A 311 15.273 -27.182 10.072 1.00 11.24 C ATOM 1044 C SER A 311 14.673 -27.879 8.850 1.00 33.41 C ATOM 1045 O SER A 311 14.650 -29.107 8.780 1.00 22.34 O ATOM 1046 CB SER A 311 16.801 -27.240 10.020 1.00 52.13 C ATOM 1047 OG SER A 311 17.303 -28.495 10.471 1.00 2.21 O ATOM 0 H SER A 311 14.062 -28.514 11.146 1.00 40.03 H new ATOM 0 HA SER A 311 14.976 -26.133 10.066 1.00 11.24 H new ATOM 0 HB2 SER A 311 17.136 -27.062 8.998 1.00 52.13 H new ATOM 0 HB3 SER A 311 17.215 -26.441 10.635 1.00 52.13 H new ATOM 0 HG SER A 311 18.282 -28.493 10.421 1.00 2.21 H new ATOM 1053 N LEU A 312 14.201 -27.066 7.917 1.00 70.03 N ATOM 1054 CA LEU A 312 13.602 -27.590 6.701 1.00 41.43 C ATOM 1055 C LEU A 312 14.483 -27.223 5.505 1.00 62.22 C ATOM 1056 O LEU A 312 15.270 -26.281 5.575 1.00 43.33 O ATOM 1057 CB LEU A 312 12.155 -27.112 6.568 1.00 53.14 C ATOM 1058 CG LEU A 312 11.188 -27.591 7.652 1.00 12.13 C ATOM 1059 CD1 LEU A 312 11.210 -26.652 8.860 1.00 53.32 C ATOM 1060 CD2 LEU A 312 9.776 -27.768 7.089 1.00 2.23 C ATOM 0 H LEU A 312 14.221 -26.048 7.978 1.00 70.03 H new ATOM 0 HA LEU A 312 13.552 -28.678 6.739 1.00 41.43 H new ATOM 0 HB2 LEU A 312 12.152 -26.022 6.563 1.00 53.14 H new ATOM 0 HB3 LEU A 312 11.774 -27.436 5.600 1.00 53.14 H new ATOM 0 HG LEU A 312 11.521 -28.569 7.998 1.00 12.13 H new ATOM 0 HD11 LEU A 312 10.514 -27.015 9.616 1.00 53.32 H new ATOM 0 HD12 LEU A 312 12.216 -26.621 9.278 1.00 53.32 H new ATOM 0 HD13 LEU A 312 10.916 -25.650 8.547 1.00 53.32 H new ATOM 0 HD21 LEU A 312 9.109 -28.109 7.881 1.00 2.23 H new ATOM 0 HD22 LEU A 312 9.418 -26.816 6.698 1.00 2.23 H new ATOM 0 HD23 LEU A 312 9.794 -28.506 6.287 1.00 2.23 H new ATOM 1072 N PRO A 313 14.317 -28.008 4.407 1.00 52.15 N ATOM 1073 CA PRO A 313 15.088 -27.776 3.197 1.00 54.40 C ATOM 1074 C PRO A 313 14.568 -26.550 2.443 1.00 42.13 C ATOM 1075 O PRO A 313 13.372 -26.265 2.463 1.00 12.23 O ATOM 1076 CB PRO A 313 14.963 -29.062 2.397 1.00 35.25 C ATOM 1077 CG PRO A 313 13.755 -29.790 2.965 1.00 31.04 C ATOM 1078 CD PRO A 313 13.394 -29.133 4.288 1.00 50.14 C ATOM 0 HA PRO A 313 16.135 -27.551 3.402 1.00 54.40 H new ATOM 0 HB2 PRO A 313 14.829 -28.851 1.336 1.00 35.25 H new ATOM 0 HB3 PRO A 313 15.864 -29.669 2.489 1.00 35.25 H new ATOM 0 HG2 PRO A 313 12.916 -29.737 2.271 1.00 31.04 H new ATOM 0 HG3 PRO A 313 13.980 -30.846 3.112 1.00 31.04 H new ATOM 0 HD2 PRO A 313 12.357 -28.797 4.293 1.00 50.14 H new ATOM 0 HD3 PRO A 313 13.508 -29.828 5.120 1.00 50.14 H new ATOM 1086 N THR A 314 15.493 -25.858 1.794 1.00 5.24 N ATOM 1087 CA THR A 314 15.144 -24.669 1.035 1.00 70.53 C ATOM 1088 C THR A 314 15.776 -24.722 -0.357 1.00 43.55 C ATOM 1089 O THR A 314 16.695 -25.503 -0.597 1.00 63.01 O ATOM 1090 CB THR A 314 15.568 -23.446 1.849 1.00 1.14 C ATOM 1091 OG1 THR A 314 16.604 -23.935 2.697 1.00 35.23 O ATOM 1092 CG2 THR A 314 14.480 -22.982 2.820 1.00 73.53 C ATOM 0 H THR A 314 16.484 -26.098 1.778 1.00 5.24 H new ATOM 0 HA THR A 314 14.069 -24.608 0.868 1.00 70.53 H new ATOM 0 HB THR A 314 15.822 -22.630 1.172 1.00 1.14 H new ATOM 0 HG1 THR A 314 17.423 -23.420 2.543 1.00 35.23 H new ATOM 0 HG21 THR A 314 14.833 -22.111 3.373 1.00 73.53 H new ATOM 0 HG22 THR A 314 13.582 -22.718 2.261 1.00 73.53 H new ATOM 0 HG23 THR A 314 14.249 -23.786 3.519 1.00 73.53 H new ATOM 1100 N PRO A 315 15.245 -23.857 -1.263 1.00 11.33 N ATOM 1101 CA PRO A 315 14.158 -22.965 -0.897 1.00 13.22 C ATOM 1102 C PRO A 315 12.834 -23.726 -0.795 1.00 64.15 C ATOM 1103 O PRO A 315 12.776 -24.919 -1.089 1.00 64.22 O ATOM 1104 CB PRO A 315 14.146 -21.895 -1.976 1.00 44.13 C ATOM 1105 CG PRO A 315 14.916 -22.479 -3.150 1.00 1.31 C ATOM 1106 CD PRO A 315 15.663 -23.706 -2.653 1.00 44.52 C ATOM 0 HA PRO A 315 14.295 -22.517 0.087 1.00 13.22 H new ATOM 0 HB2 PRO A 315 13.126 -21.643 -2.265 1.00 44.13 H new ATOM 0 HB3 PRO A 315 14.613 -20.976 -1.621 1.00 44.13 H new ATOM 0 HG2 PRO A 315 14.235 -22.748 -3.957 1.00 1.31 H new ATOM 0 HG3 PRO A 315 15.613 -21.744 -3.552 1.00 1.31 H new ATOM 0 HD2 PRO A 315 15.410 -24.588 -3.241 1.00 44.52 H new ATOM 0 HD3 PRO A 315 16.742 -23.571 -2.730 1.00 44.52 H new ATOM 1114 N LEU A 316 11.804 -23.005 -0.379 1.00 0.11 N