USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=28 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 159:sc= -9.93! (180deg=-7.46!) USER MOD Set 1.2: A 336 CYS SG : rot -101:sc= -2.64 USER MOD Set 2.1: A 283 SER OG : rot -110:sc= -0.886 USER MOD Set 2.2: A 319 TYR OH : rot -170:sc= 0.0276 USER MOD Set 3.1: A 267 ASN : amide:sc= -5.35! C(o=-4.9!,f=-9.1!) USER MOD Set 3.2: A 269 THR OG1 : rot -84:sc= 0.429 USER MOD Single : A 251 HIS : no HD1:sc= -0.213 X(o=-0.21,f=-0.66) USER MOD Single : A 255 SER OG : rot 67:sc= 0.306 USER MOD Single : A 256 ASN : amide:sc= -1.15 X(o=-1.2,f=-0.91) USER MOD Single : A 259 ASN : amide:sc= -3.39! C(o=-3.4!,f=-11!) USER MOD Single : A 260 SER OG : rot -40:sc= 0.442 USER MOD Single : A 262 HIS : no HE2:sc= -3.3! C(o=-3.3!,f=-7.1!) USER MOD Single : A 266 TYR OH : rot 180:sc= -0.328 USER MOD Single : A 268 LYS NZ :NH3+ -111:sc= -0.105 (180deg=-1.08) USER MOD Single : A 270 ASN : amide:sc= -0.0304 K(o=-0.03,f=-1.1) USER MOD Single : A 276 ASN : amide:sc= -0.762 K(o=-0.76,f=-0.12) USER MOD Single : A 277 CYS SG : rot 180:sc= -0.401 USER MOD Single : A 278 THR OG1 : rot 180:sc= -1.69! USER MOD Single : A 282 SER OG : rot 180:sc= 0 USER MOD Single : A 290 SER OG : rot 66:sc= -2.6! USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 293 MET CE :methyl 174:sc= -0.6 (180deg=-0.682) USER MOD Single : A 296 HIS : no HE2:sc= -3.58! C(o=-3.6!,f=-5.3!) USER MOD Single : A 301 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 303 GLN : amide:sc= -0.0324 X(o=-0.032,f=0) USER MOD Single : A 304 LYS NZ :NH3+ 144:sc= -4.43! (180deg=-7.69!) USER MOD Single : A 311 SER OG : rot 180:sc= 0 USER MOD Single : A 314 THR OG1 : rot 170:sc= 0.0105 USER MOD Single : A 317 SER OG : rot 180:sc= 0 USER MOD Single : A 318 ASN : amide:sc= -0.0276 X(o=-0.028,f=-0.4) USER MOD Single : A 320 THR OG1 : rot 180:sc= 0 USER MOD Single : A 322 LYS NZ :NH3+ -154:sc= -1.87 (180deg=-3.69!) USER MOD Single : A 325 ASN : amide:sc= -1.88 K(o=-1.9,f=-7.3!) USER MOD Single : A 326 GLN : amide:sc= -0.245 X(o=-0.24,f=0) USER MOD Single : A 330 THR OG1 : rot 180:sc=0.000455 USER MOD Single : A 335 LYS NZ :NH3+ -178:sc= -3.29! (180deg=-3.4!) USER MOD Single : A 339 SER OG : rot 6:sc= 0.907 USER MOD Single : A 340 ASN : amide:sc= 0.834 K(o=0.83,f=-2!) USER MOD Single : A 343 THR OG1 : rot 69:sc= 0.672 USER MOD Single : A 345 LYS NZ :NH3+ -111:sc= -1.74! (180deg=-5.25!) USER MOD Single : A 346 SER OG : rot -97:sc= -0.29 USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 249 3.028 -7.100 -1.501 1.00 33.23 N ATOM 43 CA LEU A 249 4.279 -7.837 -1.439 1.00 75.25 C ATOM 44 C LEU A 249 4.767 -7.885 0.010 1.00 41.34 C ATOM 45 O LEU A 249 4.758 -6.870 0.705 1.00 20.21 O ATOM 46 CB LEU A 249 5.298 -7.243 -2.413 1.00 64.42 C ATOM 47 CG LEU A 249 6.382 -6.359 -1.793 1.00 22.42 C ATOM 48 CD1 LEU A 249 5.763 -5.201 -1.009 1.00 55.21 C ATOM 49 CD2 LEU A 249 7.339 -7.187 -0.932 1.00 34.11 C ATOM 0 HA LEU A 249 4.131 -8.868 -1.759 1.00 75.25 H new ATOM 0 HB2 LEU A 249 5.784 -8.062 -2.943 1.00 64.42 H new ATOM 0 HB3 LEU A 249 4.760 -6.656 -3.157 1.00 64.42 H new ATOM 0 HG LEU A 249 6.970 -5.923 -2.601 1.00 22.42 H new ATOM 0 HD11 LEU A 249 6.555 -4.588 -0.579 1.00 55.21 H new ATOM 0 HD12 LEU A 249 5.156 -4.592 -1.679 1.00 55.21 H new ATOM 0 HD13 LEU A 249 5.136 -5.597 -0.210 1.00 55.21 H new ATOM 0 HD21 LEU A 249 8.100 -6.535 -0.503 1.00 34.11 H new ATOM 0 HD22 LEU A 249 6.781 -7.670 -0.130 1.00 34.11 H new ATOM 0 HD23 LEU A 249 7.819 -7.947 -1.549 1.00 34.11 H new ATOM 61 N LEU A 250 5.182 -9.073 0.422 1.00 61.41 N ATOM 62 CA LEU A 250 5.673 -9.266 1.776 1.00 64.53 C ATOM 63 C LEU A 250 7.111 -9.788 1.722 1.00 12.04 C ATOM 64 O LEU A 250 7.338 -10.966 1.450 1.00 50.34 O ATOM 65 CB LEU A 250 4.722 -10.166 2.568 1.00 40.51 C ATOM 66 CG LEU A 250 5.012 -10.295 4.065 1.00 64.45 C ATOM 67 CD1 LEU A 250 3.888 -9.676 4.897 1.00 42.32 C ATOM 68 CD2 LEU A 250 5.272 -11.754 4.448 1.00 45.40 C ATOM 0 H LEU A 250 5.189 -9.912 -0.158 1.00 61.41 H new ATOM 0 HA LEU A 250 5.697 -8.317 2.312 1.00 64.53 H new ATOM 0 HB2 LEU A 250 3.708 -9.786 2.446 1.00 40.51 H new ATOM 0 HB3 LEU A 250 4.744 -11.162 2.127 1.00 40.51 H new ATOM 0 HG LEU A 250 5.921 -9.736 4.287 1.00 64.45 H new ATOM 0 HD11 LEU A 250 4.119 -9.781 5.957 1.00 42.32 H new ATOM 0 HD12 LEU A 250 3.792 -8.619 4.650 1.00 42.32 H new ATOM 0 HD13 LEU A 250 2.950 -10.186 4.678 1.00 42.32 H new ATOM 0 HD21 LEU A 250 5.476 -11.819 5.517 1.00 45.40 H new ATOM 0 HD22 LEU A 250 4.395 -12.355 4.209 1.00 45.40 H new ATOM 0 HD23 LEU A 250 6.131 -12.129 3.892 1.00 45.40 H new ATOM 80 N HIS A 251 8.044 -8.886 1.987 1.00 0.43 N ATOM 81 CA HIS A 251 9.453 -9.240 1.973 1.00 42.21 C ATOM 82 C HIS A 251 9.724 -10.311 3.031 1.00 11.14 C ATOM 83 O HIS A 251 9.259 -10.200 4.165 1.00 62.21 O ATOM 84 CB HIS A 251 10.328 -7.997 2.150 1.00 55.11 C ATOM 85 CG HIS A 251 10.615 -7.260 0.863 1.00 25.33 C ATOM 86 ND1 HIS A 251 10.643 -5.879 0.780 1.00 32.12 N ATOM 87 CD2 HIS A 251 10.889 -7.727 -0.389 1.00 30.02 C ATOM 88 CE1 HIS A 251 10.920 -5.541 -0.470 1.00 42.23 C ATOM 89 NE2 HIS A 251 11.072 -6.687 -1.193 1.00 71.44 N ATOM 0 H HIS A 251 7.852 -7.910 2.213 1.00 0.43 H new ATOM 0 HA HIS A 251 9.715 -9.662 1.003 1.00 42.21 H new ATOM 0 HB2 HIS A 251 9.837 -7.316 2.845 1.00 55.11 H new ATOM 0 HB3 HIS A 251 11.273 -8.292 2.606 1.00 55.11 H new ATOM 0 HD2 HIS A 251 10.947 -8.766 -0.677 1.00 30.02 H new ATOM 0 HE1 HIS A 251 11.010 -4.534 -0.850 1.00 42.23 H new ATOM 0 HE2 HIS A 251 11.290 -6.737 -2.188 1.00 71.44 H new ATOM 97 N VAL A 252 10.475 -11.324 2.624 1.00 53.52 N ATOM 98 CA VAL A 252 10.813 -12.414 3.523 1.00 40.22 C ATOM 99 C VAL A 252 12.251 -12.863 3.255 1.00 51.33 C ATOM 100 O VAL A 252 12.831 -12.519 2.226 1.00 52.50 O ATOM 101 CB VAL A 252 9.796 -13.547 3.377 1.00 72.32 C ATOM 102 CG1 VAL A 252 10.194 -14.754 4.228 1.00 21.42 C ATOM 103 CG2 VAL A 252 8.386 -13.068 3.730 1.00 4.01 C ATOM 0 H VAL A 252 10.859 -11.413 1.683 1.00 53.52 H new ATOM 0 HA VAL A 252 10.764 -12.083 4.560 1.00 40.22 H new ATOM 0 HB VAL A 252 9.791 -13.860 2.333 1.00 72.32 H new ATOM 0 HG11 VAL A 252 9.454 -15.545 4.106 1.00 21.42 H new ATOM 0 HG12 VAL A 252 11.171 -15.118 3.909 1.00 21.42 H new ATOM 0 HG13 VAL A 252 10.241 -14.460 5.277 1.00 21.42 H new ATOM 0 HG21 VAL A 252 7.683 -13.893 3.618 1.00 4.01 H new ATOM 0 HG22 VAL A 252 8.369 -12.715 4.761 1.00 4.01 H new ATOM 0 HG23 VAL A 252 8.100 -12.255 3.063 1.00 4.01 H new ATOM 113 N GLU A 253 12.785 -13.624 4.198 1.00 32.41 N ATOM 114 CA GLU A 253 14.144 -14.124 4.077 1.00 51.03 C ATOM 115 C GLU A 253 14.257 -15.513 4.709 1.00 44.33 C ATOM 116 O GLU A 253 13.840 -15.716 5.848 1.00 64.11 O ATOM 117 CB GLU A 253 15.144 -13.152 4.706 1.00 53.21 C ATOM 118 CG GLU A 253 16.568 -13.448 4.234 1.00 64.53 C ATOM 119 CD GLU A 253 16.891 -12.682 2.950 1.00 42.15 C ATOM 120 OE1 GLU A 253 16.845 -11.443 2.939 1.00 40.21 O ATOM 121 OE2 GLU A 253 17.200 -13.420 1.937 1.00 11.52 O ATOM 0 H GLU A 253 12.301 -13.907 5.050 1.00 32.41 H new ATOM 0 HA GLU A 253 14.387 -14.208 3.018 1.00 51.03 H new ATOM 0 HB2 GLU A 253 14.876 -12.129 4.444 1.00 53.21 H new ATOM 0 HB3 GLU A 253 15.094 -13.226 5.792 1.00 53.21 H new ATOM 0 HG2 GLU A 253 17.278 -13.173 5.014 1.00 64.53 H new ATOM 0 HG3 GLU A 253 16.683 -14.518 4.062 1.00 64.53 H new ATOM 129 N VAL A 254 14.824 -16.432 3.942 1.00 72.54 N ATOM 130 CA VAL A 254 14.997 -17.796 4.412 1.00 25.23 C ATOM 131 C VAL A 254 16.456 -18.008 4.821 1.00 24.05 C ATOM 132 O VAL A 254 17.360 -17.893 3.995 1.00 53.14 O ATOM 133 CB VAL A 254 14.527 -18.783 3.342 1.00 64.12 C ATOM 134 CG1 VAL A 254 14.726 -20.228 3.803 1.00 22.23 C ATOM 135 CG2 VAL A 254 13.068 -18.525 2.961 1.00 43.22 C ATOM 0 H VAL A 254 15.170 -16.259 2.998 1.00 72.54 H new ATOM 0 HA VAL A 254 14.382 -17.977 5.294 1.00 25.23 H new ATOM 0 HB VAL A 254 15.138 -18.628 2.453 1.00 64.12 H new ATOM 0 HG11 VAL A 254 14.384 -20.909 3.024 1.00 22.23 H new ATOM 0 HG12 VAL A 254 15.783 -20.405 4.000 1.00 22.23 H new ATOM 0 HG13 VAL A 254 14.153 -20.402 4.714 1.00 22.23 H new ATOM 0 HG21 VAL A 254 12.759 -19.240 2.199 1.00 43.22 H new ATOM 0 HG22 VAL A 254 12.436 -18.638 3.842 1.00 43.22 H new ATOM 0 HG23 VAL A 254 12.968 -17.512 2.570 1.00 43.22 H new ATOM 145 N SER A 255 16.641 -18.314 6.097 1.00 4.12 N ATOM 146 CA SER A 255 17.975 -18.543 6.626 1.00 3.12 C ATOM 147 C SER A 255 18.364 -20.012 6.448 1.00 35.15 C ATOM 148 O SER A 255 19.288 -20.328 5.701 1.00 53.34 O ATOM 149 CB SER A 255 18.058 -18.147 8.102 1.00 42.34 C ATOM 150 OG SER A 255 17.600 -16.815 8.323 1.00 25.54 O ATOM 0 H SER A 255 15.889 -18.409 6.780 1.00 4.12 H new ATOM 0 HA SER A 255 18.675 -17.919 6.070 1.00 3.12 H new ATOM 0 HB2 SER A 255 17.462 -18.839 8.697 1.00 42.34 H new ATOM 0 HB3 SER A 255 19.089 -18.238 8.445 1.00 42.34 H new ATOM 0 HG SER A 255 16.638 -16.765 8.140 1.00 25.54 H new ATOM 156 N ASN A 256 17.638 -20.872 7.149 1.00 40.52 N ATOM 157 CA ASN A 256 17.895 -22.300 7.078 1.00 51.02 C ATOM 158 C ASN A 256 19.339 -22.576 7.500 1.00 3.43 C ATOM 159 O ASN A 256 20.143 -23.055 6.702 1.00 73.12 O ATOM 160 CB ASN A 256 17.712 -22.822 5.652 1.00 74.34 C ATOM 161 CG ASN A 256 18.164 -24.279 5.539 1.00 63.51 C ATOM 162 OD1 ASN A 256 18.921 -24.655 4.659 1.00 72.34 O ATOM 163 ND2 ASN A 256 17.660 -25.076 6.477 1.00 65.51 N ATOM 0 H ASN A 256 16.872 -20.607 7.768 1.00 40.52 H new ATOM 0 HA ASN A 256 17.190 -22.802 7.740 1.00 51.02 H new ATOM 0 HB2 ASN A 256 16.664 -22.739 5.362 1.00 74.34 H new ATOM 0 HB3 ASN A 256 18.284 -22.205 4.959 1.00 74.34 H new ATOM 0 HD21 ASN A 256 17.902 -26.067 6.488 1.00 65.51 H new ATOM 0 HD22 ASN A 256 17.031 -24.696 7.185 1.00 65.51 H new ATOM 170 N GLU A 257 19.626 -22.261 8.755 1.00 55.50 N ATOM 171 CA GLU A 257 20.959 -22.468 9.293 1.00 22.22 C ATOM 172 C GLU A 257 20.924 -22.446 10.823 1.00 74.43 C ATOM 173 O GLU A 257 19.852 -22.363 11.421 1.00 2.31 O ATOM 174 CB GLU A 257 21.937 -21.424 8.753 1.00 44.54 C ATOM 175 CG GLU A 257 21.328 -20.021 8.807 1.00 74.31 C ATOM 176 CD GLU A 257 22.037 -19.077 7.834 1.00 1.13 C ATOM 177 OE1 GLU A 257 22.460 -17.981 8.232 1.00 63.32 O ATOM 178 OE2 GLU A 257 22.143 -19.517 6.626 1.00 30.14 O ATOM 0 H GLU A 257 18.957 -21.864 9.415 1.00 55.50 H new ATOM 0 HA GLU A 257 21.310 -23.448 8.971 1.00 22.22 H new ATOM 0 HB2 GLU A 257 22.858 -21.447 9.336 1.00 44.54 H new ATOM 0 HB3 GLU A 257 22.205 -21.669 7.725 1.00 44.54 H new ATOM 0 HG2 GLU A 257 20.267 -20.072 8.562 1.00 74.31 H new ATOM 0 HG3 GLU A 257 21.403 -19.627 9.821 1.00 74.31 H new ATOM 186 N ASP A 258 22.108 -22.523 11.411 1.00 20.14 N ATOM 187 CA ASP A 258 22.226 -22.513 12.860 1.00 71.23 C ATOM 188 C ASP A 258 21.672 -23.824 13.421 1.00 33.11 C ATOM 189 O ASP A 258 21.256 -23.882 14.577 1.00 4.25 O ATOM 190 CB ASP A 258 21.425 -21.361 13.470 1.00 73.44 C ATOM 191 CG ASP A 258 21.930 -20.871 14.828 1.00 54.51 C ATOM 192 OD1 ASP A 258 21.233 -20.985 15.847 1.00 22.05 O ATOM 193 OD2 ASP A 258 23.107 -20.344 14.814 1.00 22.20 O ATOM 0 H ASP A 258 22.994 -22.593 10.911 1.00 20.14 H new ATOM 0 HA ASP A 258 23.280 -22.392 13.112 1.00 71.23 H new ATOM 0 HB2 ASP A 258 21.433 -20.523 12.772 1.00 73.44 