USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=26 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 -117:sc= -11.4! (180deg=-11.8!) USER MOD Set 1.2: A 336 CYS SG : rot -105:sc= -2.57 USER MOD Set 2.1: A 320 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 322 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 256 ASN : amide:sc= -5.97! C(o=-6.1!,f=-17!) USER MOD Set 3.2: A 314 THR OG1 : rot -80:sc= -0.104! USER MOD Single : A 251 HIS : no HD1:sc= -5.68! C(o=-5.7!,f=-4.9!) USER MOD Single : A 255 SER OG : rot 87:sc= 0.881 USER MOD Single : A 259 ASN : amide:sc= -0.166 K(o=-0.17,f=-1.5) USER MOD Single : A 260 SER OG : rot 39:sc= 1.25 USER MOD Single : A 262 HIS : no HD1:sc= -0.228 X(o=-0.23,f=-0.082) USER MOD Single : A 266 TYR OH : rot 180:sc= -0.57 USER MOD Single : A 267 ASN : amide:sc= -12.5! C(o=-13!,f=-21!) USER MOD Single : A 268 LYS NZ :NH3+ 142:sc= -0.479! (180deg=-5.45!) USER MOD Single : A 269 THR OG1 : rot 180:sc= 0 USER MOD Single : A 270 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 276 ASN : amide:sc= -0.33 K(o=-0.33,f=-2.6!) USER MOD Single : A 277 CYS SG : rot -94:sc= -0.939 USER MOD Single : A 278 THR OG1 : rot 180:sc= -1.52! USER MOD Single : A 282 SER OG : rot -17:sc= 0.665 USER MOD Single : A 283 SER OG : rot -172:sc= -1.35 USER MOD Single : A 290 SER OG : rot 180:sc= 0 USER MOD Single : A 292 LYS NZ :NH3+ 127:sc= -0.202 (180deg=-0.831) USER MOD Single : A 293 MET CE :methyl 146:sc= -2.29 (180deg=-4.46!) USER MOD Single : A 296 HIS : no HD1:sc= -0.489 X(o=-0.49,f=-0.52) 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+ -171:sc= -8.3! (180deg=-9.22!) USER MOD Single : A 311 SER OG : rot 180:sc= 0 USER MOD Single : A 317 SER OG : rot 158:sc= 0.0143 USER MOD Single : A 318 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.1!) USER MOD Single : A 319 TYR OH : rot 180:sc= 0 USER MOD Single : A 325 ASN : amide:sc= -11.8! 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= -0.123 USER MOD Single : A 335 LYS NZ :NH3+ -149:sc= -7.28! (180deg=-8.92!) USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 340 ASN : amide:sc= -0.52 K(o=-0.52,f=-4!) USER MOD Single : A 343 THR OG1 : rot 70:sc= 1.07 USER MOD Single : A 345 LYS NZ :NH3+ 150:sc= -0.0476 (180deg=-0.273) USER MOD Single : A 346 SER OG : rot 111:sc= 0.471 USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 249 3.567 -5.382 -1.033 1.00 34.11 N ATOM 43 CA LEU A 249 4.368 -6.584 -1.191 1.00 33.23 C ATOM 44 C LEU A 249 4.978 -6.966 0.159 1.00 32.14 C ATOM 45 O LEU A 249 5.339 -6.096 0.950 1.00 41.42 O ATOM 46 CB LEU A 249 5.402 -6.396 -2.302 1.00 62.51 C ATOM 47 CG LEU A 249 6.194 -5.088 -2.267 1.00 41.34 C ATOM 48 CD1 LEU A 249 6.714 -4.799 -0.858 1.00 2.11 C ATOM 49 CD2 LEU A 249 7.321 -5.101 -3.303 1.00 13.15 C ATOM 0 HA LEU A 249 3.743 -7.420 -1.507 1.00 33.23 H new ATOM 0 HB2 LEU A 249 6.107 -7.226 -2.259 1.00 62.51 H new ATOM 0 HB3 LEU A 249 4.890 -6.462 -3.262 1.00 62.51 H new ATOM 0 HG LEU A 249 5.520 -4.274 -2.534 1.00 41.34 H new ATOM 0 HD11 LEU A 249 7.273 -3.864 -0.861 1.00 2.11 H new ATOM 0 HD12 LEU A 249 5.873 -4.716 -0.170 1.00 2.11 H new ATOM 0 HD13 LEU A 249 7.367 -5.611 -0.537 1.00 2.11 H new ATOM 0 HD21 LEU A 249 7.868 -4.159 -3.257 1.00 13.15 H new ATOM 0 HD22 LEU A 249 8.001 -5.926 -3.091 1.00 13.15 H new ATOM 0 HD23 LEU A 249 6.898 -5.226 -4.300 1.00 13.15 H new ATOM 61 N LEU A 250 5.074 -8.269 0.382 1.00 11.40 N ATOM 62 CA LEU A 250 5.634 -8.776 1.623 1.00 61.41 C ATOM 63 C LEU A 250 6.910 -9.564 1.317 1.00 54.02 C ATOM 64 O LEU A 250 6.845 -10.720 0.900 1.00 1.44 O ATOM 65 CB LEU A 250 4.586 -9.580 2.395 1.00 54.21 C ATOM 66 CG LEU A 250 4.990 -10.037 3.798 1.00 41.21 C ATOM 67 CD1 LEU A 250 6.491 -9.846 4.025 1.00 11.13 C ATOM 68 CD2 LEU A 250 4.154 -9.330 4.867 1.00 70.50 C ATOM 0 H LEU A 250 4.773 -8.988 -0.276 1.00 11.40 H new ATOM 0 HA LEU A 250 5.916 -7.952 2.278 1.00 61.41 H new ATOM 0 HB2 LEU A 250 3.682 -8.976 2.477 1.00 54.21 H new ATOM 0 HB3 LEU A 250 4.328 -10.461 1.808 1.00 54.21 H new ATOM 0 HG LEU A 250 4.784 -11.104 3.882 1.00 41.21 H new ATOM 0 HD11 LEU A 250 6.752 -10.178 5.030 1.00 11.13 H new ATOM 0 HD12 LEU A 250 7.047 -10.432 3.293 1.00 11.13 H new ATOM 0 HD13 LEU A 250 6.744 -8.792 3.914 1.00 11.13 H new ATOM 0 HD21 LEU A 250 4.461 -9.673 5.855 1.00 70.50 H new ATOM 0 HD22 LEU A 250 4.305 -8.253 4.794 1.00 70.50 H new ATOM 0 HD23 LEU A 250 3.099 -9.560 4.715 1.00 70.50 H new ATOM 80 N HIS A 251 8.039 -8.907 1.535 1.00 23.01 N ATOM 81 CA HIS A 251 9.328 -9.531 1.288 1.00 71.32 C ATOM 82 C HIS A 251 9.817 -10.221 2.563 1.00 4.51 C ATOM 83 O HIS A 251 9.852 -9.609 3.630 1.00 44.44 O ATOM 84 CB HIS A 251 10.330 -8.512 0.743 1.00 51.41 C ATOM 85 CG HIS A 251 10.286 -8.349 -0.758 1.00 25.52 C ATOM 86 ND1 HIS A 251 9.841 -7.193 -1.374 1.00 75.54 N ATOM 87 CD2 HIS A 251 10.638 -9.208 -1.758 1.00 25.04 C ATOM 88 CE1 HIS A 251 9.924 -7.360 -2.686 1.00 72.31 C ATOM 89 NE2 HIS A 251 10.418 -8.610 -2.922 1.00 0.44 N ATOM 0 H HIS A 251 8.088 -7.948 1.880 1.00 23.01 H new ATOM 0 HA HIS A 251 9.224 -10.297 0.519 1.00 71.32 H new ATOM 0 HB2 HIS A 251 10.139 -7.545 1.209 1.00 51.41 H new ATOM 0 HB3 HIS A 251 11.335 -8.814 1.036 1.00 51.41 H new ATOM 0 HD2 HIS A 251 11.029 -10.206 -1.625 1.00 25.04 H new ATOM 0 HE1 HIS A 251 9.649 -6.634 -3.437 1.00 72.31 H new ATOM 0 HE2 HIS A 251 10.590 -9.017 -3.841 1.00 0.44 H new ATOM 97 N VAL A 252 10.183 -11.485 2.411 1.00 42.21 N ATOM 98 CA VAL A 252 10.669 -12.264 3.537 1.00 42.00 C ATOM 99 C VAL A 252 12.090 -12.749 3.241 1.00 52.11 C ATOM 100 O VAL A 252 12.553 -12.668 2.104 1.00 33.32 O ATOM 101 CB VAL A 252 9.698 -13.407 3.840 1.00 24.03 C ATOM 102 CG1 VAL A 252 10.178 -14.231 5.037 1.00 10.42 C ATOM 103 CG2 VAL A 252 8.282 -12.877 4.072 1.00 41.43 C ATOM 0 H VAL A 252 10.153 -11.989 1.525 1.00 42.21 H new ATOM 0 HA VAL A 252 10.716 -11.649 4.435 1.00 42.00 H new ATOM 0 HB VAL A 252 9.671 -14.063 2.970 1.00 24.03 H new ATOM 0 HG11 VAL A 252 9.470 -15.037 5.231 1.00 10.42 H new ATOM 0 HG12 VAL A 252 11.158 -14.654 4.818 1.00 10.42 H new ATOM 0 HG13 VAL A 252 10.248 -13.590 5.916 1.00 10.42 H new ATOM 0 HG21 VAL A 252 7.612 -13.710 4.285 1.00 41.43 H new ATOM 0 HG22 VAL A 252 8.285 -12.188 4.917 1.00 41.43 H new ATOM 0 HG23 VAL A 252 7.938 -12.354 3.179 1.00 41.43 H new ATOM 113 N GLU A 253 12.742 -13.242 4.284 1.00 51.25 N ATOM 114 CA GLU A 253 14.100 -13.740 4.150 1.00 44.35 C ATOM 115 C GLU A 253 14.207 -15.153 4.726 1.00 41.10 C ATOM 116 O GLU A 253 13.690 -15.426 5.808 1.00 23.32 O ATOM 117 CB GLU A 253 15.099 -12.796 4.823 1.00 61.24 C ATOM 118 CG GLU A 253 16.483 -13.442 4.921 1.00 51.44 C ATOM 119 CD GLU A 253 17.121 -13.583 3.537 1.00 1.12 C ATOM 120 OE1 GLU A 253 17.122 -12.622 2.754 1.00 42.31 O ATOM 121 OE2 GLU A 253 17.630 -14.742 3.287 1.00 12.33 O ATOM 0 H GLU A 253 12.355 -13.307 5.225 1.00 51.25 H new ATOM 0 HA GLU A 253 14.348 -13.782 3.089 1.00 44.35 H new ATOM 0 HB2 GLU A 253 15.166 -11.868 4.256 1.00 61.24 H new ATOM 0 HB3 GLU A 253 14.744 -12.535 5.820 1.00 61.24 H new ATOM 0 HG2 GLU A 253 17.126 -12.838 5.562 1.00 51.44 H new ATOM 0 HG3 GLU A 253 16.398 -14.423 5.388 1.00 51.44 H new ATOM 129 N VAL A 254 14.881 -16.014 3.977 1.00 10.34 N ATOM 130 CA VAL A 254 15.062 -17.392 4.401 1.00 40.14 C ATOM 131 C VAL A 254 16.527 -17.616 4.781 1.00 10.20 C ATOM 132 O VAL A 254 17.401 -17.632 3.916 1.00 61.41 O ATOM 133 CB VAL A 254 14.577 -18.344 3.305 1.00 14.33 C ATOM 134 CG1 VAL A 254 14.822 -19.802 3.698 1.00 43.13 C ATOM 135 CG2 VAL A 254 13.100 -18.103 2.985 1.00 60.21 C ATOM 0 H VAL A 254 15.308 -15.784 3.080 1.00 10.34 H new ATOM 0 HA VAL A 254 14.461 -17.602 5.286 1.00 40.14 H new ATOM 0 HB VAL A 254 15.153 -18.139 2.403 1.00 14.33 H new ATOM 0 HG11 VAL A 254 14.468 -20.458 2.902 1.00 43.13 H new ATOM 0 HG12 VAL A 254 15.889 -19.963 3.853 1.00 43.13 H new ATOM 0 HG13 VAL A 254 14.283 -20.026 4.619 1.00 43.13 H new ATOM 0 HG21 VAL A 254 12.780 -18.792 2.203 1.00 60.21 H new ATOM 0 HG22 VAL A 254 12.502 -18.268 3.881 1.00 60.21 H new ATOM 0 HG23 VAL A 254 12.965 -17.077 2.642 1.00 60.21 H new ATOM 145 N SER A 255 16.750 -17.782 6.076 1.00 31.44 N ATOM 146 CA SER A 255 18.094 -18.005 6.582 1.00 51.50 C ATOM 147 C SER A 255 18.495 -19.467 6.377 1.00 11.22 C ATOM 148 O SER A 255 19.414 -19.761 5.614 1.00 35.31 O ATOM 149 CB SER A 255 18.195 -17.629 8.062 1.00 52.34 C ATOM 150 OG SER A 255 17.770 -16.290 8.303 1.00 74.04 O ATOM 0 H SER A 255 16.022 -17.767 6.791 1.00 31.44 H new ATOM 0 HA SER A 255 18.779 -17.366 6.025 1.00 51.50 H new ATOM 0 HB2 SER A 255 17.587 -18.314 8.652 1.00 52.34 H new ATOM 0 HB3 SER A 255 19.225 -17.748 8.397 1.00 52.34 H new ATOM 0 HG SER A 255 16.800 -16.275 8.441 1.00 74.04 H new ATOM 156 N ASN A 256 17.786 -20.344 7.072 1.00 23.34 N ATOM 157 CA ASN A 256 18.057 -21.769 6.976 1.00 13.35 C ATOM 158 C ASN A 256 19.466 -22.052 7.501 1.00 72.31 C ATOM 159 O ASN A 256 20.369 -22.365 6.727 1.00 71.04 O ATOM 160 CB ASN A 256 17.988 -22.246 5.525 1.00 52.15 C ATOM 161 CG ASN A 256 17.522 -23.701 5.447 1.00 21.21 C ATOM 162 OD1 ASN A 256 16.547 -24.034 4.794 1.00 32.10 O ATOM 163 ND2 ASN A 256 18.272 -24.547 6.148 1.00 15.03 N ATOM 0 H ASN A 256 17.025 -20.096 7.704 1.00 23.34 H new ATOM 0 HA ASN A 256 17.306 -22.296 7.564 1.00 13.35 H new ATOM 0 HB2 ASN A 256 17.304 -21.611 4.962 1.00 52.15 H new ATOM 0 HB3 ASN A 256 18.969 -22.149 5.060 1.00 52.15 H new ATOM 0 HD21 ASN A 256 18.044 -25.541 6.160 1.00 15.03 H new ATOM 0 HD22 ASN A 256 19.075 -24.202 6.673 1.00 15.03 H new ATOM 170 N GLU A 257 19.610 -21.933 8.813 1.00 54.25 N ATOM 171 CA GLU A 257 20.893 -22.172 9.450 1.00 64.44 C ATOM 172 C GLU A 257 21.012 -23.639 9.871 1.00 53.44 C ATOM 173 O GLU A 257 20.016 -24.269 10.224 1.00 3.22 O ATOM 174 CB GLU A 257 21.094 -21.240 10.646 1.00 22.52 C ATOM 175 CG GLU A 257 20.922 -19.777 10.236 1.00 40.50 C ATOM 176 CD GLU A 257 21.235 -18.839 11.404 1.00 34.43 C ATOM 177 OE1 GLU A 257 20.974 -19.188 12.566 1.00 64.15 O ATOM 178 OE2 GLU A 257 21.768 -17.713 11.072 1.00 3.00 O ATOM 0 H GLU A 257 18.858 -21.674 9.452 1.00 54.25 H new ATOM 0 HA GLU A 257 21.681 -21.957 8.728 1.00 64.44 H new ATOM 0 HB2 GLU A 257 20.378 -21.488 11.429 1.00 22.52 H new ATOM 0 HB3 GLU A 257 22.089 -21.389 11.065 1.00 22.52 H new ATOM 0 HG2 GLU A 257 21.580 -19.551 9.397 1.00 40.50 H new ATOM 0 HG3 GLU A 257 19.901 -19.609 9.894 1.00 40.50 H new ATOM 186 N ASP A 258 22.237 -24.139 9.819 1.00 44.02 N ATOM 187 CA ASP A 258 22.499 -25.519 10.190 1.00 34.25 C ATOM 188 C ASP A 258 21.882 -25.799 11.563 1.00 40.24 C ATOM 189 O ASP A 258 21.395 -26.899 11.815 1.00 33.55 O ATOM 190 CB ASP A 258 24.002 -25.789 10.284 1.00 75.54 C ATOM 191 CG ASP A 258 24.383 -27.080 11.013 1.00 54.53 C ATOM 192 OD1 ASP A 258 23.852 -28.161 10.717 1.00 44.30 O ATOM 193 OD2 ASP A 258 25.277 -26.942 11.932 1.00 34.25 O ATOM 0 H ASP A 258 23.060 -23.613 9.525 1.00 44.02 H new ATOM 0 HA ASP A 258 22.064 -26.162 9.425 1.00 34.25 H new ATOM 0 HB2 ASP A 258 24.413 -25.824 9.275 1.00 75.54 H new ATOM 0 HB3 ASP A 258 24.476 -24.949 10.792 1.00 75.54 H new ATOM 199 N ASN A 259 21.923 -24.783 12.412 1.00 25.35 N ATOM 200 