ATOM 1115 CA LEU A 316 10.485 -23.597 -0.235 1.00 60.33 C ATOM 1116 C LEU A 316 9.688 -23.375 -1.522 1.00 52.51 C ATOM 1117 O LEU A 316 8.686 -22.661 -1.520 1.00 50.11 O ATOM 1118 CB LEU A 316 9.791 -23.062 1.019 1.00 71.13 C ATOM 1119 CG LEU A 316 10.495 -23.345 2.347 1.00 33.04 C ATOM 1120 CD1 LEU A 316 11.515 -22.252 2.671 1.00 13.33 C ATOM 1121 CD2 LEU A 316 9.479 -23.534 3.476 1.00 25.33 C ATOM 0 H LEU A 316 11.856 -22.016 -0.137 1.00 0.11 H new ATOM 0 HA LEU A 316 10.565 -24.675 -0.091 1.00 60.33 H new ATOM 0 HB2 LEU A 316 9.676 -21.983 0.914 1.00 71.13 H new ATOM 0 HB3 LEU A 316 8.788 -23.487 1.064 1.00 71.13 H new ATOM 0 HG LEU A 316 11.046 -24.280 2.249 1.00 33.04 H new ATOM 0 HD11 LEU A 316 12.001 -22.478 3.620 1.00 13.33 H new ATOM 0 HD12 LEU A 316 12.265 -22.208 1.881 1.00 13.33 H new ATOM 0 HD13 LEU A 316 11.007 -21.290 2.743 1.00 13.33 H new ATOM 0 HD21 LEU A 316 10.005 -23.734 4.409 1.00 25.33 H new ATOM 0 HD22 LEU A 316 8.881 -22.629 3.583 1.00 25.33 H new ATOM 0 HD23 LEU A 316 8.826 -24.374 3.241 1.00 25.33 H new ATOM 1133 N SER A 317 10.163 -23.998 -2.590 1.00 74.50 N ATOM 1134 CA SER A 317 9.507 -23.877 -3.881 1.00 33.31 C ATOM 1135 C SER A 317 8.286 -24.798 -3.936 1.00 12.11 C ATOM 1136 O SER A 317 8.399 -25.999 -3.698 1.00 35.35 O ATOM 1137 CB SER A 317 10.471 -24.206 -5.022 1.00 23.31 C ATOM 1138 OG SER A 317 11.833 -24.138 -4.606 1.00 52.14 O ATOM 0 H SER A 317 10.995 -24.588 -2.588 1.00 74.50 H new ATOM 0 HA SER A 317 9.181 -22.844 -4.003 1.00 33.31 H new ATOM 0 HB2 SER A 317 10.257 -25.205 -5.401 1.00 23.31 H new ATOM 0 HB3 SER A 317 10.308 -23.511 -5.846 1.00 23.31 H new ATOM 0 HG SER A 317 12.408 -24.508 -5.308 1.00 52.14 H new ATOM 1144 N ASN A 318 7.147 -24.199 -4.252 1.00 31.13 N ATOM 1145 CA ASN A 318 5.906 -24.950 -4.341 1.00 62.11 C ATOM 1146 C ASN A 318 5.431 -25.311 -2.932 1.00 62.53 C ATOM 1147 O ASN A 318 4.768 -26.329 -2.739 1.00 24.42 O ATOM 1148 CB ASN A 318 6.105 -26.251 -5.121 1.00 71.12 C ATOM 1149 CG ASN A 318 4.980 -26.458 -6.138 1.00 4.01 C ATOM 1150 OD1 ASN A 318 3.992 -25.743 -6.163 1.00 71.30 O ATOM 1151 ND2 ASN A 318 5.186 -27.473 -6.972 1.00 74.03 N ATOM 0 H ASN A 318 7.058 -23.202 -4.450 1.00 31.13 H new ATOM 0 HA ASN A 318 5.172 -24.330 -4.855 1.00 62.11 H new ATOM 0 HB2 ASN A 318 7.066 -26.227 -5.636 1.00 71.12 H new ATOM 0 HB3 ASN A 318 6.134 -27.093 -4.429 1.00 71.12 H new ATOM 0 HD21 ASN A 318 4.494 -27.693 -7.688 1.00 74.03 H new ATOM 0 HD22 ASN A 318 6.036 -28.031 -6.896 1.00 74.03 H new ATOM 1158 N TYR A 319 5.789 -24.457 -1.985 1.00 33.44 N ATOM 1159 CA TYR A 319 5.407 -24.674 -0.599 1.00 43.13 C ATOM 1160 C TYR A 319 4.374 -23.640 -0.147 1.00 74.52 C ATOM 1161 O TYR A 319 4.528 -22.448 -0.407 1.00 73.24 O ATOM 1162 CB TYR A 319 6.685 -24.493 0.223 1.00 72.20 C ATOM 1163 CG TYR A 319 7.560 -25.746 0.297 1.00 72.12 C ATOM 1164 CD1 TYR A 319 7.783 -26.500 -0.838 1.00 10.34 C ATOM 1165 CD2 TYR A 319 8.126 -26.123 1.498 1.00 40.41 C ATOM 1166 CE1 TYR A 319 8.606 -27.679 -0.768 1.00 45.11 C ATOM 1167 CE2 TYR A 319 8.950 -27.302 1.567 1.00 15.13 C ATOM 1168 CZ TYR A 319 9.149 -28.022 0.431 1.00 41.21 C ATOM 1169 OH TYR A 319 9.927 -29.136 0.497 1.00 52.54 O ATOM 0 H TYR A 319 6.339 -23.614 -2.149 1.00 33.44 H new ATOM 0 HA TYR A 319 4.964 -25.662 -0.473 1.00 43.13 H new ATOM 0 HB2 TYR A 319 7.269 -23.679 -0.207 1.00 72.20 H new ATOM 0 HB3 TYR A 319 6.414 -24.191 1.235 1.00 72.20 H new ATOM 0 HD1 TYR A 319 7.340 -26.205 -1.778 1.00 10.34 H new ATOM 0 HD2 TYR A 319 7.951 -25.534 2.386 1.00 40.41 H new ATOM 0 HE1 TYR A 319 8.788 -28.278 -1.648 1.00 45.11 H new ATOM 0 HE2 TYR A 319 9.400 -27.607 2.500 1.00 15.13 H new ATOM 0 HH TYR A 319 10.771 -28.919 0.945 1.00 52.54 H new ATOM 1179 N THR A 320 3.343 -24.135 0.522 1.00 73.40 N ATOM 1180 CA THR A 320 2.284 -23.270 1.013 1.00 52.23 C ATOM 1181 C THR A 320 2.876 -22.077 1.766 1.00 21.21 C ATOM 1182 O THR A 320 2.731 -20.933 1.338 1.00 71.45 O ATOM 1183 CB THR A 320 1.337 -24.117 1.865 1.00 61.43 C ATOM 1184 OG1 THR A 320 0.430 -24.680 0.921 1.00 41.04 O ATOM 1185 CG2 THR A 320 0.448 -23.267 2.774 1.00 0.04 C ATOM 0 H THR A 320 3.219 -25.125 0.736 1.00 73.40 H new ATOM 0 HA THR