H new ATOM 0 HB3 ASP A 258 20.387 -21.677 13.577 1.00 73.44 H new ATOM 199 N ASN A 259 21.683 -24.844 12.576 1.00 61.40 N ATOM 200 CA ASN A 259 21.187 -26.151 12.973 1.00 13.14 C ATOM 201 C ASN A 259 19.661 -26.103 13.073 1.00 74.35 C ATOM 202 O ASN A 259 19.049 -26.962 13.706 1.00 60.54 O ATOM 203 CB ASN A 259 21.737 -26.556 14.342 1.00 31.22 C ATOM 204 CG ASN A 259 23.239 -26.282 14.432 1.00 4.23 C ATOM 205 OD1 ASN A 259 23.750 -25.303 13.913 1.00 1.35 O ATOM 206 ND2 ASN A 259 23.917 -27.198 15.118 1.00 75.30 N ATOM 0 H ASN A 259 22.028 -24.792 11.617 1.00 61.40 H new ATOM 0 HA ASN A 259 21.510 -26.876 12.225 1.00 13.14 H new ATOM 0 HB2 ASN A 259 21.216 -26.005 15.125 1.00 31.22 H new ATOM 0 HB3 ASN A 259 21.546 -27.615 14.516 1.00 31.22 H new ATOM 0 HD21 ASN A 259 24.926 -27.104 15.235 1.00 75.30 H new ATOM 0 HD22 ASN A 259 23.428 -27.994 15.527 1.00 75.30 H new ATOM 213 N SER A 260 19.090 -25.090 12.437 1.00 34.44 N ATOM 214 CA SER A 260 17.647 -24.920 12.446 1.00 14.51 C ATOM 215 C SER A 260 17.231 -23.921 11.364 1.00 5.41 C ATOM 216 O SER A 260 18.030 -23.573 10.495 1.00 21.34 O ATOM 217 CB SER A 260 17.156 -24.451 13.817 1.00 32.24 C ATOM 218 OG SER A 260 17.776 -25.170 14.880 1.00 12.14 O ATOM 0 H SER A 260 19.600 -24.379 11.913 1.00 34.44 H new ATOM 0 HA SER A 260 17.188 -25.886 12.236 1.00 14.51 H new ATOM 0 HB2 SER A 260 17.361 -23.387 13.931 1.00 32.24 H new ATOM 0 HB3 SER A 260 16.075 -24.575 13.877 1.00 32.24 H new ATOM 0 HG SER A 260 17.857 -26.115 14.632 1.00 12.14 H new ATOM 224 N LEU A 261 15.983 -23.487 11.452 1.00 12.32 N ATOM 225 CA LEU A 261 15.452 -22.535 10.492 1.00 52.55 C ATOM 226 C LEU A 261 15.449 -21.137 11.114 1.00 50.33 C ATOM 227 O LEU A 261 15.613 -20.992 12.324 1.00 11.21 O ATOM 228 CB LEU A 261 14.079 -22.988 9.991 1.00 51.42 C ATOM 229 CG LEU A 261 14.071 -23.789 8.688 1.00 63.15 C ATOM 230 CD1 LEU A 261 12.659 -24.267 8.346 1.00 54.20 C ATOM 231 CD2 LEU A 261 14.696 -22.985 7.546 1.00 62.03 C ATOM 0 H LEU A 261 15.324 -23.777 12.174 1.00 12.32 H new ATOM 0 HA LEU A 261 16.089 -22.490 9.609 1.00 52.55 H new ATOM 0 HB2 LEU A 261 13.612 -23.592 10.769 1.00 51.42 H new ATOM 0 HB3 LEU A 261 13.454 -22.105 9.855 1.00 51.42 H new ATOM 0 HG LEU A 261 14.686 -24.678 8.830 1.00 63.15 H new ATOM 0 HD11 LEU A 261 12.682 -24.834 7.415 1.00 54.20 H new ATOM 0 HD12 LEU A 261 12.286 -24.903 9.149 1.00 54.20 H new ATOM 0 HD13 LEU A 261 12.001 -23.406 8.230 1.00 54.20 H new ATOM 0 HD21 LEU A 261 14.678 -23.578 6.631 1.00 62.03 H new ATOM 0 HD22 LEU A 261 14.129 -22.067 7.395 1.00 62.03 H new ATOM 0 HD23 LEU A 261 15.727 -22.737 7.797 1.00 62.03 H new ATOM 243 N HIS A 262 15.261 -20.143 10.258 1.00 72.24 N ATOM 244 CA HIS A 262 15.234 -18.762 10.708 1.00 4.00 C ATOM 245 C HIS A 262 14.600 -17.882 9.629 1.00 63.22 C ATOM 246 O HIS A 262 15.280 -17.443 8.702 1.00 13.14 O ATOM 247 CB HIS A 262 16.635 -18.294 11.107 1.00 3.10 C ATOM 248 CG HIS A 262 16.668 -17.454 12.361 1.00 10.34 C ATOM 249 ND1 HIS A 262 17.597 -17.646 13.369 1.00 63.23 N ATOM 250 CD2 HIS A 262 15.877 -16.416 12.760 1.00 65.01 C ATOM 251 CE1 HIS A 262 17.366 -16.760 14.326 1.00 45.43 C ATOM 252 NE2 HIS A 262 16.300 -15.998 13.947 1.00 71.52 N ATOM 0 H HIS A 262 15.126 -20.267 9.255 1.00 72.24 H new ATOM 0 HA HIS A 262 14.617 -18.679 11.603 1.00 4.00 H new ATOM 0 HB2 HIS A 262 17.272 -19.167 11.250 1.00 3.10 H new ATOM 0 HB3 HIS A 262 17.063 -17.719 10.286 1.00 3.10 H new ATOM 0 HD1 HIS A 262 18.335 -18.351 13.374 1.00 63.23 H new ATOM 0 HD2 HIS A 262 15.047 -16.004 12.204 1.00 65.01 H new ATOM 0 HE1 HIS A 262 17.924 -16.659 15.245 1.00 45.43 H new ATOM 260 N PHE A 263 13.305 -17.651 9.785 1.00 70.34 N ATOM 261 CA PHE A 263 12.571 -16.832 8.835 1.00 3.11 C ATOM 262 C PHE A 263 12.437 -15.394 9.340 1.00 3.04 C ATOM 263 O PHE A 263 12.382 -15.159 10.546 1.00 10.44 O ATOM 264 CB PHE A 263 11.176 -17.445 8.700 1.00 11.42 C ATOM 265 CG PHE A 263 11.166 -18.836 8.064 1.00 40.02 C ATOM 266 CD1 PHE A 263 11.157 -18.964 6.710 1.00 61.32 C ATOM 267 CD2 PHE A 263 11.166 -19.944 8.852 1.00 61.31 C ATOM 268 CE1 PHE A 263 11.148 -20.256 6.119 1.00 11.42 C ATOM 269 CE2 PHE A 263 11.157 -21.236 8.261 1.00 12.42 C ATOM 270 CZ PHE A 263 11.148 -21.364 6.907 1.00 11.03 C ATOM 0 H PHE A 263 12.745 -18.017 10.555 1.00 70.34 H new ATOM 0 HA PHE A 263 13.098 -16.806 7.881 1.00 3.11 H new ATOM 0 HB2 PHE A 263 10.720 -17.505 9.688 1.00 11.42 H new ATOM 0 HB3 PHE A 263 10.554 -16.779 8.102 1.00 11.42 H new ATOM 0 HD1 PHE A 263 11.157 -18.084 6.084 1.00 61.32 H new ATOM 0 HD2 PHE A 263 11.173 -19.842 9.927 1.00 61.31 H new ATOM 0 HE1 PHE A 263 11.141 -20.358 5.044 1.00 11.42 H new ATOM 0 HE2 PHE A 263 11.157 -22.116 8.887 1.00 12.42 H new ATOM 0 HZ PHE A 263 11.141 -22.346 6.458 1.00 11.03 H new ATOM 280 N ILE A 264 12.389 -14.470 8.392 1.00 1.44 N ATOM 281 CA ILE A 264 12.263 -13.061 8.726 1.00 33.13 C ATOM 282 C ILE A 264 11.349 -12.379 7.705 1.00 24.45 C ATOM 283 O ILE A 264 11.709 -12.247 6.537 1.00 71.14 O ATOM 284 CB ILE A 264 13.643 -12.413 8.846 1.00 44.23 C ATOM 285 CG1 ILE A 264 14.529 -13.185 9.825 1.00 20.45 C ATOM 286 CG2 ILE A 264 13.524 -10.935 9.224 1.00 44.15 C ATOM 287 CD1 ILE A 264 15.916 -12.549 9.930 1.00 43.51 C ATOM 0 H ILE A 264 12.435 -14.669 7.393 1.00 1.44 H new ATOM 0 HA ILE A 264 11.795 -12.941 9.703 1.00 33.13 H new ATOM 0 HB ILE A 264 14.127 -12.458 7.870 1.00 44.23 H new ATOM 0 HG12 ILE A 264 14.059 -13.205 10.808 1.00 20.45 H new ATOM 0 HG13 ILE A 264 14.624 -14.220 9.496 1.00 20.45 H new ATOM 0 HG21 ILE A 264 14.520 -10.498 9.303 1.00 44.15 H new ATOM 0 HG22 ILE A 264 12.956 -10.408 8.457 1.00 44.15 H new ATOM 0 HG23 ILE A 264 13.011 -10.844 10.182 1.00 44.15 H new ATOM 0 HD11 ILE A 264 16.525 -13.118 10.633 1.00 43.51 H new ATOM 0 HD12 ILE A 264 16.393 -12.553 8.950 1.00 43.51 H new ATOM 0 HD13 ILE A 264 15.820 -11.522 10.282 1.00 43.51 H new ATOM 299 N LEU A 265 10.186 -11.965 8.184 1.00 12.33 N ATOM 300 CA LEU A 265 9.218 -11.300 7.328 1.00 42.10 C ATOM 301 C LEU A 265 9.099 -9.832 7.744 1.00 62.33 C ATOM 302 O LEU A 265 9.177 -9.511 8.928 1.00 5.33 O ATOM 303 CB LEU A 265 7.886 -12.052 7.340 1.00 61.42 C ATOM 304 CG LEU A 265 7.964 -13.550 7.644 1.00 64.05 C ATOM 305 CD1 LEU A 265 7.869 -13.810 9.148 1.00 33.01 C ATOM 306 CD2 LEU A 265 6.903 -14.325 6.859 1.00 3.33 C ATOM 0 H LEU A 265 9.892 -12.077 9.154 1.00 12.33 H new ATOM 0 HA LEU A 265 9.555 -11.312 6.291 1.00 42.10 H new ATOM 0 HB2 LEU A 265 7.234 -11.585 8.079 1.00 61.42 H new ATOM 0 HB3 LEU A 265 7.410 -11.923 6.368 1.00 61.42 H new ATOM 0 HG LEU A 265 8.937 -13.915 7.316 1.00 64.05 H new ATOM 0 HD11 LEU A 265 7.927 -14.882 9.336 1.00 33.01 H new ATOM 0 HD12 LEU A 265 8.691 -13.307 9.657 1.00 33.01 H new ATOM 0 HD13 LEU A 265 6.921 -13.426 9.524 1.00 33.01 H new ATOM 0 HD21 LEU A 265 6.980 -15.387 7.093 1.00 3.33 H new ATOM 0 HD22 LEU A 265 5.912 -13.964 7.133 1.00 3.33 H new ATOM 0 HD23 LEU A 265 7.060 -14.177 5.791 1.00 3.33 H new ATOM 318 N TYR A 266 8.912 -8.981 6.746 1.00 61.12 N ATOM 319 CA TYR A 266 8.782 -7.555 6.993 1.00 75.21 C ATOM 320 C TYR A 266 7.528 -6.994 6.318 1.00 21.31 C ATOM 321 O TYR A 266 7.452 -6.937 5.092 1.00 72.12 O ATOM 322 CB TYR A 266 10.017 -6.904 6.368 1.00 22.23 C ATOM 323 CG TYR A 266 11.288 -7.750 6.476 1.00 13.44 C ATOM 324 CD1 TYR A 266 12.078 -7.667 7.605 1.00 13.10 C ATOM 325 CD2 TYR A 266 11.644 -8.595 5.445 1.00 31.02 C ATOM 326 CE1 TYR A 266 13.274 -8.463 7.707 1.00 55.43 C ATOM 327 CE2 TYR A 266 12.840 -9.391 5.547 1.00 52.20 C ATOM 328 CZ TYR A 266 13.596 -9.285 6.673 1.00 74.23 C ATOM 329 OH TYR A 266 14.725 -10.037 6.769 1.00 50.22 O ATOM 0 H TYR A 266 8.847 -9.252 5.765 1.00 61.12 H new ATOM 0 HA TYR A 266 8.701 -7.357 8.062 1.00 75.21 H new ATOM 0 HB2 TYR A 266 9.816 -6.702 5.316 1.00 22.23 H new ATOM 0 HB3 TYR A 266 10.191 -5.942 6.850 1.00 22.23 H new ATOM 0 HD1 TYR A 266 11.799 -7.005 8.412 1.00 13.10 H new ATOM 0 HD2 TYR A 266 11.026 -8.660 4.562 1.00 31.02 H new ATOM 0 HE1 TYR A 266 13.901 -8.408 8.585 1.00 55.43 H new ATOM 0 HE2 TYR A 266 13.130 -10.057 4.748 1.00 52.20 H new ATOM 0 HH TYR A 266 14.828 -10.577 5.958 1.00 50.22 H new ATOM 339 N ASN A 267 6.576 -6.594 7.149 1.00 64.43 N ATOM 340 CA ASN A 267 5.330 -6.040 6.648 1.00 62.03 C ATOM 341 C ASN A 267 5.629 -4.784 5.828 1.00 43.54 C ATOM 342 O ASN A 267 5.869 -3.715 6.387 1.00 12.25 O ATOM 343 CB ASN A 267 4.402 -5.644 7.798 1.00 70.14 C ATOM 344 CG ASN A 267 3.145 -4.948 7.273 1.00 75.45 C ATOM 345 OD1 ASN A 267 2.283 -5.551 6.654 1.00 13.00 O ATOM 346 ND2 ASN A 267 3.088 -3.649 7.553 1.00 61.54 N ATOM 0 H ASN A 267 6.643 -6.643 8.166 1.00 64.43 H new ATOM 0 HA ASN A 267 4.844 -6.801 6.038 1.00 62.03 H new ATOM 0 HB2 ASN A 267 4.121 -6.531 8.365 1.00 70.14 H new ATOM 0 HB3 ASN A 267 4.929 -4.981 8.484 1.00 70.14 H new ATOM 0 HD21 ASN A 267 2.288 -3.096 7.245 1.00 61.54 H new ATOM 0 HD22 ASN A 267 3.844 -3.206 8.075 1.00 61.54 H new ATOM 353 N LYS A 268 5.606 -4.954 4.514 1.00 53.32 N ATOM 354 CA LYS A 268 5.871 -3.847 3.611 1.00 44.41 C ATOM 355 C LYS A 268 4.548 -3.321 3.053 1.00 54.44 C ATOM 356 O LYS A 268 4.481 -2.196 2.560 1.00 51.41 O ATOM 357 CB LYS A 268 6.872 -4.264 2.531 1.00 33.21 C ATOM 358 CG LYS A 268 8.251 -4.534 3.136 1.00 10.40 C ATOM 359 CD LYS A 268 9.104 -3.263 3.144 1.00 32.31 C ATOM 360 CE LYS A 268 8.832 -2.429 4.397 1.00 5.24 C ATOM 361 NZ LYS A 268 10.043 -1.674 4.789 1.00 4.44 N ATOM 0 H LYS A 268 5.408 -5.842 4.053 1.00 53.32 H new ATOM 0 HA LYS A 268 6.341 -3.023 4.147 1.00 44.41 H new ATOM 0 HB2 LYS A 268 6.512 -5.159 2.023 1.00 33.21 H new ATOM 0 HB3 LYS A 268 6.948 -3.479 1.779 1.00 33.21 H new ATOM 0 HG2 LYS A 268 8.139 -4.908 4.154 1.00 10.40 H new ATOM 0 HG3 LYS A 268 8.757 -5.312 2.565 1.00 10.40 H new ATOM 0 HD2 LYS A 268 10.160 -3.529 3.102 1.00 32.31 H new ATOM 0 HD3 LYS A 268 8.889 -2.671 2.255 1.00 32.31 H new ATOM 0 HE2 LYS A 268 8.010 -1.738 4.210 1.00 5.24 H new ATOM 0 HE3 LYS A 268 8.522 -3.080 5.214 1.00 5.24 H new ATOM 0 HZ1 LYS A 268 10.420 -2.060 5.678 1.00 4.44 H new ATOM 0 HZ2 LYS A 268 10.762 -1.759 4.042 1.00 4.44 H new ATOM 0 HZ3 LYS A 268 9.799 -0.672 4.923 1.00 4.44 H new ATOM 374 N THR A 269 3.527 -4.160 3.149 1.00 54.54 N ATOM 375 CA THR A 269 2.208 -3.793 2.659 1.00 24.23 C ATOM 376 C THR A 269 1.822 -2.400 3.160 1.00 71.11 C ATOM 377 O THR A 269 2.550 -1.795 3.945 1.00 13.24 O ATOM 378 CB THR A 269 1.226 -4.886 3.085 1.00 53.05 C ATOM 379 OG1 THR A 269 1.255 -4.845 4.509 1.00 44.44 O ATOM 380 CG2 THR A 269 1.728 -6.290 2.742 1.00 35.31 C ATOM 0 H THR A 269 3.586 -5.092 3.559 1.00 54.54 H new ATOM 0 HA THR A 269 2.193 -3.728 1.571 1.00 24.23 H new ATOM 0 HB THR A 269 0.264 -4.716 2.602 1.00 53.05 H new ATOM 0 HG1 THR A 269 2.009 -5.379 4.836 1.00 44.44 H new ATOM 0 HG21 THR A 269 0.994 -7.028 3.066 1.00 35.31 H new ATOM 0 HG22 THR A 269 1.874 -6.371 1.665 1.00 35.31 H new ATOM 0 HG23 THR A 269 2.674 -6.472 3.251 1.00 35.31 H new ATOM 388 N ASN A 270 0.677 -1.932 2.685 1.00 62.13 N ATOM 389 CA ASN A 270 0.185 -0.622 3.074 1.00 1.53 C ATOM 390 C ASN A 270 -0.315 -0.678 4.519 1.00 24.03 C ATOM 391 O ASN A 270 0.157 0.072 5.373 1.00 61.23 O ATOM 392 CB ASN A 270 -0.982 -0.186 2.187 1.00 15.50 C ATOM 393 CG ASN A 270 -1.458 1.221 2.558 1.00 20.52 C ATOM 394 OD1 ASN A 270 -0.771 1.982 3.218 1.00 3.25 O ATOM 395 ND2 ASN A 270 -2.669 1.521 2.098 1.00 32.14 N ATOM 0 H ASN A 270 0.076 -2.437 2.034 1.00 62.13 H new ATOM 0 HA ASN A 270 1.004 0.090 2.969 1.00 1.53 H new ATOM 0 HB2 ASN A 270 -0.676 -0.206 1.141 1.00 15.50 H new ATOM 0 HB3 ASN A 270 -1.806 -0.892 2.291 1.00 15.50 H new ATOM 0 HD21 ASN A 270 -3.076 2.436 2.292 1.00 32.14 H new ATOM 0 HD22 ASN A 270 -3.191 0.836 1.551 1.00 32.14 H new ATOM 402 N ILE A 271 -1.263 -1.574 4.749 1.00 22.32 N ATOM 403 CA ILE A 271 -1.832 -1.738 6.076 1.00 24.42 C ATOM 404 C ILE A 271 -0.781 -2.350 7.005 1.00 63.43 C ATOM 405 O ILE A 271 0.248 -2.843 6.544 1.00 31.33 O ATOM 406 CB ILE A 271 -3.132 -2.541 6.006 1.00 14.01 C ATOM 407 CG1 ILE A 271 -2.865 -4.036 6.192 1.00 1.11 C ATOM 408 CG2 ILE A 271 -3.886 -2.251 4.707 1.00 52.24 C ATOM 409 CD1 ILE A 271 -1.867 -4.548 5.152 1.00 42.03 C ATOM 0 H ILE A 271 -1.652 -2.194 4.039 1.00 22.32 H new ATOM 0 HA ILE A 271 -2.104 -0.770 6.496 1.00 24.42 H new ATOM 0 HB ILE A 271 -3.773 -2.224 6.829 1.00 14.01 H new ATOM 0 HG12 ILE A 271 -2.477 -4.218 7.194 1.00 1.11 H new ATOM 0 HG13 ILE A 271 -3.800 -4.589 6.107 1.00 1.11 H new ATOM 0 HG21 ILE A 271 -4.806 -2.835 4.682 1.00 52.24 H new ATOM 0 HG22 ILE A 271 -4.128 -1.189 4.656 1.00 52.24 H new ATOM 0 HG23 ILE A 271 -3.262 -2.522 3.856 1.00 52.24 H new ATOM 0 HD11 ILE A 271 -1.695 -5.613 5.307 1.00 42.03 H new ATOM 0 HD12 ILE A 271 -2.269 -4.387 4.152 1.00 42.03 H new ATOM 0 HD13 ILE A 271 -0.925 -4.009 5.256 1.00 42.03 H new ATOM 421 N ILE A 272 -1.076 -2.299 8.295 1.00 2.33 N ATOM 422 CA ILE A 272 -0.169 -2.842 9.293 1.00 52.25 C ATOM 423 C ILE A 272 -0.780 -4.109 9.894 1.00 65.41 C ATOM 424 O ILE A 272 -1.943 -4.113 10.293 1.00 21.33 O ATOM 425 CB ILE A 272 0.184 -1.776 10.332 1.00 21.42 C ATOM 426 CG1 ILE A 272 1.108 -0.713 9.735 1.00 12.32 C ATOM 427 CG2 ILE A 272 0.780 -2.413 11.589 1.00 25.41 C ATOM 428 CD1 ILE A 272 0.305 0.352 8.985 1.00 10.22 C ATOM 0 H ILE A 272 -1.931 -1.890 8.673 1.00 2.33 H new ATOM 0 HA ILE A 272 0.776 -3.131 8.833 1.00 52.25 H new ATOM 0 HB ILE A 272 -0.735 -1.272 10.631 1.00 21.42 H new ATOM 0 HG12 ILE A 272 1.689 -0.244 10.529 1.00 12.32 H new ATOM 0 HG13 ILE A 272 1.819 -1.184 9.055 1.00 12.32 H new ATOM 0 HG21 ILE A 272 1.022 -1.634 12.312 1.00 25.41 H new ATOM 0 HG22 ILE A 272 0.057 -3.101 12.026 1.00 25.41 H new ATOM 0 HG23 ILE A 272 1.686 -2.958 11.326 1.00 25.41 H new ATOM 0 HD11 ILE A 272 0.985 1.096 8.570 1.00 10.22 H new ATOM 0 HD12 ILE A 272 -0.256 -0.117 8.177 1.00 10.22 H new ATOM 0 HD13 ILE A 272 -0.387 0.837 9.673 1.00 10.22 H new ATOM 440 N ILE A 273 0.033 -5.155 9.939 1.00 10.13 N ATOM 441 CA ILE A 273 -0.412 -6.426 10.485 1.00 14.32 C ATOM 442 C ILE A 273 -1.262 -6.171 11.732 1.00 52.33 C ATOM 443 O ILE A 273 -0.946 -5.294 12.534 1.00 11.30 O ATOM 444 CB ILE A 273 0.781 -7.350 10.733 1.00 22.22 C ATOM 445 CG1 ILE A 273 1.074 -8.210 9.502 1.00 41.23 C ATOM 446 CG2 ILE A 273 0.565 -8.200 11.987 1.00 4.22 C ATOM 447 CD1 ILE A 273 1.817 -7.404 8.435 1.00 42.34 C ATOM 0 H ILE A 273 0.997 -5.148 9.606 1.00 10.13 H new ATOM 0 HA ILE A 273 -1.046 -6.948 9.768 1.00 14.32 H new ATOM 0 HB ILE A 273 1.661 -6.731 10.911 1.00 22.22 H new ATOM 0 HG12 ILE A 273 1.671 -9.074 9.792 1.00 41.23 H new ATOM 0 HG13 ILE A 273 0.140 -8.592 9.090 1.00 41.23 H new ATOM 0 HG21 ILE A 273 1.428 -8.848 12.140 1.00 4.22 H new ATOM 0 HG22 ILE A 273 0.443 -7.548 12.852 1.00 4.22 H new ATOM 0 HG23 ILE A 273 -0.330 -8.810 11.863 1.00 4.22 H new ATOM 0 HD11 ILE A 273 2.013 -8.038 7.571 1.00 42.34 H new ATOM 0 HD12 ILE A 273 1.206 -6.554 8.130 1.00 42.34 H new ATOM 0 HD13 ILE A 273 2.762 -7.044 8.843 1.00 42.34 H new ATOM 459 N PRO A 274 -2.352 -6.974 11.858 1.00 13.13 N ATOM 460 CA PRO A 274 -3.250 -6.844 12.993 1.00 1.25 C ATOM 461 C PRO A 274 -2.624 -7.435 14.258 1.00 20.51 C ATOM 462 O PRO A 274 -2.837 -6.926 15.357 1.00 2.12 O ATOM 463 CB PRO A 274 -4.524 -7.557 12.571 1.00 21.44 C ATOM 464 CG PRO A 274 -4.133 -8.456 11.409 1.00 1.04 C ATOM 465 CD PRO A 274 -2.758 -8.023 10.928 1.00 62.23 C ATOM 0 HA PRO A 274 -3.458 -5.805 13.248 1.00 1.25 H new ATOM 0 HB2 PRO A 274 -4.936 -8.140 13.394 1.00 21.44 H new ATOM 0 HB3 PRO A 274 -5.291 -6.842 12.271 1.00 21.44 H new ATOM 0 HG2 PRO A 274 -4.117 -9.500 11.722 1.00 1.04 H new ATOM 0 HG3 PRO A 274 -4.862 -8.377 10.603 1.00 1.04 H new ATOM 0 HD2 PRO A 274 -2.055 -8.856 10.939 1.00 62.23 H new ATOM 0 HD3 PRO A 274 -2.796 -7.651 9.904 1.00 62.23 H new ATOM 473 N GLY A 275 -1.864 -8.503 14.060 1.00 14.21 N ATOM 474 CA GLY A 275 -1.206 -9.169 15.171 1.00 60.21 C ATOM 475 C GLY A 275 -1.895 -10.495 15.501 1.00 2.12 C ATOM 476 O GLY A 275 -3.054 -10.702 15.145 1.00 2.00 O ATOM 0 H GLY A 275 -1.690 -8.923 13.147 1.00 14.21 H new ATOM 0 HA2 GLY A 275 -0.160 -9.350 14.923 1.00 60.21 H new ATOM 0 HA3 GLY A 275 -1.218 -8.521 16.047 1.00 60.21 H new ATOM 480 N ASN A 276 -1.152 -11.358 16.178 1.00 32.32 N ATOM 481 CA ASN A 276 -1.677 -12.658 16.561 1.00 61.35 C ATOM 482 C ASN A 276 -1.857 -13.519 15.308 1.00 12.15 C ATOM 483 O ASN A 276 -2.658 -14.452 15.303 1.00 71.53 O ATOM 484 CB ASN A 276 -3.040 -12.523 17.242 1.00 71.32 C ATOM 485 CG ASN A 276 -3.346 -13.750 18.103 1.00 35.12 C ATOM 486 OD1 ASN A 276 -2.805 -13.935 19.181 1.00 52.01 O ATOM 487 ND2 ASN A 276 -4.242 -14.576 17.570 1.00 54.43 N ATOM 0 H ASN A 276 -0.191 -11.183 16.471 1.00 32.32 H new ATOM 0 HA ASN A 276 -0.972 -13.116 17.255 1.00 61.35 H new ATOM 0 HB2 ASN A 276 -3.054 -11.627 17.862 1.00 71.32 H new ATOM 0 HB3 ASN A 276 -3.817 -12.401 16.488 1.00 71.32 H new ATOM 0 HD21 ASN A 276 -4.514 -15.424 18.068 1.00 54.43 H new ATOM 0 HD22 ASN A 276 -4.657 -14.362 16.663 1.00 54.43 H new ATOM 494 N CYS A 277 -1.099 -13.174 14.278 1.00 31.11 N ATOM 495 CA CYS A 277 -1.165 -13.903 13.023 1.00 32.51 C ATOM 496 C CYS A 277 -0.538 -15.283 13.236 1.00 53.24 C ATOM 497 O CYS A 277 -0.102 -15.607 14.339 1.00 32.01 O ATOM 498 CB CYS A 277 -0.486 -13.137 11.887 1.00 43.33 C ATOM 499 SG CYS A 277 -1.227 -11.471 11.725 1.00 62.32 S ATOM 0 H CYS A 277 -0.436 -12.399 14.287 1.00 31.11 H new ATOM 0 HA CYS A 277 -2.206 -14.020 12.722 1.00 32.51 H new ATOM 0 HB2 CYS A 277 0.583 -13.051 12.083 1.00 43.33 H new ATOM 0 HB3 CYS A 277 -0.595 -13.685 10.951 1.00 43.33 H new ATOM 0 HG CYS A 277 -0.642 -10.828 10.759 1.00 62.32 H new ATOM 505 N THR A 278 -0.513 -16.058 12.161 1.00 33.04 N ATOM 506 CA THR A 278 0.053 -17.395 12.216 1.00 30.15 C ATOM 507 C THR A 278 0.552 -17.820 10.834 1.00 21.11 C ATOM 508 O THR A 278 -0.128 -17.606 9.832 1.00 61.02 O ATOM 509 CB THR A 278 -1.007 -18.334 12.795 1.00 74.11 C ATOM 510 OG1 THR A 278 -1.664 -17.548 13.785 1.00 14.12 O ATOM 511 CG2 THR A 278 -0.395 -19.493 13.585 1.00 53.22 C ATOM 0 H THR A 278 -0.876 -15.785 11.247 1.00 33.04 H new ATOM 0 HA THR A 278 0.927 -17.428 12.867 1.00 30.15 H new ATOM 0 HB THR A 278 -1.621 -18.731 11.986 1.00 74.11 H new ATOM 0 HG1 THR A 278 -2.369 -18.080 14.211 1.00 14.12 H new ATOM 0 HG21 THR A 278 -1.191 -20.129 13.974 1.00 53.22 H new ATOM 0 HG22 THR A 278 0.250 -20.079 12.930 1.00 53.22 H new ATOM 0 HG23 THR A 278 0.192 -19.098 14.414 1.00 53.22 H new ATOM 519 N PHE A 279 1.736 -18.415 10.825 1.00 50.22 N ATOM 520 CA PHE A 279 2.334 -18.872 9.582 1.00 42.10 C ATOM 521 C PHE A 279 1.914 -20.309 9.268 1.00 65.35 C ATOM 522 O PHE A 279 1.179 -20.927 10.036 1.00 61.21 O ATOM 523 CB PHE A 279 3.851 -18.826 9.773 1.00 65.33 C ATOM 524 CG PHE A 279 4.636 -18.631 8.474 1.00 63.22 C ATOM 525 CD1 PHE A 279 4.201 -17.739 7.544 1.00 61.11 C ATOM 526 CD2 PHE A 279 5.769 -19.350 8.249 1.00 12.31 C ATOM 527 CE1 PHE A 279 4.929 -17.558 6.338 1.00 24.14 C ATOM 528 CE2 PHE A 279 6.497 -19.169 7.044 1.00 41.35 C ATOM 529 CZ PHE A 279 6.062 -18.277 6.114 1.00 50.34 C ATOM 0 H PHE A 279 2.297 -18.591 11.658 1.00 50.22 H new ATOM 0 HA PHE A 279 2.009 -18.239 8.757 1.00 42.10 H new ATOM 0 HB2 PHE A 279 4.096 -18.015 10.459 1.00 65.33 H new ATOM 0 HB3 PHE A 279 4.176 -19.753 10.246 1.00 65.33 H new ATOM 0 HD1 PHE A 279 3.302 -17.168 7.723 1.00 61.11 H new ATOM 0 HD2 PHE A 279 6.114 -20.058 8.987 1.00 12.31 H new ATOM 0 HE1 PHE A 279 4.583 -16.850 5.599 1.00 24.14 H new ATOM 0 HE2 PHE A 279 7.396 -19.740 6.866 1.00 41.35 H new ATOM 0 HZ PHE A 279 6.616 -18.139 5.197 1.00 50.34 H new ATOM 539 N GLU A 280 2.400 -20.800 8.137 1.00 41.44 N ATOM 540 CA GLU A 280 2.085 -22.153 7.711 1.00 14.30 C ATOM 541 C GLU A 280 2.835 -22.492 6.422 1.00 72.15 C ATOM 542 O GLU A 280 2.432 -22.075 5.337 1.00 71.23 O ATOM 543 CB GLU A 280 0.576 -22.333 7.531 1.00 20.24 C ATOM 544 CG GLU A 280 0.238 -23.777 7.154 1.00 14.10 C ATOM 545 CD GLU A 280 -1.157 -24.161 7.652 1.00 31.20 C ATOM 546 OE1 GLU A 280 -1.304 -24.614 8.797 1.00 4.21 O ATOM 547 OE2 GLU A 280 -2.110 -23.974 6.803 1.00 50.21 O ATOM 0 H GLU A 280 3.010 -20.285 7.502 1.00 41.44 H new ATOM 0 HA GLU A 280 2.410 -22.843 8.489 1.00 14.30 H new ATOM 0 HB2 GLU A 280 0.061 -22.064 8.453 1.00 20.24 H new ATOM 0 HB3 GLU A 280 0.215 -21.657 6.756 1.00 20.24 H new ATOM 0 HG2 GLU A 280 0.287 -23.895 6.072 1.00 14.10 H new ATOM 0 HG3 GLU A 280 0.979 -24.452 7.582 1.00 14.10 H new ATOM 555 N PHE A 281 3.913 -23.246 6.583 1.00 54.45 N ATOM 556 CA PHE A 281 4.723 -23.646 5.445 1.00 52.24 C ATOM 557 C PHE A 281 4.701 -25.165 5.263 1.00 4.14 C ATOM 558 O PHE A 281 4.603 -25.909 6.238 1.00 11.41 O ATOM 559 CB PHE A 281 6.157 -23.199 5.737 1.00 34.23 C ATOM 560 CG PHE A 281 6.565 -23.341 7.205 1.00 40.30 C ATOM 561 CD1 PHE A 281 6.113 -22.448 8.126 1.00 53.12 C ATOM 562 CD2 PHE A 281 7.380 -24.359 7.589 1.00 65.23 C ATOM 563 CE1 PHE A 281 6.492 -22.579 9.488 1.00 72.11 C ATOM 564 CE2 PHE A 281 7.760 -24.490 8.951 1.00 74.41 C ATOM 565 CZ PHE A 281 7.307 -23.598 9.872 1.00 43.43 C ATOM 0 H PHE A 281 4.244 -23.590 7.484 1.00 54.45 H new ATOM 0 HA PHE A 281 4.334 -23.193 4.533 1.00 52.24 H new ATOM 0 HB2 PHE A 281 6.841 -23.783 5.122 1.00 34.23 H new ATOM 0 HB3 PHE A 281 6.270 -22.157 5.438 1.00 34.23 H new ATOM 0 HD1 PHE A 281 5.466 -21.639 7.821 1.00 53.12 H new ATOM 0 HD2 PHE A 281 7.739 -25.068 6.858 1.00 65.23 H new ATOM 0 HE1 PHE A 281 6.133 -21.870 10.219 1.00 72.11 H new ATOM 0 HE2 PHE A 281 8.409 -25.298 9.255 1.00 74.41 H new ATOM 0 HZ PHE A 281 7.594 -23.699 10.908 1.00 43.43 H new ATOM 575 N SER A 282 4.795 -25.581 4.009 1.00 41.52 N ATOM 576 CA SER A 282 4.788 -26.998 3.687 1.00 13.53 C ATOM 577 C SER A 282 6.216 -27.483 3.429 1.00 55.13 C ATOM 578 O SER A 282 7.171 -26.726 3.591 1.00 24.04 O ATOM 579 CB SER A 282 3.902 -27.282 2.473 1.00 62.04 C ATOM 580 OG SER A 282 4.516 -26.868 1.255 1.00 4.43 O ATOM 0 H SER A 282 4.877 -24.961 3.203 1.00 41.52 H new ATOM 0 HA SER A 282 4.376 -27.541 4.538 1.00 13.53 H new ATOM 0 HB2 SER A 282 3.684 -28.349 2.425 1.00 62.04 H new ATOM 0 HB3 SER A 282 2.949 -26.767 2.592 1.00 62.04 H new ATOM 0 HG SER A 282 3.920 -27.068 0.504 1.00 4.43 H new ATOM 586 N SER A 283 6.315 -28.742 3.030 1.00 61.40 N ATOM 587 CA SER A 283 7.610 -29.338 2.747 1.00 0.22 C ATOM 588 C SER A 283 7.430 -30.781 2.271 1.00 11.33 C ATOM 589 O SER A 283 6.305 -31.236 2.071 1.00 70.30 O ATOM 590 CB SER A 283 8.517 -29.294 3.979 1.00 71.34 C ATOM 591 OG SER A 283 9.872 -29.019 3.634 1.00 21.22 O ATOM 0 H SER A 283 5.520 -29.366 2.896 1.00 61.40 H new ATOM 0 HA SER A 283 8.088 -28.759 1.956 1.00 0.22 H new ATOM 0 HB2 SER A 283 8.156 -28.530 4.668 1.00 71.34 H new ATOM 0 HB3 SER A 283 8.463 -30.248 4.504 1.00 71.34 H new ATOM 0 HG SER A 283 10.416 -29.821 3.780 1.00 21.22 H new ATOM 660 N VAL A 288 3.159 -29.847 6.981 1.00 52.55 N ATOM 661 CA VAL A 288 2.805 -28.453 7.192 1.00 25.14 C ATOM 662 C VAL A 288 2.605 -28.204 8.689 1.00 73.24 C ATOM 663 O VAL A 288 2.159 -29.091 9.415 1.00 60.32 O ATOM 664 CB VAL A 288 1.576 -28.092 6.356 1.00 3.10 C ATOM 665 CG1 VAL A 288 0.460 -29.120 6.550 1.00 70.02 C ATOM 666 CG2 VAL A 288 1.085 -26.681 6.684 1.00 1.44 C ATOM 0 HA VAL A 288 3.611 -27.799 6.858 1.00 25.14 H new ATOM 0 HB VAL A 288 1.868 -28.109 5.306 1.00 3.10 H new ATOM 0 HG11 VAL A 288 -0.402 -28.840 5.945 1.00 70.02 H new ATOM 0 HG12 VAL A 288 0.814 -30.104 6.243 1.00 70.02 H new ATOM 0 HG13 VAL A 288 0.171 -29.150 7.601 1.00 70.02 H new ATOM 0 HG21 VAL A 288 0.211 -26.450 6.076 1.00 1.44 H new ATOM 0 HG22 VAL A 288 0.818 -26.625 7.739 1.00 1.44 H new ATOM 0 HG23 VAL A 288 1.876 -25.962 6.471 1.00 1.44 H new ATOM 676 N PHE A 289 2.943 -26.993 9.105 1.00 3.11 N ATOM 677 CA PHE A 289 2.806 -26.616 10.502 1.00 72.03 C ATOM 678 C PHE A 289 2.599 -25.107 10.645 1.00 44.34 C ATOM 679 O PHE A 289 3.189 -24.323 9.902 1.00 55.01 O ATOM 680 CB PHE A 289 4.108 -27.009 11.201 1.00 23.23 C ATOM 681 CG PHE A 289 3.939 -27.356 12.682 1.00 62.11 C ATOM 682 CD1 PHE A 289 3.603 -28.622 13.050 1.00 43.52 C ATOM 683 CD2 PHE A 289 4.125 -26.399 13.630 1.00 11.11 C ATOM 684 CE1 PHE A 289 3.446 -28.943 14.424 1.00 65.51 C ATOM 685 CE2 PHE A 289 3.968 -26.721 15.004 1.00 10.21 C ATOM 686 CZ PHE A 289 3.632 -27.986 15.372 1.00 21.31 C ATOM 0 H PHE A 289 3.312 -26.260 8.499 1.00 3.11 H new ATOM 0 HA PHE A 289 1.942 -27.117 10.940 1.00 72.03 H new ATOM 0 HB2 PHE A 289 4.541 -27.866 10.685 1.00 23.23 H new ATOM 0 HB3 PHE A 289 4.820 -26.188 11.110 1.00 23.23 H new ATOM 0 HD1 PHE A 289 3.456 -29.382 12.297 1.00 43.52 H new ATOM 0 HD2 PHE A 289 4.392 -25.394 13.338 1.00 11.11 H new ATOM 0 HE1 PHE A 289 3.179 -29.948 14.716 1.00 65.51 H new ATOM 0 HE2 PHE A 289 4.116 -25.961 15.757 1.00 10.21 H new ATOM 0 HZ PHE A 289 3.513 -28.231 16.417 1.00 21.31 H new ATOM 696 N SER A 290 1.761 -24.745 11.604 1.00 0.35 N ATOM 697 CA SER A 290 1.470 -23.343 11.854 1.00 34.23 C ATOM 698 C SER A 290 2.144 -22.892 13.151 1.00 4.51 C ATOM 699 O SER A 290 1.980 -23.524 14.193 1.00 3.33 O ATOM 700 CB SER A 290 -0.039 -23.099 11.928 1.00 20.10 C ATOM 701 OG SER A 290 -0.349 -21.716 12.076 1.00 73.14 O ATOM 0 H SER A 290 1.274 -25.398 12.218 1.00 0.35 H new ATOM 0 HA SER A 290 1.866 -22.758 11.024 1.00 34.23 H new ATOM 0 HB2 SER A 290 -0.513 -23.482 11.024 1.00 20.10 H new ATOM 0 HB3 SER A 290 -0.456 -23.656 12.767 1.00 20.10 H new ATOM 0 HG SER A 290 -0.075 -21.231 11.270 1.00 73.14 H new ATOM 707 N ILE A 291 2.889 -21.801 13.044 1.00 22.02 N ATOM 708 CA ILE A 291 3.590 -21.257 14.195 1.00 34.33 C ATOM 709 C ILE A 291 2.807 -20.064 14.746 1.00 52.50 C ATOM 710 O ILE A 291 2.319 -19.231 13.983 1.00 72.41 O ATOM 711 CB ILE A 291 5.039 -20.928 13.834 1.00 24.21 C ATOM 712 CG1 ILE A 291 5.934 -22.160 13.982 1.00 65.45 C ATOM 713 CG2 ILE A 291 5.554 -19.744 14.656 1.00 70.45 C ATOM 714 CD1 ILE A 291 7.276 -21.951 13.276 1.00 31.31 C ATOM 0 H ILE A 291 3.022 -21.279 12.178 1.00 22.02 H new ATOM 0 HA ILE A 291 3.646 -21.998 14.992 1.00 34.33 H new ATOM 0 HB ILE A 291 5.071 -20.631 12.786 1.00 24.21 H new ATOM 0 HG12 ILE A 291 6.103 -22.366 15.039 1.00 65.45 H new ATOM 0 HG13 ILE A 291 5.431 -23.032 13.564 1.00 65.45 H new ATOM 0 HG21 ILE A 291 6.587 -19.531 14.380 1.00 70.45 H new ATOM 0 HG22 ILE A 291 4.937 -18.868 14.458 1.00 70.45 H new ATOM 0 HG23 ILE A 291 5.506 -19.989 15.717 1.00 70.45 H new ATOM 0 HD11 ILE A 291 7.893 -22.841 13.397 1.00 31.31 H new ATOM 0 HD12 ILE A 291 7.105 -21.769 12.215 1.00 31.31 H new ATOM 0 HD13 ILE A 291 7.787 -21.093 13.713 1.00 31.31 H new ATOM 726 N LYS A 292 2.711 -20.018 16.067 1.00 45.44 N ATOM 727 CA LYS A 292 1.996 -18.940 16.728 1.00 4.43 C ATOM 728 C LYS A 292 2.871 -17.685 16.740 1.00 43.55 C ATOM 729 O LYS A 292 3.907 -17.652 17.402 1.00 44.34 O ATOM 730 CB LYS A 292 1.533 -19.378 18.119 1.00 73.53 C ATOM 731 CG LYS A 292 0.636 -20.616 18.033 1.00 45.43 C ATOM 732 CD LYS A 292 -0.311 -20.524 16.835 1.00 62.23 C ATOM 733 CE LYS A 292 -1.510 -21.458 17.011 1.00 10.35 C ATOM 734 NZ LYS A 292 -1.188 -22.815 16.517 1.00 5.03 N ATOM 0 H LYS A 292 3.117 -20.710 16.697 1.00 45.44 H new ATOM 0 HA LYS A 292 1.088 -18.692 16.178 1.00 4.43 H new ATOM 0 HB2 LYS A 292 2.400 -19.595 18.743 1.00 73.53 H new ATOM 0 HB3 LYS A 292 0.990 -18.564 18.599 1.00 73.53 H new ATOM 0 HG2 LYS A 292 1.252 -21.511 17.946 1.00 45.43 H new ATOM 0 HG3 LYS A 292 0.058 -20.715 18.952 1.00 45.43 H new ATOM 0 HD2 LYS A 292 -0.659 -19.497 16.720 1.00 62.23 H new ATOM 0 HD3 LYS A 292 0.225 -20.783 15.922 1.00 62.23 H new ATOM 0 HE2 LYS A 292 -1.790 -21.505 18.063 1.00 10.35 H new ATOM 0 HE3 LYS A 292 -2.369 -21.062 16.470 1.00 10.35 H new ATOM 0 HZ1 LYS A 292 -2.013 -23.436 16.644 1.00 5.03 H new ATOM 0 HZ2 LYS A 292 -0.943 -22.768 15.507 1.00 5.03 H new ATOM 0 HZ3 LYS A 292 -0.382 -23.197 17.052 1.00 5.03 H new ATOM 747 N MET A 293 2.422 -16.682 15.999 1.00 61.23 N ATOM 748 CA MET A 293 3.151 -15.428 15.915 1.00 21.00 C ATOM 749 C MET A 293 2.800 -14.511 17.088 1.00 3.41 C ATOM 750 O MET A 293 1.818 -14.743 17.790 1.00 35.13 O ATOM 751 CB MET A 293 2.811 -14.726 14.599 1.00 71.54 C ATOM 752 CG MET A 293 3.131 -15.623 13.401 1.00 72.31 C ATOM 753 SD MET A 293 2.233 -15.064 11.963 1.00 64.32 S ATOM 754 CE MET A 293 3.092 -13.534 11.637 1.00 10.42 C ATOM 0 H MET A 293 1.562 -16.713 15.451 1.00 61.23 H new ATOM 0 HA MET A 293 4.218 -15.647 15.955 1.00 21.00 H new ATOM 0 HB2 MET A 293 1.754 -14.460 14.587 1.00 71.54 H new ATOM 0 HB3 MET A 293 3.374 -13.796 14.522 1.00 71.54 H new ATOM 0 HG2 MET A 293 4.202 -15.607 13.200 1.00 72.31 H new ATOM 0 HG3 MET A 293 2.865 -16.655 13.628 1.00 72.31 H new ATOM 0 HE1 MET A 293 2.728 -13.104 10.704 1.00 10.42 H new ATOM 0 HE2 MET A 293 2.912 -12.835 12.454 1.00 10.42 H new ATOM 0 HE3 MET A 293 4.161 -13.728 11.554 1.00 10.42 H new ATOM 764 N GLY A 294 3.623 -13.487 17.264 1.00 22.32 N ATOM 765 CA GLY A 294 3.412 -12.534 18.340 1.00 3.31 C ATOM 766 C GLY A 294 2.104 -11.766 18.144 1.00 55.14 C ATOM 767 O GLY A 294 1.656 -11.573 17.014 1.00 24.01 O ATOM 0 H GLY A 294 4.437 -13.297 16.679 1.00 22.32 H new ATOM 0 HA2 GLY A 294 3.390 -13.058 19.296 1.00 3.31 H new ATOM 0 HA3 GLY A 294 4.246 -11.834 18.379 1.00 3.31 H new ATOM 771 N PRO A 295 1.511 -11.337 19.290 1.00 32.42 N ATOM 772 CA PRO A 295 0.262 -10.595 19.255 1.00 43.10 C ATOM 773 C PRO A 295 0.494 -9.154 18.795 1.00 31.13 C ATOM 774 O PRO A 295 -0.375 -8.552 18.166 1.00 61.30 O ATOM 775 CB PRO A 295 -0.290 -10.686 20.668 1.00 24.13 C ATOM 776 CG PRO A 295 0.886 -11.075 21.550 1.00 12.45 C ATOM 777 CD PRO A 295 2.012 -11.547 20.645 1.00 34.54 C ATOM 0 HA PRO A 295 -0.450 -11.003 18.537 1.00 43.10 H new ATOM 0 HB2 PRO A 295 -0.716 -9.734 20.983 1.00 24.13 H new ATOM 0 HB3 PRO A 295 -1.086 -11.428 20.729 1.00 24.13 H new ATOM 0 HG2 PRO A 295 1.210 -10.225 22.151 1.00 12.45 H new ATOM 0 HG3 PRO A 295 0.598 -11.865 22.244 1.00 12.45 H new ATOM 0 HD2 PRO A 295 2.926 -10.980 20.822 1.00 34.54 H new ATOM 0 HD3 PRO A 295 2.249 -12.596 20.822 1.00 34.54 H new ATOM 785 N HIS A 296 1.670 -8.643 19.127 1.00 1.44 N ATOM 786 CA HIS A 296 2.027 -7.284 18.756 1.00 0.24 C ATOM 787 C HIS A 296 2.196 -7.194 17.238 1.00 2.04 C ATOM 788 O HIS A 296 2.694 -8.126 16.609 1.00 25.23 O ATOM 789 CB HIS A 296 3.269 -6.821 19.520 1.00 44.21 C ATOM 790 CG HIS A 296 3.565 -5.347 19.376 1.00 50.13 C ATOM 791 ND1 HIS A 296 4.334 -4.834 18.346 1.00 43.20 N ATOM 792 CD2 HIS A 296 3.186 -4.283 20.140 1.00 0.14 C ATOM 793 CE1 HIS A 296 4.409 -3.519 18.495 1.00 62.53 C ATOM 794 NE2 HIS A 296 3.697 -3.180 19.608 1.00 64.14 N ATOM 0 H HIS A 296 2.388 -9.145 19.649 1.00 1.44 H new ATOM 0 HA HIS A 296 1.224 -6.603 19.038 1.00 0.24 H new ATOM 0 HB2 HIS A 296 3.140 -7.054 20.577 1.00 44.21 H new ATOM 0 HB3 HIS A 296 4.131 -7.390 19.171 1.00 44.21 H new ATOM 0 HD1 HIS A 296 4.769 -5.376 17.599 1.00 43.20 H new ATOM 0 HD2 HIS A 296 2.573 -4.330 21.028 1.00 0.14 H new ATOM 0 HE1 HIS A 296 4.940 -2.836 17.849 1.00 62.53 H new ATOM 802 N GLU A 297 1.772 -6.063 16.694 1.00 73.21 N ATOM 803 CA GLU A 297 1.870 -5.839 15.262 1.00 71.24 C ATOM 804 C GLU A 297 3.337 -5.775 14.834 1.00 64.13 C ATOM 805 O GLU A 297 4.236 -5.895 15.665 1.00 31.11 O ATOM 806 CB GLU A 297 1.124 -4.568 14.853 1.00 14.41 C ATOM 807 CG GLU A 297 1.806 -3.323 15.425 1.00 65.53 C ATOM 808 CD GLU A 297 1.259 -2.987 16.813 1.00 2.23 C ATOM 809 OE1 GLU A 297 1.930 -3.245 17.824 1.00 61.45 O ATOM 810 OE2 GLU A 297 0.093 -2.436 16.821 1.00 52.23 O ATOM 0 H GLU A 297 1.360 -5.292 17.219 1.00 73.21 H new ATOM 0 HA GLU A 297 1.398 -6.678 14.750 1.00 71.24 H new ATOM 0 HB2 GLU A 297 1.085 -4.499 13.766 1.00 14.41 H new ATOM 0 HB3 GLU A 297 0.094 -4.617 15.206 1.00 14.41 H new ATOM 0 HG2 GLU A 297 2.882 -3.488 15.484 1.00 65.53 H new ATOM 0 HG3 GLU A 297 1.650 -2.478 14.754 1.00 65.53 H new ATOM 818 N ILE A 298 3.535 -5.586 13.537 1.00 10.13 N ATOM 819 CA ILE A 298 4.878 -5.504 12.989 1.00 22.40 C ATOM 820 C ILE A 298 5.194 -4.049 12.639 1.00 51.22 C ATOM 821 O ILE A 298 5.931 -3.379 13.360 1.00 1.13 O ATOM 822 CB ILE A 298 5.036 -6.468 11.811 1.00 34.34 C ATOM 823 CG1 ILE A 298 4.945 -7.923 12.278 1.00 51.25 C ATOM 824 CG2 ILE A 298 6.331 -6.192 11.046 1.00 51.54 C ATOM 825 CD1 ILE A 298 4.506 -8.839 11.133 1.00 14.15 C ATOM 0 H ILE A 298 2.787 -5.487 12.850 1.00 10.13 H new ATOM 0 HA ILE A 298 5.612 -5.820 13.731 1.00 22.40 H new ATOM 0 HB ILE A 298 4.211 -6.299 11.118 1.00 34.34 H new ATOM 0 HG12 ILE A 298 5.914 -8.248 12.658 1.00 51.25 H new ATOM 0 HG13 ILE A 298 4.237 -8.001 13.103 1.00 51.25 H new ATOM 0 HG21 ILE A 298 6.418 -6.891 10.214 1.00 51.54 H new ATOM 0 HG22 ILE A 298 6.317 -5.172 10.663 1.00 51.54 H new ATOM 0 HG23 ILE A 298 7.182 -6.316 11.715 1.00 51.54 H new ATOM 0 HD11 ILE A 298 4.449 -9.867 11.491 1.00 14.15 H new ATOM 0 HD12 ILE A 298 3.526 -8.526 10.772 1.00 14.15 H new ATOM 0 HD13 ILE A 298 5.229 -8.777 10.320 1.00 14.15 H new ATOM 837 N GLY A 299 4.620 -3.602 11.531 1.00 21.42 N ATOM 838 CA GLY A 299 4.831 -2.239 11.076 1.00 1.54 C ATOM 839 C GLY A 299 5.281 -2.211 9.614 1.00 30.43 C ATOM 840 O GLY A 299 5.935 -3.141 9.145 1.00 23.31 O ATOM 0 H GLY A 299 4.009 -4.161 10.935 1.00 21.42 H new ATOM 0 HA2 GLY A 299 3.909 -1.668 11.187 1.00 1.54 H new ATOM 0 HA3 GLY A 299 5.582 -1.756 11.701 1.00 1.54 H new ATOM 844 N ILE A 300 4.912 -1.135 8.935 1.00 62.42 N ATOM 845 CA ILE A 300 5.270 -0.975 7.536 1.00 53.04 C ATOM 846 C ILE A 300 6.752 -1.307 7.351 1.00 12.31 C ATOM 847 O ILE A 300 7.174 -1.694 6.263 1.00 61.23 O ATOM 848 CB ILE A 300 4.886 0.421 7.041 1.00 13.12 C ATOM 849 CG1 