CA ASN A 259 21.375 -24.906 13.752 1.00 11.14 C ATOM 201 C ASN A 259 19.856 -25.070 13.664 1.00 3.11 C ATOM 202 O ASN A 259 19.284 -25.944 14.313 1.00 0.03 O ATOM 203 CB ASN A 259 21.668 -23.656 14.584 1.00 52.50 C ATOM 204 CG ASN A 259 21.185 -23.830 16.025 1.00 22.23 C ATOM 205 OD1 ASN A 259 20.001 -23.816 16.317 1.00 75.23 O ATOM 206 ND2 ASN A 259 22.166 -23.995 16.908 1.00 2.10 N ATOM 0 H ASN A 259 22.327 -23.871 12.198 1.00 25.35 H new ATOM 0 HA ASN A 259 21.837 -25.772 14.227 1.00 11.14 H new ATOM 0 HB2 ASN A 259 22.739 -23.454 14.578 1.00 52.50 H new ATOM 0 HB3 ASN A 259 21.178 -22.793 14.134 1.00 52.50 H new ATOM 0 HD21 ASN A 259 21.947 -24.120 17.896 1.00 2.10 H new ATOM 0 HD22 ASN A 259 23.137 -23.997 16.597 1.00 2.10 H new ATOM 213 N SER A 260 19.247 -24.216 12.855 1.00 10.43 N ATOM 214 CA SER A 260 17.806 -24.255 12.674 1.00 51.23 C ATOM 215 C SER A 260 17.388 -23.262 11.587 1.00 62.22 C ATOM 216 O SER A 260 18.237 -22.666 10.926 1.00 4.22 O ATOM 217 CB SER A 260 17.077 -23.946 13.983 1.00 41.11 C ATOM 218 OG SER A 260 16.793 -25.127 14.728 1.00 65.44 O ATOM 0 H SER A 260 19.725 -23.493 12.317 1.00 10.43 H new ATOM 0 HA SER A 260 17.528 -25.262 12.364 1.00 51.23 H new ATOM 0 HB2 SER A 260 17.686 -23.274 14.587 1.00 41.11 H new ATOM 0 HB3 SER A 260 16.146 -23.423 13.765 1.00 41.11 H new ATOM 0 HG SER A 260 17.546 -25.750 14.653 1.00 65.44 H new ATOM 224 N LEU A 261 16.080 -23.116 11.435 1.00 2.31 N ATOM 225 CA LEU A 261 15.540 -22.206 10.440 1.00 54.43 C ATOM 226 C LEU A 261 15.417 -20.807 11.047 1.00 12.31 C ATOM 227 O LEU A 261 15.428 -20.653 12.267 1.00 0.15 O ATOM 228 CB LEU A 261 14.225 -22.748 9.875 1.00 22.42 C ATOM 229 CG LEU A 261 14.337 -23.579 8.595 1.00 42.42 C ATOM 230 CD1 LEU A 261 12.984 -24.180 8.211 1.00 53.51 C ATOM 231 CD2 LEU A 261 14.941 -22.753 7.457 1.00 1.21 C ATOM 0 H LEU A 261 15.379 -23.613 11.984 1.00 2.31 H new ATOM 0 HA LEU A 261 16.218 -22.127 9.590 1.00 54.43 H new ATOM 0 HB2 LEU A 261 13.748 -23.359 10.641 1.00 22.42 H new ATOM 0 HB3 LEU A 261 13.561 -21.905 9.681 1.00 22.42 H new ATOM 0 HG LEU A 261 15.016 -24.410 8.786 1.00 42.42 H new ATOM 0 HD11 LEU A 261 13.092 -24.766 7.298 1.00 53.51 H new ATOM 0 HD12 LEU A 261 12.631 -24.825 9.016 1.00 53.51 H new ATOM 0 HD13 LEU A 261 12.264 -23.379 8.045 1.00 53.51 H new ATOM 0 HD21 LEU A 261 15.010 -23.367 6.559 1.00 1.21 H new ATOM 0 HD22 LEU A 261 14.307 -21.889 7.258 1.00 1.21 H new ATOM 0 HD23 LEU A 261 15.937 -22.414 7.742 1.00 1.21 H new ATOM 243 N HIS A 262 15.302 -19.822 10.168 1.00 65.53 N ATOM 244 CA HIS A 262 15.178 -18.441 10.602 1.00 32.50 C ATOM 245 C HIS A 262 14.574 -17.601 9.475 1.00 70.52 C ATOM 246 O HIS A 262 15.270 -17.230 8.531 1.00 70.41 O ATOM 247 CB HIS A 262 16.524 -17.901 11.088 1.00 20.33 C ATOM 248 CG HIS A 262 16.428 -17.030 12.318 1.00 23.32 C ATOM 249 ND1 HIS A 262 17.522 -16.730 13.111 1.00 41.41 N ATOM 250 CD2 HIS A 262 15.359 -16.399 12.882 1.00 51.52 C ATOM 251 CE1 HIS A 262 17.118 -15.952 14.105 1.00 75.25 C ATOM 252 NE2 HIS A 262 15.776 -15.749 13.961 1.00 4.41 N ATOM 0 H HIS A 262 15.292 -19.953 9.157 1.00 65.53 H new ATOM 0 HA HIS A 262 14.501 -18.384 11.454 1.00 32.50 H new ATOM 0 HB2 HIS A 262 17.185 -18.741 11.301 1.00 20.33 H new ATOM 0 HB3 HIS A 262 16.985 -17.327 10.284 1.00 20.33 H new ATOM 0 HD2 HIS A 262 14.344 -16.424 12.513 1.00 51.52 H new ATOM 0 HE1 HIS A 262 17.741 -15.550 14.890 1.00 75.25 H new ATOM 0 HE2 HIS A 262 15.190 -15.190 14.581 1.00 4.41 H new ATOM 260 N PHE A 263 13.285 -17.326 9.611 1.00 61.14 N ATOM 261 CA PHE A 263 12.580 -16.537 8.615 1.00 15.23 C ATOM 262 C PHE A 263 12.193 -15.167 9.176 1.00 54.33 C ATOM 263 O PHE A 263 11.602 -15.076 10.251 1.00 61.01 O ATOM 264 CB PHE A 263 11.307 -17.305 8.255 1.00 34.43 C ATOM 265 CG PHE A 263 11.553 -18.757 7.839 1.00 51.13 C ATOM 266 CD1 PHE A 263 12.213 -19.029 6.681 1.00 33.51 C ATOM 267 CD2 PHE A 263 11.112 -19.774 8.626 1.00 60.51 C ATOM 268 CE1 PHE A 263 12.441 -20.376 6.294 1.00 22.54 C ATOM 269 CE2 PHE A 263 11.341 -21.122 8.239 1.00 15.42 C ATOM 270 CZ PHE A 263 12.000 -21.394 7.082 1.00 63.14 C ATOM 0 H PHE A 263 12.711 -17.635 10.395 1.00 61.14 H new ATOM 0 HA PHE A 263 13.218 -16.378 7.746 1.00 15.23 H new ATOM 0 HB2 PHE A 263 10.633 -17.292 9.111 1.00 34.43 H new ATOM 0 HB3 PHE A 263 10.799 -16.786 7.442 1.00 34.43 H new ATOM 0 HD1 PHE A 263 12.563 -18.221 6.056 1.00 33.51 H new ATOM 0 HD2 PHE A 263 10.588 -19.557 9.545 1.00 60.51 H new ATOM 0 HE1 PHE A 263 12.964 -20.593 5.374 1.00 22.54 H new ATOM 0 HE2 PHE A 263 10.991 -21.930 8.864 1.00 15.42 H new ATOM 0 HZ PHE A 263 12.174 -22.419 6.788 1.00 63.14 H new ATOM 280 N ILE A 264 12.541 -14.135 8.422 1.00 42.44 N ATOM 281 CA ILE A 264 12.238 -12.773 8.830 1.00 72.44 C ATOM 282 C ILE A 264 11.334 -12.121 7.781 1.00 4.23 C ATOM 283 O ILE A 264 11.719 -11.989 6.620 1.00 21.34 O ATOM 284 CB ILE A 264 13.527 -11.995 9.101 1.00 70.35 C ATOM 285 CG1 ILE A 264 14.438 -12.762 10.061 1.00 3.44 C ATOM 286 CG2 ILE A 264 13.220 -10.584 9.605 1.00 53.21 C ATOM 287 CD1 ILE A 264 15.810 -12.093 10.166 1.00 25.12 C ATOM 0 H ILE A 264 13.030 -14.214 7.530 1.00 42.44 H new ATOM 0 HA ILE A 264 11.689 -12.770 9.771 1.00 72.44 H new ATOM 0 HB ILE A 264 14.067 -11.890 8.160 1.00 70.35 H new ATOM 0 HG12 ILE A 264 13.976 -12.809 11.047 1.00 3.44 H new ATOM 0 HG13 ILE A 264 14.555 -13.789 9.715 1.00 3.44 H new ATOM 0 HG21 ILE A 264 14.154 -10.053 9.790 1.00 53.21 H new ATOM 0 HG22 ILE A 264 12.640 -10.048 8.854 1.00 53.21 H new ATOM 0 HG23 ILE A 264 12.648 -10.645 10.531 1.00 53.21 H new ATOM 0 HD11 ILE A 264 16.438 -12.658 10.855 1.00 25.12 H new ATOM 0 HD12 ILE A 264 16.279 -12.069 9.183 1.00 25.12 H new ATOM 0 HD13 ILE A 264 15.691 -11.075 10.536 1.00 25.12 H new ATOM 299 N LEU A 265 10.150 -11.729 8.228 1.00 22.33 N ATOM 300 CA LEU A 265 9.189 -11.094 7.343 1.00 11.43 C ATOM 301 C LEU A 265 9.010 -9.632 7.757 1.00 1.44 C ATOM 302 O LEU A 265 8.967 -9.320 8.947 1.00 74.54 O ATOM 303 CB LEU A 265 7.882 -11.888 7.312 1.00 31.44 C ATOM 304 CG LEU A 265 7.962 -13.331 7.816 1.00 11.24 C ATOM 305 CD1 LEU A 265 7.613 -13.412 9.304 1.00 74.13 C ATOM 306 CD2 LEU A 265 7.086 -14.257 6.970 1.00 14.44 C ATOM 0 H LEU A 265 9.835 -11.839 9.192 1.00 22.33 H new ATOM 0 HA LEU A 265 9.559 -11.093 6.318 1.00 11.43 H new ATOM 0 HB2 LEU A 265 7.142 -11.356 7.910 1.00 31.44 H new ATOM 0 HB3 LEU A 265 7.513 -11.902 6.287 1.00 31.44 H new ATOM 0 HG LEU A 265 8.991 -13.674 7.707 1.00 11.24 H new ATOM 0 HD11 LEU A 265 7.677 -14.448 9.637 1.00 74.13 H new ATOM 0 HD12 LEU A 265 8.313 -12.803 9.876 1.00 74.13 H new ATOM 0 HD13 LEU A 265 6.599 -13.043 9.461 1.00 74.13 H new ATOM 0 HD21 LEU A 265 7.161 -15.276 7.350 1.00 14.44 H new ATOM 0 HD22 LEU A 265 6.049 -13.926 7.023 1.00 14.44 H new ATOM 0 HD23 LEU A 265 7.423 -14.230 5.934 1.00 14.44 H new ATOM 318 N TYR A 266 8.911 -8.773 6.753 1.00 62.30 N ATOM 319 CA TYR A 266 8.738 -7.352 6.998 1.00 40.51 C ATOM 320 C TYR A 266 7.526 -6.808 6.238 1.00 45.21 C ATOM 321 O TYR A 266 7.516 -6.794 5.008 1.00 51.40 O ATOM 322 CB TYR A 266 10.004 -6.675 6.467 1.00 35.02 C ATOM 323 CG TYR A 266 11.288 -7.461 6.736 1.00 44.03 C ATOM 324 CD1 TYR A 266 11.946 -7.318 7.941 1.00 41.34 C ATOM 325 CD2 TYR A 266 11.790 -8.313 5.773 1.00 71.20 C ATOM 326 CE1 TYR A 266 13.155 -8.057 8.193 1.00 24.43 C ATOM 327 CE2 TYR A 266 12.999 -9.053 6.026 1.00 43.03 C ATOM 328 CZ TYR A 266 13.622 -8.889 7.223 1.00 3.44 C ATOM 329 OH TYR A 266 14.764 -9.587 7.462 1.00 25.20 O ATOM 0 H TYR A 266 8.947 -9.034 5.768 1.00 62.30 H new ATOM 0 HA TYR A 266 8.576 -7.163 8.059 1.00 40.51 H new ATOM 0 HB2 TYR A 266 9.900 -6.525 5.392 1.00 35.02 H new ATOM 0 HB3 TYR A 266 10.093 -5.687 6.920 1.00 35.02 H new ATOM 0 HD1 TYR A 266 11.554 -6.651 8.695 1.00 41.34 H new ATOM 0 HD2 TYR A 266 11.276 -8.425 4.830 1.00 71.20 H new ATOM 0 HE1 TYR A 266 13.680 -7.953 9.131 1.00 24.43 H new ATOM 0 HE2 TYR A 266 13.402 -9.723 5.281 1.00 43.03 H new ATOM 0 HH TYR A 266 14.978 -10.141 6.683 1.00 25.20 H new ATOM 339 N ASN A 267 6.535 -6.373 7.002 1.00 60.41 N ATOM 340 CA ASN A 267 5.321 -5.830 6.416 1.00 64.11 C ATOM 341 C ASN A 267 5.637 -4.489 5.751 1.00 45.01 C ATOM 342 O ASN A 267 5.331 -3.432 6.300 1.00 33.02 O ATOM 343 CB ASN A 267 4.254 -5.588 7.485 1.00 3.31 C ATOM 344 CG ASN A 267 4.747 -4.590 8.535 1.00 11.11 C ATOM 345 OD1 ASN A 267 5.880 -4.139 8.517 1.00 43.32 O ATOM 346 ND2 ASN A 267 3.835 -4.272 9.449 1.00 14.11 N ATOM 0 H ASN A 267 6.548 -6.385 8.022 1.00 60.41 H new ATOM 0 HA ASN A 267 4.946 -6.550 5.689 1.00 64.11 H new ATOM 0 HB2 ASN A 267 3.345 -5.210 7.017 1.00 3.31 H new ATOM 0 HB3 ASN A 267 3.996 -6.531 7.967 1.00 3.31 H new ATOM 0 HD21 ASN A 267 4.067 -3.614 10.193 1.00 14.11 H new ATOM 0 HD22 ASN A 267 2.904 -4.686 9.406 1.00 14.11 H new ATOM 353 N LYS A 268 6.247 -4.576 4.578 1.00 51.44 N ATOM 354 CA LYS A 268 6.608 -3.382 3.832 1.00 50.02 C ATOM 355 C LYS A 268 5.368 -2.835 3.122 1.00 12.44 C ATOM 356 O LYS A 268 5.375 -2.650 1.906 1.00 33.22 O ATOM 357 CB LYS A 268 7.778 -3.672 2.889 1.00 33.44 C ATOM 358 CG LYS A 268 9.112 -3.300 3.540 1.00 75.10 C ATOM 359 CD LYS A 268 9.309 -4.054 4.857 1.00 72.25 C ATOM 360 CE LYS A 268 8.842 -3.212 6.046 1.00 63.32 C ATOM 361 NZ LYS A 268 9.728 -3.427 7.212 1.00 70.10 N ATOM 0 H LYS A 268 6.500 -5.454 4.126 1.00 51.44 H new ATOM 0 HA LYS A 268 6.959 -2.603 4.508 1.00 50.02 H new ATOM 0 HB2 LYS A 268 7.782 -4.729 2.622 1.00 33.44 H new ATOM 0 HB3 LYS A 268 7.652 -3.110 1.963 1.00 33.44 H new ATOM 0 HG2 LYS A 268 9.930 -3.532 2.858 1.00 75.10 H new ATOM 0 HG3 LYS A 268 9.144 -2.226 3.723 1.00 75.10 H new ATOM 0 HD2 LYS A 268 8.753 -4.991 4.830 1.00 72.25 H new ATOM 0 HD3 LYS A 268 10.361 -4.311 4.979 1.00 72.25 H new ATOM 0 HE2 LYS A 268 8.839 -2.157 5.773 1.00 63.32 H new ATOM 0 HE3 LYS A 268 7.817 -3.477 6.307 1.00 63.32 H new ATOM 0 HZ1 LYS A 268 9.864 -2.527 7.716 1.00 70.10 H new ATOM 0 HZ2 LYS A 268 9.295 -4.121 7.854 1.00 70.10 H new ATOM 0 HZ3 LYS A 268 10.649 -3.784 6.887 1.00 70.10 H new ATOM 374 N THR A 269 4.333 -2.590 3.913 1.00 71.24 N ATOM 375 CA THR A 269 3.088 -2.068 3.375 1.00 0.43 C ATOM 376 C THR A 269 2.687 -0.786 4.108 1.00 3.13 C ATOM 377 O THR A 269 3.467 -0.244 4.890 1.00 42.33 O ATOM 378 CB THR A 269 2.034 -3.173 3.464 1.00 70.13 C ATOM 379 OG1 THR A 269 1.702 -3.226 4.848 1.00 14.03 O ATOM 380 CG2 THR A 269 2.612 -4.558 3.166 1.00 33.20 C ATOM 0 H THR A 269 4.331 -2.743 4.921 1.00 71.24 H new ATOM 0 HA THR A 269 3.197 -1.787 2.328 1.00 0.43 H new ATOM 0 HB THR A 269 1.224 -2.959 2.766 1.00 70.13 H new ATOM 0 HG1 THR A 269 1.022 -3.916 4.995 1.00 14.03 H new ATOM 0 HG21 THR A 269 1.823 -5.306 3.243 1.00 33.20 H new ATOM 0 HG22 THR A 269 3.027 -4.570 2.158 1.00 33.20 H new ATOM 0 HG23 THR A 269 3.399 -4.786 3.885 1.00 33.20 H new ATOM 388 N ASN A 270 1.472 -0.339 3.830 1.00 14.31 N ATOM 389 CA ASN A 270 0.958 0.869 4.453 1.00 13.22 C ATOM 390 C ASN A 270 0.147 0.492 5.695 1.00 4.10 C ATOM 391 O ASN A 270 0.394 1.011 6.783 1.00 54.54 O ATOM 392 CB ASN A 270 0.035 1.631 3.500 1.00 71.01 C ATOM 393 CG ASN A 270 -0.177 3.070 3.975 1.00 34.31 C ATOM 394 OD1 ASN A 270 0.707 3.908 3.914 1.00 