A 320 1.710 -22.843 0.191 1.00 52.23 H new ATOM 0 HB THR A 320 1.918 -24.811 2.472 1.00 61.43 H new ATOM 0 HG1 THR A 320 -0.219 -25.246 1.388 1.00 41.04 H new ATOM 0 HG21 THR A 320 -0.204 -23.918 3.356 1.00 0.04 H new ATOM 0 HG22 THR A 320 1.072 -22.681 3.449 1.00 0.04 H new ATOM 0 HG23 THR A 320 -0.158 -22.596 2.166 1.00 0.04 H new ATOM 1193 N MET A 321 3.531 -22.385 2.876 1.00 62.33 N ATOM 1194 CA MET A 321 4.146 -21.353 3.693 1.00 61.11 C ATOM 1195 C MET A 321 3.348 -20.049 3.621 1.00 24.44 C ATOM 1196 O MET A 321 3.927 -18.969 3.519 1.00 54.41 O ATOM 1197 CB MET A 321 5.576 -21.104 3.210 1.00 43.11 C ATOM 1198 CG MET A 321 6.477 -20.667 4.367 1.00 42.53 C ATOM 1199 SD MET A 321 7.622 -19.416 3.809 1.00 2.35 S ATOM 1200 CE MET A 321 8.779 -20.433 2.908 1.00 75.53 C ATOM 0 H MET A 321 3.649 -23.335 3.229 1.00 62.33 H new ATOM 0 HA MET A 321 4.157 -21.694 4.728 1.00 61.11 H new ATOM 0 HB2 MET A 321 5.974 -22.012 2.757 1.00 43.11 H new ATOM 0 HB3 MET A 321 5.574 -20.336 2.436 1.00 43.11 H new ATOM 0 HG2 MET A 321 5.870 -20.278 5.185 1.00 42.53 H new ATOM 0 HG3 MET A 321 7.024 -21.525 4.757 1.00 42.53 H new ATOM 0 HE1 MET A 321 9.318 -19.819 2.187 1.00 75.53 H new ATOM 0 HE2 MET A 321 9.488 -20.882 3.604 1.00 75.53 H new ATOM 0 HE3 MET A 321 8.239 -21.220 2.382 1.00 75.53 H new ATOM 1210 N LYS A 322 2.033 -20.194 3.678 1.00 33.23 N ATOM 1211 CA LYS A 322 1.150 -19.042 3.621 1.00 12.52 C ATOM 1212 C LYS A 322 1.089 -18.382 5.001 1.00 61.34 C ATOM 1213 O LYS A 322 1.970 -18.593 5.833 1.00 63.05 O ATOM 1214 CB LYS A 322 -0.220 -19.443 3.071 1.00 52.34 C ATOM 1215 CG LYS A 322 -0.938 -20.397 4.028 1.00 42.24 C ATOM 1216 CD LYS A 322 -1.838 -21.367 3.261 1.00 34.50 C ATOM 1217 CE LYS A 322 -2.203 -22.576 4.125 1.00 23.25 C ATOM 1218 NZ LYS A 322 -2.804 -23.644 3.296 1.00 74.11 N ATOM 0 H LYS A 322 1.557 -21.092 3.763 1.00 33.23 H new ATOM 0 HA LYS A 322 1.541 -18.297 2.928 1.00 12.52 H new ATOM 0 HB2 LYS A 322 -0.828 -18.552 2.916 1.00 52.34 H new ATOM 0 HB3 LYS A 322 -0.100 -19.920 2.098 1.00 52.34 H new ATOM 0 HG2 LYS A 322 -0.204 -20.957 4.608 1.00 42.24 H new ATOM 0 HG3 LYS A 322 -1.535 -19.825 4.738 1.00 42.24 H new ATOM 0 HD2 LYS A 322 -2.746 -20.854 2.945 1.00 34.50 H new ATOM 0 HD3 LYS A 322 -1.330 -21.702 2.356 1.00 34.50 H new ATOM 0 HE2 LYS A 322 -1.312 -22.955 4.626 1.00 23.25 H new ATOM 0 HE3 LYS A 322 -2.903 -22.275 4.904 1.00 23.25 H new ATOM 0 HZ1 LYS A 322 -2.936 -24.499 3.874 1.00 74.11 H new ATOM 0 HZ2 LYS A 322 -3.725 -23.325 2.933 1.00 74.11 H new ATOM 0 HZ3 LYS A 322 -2.174 -23.860 2.498 1.00 74.11 H new ATOM 1231 N VAL A 323 0.041 -17.597 5.200 1.00 35.54 N ATOM 1232 CA VAL A 323 -0.147 -16.906 6.465 1.00 64.04 C ATOM 1233 C VAL A 323 -1.641 -16.678 6.700 1.00 51.44 C ATOM 1234 O VAL A 323 -2.354 -16.237 5.800 1.00 53.43 O ATOM 1235 CB VAL A 323 0.666 -15.609 6.477 1.00 34.42 C ATOM 1236 CG1 VAL A 323 0.821 -15.074 7.902 1.00 51.42 C ATOM 1237 CG2 VAL A 323 2.030 -15.811 5.815 1.00 2.12 C ATOM 0 H VAL A 323 -0.687 -17.424 4.507 1.00 35.54 H new ATOM 0 HA VAL A 323 0.222 -17.513 7.291 1.00 64.04 H new ATOM 0 HB VAL A 323 0.120 -14.865 5.897 1.00 34.42 H new ATOM 0 HG11 VAL A 323 1.402 -14.152 7.883 1.00 51.42 H new ATOM 0 HG12 VAL A 323 -0.164 -14.874 8.325 1.00 51.42 H new ATOM 0 HG13 VAL A 323 1.335 -15.815 8.515 1.00 51.42 H new ATOM 0 HG21 VAL A 323 2.587 -14.874 5.837 1.00 2.12 H new ATOM 0 HG22 VAL A 323 2.587 -16.577 6.355 1.00 2.12 H new ATOM 0 HG23 VAL A 323 1.890 -16.126 4.781 1.00 2.12 H new ATOM 1247 N VAL A 324 -2.071 -16.988 7.914 1.00 42.01 N ATOM 1248 CA VAL A 324 -3.468 -16.822 8.279 1.00 64.14 C ATOM 1249 C VAL A 324 -3.590 -15.706 9.318 1.00 44.00 C ATOM 1250 O VAL A 324 -2.586 -15.134 9.740 1.00 11.42 O ATOM 1251 CB VAL A 324 -4.044 -18.154 8.762 1.00 71.54 C ATOM 1252 CG1 VAL A 324 -4.113 -19.169 7.618 1.00 12.41 C ATOM 1253 CG2 VAL A 324 -3.236 -18.708 9.937 1.00 11.41 C ATOM 0 H VAL A 324 -1.477 -17.353 8.658 1.00 42.01 H new ATOM 0 HA VAL A 324 -4.057 -16.524 7.411 1.00 64.14 H new ATOM 0 HB VAL A 324 -5.060 -17.972 9.111 1.00 71.54 H new ATOM 0 HG11 VAL A 324 -4.526 -20.107 7.988 1.00 12.41 H new ATOM 0 HG12 VAL A 324 -4.751 -18.780 