ILE A 300 3.394 0.494 6.708 1.00 21.21 C ATOM 850 CG2 ILE A 300 5.759 0.843 5.858 1.00 73.15 C ATOM 851 CD1 ILE A 300 3.071 1.761 5.913 1.00 30.33 C ATOM 0 H ILE A 300 4.369 -0.366 9.327 1.00 62.42 H new ATOM 0 HA ILE A 300 4.707 -1.674 6.917 1.00 53.04 H new ATOM 0 HB ILE A 300 5.071 1.132 7.847 1.00 13.12 H new ATOM 0 HG12 ILE A 300 3.103 -0.385 6.133 1.00 21.21 H new ATOM 0 HG13 ILE A 300 2.811 0.480 7.629 1.00 21.21 H new ATOM 0 HG21 ILE A 300 5.465 1.839 5.526 1.00 73.15 H new ATOM 0 HG22 ILE A 300 6.805 0.857 6.164 1.00 73.15 H new ATOM 0 HG23 ILE A 300 5.630 0.135 5.040 1.00 73.15 H new ATOM 0 HD11 ILE A 300 2.005 1.788 5.689 1.00 30.33 H new ATOM 0 HD12 ILE A 300 3.341 2.638 6.501 1.00 30.33 H new ATOM 0 HD13 ILE A 300 3.637 1.760 4.982 1.00 30.33 H new ATOM 863 N LYS A 301 7.501 -1.142 8.431 1.00 21.33 N ATOM 864 CA LYS A 301 8.927 -1.419 8.402 1.00 22.53 C ATOM 865 C LYS A 301 9.235 -2.587 9.343 1.00 52.44 C ATOM 866 O LYS A 301 10.082 -3.425 9.040 1.00 21.32 O ATOM 867 CB LYS A 301 9.726 -0.152 8.713 1.00 33.15 C ATOM 868 CG LYS A 301 9.608 0.863 7.575 1.00 45.31 C ATOM 869 CD LYS A 301 8.572 1.939 7.905 1.00 42.55 C ATOM 870 CE LYS A 301 9.251 3.237 8.347 1.00 1.13 C ATOM 871 NZ LYS A 301 8.286 4.359 8.330 1.00 0.02 N ATOM 0 H LYS A 301 7.147 -0.820 9.332 1.00 21.33 H new ATOM 0 HA LYS A 301 9.235 -1.725 7.402 1.00 22.53 H new ATOM 0 HB2 LYS A 301 9.364 0.292 9.640 1.00 33.15 H new ATOM 0 HB3 LYS A 301 10.774 -0.408 8.870 1.00 33.15 H new ATOM 0 HG2 LYS A 301 10.577 1.329 7.397 1.00 45.31 H new ATOM 0 HG3 LYS A 301 9.326 0.352 6.655 1.00 45.31 H new ATOM 0 HD2 LYS A 301 7.949 2.130 7.031 1.00 42.55 H new ATOM 0 HD3 LYS A 301 7.911 1.583 8.695 1.00 42.55 H new ATOM 0 HE2 LYS A 301 9.660 3.117 9.350 1.00 1.13 H new ATOM 0 HE3 LYS A 301 10.088 3.460 7.686 1.00 1.13 H new ATOM 0 HZ1 LYS A 301 8.763 5.232 8.633 1.00 0.02 H new ATOM 0 HZ2 LYS A 301 7.915 4.483 7.366 1.00 0.02 H new ATOM 0 HZ3 LYS A 301 7.500 4.151 8.979 1.00 0.02 H new ATOM 884 N GLY A 302 8.529 -2.603 10.464 1.00 5.10 N ATOM 885 CA GLY A 302 8.716 -3.653 11.451 1.00 65.35 C ATOM 886 C GLY A 302 8.883 -5.016 10.775 1.00 23.24 C ATOM 887 O GLY A 302 8.354 -5.243 9.688 1.00 22.45 O ATOM 0 H GLY A 302 7.827 -1.906 10.711 1.00 5.10 H new ATOM 0 HA2 GLY A 302 9.594 -3.434 12.058 1.00 65.35 H new ATOM 0 HA3 GLY A 302 7.860 -3.680 12.126 1.00 65.35 H new ATOM 891 N GLN A 303 9.621 -5.888 11.448 1.00 51.42 N ATOM 892 CA GLN A 303 9.864 -7.222 10.926 1.00 10.15 C ATOM 893 C GLN A 303 9.184 -8.269 11.810 1.00 35.23 C ATOM 894 O GLN A 303 8.505 -7.925 12.777 1.00 52.34 O ATOM 895 CB GLN A 303 11.364 -7.498 10.805 1.00 72.22 C ATOM 896 CG GLN A 303 11.968 -7.856 12.164 1.00 34.13 C ATOM 897 CD GLN A 303 13.495 -7.904 12.090 1.00 20.43 C ATOM 898 OE1 GLN A 303 14.119 -8.937 12.270 1.00 33.52 O ATOM 899 NE2 GLN A 303 14.061 -6.732 11.816 1.00 33.32 N ATOM 0 H GLN A 303 10.058 -5.696 12.349 1.00 51.42 H new ATOM 0 HA GLN A 303 9.434 -7.284 9.926 1.00 10.15 H new ATOM 0 HB2 GLN A 303 11.531 -8.314 10.102 1.00 72.22 H new ATOM 0 HB3 GLN A 303 11.867 -6.620 10.399 1.00 72.22 H new ATOM 0 HG2 GLN A 303 11.659 -7.122 12.908 1.00 34.13 H new ATOM 0 HG3 GLN A 303 11.586 -8.822 12.493 1.00 34.13 H new ATOM 0 HE21 GLN A 303 13.480 -5.905 11.676 1.00 33.32 H new ATOM 0 HE22 GLN A 303 15.076 -6.660 11.745 1.00 33.32 H new ATOM 908 N LYS A 304 9.389 -9.527 11.448 1.00 51.24 N ATOM 909 CA LYS A 304 8.804 -10.627 12.196 1.00 53.54 C ATOM 910 C LYS A 304 9.656 -11.882 11.999 1.00 3.25 C ATOM 911 O LYS A 304 10.189 -12.112 10.915 1.00 52.42 O ATOM 912 CB LYS A 304 7.335 -10.815 11.811 1.00 52.51 C ATOM 913 CG LYS A 304 6.651 -11.824 12.735 1.00 71.21 C ATOM 914 CD LYS A 304 6.310 -11.189 14.085 1.00 65.24 C ATOM 915 CE LYS A 304 5.115 -11.889 14.734 1.00 72.12 C ATOM 916 NZ LYS A 304 4.864 -11.340 16.085 1.00 31.01 N ATOM 0 H LYS A 304 9.952 -9.809 10.646 1.00 51.24 H new ATOM 0 HA LYS A 304 8.805 -10.405 13.263 1.00 53.54 H new ATOM 0 HB2 LYS A 304 6.816 -9.858 11.864 1.00 52.51 H new ATOM 0 HB3 LYS A 304 7.267 -11.158 10.779 1.00 52.51 H new ATOM 0 HG2 LYS A 304 5.741 -12.195 12.264 1.00 71.21 H new ATOM 0 HG3 LYS A 304 7.304 -12.683 12.888 1.00 71.21 H new ATOM 0 HD2 LYS A 304 7.174 -11.248 14.747 1.00 65.24 H new ATOM 0 HD3 LYS A 304 6.085 -10.131 13.947 1.00 65.24 H new ATOM 0 HE2 LYS A 304 4.229 -11.760 14.112 1.00 72.12 H new ATOM 0 HE3 LYS A 304 5.305 -12.960 14.800 1.00 72.12 H new ATOM 0 HZ1 LYS A 304 3.840 -11.314 16.264 1.00 31.01 H new ATOM 0 HZ2 LYS A 304 5.325 -11.943 16.796 1.00 31.01 H new ATOM 0 HZ3 LYS A 304 5.250 -10.376 16.145 1.00 31.01 H new ATOM 929 N GLU A 305 9.759 -12.661 13.066 1.00 21.00 N ATOM 930 CA GLU A 305 10.538 -13.887 13.025 1.00 71.12 C ATOM 931 C GLU A 305 9.626 -15.102 13.207 1.00 54.22 C ATOM 932 O GLU A 305 8.592 -15.013 13.868 1.00 50.24 O ATOM 933 CB GLU A 305 11.645 -13.869 14.081 1.00 34.41 C ATOM 934 CG GLU A 305 12.789 -12.944 13.661 1.00 35.13 C ATOM 935 CD GLU A 305 13.508 -12.372 14.885 1.00 52.15 C ATOM 936 OE1 GLU A 305 12.904 -11.618 15.662 1.00 20.13 O ATOM 937 OE2 GLU A 305 14.738 -12.737 15.014 1.00 62.11 O ATOM 0 H GLU A 305 9.316 -12.467 13.964 1.00 21.00 H new ATOM 0 HA GLU A 305 11.015 -13.959 12.048 1.00 71.12 H new ATOM 0 HB2 GLU A 305 11.236 -13.537 15.036 1.00 34.41 H new ATOM 0 HB3 GLU A 305 12.026 -14.879 14.231 1.00 34.41 H new ATOM 0 HG2 GLU A 305 13.498 -13.494 13.042 1.00 35.13 H new ATOM 0 HG3 GLU A 305 12.398 -12.130 13.051 1.00 35.13 H new ATOM 945 N LEU A 306 10.041 -16.209 12.609 1.00 40.31 N ATOM 946 CA LEU A 306 9.274 -17.440 12.697 1.00 41.23 C ATOM 947 C LEU A 306 10.233 -18.623 12.841 1.00 73.53 C ATOM 948 O LEU A 306 10.276 -19.500 11.979 1.00 62.11 O ATOM 949 CB LEU A 306 8.320 -17.562 11.507 1.00 33.52 C ATOM 950 CG LEU A 306 7.132 -16.598 11.498 1.00 34.43 C ATOM 951 CD1 LEU A 306 6.393 -16.651 10.160 1.00 71.14 C ATOM 952 CD2 LEU A 306 6.197 -16.869 12.679 1.00 4.45 C ATOM 0 H LEU A 306 10.899 -16.279 12.061 1.00 40.31 H new ATOM 0 HA LEU A 306 8.641 -17.433 13.584 1.00 41.23 H new ATOM 0 HB2 LEU A 306 8.892 -17.411 10.591 1.00 33.52 H new ATOM 0 HB3 LEU A 306 7.935 -18.581 11.478 1.00 33.52 H new ATOM 0 HG LEU A 306 7.515 -15.584 11.615 1.00 34.43 H new ATOM 0 HD11 LEU A 306 5.553 -15.956 10.180 1.00 71.14 H new ATOM 0 HD12 LEU A 306 7.075 -16.372 9.356 1.00 71.14 H new ATOM 0 HD13 LEU A 306 6.024 -17.662 9.988 1.00 71.14 H new ATOM 0 HD21 LEU A 306 5.361 -16.170 12.649 1.00 4.45 H new ATOM 0 HD22 LEU A 306 5.819 -17.890 12.617 1.00 4.45 H new ATOM 0 HD23 LEU A 306 6.744 -16.741 13.613 1.00 4.45 H new ATOM 964 N TRP A 307 10.977 -18.611 13.936 1.00 4.25 N ATOM 965 CA TRP A 307 11.933 -19.672 14.204 1.00 33.55 C ATOM 966 C TRP A 307 11.165 -20.995 14.264 1.00 4.23 C ATOM 967 O TRP A 307 10.110 -21.077 14.891 1.00 5.25 O ATOM 968 CB TRP A 307 12.729 -19.385 15.479 1.00 15.10 C ATOM 969 CG TRP A 307 13.044 -17.903 15.695 1.00 32.40 C ATOM 970 CD1 TRP A 307 14.140 -17.230 15.321 1.00 62.14 C ATOM 971 CD2 TRP A 307 12.204 -16.933 16.355 1.00 12.01 C ATOM 972 NE1 TRP A 307 14.069 -15.902 15.690 1.00 71.14 N ATOM 973 CE2 TRP A 307 12.854 -15.716 16.339 1.00 52.25 C ATOM 974 CE3 TRP A 307 10.937 -17.079 16.946 1.00 14.14 C ATOM 975 CZ2 TRP A 307 12.315 -14.551 16.898 1.00 32.22 C ATOM 976 CZ3 TRP A 307 10.412 -15.906 17.501 1.00 14.44 C ATOM 977 CH2 TRP A 307 11.053 -14.673 17.493 1.00 4.31 C ATOM 0 H TRP A 307 10.937 -17.883 14.649 1.00 4.25 H new ATOM 0 HA TRP A 307 12.674 -19.734 13.407 1.00 33.55 H new ATOM 0 HB2 TRP A 307 12.168 -19.755 16.337 1.00 15.10 H new ATOM 0 HB3 TRP A 307 13.664 -19.944 15.445 1.00 15.10 H new ATOM 0 HD1 TRP A 307 14.975 -17.671 14.796 1.00 62.14 H new ATOM 0 HE1 TRP A 307 14.777 -15.189 15.518 1.00 71.14 H new ATOM 0 HE3 TRP A 307 10.410 -18.022 16.970 1.00 14.14 H new ATOM 0 HZ2 TRP A 307 12.844 -13.610 16.872 1.00 32.22 H new ATOM 0 HZ3 TRP A 307 9.440 -15.963 17.968 1.00 14.44 H new ATOM 0 HH2 TRP A 307 10.580 -13.813 17.944 1.00 4.31 H new ATOM 988 N PHE A 308 11.725 -21.997 13.603 1.00 22.31 N ATOM 989 CA PHE A 308 11.107 -23.312 13.573 1.00 11.12 C ATOM 990 C PHE A 308 12.152 -24.414 13.761 1.00 52.31 C ATOM 991 O PHE A 308 13.329 -24.215 13.463 1.00 74.40 O ATOM 992 CB PHE A 308 10.458 -23.470 12.197 1.00 43.24 C ATOM 993 CG PHE A 308 10.114 -24.916 11.833 1.00 42.30 C ATOM 994 CD1 PHE A 308 11.056 -25.717 11.266 1.00 13.21 C ATOM 995 CD2 PHE A 308 8.867 -25.400 12.077 1.00 52.33 C ATOM 996 CE1 PHE A 308 10.736 -27.059 10.929 1.00 44.32 C ATOM 997 CE2 PHE A 308 8.548 -26.742 11.739 1.00 15.53 C ATOM 998 CZ PHE A 308 9.489 -27.543 11.173 1.00 50.35 C ATOM 0 H PHE A 308 12.600 -21.925 13.084 1.00 22.31 H new ATOM 0 HA PHE A 308 10.378 -23.399 14.379 1.00 11.12 H new ATOM 0 HB2 PHE A 308 9.547 -22.872 12.165 1.00 43.24 H new ATOM 0 HB3 PHE A 308 11.131 -23.066 11.441 1.00 43.24 H new ATOM 0 HD1 PHE A 308 12.047 -25.333 11.072 1.00 13.21 H new ATOM 0 HD2 PHE A 308 8.119 -24.764 12.528 1.00 52.33 H new ATOM 0 HE1 PHE A 308 11.483 -27.695 10.479 1.00 44.32 H new ATOM 0 HE2 PHE A 308 7.557 -27.126 11.932 1.00 15.53 H new ATOM 0 HZ PHE A 308 9.246 -28.564 10.917 1.00 50.35 H new ATOM 1008 N PHE A 309 11.684 -25.551 14.254 1.00 51.01 N ATOM 1009 CA PHE A 309 12.563 -26.684 14.485 1.00 62.51 C ATOM 1010 C PHE A 309 11.924 -27.984 13.991 1.00 12.04 C ATOM 1011 O PHE A 309 10.705 -28.138 14.042 1.00 34.52 O ATOM 1012 CB PHE A 309 12.783 -26.780 15.996 1.00 14.30 C ATOM 1013 CG PHE A 309 11.616 -26.245 16.829 1.00 32.20 C ATOM 1014 CD1 PHE A 309 11.292 -24.925 16.778 1.00 62.31 C ATOM 1015 CD2 PHE A 309 10.902 -27.090 17.621 1.00 61.14 C ATOM 1016 CE1 PHE A 309 10.209 -24.429 17.551 1.00 62.20 C ATOM 1017 CE2 PHE A 309 9.819 -26.594 18.394 1.00 63.14 C ATOM 1018 CZ PHE A 309 9.496 -25.274 18.343 1.00 74.25 C ATOM 0 H PHE A 309 10.707 -25.712 14.500 1.00 51.01 H new ATOM 0 HA PHE A 309 13.500 -26.543 13.946 1.00 62.51 H new ATOM 0 HB2 PHE A 309 12.958 -27.822 16.262 1.00 14.30 H new ATOM 0 HB3 PHE A 309 13.686 -26.228 16.257 1.00 14.30 H new ATOM 0 HD1 PHE A 309 11.859 -24.254 16.149 1.00 62.31 H new ATOM 0 HD2 PHE A 309 11.159 -28.138 17.662 1.00 61.14 H new ATOM 0 HE1 PHE A 309 9.952 -23.381 17.510 1.00 62.20 H new ATOM 0 HE2 PHE A 309 9.252 -27.265 19.022 1.00 63.14 H new ATOM 0 HZ PHE A 309 8.673 -24.897 18.932 1.00 74.25 H new ATOM 1028 N PRO A 310 12.798 -28.909 13.513 1.00 62.22 N ATOM 1029 CA PRO A 310 14.227 -28.646 13.488 1.00 31.32 C ATOM 1030 C PRO A 310 14.586 -27.674 12.363 1.00 43.10 C ATOM 1031 O PRO A 310 15.225 -26.650 12.603 1.00 60.34 O ATOM 1032 CB PRO A 310 14.875 -30.011 13.324 1.00 63.24 C ATOM 1033 CG PRO A 310 13.785 -30.930 12.797 1.00 13.12 C ATOM 1034 CD PRO A 310 12.451 -30.225 12.984 1.00 21.23 C ATOM 0 HA PRO A 310 14.581 -28.158 14.396 1.00 31.32 H new ATOM 0 HB2 PRO A 310 15.715 -29.964 12.631 1.00 63.24 H new ATOM 0 HB3 PRO A 310 15.266 -30.374 14.274 1.00 63.24 H new ATOM 0 HG2 PRO A 310 13.953 -31.157 11.744 1.00 13.12 H new ATOM 0 HG3 PRO A 310 13.794 -31.879 13.333 1.00 13.12 H new ATOM 0 HD2 PRO A 310 11.911 -30.143 12.041 1.00 21.23 H new ATOM 0 HD3 PRO A 310 11.807 -30.772 13.673 1.00 21.23 H new ATOM 