51.12 O ATOM 395 ND2 ASN A 270 -1.396 3.308 4.451 1.00 32.00 N ATOM 0 H ASN A 270 0.828 -0.792 3.181 1.00 14.31 H new ATOM 0 HA ASN A 270 1.807 1.500 4.715 1.00 13.22 H new ATOM 0 HB2 ASN A 270 0.464 1.635 2.498 1.00 71.01 H new ATOM 0 HB3 ASN A 270 -0.926 1.121 3.433 1.00 71.01 H new ATOM 0 HD21 ASN A 270 -1.637 4.238 4.793 1.00 32.00 H new ATOM 0 HD22 ASN A 270 -2.090 2.560 4.474 1.00 32.00 H new ATOM 402 N ILE A 271 -0.803 -0.409 5.491 1.00 3.44 N ATOM 403 CA ILE A 271 -1.651 -0.861 6.581 1.00 23.21 C ATOM 404 C ILE A 271 -0.777 -1.442 7.694 1.00 24.43 C ATOM 405 O ILE A 271 0.422 -1.645 7.505 1.00 33.44 O ATOM 406 CB ILE A 271 -2.715 -1.832 6.064 1.00 5.14 C ATOM 407 CG1 ILE A 271 -2.095 -3.185 5.707 1.00 13.33 C ATOM 408 CG2 ILE A 271 -3.485 -1.226 4.889 1.00 31.25 C ATOM 409 CD1 ILE A 271 -3.138 -4.302 5.782 1.00 51.11 C ATOM 0 H ILE A 271 -1.004 -0.838 4.588 1.00 3.44 H new ATOM 0 HA ILE A 271 -2.199 -0.023 7.011 1.00 23.21 H new ATOM 0 HB ILE A 271 -3.435 -2.009 6.864 1.00 5.14 H new ATOM 0 HG12 ILE A 271 -1.674 -3.143 4.703 1.00 13.33 H new ATOM 0 HG13 ILE A 271 -1.273 -3.404 6.388 1.00 13.33 H new ATOM 0 HG21 ILE A 271 -4.235 -1.936 4.540 1.00 31.25 H new ATOM 0 HG22 ILE A 271 -3.977 -0.308 5.211 1.00 31.25 H new ATOM 0 HG23 ILE A 271 -2.793 -1.002 4.077 1.00 31.25 H new ATOM 0 HD11 ILE A 271 -2.672 -5.253 5.524 1.00 51.11 H new ATOM 0 HD12 ILE A 271 -3.540 -4.358 6.794 1.00 51.11 H new ATOM 0 HD13 ILE A 271 -3.947 -4.092 5.082 1.00 51.11 H new ATOM 421 N ILE A 272 -1.410 -1.694 8.830 1.00 14.33 N ATOM 422 CA ILE A 272 -0.706 -2.247 9.974 1.00 65.51 C ATOM 423 C ILE A 272 -1.091 -3.719 10.142 1.00 41.45 C ATOM 424 O ILE A 272 -2.105 -4.163 9.605 1.00 25.53 O ATOM 425 CB ILE A 272 -0.959 -1.399 11.222 1.00 72.23 C ATOM 426 CG1 ILE A 272 -0.342 -0.007 11.073 1.00 22.22 C ATOM 427 CG2 ILE A 272 -0.464 -2.114 12.481 1.00 74.44 C ATOM 428 CD1 ILE A 272 -1.223 0.894 10.206 1.00 34.03 C ATOM 0 H ILE A 272 -2.404 -1.525 8.983 1.00 14.33 H new ATOM 0 HA ILE A 272 0.371 -2.215 9.809 1.00 65.51 H new ATOM 0 HB ILE A 272 -2.035 -1.264 11.331 1.00 72.23 H new ATOM 0 HG12 ILE A 272 -0.212 0.444 12.057 1.00 22.22 H new ATOM 0 HG13 ILE A 272 0.649 -0.091 10.627 1.00 22.22 H new ATOM 0 HG21 ILE A 272 -0.656 -1.489 13.353 1.00 74.44 H new ATOM 0 HG22 ILE A 272 -0.989 -3.063 12.591 1.00 74.44 H new ATOM 0 HG23 ILE A 272 0.607 -2.300 12.397 1.00 74.44 H new ATOM 0 HD11 ILE A 272 -0.761 1.877 10.116 1.00 34.03 H new ATOM 0 HD12 ILE A 272 -1.331 0.452 9.215 1.00 34.03 H new ATOM 0 HD13 ILE A 272 -2.205 0.995 10.667 1.00 34.03 H new ATOM 440 N ILE A 273 -0.262 -4.433 10.888 1.00 65.11 N ATOM 441 CA ILE A 273 -0.503 -5.845 11.133 1.00 43.11 C ATOM 442 C ILE A 273 -1.306 -6.004 12.426 1.00 45.14 C ATOM 443 O ILE A 273 -1.029 -5.333 13.419 1.00 63.41 O ATOM 444 CB ILE A 273 0.815 -6.622 11.128 1.00 60.32 C ATOM 445 CG1 ILE A 273 1.245 -6.964 9.700 1.00 54.25 C ATOM 446 CG2 ILE A 273 0.720 -7.868 12.011 1.00 21.01 C ATOM 447 CD1 ILE A 273 0.136 -7.713 8.958 1.00 52.13 C ATOM 0 H ILE A 273 0.578 -4.060 11.331 1.00 65.11 H new ATOM 0 HA ILE A 273 -1.102 -6.274 10.330 1.00 43.11 H new ATOM 0 HB ILE A 273 1.589 -5.983 11.553 1.00 60.32 H new ATOM 0 HG12 ILE A 273 1.494 -6.049 9.162 1.00 54.25 H new ATOM 0 HG13 ILE A 273 2.148 -7.575 9.725 1.00 54.25 H new ATOM 0 HG21 ILE A 273 1.670 -8.402 11.990 1.00 21.01 H new ATOM 0 HG22 ILE A 273 0.493 -7.572 13.035 1.00 21.01 H new ATOM 0 HG23 ILE A 273 -0.071 -8.519 11.638 1.00 21.01 H new ATOM 0 HD11 ILE A 273 0.467 -7.944 7.946 1.00 52.13 H new ATOM 0 HD12 ILE A 273 -0.093 -8.639 9.485 1.00 52.13 H new ATOM 0 HD13 ILE A 273 -0.757 -7.090 8.914 1.00 52.13 H new ATOM 459 N PRO A 274 -2.310 -6.919 12.369 1.00 11.15 N ATOM 460 CA PRO A 274 -3.155 -7.174 13.524 1.00 60.54 C ATOM 461 C PRO A 274 -2.412 -8.003 14.574 1.00 15.21 C ATOM 462 O PRO A 274 -2.751 -7.961 15.756 1.00 51.12 O ATOM 463 CB PRO A 274 -4.379 -7.882 12.966 1.00 53.20 C ATOM 464 CG PRO A 274 -3.970 -8.410 11.601 1.00 41.45 C ATOM 465 CD PRO A 274 -2.667 -7.731 11.210 1.00 20.31 C ATOM 0 HA PRO A 274 -3.442 -6.261 14.046 1.00 60.54 H new ATOM 0 HB2 PRO A 274 -4.692 -8.695 13.621 1.00 53.20 H new ATOM 0 HB3 PRO A 274 -5.222 -7.197 12.883 1.00 53.20 H new ATOM 0 HG2 PRO A 274 -3.842 -9.492 11.633 1.00 41.45 H new ATOM 0 HG3 PRO A 274 -4.745 -8.202 10.863 1.00 41.45 H new ATOM 0 HD2 PRO A 274 -1.891 -8.463 10.985 1.00 20.31 H new ATOM 0 HD3 PRO A 274 -2.793 -7.116 10.319 1.00 20.31 H new ATOM 473 N GLY A 275 -1.414 -8.736 14.105 1.00 23.32 N ATOM 474 CA GLY A 275 -0.620 -9.573 14.989 1.00 33.04 C ATOM 475 C GLY A 275 -1.404 -10.816 15.417 1.00 4.34 C ATOM 476 O GLY A 275 -2.628 -10.850 15.308 1.00 13.03 O ATOM 0 H GLY A 275 -1.136 -8.768 13.124 1.00 23.32 H new ATOM 0 HA2 GLY A 275 0.298 -9.874 14.484 1.00 33.04 H new ATOM 0 HA3 GLY A 275 -0.327 -9.002 15.870 1.00 33.04 H new ATOM 480 N ASN A 276 -0.665 -11.806 15.896 1.00 62.14 N ATOM 481 CA ASN A 276 -1.275 -13.048 16.341 1.00 41.54 C ATOM 482 C ASN A 276 -1.542 -13.943 15.129 1.00 44.42 C ATOM 483 O ASN A 276 -2.389 -14.832 15.184 1.00 33.22 O ATOM 484 CB ASN A 276 -2.611 -12.786 17.038 1.00 11.50 C ATOM 485 CG ASN A 276 -2.799 -13.722 18.233 1.00 23.03 C ATOM 486 OD1 ASN A 276 -1.888 -14.409 18.665 1.00 20.34 O ATOM 487 ND2 ASN A 276 -4.028 -13.711 18.742 1.00 43.15 N ATOM 0 H ASN A 276 0.351 -11.773 15.986 1.00 62.14 H new ATOM 0 HA ASN A 276 -0.591 -13.528 17.041 1.00 41.54 H new ATOM 0 HB2 ASN A 276 -2.653 -11.750 17.373 1.00 11.50 H new ATOM 0 HB3 ASN A 276 -3.428 -12.926 16.330 1.00 11.50 H new ATOM 0 HD21 ASN A 276 -4.254 -14.302 19.542 1.00 43.15 H new ATOM 0 HD22 ASN A 276 -4.744 -13.112 18.332 1.00 43.15 H new ATOM 494 N CYS A 277 -0.802 -13.676 14.062 1.00 31.22 N ATOM 495 CA CYS A 277 -0.948 -14.446 12.839 1.00 71.52 C ATOM 496 C CYS A 277 -0.420 -15.859 13.095 1.00 65.23 C ATOM 497 O CYS A 277 0.000 -16.177 14.207 1.00 52.04 O ATOM 498 CB CYS A 277 -0.239 -13.776 11.660 1.00 23.35 C ATOM 499 SG CYS A 277 -1.277 -12.426 10.991 1.00 62.22 S ATOM 0 H CYS A 277 -0.100 -12.937 14.020 1.00 31.22 H new ATOM 0 HA CYS A 277 -2.001 -14.497 12.562 1.00 71.52 H new ATOM 0 HB2 CYS A 277 0.724 -13.380 11.982 1.00 23.35 H new ATOM 0 HB3 CYS A 277 -0.037 -14.511 10.881 1.00 23.35 H new ATOM 0 HG CYS A 277 -1.991 -12.877 10.002 1.00 62.22 H new ATOM 505 N THR A 278 -0.457 -16.669 12.047 1.00 23.30 N ATOM 506 CA THR A 278 0.013 -18.041 12.144 1.00 4.23 C ATOM 507 C THR A 278 0.475 -18.545 10.775 1.00 12.35 C ATOM 508 O THR A 278 -0.346 -18.819 9.902 1.00 74.50 O ATOM 509 CB THR A 278 -1.108 -18.883 12.755 1.00 14.23 C ATOM 510 OG1 THR A 278 -1.718 -18.012 13.704 1.00 33.45 O ATOM 511 CG2 THR A 278 -0.577 -20.042 13.601 1.00 44.13 C ATOM 0 H THR A 278 -0.805 -16.402 11.126 1.00 23.30 H new ATOM 0 HA THR A 278 0.885 -18.115 12.794 1.00 4.23 H new ATOM 0 HB THR A 278 -1.741 -19.276 11.959 1.00 14.23 H new ATOM 0 HG1 THR A 278 -2.458 -18.478 14.147 1.00 33.45 H new ATOM 0 HG21 THR A 278 -1.414 -20.607 14.011 1.00 44.13 H new ATOM 0 HG22 THR A 278 0.033 -20.697 12.979 1.00 44.13 H new ATOM 0 HG23 THR A 278 0.029 -19.649 14.417 1.00 44.13 H new ATOM 519 N PHE A 279 1.788 -18.651 10.631 1.00 14.24 N ATOM 520 CA PHE A 279 2.368 -19.117 9.384 1.00 43.24 C ATOM 521 C PHE A 279 1.895 -20.534 9.054 1.00 54.11 C ATOM 522 O PHE A 279 1.225 -21.173 9.864 1.00 1.32 O ATOM 523 CB PHE A 279 3.886 -19.131 9.574 1.00 2.24 C ATOM 524 CG PHE A 279 4.670 -18.626 8.362 1.00 45.34 C ATOM 525 CD1 PHE A 279 4.228 -17.543 7.668 1.00 15.33 C ATOM 526 CD2 PHE A 279 5.810 -19.260 7.977 1.00 44.22 C ATOM 527 CE1 PHE A 279 4.955 -17.074 6.543 1.00 63.13 C ATOM 528 CE2 PHE A 279 6.538 -18.791 6.851 1.00 22.11 C ATOM 529 CZ PHE A 279 6.095 -17.708 6.158 1.00 63.12 C ATOM 0 H PHE A 279 2.466 -18.422 11.358 1.00 14.24 H new ATOM 0 HA PHE A 279 2.066 -18.462 8.567 1.00 43.24 H new ATOM 0 HB2 PHE A 279 4.139 -18.518 10.439 1.00 2.24 H new ATOM 0 HB3 PHE A 279 4.204 -20.149 9.801 1.00 2.24 H new ATOM 0 HD1 PHE A 279 3.323 -17.039 7.973 1.00 15.33 H new ATOM 0 HD2 PHE A 279 6.162 -20.120 8.527 1.00 44.22 H new ATOM 0 HE1 PHE A 279 4.603 -16.214 5.993 1.00 63.13 H new ATOM 0 HE2 PHE A 279 7.443 -19.294 6.545 1.00 22.11 H new ATOM 0 HZ PHE A 279 6.648 -17.351 5.302 1.00 63.12 H new ATOM 539 N GLU A 280 2.261 -20.984 7.863 1.00 52.33 N ATOM 540 CA GLU A 280 1.882 -22.313 7.416 1.00 73.41 C ATOM 541 C GLU A 280 2.658 -22.690 6.153 1.00 63.43 C ATOM 542 O GLU A 280 2.227 -22.389 5.041 1.00 13.42 O ATOM 543 CB GLU A 280 0.373 -22.403 7.179 1.00 51.30 C ATOM 544 CG GLU A 280 -0.007 -23.752 6.565 1.00 1.23 C ATOM 545 CD GLU A 280 -1.515 -23.837 6.319 1.00 65.11 C ATOM 546 OE1 GLU A 280 -2.175 -22.801 6.152 1.00 61.15 O ATOM 547 OE2 GLU A 280 -1.998 -25.033 6.304 1.00 63.24 O ATOM 0 H GLU A 280 2.816 -20.451 7.194 1.00 52.33 H new ATOM 0 HA GLU A 280 2.136 -23.025 8.201 1.00 73.41 H new ATOM 0 HB2 GLU A 280 -0.155 -22.267 8.123 1.00 51.30 H new ATOM 0 HB3 GLU A 280 0.057 -21.596 6.518 1.00 51.30 H new ATOM 0 HG2 GLU A 280 0.527 -23.891 5.625 1.00 1.23 H new ATOM 0 HG3 GLU A 280 0.303 -24.558 7.230 1.00 1.23 H new ATOM 555 N PHE A 281 3.791 -23.345 6.366 1.00 54.42 N ATOM 556 CA PHE A 281 4.631 -23.766 5.258 1.00 3.02 C ATOM 557 C PHE A 281 4.724 -25.292 5.190 1.00 42.33 C ATOM 558 O PHE A 281 4.695 -25.966 6.218 1.00 3.33 O ATOM 559 CB PHE A 281 6.027 -23.193 5.513 1.00 51.12 C ATOM 560 CG PHE A 281 6.533 -23.400 6.942 1.00 44.03 C ATOM 561 CD1 PHE A 281 6.083 -22.601 7.945 1.00 14.44 C ATOM 562 CD2 PHE A 281 7.434 -24.383 7.208 1.00 64.20 C ATOM 563 CE1 PHE A 281 6.553 -22.793 9.271 1.00 13.34 C ATOM 564 CE2 PHE A 281 7.905 -24.575 8.534 1.00 34.31 C ATOM 565 CZ PHE A 281 7.454 -23.776 9.538 1.00 53.12 C ATOM 0 H PHE A 281 4.146 -23.594 7.289 1.00 54.42 H new ATOM 0 HA PHE A 281 4.211 -23.412 4.317 1.00 3.02 H new ATOM 0 HB2 PHE A 281 6.730 -23.654 4.819 1.00 51.12 H new ATOM 0 HB3 PHE A 281 6.016 -22.125 5.293 1.00 51.12 H new ATOM 0 HD1 PHE A 281 5.368 -21.820 7.733 1.00 14.44 H new ATOM 0 HD2 PHE A 281 7.792 -25.018 6.411 1.00 64.20 H new ATOM 0 HE1 PHE A 281 6.195 -22.158 10.068 1.00 13.34 H new ATOM 0 HE2 PHE A 281 8.621 -25.355 8.745 1.00 34.31 H new ATOM 0 HZ PHE A 281 7.811 -23.922 10.547 1.00 53.12 H new ATOM 575 N SER A 282 4.834 -25.792 3.968 1.00 53.33 N ATOM 576 CA SER A 282 4.931 -27.225 3.752 1.00 71.34 C ATOM 577 C SER A 282 6.308 -27.728 4.190 1.00 33.43 C ATOM 578 O SER A 282 7.140 -26.949 4.651 1.00 13.53 O ATOM 579 CB SER A 282 4.679 -27.579 2.285 1.00 61.43 C ATOM 580 OG SER A 282 5.735 -27.132 1.439 1.00 60.24 O ATOM 0 H SER A 282 4.858 -25.230 3.117 1.00 53.33 H new ATOM 0 HA SER A 282 4.164 -27.714 4.353 1.00 71.34 H new ATOM 0 HB2 SER A 282 4.568 -28.659 2.187 1.00 61.43 H new ATOM 0 HB3 SER A 282 3.740 -27.131 1.960 1.00 61.43 H new ATOM 0 HG SER A 282 6.272 -26.462 1.912 1.00 60.24 H new ATOM 586 N SER A 283 6.505 -29.029 4.031 1.00 3.23 N ATOM 587 CA SER A 283 7.767 -29.645 4.405 1.00 32.32 C ATOM 588 C SER A 283 7.964 -30.948 3.627 1.00 51.44 C ATOM 589 O SER A 283 7.081 -31.369 2.881 1.00 41.23 O ATOM 590 CB SER A 283 7.824 -29.913 5.910 1.00 22.04 C ATOM 591 