6.824 1.00 12.41 H new ATOM 0 HG13 VAL A 324 -3.111 -19.344 7.226 1.00 12.41 H new ATOM 0 HG21 VAL A 324 -3.667 -19.655 10.261 1.00 11.41 H new ATOM 0 HG22 VAL A 324 -2.203 -18.867 9.626 1.00 11.41 H new ATOM 0 HG23 VAL A 324 -3.261 -17.997 10.763 1.00 11.41 H new ATOM 1263 N ASN A 325 -4.828 -15.430 9.700 1.00 22.04 N ATOM 1264 CA ASN A 325 -5.094 -14.393 10.682 1.00 11.44 C ATOM 1265 C ASN A 325 -5.609 -15.037 11.971 1.00 10.52 C ATOM 1266 O ASN A 325 -5.605 -16.259 12.103 1.00 73.51 O ATOM 1267 CB ASN A 325 -6.163 -13.420 10.180 1.00 21.10 C ATOM 1268 CG ASN A 325 -7.114 -14.109 9.199 1.00 45.01 C ATOM 1269 OD1 ASN A 325 -7.478 -13.571 8.166 1.00 63.40 O ATOM 1270 ND2 ASN A 325 -7.494 -15.326 9.578 1.00 3.31 N ATOM 0 H ASN A 325 -5.658 -15.906 9.347 1.00 22.04 H new ATOM 0 HA ASN A 325 -4.166 -13.850 10.858 1.00 11.44 H new ATOM 0 HB2 ASN A 325 -6.728 -13.027 11.025 1.00 21.10 H new ATOM 0 HB3 ASN A 325 -5.686 -12.569 9.693 1.00 21.10 H new ATOM 0 HD21 ASN A 325 -8.128 -15.868 8.991 1.00 3.31 H new ATOM 0 HD22 ASN A 325 -7.151 -15.717 10.456 1.00 3.31 H new ATOM 1277 N GLN A 326 -6.040 -14.184 12.890 1.00 62.24 N ATOM 1278 CA GLN A 326 -6.557 -14.655 14.163 1.00 2.34 C ATOM 1279 C GLN A 326 -7.912 -15.337 13.967 1.00 52.12 C ATOM 1280 O GLN A 326 -8.504 -15.837 14.922 1.00 23.23 O ATOM 1281 CB GLN A 326 -6.661 -13.507 15.170 1.00 35.51 C ATOM 1282 CG GLN A 326 -7.846 -12.596 14.842 1.00 31.42 C ATOM 1283 CD GLN A 326 -8.103 -11.601 15.976 1.00 64.24 C ATOM 1284 OE1 GLN A 326 -9.162 -11.569 16.581 1.00 63.25 O ATOM 1285 NE2 GLN A 326 -7.077 -10.793 16.228 1.00 20.04 N ATOM 0 H GLN A 326 -6.041 -13.170 12.778 1.00 62.24 H new ATOM 0 HA GLN A 326 -5.859 -15.388 14.568 1.00 2.34 H new ATOM 0 HB2 GLN A 326 -6.775 -13.910 16.176 1.00 35.51 H new ATOM 0 HB3 GLN A 326 -5.738 -12.927 15.162 1.00 35.51 H new ATOM 0 HG2 GLN A 326 -7.648 -12.055 13.917 1.00 31.42 H new ATOM 0 HG3 GLN A 326 -8.738 -13.200 14.674 1.00 31.42 H new ATOM 0 HE21 GLN A 326 -6.219 -10.874 15.683 1.00 20.04 H new ATOM 0 HE22 GLN A 326 -7.149 -10.093 16.966 1.00 20.04 H new ATOM 1294 N ASP A 327 -8.365 -15.335 12.722 1.00 65.24 N ATOM 1295 CA ASP A 327 -9.639 -15.948 12.387 1.00 11.25 C ATOM 1296 C ASP A 327 -9.395 -17.350 11.825 1.00 4.52 C ATOM 1297 O ASP A 327 -10.337 -18.111 11.614 1.00 14.22 O ATOM 1298 CB ASP A 327 -10.379 -15.134 11.324 1.00 72.31 C ATOM 1299 CG ASP A 327 -11.283 -14.027 11.870 1.00 43.35 C ATOM 1300 OD1 ASP A 327 -11.268 -12.889 11.376 1.00 25.14 O ATOM 1301 OD2 ASP A 327 -12.036 -14.375 12.857 1.00 12.20 O ATOM 0 H ASP A 327 -7.872 -14.918 11.932 1.00 65.24 H new ATOM 0 HA ASP A 327 -10.242 -15.989 13.294 1.00 11.25 H new ATOM 0 HB2 ASP A 327 -9.645 -14.686 10.655 1.00 72.31 H new ATOM 0 HB3 ASP A 327 -10.984 -15.813 10.724 1.00 72.31 H new ATOM 1307 N GLY A 328 -8.124 -17.648 11.599 1.00 62.13 N ATOM 1308 CA GLY A 328 -7.743 -18.945 11.065 1.00 13.11 C ATOM 1309 C GLY A 328 -8.080 -19.045 9.576 1.00 65.12 C ATOM 1310 O GLY A 328 -8.778 -19.966 9.154 1.00 43.21 O ATOM 0 H GLY A 328 -7.345 -17.014 11.776 1.00 62.13 H new ATOM 0 HA2 GLY A 328 -6.674 -19.103 11.211 1.00 13.11 H new ATOM 0 HA3 GLY A 328 -8.259 -19.734 11.612 1.00 13.11 H new ATOM 1314 N GLU A 329 -7.567 -18.085 8.820 1.00 10.03 N ATOM 1315 CA GLU A 329 -7.804 -18.053 7.387 1.00 32.40 C ATOM 1316 C GLU A 329 -6.616 -17.413 6.666 1.00 12.24 C ATOM 1317 O GLU A 329 -6.168 -16.331 7.042 1.00 2.21 O ATOM 1318 CB GLU A 329 -9.105 -17.316 7.063 1.00 42.04 C ATOM 1319 CG GLU A 329 -8.819 -15.935 6.468 1.00 23.43 C ATOM 1320 CD GLU A 329 -10.110 -15.262 5.999 1.00 32.05 C ATOM 1321 OE1 GLU A 329 -10.977 -14.940 6.826 1.00 61.22 O ATOM 1322 OE2 GLU A 329 -10.196 -15.074 4.726 1.00 30.41 O ATOM 0 H GLU A 329 -6.988 -17.323 9.173 1.00 10.03 H new ATOM 0 HA GLU A 329 -7.908 -19.079 7.033 1.00 32.40 H new ATOM 0 HB2 GLU A 329 -9.695 -17.904 6.360 1.00 42.04 H new ATOM 0 HB3 GLU A 329 -9.702 -17.209 7.969 1.00 42.04 H new ATOM 0 HG2 GLU A 329 -8.328 -15.309 7.213 1.00 23.43 H new ATOM 0 HG3 GLU A 329 -8.130 -16.032 5.629 1.00 23.43 H new ATOM 1330 N THR A 330 -6.140 -18.108 5.644 1.00 74.11 N ATOM 1331 CA THR A 330 -5.013 -17.621 4.867 