1042 N SER A 311 14.160 -28.028 11.160 1.00 62.15 N ATOM 1043 CA SER A 311 14.429 -27.199 9.997 1.00 71.44 C ATOM 1044 C SER A 311 13.860 -27.861 8.740 1.00 64.33 C ATOM 1045 O SER A 311 13.363 -28.985 8.796 1.00 12.24 O ATOM 1046 CB SER A 311 15.929 -26.950 9.833 1.00 65.23 C ATOM 1047 OG SER A 311 16.694 -28.132 10.053 1.00 22.35 O ATOM 0 H SER A 311 13.630 -28.878 10.965 1.00 62.15 H new ATOM 0 HA SER A 311 13.942 -26.235 10.144 1.00 71.44 H new ATOM 0 HB2 SER A 311 16.126 -26.572 8.830 1.00 65.23 H new ATOM 0 HB3 SER A 311 16.247 -26.177 10.533 1.00 65.23 H new ATOM 0 HG SER A 311 17.646 -27.932 9.937 1.00 22.35 H new ATOM 1053 N LEU A 312 13.953 -27.137 7.634 1.00 4.35 N ATOM 1054 CA LEU A 312 13.455 -27.639 6.366 1.00 74.53 C ATOM 1055 C LEU A 312 14.444 -27.281 5.255 1.00 3.24 C ATOM 1056 O LEU A 312 15.242 -26.356 5.404 1.00 34.24 O ATOM 1057 CB LEU A 312 12.034 -27.133 6.110 1.00 34.11 C ATOM 1058 CG LEU A 312 10.976 -27.561 7.129 1.00 34.40 C ATOM 1059 CD1 LEU A 312 10.670 -26.429 8.111 1.00 51.31 C ATOM 1060 CD2 LEU A 312 9.714 -28.069 6.429 1.00 55.14 C ATOM 0 H LEU A 312 14.367 -26.206 7.591 1.00 4.35 H new ATOM 0 HA LEU A 312 13.383 -28.726 6.390 1.00 74.53 H new ATOM 0 HB2 LEU A 312 12.058 -26.044 6.077 1.00 34.11 H new ATOM 0 HB3 LEU A 312 11.720 -27.475 5.124 1.00 34.11 H new ATOM 0 HG LEU A 312 11.378 -28.391 7.710 1.00 34.40 H new ATOM 0 HD11 LEU A 312 9.915 -26.760 8.824 1.00 51.31 H new ATOM 0 HD12 LEU A 312 11.579 -26.156 8.646 1.00 51.31 H new ATOM 0 HD13 LEU A 312 10.297 -25.563 7.564 1.00 51.31 H new ATOM 0 HD21 LEU A 312 8.978 -28.367 7.176 1.00 55.14 H new ATOM 0 HD22 LEU A 312 9.299 -27.276 5.807 1.00 55.14 H new ATOM 0 HD23 LEU A 312 9.964 -28.927 5.805 1.00 55.14 H new ATOM 1072 N PRO A 313 14.358 -28.051 4.138 1.00 24.40 N ATOM 1073 CA PRO A 313 15.237 -27.824 3.003 1.00 33.30 C ATOM 1074 C PRO A 313 14.811 -26.581 2.220 1.00 14.42 C ATOM 1075 O PRO A 313 13.621 -26.288 2.113 1.00 52.15 O ATOM 1076 CB PRO A 313 15.155 -29.100 2.181 1.00 24.32 C ATOM 1077 CG PRO A 313 13.888 -29.807 2.633 1.00 31.23 C ATOM 1078 CD PRO A 313 13.426 -29.155 3.926 1.00 24.03 C ATOM 0 HA PRO A 313 16.266 -27.623 3.301 1.00 33.30 H new ATOM 0 HB2 PRO A 313 15.118 -28.876 1.115 1.00 24.32 H new ATOM 0 HB3 PRO A 313 16.032 -29.727 2.345 1.00 24.32 H new ATOM 0 HG2 PRO A 313 13.114 -29.730 1.869 1.00 31.23 H new ATOM 0 HG3 PRO A 313 14.078 -30.869 2.788 1.00 31.23 H new ATOM 0 HD2 PRO A 313 12.400 -28.797 3.844 1.00 24.03 H new ATOM 0 HD3 PRO A 313 13.452 -29.860 4.757 1.00 24.03 H new ATOM 1086 N THR A 314 15.806 -25.882 1.694 1.00 71.44 N ATOM 1087 CA THR A 314 15.549 -24.677 0.924 1.00 61.13 C ATOM 1088 C THR A 314 16.153 -24.800 -0.477 1.00 32.23 C ATOM 1089 O THR A 314 17.010 -25.649 -0.715 1.00 25.25 O ATOM 1090 CB THR A 314 16.090 -23.486 1.716 1.00 5.42 C ATOM 1091 OG1 THR A 314 17.153 -24.037 2.489 1.00 11.24 O ATOM 1092 CG2 THR A 314 15.095 -22.976 2.760 1.00 1.04 C ATOM 0 H THR A 314 16.792 -26.127 1.786 1.00 71.44 H new ATOM 0 HA THR A 314 14.480 -24.526 0.771 1.00 61.13 H new ATOM 0 HB THR A 314 16.341 -22.678 1.029 1.00 5.42 H new ATOM 0 HG1 THR A 314 17.662 -23.312 2.908 1.00 11.24 H new ATOM 0 HG21 THR A 314 15.529 -22.130 3.294 1.00 1.04 H new ATOM 0 HG22 THR A 314 14.177 -22.660 2.264 1.00 1.04 H new ATOM 0 HG23 THR A 314 14.869 -23.774 3.467 1.00 1.04 H new ATOM 1100 N PRO A 315 15.669 -23.917 -1.391 1.00 34.31 N ATOM 1101 CA PRO A 315 14.653 -22.944 -1.027 1.00 22.05 C ATOM 1102 C PRO A 315 13.281 -23.608 -0.890 1.00 5.24 C ATOM 1103 O PRO A 315 13.164 -24.827 -1.000 1.00 22.24 O ATOM 1104 CB PRO A 315 14.699 -21.897 -2.127 1.00 42.31 C ATOM 1105 CG PRO A 315 15.406 -22.556 -3.300 1.00 42.33 C ATOM 1106 CD PRO A 315 16.073 -23.823 -2.790 1.00 44.34 C ATOM 0 HA PRO A 315 14.837 -22.488 -0.054 1.00 22.05 H new ATOM 0 HB2 PRO A 315 13.694 -21.579 -2.405 1.00 42.31 H new ATOM 0 HB3 PRO A 315 15.236 -21.007 -1.797 1.00 42.31 H new ATOM 0 HG2 PRO A 315 14.694 -22.791 -4.091 1.00 42.33 H new ATOM 0 HG3 PRO A 315 16.147 -21.880 -3.728 1.00 42.33 H new ATOM 0 HD2 PRO A 315 15.748 -24.697 -3.355 1.00 44.34 H new ATOM 0 HD3 PRO A 315 17.157 -23.766 -2.886 1.00 44.34 H new ATOM 1114 N LEU A 316 12.278 -22.776 -0.652 1.00 2.23 N ATOM 1115 CA LEU A 316 10.919 -23.267 -0.499 1.00 1.42 C ATOM 1116 C LEU A 316 10.088 -22.840 -1.711 1.00 21.24 C ATOM 1117 O LEU A 316 9.070 -22.165 -1.563 1.00 63.43 O ATOM 1118 CB LEU A 316 10.333 -22.813 0.840 1.00 51.45 C ATOM 1119 CG LEU A 316 11.088 -23.266 2.091 1.00 50.42 C ATOM 1120 CD1 LEU A 316 11.258 -22.109 3.077 1.00 4.32 C ATOM 1121 CD2 LEU A 316 10.405 -24.473 2.736 1.00 21.21 C ATOM 0 H LEU A 316 12.379 -21.765 -0.561 1.00 2.23 H new ATOM 0 HA LEU A 316 10.908 -24.357 -0.472 1.00 1.42 H new ATOM 0 HB2 LEU A 316 10.286 -21.724 0.843 1.00 51.45 H new ATOM 0 HB3 LEU A 316 9.308 -23.177 0.907 1.00 51.45 H new ATOM 0 HG LEU A 316 12.087 -23.583 1.792 1.00 50.42 H new ATOM 0 HD11 LEU A 316 11.798 -22.458 3.957 1.00 4.32 H new ATOM 0 HD12 LEU A 316 11.820 -21.305 2.601 1.00 4.32 H new ATOM 0 HD13 LEU A 316 10.277 -21.738 3.376 1.00 4.32 H new ATOM 0 HD21 LEU A 316 10.962 -24.775 3.623 1.00 21.21 H new ATOM 0 HD22 LEU A 316 9.387 -24.206 3.020 1.00 21.21 H new ATOM 0 HD23 LEU A 316 10.379 -25.299 2.025 1.00 21.21 H new ATOM 1133 N SER A 317 10.553 -23.251 -2.881 1.00 70.51 N ATOM 1134 CA SER A 317 9.865 -22.920 -4.118 1.00 24.44 C ATOM 1135 C SER A 317 8.759 -23.942 -4.391 1.00 4.21 C ATOM 1136 O SER A 317 8.975 -25.146 -4.260 1.00 42.33 O ATOM 1137 CB SER A 317 10.842 -22.868 -5.294 1.00 22.20 C ATOM 1138 OG SER A 317 10.971 -24.133 -5.938 1.00 31.25 O ATOM 0 H SER A 317 11.398 -23.810 -2.999 1.00 70.51 H new ATOM 0 HA SER A 317 9.418 -21.932 -4.008 1.00 24.44 H new ATOM 0 HB2 SER A 317 10.500 -22.127 -6.016 1.00 22.20 H new ATOM 0 HB3 SER A 317 11.819 -22.541 -4.939 1.00 22.20 H new ATOM 0 HG SER A 317 11.602 -24.057 -6.684 1.00 31.25 H new ATOM 1144 N ASN A 318 7.599 -23.424 -4.765 1.00 50.44 N ATOM 1145 CA ASN A 318 6.459 -24.275 -5.058 1.00 73.43 C ATOM 1146 C ASN A 318 5.747 -24.635 -3.752 1.00 45.02 C ATOM 1147 O ASN A 318 4.777 -25.391 -3.757 1.00 64.24 O ATOM 1148 CB ASN A 318 6.902 -25.577 -5.729 1.00 54.03 C ATOM 1149 CG ASN A 318 5.775 -26.165 -6.582 1.00 24.11 C ATOM 1150 OD1 ASN A 318 5.122 -25.480 -7.352 1.00 24.20 O ATOM 1151 ND2 ASN A 318 5.585 -27.469 -6.402 1.00 43.01 N ATOM 0 H ASN A 318 7.424 -22.425 -4.872 1.00 50.44 H new ATOM 0 HA ASN A 318 5.796 -23.730 -5.730 1.00 73.43 H new ATOM 0 HB2 ASN A 318 7.776 -25.390 -6.353 1.00 54.03 H new ATOM 0 HB3 ASN A 318 7.202 -26.298 -4.969 1.00 54.03 H new ATOM 0 HD21 ASN A 318 4.857 -27.955 -6.925 1.00 43.01 H new ATOM 0 HD22 ASN A 318 6.168 -27.983 -5.741 1.00 43.01 H new ATOM 1158 N TYR A 319 6.257 -24.076 -2.665 1.00 25.03 N ATOM 1159 CA TYR A 319 5.683 -24.328 -1.354 1.00 22.30 C ATOM 1160 C TYR A 319 4.454 -23.449 -1.115 1.00 43.42 C ATOM 1161 O TYR A 319 4.058 -22.679 -1.989 1.00 43.20 O ATOM 1162 CB TYR A 319 6.767 -23.956 -0.340 1.00 72.11 C ATOM 1163 CG TYR A 319 7.794 -25.063 -0.093 1.00 11.33 C ATOM 1164 CD1 TYR A 319 8.560 -25.539 -1.137 1.00 3.11 C ATOM 1165 CD2 TYR A 319 7.954 -25.585 1.175 1.00 41.31 C ATOM 1166 CE1 TYR A 319 9.527 -26.580 -0.904 1.00 70.50 C ATOM 1167 CE2 TYR A 319 8.921 -26.626 1.408 1.00 72.32 C ATOM 1168 CZ TYR A 319 9.660 -27.073 0.357 1.00 55.22 C ATOM 1169 OH TYR A 319 10.573 -28.056 0.577 1.00 75.42 O ATOM 0 H TYR A 319 7.062 -23.449 -2.665 1.00 25.03 H new ATOM 0 HA TYR A 319 5.368 -25.368 -1.267 1.00 22.30 H new ATOM 0 HB2 TYR A 319 7.287 -23.064 -0.690 1.00 72.11 H new ATOM 0 HB3 TYR A 319 6.292 -23.698 0.606 1.00 72.11 H new ATOM 0 HD1 TYR A 319 8.434 -25.131 -2.129 1.00 3.11 H new ATOM 0 HD2 TYR A 319 7.354 -25.213 1.992 1.00 41.31 H new ATOM 0 HE1 TYR A 319 10.133 -26.961 -1.712 1.00 70.50 H new ATOM 0 HE2 TYR A 319 9.057 -27.043 2.395 1.00 72.32 H new ATOM 0 HH TYR A 319 10.451 -28.419 1.479 1.00 75.42 H new ATOM 1179 N THR A 320 3.885 -23.592 0.073 1.00 61.25 N ATOM 1180 CA THR A 320 2.709 -22.820 0.437 1.00 23.32 C ATOM 1181 C THR A 320 3.110 -21.596 1.263 1.00 61.13 C ATOM 1182 O THR A 320 2.822 -20.463 0.880 1.00 71.32 O ATOM 1183 CB THR A 320 1.739 -23.753 1.165 1.00 53.51 C ATOM 1184 OG1 THR A 320 0.988 -24.359 0.116 1.00 12.24 O ATOM 1185 CG2 THR A 320 0.692 -22.989 1.979 1.00 43.31 C ATOM 0 H THR A 320 4.216 -24.231 0.796 1.00 61.25 H new ATOM 0 HA THR A 320 2.204 -22.427 -0.445 1.00 23.32 H new ATOM 0 HB THR A 320 2.299 -24.416 1.824 1.00 53.51 H new ATOM 0 HG1 THR A 320 0.335 -24.982 0.499 1.00 12.24 H new ATOM 0 HG21 THR A 320 0.029 -23.698 2.475 1.00 43.31 H new ATOM 0 HG22 THR A 320 1.191 -22.373 2.727 1.00 43.31 H new ATOM 0 HG23 THR A 320 0.109 -22.351 1.315 1.00 43.31 H new ATOM 1193 N MET A 321 3.769 -21.866 2.380 1.00 14.43 N ATOM 1194 CA MET A 321 4.212 -20.800 3.263 1.00 20.22 C ATOM 1195 C MET A 321 3.290 -19.584 3.161 1.00 52.43 C ATOM 1196 O MET A 321 3.713 -18.515 2.724 1.00 52.44 O ATOM 1197 CB MET A 321 5.639 -20.392 2.894 1.00 44.53 C ATOM 1198 CG MET A 321 6.496 -21.619 2.577 1.00 43.24 C ATOM 1199 SD MET A 321 8.104 -21.453 3.333 1.00 4.42 S ATOM 1200 CE MET A 321 8.751 -20.083 2.388 1.00 24.42 C ATOM 0 H MET A 321 4.007 -22.807 2.694 1.00 14.43 H new ATOM 0 HA MET A 321 4.184 -21.168 4.289 1.00 20.22 H new ATOM 0 HB2 MET A 321 5.619 -19.726 2.032 1.00 44.53 H new ATOM 0 HB3 MET A 321 6.086 -19.835 3.717 1.00 44.53 H new ATOM 0 HG2 MET A 321 6.004 -22.520 2.943 1.00 43.24 H new ATOM 0 HG3 MET A 321 6.602 -21.730 1.498 1.00 43.24 H new ATOM 0 HE1 MET A 321 9.559 -19.607 2.943 1.00 24.42 H new ATOM 0 HE2 MET A 321 9.132 -20.447 1.434 1.00 24.42 H new ATOM 0 HE3 MET A 321 7.958 -19.357 2.209 1.00 24.42 H new ATOM 1210 N LYS A 322 2.047 -19.787 3.571 1.00 34.30 N ATOM 1211 CA LYS A 322 1.061 -18.720 3.531 1.00 71.42 C ATOM 1212 C LYS A 322 1.047 -17.994 4.877 1.00 33.14 C ATOM 1213 O LYS A 322 1.889 -18.254 5.736 1.00 54.13 O ATOM 1214 CB LYS A 322 -0.305 -19.268 3.113 1.00 32.53 C ATOM 1215 CG LYS A 322 -0.274 -19.779 1.671 1.00 25.33 C ATOM 1216 CD LYS A 322 -1.667 -20.215 1.213 1.00 22.45 C ATOM 1217 CE LYS A 322 -1.601 -20.928 -0.139 1.00 33.33 C ATOM 1218 NZ LYS A 322 -1.780 -19.960 -1.244 1.00 64.30 N ATOM 0 H LYS A 322 1.700 -20.675 3.933 1.00 34.30 H new ATOM 0 HA LYS A 322 1.328 -17.983 2.774 1.00 71.42 H new ATOM 0 HB2 LYS A 322 -0.597 -20.077 3.783 1.00 32.53 H new ATOM 0 HB3 LYS A 322 -1.059 -18.487 3.209 1.00 32.53 H new ATOM 0 HG2 LYS A 322 0.101 -18.996 1.012 1.00 25.33 H new ATOM 0 HG3 LYS A 322 0.417 -20.618 1.594 1.00 25.33 H new ATOM 0 HD2 LYS A 322 -2.107 -20.879 1.957 1.00 22.45 H new ATOM 0 HD3 LYS A 322 -2.318 -19.344 1.138 1.00 22.45 H new ATOM 0 HE2 LYS A 322 -0.642 -21.435 -0.243 1.00 33.33 H new ATOM 0 HE3 LYS A 322 -2.374 -21.695 -0.191 1.00 33.33 H new ATOM 0 HZ1 LYS A 322 -2.167 -20.450 -2.076 1.00 64.30 H new ATOM 0 HZ2 LYS A 322 -2.438 -19.211 -0.947 1.00 64.30 H new ATOM 0 HZ3 LYS A 322 -0.862 -19.537 -1.487 1.00 64.30 H new ATOM 1231 N VAL A 323 0.081 -17.098 5.020 1.00 21.32 N ATOM 1232 CA VAL A 323 -0.054 -16.333 6.248 1.00 42.42 C ATOM 1233 C VAL A 323 -1.538 -16.161 6.576 