OG SER A 283 7.250 -28.849 6.664 1.00 15.12 O ATOM 0 H SER A 283 5.812 -29.673 3.649 1.00 3.23 H new ATOM 0 HA SER A 283 8.572 -28.954 4.155 1.00 32.32 H new ATOM 0 HB2 SER A 283 7.297 -30.841 6.133 1.00 22.04 H new ATOM 0 HB3 SER A 283 8.861 -30.054 6.214 1.00 22.04 H new ATOM 0 HG SER A 283 7.417 -28.997 7.618 1.00 15.12 H new ATOM 660 N VAL A 288 2.629 -30.276 7.125 1.00 71.43 N ATOM 661 CA VAL A 288 2.650 -28.829 7.248 1.00 50.35 C ATOM 662 C VAL A 288 2.526 -28.445 8.723 1.00 12.53 C ATOM 663 O VAL A 288 1.901 -29.161 9.504 1.00 0.53 O ATOM 664 CB VAL A 288 1.554 -28.214 6.375 1.00 13.53 C ATOM 665 CG1 VAL A 288 0.165 -28.587 6.896 1.00 15.03 C ATOM 666 CG2 VAL A 288 1.715 -26.695 6.282 1.00 13.14 C ATOM 0 HA VAL A 288 3.597 -28.428 6.887 1.00 50.35 H new ATOM 0 HB VAL A 288 1.656 -28.624 5.370 1.00 13.53 H new ATOM 0 HG11 VAL A 288 -0.596 -28.137 6.258 1.00 15.03 H new ATOM 0 HG12 VAL A 288 0.052 -29.671 6.887 1.00 15.03 H new ATOM 0 HG13 VAL A 288 0.048 -28.219 7.915 1.00 15.03 H new ATOM 0 HG21 VAL A 288 0.924 -26.283 5.656 1.00 13.14 H new ATOM 0 HG22 VAL A 288 1.652 -26.261 7.280 1.00 13.14 H new ATOM 0 HG23 VAL A 288 2.685 -26.458 5.844 1.00 13.14 H new ATOM 676 N PHE A 289 3.131 -27.315 9.061 1.00 72.24 N ATOM 677 CA PHE A 289 3.096 -26.827 10.429 1.00 72.21 C ATOM 678 C PHE A 289 2.774 -25.332 10.470 1.00 54.03 C ATOM 679 O PHE A 289 3.191 -24.579 9.591 1.00 24.13 O ATOM 680 CB PHE A 289 4.489 -27.053 11.020 1.00 53.10 C ATOM 681 CG PHE A 289 4.498 -27.236 12.539 1.00 31.10 C ATOM 682 CD1 PHE A 289 3.982 -28.367 13.091 1.00 55.13 C ATOM 683 CD2 PHE A 289 5.022 -26.268 13.337 1.00 22.15 C ATOM 684 CE1 PHE A 289 3.990 -28.537 14.500 1.00 10.24 C ATOM 685 CE2 PHE A 289 5.031 -26.438 14.747 1.00 14.03 C ATOM 686 CZ PHE A 289 4.514 -27.569 15.299 1.00 43.20 C ATOM 0 H PHE A 289 3.648 -26.724 8.411 1.00 72.24 H new ATOM 0 HA PHE A 289 2.325 -27.353 10.992 1.00 72.21 H new ATOM 0 HB2 PHE A 289 4.931 -27.934 10.555 1.00 53.10 H new ATOM 0 HB3 PHE A 289 5.124 -26.205 10.763 1.00 53.10 H new ATOM 0 HD1 PHE A 289 3.566 -29.136 12.457 1.00 55.13 H new ATOM 0 HD2 PHE A 289 5.431 -25.370 12.899 1.00 22.15 H new ATOM 0 HE1 PHE A 289 3.580 -29.435 14.938 1.00 10.24 H new ATOM 0 HE2 PHE A 289 5.448 -25.670 15.381 1.00 14.03 H new ATOM 0 HZ PHE A 289 4.520 -27.698 16.371 1.00 43.20 H new ATOM 696 N SER A 290 2.033 -24.947 11.499 1.00 43.43 N ATOM 697 CA SER A 290 1.650 -23.555 11.666 1.00 42.04 C ATOM 698 C SER A 290 2.308 -22.978 12.921 1.00 34.21 C ATOM 699 O SER A 290 2.110 -23.491 14.021 1.00 33.33 O ATOM 700 CB SER A 290 0.130 -23.408 11.748 1.00 74.34 C ATOM 701 OG SER A 290 -0.522 -23.949 10.601 1.00 45.10 O ATOM 0 H SER A 290 1.688 -25.575 12.225 1.00 43.43 H new ATOM 0 HA SER A 290 1.995 -22.999 10.794 1.00 42.04 H new ATOM 0 HB2 SER A 290 -0.235 -23.911 12.643 1.00 74.34 H new ATOM 0 HB3 SER A 290 -0.127 -22.354 11.848 1.00 74.34 H new ATOM 0 HG SER A 290 -1.491 -23.837 10.692 1.00 45.10 H new ATOM 707 N ILE A 291 3.076 -21.919 12.714 1.00 24.23 N ATOM 708 CA ILE A 291 3.764 -21.267 13.816 1.00 61.13 C ATOM 709 C ILE A 291 3.005 -19.997 14.205 1.00 32.21 C ATOM 710 O ILE A 291 2.701 -19.165 13.352 1.00 41.12 O ATOM 711 CB ILE A 291 5.232 -21.021 13.461 1.00 71.53 C ATOM 712 CG1 ILE A 291 6.068 -22.284 13.682 1.00 41.41 C ATOM 713 CG2 ILE A 291 5.789 -19.823 14.231 1.00 41.53 C ATOM 714 CD1 ILE A 291 7.435 -22.161 13.006 1.00 61.13 C ATOM 0 H ILE A 291 3.237 -21.496 11.800 1.00 24.23 H new ATOM 0 HA ILE A 291 3.776 -21.914 14.693 1.00 61.13 H new ATOM 0 HB ILE A 291 5.291 -20.777 12.400 1.00 71.53 H new ATOM 0 HG12 ILE A 291 6.201 -22.455 14.750 1.00 41.41 H new ATOM 0 HG13 ILE A 291 5.538 -23.150 13.284 1.00 41.41 H new ATOM 0 HG21 ILE A 291 6.834 -19.670 13.960 1.00 41.53 H new ATOM 0 HG22 ILE A 291 5.215 -18.931 13.981 1.00 41.53 H new ATOM 0 HG23 ILE A 291 5.716 -20.013 15.302 1.00 41.53 H new ATOM 0 HD11 ILE A 291 8.009 -23.071 13.178 1.00 61.13 H new ATOM 0 HD12 ILE A 291 7.299 -22.015 11.934 1.00 61.13 H new ATOM 0 HD13 ILE A 291 7.972 -21.309 13.423 1.00 61.13 H new ATOM 726 N LYS A 292 2.720 -19.888 15.494 1.00 31.25 N ATOM 727 CA LYS A 292 2.002 -18.734 16.007 1.00 12.23 C ATOM 728 C LYS A 292 2.890 -17.493 15.891 1.00 73.32 C ATOM 729 O LYS A 292 3.765 -17.271 16.726 1.00 63.53 O ATOM 730 CB LYS A 292 1.503 -19.001 17.429 1.00 74.44 C ATOM 731 CG LYS A 292 0.063 -19.520 17.416 1.00 41.24 C ATOM 732 CD LYS A 292 -0.028 -20.867 16.697 1.00 61.41 C ATOM 733 CE LYS A 292 0.354 -22.015 17.633 1.00 25.25 C ATOM 734 NZ LYS A 292 -0.600 -22.103 18.761 1.00 23.54 N ATOM 0 H LYS A 292 2.973 -20.580 16.199 1.00 31.25 H new ATOM 0 HA LYS A 292 1.109 -18.546 15.410 1.00 12.23 H new ATOM 0 HB2 LYS A 292 2.152 -19.730 17.915 1.00 74.44 H new ATOM 0 HB3 LYS A 292 1.558 -18.084 18.016 1.00 74.44 H new ATOM 0 HG2 LYS A 292 -0.299 -19.625 18.439 1.00 41.24 H new ATOM 0 HG3 LYS A 292 -0.584 -18.795 16.922 1.00 41.24 H new ATOM 0 HD2 LYS A 292 -1.042 -21.017 16.326 1.00 61.41 H new ATOM 0 HD3 LYS A 292 0.632 -20.865 15.829 1.00 61.41 H new ATOM 0 HE2 LYS A 292 0.361 -22.955 17.081 1.00 25.25 H new ATOM 0 HE3 LYS A 292 1.364 -21.861 18.014 1.00 25.25 H new ATOM 0 HZ1 LYS A 292 -0.972 -23.072 18.826 1.00 23.54 H new ATOM 0 HZ2 LYS A 292 -0.113 -21.859 19.647 1.00 23.54 H new ATOM 0 HZ3 LYS A 292 -1.386 -21.440 18.603 1.00 23.54 H new ATOM 747 N MET A 293 2.633 -16.717 14.848 1.00 21.02 N ATOM 748 CA MET A 293 3.398 -15.505 14.612 1.00 42.45 C ATOM 749 C MET A 293 3.338 -14.573 15.824 1.00 40.13 C ATOM 750 O MET A 293 2.368 -14.595 16.580 1.00 5.34 O ATOM 751 CB MET A 293 2.842 -14.781 13.383 1.00 31.35 C ATOM 752 CG MET A 293 3.364 -15.414 12.092 1.00 51.44 C ATOM 753 SD MET A 293 2.543 -14.689 10.682 1.00 0.31 S ATOM 754 CE MET A 293 3.433 -13.146 10.564 1.00 23.04 C ATOM 0 H MET A 293 1.906 -16.904 14.157 1.00 21.02 H new ATOM 0 HA MET A 293 4.438 -15.782 14.442 1.00 42.45 H new ATOM 0 HB2 MET A 293 1.753 -14.818 13.396 1.00 31.35 H new ATOM 0 HB3 MET A 293 3.125 -13.729 13.417 1.00 31.35 H new ATOM 0 HG2 MET A 293 4.441 -15.264 12.013 1.00 51.44 H new ATOM 0 HG3 MET A 293 3.192 -16.490 12.110 1.00 51.44 H new ATOM 0 HE1 MET A 293 3.524 -12.858 9.517 1.00 23.04 H new ATOM 0 HE2 MET A 293 2.892 -12.371 11.108 1.00 23.04 H new ATOM 0 HE3 MET A 293 4.427 -13.265 10.995 1.00 23.04 H new ATOM 764 N GLY A 294 4.387 -13.777 15.970 1.00 13.45 N ATOM 765 CA GLY A 294 4.465 -12.839 17.078 1.00 64.02 C ATOM 766 C GLY A 294 3.084 -12.275 17.418 1.00 63.10 C ATOM 767 O GLY A 294 2.289 -11.990 16.524 1.00 11.12 O ATOM 0 H GLY A 294 5.189 -13.762 15.340 1.00 13.45 H new ATOM 0 HA2 GLY A 294 4.883 -13.338 17.952 1.00 64.02 H new ATOM 0 HA3 GLY A 294 5.142 -12.024 16.822 1.00 64.02 H new ATOM 771 N PRO A 295 2.835 -12.127 18.747 1.00 62.42 N ATOM 772 CA PRO A 295 1.564 -11.603 19.216 1.00 1.31 C ATOM 773 C PRO A 295 1.480 -10.091 18.997 1.00 5.30 C ATOM 774 O PRO A 295 0.388 -9.530 18.924 1.00 2.14 O ATOM 775 CB PRO A 295 1.494 -11.995 20.683 1.00 70.22 C ATOM 776 CG PRO A 295 2.921 -12.315 21.098 1.00 41.44 C ATOM 777 CD PRO A 295 3.753 -12.455 19.834 1.00 45.34 C ATOM 0 HA PRO A 295 0.714 -12.009 18.668 1.00 1.31 H new ATOM 0 HB2 PRO A 295 1.085 -11.184 21.285 1.00 70.22 H new ATOM 0 HB3 PRO A 295 0.843 -12.857 20.826 1.00 70.22 H new ATOM 0 HG2 PRO A 295 3.321 -11.524 21.732 1.00 41.44 H new ATOM 0 HG3 PRO A 295 2.952 -13.236 21.680 1.00 41.44 H new ATOM 0 HD2 PRO A 295 4.609 -11.780 19.847 1.00 45.34 H new ATOM 0 HD3 PRO A 295 4.146 -13.466 19.729 1.00 45.34 H new ATOM 785 N HIS A 296 2.649 -9.474 18.898 1.00 52.13 N ATOM 786 CA HIS A 296 2.722 -8.038 18.688 1.00 14.12 C ATOM 787 C HIS A 296 2.393 -7.715 17.229 1.00 5.11 C ATOM 788 O HIS A 296 2.254 -8.618 16.406 1.00 44.13 O ATOM 789 CB HIS A 296 4.083 -7.494 19.124 1.00 3.42 C ATOM 790 CG HIS A 296 4.079 -6.019 19.451 1.00 23.33 C ATOM 791 ND1 HIS A 296 4.746 -5.080 18.685 1.00 43.41 N ATOM 792 CD2 HIS A 296 3.482 -5.334 20.468 1.00 4.41 C ATOM 793 CE1 HIS A 296 4.553 -3.886 19.226 1.00 45.32 C ATOM 794 NE2 HIS A 296 3.770 -4.045 20.331 1.00 24.21 N ATOM 0 H HIS A 296 3.553 -9.943 18.959 1.00 52.13 H new ATOM 0 HA HIS A 296 1.980 -7.538 19.310 1.00 14.12 H new ATOM 0 HB2 HIS A 296 4.421 -8.049 19.999 1.00 3.42 H new ATOM 0 HB3 HIS A 296 4.807 -7.678 18.331 1.00 3.42 H new ATOM 0 HD2 HIS A 296 2.878 -5.766 21.252 1.00 4.41 H new ATOM 0 HE1 HIS A 296 4.947 -2.951 18.857 1.00 45.32 H new ATOM 0 HE2 HIS A 296 3.457 -3.297 20.950 1.00 24.21 H new ATOM 802 N GLU A 297 2.279 -6.424 16.954 1.00 43.03 N ATOM 803 CA GLU A 297 1.970 -5.970 15.608 1.00 21.33 C ATOM 804 C GLU A 297 3.205 -5.336 14.965 1.00 11.43 C ATOM 805 O GLU A 297 3.786 -4.403 15.517 1.00 3.32 O ATOM 806 CB GLU A 297 0.793 -4.993 15.616 1.00 33.32 C ATOM 807 CG GLU A 297 1.006 -3.886 16.651 1.00 73.34 C ATOM 808 CD GLU A 297 0.353 -4.251 17.986 1.00 42.43 C ATOM 809 OE1 GLU A 297 -0.372 -5.253 18.068 1.00 13.21 O ATOM 810 OE2 GLU A 297 0.624 -3.451 18.961 1.00 54.30 O ATOM 0 H GLU A 297 2.395 -5.678 17.640 1.00 43.03 H new ATOM 0 HA GLU A 297 1.678 -6.834 15.012 1.00 21.33 H new ATOM 0 HB2 GLU A 297 0.675 -4.552 14.626 1.00 33.32 H new ATOM 0 HB3 GLU A 297 -0.129 -5.531 15.838 1.00 33.32 H new ATOM 0 HG2 GLU A 297 2.073 -3.720 16.797 1.00 73.34 H new ATOM 0 HG3 GLU A 297 0.586 -2.951 16.280 1.00 73.34 H new ATOM 818 N ILE A 298 3.569 -5.867 13.807 1.00 12.15 N ATOM 819 CA ILE A 298 4.724 -5.364 13.083 1.00 30.14 C ATOM 820 C ILE A 298 4.661 -3.836 13.029 1.00 71.40 C ATOM 821 O ILE A 298 5.487 -3.155 13.634 1.00 22.43 O ATOM 822 CB ILE A 298 4.823 -6.025 11.707 1.00 11.11 C ATOM 823 CG1 ILE A 298 4.933 -7.546 11.836 1.00 54.44 C ATOM 824 CG2 ILE A 298 5.978 -5.433 10.897 1.00 61.44 C ATOM 825 CD1 ILE A 298 4.282 -8.245 10.641 1.00 73.23 C ATOM 0 H ILE A 298 3.084 -6.641 13.352 1.00 12.15 H new ATOM 0 HA ILE A 298 5.645 -5.627 13.604 1.00 30.14 H new ATOM 0 HB ILE A 298 3.904 -5.814 11.159 1.00 11.11 H new ATOM 0 HG12 ILE A 298 5.982 -7.834 11.903 1.00 54.44 H new ATOM 0 HG13 ILE A 298 4.453 -7.872 12.759 1.00 54.44 H new ATOM 0 HG21 ILE A 298 6.027 -5.920 9.923 1.00 61.44 H new ATOM 0 HG22 ILE A 298 5.816 -4.364 10.760 1.00 61.44 H new ATOM 0 HG23 ILE A 298 6.915 -5.593 11.430 1.00 61.44 H new ATOM 0 HD11 ILE A 298 4.374 -9.325 10.757 1.00 73.23 H new ATOM 0 HD12 ILE A 298 3.227 -7.974 10.591 1.00 73.23 H new ATOM 0 HD13 ILE A 298 4.780 -7.935 9.722 1.00 73.23 H new ATOM 837 N GLY A 299 3.672 -3.342 12.298 1.00 24.50 N ATOM 838 CA GLY A 299 3.491 -1.908 12.157 1.00 54.23 C ATOM 839 C GLY A 299 4.155 -1.394 10.878 1.00 65.21 C ATOM 840 O GLY A 299 5.040 -2.049 10.328 1.00 55.04 O ATOM 0 H GLY A 299 2.988 -3.910 11.797 1.00 24.50 H new ATOM 0 HA2 GLY A 299 2.427 -1.672 12.138 1.00 54.23 H new ATOM 0 HA3 GLY A 299 3.915 -1.398 13.022 1.00 54.23 H new ATOM 844 N ILE A 300 3.705 -0.227 10.442 1.00 34.12 N ATOM 845 CA ILE A 300 4.245 0.382 9.239 1.00 73.14 C ATOM 846 C ILE A 300 5.768 0.244 9.242 1.00 5.23 C ATOM 847 O ILE A 300 6.448 0.852 10.067 1.00 3.54 O ATOM 848 CB ILE A 300 3.758 1.826 9.104 1.00 0.10 C ATOM 849 CG1 ILE A 300 2.325 1.874 8.571 1.00 54.30 C ATOM 850 CG2 ILE A 300 