1.00 11.43 C ATOM 1332 C THR A 330 -5.382 -16.320 4.150 1.00 31.52 C ATOM 1333 O THR A 330 -6.227 -16.318 3.257 1.00 74.54 O ATOM 1334 CB THR A 330 -4.577 -18.736 3.916 1.00 65.50 C ATOM 1335 OG1 THR A 330 -3.720 -19.554 4.709 1.00 11.42 O ATOM 1336 CG2 THR A 330 -3.671 -18.227 2.793 1.00 65.50 C ATOM 0 H THR A 330 -6.514 -19.005 5.336 1.00 74.11 H new ATOM 0 HA THR A 330 -4.168 -17.373 5.509 1.00 11.43 H new ATOM 0 HB THR A 330 -5.459 -19.210 3.485 1.00 65.50 H new ATOM 0 HG1 THR A 330 -4.087 -20.461 4.758 1.00 11.42 H new ATOM 0 HG21 THR A 330 -3.390 -19.059 2.147 1.00 65.50 H new ATOM 0 HG22 THR A 330 -4.203 -17.476 2.208 1.00 65.50 H new ATOM 0 HG23 THR A 330 -2.773 -17.783 3.223 1.00 65.50 H new ATOM 1344 N ILE A 331 -4.730 -15.246 4.569 1.00 41.23 N ATOM 1345 CA ILE A 331 -4.979 -13.942 3.978 1.00 43.15 C ATOM 1346 C ILE A 331 -4.011 -13.722 2.813 1.00 3.53 C ATOM 1347 O ILE A 331 -4.364 -13.090 1.819 1.00 50.13 O ATOM 1348 CB ILE A 331 -4.915 -12.848 5.046 1.00 70.43 C ATOM 1349 CG1 ILE A 331 -3.465 -12.514 5.402 1.00 12.12 C ATOM 1350 CG2 ILE A 331 -5.733 -13.238 6.279 1.00 52.05 C ATOM 1351 CD1 ILE A 331 -3.387 -11.765 6.734 1.00 22.22 C ATOM 0 H ILE A 331 -4.030 -15.252 5.311 1.00 41.23 H new ATOM 0 HA ILE A 331 -5.988 -13.896 3.568 1.00 43.15 H new ATOM 0 HB ILE A 331 -5.362 -11.943 4.636 1.00 70.43 H new ATOM 0 HG12 ILE A 331 -2.881 -13.432 5.462 1.00 12.12 H new ATOM 0 HG13 ILE A 331 -3.023 -11.906 4.612 1.00 12.12 H new ATOM 0 HG21 ILE A 331 -5.671 -12.444 7.023 1.00 52.05 H new ATOM 0 HG22 ILE A 331 -6.774 -13.387 5.993 1.00 52.05 H new ATOM 0 HG23 ILE A 331 -5.337 -14.162 6.701 1.00 52.05 H new ATOM 0 HD11 ILE A 331 -2.346 -11.539 6.964 1.00 22.22 H new ATOM 0 HD12 ILE A 331 -3.952 -10.836 6.663 1.00 22.22 H new ATOM 0 HD13 ILE A 331 -3.807 -12.386 7.525 1.00 22.22 H new ATOM 1363 N LEU A 332 -2.809 -14.255 2.976 1.00 43.41 N ATOM 1364 CA LEU A 332 -1.787 -14.124 1.951 1.00 72.02 C ATOM 1365 C LEU A 332 -1.055 -15.458 1.794 1.00 60.22 C ATOM 1366 O LEU A 332 -1.173 -16.339 2.644 1.00 34.20 O ATOM 1367 CB LEU A 332 -0.861 -12.947 2.264 1.00 30.22 C ATOM 1368 CG LEU A 332 -1.286 -11.590 1.700 1.00 72.23 C ATOM 1369 CD1 LEU A 332 -0.179 -10.550 1.879 1.00 24.35 C ATOM 1370 CD2 LEU A 332 -1.722 -11.716 0.239 1.00 72.44 C ATOM 0 H LEU A 332 -2.520 -14.778 3.802 1.00 43.41 H new ATOM 0 HA LEU A 332 -2.241 -13.894 0.987 1.00 72.02 H new ATOM 0 HB2 LEU A 332 -0.774 -12.857 3.347 1.00 30.22 H new ATOM 0 HB3 LEU A 332 0.133 -13.181 1.883 1.00 30.22 H new ATOM 0 HG LEU A 332 -2.150 -11.241 2.266 1.00 72.23 H new ATOM 0 HD11 LEU A 332 -0.508 -9.595 1.469 1.00 24.35 H new ATOM 0 HD12 LEU A 332 0.042 -10.433 2.940 1.00 24.35 H new ATOM 0 HD13 LEU A 332 0.718 -10.880 1.355 1.00 24.35 H new ATOM 0 HD21 LEU A 332 -2.019 -10.737 -0.138 1.00 72.44 H new ATOM 0 HD22 LEU A 332 -0.893 -12.098 -0.357 1.00 72.44 H new ATOM 0 HD23 LEU A 332 -2.565 -12.403 0.169 1.00 72.44 H new ATOM 1382 N VAL A 333 -0.314 -15.565 0.701 1.00 73.15 N ATOM 1383 CA VAL A 333 0.437 -16.777 0.421 1.00 2.02 C ATOM 1384 C VAL A 333 1.645 -16.433 -0.453 1.00 1.14 C ATOM 1385 O VAL A 333 1.491 -15.888 -1.545 1.00 32.34 O ATOM 1386 CB VAL A 333 -0.479 -17.827 -0.212 1.00 2.45 C ATOM 1387 CG1 VAL A 333 -1.601 -17.163 -1.012 1.00 71.54 C ATOM 1388 CG2 VAL A 333 0.320 -18.796 -1.085 1.00 52.24 C ATOM 0 H VAL A 333 -0.218 -14.832 -0.002 1.00 73.15 H new ATOM 0 HA VAL A 333 0.817 -17.212 1.345 1.00 2.02 H new ATOM 0 HB VAL A 333 -0.937 -18.403 0.592 1.00 2.45 H new ATOM 0 HG11 VAL A 333 -2.238 -17.931 -1.452 1.00 71.54 H new ATOM 0 HG12 VAL A 333 -2.196 -16.533 -0.351 1.00 71.54 H new ATOM 0 HG13 VAL A 333 -1.170 -16.551 -1.805 1.00 71.54 H new ATOM 0 HG21 VAL A 333 -0.354 -19.532 -1.523 1.00 52.24 H new ATOM 0 HG22 VAL A 333 0.819 -18.242 -1.880 1.00 52.24 H new ATOM 0 HG23 VAL A 333 1.066 -19.305 -0.475 1.00 52.24 H new ATOM 1398 N GLY A 334 2.820 -16.765 0.061 1.00 4.10 N ATOM 1399 CA GLY A 334 4.054 -16.498 -0.659 1.00 1.12 C ATOM 1400 C GLY A 334 4.182 -17.406 -1.884 1.00 13.23 C ATOM 1401 O GLY A 334 4.077 -18.626 -1.770 1.00 25.22 O ATOM 0 H GLY A 334 2.944 -17.216 0.967 1.00 4.10 H new ATOM 0 HA2 GLY A 334 