1.00 33.33 C ATOM 1234 O VAL A 323 -2.326 -15.765 5.719 1.00 61.05 O ATOM 1235 CB VAL A 323 0.687 -15.000 6.118 1.00 63.43 C ATOM 1236 CG1 VAL A 323 0.652 -14.223 7.435 1.00 42.42 C ATOM 1237 CG2 VAL A 323 2.127 -15.218 5.647 1.00 11.52 C ATOM 0 H VAL A 323 -0.615 -16.885 4.306 1.00 21.32 H new ATOM 0 HA VAL A 323 0.404 -16.865 7.082 1.00 42.42 H new ATOM 0 HB VAL A 323 0.174 -14.403 5.364 1.00 63.43 H new ATOM 0 HG11 VAL A 323 1.185 -13.280 7.315 1.00 42.42 H new ATOM 0 HG12 VAL A 323 -0.383 -14.022 7.711 1.00 42.42 H new ATOM 0 HG13 VAL A 323 1.129 -14.813 8.218 1.00 42.42 H new ATOM 0 HG21 VAL A 323 2.632 -14.256 5.563 1.00 11.52 H new ATOM 0 HG22 VAL A 323 2.655 -15.843 6.368 1.00 11.52 H new ATOM 0 HG23 VAL A 323 2.121 -15.711 4.675 1.00 11.52 H new ATOM 1247 N VAL A 324 -1.876 -16.468 7.820 1.00 25.42 N ATOM 1248 CA VAL A 324 -3.252 -16.353 8.273 1.00 64.33 C ATOM 1249 C VAL A 324 -3.366 -15.181 9.249 1.00 34.23 C ATOM 1250 O VAL A 324 -2.366 -14.552 9.590 1.00 22.10 O ATOM 1251 CB VAL A 324 -3.717 -17.681 8.874 1.00 12.24 C ATOM 1252 CG1 VAL A 324 -3.986 -18.715 7.779 1.00 3.14 C ATOM 1253 CG2 VAL A 324 -2.702 -18.208 9.890 1.00 21.41 C ATOM 0 H VAL A 324 -1.220 -16.796 8.529 1.00 25.42 H new ATOM 0 HA VAL A 324 -3.915 -16.142 7.434 1.00 64.33 H new ATOM 0 HB VAL A 324 -4.654 -17.501 9.400 1.00 12.24 H new ATOM 0 HG11 VAL A 324 -4.315 -19.649 8.234 1.00 3.14 H new ATOM 0 HG12 VAL A 324 -4.763 -18.343 7.111 1.00 3.14 H new ATOM 0 HG13 VAL A 324 -3.072 -18.890 7.211 1.00 3.14 H new ATOM 0 HG21 VAL A 324 -3.057 -19.153 10.302 1.00 21.41 H new ATOM 0 HG22 VAL A 324 -1.742 -18.364 9.398 1.00 21.41 H new ATOM 0 HG23 VAL A 324 -2.583 -17.483 10.695 1.00 21.41 H new ATOM 1263 N ASN A 325 -4.595 -14.923 9.672 1.00 32.23 N ATOM 1264 CA ASN A 325 -4.854 -13.838 10.603 1.00 2.30 C ATOM 1265 C ASN A 325 -5.026 -14.410 12.012 1.00 51.34 C ATOM 1266 O ASN A 325 -4.683 -15.564 12.263 1.00 54.00 O ATOM 1267 CB ASN A 325 -6.138 -13.091 10.236 1.00 62.34 C ATOM 1268 CG ASN A 325 -5.969 -11.583 10.428 1.00 52.22 C ATOM 1269 OD1 ASN A 325 -5.130 -10.943 9.815 1.00 12.24 O ATOM 1270 ND2 ASN A 325 -6.811 -11.053 11.310 1.00 11.43 N ATOM 0 H ASN A 325 -5.422 -15.447 9.387 1.00 32.23 H new ATOM 0 HA ASN A 325 -4.011 -13.149 10.559 1.00 2.30 H new ATOM 0 HB2 ASN A 325 -6.402 -13.302 9.200 1.00 62.34 H new ATOM 0 HB3 ASN A 325 -6.961 -13.450 10.854 1.00 62.34 H new ATOM 0 HD21 ASN A 325 -6.779 -10.053 11.509 1.00 11.43 H new ATOM 0 HD22 ASN A 325 -7.489 -11.646 11.788 1.00 11.43 H new ATOM 1277 N GLN A 326 -5.557 -13.576 12.894 1.00 51.45 N ATOM 1278 CA GLN A 326 -5.779 -13.984 14.270 1.00 10.23 C ATOM 1279 C GLN A 326 -6.910 -15.012 14.343 1.00 0.35 C ATOM 1280 O GLN A 326 -7.158 -15.593 15.399 1.00 53.51 O ATOM 1281 CB GLN A 326 -6.078 -12.775 15.159 1.00 34.01 C ATOM 1282 CG GLN A 326 -7.358 -12.067 14.709 1.00 32.34 C ATOM 1283 CD GLN A 326 -8.012 -11.324 15.876 1.00 53.33 C ATOM 1284 OE1 GLN A 326 -9.214 -11.375 16.083 1.00 44.23 O ATOM 1285 NE2 GLN A 326 -7.157 -10.632 16.624 1.00 54.13 N ATOM 0 H GLN A 326 -5.840 -12.619 12.682 1.00 51.45 H new ATOM 0 HA GLN A 326 -4.867 -14.450 14.642 1.00 10.23 H new ATOM 0 HB2 GLN A 326 -6.182 -13.098 16.195 1.00 34.01 H new ATOM 0 HB3 GLN A 326 -5.241 -12.078 15.124 1.00 34.01 H new ATOM 0 HG2 GLN A 326 -7.127 -11.364 13.909 1.00 32.34 H new ATOM 0 HG3 GLN A 326 -8.057 -12.797 14.300 1.00 32.34 H new ATOM 0 HE21 GLN A 326 -6.163 -10.632 16.395 1.00 54.13 H new ATOM 0 HE22 GLN A 326 -7.495 -10.101 17.427 1.00 54.13 H new ATOM 1294 N ASP A 327 -7.565 -15.205 13.208 1.00 13.03 N ATOM 1295 CA ASP A 327 -8.664 -16.153 13.130 1.00 10.45 C ATOM 1296 C ASP A 327 -8.217 -17.381 12.335 1.00 0.04 C ATOM 1297 O ASP A 327 -9.043 -18.199 11.934 1.00 61.14 O ATOM 1298 CB ASP A 327 -9.870 -15.540 12.416 1.00 71.12 C ATOM 1299 CG ASP A 327 -10.737 -14.623 13.281 1.00 73.22 C ATOM 1300 OD1 ASP A 327 -11.330 -13.652 12.787 1.00 22.21 O ATOM 1301 OD2 ASP A 327 -10.793 -14.944 14.529 1.00 4.42 O ATOM 0 H ASP A 327 -7.356 -14.721 12.335 1.00 13.03 H new ATOM 0 HA ASP A 327 -8.947 -16.426 14.147 1.00 10.45 H new ATOM 0 HB2 ASP A 327 -9.514 -14.973 11.556 1.00 71.12 H new ATOM 0 HB3 ASP A 327 -10.493 -16.347 12.030 1.00 71.12 H new ATOM 1307 N GLY A 328 -6.911 -17.471 12.132 1.00 21.40 N ATOM 1308 CA GLY A 328 -6.344 -18.586 11.392 1.00 31.11 C ATOM 1309 C GLY A 328 -6.860 -18.607 9.952 1.00 70.22 C ATOM 1310 O GLY A 328 -6.933 -19.666 9.330 1.00 21.12 O ATOM 0 H GLY A 328 -6.229 -16.790 12.467 1.00 21.40 H new ATOM 0 HA2 GLY A 328 -5.257 -18.511 11.391 1.00 31.11 H new ATOM 0 HA3 GLY A 328 -6.599 -19.523 11.887 1.00 31.11 H new ATOM 1314 N GLU A 329 -7.205 -17.425 9.463 1.00 2.02 N ATOM 1315 CA GLU A 329 -7.712 -17.294 8.108 1.00 62.32 C ATOM 1316 C GLU A 329 -6.622 -16.745 7.184 1.00 35.42 C ATOM 1317 O GLU A 329 -6.023 -15.711 7.472 1.00 10.41 O ATOM 1318 CB GLU A 329 -8.959 -16.409 8.072 1.00 43.52 C ATOM 1319 CG GLU A 329 -8.578 -14.927 8.061 1.00 14.42 C ATOM 1320 CD GLU A 329 -9.791 -14.047 8.373 1.00 71.14 C ATOM 1321 OE1 GLU A 329 -10.011 -13.032 7.695 1.00 0.14 O ATOM 1322 OE2 GLU A 329 -10.519 -14.452 9.357 1.00 15.34 O ATOM 0 H GLU A 329 -7.143 -16.549 9.982 1.00 2.02 H new ATOM 0 HA GLU A 329 -7.999 -18.283 7.751 1.00 62.32 H new ATOM 0 HB2 GLU A 329 -9.550 -16.643 7.187 1.00 43.52 H new ATOM 0 HB3 GLU A 329 -9.585 -16.621 8.939 1.00 43.52 H new ATOM 0 HG2 GLU A 329 -7.793 -14.744 8.795 1.00 14.42 H new ATOM 0 HG3 GLU A 329 -8.171 -14.660 7.086 1.00 14.42 H new ATOM 1330 N THR A 330 -6.399 -17.463 6.093 1.00 34.10 N ATOM 1331 CA THR A 330 -5.393 -17.061 5.125 1.00 2.25 C ATOM 1332 C THR A 330 -5.637 -15.621 4.670 1.00 44.23 C ATOM 1333 O THR A 330 -6.614 -15.342 3.977 1.00 33.13 O ATOM 1334 CB THR A 330 -5.409 -18.072 3.978 1.00 72.42 C ATOM 1335 OG1 THR A 330 -5.208 -19.329 4.620 1.00 40.35 O ATOM 1336 CG2 THR A 330 -4.199 -17.928 3.053 1.00 61.41 C ATOM 0 H THR A 330 -6.898 -18.321 5.858 1.00 34.10 H new ATOM 0 HA THR A 330 -4.396 -17.065 5.566 1.00 2.25 H new ATOM 0 HB THR A 330 -6.324 -17.949 3.399 1.00 72.42 H new ATOM 0 HG1 THR A 330 -5.206 -20.043 3.948 1.00 40.35 H new ATOM 0 HG21 THR A 330 -4.260 -18.669 2.256 1.00 61.41 H new ATOM 0 HG22 THR A 330 -4.190 -16.928 2.619 1.00 61.41 H new ATOM 0 HG23 THR A 330 -3.284 -18.084 3.624 1.00 61.41 H new ATOM 1344 N ILE A 331 -4.731 -14.744 5.077 1.00 42.22 N ATOM 1345 CA ILE A 331 -4.835 -13.339 4.719 1.00 71.31 C ATOM 1346 C ILE A 331 -4.007 -13.076 3.460 1.00 53.55 C ATOM 1347 O ILE A 331 -4.411 -12.294 2.599 1.00 21.25 O ATOM 1348 CB ILE A 331 -4.449 -12.454 5.905 1.00 2.05 C ATOM 1349 CG1 ILE A 331 -2.934 -12.455 6.120 1.00 42.33 C ATOM 1350 CG2 ILE A 331 -5.207 -12.868 7.168 1.00 25.54 C ATOM 1351 CD1 ILE A 331 -2.567 -11.785 7.446 1.00 73.41 C ATOM 0 H ILE A 331 -3.921 -14.979 5.651 1.00 42.22 H new ATOM 0 HA ILE A 331 -5.867 -13.081 4.482 1.00 71.31 H new ATOM 0 HB ILE A 331 -4.741 -11.429 5.675 1.00 2.05 H new ATOM 0 HG12 ILE A 331 -2.563 -13.480 6.111 1.00 42.33 H new ATOM 0 HG13 ILE A 331 -2.446 -11.932 5.297 1.00 42.33 H new ATOM 0 HG21 ILE A 331 -4.914 -12.223 7.996 1.00 25.54 H new ATOM 0 HG22 ILE A 331 -6.279 -12.774 6.996 1.00 25.54 H new ATOM 0 HG23 ILE A 331 -4.969 -13.903 7.413 1.00 25.54 H new ATOM 0 HD11 ILE A 331 -1.485 -11.799 7.574 1.00 73.41 H new ATOM 0 HD12 ILE A 331 -2.918 -10.753 7.442 1.00 73.41 H new ATOM 0 HD13 ILE A 331 -3.036 -12.325 8.268 1.00 73.41 H new ATOM 1363 N LEU A 332 -2.864 -13.742 3.391 1.00 75.21 N ATOM 1364 CA LEU A 332 -1.976 -13.590 2.251 1.00 13.30 C ATOM 1365 C LEU A 332 -1.405 -14.957 1.868 1.00 13.54 C ATOM 1366 O LEU A 332 -1.664 -15.952 2.542 1.00 34.34 O ATOM 1367 CB LEU A 332 -0.906 -12.536 2.543 1.00 51.11 C ATOM 1368 CG LEU A 332 -1.211 -11.118 2.057 1.00 13.51 C ATOM 1369 CD1 LEU A 332 -0.114 -10.142 2.489 1.00 74.33 C ATOM 1370 CD2 LEU A 332 -1.437 -11.093 0.544 1.00 12.10 C ATOM 0 H LEU A 332 -2.532 -14.389 4.107 1.00 75.21 H new ATOM 0 HA LEU A 332 -2.527 -13.221 1.386 1.00 13.30 H new ATOM 0 HB2 LEU A 332 -0.742 -12.502 3.620 1.00 51.11 H new ATOM 0 HB3 LEU A 332 0.030 -12.861 2.088 1.00 51.11 H new ATOM 0 HG LEU A 332 -2.138 -10.789 2.526 1.00 13.51 H new ATOM 0 HD11 LEU A 332 -0.356 -9.141 2.131 1.00 74.33 H new ATOM 0 HD12 LEU A 332 -0.045 -10.131 3.577 1.00 74.33 H new ATOM 0 HD13 LEU A 332 0.840 -10.458 2.068 1.00 74.33 H new ATOM 0 HD21 LEU A 332 -1.652 -10.073 0.225 1.00 12.10 H new ATOM 0 HD22 LEU A 332 -0.541 -11.451 0.036 1.00 12.10 H new ATOM 0 HD23 LEU A 332 -2.279 -11.737 0.291 1.00 12.10 H new ATOM 1382 N VAL A 333 -0.639 -14.961 0.788 1.00 43.53 N ATOM 1383 CA VAL A 333 -0.029 -16.189 0.307 1.00 2.33 C ATOM 1384 C VAL A 333 1.279 -15.856 -0.414 1.00 13.40 C ATOM 1385 O VAL A 333 1.313 -14.971 -1.268 1.00 12.22 O ATOM 1386 CB VAL A 333 -1.019 -16.955 -0.573 1.00 25.13 C ATOM 1387 CG1 VAL A 333 -2.458 -16.718 -0.113 1.00 33.44 C ATOM 1388 CG2 VAL A 333 -0.845 -16.582 -2.046 1.00 51.42 C ATOM 0 H VAL A 333 -0.426 -14.133 0.232 1.00 43.53 H new ATOM 0 HA VAL A 333 0.218 -16.845 1.142 1.00 2.33 H new ATOM 0 HB VAL A 333 -0.806 -18.019 -0.470 1.00 25.13 H new ATOM 0 HG11 VAL A 333 -3.141 -17.274 -0.755 1.00 33.44 H new ATOM 0 HG12 VAL A 333 -2.571 -17.057 0.917 1.00 33.44 H new ATOM 0 HG13 VAL A 333 -2.688 -15.654 -0.172 1.00 33.44 H new ATOM 0 HG21 VAL A 333 -1.560 -17.140 -2.650 1.00 51.42 H new ATOM 0 HG22 VAL A 333 -1.018 -15.513 -2.174 1.00 51.42 H new ATOM 0 HG23 VAL A 333 0.168 -16.826 -2.366 1.00 51.42 H new ATOM 1398 N GLY A 334 2.323 -16.582 -0.044 1.00 21.01 N ATOM 1399 CA GLY A 334 3.630 -16.375 -0.645 1.00 13.30 C ATOM 1400 C GLY A 334 3.754 -17.141 -1.964 1.00 5.35 C ATOM 1401 O GLY A 334 3.454 -18.332 -2.024 1.00 62.03 O ATOM 0 H GLY A 334 2.291 -17.315 0.665 1.00 21.01 H new ATOM 0 HA2 GLY A 334 3.789 -15.311 -0.822 1.00 13.30 H new ATOM 0 HA3 GLY A 334 4.408 -16.703 0.045 1.00 13.30 H new ATOM 1405 N LYS A 335 4.198 -16.425 -2.987 1.00 21.52 N ATOM 1406 CA LYS A 335 4.366 -17.023 -4.301 1.00 23.04 C ATOM 1407 C LYS A 335 5.388 -18.158 -4.213 1.00 23.24 C ATOM 1408 O LYS A 335 5.351 -19.095 -5.009 1.00 33.24 O ATOM 1409 CB LYS A 335 4.723 -15.953 -5.334 1.00 42.12 C ATOM 1410 CG LYS A 335 6.235 -15.722 -5.385 1.00 71.53 C ATOM 1411 CD LYS A 335 6.707 -14.914 -4.175 1.00 45.25 C ATOM 1412 CE LYS A 335 8.209 -14.631 -4.257 1.00 71.44 C ATOM 1413 NZ LYS A 335 8.621 -14.422 -5.663 1.00 70.55 N ATOM 0 H LYS A 335 4.446 -15.437 -2.933 1.00 21.52 H new ATOM 0 HA LYS A 335 3.429 -17.463 -4.642 1.00 23.04 H new ATOM 0 HB2 LYS A 335 4.365 -16.258 -6.317 1.00 42.12 H new ATOM 0 HB3 LYS A 335 4.217 -15.020 -5.086 1.00 42.12 H new ATOM 0 HG2 LYS A 335 6.752 -16.681 -5.411 1.00 71.53 H new ATOM 0 HG3 LYS A 335 6.495 -15.195 -6.303 1.00 71.53 H new ATOM 0 HD2 LYS A 335 6.158 -13.974 -4.125 1.00 45.25 H new ATOM 0 HD3 LYS A 335 6.486 -15.462 -3.259 1.00 45.25 H new ATOM 0 HE2 LYS A 335 8.451 -13.748 -3.666 1.00 71.44 H new ATOM 0 HE3 LYS A 335 8.766 -15.464 -3.829 1.00 71.44 H new ATOM 0 HZ1 LYS A 335 9.648 -14.265 -5.704 1.00 70.55 H new ATOM 0 HZ2 LYS A 335 8.376 -15.262 -6.225 1.00 70.55 H new ATOM 0 HZ3 LYS A 335 8.128 -13.592 -6.049 1.00 70.55 H