4.718 2.650 8.243 1.00 13.22 C ATOM 851 CD1 ILE A 300 1.640 3.187 8.957 1.00 50.02 C ATOM 0 H ILE A 300 2.972 0.313 10.901 1.00 34.12 H new ATOM 0 HA ILE A 300 3.880 -0.137 8.353 1.00 73.14 H new ATOM 0 HB ILE A 300 3.747 2.277 10.096 1.00 0.10 H new ATOM 0 HG12 ILE A 300 2.333 1.769 7.486 1.00 54.30 H new ATOM 0 HG13 ILE A 300 1.757 1.033 8.968 1.00 54.30 H new ATOM 0 HG21 ILE A 300 4.349 3.672 8.163 1.00 13.22 H new ATOM 0 HG22 ILE A 300 5.706 2.656 8.704 1.00 13.22 H new ATOM 0 HG23 ILE A 300 4.784 2.209 7.248 1.00 13.22 H new ATOM 0 HD11 ILE A 300 0.623 3.195 8.566 1.00 50.02 H new ATOM 0 HD12 ILE A 300 1.612 3.277 10.043 1.00 50.02 H new ATOM 0 HD13 ILE A 300 2.197 4.025 8.538 1.00 50.02 H new ATOM 863 N LYS A 301 6.260 -0.559 8.310 1.00 4.04 N ATOM 864 CA LYS A 301 7.691 -0.784 8.196 1.00 63.22 C ATOM 865 C LYS A 301 8.202 -1.450 9.475 1.00 5.21 C ATOM 866 O LYS A 301 8.842 -0.803 10.303 1.00 13.41 O ATOM 867 CB LYS A 301 8.413 0.520 7.850 1.00 20.15 C ATOM 868 CG LYS A 301 8.923 0.499 6.408 1.00 21.11 C ATOM 869 CD LYS A 301 7.766 0.341 5.420 1.00 50.34 C ATOM 870 CE LYS A 301 7.377 1.690 4.811 1.00 1.11 C ATOM 871 NZ LYS A 301 8.283 2.035 3.693 1.00 62.43 N ATOM 0 H LYS A 301 5.693 -1.062 7.627 1.00 4.04 H new ATOM 0 HA LYS A 301 7.905 -1.467 7.374 1.00 63.22 H new ATOM 0 HB2 LYS A 301 7.735 1.362 7.987 1.00 20.15 H new ATOM 0 HB3 LYS A 301 9.249 0.669 8.533 1.00 20.15 H new ATOM 0 HG2 LYS A 301 9.464 1.422 6.196 1.00 21.11 H new ATOM 0 HG3 LYS A 301 9.630 -0.321 6.280 1.00 21.11 H new ATOM 0 HD2 LYS A 301 8.052 -0.351 4.628 1.00 50.34 H new ATOM 0 HD3 LYS A 301 6.906 -0.094 5.928 1.00 50.34 H new ATOM 0 HE2 LYS A 301 6.348 1.651 4.454 1.00 1.11 H new ATOM 0 HE3 LYS A 301 7.420 2.466 5.575 1.00 1.11 H new ATOM 0 HZ1 LYS A 301 8.005 2.953 3.291 1.00 62.43 H new ATOM 0 HZ2 LYS A 301 9.261 2.092 4.043 1.00 62.43 H new ATOM 0 HZ3 LYS A 301 8.221 1.302 2.957 1.00 62.43 H new ATOM 884 N GLY A 302 7.902 -2.734 9.597 1.00 73.43 N ATOM 885 CA GLY A 302 8.323 -3.495 10.761 1.00 13.31 C ATOM 886 C GLY A 302 8.896 -4.853 10.351 1.00 4.42 C ATOM 887 O GLY A 302 8.846 -5.224 9.180 1.00 53.14 O ATOM 0 H GLY A 302 7.372 -3.268 8.908 1.00 73.43 H new ATOM 0 HA2 GLY A 302 9.074 -2.932 11.316 1.00 13.31 H new ATOM 0 HA3 GLY A 302 7.475 -3.641 11.430 1.00 13.31 H new ATOM 891 N GLN A 303 9.429 -5.557 11.339 1.00 1.31 N ATOM 892 CA GLN A 303 10.012 -6.865 11.096 1.00 72.41 C ATOM 893 C GLN A 303 9.144 -7.958 11.724 1.00 2.24 C ATOM 894 O GLN A 303 8.150 -7.662 12.385 1.00 32.13 O ATOM 895 CB GLN A 303 11.446 -6.933 11.623 1.00 23.43 C ATOM 896 CG GLN A 303 11.470 -7.344 13.097 1.00 12.42 C ATOM 897 CD GLN A 303 12.672 -6.730 13.818 1.00 53.30 C ATOM 898 OE1 GLN A 303 12.673 -5.571 14.201 1.00 23.31 O ATOM 899 NE2 GLN A 303 13.691 -7.568 13.981 1.00 62.23 N ATOM 0 H GLN A 303 9.469 -5.246 12.310 1.00 1.31 H new ATOM 0 HA GLN A 303 10.048 -7.031 10.019 1.00 72.41 H new ATOM 0 HB2 GLN A 303 12.020 -7.647 11.033 1.00 23.43 H new ATOM 0 HB3 GLN A 303 11.927 -5.962 11.505 1.00 23.43 H new ATOM 0 HG2 GLN A 303 10.548 -7.024 13.582 1.00 12.42 H new ATOM 0 HG3 GLN A 303 11.511 -8.430 13.175 1.00 12.42 H new ATOM 0 HE21 GLN A 303 13.624 -8.526 13.636 1.00 62.23 H new ATOM 0 HE22 GLN A 303 14.540 -7.253 14.451 1.00 62.23 H new ATOM 908 N LYS A 304 9.552 -9.197 11.496 1.00 22.41 N ATOM 909 CA LYS A 304 8.824 -10.335 12.032 1.00 65.43 C ATOM 910 C LYS A 304 9.748 -11.555 12.066 1.00 34.04 C ATOM 911 O LYS A 304 10.706 -11.635 11.300 1.00 40.34 O ATOM 912 CB LYS A 304 7.533 -10.564 11.244 1.00 33.13 C ATOM 913 CG LYS A 304 6.686 -11.664 11.888 1.00 52.02 C ATOM 914 CD LYS A 304 6.043 -11.172 13.186 1.00 21.13 C ATOM 915 CE LYS A 304 4.763 -11.951 13.494 1.00 70.51 C ATOM 916 NZ LYS A 304 4.162 -11.481 14.762 1.00 20.20 N ATOM 0 H LYS A 304 10.377 -9.438 10.947 1.00 22.41 H new ATOM 0 HA LYS A 304 8.514 -10.140 13.059 1.00 65.43 H new ATOM 0 HB2 LYS A 304 6.960 -9.638 11.200 1.00 33.13 H new ATOM 0 HB3 LYS A 304 7.773 -10.839 10.217 1.00 33.13 H new ATOM 0 HG2 LYS A 304 5.910 -11.985 11.193 1.00 52.02 H new ATOM 0 HG3 LYS A 304 7.309 -12.534 12.094 1.00 52.02 H new ATOM 0 HD2 LYS A 304 6.748 -11.283 14.010 1.00 21.13 H new ATOM 0 HD3 LYS A 304 5.815 -10.109 13.103 1.00 21.13 H new ATOM 0 HE2 LYS A 304 4.050 -11.827 12.679 1.00 70.51 H new ATOM 0 HE3 LYS A 304 4.986 -13.016 13.563 1.00 70.51 H new ATOM 0 HZ1 LYS A 304 3.385 -12.116 15.034 1.00 20.20 H new ATOM 0 HZ2 LYS A 304 4.885 -11.478 15.509 1.00 20.20 H new ATOM 0 HZ3 LYS A 304 3.792 -10.517 14.635 1.00 20.20 H new ATOM 929 N GLU A 305 9.426 -12.475 12.964 1.00 24.01 N ATOM 930 CA GLU A 305 10.215 -13.687 13.109 1.00 51.11 C ATOM 931 C GLU A 305 9.305 -14.917 13.099 1.00 13.34 C ATOM 932 O GLU A 305 8.223 -14.897 13.685 1.00 23.51 O ATOM 933 CB GLU A 305 11.062 -13.641 14.382 1.00 35.25 C ATOM 934 CG GLU A 305 12.401 -12.947 14.126 1.00 14.01 C ATOM 935 CD GLU A 305 12.935 -12.297 15.404 1.00 31.32 C ATOM 936 OE1 GLU A 305 13.967 -12.733 15.936 1.00 11.42 O ATOM 937 OE2 GLU A 305 12.238 -11.305 15.844 1.00 41.44 O ATOM 0 H GLU A 305 8.630 -12.406 13.598 1.00 24.01 H new ATOM 0 HA GLU A 305 10.897 -13.757 12.261 1.00 51.11 H new ATOM 0 HB2 GLU A 305 10.519 -13.113 15.165 1.00 35.25 H new ATOM 0 HB3 GLU A 305 11.237 -14.654 14.743 1.00 35.25 H new ATOM 0 HG2 GLU A 305 13.125 -13.672 13.753 1.00 14.01 H new ATOM 0 HG3 GLU A 305 12.280 -12.189 13.352 1.00 14.01 H new ATOM 945 N LEU A 306 9.776 -15.957 12.428 1.00 61.01 N ATOM 946 CA LEU A 306 9.018 -17.193 12.334 1.00 22.24 C ATOM 947 C LEU A 306 9.981 -18.381 12.379 1.00 62.31 C ATOM 948 O LEU A 306 9.788 -19.369 11.671 1.00 13.41 O ATOM 949 CB LEU A 306 8.118 -17.177 11.098 1.00 73.44 C ATOM 950 CG LEU A 306 6.752 -16.509 11.271 1.00 43.15 C ATOM 951 CD1 LEU A 306 5.982 -16.485 9.949 1.00 44.43 C ATOM 952 CD2 LEU A 306 5.951 -17.179 12.388 1.00 22.43 C ATOM 0 H LEU A 306 10.674 -15.969 11.944 1.00 61.01 H new ATOM 0 HA LEU A 306 8.346 -17.294 13.187 1.00 22.24 H new ATOM 0 HB2 LEU A 306 8.649 -16.669 10.293 1.00 73.44 H new ATOM 0 HB3 LEU A 306 7.959 -18.206 10.776 1.00 73.44 H new ATOM 0 HG LEU A 306 6.914 -15.473 11.568 1.00 43.15 H new ATOM 0 HD11 LEU A 306 5.015 -16.005 10.100 1.00 44.43 H new ATOM 0 HD12 LEU A 306 6.552 -15.927 9.206 1.00 44.43 H new ATOM 0 HD13 LEU A 306 5.830 -17.506 9.598 1.00 44.43 H new ATOM 0 HD21 LEU A 306 4.985 -16.685 12.490 1.00 22.43 H new ATOM 0 HD22 LEU A 306 5.797 -18.230 12.145 1.00 22.43 H new ATOM 0 HD23 LEU A 306 6.499 -17.100 13.327 1.00 22.43 H new ATOM 964 N TRP A 307 10.998 -18.247 13.218 1.00 50.14 N ATOM 965 CA TRP A 307 11.992 -19.297 13.364 1.00 75.04 C ATOM 966 C TRP A 307 11.253 -20.620 13.577 1.00 3.05 C ATOM 967 O TRP A 307 10.171 -20.644 14.161 1.00 12.42 O ATOM 968 CB TRP A 307 12.972 -18.971 14.491 1.00 4.34 C ATOM 969 CG TRP A 307 12.322 -18.872 15.873 1.00 70.22 C ATOM 970 CD1 TRP A 307 11.703 -19.839 16.564 1.00 23.12 C ATOM 971 CD2 TRP A 307 12.251 -17.697 16.708 1.00 72.32 C ATOM 972 NE1 TRP A 307 11.240 -19.375 17.779 1.00 63.32 N ATOM 973 CE2 TRP A 307 11.584 -18.031 17.869 1.00 70.42 C ATOM 974 CE3 TRP A 307 12.734 -16.395 16.489 1.00 21.14 C ATOM 975 CZ2 TRP A 307 11.339 -17.119 18.902 1.00 25.12 C ATOM 976 CZ3 TRP A 307 12.482 -15.495 17.532 1.00 74.14 C ATOM 977 CH2 TRP A 307 11.812 -15.816 18.707 1.00 53.25 C ATOM 0 H TRP A 307 11.155 -17.427 13.804 1.00 50.14 H new ATOM 0 HA TRP A 307 12.602 -19.380 12.464 1.00 75.04 H new ATOM 0 HB2 TRP A 307 13.746 -19.738 14.519 1.00 4.34 H new ATOM 0 HB3 TRP A 307 13.468 -18.027 14.266 1.00 4.34 H new ATOM 0 HD1 TRP A 307 11.582 -20.854 16.214 1.00 23.12 H new ATOM 0 HE1 TRP A 307 10.738 -19.918 18.481 1.00 63.32 H new ATOM 0 HE3 TRP A 307 13.258 -16.111 15.588 1.00 21.14 H new ATOM 0 HZ2 TRP A 307 10.813 -17.405 19.801 1.00 25.12 H new ATOM 0 HZ3 TRP A 307 12.833 -14.480 17.415 1.00 74.14 H new ATOM 0 HH2 TRP A 307 11.657 -15.063 19.466 1.00 53.25 H new ATOM 988 N PHE A 308 11.868 -21.689 13.093 1.00 2.02 N ATOM 989 CA PHE A 308 11.283 -23.012 13.224 1.00 30.50 C ATOM 990 C PHE A 308 12.369 -24.081 13.366 1.00 41.23 C ATOM 991 O PHE A 308 13.547 -23.806 13.144 1.00 64.31 O ATOM 992 CB PHE A 308 10.487 -23.278 11.945 1.00 50.13 C ATOM 993 CG PHE A 308 9.622 -24.539 12.000 1.00 11.24 C ATOM 994 CD1 PHE A 308 8.876 -24.803 13.106 1.00 34.13 C ATOM 995 CD2 PHE A 308 9.599 -25.395 10.944 1.00 24.22 C ATOM 996 CE1 PHE A 308 8.073 -25.973 13.158 1.00 71.20 C ATOM 997 CE2 PHE A 308 8.797 -26.565 10.996 1.00 73.41 C ATOM 998 CZ PHE A 308 8.050 -26.830 12.102 1.00 44.32 C ATOM 0 H PHE A 308 12.766 -21.666 12.609 1.00 2.02 H new ATOM 0 HA PHE A 308 10.652 -23.053 14.112 1.00 30.50 H new ATOM 0 HB2 PHE A 308 9.847 -22.419 11.743 1.00 50.13 H new ATOM 0 HB3 PHE A 308 11.181 -23.362 11.109 1.00 50.13 H new ATOM 0 HD1 PHE A 308 8.894 -24.123 13.945 1.00 34.13 H new ATOM 0 HD2 PHE A 308 10.191 -25.185 10.066 1.00 24.22 H new ATOM 0 HE1 PHE A 308 7.480 -26.182 14.036 1.00 71.20 H new ATOM 0 HE2 PHE A 308 8.780 -27.245 10.157 1.00 73.41 H new ATOM 0 HZ PHE A 308 7.439 -27.720 12.141 1.00 44.32 H new ATOM 1008 N PHE A 309 11.934 -25.277 13.734 1.00 13.43 N ATOM 1009 CA PHE A 309 12.854 -26.387 13.908 1.00 21.41 C ATOM 1010 C PHE A 309 12.243 -27.692 13.393 1.00 13.11 C ATOM 1011 O PHE A 309 11.027 -27.792 13.234 1.00 1.34 O ATOM 1012 CB PHE A 309 13.117 -26.519 15.409 1.00 24.25 C ATOM 1013 CG PHE A 309 11.928 -26.123 16.287 1.00 43.31 C ATOM 1014 CD1 PHE A 309 11.516 -24.827 16.329 1.00 61.43 C ATOM 1015 CD2 PHE A 309 11.284 -27.066 17.025 1.00 14.20 C ATOM 1016 CE1 PHE A 309 10.412 -24.459 17.143 1.00 24.50 C ATOM 1017 CE2 PHE A 309 10.180 -26.698 17.839 1.00 0.23 C ATOM 1018 CZ PHE A 309 9.768 -25.403 17.881 1.00 13.51 C ATOM 0 H PHE A 309 10.956 -25.501 13.916 1.00 13.43 H new ATOM 0 HA PHE A 309 13.771 -26.201 13.349 1.00 21.41 H new ATOM 0 HB2 PHE A 309 13.391 -27.551 15.630 1.00 24.25 H new ATOM 0 HB3 PHE A 309 13.973 -25.898 15.673 1.00 24.25 H new ATOM 0 HD1 PHE A 309 12.028 -24.078 15.743 1.00 61.43 H new ATOM 0 HD2 PHE A 309 11.612 -28.094 16.992 1.00 14.20 H new ATOM 0 HE1 PHE A 309 10.084 -23.431 17.176 1.00 24.50 H new ATOM 0 HE2 PHE A 309 9.668 -27.447 18.425 1.00 0.23 H new ATOM 0 HZ PHE A 309 8.929 -25.124 18.501 1.00 13.51 H new ATOM 1028 N PRO A 310 13.137 -28.685 13.140 1.00 74.11 N ATOM 1029 CA PRO A 310 14.559 -28.484 13.355 1.00 45.01 C ATOM 1030 C PRO A 310 15.163 -27.612 12.252 1.00 70.22 C ATOM 1031 O PRO A 310 15.894 -26.664 12.535 1.00 71.31 O ATOM 1032 CB PRO A 310 15.152 -29.883 13.398 1.00 44.13 C ATOM 1033 CG PRO A 310 14.124 -30.792 12.745 1.00 53.21 C ATOM 1034 CD PRO A 310 12.818 -30.021 12.644 1.00 52.31 C ATOM 0 HA PRO A 310 14.773 -27.947 14.279 1.00 45.01 H new ATOM 0 HB2 PRO A 310 16.102 -29.921 12.865 1.00 44.13 H new ATOM 0 HB3 PRO A 310 15.350 -30.192 14.424 1.00 44.13 H new ATOM 0 HG2 PRO A 310 14.462 -31.102 11.756 1.00 53.21 H new ATOM 0 HG3 PRO A 310 13.987 -31.699 13.334 1.00 53.21 H new ATOM 0 HD2 PRO A 310 12.457 -29.986 11.616 1.00 52.31 H new ATOM 0 HD3 PRO A 310 12.035 -30.489 13.241 1.00 52.31 H new ATOM 1042 N SER A 311 14.835 -27.964 11.017 1.00 35.15 