4.078 -15.454 -0.972 1.00 1.12 H new ATOM 0 HA3 GLY A 334 4.906 -16.652 0.003 1.00 1.12 H new ATOM 1405 N LYS A 335 4.406 -16.775 -3.027 1.00 74.22 N ATOM 1406 CA LYS A 335 4.549 -17.511 -4.272 1.00 55.01 C ATOM 1407 C LYS A 335 5.460 -18.719 -4.044 1.00 11.41 C ATOM 1408 O LYS A 335 5.356 -19.721 -4.749 1.00 34.34 O ATOM 1409 CB LYS A 335 5.026 -16.583 -5.391 1.00 72.00 C ATOM 1410 CG LYS A 335 6.553 -16.503 -5.423 1.00 64.42 C ATOM 1411 CD LYS A 335 7.080 -15.613 -4.296 1.00 31.13 C ATOM 1412 CE LYS A 335 8.584 -15.377 -4.441 1.00 44.40 C ATOM 1413 NZ LYS A 335 8.957 -15.274 -5.870 1.00 24.43 N ATOM 0 H LYS A 335 4.492 -15.763 -3.117 1.00 74.22 H new ATOM 0 HA LYS A 335 3.584 -17.897 -4.599 1.00 55.01 H new ATOM 0 HB2 LYS A 335 4.657 -16.945 -6.351 1.00 72.00 H new ATOM 0 HB3 LYS A 335 4.609 -15.587 -5.245 1.00 72.00 H new ATOM 0 HG2 LYS A 335 6.975 -17.504 -5.328 1.00 64.42 H new ATOM 0 HG3 LYS A 335 6.880 -16.109 -6.385 1.00 64.42 H new ATOM 0 HD2 LYS A 335 6.556 -14.657 -4.307 1.00 31.13 H new ATOM 0 HD3 LYS A 335 6.873 -16.079 -3.333 1.00 31.13 H new ATOM 0 HE2 LYS A 335 8.867 -14.463 -3.918 1.00 44.40 H new ATOM 0 HE3 LYS A 335 9.133 -16.194 -3.974 1.00 44.40 H new ATOM 0 HZ1 LYS A 335 9.984 -15.131 -5.951 1.00 24.43 H new ATOM 0 HZ2 LYS A 335 8.689 -16.150 -6.363 1.00 24.43 H new ATOM 0 HZ3 LYS A 335 8.460 -14.469 -6.301 1.00 24.43 H new ATOM 1426 N CYS A 336 6.333 -18.583 -3.057 1.00 12.34 N ATOM 1427 CA CYS A 336 7.262 -19.650 -2.727 1.00 32.23 C ATOM 1428 C CYS A 336 7.897 -20.152 -4.025 1.00 24.02 C ATOM 1429 O CYS A 336 7.686 -21.297 -4.421 1.00 64.21 O ATOM 1430 CB CYS A 336 6.576 -20.778 -1.954 1.00 33.32 C ATOM 1431 SG CYS A 336 7.095 -20.740 -0.199 1.00 74.53 S ATOM 0 H CYS A 336 6.417 -17.750 -2.475 1.00 12.34 H new ATOM 0 HA CYS A 336 8.040 -19.267 -2.067 1.00 32.23 H new ATOM 0 HB2 CYS A 336 5.493 -20.672 -2.024 1.00 33.32 H new ATOM 0 HB3 CYS A 336 6.831 -21.741 -2.397 1.00 33.32 H new ATOM 0 HG CYS A 336 7.929 -21.711 0.028 1.00 74.53 H new ATOM 1437 N ALA A 337 8.663 -19.270 -4.651 1.00 32.31 N ATOM 1438 CA ALA A 337 9.330 -19.610 -5.896 1.00 45.51 C ATOM 1439 C ALA A 337 10.551 -20.481 -5.594 1.00 44.31 C ATOM 1440 O ALA A 337 10.742 -20.917 -4.460 1.00 73.40 O ATOM 1441 CB ALA A 337 9.700 -18.327 -6.643 1.00 40.44 C ATOM 0 H ALA A 337 8.836 -18.321 -4.319 1.00 32.31 H new ATOM 0 HA ALA A 337 8.667 -20.185 -6.543 1.00 45.51 H new ATOM 0 HB1 ALA A 337 10.201 -18.581 -7.577 1.00 40.44 H new ATOM 0 HB2 ALA A 337 8.796 -17.758 -6.859 1.00 40.44 H new ATOM 0 HB3 ALA A 337 10.368 -17.726 -6.026 1.00 40.44 H new ATOM 1447 N ASP A 338 11.347 -20.707 -6.629 1.00 22.42 N ATOM 1448 CA ASP A 338 12.545 -21.519 -6.489 1.00 14.45 C ATOM 1449 C ASP A 338 13.664 -20.668 -5.885 1.00 51.22 C ATOM 1450 O ASP A 338 14.749 -20.569 -6.455 1.00 64.02 O ATOM 1451 CB ASP A 338 13.023 -22.034 -7.847 1.00 73.42 C ATOM 1452 CG ASP A 338 11.915 -22.269 -8.876 1.00 40.43 C ATOM 1453 OD1 ASP A 338 10.869 -22.857 -8.566 1.00 13.05 O ATOM 1454 OD2 ASP A 338 12.163 -21.813 -10.057 1.00 52.53 O ATOM 0 H ASP A 338 11.186 -20.342 -7.568 1.00 22.42 H new ATOM 0 HA ASP A 338 12.305 -22.366 -5.847 1.00 14.45 H new ATOM 0 HB2 ASP A 338 13.736 -21.320 -8.259 1.00 73.42 H new ATOM 0 HB3 ASP A 338 13.561 -22.970 -7.695 1.00 73.42 H new ATOM 1460 N SER A 339 13.361 -20.075 -4.740 1.00 2.13 N ATOM 1461 CA SER A 339 14.328 -19.236 -4.053 1.00 3.32 C ATOM 1462 C SER A 339 13.821 -18.892 -2.651 1.00 33.00 C ATOM 1463 O SER A 339 12.634 -19.040 -2.363 1.00 21.31 O ATOM 1464 CB SER A 339 14.608 -17.957 -4.844 1.00 50.34 C ATOM 1465 OG SER A 339 15.627 -18.146 -5.823 1.00 32.34 O ATOM 0 H SER A 339 12.459 -20.159 -4.271 1.00 2.13 H new ATOM 0 HA SER A 339 15.262 -19.791 -3.968 1.00 3.32 H new ATOM 0 HB2 SER A 339 13.692 -17.626 -5.333 1.00 50.34 H new ATOM 0 HB3 SER A 339 14.907 -17.165 -4.158 1.00 50.34 H new ATOM 0 HG SER A 339 15.477 -18.994 -6.292 1.00 32.34 H new ATOM 1471 N ASN A 340 14.745 -18.439 -1.816 1.00 73.43 N ATOM 1472 CA ASN A 340 14.406 -18.073 -0.452 1.00 33.44 C ATOM 1473 C ASN A 340 13.477 -16.858 -0.470 1.00 3.52 C ATOM 1474 O ASN A 340 12.616 -16.717 0.397 1.00 1.51 O ATOM 1475 