new ATOM 1426 N CYS A 336 6.278 -18.037 -3.238 1.00 15.20 N ATOM 1427 CA CYS A 336 7.308 -19.041 -3.036 1.00 30.13 C ATOM 1428 C CYS A 336 7.962 -19.337 -4.387 1.00 20.23 C ATOM 1429 O CYS A 336 7.685 -20.366 -5.002 1.00 43.52 O ATOM 1430 CB CYS A 336 6.745 -20.306 -2.385 1.00 30.13 C ATOM 1431 SG CYS A 336 7.185 -20.345 -0.609 1.00 2.12 S ATOM 0 H CYS A 336 6.306 -17.258 -2.580 1.00 15.20 H new ATOM 0 HA CYS A 336 8.060 -18.660 -2.345 1.00 30.13 H new ATOM 0 HB2 CYS A 336 5.661 -20.333 -2.500 1.00 30.13 H new ATOM 0 HB3 CYS A 336 7.141 -21.190 -2.886 1.00 30.13 H new ATOM 0 HG CYS A 336 8.187 -21.153 -0.428 1.00 2.12 H new ATOM 1437 N ALA A 337 8.817 -18.417 -4.808 1.00 62.34 N ATOM 1438 CA ALA A 337 9.513 -18.567 -6.075 1.00 51.14 C ATOM 1439 C ALA A 337 10.809 -19.348 -5.851 1.00 44.42 C ATOM 1440 O ALA A 337 11.104 -19.759 -4.730 1.00 64.53 O ATOM 1441 CB ALA A 337 9.762 -17.187 -6.687 1.00 54.14 C ATOM 0 H ALA A 337 9.044 -17.565 -4.295 1.00 62.34 H new ATOM 0 HA ALA A 337 8.906 -19.132 -6.782 1.00 51.14 H new ATOM 0 HB1 ALA A 337 10.284 -17.299 -7.637 1.00 54.14 H new ATOM 0 HB2 ALA A 337 8.809 -16.686 -6.854 1.00 54.14 H new ATOM 0 HB3 ALA A 337 10.371 -16.592 -6.007 1.00 54.14 H new ATOM 1447 N ASP A 338 11.549 -19.528 -6.935 1.00 42.45 N ATOM 1448 CA ASP A 338 12.807 -20.252 -6.871 1.00 44.44 C ATOM 1449 C ASP A 338 13.875 -19.355 -6.241 1.00 62.12 C ATOM 1450 O ASP A 338 14.871 -19.025 -6.883 1.00 2.20 O ATOM 1451 CB ASP A 338 13.287 -20.647 -8.269 1.00 61.12 C ATOM 1452 CG ASP A 338 13.614 -19.475 -9.196 1.00 43.14 C ATOM 1453 OD1 ASP A 338 14.628 -19.489 -9.910 1.00 4.42 O ATOM 1454 OD2 ASP A 338 12.766 -18.504 -9.168 1.00 15.22 O ATOM 0 H ASP A 338 11.301 -19.185 -7.863 1.00 42.45 H new ATOM 0 HA ASP A 338 12.648 -21.152 -6.276 1.00 44.44 H new ATOM 0 HB2 ASP A 338 14.176 -21.270 -8.169 1.00 61.12 H new ATOM 0 HB3 ASP A 338 12.519 -21.260 -8.741 1.00 61.12 H new ATOM 1460 N SER A 339 13.631 -18.987 -4.992 1.00 40.32 N ATOM 1461 CA SER A 339 14.559 -18.135 -4.268 1.00 42.22 C ATOM 1462 C SER A 339 14.116 -17.998 -2.810 1.00 74.03 C ATOM 1463 O SER A 339 12.925 -18.073 -2.510 1.00 41.02 O ATOM 1464 CB SER A 339 14.666 -16.756 -4.922 1.00 52.21 C ATOM 1465 OG SER A 339 15.405 -16.798 -6.140 1.00 20.13 O ATOM 0 H SER A 339 12.804 -19.263 -4.463 1.00 40.32 H new ATOM 0 HA SER A 339 15.545 -18.599 -4.299 1.00 42.22 H new ATOM 0 HB2 SER A 339 13.666 -16.369 -5.118 1.00 52.21 H new ATOM 0 HB3 SER A 339 15.146 -16.063 -4.231 1.00 52.21 H new ATOM 0 HG SER A 339 15.620 -17.728 -6.360 1.00 20.13 H new ATOM 1471 N ASN A 340 15.097 -17.800 -1.943 1.00 1.13 N ATOM 1472 CA ASN A 340 14.823 -17.652 -0.523 1.00 51.14 C ATOM 1473 C ASN A 340 13.884 -16.463 -0.311 1.00 53.11 C ATOM 1474 O ASN A 340 13.262 -16.339 0.743 1.00 1.21 O ATOM 1475 CB ASN A 340 16.109 -17.385 0.261 1.00 11.50 C ATOM 1476 CG ASN A 340 16.980 -18.641 0.331 1.00 14.41 C ATOM 1477 OD1 ASN A 340 17.007 -19.460 -0.572 1.00 54.05 O ATOM 1478 ND2 ASN A 340 17.688 -18.746 1.452 1.00 51.02 N ATOM 0 H ASN A 340 16.083 -17.738 -2.196 1.00 1.13 H new ATOM 0 HA ASN A 340 14.370 -18.578 -0.168 1.00 51.14 H new ATOM 0 HB2 ASN A 340 16.667 -16.577 -0.213 1.00 11.50 H new ATOM 0 HB3 ASN A 340 15.862 -17.053 1.269 1.00 11.50 H new ATOM 0 HD21 ASN A 340 18.300 -19.549 1.595 1.00 51.02 H new ATOM 0 HD22 ASN A 340 17.619 -18.023 2.169 1.00 51.02 H new ATOM 1485 N GLU A 341 13.810 -15.619 -1.330 1.00 0.35 N ATOM 1486 CA GLU A 341 12.957 -14.444 -1.268 1.00 1.03 C ATOM 1487 C GLU A 341 11.497 -14.835 -1.507 1.00 3.33 C ATOM 1488 O GLU A 341 11.215 -15.756 -2.271 1.00 52.13 O ATOM 1489 CB GLU A 341 13.412 -13.383 -2.271 1.00 41.34 C ATOM 1490 CG GLU A 341 14.252 -12.303 -1.585 1.00 74.22 C ATOM 1491 CD GLU A 341 15.163 -11.596 -2.590 1.00 63.33 C ATOM 1492 OE1 GLU A 341 14.693 -11.150 -3.647 1.00 73.12 O ATOM 1493 OE2 GLU A 341 16.403 -11.517 -2.241 1.00 35.44 O ATOM 0 H GLU A 341 14.327 -15.725 -2.203 1.00 0.35 H new ATOM 0 HA GLU A 341 13.038 -14.012 -0.271 1.00 1.03 H new ATOM 0 HB2 GLU A 341 13.995 -13.853 -3.063 1.00 41.34 H new ATOM 0 HB3 GLU A 341 12.542 -12.927 -2.743 1.00 41.34 H new ATOM 0 HG2 GLU A 341 13.596 -11.575 -1.109 1.00 74.22 H new ATOM 0 HG3 GLU A 341 14.855 -12.753 -0.796 1.00 74.22 H new ATOM 1501 N ILE A 342 10.608 -14.115 -0.839 1.00 3.44 N ATOM 1502 CA ILE A 342 9.185 -14.375 -0.969 1.00 14.52 C ATOM 1503 C ILE A 342 8.414 -13.062 -0.811 1.00 44.12 C ATOM 1504 O ILE A 342 8.772 -12.224 0.015 1.00 12.31 O ATOM 1505 CB ILE A 342 8.747 -15.466 0.011 1.00 43.53 C ATOM 1506 CG1 ILE A 342 9.503 -16.770 -0.249 1.00 21.31 C ATOM 1507 CG2 ILE A 342 7.231 -15.664 -0.031 1.00 13.43 C ATOM 1508 CD1 ILE A 342 9.085 -17.854 0.747 1.00 11.44 C ATOM 0 H ILE A 342 10.846 -13.351 -0.206 1.00 3.44 H new ATOM 0 HA ILE A 342 8.958 -14.761 -1.963 1.00 14.52 H new ATOM 0 HB ILE A 342 9.001 -15.142 1.020 1.00 43.53 H new ATOM 0 HG12 ILE A 342 9.308 -17.111 -1.266 1.00 21.31 H new ATOM 0 HG13 ILE A 342 10.576 -16.594 -0.172 1.00 21.31 H new ATOM 0 HG21 ILE A 342 6.946 -16.445 0.675 1.00 13.43 H new ATOM 0 HG22 ILE A 342 6.735 -14.732 0.239 1.00 13.43 H new ATOM 0 HG23 ILE A 342 6.930 -15.957 -1.037 1.00 13.43 H new ATOM 0 HD11 ILE A 342 9.637 -18.771 0.540 1.00 11.44 H new ATOM 0 HD12 ILE A 342 9.303 -17.520 1.761 1.00 11.44 H new ATOM 0 HD13 ILE A 342 8.016 -18.045 0.650 1.00 11.44 H new ATOM 1520 N THR A 343 7.372 -12.924 -1.617 1.00 34.42 N ATOM 1521 CA THR A 343 6.548 -11.728 -1.577 1.00 51.01 C ATOM 1522 C THR A 343 5.068 -12.096 -1.697 1.00 53.50 C ATOM 1523 O THR A 343 4.564 -12.305 -2.799 1.00 54.23 O ATOM 1524 CB THR A 343 7.031 -10.785 -2.680 1.00 41.44 C ATOM 1525 OG1 THR A 343 6.471 -11.329 -3.872 1.00 51.44 O ATOM 1526 CG2 THR A 343 8.542 -10.872 -2.905 1.00 40.24 C ATOM 0 H THR A 343 7.079 -13.621 -2.302 1.00 34.42 H new ATOM 0 HA THR A 343 6.646 -11.212 -0.622 1.00 51.01 H new ATOM 0 HB THR A 343 6.760 -9.760 -2.425 1.00 41.44 H new ATOM 0 HG1 THR A 343 5.498 -11.217 -3.857 1.00 51.44 H new ATOM 0 HG21 THR A 343 8.832 -10.183 -3.698 1.00 40.24 H new ATOM 0 HG22 THR A 343 9.063 -10.606 -1.985 1.00 40.24 H new ATOM 0 HG23 THR A 343 8.809 -11.889 -3.193 1.00 40.24 H new ATOM 1534 N LEU A 344 4.413 -12.163 -0.547 1.00 54.23 N ATOM 1535 CA LEU A 344 3.000 -12.501 -0.509 1.00 61.45 C ATOM 1536 C LEU A 344 2.254 -11.678 -1.561 1.00 43.23 C ATOM 1537 O LEU A 344 2.458 -10.470 -1.668 1.00 44.50 O ATOM 1538 CB LEU A 344 2.447 -12.335 0.907 1.00 21.24 C ATOM 1539 CG LEU A 344 2.619 -13.536 1.840 1.00 63.13 C ATOM 1540 CD1 LEU A 344 4.075 -14.005 1.867 1.00 44.14 C ATOM 1541 CD2 LEU A 344 2.092 -13.222 3.241 1.00 24.04 C ATOM 0 H LEU A 344 4.835 -11.989 0.365 1.00 54.23 H new ATOM 0 HA LEU A 344 2.853 -13.551 -0.762 1.00 61.45 H new ATOM 0 HB2 LEU A 344 2.930 -11.472 1.365 1.00 21.24 H new ATOM 0 HB3 LEU A 344 1.384 -12.105 0.836 1.00 21.24 H new ATOM 0 HG LEU A 344 2.022 -14.360 1.449 1.00 63.13 H new ATOM 0 HD11 LEU A 344 4.170 -14.859 2.537 1.00 44.14 H new ATOM 0 HD12 LEU A 344 4.382 -14.296 0.863 1.00 44.14 H new ATOM 0 HD13 LEU A 344 4.712 -13.194 2.220 1.00 44.14 H new ATOM 0 HD21 LEU A 344 2.226 -14.092 3.884 1.00 24.04 H new ATOM 0 HD22 LEU A 344 2.641 -12.377 3.655 1.00 24.04 H new ATOM 0 HD23 LEU A 344 1.032 -12.973 3.184 1.00 24.04 H new ATOM 1553 N LYS A 345 1.405 -12.365 -2.312 1.00 3.45 N ATOM 1554 CA LYS A 345 0.628 -11.712 -3.351 1.00 50.32 C ATOM 1555 C LYS A 345 -0.772 -11.403 -2.817 1.00 72.13 C ATOM 1556 O LYS A 345 -1.074 -10.259 -2.480 1.00 24.43 O ATOM 1557 CB LYS A 345 0.627 -12.554 -4.628 1.00 63.05 C ATOM 1558 CG LYS A 345 1.945 -13.316 -4.783 1.00 71.42 C ATOM 1559 CD LYS A 345 1.722 -14.825 -4.664 1.00 64.42 C ATOM 1560 CE LYS A 345 1.608 -15.473 -6.046 1.00 21.35 C ATOM 1561 NZ LYS A 345 1.599 -16.949 -5.927 1.00 12.42 N ATOM 0 H LYS A 345 1.239 -13.367 -2.221 1.00 3.45 H new ATOM 0 HA LYS A 345 1.082 -10.760 -3.625 1.00 50.32 H new ATOM 0 HB2 LYS A 345 -0.204 -13.259 -4.602 1.00 63.05 H new ATOM 0 HB3 LYS A 345 0.472 -11.909 -5.493 1.00 63.05 H new ATOM 0 HG2 LYS A 345 2.391 -13.086 -5.751 1.00 71.42 H new ATOM 0 HG3 LYS A 345 2.651 -12.988 -4.020 1.00 71.42 H new ATOM 0 HD2 LYS A 345 2.548 -15.276 -4.114 1.00 64.42 H new ATOM 0 HD3 LYS A 345 0.815 -15.018 -4.092 1.00 64.42 H new ATOM 0 HE2 LYS A 345 0.695 -15.136 -6.538 1.00 21.35 H new ATOM 0 HE3 LYS A 345 2.443 -15.158 -6.672 1.00 21.35 H new ATOM 0 HZ1 LYS A 345 2.482 -17.334 -6.318 1.00 12.42 H new ATOM 0 HZ2 LYS A 345 1.519 -17.216 -4.925 1.00 12.42 H new ATOM 0 HZ3 LYS A 345 0.790 -17.335 -6.454 1.00 12.42 H new ATOM 1574 N SER A 346 -1.590 -12.443 -2.757 1.00 75.45 N ATOM 1575 CA SER A 346 -2.952 -12.298 -2.270 1.00 43.14 C ATOM 1576 C SER A 346 -3.809 -13.468 -2.756 1.00 31.53 C ATOM 1577 O SER A 346 -3.652 -13.932 -3.884 1.00 51.32 O ATOM 1578 CB SER A 346 -3.560 -10.970 -2.725 1.00 53.10 C ATOM 1579 OG SER A 346 -3.182 -10.638 -4.058 1.00 71.03 O ATOM 0 H SER A 346 -1.336 -13.390 -3.038 1.00 75.45 H new ATOM 0 HA SER A 346 -2.928 -12.302 -1.180 1.00 43.14 H new ATOM 0 HB2 SER A 346 -4.647 -11.028 -2.660 1.00 53.10 H new ATOM 0 HB3 SER A 346 -3.242 -10.176 -2.050 1.00 53.10 H new ATOM 0 HG SER A 346 -2.426 -10.014 -4.038 1.00 71.03 H new ATOM 1585 N PRO A 347 -4.721 -13.925 -1.856 1.00 2.04 N ATOM 1586 CA PRO A 347 -5.603 -15.033 -2.180 1.00 53.45 C ATOM 1587 C PRO A 347 -6.715 -14.587 -3.133 1.00 0.04 C ATOM 1588 O PRO A 347 -6.632 -14.813 -4.339 1.00 23.12 O ATOM 1589 CB PRO A 347 -6.129 -15.522 -0.841 1.00 72.52 C ATOM 1590 CG PRO A 347 -5.891 -14.387 0.141 1.00 54.33 C ATOM 1591 CD PRO A 347 -4.935 -13.401 -0.510 1.00 2.21 C ATOM 0 HA PRO A 347 -5.092 -15.837 -2.709 1.00 53.45 H new ATOM 0 HB2 PRO A 347 -7.189 -15.768 -0.904 1.00 72.52 H new ATOM 0 HB3 PRO A 347 -5.610 -16.427 -0.525 1.00 72.52 H new ATOM 0 HG2 PRO A 347 -6.831 -13.897 0.393 1.00 54.33 H new ATOM 0 HG3 PRO A 347 -5.471 -14.769 1.071 1.00 54.33 H new ATOM 0 HD2 PRO A 347 -5.360 -12.398 -0.539 1.00 2.21 H new ATOM 0 HD3 PRO A 347 -3.998 -13.335 0.043 1.00 2.21 H new ATOM 1599 N LEU A 348 -7.730 -13.962 -2.555 1.00 1.44 N ATOM 1600 CA LEU A 348 -8.857 -13.482 -3.337 1.00 22.03 C ATOM 1601 C LEU A 348 -8.767 -11.961 -3.472 1.00 53.33 C ATOM 1602 O LEU A 348 -8.317 -11.277 -2.554 1.00 32.41 O ATOM 1603 CB LEU A 348 -10.175 -13.969 -2.732 1.00 21.15 C ATOM 1604 CG LEU A 348 -11.321 -14.201 -3.719 1.00 23.45 C ATOM 1605 CD1 LEU A 348 -11.352 -13.109 -4.789 1.00 52.11 C ATOM 1606 CD2 LEU A 348 -11.242 -15.601 -4.331 1.00 21.45 C ATOM 0 H LEU A 348 -7.796 -13.777 -1.554 1.00 1.44 H new ATOM 0 HA LEU A 348 -8.825 -13.894 -4.345 1.00 22.03 H new ATOM 0 HB2 LEU A 348 -9.985 -14.902 -2.201 1.00 21.15 H new ATOM 0 HB3 LEU A 348 -10.503 -13.240 -1.990 1.00 21.15 H new ATOM 0 HG LEU A 348 -12.261 -14.142 -3.171 1.00 23.45 H new ATOM 0 HD11 LEU A 348 -12.176 -13.298 -5.478 1.00 52.11 H new ATOM 0 HD12 LEU A 348 -11.491 -12.138 -4.314 1.00 52.11 H new ATOM 0 HD13 LEU A 348 -10.411 -13.112 -5.339 1.00 52.11 H new ATOM 0 HD21 LEU A 348 -12.068 -15.740 -5.029 1.00 21.45 H new ATOM 0 HD22 LEU A 348 -10.296 -15.714 -4.861 1.00 21.45 H new ATOM 0 HD23 LEU A 348 -11.306 -16.348 -3.540 1.00 21.45 H new