N ATOM 1043 CA SER A 311 15.335 -27.225 9.870 1.00 31.55 C ATOM 1044 C SER A 311 14.860 -27.887 8.575 1.00 43.42 C ATOM 1045 O SER A 311 14.948 -29.105 8.427 1.00 14.50 O ATOM 1046 CB SER A 311 16.862 -27.140 9.894 1.00 2.12 C ATOM 1047 OG SER A 311 17.461 -28.381 10.257 1.00 71.34 O ATOM 0 H SER A 311 14.229 -28.751 10.786 1.00 35.15 H new ATOM 0 HA SER A 311 14.941 -26.210 9.917 1.00 31.55 H new ATOM 0 HB2 SER A 311 17.224 -26.837 8.911 1.00 2.12 H new ATOM 0 HB3 SER A 311 17.171 -26.368 10.599 1.00 2.12 H new ATOM 0 HG SER A 311 18.436 -28.285 10.259 1.00 71.34 H new ATOM 1053 N LEU A 312 14.368 -27.054 7.669 1.00 23.12 N ATOM 1054 CA LEU A 312 13.880 -27.542 6.391 1.00 72.42 C ATOM 1055 C LEU A 312 14.821 -27.077 5.278 1.00 3.43 C ATOM 1056 O LEU A 312 15.562 -26.110 5.451 1.00 13.21 O ATOM 1057 CB LEU A 312 12.423 -27.125 6.179 1.00 43.21 C ATOM 1058 CG LEU A 312 11.402 -27.745 7.135 1.00 51.15 C ATOM 1059 CD1 LEU A 312 11.256 -26.902 8.403 1.00 21.42 C ATOM 1060 CD2 LEU A 312 10.059 -27.964 6.435 1.00 61.42 C ATOM 0 H LEU A 312 14.297 -26.044 7.795 1.00 23.12 H new ATOM 0 HA LEU A 312 13.881 -28.632 6.374 1.00 72.42 H new ATOM 0 HB2 LEU A 312 12.360 -26.040 6.265 1.00 43.21 H new ATOM 0 HB3 LEU A 312 12.138 -27.381 5.159 1.00 43.21 H new ATOM 0 HG LEU A 312 11.770 -28.724 7.440 1.00 51.15 H new ATOM 0 HD11 LEU A 312 10.524 -27.365 9.065 1.00 21.42 H new ATOM 0 HD12 LEU A 312 12.218 -26.840 8.912 1.00 21.42 H new ATOM 0 HD13 LEU A 312 10.921 -25.899 8.137 1.00 21.42 H new ATOM 0 HD21 LEU A 312 9.351 -28.406 7.136 1.00 61.42 H new ATOM 0 HD22 LEU A 312 9.672 -27.008 6.083 1.00 61.42 H new ATOM 0 HD23 LEU A 312 10.196 -28.635 5.587 1.00 61.42 H new ATOM 1072 N PRO A 313 14.760 -27.805 4.131 1.00 25.04 N ATOM 1073 CA PRO A 313 15.599 -27.476 2.991 1.00 75.51 C ATOM 1074 C PRO A 313 15.079 -26.232 2.269 1.00 55.22 C ATOM 1075 O PRO A 313 13.872 -25.999 2.217 1.00 51.33 O ATOM 1076 CB PRO A 313 15.580 -28.721 2.118 1.00 44.30 C ATOM 1077 CG PRO A 313 14.370 -29.525 2.564 1.00 51.25 C ATOM 1078 CD PRO A 313 13.896 -28.956 3.891 1.00 34.50 C ATOM 0 HA PRO A 313 16.619 -27.222 3.278 1.00 75.51 H new ATOM 0 HB2 PRO A 313 15.506 -28.457 1.063 1.00 44.30 H new ATOM 0 HB3 PRO A 313 16.498 -29.297 2.239 1.00 44.30 H new ATOM 0 HG2 PRO A 313 13.577 -29.467 1.819 1.00 51.25 H new ATOM 0 HG3 PRO A 313 14.630 -30.578 2.671 1.00 51.25 H new ATOM 0 HD2 PRO A 313 12.848 -28.661 3.843 1.00 34.50 H new ATOM 0 HD3 PRO A 313 13.984 -29.691 4.691 1.00 34.50 H new ATOM 1086 N THR A 314 16.015 -25.465 1.730 1.00 71.14 N ATOM 1087 CA THR A 314 15.666 -24.250 1.013 1.00 63.33 C ATOM 1088 C THR A 314 16.253 -24.278 -0.400 1.00 53.01 C ATOM 1089 O THR A 314 17.167 -25.051 -0.682 1.00 34.42 O ATOM 1090 CB THR A 314 16.142 -23.057 1.845 1.00 73.54 C ATOM 1091 OG1 THR A 314 17.267 -23.560 2.561 1.00 53.25 O ATOM 1092 CG2 THR A 314 15.145 -22.673 2.940 1.00 53.23 C ATOM 0 H THR A 314 17.015 -25.661 1.775 1.00 71.14 H new ATOM 0 HA THR A 314 14.587 -24.164 0.882 1.00 63.33 H new ATOM 0 HB THR A 314 16.310 -22.202 1.191 1.00 73.54 H new ATOM 0 HG1 THR A 314 16.958 -24.079 3.333 1.00 53.25 H new ATOM 0 HG21 THR A 314 15.531 -21.822 3.501 1.00 53.23 H new ATOM 0 HG22 THR A 314 14.191 -22.406 2.486 1.00 53.23 H new ATOM 0 HG23 THR A 314 15.002 -23.517 3.615 1.00 53.23 H new ATOM 1100 N PRO A 315 15.688 -23.402 -1.274 1.00 3.21 N ATOM 1101 CA PRO A 315 14.610 -22.521 -0.859 1.00 1.22 C ATOM 1102 C PRO A 315 13.294 -23.290 -0.726 1.00 10.31 C ATOM 1103 O PRO A 315 13.254 -24.500 -0.940 1.00 73.23 O ATOM 1104 CB PRO A 315 14.559 -21.434 -1.921 1.00 32.53 C ATOM 1105 CG PRO A 315 15.292 -21.997 -3.128 1.00 0.43 C ATOM 1106 CD PRO A 315 16.060 -23.227 -2.675 1.00 22.41 C ATOM 0 HA PRO A 315 14.777 -22.088 0.127 1.00 1.22 H new ATOM 0 HB2 PRO A 315 13.529 -21.181 -2.172 1.00 32.53 H new ATOM 0 HB3 PRO A 315 15.034 -20.519 -1.567 1.00 32.53 H new ATOM 0 HG2 PRO A 315 14.586 -22.257 -3.916 1.00 0.43 H new ATOM 0 HG3 PRO A 315 15.973 -21.253 -3.542 1.00 0.43 H new ATOM 0 HD2 PRO A 315 15.792 -24.102 -3.268 1.00 22.41 H new ATOM 0 HD3 PRO A 315 17.135 -23.085 -2.784 1.00 22.41 H new ATOM 1114 N LEU A 316 12.249 -22.555 -0.373 1.00 45.10 N ATOM 1115 CA LEU A 316 10.935 -23.153 -0.209 1.00 42.52 C ATOM 1116 C LEU A 316 10.137 -22.982 -1.503 1.00 41.33 C ATOM 1117 O LEU A 316 9.121 -22.288 -1.523 1.00 64.15 O ATOM 1118 CB LEU A 316 10.236 -22.579 1.025 1.00 51.01 C ATOM 1119 CG LEU A 316 10.898 -22.879 2.371 1.00 21.02 C ATOM 1120 CD1 LEU A 316 11.012 -21.612 3.221 1.00 52.23 C ATOM 1121 CD2 LEU A 316 10.160 -23.999 3.108 1.00 50.42 C ATOM 0 H LEU A 316 12.286 -21.551 -0.196 1.00 45.10 H new ATOM 0 HA LEU A 316 11.023 -24.224 -0.028 1.00 42.52 H new ATOM 0 HB2 LEU A 316 10.168 -21.497 0.909 1.00 51.01 H new ATOM 0 HB3 LEU A 316 9.216 -22.962 1.051 1.00 51.01 H new ATOM 0 HG LEU A 316 11.912 -23.232 2.181 1.00 21.02 H new ATOM 0 HD11 LEU A 316 11.486 -21.854 4.172 1.00 52.23 H new ATOM 0 HD12 LEU A 316 11.614 -20.873 2.693 1.00 52.23 H new ATOM 0 HD13 LEU A 316 10.017 -21.206 3.404 1.00 52.23 H new ATOM 0 HD21 LEU A 316 10.651 -24.192 4.062 1.00 50.42 H new ATOM 0 HD22 LEU A 316 9.127 -23.699 3.286 1.00 50.42 H new ATOM 0 HD23 LEU A 316 10.175 -24.905 2.502 1.00 50.42 H new ATOM 1133 N SER A 317 10.627 -23.626 -2.552 1.00 52.14 N ATOM 1134 CA SER A 317 9.972 -23.554 -3.847 1.00 50.15 C ATOM 1135 C SER A 317 8.798 -24.534 -3.895 1.00 53.43 C ATOM 1136 O SER A 317 8.975 -25.732 -3.682 1.00 3.13 O ATOM 1137 CB SER A 317 10.957 -23.850 -4.980 1.00 20.41 C ATOM 1138 OG SER A 317 10.359 -23.690 -6.263 1.00 51.14 O ATOM 0 H SER A 317 11.470 -24.200 -2.532 1.00 52.14 H new ATOM 0 HA SER A 317 9.596 -22.540 -3.984 1.00 50.15 H new ATOM 0 HB2 SER A 317 11.817 -23.186 -4.896 1.00 20.41 H new ATOM 0 HB3 SER A 317 11.330 -24.869 -4.879 1.00 20.41 H new ATOM 0 HG SER A 317 11.058 -23.539 -6.933 1.00 51.14 H new ATOM 1144 N ASN A 318 7.624 -23.987 -4.177 1.00 30.41 N ATOM 1145 CA ASN A 318 6.421 -24.798 -4.256 1.00 32.25 C ATOM 1146 C ASN A 318 5.875 -25.032 -2.845 1.00 43.32 C ATOM 1147 O ASN A 318 5.107 -25.966 -2.620 1.00 4.34 O ATOM 1148 CB ASN A 318 6.716 -26.163 -4.880 1.00 63.20 C ATOM 1149 CG ASN A 318 5.457 -26.764 -5.507 1.00 55.54 C ATOM 1150 OD1 ASN A 318 4.621 -26.073 -6.067 1.00 13.22 O ATOM 1151 ND2 ASN A 318 5.367 -28.085 -5.384 1.00 5.33 N ATOM 0 H ASN A 318 7.481 -22.993 -4.353 1.00 30.41 H new ATOM 0 HA ASN A 318 5.697 -24.267 -4.875 1.00 32.25 H new ATOM 0 HB2 ASN A 318 7.491 -26.060 -5.640 1.00 63.20 H new ATOM 0 HB3 ASN A 318 7.105 -26.839 -4.118 1.00 63.20 H new ATOM 0 HD21 ASN A 318 4.563 -28.580 -5.770 1.00 5.33 H new ATOM 0 HD22 ASN A 318 6.102 -28.604 -4.903 1.00 5.33 H new ATOM 1158 N TYR A 319 6.294 -24.167 -1.933 1.00 14.21 N ATOM 1159 CA TYR A 319 5.857 -24.267 -0.551 1.00 35.13 C ATOM 1160 C TYR A 319 4.766 -23.239 -0.245 1.00 12.35 C ATOM 1161 O TYR A 319 5.019 -22.035 -0.265 1.00 71.24 O ATOM 1162 CB TYR A 319 7.087 -23.958 0.304 1.00 1.51 C ATOM 1163 CG TYR A 319 8.023 -25.151 0.502 1.00 23.22 C ATOM 1164 CD1 TYR A 319 8.803 -25.598 -0.545 1.00 72.22 C ATOM 1165 CD2 TYR A 319 8.089 -25.781 1.729 1.00 74.03 C ATOM 1166 CE1 TYR A 319 9.684 -26.722 -0.359 1.00 10.33 C ATOM 1167 CE2 TYR A 319 8.970 -26.904 1.915 1.00 32.52 C ATOM 1168 CZ TYR A 319 9.724 -27.319 0.862 1.00 30.42 C ATOM 1169 OH TYR A 319 10.556 -28.381 1.038 1.00 2.54 O ATOM 0 H TYR A 319 6.931 -23.394 -2.124 1.00 14.21 H new ATOM 0 HA TYR A 319 5.446 -25.256 -0.349 1.00 35.13 H new ATOM 0 HB2 TYR A 319 7.645 -23.145 -0.161 1.00 1.51 H new ATOM 0 HB3 TYR A 319 6.758 -23.602 1.280 1.00 1.51 H new ATOM 0 HD1 TYR A 319 8.753 -25.105 -1.504 1.00 72.22 H new ATOM 0 HD2 TYR A 319 7.480 -25.431 2.549 1.00 74.03 H new ATOM 0 HE1 TYR A 319 10.299 -27.082 -1.171 1.00 10.33 H new ATOM 0 HE2 TYR A 319 9.031 -27.406 2.869 1.00 32.52 H new ATOM 0 HH TYR A 319 10.481 -28.706 1.960 1.00 2.54 H new ATOM 1179 N THR A 320 3.576 -23.751 0.033 1.00 54.54 N ATOM 1180 CA THR A 320 2.445 -22.892 0.343 1.00 43.43 C ATOM 1181 C THR A 320 2.900 -21.692 1.176 1.00 41.20 C ATOM 1182 O THR A 320 2.597 -20.548 0.841 1.00 40.14 O ATOM 1183 CB THR A 320 1.380 -23.744 1.035 1.00 1.34 C ATOM 1184 OG1 THR A 320 0.548 -24.193 -0.030 1.00 61.45 O ATOM 1185 CG2 THR A 320 0.444 -22.911 1.913 1.00 15.11 C ATOM 0 H THR A 320 3.370 -24.750 0.050 1.00 54.54 H new ATOM 0 HA THR A 320 2.007 -22.472 -0.562 1.00 43.43 H new ATOM 0 HB THR A 320 1.865 -24.507 1.643 1.00 1.34 H new ATOM 0 HG1 THR A 320 -0.170 -24.755 0.330 1.00 61.45 H new ATOM 0 HG21 THR A 320 -0.293 -23.564 2.381 1.00 15.11 H new ATOM 0 HG22 THR A 320 1.024 -22.406 2.686 1.00 15.11 H new ATOM 0 HG23 THR A 320 -0.067 -22.169 1.299 1.00 15.11 H new ATOM 1193 N MET A 321 3.620 -21.994 2.246 1.00 23.22 N ATOM 1194 CA MET A 321 4.120 -20.955 3.130 1.00 0.21 C ATOM 1195 C MET A 321 3.171 -19.755 3.157 1.00 43.34 C ATOM 1196 O MET A 321 3.593 -18.621 2.933 1.00 15.23 O ATOM 1197 CB MET A 321 5.503 -20.502 2.656 1.00 34.40 C ATOM 1198 CG MET A 321 6.298 -19.878 3.804 1.00 44.52 C ATOM 1199 SD MET A 321 7.409 -18.633 3.170 1.00 42.54 S ATOM 1200 CE MET A 321 8.794 -19.659 2.708 1.00 64.31 C ATOM 0 H MET A 321 3.869 -22.944 2.521 1.00 23.22 H new ATOM 0 HA MET A 321 4.188 -21.364 4.138 1.00 0.21 H new ATOM 0 HB2 MET A 321 6.050 -21.354 2.251 1.00 34.40 H new ATOM 0 HB3 MET A 321 5.396 -19.779 1.848 1.00 34.40 H new ATOM 0 HG2 MET A 321 5.617 -19.434 4.530 1.00 44.52 H new ATOM 0 HG3 MET A 321 6.863 -20.649 4.327 1.00 44.52 H new ATOM 0 HE1 MET A 321 9.665 -19.384 3.303 1.00 64.31 H new ATOM 0 HE2 MET A 321 8.548 -20.705 2.888 1.00 64.31 H new ATOM 0 HE3 MET A 321 9.017 -19.515 1.651 1.00 64.31 H new ATOM 1210 N LYS A 322 1.908 -20.045 3.432 1.00 62.44 N ATOM 1211 CA LYS A 322 0.896 -19.004 3.490 1.00 23.22 C ATOM 1212 C LYS A 322 0.962 -18.311 4.853 1.00 61.33 C ATOM 1213 O LYS A 322 1.894 -18.536 5.623 1.00 20.32 O ATOM 1214 CB LYS A 322 -0.483 -19.578 3.158 1.00 44.01 C ATOM 1215 CG LYS A 322 -0.748 -19.531 1.652 1.00 43.33 C ATOM 1216 CD LYS A 322 -1.736 -20.621 1.235 1.00 72.55 C ATOM 1217 CE LYS A 322 -1.657 -20.887 -0.270 1.00 42.22 C ATOM 1218 NZ LYS A 322 -2.388 -22.126 -0.617 1.00 51.12 N ATOM 0 H LYS A 322 1.562 -20.987 3.617 1.00 62.44 H new ATOM 0 HA LYS A 322 1.089 -18.242 2.734 1.00 23.22 H new ATOM 0 HB2 LYS A 322 -0.547 -20.608 3.510 1.00 44.01 H new ATOM 0 HB3 LYS A 322 -1.252 -19.013 3.684 1.00 44.01 H new ATOM 0 HG2 LYS A 322 -1.144 -18.553 1.379 1.00 43.33 H new ATOM 0 HG3 LYS A 322 0.189 -19.658 1.110 1.00 43.33 H new ATOM 0 HD2 LYS A 322 -1.522 -21.539 1.782 1.00 72.55 H new ATOM 0 HD3 LYS A 322 -2.749 -20.320 1.502 1.00 72.55 H new ATOM 0 HE2 LYS A 322 -2.079 -20.044 -0.817 1.00 42.22 H new ATOM 0 HE3 LYS A 322 -0.614 -20.975 -0.575 1.00 42.22 H new ATOM 0 HZ1 LYS A 322 -2.324 -22.291 -1.642 1.00 51.12 H new ATOM 0 HZ2 LYS A 322 -1.968 -22.931 -0.110 1.00 51.12 H new ATOM 0 HZ3 LYS A 322 -3.387 -22.028 -0.344 1.00 51.12 H new ATOM 1231 N VAL A 323 -0.039 -17.482 5.108 1.00 34.41 N ATOM 1232 CA VAL A 323 -0.107 -16.755 6.364 1.00 31.13 C ATOM 1233 C VAL A 323 -1.571 -16.472 6.707 1.00 73.53 C ATOM 1234 O VAL