CB ASN A 340 15.657 -17.701 0.346 1.00 42.33 C ATOM 1476 CG ASN A 340 16.614 -18.890 0.451 1.00 3.34 C ATOM 1477 OD1 ASN A 340 17.775 -18.820 0.083 1.00 42.01 O ATOM 1478 ND2 ASN A 340 16.064 -19.982 0.974 1.00 23.00 N ATOM 0 H ASN A 340 15.728 -18.317 -2.058 1.00 73.43 H new ATOM 0 HA ASN A 340 13.922 -18.930 0.016 1.00 33.44 H new ATOM 0 HB2 ASN A 340 16.163 -16.863 -0.134 1.00 42.33 H new ATOM 0 HB3 ASN A 340 15.371 -17.371 1.345 1.00 42.33 H new ATOM 0 HD21 ASN A 340 16.621 -20.829 1.088 1.00 23.00 H new ATOM 0 HD22 ASN A 340 15.085 -19.972 1.262 1.00 23.00 H new ATOM 1485 N GLU A 341 13.684 -16.010 -1.467 1.00 71.11 N ATOM 1486 CA GLU A 341 12.876 -14.811 -1.610 1.00 1.23 C ATOM 1487 C GLU A 341 11.399 -15.180 -1.761 1.00 22.42 C ATOM 1488 O GLU A 341 11.058 -16.095 -2.509 1.00 70.11 O ATOM 1489 CB GLU A 341 13.353 -13.966 -2.792 1.00 45.43 C ATOM 1490 CG GLU A 341 13.601 -12.517 -2.367 1.00 13.15 C ATOM 1491 CD GLU A 341 13.413 -11.559 -3.545 1.00 64.52 C ATOM 1492 OE1 GLU A 341 13.053 -10.390 -3.343 1.00 70.41 O ATOM 1493 OE2 GLU A 341 13.658 -12.068 -4.705 1.00 73.41 O ATOM 0 H GLU A 341 14.400 -16.130 -2.184 1.00 71.11 H new ATOM 0 HA GLU A 341 12.990 -14.211 -0.707 1.00 1.23 H new ATOM 0 HB2 GLU A 341 14.270 -14.391 -3.200 1.00 45.43 H new ATOM 0 HB3 GLU A 341 12.608 -13.993 -3.587 1.00 45.43 H new ATOM 0 HG2 GLU A 341 12.916 -12.248 -1.563 1.00 13.15 H new ATOM 0 HG3 GLU A 341 14.612 -12.418 -1.972 1.00 13.15 H new ATOM 1501 N ILE A 342 10.562 -14.450 -1.038 1.00 64.41 N ATOM 1502 CA ILE A 342 9.130 -14.690 -1.082 1.00 70.15 C ATOM 1503 C ILE A 342 8.390 -13.354 -0.983 1.00 24.41 C ATOM 1504 O ILE A 342 8.549 -12.625 -0.006 1.00 14.54 O ATOM 1505 CB ILE A 342 8.722 -15.700 -0.008 1.00 63.32 C ATOM 1506 CG1 ILE A 342 9.453 -17.031 -0.201 1.00 3.42 C ATOM 1507 CG2 ILE A 342 7.203 -15.881 0.027 1.00 43.34 C ATOM 1508 CD1 ILE A 342 9.172 -17.984 0.962 1.00 32.30 C ATOM 0 H ILE A 342 10.849 -13.692 -0.418 1.00 64.41 H new ATOM 0 HA ILE A 342 8.849 -15.141 -2.034 1.00 70.15 H new ATOM 0 HB ILE A 342 9.022 -15.305 0.963 1.00 63.32 H new ATOM 0 HG12 ILE A 342 9.137 -17.491 -1.137 1.00 3.42 H new ATOM 0 HG13 ILE A 342 10.526 -16.853 -0.279 1.00 3.42 H new ATOM 0 HG21 ILE A 342 6.940 -16.604 0.799 1.00 43.34 H new ATOM 0 HG22 ILE A 342 6.728 -14.925 0.248 1.00 43.34 H new ATOM 0 HG23 ILE A 342 6.857 -16.243 -0.941 1.00 43.34 H new ATOM 0 HD11 ILE A 342 9.703 -18.922 0.800 1.00 32.30 H new ATOM 0 HD12 ILE A 342 9.511 -17.531 1.894 1.00 32.30 H new ATOM 0 HD13 ILE A 342 8.101 -18.179 1.022 1.00 32.30 H new ATOM 1520 N THR A 343 7.599 -13.075 -2.008 1.00 33.01 N ATOM 1521 CA THR A 343 6.834 -11.840 -2.048 1.00 42.01 C ATOM 1522 C THR A 343 5.342 -12.141 -2.205 1.00 65.14 C ATOM 1523 O THR A 343 4.818 -12.135 -3.318 1.00 62.21 O ATOM 1524 CB THR A 343 7.400 -10.970 -3.172 1.00 63.02 C ATOM 1525 OG1 THR A 343 6.911 -11.580 -4.363 1.00 64.54 O ATOM 1526 CG2 THR A 343 8.921 -11.085 -3.292 1.00 4.20 C ATOM 0 H THR A 343 7.471 -13.683 -2.817 1.00 33.01 H new ATOM 0 HA THR A 343 6.925 -11.288 -1.113 1.00 42.01 H new ATOM 0 HB THR A 343 7.127 -9.929 -2.998 1.00 63.02 H new ATOM 0 HG1 THR A 343 5.944 -11.434 -4.432 1.00 64.54 H new ATOM 0 HG21 THR A 343 9.271 -10.448 -4.104 1.00 4.20 H new ATOM 0 HG22 THR A 343 9.385 -10.769 -2.357 1.00 4.20 H new ATOM 0 HG23 THR A 343 9.192 -12.120 -3.500 1.00 4.20 H new ATOM 1534 N LEU A 344 4.701 -12.397 -1.075 1.00 32.12 N ATOM 1535 CA LEU A 344 3.280 -12.700 -1.073 1.00 13.11 C ATOM 1536 C LEU A 344 2.572 -11.813 -2.100 1.00 23.05 C ATOM 1537 O LEU A 344 2.982 -10.676 -2.330 1.00 34.22 O ATOM 1538 CB LEU A 344 2.708 -12.580 0.341 1.00 2.12 C ATOM 1539 CG LEU A 344 2.998 -13.750 1.283 1.00 33.23 C ATOM 1540 CD1 LEU A 344 4.501 -14.018 1.379 1.00 72.55 C ATOM 1541 CD2 LEU A 344 2.369 -13.516 2.658 1.00 0.33 C ATOM 0 H LEU A 344 5.139 -12.401 -0.154 1.00 32.12 H new ATOM 0 HA LEU A 344 3.111 -13.734 -1.374 1.00 13.11 H new ATOM 0 HB2 LEU A 344 3.099 -11.669 0.794 1.00 2.12 H new ATOM 0 HB3 LEU A 344 1.627 -12.459 0.265 1.00 2.12 H new ATOM 0 HG LEU A 344 2.537 -14.646 0.866 1.00 33.23 H new ATOM 0 HD11 LEU A 344 4.679 -14.854 2.055 1.00 72.55 H new ATOM 0 HD12 LEU A 344 4.891 -14.261 0.391 1.00 72.55 H new ATOM 0 HD13 LEU A 344 5.005 -13.130 1.760 1.00 72.55 H new ATOM 0 HD21 LEU A 344 2.590 -14.362 3.308 1.00 0.33 H new ATOM 0 HD22 LEU A 344 2.779 -12.606 3.095 1.00 0.33 H new ATOM 0 HD23 LEU A 344 1.289 -13.413 2.551 1.00 0.33 H new ATOM 1553 N LYS A 345 1.523 -12.366 -2.689 1.00 34.42 N ATOM 1554 CA LYS A 345 0.754 -11.640 -3.685 1.00 44.24 C ATOM 1555 C LYS A 345 -0.730 -11.697 -3.320 1.00 72.00 C ATOM 1556 O LYS A 345 -1.411 -10.672 -3.311 1.00 22.52 O ATOM 1557 CB LYS A 345 1.063 -12.166 -5.088 1.00 62.34 C ATOM 1558 CG LYS A 345 1.348 -13.669 -5.060 1.00 21.34 C ATOM 1559 CD LYS A 345 2.830 -13.941 -4.795 1.00 22.43 C ATOM 1560 CE LYS A 345 3.685 -13.539 -5.998 1.00 61.21 C ATOM 1561 NZ LYS A 345 3.325 -14.349 -7.184 1.00 11.15 N ATOM 0 H LYS A 345 1.187 -13.309 -2.496 1.00 34.42 H new ATOM 0 HA LYS A 345 1.039 -10.588 -3.694 1.00 44.24 H new ATOM 0 HB2 LYS A 345 0.220 -11.964 -5.750 1.00 62.34 H new ATOM 0 HB3 LYS A 345 1.923 -11.637 -5.497 1.00 62.34 H new ATOM 0 HG2 LYS A 345 0.744 -14.143 -4.287 1.00 21.34 H new ATOM 0 HG3 LYS A 345 1.057 -14.116 -6.011 1.00 21.34 H new ATOM 0 HD2 LYS A 345 3.153 -13.387 -3.913 1.00 22.43 H new ATOM 0 HD3 LYS A 345 2.976 -14.999 -4.578 1.00 22.43 H new ATOM 0 HE2 LYS A 345 3.542 -12.481 -6.216 1.00 61.21 H new ATOM 0 HE3 LYS A 345 4.741 -13.676 -5.763 1.00 61.21 H new ATOM 0 HZ1 LYS A 345 4.190 -14.718 -7.628 1.00 11.15 H new ATOM 0 HZ2 LYS A 345 2.720 -15.143 -6.892 1.00 11.15 H new ATOM 0 HZ3 LYS A 345 2.811 -13.756 -7.867 1.00 11.15 H new ATOM 1574 N SER A 346 -1.189 -12.905 -3.028 1.00 22.21 N ATOM 1575 CA SER A 346 -2.580 -13.109 -2.663 1.00 33.43 C ATOM 1576 C SER A 346 -2.997 -14.549 -2.973 1.00 1.42 C ATOM 1577 O SER A 346 -2.507 -15.148 -3.928 1.00 70.35 O ATOM 1578 CB SER A 346 -3.492 -12.123 -3.395 1.00 73.42 C ATOM 1579 OG SER A 346 -3.088 -11.925 -4.747 1.00 63.12 O ATOM 0 H SER A 346 -0.622 -13.753 -3.037 1.00 22.21 H new ATOM 0 HA SER A 346 -2.682 -12.930 -1.593 1.00 33.43 H new ATOM 0 HB2 SER A 346 -4.517 -12.493 -3.373 1.00 73.42 H new ATOM 0 HB3 SER A 346 -3.487 -11.167 -2.871 1.00 73.42 H new ATOM 0 HG SER A 346 -2.520 -11.129 -4.805 1.00 63.12 H new ATOM 1585 N PRO A 347 -3.921 -15.075 -2.125 1.00 2.21 N ATOM 1586 CA PRO A 347 -4.409 -16.432 -2.299 1.00 21.32 C ATOM 1587 C PRO A 347 -5.387 -16.517 -3.472 1.00 62.35 C ATOM 1588 O PRO A 347 -5.064 -17.086 -4.514 1.00 43.44 O ATOM 1589 CB PRO A 347 -5.046 -16.795 -0.967 1.00 50.13 C ATOM 1590 CG PRO A 347 -5.305 -15.477 -0.256 1.00 51.54 C ATOM 1591 CD PRO A 347 -4.523 -14.394 -0.982 1.00 72.04 C ATOM 0 HA PRO A 347 -3.615 -17.135 -2.551 1.00 21.32 H new ATOM 0 HB2 PRO A 347 -5.974 -17.348 -1.115 1.00 50.13 H new ATOM 0 HB3 PRO A 347 -4.386 -17.433 -0.379 1.00 50.13 H new ATOM 0 HG2 PRO A 347 -6.370 -15.245 -0.258 1.00 51.54 H new ATOM 0 HG3 PRO A 347 -4.994 -15.538 0.787 1.00 51.54 H new ATOM 0 HD2 PRO A 347 -5.176 -13.582 -1.303 1.00 72.04 H new ATOM 0 HD3 PRO A 347 -3.762 -13.955 -0.337 1.00 72.04 H new ATOM 1599 N LEU A 348 -6.563 -15.944 -3.264 1.00 42.41 N ATOM 1600 CA LEU A 348 -7.590 -15.947 -4.292 1.00 21.20 C ATOM 1601 C LEU A 348 -8.048 -14.511 -4.554 1.00 34.23 C ATOM 1602 O LEU A 348 -8.474 -14.184 -5.660 1.00 54.31 O ATOM 1603 CB LEU A 348 -8.728 -16.896 -3.909 1.00 45.02 C ATOM 1604 CG LEU A 348 -9.804 -17.116 -4.974 1.00 14.33 C ATOM 1605 CD1 LEU A 348 -10.652 -15.856 -5.164 1.00 61.44 C ATOM 1606 CD2 LEU A 348 -9.186 -17.595 -6.289 1.00 1.14 C ATOM 0 H LEU A 348 -6.828 -15.474 -2.398 1.00 42.41 H new ATOM 0 HA LEU A 348 -7.189 -16.330 -5.230 1.00 21.20 H new ATOM 0 HB2 LEU A 348 -8.297 -17.863 -3.651 1.00 45.02 H new ATOM 0 HB3 LEU A 348 -9.208 -16.511 -3.009 1.00 45.02 H new ATOM 0 HG LEU A 348 -10.471 -17.905 -4.627 1.00 14.33 H new ATOM 0 HD11 LEU A 348 -11.409 -16.039 -5.926 1.00 61.44 H new ATOM 0 HD12 LEU A 348 -11.139 -15.600 -4.223 1.00 61.44 H new ATOM 0 HD13 LEU A 348 -10.013 -15.031 -5.478 1.00 61.44 H new ATOM 0 HD21 LEU A 348 -9.973 -17.743 -7.028 1.00 1.14 H new ATOM 0 HD22 LEU A 348 -8.482 -16.847 -6.654 1.00 1.14 H new ATOM 0 HD23 LEU A 348 -8.662 -18.536 -6.123 1.00 1.14 H new