A 323 -2.324 -15.978 5.869 1.00 11.31 O ATOM 1235 CB VAL A 323 0.743 -15.486 6.280 1.00 10.34 C ATOM 1236 CG1 VAL A 323 0.976 -14.889 7.670 1.00 73.11 C ATOM 1237 CG2 VAL A 323 2.071 -15.761 5.572 1.00 30.13 C ATOM 0 H VAL A 323 -0.810 -17.297 4.466 1.00 34.41 H new ATOM 0 HA VAL A 323 0.306 -17.355 7.175 1.00 31.13 H new ATOM 0 HB VAL A 323 0.194 -14.754 5.688 1.00 10.34 H new ATOM 0 HG11 VAL A 323 1.583 -13.988 7.582 1.00 73.11 H new ATOM 0 HG12 VAL A 323 0.017 -14.638 8.123 1.00 73.11 H new ATOM 0 HG13 VAL A 323 1.494 -15.616 8.296 1.00 73.11 H new ATOM 0 HG21 VAL A 323 2.656 -14.842 5.526 1.00 30.13 H new ATOM 0 HG22 VAL A 323 2.628 -16.518 6.124 1.00 30.13 H new ATOM 0 HG23 VAL A 323 1.877 -16.119 4.561 1.00 30.13 H new ATOM 1247 N VAL A 324 -1.931 -16.799 7.939 1.00 31.03 N ATOM 1248 CA VAL A 324 -3.292 -16.586 8.403 1.00 63.52 C ATOM 1249 C VAL A 324 -3.311 -15.425 9.399 1.00 30.40 C ATOM 1250 O VAL A 324 -2.269 -14.846 9.702 1.00 14.24 O ATOM 1251 CB VAL A 324 -3.855 -17.884 8.986 1.00 25.22 C ATOM 1252 CG1 VAL A 324 -4.091 -18.922 7.887 1.00 22.13 C ATOM 1253 CG2 VAL A 324 -2.935 -18.439 10.076 1.00 35.03 C ATOM 0 H VAL A 324 -1.304 -17.210 8.631 1.00 31.03 H new ATOM 0 HA VAL A 324 -3.941 -16.311 7.571 1.00 63.52 H new ATOM 0 HB VAL A 324 -4.818 -17.656 9.443 1.00 25.22 H new ATOM 0 HG11 VAL A 324 -4.491 -19.835 8.328 1.00 22.13 H new ATOM 0 HG12 VAL A 324 -4.802 -18.528 7.161 1.00 22.13 H new ATOM 0 HG13 VAL A 324 -3.148 -19.144 7.387 1.00 22.13 H new ATOM 0 HG21 VAL A 324 -3.358 -19.361 10.474 1.00 35.03 H new ATOM 0 HG22 VAL A 324 -1.952 -18.644 9.653 1.00 35.03 H new ATOM 0 HG23 VAL A 324 -2.840 -17.708 10.879 1.00 35.03 H new ATOM 1263 N ASN A 325 -4.507 -15.120 9.880 1.00 31.54 N ATOM 1264 CA ASN A 325 -4.676 -14.039 10.836 1.00 2.01 C ATOM 1265 C ASN A 325 -5.072 -14.622 12.194 1.00 3.43 C ATOM 1266 O ASN A 325 -5.064 -15.838 12.378 1.00 4.33 O ATOM 1267 CB ASN A 325 -5.782 -13.080 10.393 1.00 40.44 C ATOM 1268 CG ASN A 325 -6.824 -13.802 9.536 1.00 21.35 C ATOM 1269 OD1 ASN A 325 -7.280 -13.308 8.519 1.00 41.05 O ATOM 1270 ND2 ASN A 325 -7.174 -14.997 10.004 1.00 30.03 N ATOM 0 H ASN A 325 -5.369 -15.603 9.625 1.00 31.54 H new ATOM 0 HA ASN A 325 -3.733 -13.496 10.901 1.00 2.01 H new ATOM 0 HB2 ASN A 325 -6.264 -12.646 11.269 1.00 40.44 H new ATOM 0 HB3 ASN A 325 -5.348 -12.256 9.827 1.00 40.44 H new ATOM 0 HD21 ASN A 325 -7.863 -15.559 9.504 1.00 30.03 H new ATOM 0 HD22 ASN A 325 -6.753 -15.352 10.863 1.00 30.03 H new ATOM 1277 N GLN A 326 -5.409 -13.726 13.111 1.00 62.22 N ATOM 1278 CA GLN A 326 -5.807 -14.136 14.447 1.00 71.13 C ATOM 1279 C GLN A 326 -7.151 -14.866 14.399 1.00 11.35 C ATOM 1280 O GLN A 326 -7.623 -15.372 15.417 1.00 43.24 O ATOM 1281 CB GLN A 326 -5.868 -12.936 15.393 1.00 2.33 C ATOM 1282 CG GLN A 326 -7.135 -12.113 15.154 1.00 11.53 C ATOM 1283 CD GLN A 326 -7.283 -11.014 16.209 1.00 24.34 C ATOM 1284 OE1 GLN A 326 -7.582 -11.264 17.365 1.00 35.33 O ATOM 1285 NE2 GLN A 326 -7.056 -9.787 15.749 1.00 62.44 N ATOM 0 H GLN A 326 -5.414 -12.718 12.955 1.00 62.22 H new ATOM 0 HA GLN A 326 -5.056 -14.824 14.834 1.00 71.13 H new ATOM 0 HB2 GLN A 326 -5.844 -13.282 16.426 1.00 2.33 H new ATOM 0 HB3 GLN A 326 -4.989 -12.308 15.247 1.00 2.33 H new ATOM 0 HG2 GLN A 326 -7.100 -11.666 14.161 1.00 11.53 H new ATOM 0 HG3 GLN A 326 -8.007 -12.766 15.179 1.00 11.53 H new ATOM 0 HE21 GLN A 326 -6.809 -9.647 14.769 1.00 62.44 H new ATOM 0 HE22 GLN A 326 -7.128 -8.986 16.376 1.00 62.44 H new ATOM 1294 N ASP A 327 -7.730 -14.897 13.208 1.00 1.41 N ATOM 1295 CA ASP A 327 -9.010 -15.556 13.015 1.00 14.20 C ATOM 1296 C ASP A 327 -8.776 -16.968 12.476 1.00 63.31 C ATOM 1297 O ASP A 327 -9.713 -17.756 12.361 1.00 71.34 O ATOM 1298 CB ASP A 327 -9.872 -14.800 12.001 1.00 3.04 C ATOM 1299 CG ASP A 327 -11.284 -14.458 12.480 1.00 31.43 C ATOM 1300 OD1 ASP A 327 -12.281 -14.951 11.932 1.00 50.15 O ATOM 1301 OD2 ASP A 327 -11.339 -13.638 13.474 1.00 32.14 O ATOM 0 H ASP A 327 -7.336 -14.476 12.367 1.00 1.41 H new ATOM 0 HA ASP A 327 -9.523 -15.583 13.976 1.00 14.20 H new ATOM 0 HB2 ASP A 327 -9.362 -13.875 11.731 1.00 3.04 H new ATOM 0 HB3 ASP A 327 -9.948 -15.399 11.093 1.00 3.04 H new ATOM 1307 N GLY A 328 -7.519 -17.245 12.160 1.00 32.50 N ATOM 1308 CA GLY A 328 -7.149 -18.549 11.636 1.00 74.32 C ATOM 1309 C GLY A 328 -7.626 -18.715 10.191 1.00 13.14 C ATOM 1310 O GLY A 328 -8.329 -19.673 9.872 1.00 43.32 O ATOM 0 H GLY A 328 -6.744 -16.589 12.257 1.00 32.50 H new ATOM 0 HA2 GLY A 328 -6.067 -18.669 11.682 1.00 74.32 H new ATOM 0 HA3 GLY A 328 -7.583 -19.332 12.258 1.00 74.32 H new ATOM 1314 N GLU A 329 -7.226 -17.767 9.357 1.00 5.22 N ATOM 1315 CA GLU A 329 -7.603 -17.796 7.954 1.00 12.44 C ATOM 1316 C GLU A 329 -6.517 -17.141 7.099 1.00 63.23 C ATOM 1317 O GLU A 329 -6.069 -16.035 7.396 1.00 14.25 O ATOM 1318 CB GLU A 329 -8.956 -17.115 7.737 1.00 72.42 C ATOM 1319 CG GLU A 329 -8.783 -15.752 7.064 1.00 62.44 C ATOM 1320 CD GLU A 329 -10.139 -15.146 6.696 1.00 4.24 C ATOM 1321 OE1 GLU A 329 -11.033 -15.065 7.551 1.00 35.00 O ATOM 1322 OE2 GLU A 329 -10.245 -14.749 5.474 1.00 72.04 O ATOM 0 H GLU A 329 -6.644 -16.973 9.626 1.00 5.22 H new ATOM 0 HA GLU A 329 -7.702 -18.837 7.646 1.00 12.44 H new ATOM 0 HB2 GLU A 329 -9.592 -17.750 7.121 1.00 72.42 H new ATOM 0 HB3 GLU A 329 -9.462 -16.990 8.694 1.00 72.42 H new ATOM 0 HG2 GLU A 329 -8.249 -15.077 7.733 1.00 62.44 H new ATOM 0 HG3 GLU A 329 -8.173 -15.860 6.167 1.00 62.44 H new ATOM 1330 N THR A 330 -6.123 -17.853 6.053 1.00 55.24 N ATOM 1331 CA THR A 330 -5.098 -17.355 5.152 1.00 62.14 C ATOM 1332 C THR A 330 -5.563 -16.064 4.476 1.00 44.41 C ATOM 1333 O THR A 330 -6.602 -16.042 3.819 1.00 15.22 O ATOM 1334 CB THR A 330 -4.757 -18.470 4.161 1.00 22.33 C ATOM 1335 OG1 THR A 330 -3.966 -19.380 4.922 1.00 73.04 O ATOM 1336 CG2 THR A 330 -3.817 -17.999 3.050 1.00 60.14 C ATOM 0 H THR A 330 -6.495 -18.771 5.810 1.00 55.24 H new ATOM 0 HA THR A 330 -4.190 -17.092 5.694 1.00 62.14 H new ATOM 0 HB THR A 330 -5.676 -18.857 3.719 1.00 22.33 H new ATOM 0 HG1 THR A 330 -3.702 -20.136 4.357 1.00 73.04 H new ATOM 0 HG21 THR A 330 -3.607 -18.829 2.375 1.00 60.14 H new ATOM 0 HG22 THR A 330 -4.288 -17.189 2.494 1.00 60.14 H new ATOM 0 HG23 THR A 330 -2.885 -17.644 3.489 1.00 60.14 H new ATOM 1344 N ILE A 331 -4.769 -15.018 4.660 1.00 35.53 N ATOM 1345 CA ILE A 331 -5.087 -13.726 4.077 1.00 64.12 C ATOM 1346 C ILE A 331 -4.164 -13.470 2.883 1.00 75.30 C ATOM 1347 O ILE A 331 -4.575 -12.862 1.896 1.00 51.10 O ATOM 1348 CB ILE A 331 -5.032 -12.629 5.142 1.00 30.31 C ATOM 1349 CG1 ILE A 331 -3.585 -12.253 5.468 1.00 52.22 C ATOM 1350 CG2 ILE A 331 -5.813 -13.040 6.392 1.00 2.22 C ATOM 1351 CD1 ILE A 331 -3.504 -11.475 6.783 1.00 42.12 C ATOM 0 H ILE A 331 -3.907 -15.040 5.204 1.00 35.53 H new ATOM 0 HA ILE A 331 -6.109 -13.720 3.699 1.00 64.12 H new ATOM 0 HB ILE A 331 -5.513 -11.737 4.740 1.00 30.31 H new ATOM 0 HG12 ILE A 331 -2.978 -13.155 5.537 1.00 52.22 H new ATOM 0 HG13 ILE A 331 -3.171 -11.651 4.659 1.00 52.22 H new ATOM 0 HG21 ILE A 331 -5.758 -12.243 7.134 1.00 2.22 H new ATOM 0 HG22 ILE A 331 -6.855 -13.219 6.127 1.00 2.22 H new ATOM 0 HG23 ILE A 331 -5.383 -13.952 6.807 1.00 2.22 H new ATOM 0 HD11 ILE A 331 -2.465 -11.220 6.991 1.00 42.12 H new ATOM 0 HD12 ILE A 331 -4.093 -10.561 6.702 1.00 42.12 H new ATOM 0 HD13 ILE A 331 -3.897 -12.089 7.594 1.00 42.12 H new ATOM 1363 N LEU A 332 -2.935 -13.948 3.012 1.00 14.14 N ATOM 1364 CA LEU A 332 -1.952 -13.779 1.957 1.00 43.45 C ATOM 1365 C LEU A 332 -1.303 -15.130 1.648 1.00 14.30 C ATOM 1366 O LEU A 332 -1.416 -16.070 2.433 1.00 1.11 O ATOM 1367 CB LEU A 332 -0.948 -12.686 2.330 1.00 40.24 C ATOM 1368 CG LEU A 332 -1.197 -11.307 1.714 1.00 74.51 C ATOM 1369 CD1 LEU A 332 -0.030 -10.360 1.999 1.00 71.55 C ATOM 1370 CD2 LEU A 332 -1.492 -11.421 0.217 1.00 43.22 C ATOM 0 H LEU A 332 -2.598 -14.453 3.832 1.00 14.14 H new ATOM 0 HA LEU A 332 -2.433 -13.439 1.040 1.00 43.45 H new ATOM 0 HB2 LEU A 332 -0.941 -12.581 3.415 1.00 40.24 H new ATOM 0 HB3 LEU A 332 0.047 -13.019 2.036 1.00 40.24 H new ATOM 0 HG LEU A 332 -2.081 -10.877 2.184 1.00 74.51 H new ATOM 0 HD11 LEU A 332 -0.233 -9.388 1.550 1.00 71.55 H new ATOM 0 HD12 LEU A 332 0.090 -10.245 3.076 1.00 71.55 H new ATOM 0 HD13 LEU A 332 0.885 -10.772 1.574 1.00 71.55 H new ATOM 0 HD21 LEU A 332 -1.665 -10.427 -0.196 1.00 43.22 H new ATOM 0 HD22 LEU A 332 -0.642 -11.881 -0.287 1.00 43.22 H new ATOM 0 HD23 LEU A 332 -2.379 -12.036 0.067 1.00 43.22 H new ATOM 1382 N VAL A 333 -0.639 -15.184 0.503 1.00 10.40 N ATOM 1383 CA VAL A 333 0.027 -16.404 0.081 1.00 3.10 C ATOM 1384 C VAL A 333 1.299 -16.045 -0.689 1.00 45.04 C ATOM 1385 O VAL A 333 1.272 -15.197 -1.580 1.00 74.22 O ATOM 1386 CB VAL A 333 -0.937 -17.273 -0.729 1.00 23.43 C ATOM 1387 CG1 VAL A 333 -2.382 -17.060 -0.274 1.00 3.24 C ATOM 1388 CG2 VAL A 333 -0.789 -17.006 -2.228 1.00 24.22 C ATOM 0 H VAL A 333 -0.548 -14.402 -0.146 1.00 10.40 H new ATOM 0 HA VAL A 333 0.327 -16.995 0.947 1.00 3.10 H new ATOM 0 HB VAL A 333 -0.679 -18.317 -0.548 1.00 23.43 H new ATOM 0 HG11 VAL A 333 -3.046 -17.689 -0.866 1.00 3.24 H new ATOM 0 HG12 VAL A 333 -2.475 -17.325 0.779 1.00 3.24 H new ATOM 0 HG13 VAL A 333 -2.656 -16.014 -0.411 1.00 3.24 H new ATOM 0 HG21 VAL A 333 -1.486 -17.637 -2.780 1.00 24.22 H new ATOM 0 HG22 VAL A 333 -1.007 -15.958 -2.434 1.00 24.22 H new ATOM 0 HG23 VAL A 333 0.231 -17.233 -2.539 1.00 24.22 H new ATOM 1398 N GLY A 334 2.385 -16.708 -0.318 1.00 72.24 N ATOM 1399 CA GLY A 334 3.665 -16.470 -0.963 1.00 53.34 C ATOM 1400 C GLY A 334 3.882 -17.439 -2.127 1.00 35.51 C ATOM 1401 O GLY A 334 4.005 -18.646 -1.920 1.00 13.44 O ATOM 0 H GLY A 334 2.404 -17.410 0.422 1.00 72.24 H new ATOM 0 HA2 GLY A 334 3.707 -15.444 -1.327 1.00 53.34 H new ATOM 0 HA3 GLY A 334 4.469 -16.584 -0.236 1.00 53.34 H new ATOM 1405 N LYS A 335 3.922 -16.876 -3.325 1.00 75.14 N ATOM 1406 CA LYS A 335 4.121 -17.676 -4.522 1.00 43.20 C ATOM 1407 C LYS A 335 5.211 -18.717 -4.258 1.00 42.34 C ATOM 1408 O LYS A 335 5.217 -19.784 -4.871 1.00 13.45 O ATOM 1409 CB LYS A 335 4.408 -16.776 -5.726 1.00 23.21 C ATOM 1410 CG LYS A 335 5.900 -16.451 -5.824 1.00 1.32 C ATOM 1411 CD LYS A 335 6.318 -15.461 -4.734 1.00 70.04 C ATOM 1412 CE LYS A 335 7.841 -15.327 -4.670 1.00 53.24 C ATOM 1413 NZ LYS A 335 8.422 -16.409 -3.845 1.00 1.11 N ATOM 0 H LYS A 335 3.820 -15.875 -3.493 1.00 75.14 H new ATOM 0 HA LYS A 335 3.211 -18.222 -4.772 1.00 43.20 H new ATOM 0 HB2 LYS A 335 4.079 -17.270 -6.640 1.00 23.21 H new ATOM 0 HB3 LYS A 335 3.836 -15.852 -5.639 1.00 23.21 H new ATOM 0 HG2 LYS A 335 6.482 -17.368 -5.731 1.00 1.32 H new ATOM 0 HG3 LYS A 335 6.121 -16.032 -6.806 1.00 1.32 H new ATOM 0 HD2 LYS A 335 5.872 -14.487 -4.932 1.00 70.04 H new ATOM 0 HD3 LYS A 335 5.938 -15.795 -3.769 1.00 70.04 H new ATOM 0 HE2 LYS A 335 8.258 -15.365 -5.676 1.00 53.24 H new ATOM 0 HE3 LYS A 335 8.109 -14.358 -4.250 1.00 53.24 H new ATOM 0 HZ1 LYS A 335 9.285 -16.064 -3.378 1.00 1.11 H new ATOM 0 HZ2 LYS A 335 7.733 -16.704 -3.124 1.00 1.11 H new ATOM 0 HZ3 LYS A 335 8.657 -17.220 -4.452 1.00 1.11 H new ATOM 1426 N CYS A 336 6.108 -18.370 -3.347 1.00 33.15 N ATOM 1427 CA CYS A 336 7.200 -19.261 -2.994 1.00 61.24 C ATOM 1428 C CYS A 336 7.816 -19.800 -4.287 1.00 32.50 C ATOM 1429 O CYS A 336 7.665 -20.979 -4.606 1.00 4.12 O ATOM 1430 CB CYS A 336 6.735 -20.388 -2.070 1.00 61.31 C ATOM 1431 SG CYS A 336 7.239 -20.033 -0.347 1.00 42.22 S ATOM 0 H CYS A 336 6.101 -17.484 -2.842 1.00 33.15 H new ATOM 0 HA CYS A 336 7.956 -18.710 -2.434 1.00 61.24 H new ATOM 0 HB2 CYS A 336 5.651 -20.492 -2.127 1.00 61.31 H new ATOM 0 HB3 CYS A 336 7.164 -21.336 -2.395 1.00 61.31 H new ATOM 0 HG CYS A 336 8.244 -20.792 -0.024 1.00 42.22 H new ATOM 1437 N ALA A 337 8.496 -18.912 -4.996 1.00 62.14 N ATOM 1438 CA ALA A 337 9.135 -19.284 -6.247 1.00 63.12 C ATOM 1439 C ALA A 337 10.450 -20.007 -5.948 1.00 30.23 C ATOM 1440 O ALA A 337 10.737 -20.329 -4.796 1.00 21.12 O ATOM 1441 CB ALA A 337 9.339 -18.036 -7.107 1.00 44.55 C ATOM 0 H ALA A 337 8.619 -17.935 -4.728 1.00 62.14 H new ATOM 0 HA ALA A 337 8.503 -19.969 -6.812 1.00 63.12 H new ATOM 0 HB1 ALA A 337 9.818 -18.315 -8.045 1.00 44.55 H new ATOM 0 HB2 ALA A 337 8.373 -17.576 -7.316 1.00 44.55 H new ATOM 0 HB3 ALA A 337 9.971 -17.326 -6.574 1.00 44.55 H new ATOM 1447 N ASP A 338 11.213 -20.241 -7.005 1.00 25.41 N ATOM 1448 CA ASP A 338 12.491 -20.921 -6.870 1.00 10.43 C ATOM 1449 C ASP A 338 13.537 -19.932 -6.349 1.00 75.24 C ATOM 1450 O ASP A 338 14.526 -19.656 -7.026 1.00 20.31 O ATOM 1451 CB ASP A 338 12.976 -21.455 -8.219 1.00 31.24 C ATOM 1452 CG ASP A 338 11.867 -21.894 -9.177 1.00 32.22 C ATOM 1453 OD1 ASP A 338 11.279 -21.071 -9.894 1.00 2.43 O ATOM 1454 OD2 ASP A 338 11.609 -23.158 -9.169 1.00 73.15 O ATOM 0 H ASP A 338 10.971 -19.972 -7.959 1.00 25.41 H new ATOM 0 HA ASP A 338 12.359 -21.754 -6.179 1.00 10.43 H new ATOM 0 HB2 ASP A 338 13.571 -20.682 -8.706 1.00 31.24 H new ATOM 0 HB3 ASP A 338 13.638 -22.302 -8.041 1.00 31.24 H new ATOM 1460 N SER A 339 13.281 -19.426 -5.152 1.00 24.12 N ATOM 1461 CA SER A 339 14.188 -18.474 -4.533 1.00 23.31 C ATOM 1462 C SER A 339 13.745 -18.186 -3.097 1.00 75.13 C ATOM 1463 O SER A 339 12.574 -18.357 -2.759 1.00 42.23 O ATOM 1464 CB SER A 339 14.257 -17.175 -5.338 1.00 72.21 C ATOM 1465 OG SER A 339 15.288 -16.311 -4.870 1.00 45.30 O ATOM 0 H SER A 339 12.459 -19.657 -4.594 1.00 24.12 H new ATOM 0 HA SER A 339 15.186 -18.913 -4.517 1.00 23.31 H new ATOM 0 HB2 SER A 339 14.429 -17.408 -6.389 1.00 72.21 H new ATOM 0 HB3 SER A 339 13.298 -16.660 -5.279 1.00 72.21 H new ATOM 0 HG SER A 339 15.300 -15.494 -5.411 1.00 45.30 H new ATOM 1471 N ASN A 340 14.703 -17.754 -2.291 1.00 60.11 N ATOM 1472 CA ASN A 340 14.426 -17.441 -0.900 1.00 12.44 C ATOM 1473 C ASN A 340 13.467 -16.250 -0.831 1.00 23.13 C ATOM 1474 O ASN A 340 12.678 -16.138 0.106 1.00 55.24 O ATOM 1475 CB ASN A 340 15.707 -17.060 -0.155 1.00 51.20 C ATOM 1476 CG ASN A 340 16.755 -18.170 -0.263 1.00 55.32 C ATOM 1477 OD1 ASN A 340 17.062 -18.666 -1.334 1.00 60.43 O ATOM 1478 ND2 ASN A 340 17.284 -18.530 0.903 1.00 54.43 N ATOM 0 H ASN A 340 15.673 -17.613 -2.575 1.00 60.11 H new ATOM 0 HA ASN A 340 13.989 -18.325 -0.436 1.00 12.44 H new ATOM 0 HB2 ASN A 340 16.109 -16.134 -0.566 1.00 51.20 H new ATOM 0 HB3 ASN A 340 15.479 -16.871 0.894 1.00 51.20 H new ATOM 0 HD21 ASN A 340 17.992 -19.263 0.937 1.00 54.43 H new ATOM 0 HD22 ASN A 340 16.981 -18.073 1.763 1.00 54.43 H new ATOM 1485 N GLU A 341 13.568 -15.391 -1.834 1.00 63.24 N ATOM 1486 CA GLU A 341 12.720 -14.213 -1.900 1.00 21.15 C ATOM 1487 C GLU A 341 11.258 -14.622 -2.089 1.00 50.45 C ATOM 1488 O GLU A 341 10.955 -15.502 -2.893 1.00 22.30 O ATOM 1489 CB GLU A 341 13.175 -13.271 -3.015 1.00 45.34 C ATOM 1490 CG GLU A 341 13.899 -12.051 -2.442 1.00 1.23 C ATOM 1491 CD GLU A 341 14.810 -11.410 -3.491 1.00 55.31 C ATOM 1492 OE1 GLU A 341 15.850 -10.833 -3.140 1.00 54.12 O ATOM 1493 OE2 GLU A 341 14.404 -11.527 -4.710 1.00 33.31 O ATOM 0 H GLU A 341 14.225 -15.487 -2.608 1.00 63.24 H new ATOM 0 HA GLU A 341 12.807 -13.673 -0.957 1.00 21.15 H new ATOM 0 HB2 GLU A 341 13.837 -13.803 -3.698 1.00 45.34 H new ATOM 0 HB3 GLU A 341 12.312 -12.946 -3.596 1.00 45.34 H new ATOM 0 HG2 GLU A 341 13.169 -11.320 -2.095 1.00 1.23 H new ATOM 0 HG3 GLU A 341 14.490 -12.348 -1.575 1.00 1.23 H new ATOM 1501 N ILE A 342 10.390 -13.962 -1.336 1.00 70.25 N ATOM 1502 CA ILE A 342 8.967 -14.246 -1.412 1.00 12.32 C ATOM 1503 C ILE A 342 8.183 -12.938 -1.279 1.00 20.44 C ATOM 1504 O ILE A 342 8.427 -12.155 -0.363 1.00 4.52 O ATOM 1505 CB ILE A 342 8.576 -15.305 -0.379 1.00 41.12 C ATOM 1506 CG1 ILE A 342 9.478 -16.536 -0.489 1.00 31.24 C ATOM 1507 CG2 ILE A 342 7.094 -15.667 -0.499 1.00 64.11 C ATOM 1508 CD1 ILE A 342 9.225 -17.505 0.668 1.00 23.30 C ATOM 0 H ILE A 342 10.645 -13.232 -0.671 1.00 70.25 H new ATOM 0 HA ILE A 342 8.715 -14.673 -2.383 1.00 12.32 H new ATOM 0 HB ILE A 342 8.725 -14.884 0.616 1.00 41.12 H new ATOM 0 HG12 ILE A 342 9.296 -17.041 -1.438 1.00 31.24 H new ATOM 0 HG13 ILE A 342 10.523 -16.227 -0.488 1.00 31.24 H new ATOM 0 HG21 ILE A 342 6.842 -16.421 0.246 1.00 64.11 H new ATOM 0 HG22 ILE A 342 6.487 -14.777 -0.333 1.00 64.11 H new ATOM 0 HG23 ILE A 342 6.895 -16.061 -1.496 1.00 64.11 H new ATOM 0 HD11 ILE A 342 9.879 -18.371 0.566 1.00 23.30 H new ATOM 0 HD12 ILE A 342 9.431 -17.004 1.614 1.00 23.30 H new ATOM 0 HD13 ILE A 342 8.185 -17.831 0.649 1.00 23.30 H new ATOM 1520 N THR A 343 7.257 -12.744 -2.206 1.00 10.10 N ATOM 1521 CA THR A 343 6.436 -11.545 -2.204 1.00 32.13 C ATOM 1522 C THR A 343 4.952 -11.915 -2.263 1.00 44.24 C ATOM 1523 O THR A 343 4.354 -11.925 -3.338 1.00 42.41 O ATOM 1524 CB THR A 343 6.889 -10.660 -3.366 1.00 53.43 C ATOM 1525 OG1 THR A 343 6.335 -11.290 -4.518 1.00 44.45 O ATOM 1526 CG2 THR A 343 8.400 -10.723 -3.597 1.00 30.05 C ATOM 0 H THR A 343 7.057 -13.397 -2.964 1.00 10.10 H new ATOM 0 HA THR A 343 6.561 -10.981 -1.280 1.00 32.13 H new ATOM 0 HB THR A 343 6.595 -9.628 -3.172 1.00 53.43 H new ATOM 0 HG1 THR A 343 5.361 -11.180 -4.514 1.00 44.45 H new ATOM 0 HG21 THR A 343 8.668 -10.077 -4.433 1.00 30.05 H new ATOM 0 HG22 THR A 343 8.920 -10.389 -2.699 1.00 30.05 H new ATOM 0 HG23 THR A 343 8.691 -11.749 -3.824 1.00 30.05 H new ATOM 1534 N LEU A 344 4.402 -12.210 -1.095 1.00 55.21 N ATOM 1535 CA LEU A 344 2.999 -12.579 -1.001 1.00 24.21 C ATOM 1536 C LEU A 344 2.184 -11.722 -1.971 1.00 2.41 C ATOM 1537 O LEU A 344 2.395 -10.513 -2.065 1.00 22.43 O ATOM 1538 CB LEU A 344 2.519 -12.493 0.449 1.00 11.12 C ATOM 1539 CG LEU A 344 2.813 -13.711 1.327 1.00 64.11 C ATOM 1540 CD1 LEU A 344 4.298 -14.076 1.278 1.00 62.34 C ATOM 1541 CD2 LEU A 344 2.326 -13.485 2.759 1.00 31.45 C ATOM 0 H LEU A 344 4.902 -12.201 -0.206 1.00 55.21 H new ATOM 0 HA LEU A 344 2.858 -13.618 -1.298 1.00 24.21 H new ATOM 0 HB2 LEU A 344 2.977 -11.618 0.911 1.00 11.12 H new ATOM 0 HB3 LEU A 344 1.442 -12.325 0.445 1.00 11.12 H new ATOM 0 HG LEU A 344 2.259 -14.561 0.929 1.00 64.11 H new ATOM 0 HD11 LEU A 344 4.480 -14.945 1.910 1.00 62.34 H new ATOM 0 HD12 LEU A 344 4.582 -14.308 0.252 1.00 62.34 H new ATOM 0 HD13 LEU A 344 4.891 -13.235 1.637 1.00 62.34 H new ATOM 0 HD21 LEU A 344 2.547 -14.366 3.362 1.00 31.45 H new ATOM 0 HD22 LEU A 344 2.833 -12.618 3.183 1.00 31.45 H new ATOM 0 HD23 LEU A 344 1.250 -13.310 2.754 1.00 31.45 H new ATOM 1553 N LYS A 345 1.270 -12.380 -2.668 1.00 20.20 N ATOM 1554 CA LYS A 345 0.422 -11.693 -3.627 1.00 62.24 C ATOM 1555 C LYS A 345 -1.021 -11.693 -3.118 1.00 63.54 C ATOM 1556 O LYS A 345 -1.544 -10.652 -2.726 1.00 35.00 O ATOM 1557 CB LYS A 345 0.583 -12.306 -5.020 1.00 62.20 C ATOM 1558 CG LYS A 345 1.165 -13.719 -4.933 1.00 41.44 C ATOM 1559 CD LYS A 345 1.507 -14.257 -6.324 1.00 50.02 C ATOM 1560 CE LYS A 345 2.365 -13.258 -7.103 1.00 22.10 C ATOM 1561 NZ LYS A 345 1.538 -12.515 -8.080 1.00 0.03 N ATOM 0 H LYS A 345 1.098 -13.382 -2.588 1.00 20.20 H new ATOM 0 HA LYS A 345 0.725 -10.651 -3.725 1.00 62.24 H new ATOM 0 HB2 LYS A 345 -0.384 -12.337 -5.522 1.00 62.20 H new ATOM 0 HB3 LYS A 345 1.236 -11.677 -5.625 1.00 62.20 H new ATOM 0 HG2 LYS A 345 2.061 -13.710 -4.312 1.00 41.44 H new ATOM 0 HG3 LYS A 345 0.448 -14.382 -4.449 1.00 41.44 H new ATOM 0 HD2 LYS A 345 2.039 -15.204 -6.231 1.00 50.02 H new ATOM 0 HD3 LYS A 345 0.589 -14.460 -6.875 1.00 50.02 H new ATOM 0 HE2 LYS A 345 2.838 -12.560 -6.412 1.00 22.10 H new ATOM 0 HE3 LYS A 345 3.166 -13.785 -7.622 1.00 22.10 H new ATOM 0 HZ1 LYS A 345 1.938 -11.566 -8.223 1.00 0.03 H new ATOM 0 HZ2 LYS A 345 1.528 -13.026 -8.986 1.00 0.03 H new ATOM 0 HZ3 LYS A 345 0.566 -12.430 -7.719 1.00 0.03 H new ATOM 1574 N SER A 346 -1.622 -12.874 -3.142 1.00 13.35 N ATOM 1575 CA SER A 346 -2.994 -13.023 -2.687 1.00 74.32 C ATOM 1576 C SER A 346 -3.453 -14.471 -2.874 1.00 25.10 C ATOM 1577 O SER A 346 -3.022 -15.147 -3.807 1.00 25.02 O ATOM 1578 CB SER A 346 -3.929 -12.070 -3.435 1.00 30.22 C ATOM 1579 OG SER A 346 -4.615 -12.722 -4.500 1.00 52.13 O ATOM 0 H SER A 346 -1.185 -13.735 -3.469 1.00 13.35 H new ATOM 0 HA SER A 346 -3.032 -12.770 -1.628 1.00 74.32 H new ATOM 0 HB2 SER A 346 -4.655 -11.653 -2.737 1.00 30.22 H new ATOM 0 HB3 SER A 346 -3.353 -11.235 -3.833 1.00 30.22 H new ATOM 0 HG SER A 346 -5.567 -12.793 -4.281 1.00 52.13 H new ATOM 1585 N PRO A 347 -4.343 -14.916 -1.948 1.00 14.03 N ATOM 1586 CA PRO A 347 -4.865 -16.271 -2.001 1.00 63.11 C ATOM 1587 C PRO A 347 -5.901 -16.417 -3.118 1.00 5.42 C ATOM 1588 O PRO A 347 -5.763 -17.274 -3.989 1.00 42.43 O ATOM 1589 CB PRO A 347 -5.442 -16.525 -0.618 1.00 74.23 C ATOM 1590 CG PRO A 347 -5.641 -15.155 0.009 1.00 55.25 C ATOM 1591 CD PRO A 347 -4.876 -14.144 -0.829 1.00 50.51 C ATOM 0 HA PRO A 347 -4.098 -17.008 -2.239 1.00 63.11 H new ATOM 0 HB2 PRO A 347 -6.386 -17.066 -0.682 1.00 74.23 H new ATOM 0 HB3 PRO A 347 -4.766 -17.134 -0.019 1.00 74.23 H new ATOM 0 HG2 PRO A 347 -6.700 -14.900 0.042 1.00 55.25 H new ATOM 0 HG3 PRO A 347 -5.280 -15.150 1.037 1.00 55.25 H new ATOM 0 HD2 PRO A 347 -5.529 -13.343 -1.176 1.00 50.51 H new ATOM 0 HD3 PRO A 347 -4.076 -13.677 -0.254 1.00 50.51 H new ATOM 1599 N LEU A 348 -6.914 -15.566 -3.055 1.00 54.14 N ATOM 1600 CA LEU A 348 -7.973 -15.589 -4.051 1.00 1.25 C ATOM 1601 C LEU A 348 -7.925 -14.297 -4.869 1.00 72.23 C ATOM 1602 O LEU A 348 -7.543 -13.247 -4.356 1.00 53.52 O ATOM 1603 CB LEU A 348 -9.327 -15.846 -3.387 1.00 30.54 C ATOM 1604 CG LEU A 348 -10.401 -16.476 -4.276 1.00 12.10 C ATOM 1605 CD1 LEU A 348 -11.430 -17.237 -3.438 1.00 31.02 C ATOM 1606 CD2 LEU A 348 -11.057 -15.423 -5.172 1.00 33.32 C ATOM 0 H LEU A 348 -7.025 -14.856 -2.331 1.00 54.14 H new ATOM 0 HA LEU A 348 -7.824 -16.414 -4.747 1.00 1.25 H new ATOM 0 HB2 LEU A 348 -9.170 -16.495 -2.526 1.00 30.54 H new ATOM 0 HB3 LEU A 348 -9.708 -14.898 -3.006 1.00 30.54 H new ATOM 0 HG LEU A 348 -9.920 -17.202 -4.931 1.00 12.10 H new ATOM 0 HD11 LEU A 348 -12.182 -17.675 -4.095 1.00 31.02 H new ATOM 0 HD12 LEU A 348 -10.931 -18.029 -2.880 1.00 31.02 H new ATOM 0 HD13 LEU A 348 -11.912 -16.550 -2.742 1.00 31.02 H new ATOM 0 HD21 LEU A 348 -11.817 -15.897 -5.794 1.00 33.32 H new ATOM 0 HD22 LEU A 348 -11.522 -14.656 -4.552 1.00 33.32 H new ATOM 0 HD23 LEU A 348 -10.300 -14.965 -5.809 1.00 33.32 H new