USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 703 hydrogens (7 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 305 ASN : amide:sc= 1.77 K(o=1.8,f=-4.4!) USER MOD Set 1.2: A 332 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 327 GLN : amide:sc= -0.413 K(o=-0.3,f=-1.5) USER MOD Set 2.2: A 328 THR OG1 : rot 180:sc= 0.112 USER MOD Set 3.1: A 265 SER OG : rot -130:sc= 0.876 USER MOD Set 3.2: A 282 SER OG : rot 180:sc= 0.585 USER MOD Set 4.1: A 270 SER OG : rot 180:sc= 0.13 USER MOD Set 4.2: A 314 ASN : amide:sc= 0.718 K(o=0.85,f=-0.83!) USER MOD Single : A 248 ASN : amide:sc= -0.143 K(o=-0.14,f=-0.68) USER MOD Single : A 251 THR OG1 : rot 180:sc= 0 USER MOD Single : A 253 THR OG1 : rot 180:sc= 0 USER MOD Single : A 255 ASN : amide:sc= 1.15 K(o=1.1,f=-8!) USER MOD Single : A 256 MET CE :methyl -170:sc= 0 (180deg=-0.142) USER MOD Single : A 259 HIS : no HE2:sc= 1.01 K(o=1,f=-4.3!) USER MOD Single : A 260 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 269 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 271 ASN : amide:sc= -0.205 K(o=-0.2,f=-1.9) USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 284 MET CE :methyl -137:sc= -0.193 (180deg=-0.871) USER MOD Single : A 285 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 300 MET CE :methyl 163:sc= 0 (180deg=-0.411) USER MOD Single : A 303 GLN : amide:sc= -0.507 K(o=-0.51,f=-2.2!) USER MOD Single : A 308 ASN : amide:sc= 1.66 K(o=1.7,f=-12!) USER MOD Single : A 311 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 312 MET CE :methyl 146:sc= -0.16 (180deg=-1.3) USER MOD Single : A 313 SER OG : rot 180:sc= 0.0154 USER MOD Single : A 326 SER OG : rot 66:sc= 1.25 USER MOD Single : A 334 THR OG1 : rot 79:sc= 1.05 USER MOD Single : A 337 LYS NZ :NH3+ -173:sc= 1.6! (180deg=1.18!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 248 4.659 -13.724 -6.776 1.00 0.52 N ATOM 2 CA ASN A 248 3.289 -13.616 -7.325 1.00 0.49 C ATOM 3 C ASN A 248 2.769 -12.185 -7.196 1.00 0.44 C ATOM 4 O ASN A 248 2.546 -11.693 -6.091 1.00 0.47 O ATOM 5 CB ASN A 248 2.352 -14.583 -6.593 1.00 0.57 C ATOM 6 CG ASN A 248 0.930 -14.536 -7.118 1.00 0.70 C ATOM 7 OD1 ASN A 248 0.689 -14.163 -8.268 1.00 0.99 O ATOM 8 ND2 ASN A 248 -0.023 -14.918 -6.279 1.00 1.26 N ATOM 0 HA ASN A 248 3.318 -13.880 -8.382 1.00 0.49 H new ATOM 0 HB2 ASN A 248 2.737 -15.598 -6.691 1.00 0.57 H new ATOM 0 HB3 ASN A 248 2.350 -14.344 -5.530 1.00 0.57 H new ATOM 0 HD21 ASN A 248 -0.998 -14.910 -6.577 1.00 1.26 H new ATOM 0 HD22 ASN A 248 0.219 -15.220 -5.335 1.00 1.26 H new ATOM 17 N ILE A 249 2.587 -11.521 -8.327 1.00 0.45 N ATOM 18 CA ILE A 249 2.095 -10.148 -8.339 1.00 0.43 C ATOM 19 C ILE A 249 0.574 -10.126 -8.463 1.00 0.42 C ATOM 20 O ILE A 249 0.014 -10.682 -9.409 1.00 0.50 O ATOM 21 CB ILE A 249 2.717 -9.338 -9.498 1.00 0.47 C ATOM 22 CG1 ILE A 249 4.229 -9.221 -9.309 1.00 0.54 C ATOM 23 CG2 ILE A 249 2.087 -7.956 -9.589 1.00 0.50 C ATOM 24 CD1 ILE A 249 4.935 -8.564 -10.475 1.00 0.65 C ATOM 0 H ILE A 249 2.772 -11.910 -9.252 1.00 0.45 H new ATOM 0 HA ILE A 249 2.389 -9.687 -7.396 1.00 0.43 H new ATOM 0 HB ILE A 249 2.519 -9.866 -10.431 1.00 0.47 H new ATOM 0 HG12 ILE A 249 4.431 -8.649 -8.403 1.00 0.54 H new ATOM 0 HG13 ILE A 249 4.646 -10.216 -9.156 1.00 0.54 H new ATOM 0 HG21 ILE A 249 2.540 -7.403 -10.412 1.00 0.50 H new ATOM 0 HG22 ILE A 249 1.016 -8.055 -9.765 1.00 0.50 H new ATOM 0 HG23 ILE A 249 2.253 -7.418 -8.656 1.00 0.50 H new ATOM 0 HD11 ILE A 249 6.005 -8.515 -10.272 1.00 0.65 H new ATOM 0 HD12 ILE A 249 4.764 -9.148 -11.380 1.00 0.65 H new ATOM 0 HD13 ILE A 249 4.545 -7.556 -10.615 1.00 0.65 H new ATOM 36 N ILE A 250 -0.088 -9.489 -7.509 1.00 0.39 N ATOM 37 CA ILE A 250 -1.540 -9.407 -7.519 1.00 0.41 C ATOM 38 C ILE A 250 -2.008 -7.954 -7.491 1.00 0.37 C ATOM 39 O ILE A 250 -1.655 -7.194 -6.589 1.00 0.36 O ATOM 40 CB ILE A 250 -2.164 -10.170 -6.327 1.00 0.44 C ATOM 41 CG1 ILE A 250 -1.750 -11.645 -6.365 1.00 0.48 C ATOM 42 CG2 ILE A 250 -3.682 -10.043 -6.351 1.00 0.55 C ATOM 43 CD1 ILE A 250 -2.346 -12.481 -5.252 1.00 0.54 C ATOM 0 H ILE A 250 0.357 -9.022 -6.719 1.00 0.39 H new ATOM 0 HA ILE A 250 -1.875 -9.875 -8.445 1.00 0.41 H new ATOM 0 HB ILE A 250 -1.795 -9.729 -5.401 1.00 0.44 H new ATOM 0 HG12 ILE A 250 -2.047 -12.070 -7.324 1.00 0.48 H new ATOM 0 HG13 ILE A 250 -0.663 -11.708 -6.311 1.00 0.48 H new ATOM 0 HG21 ILE A 250 -4.106 -10.585 -5.506 1.00 0.55 H new ATOM 0 HG22 ILE A 250 -3.960 -8.991 -6.284 1.00 0.55 H new ATOM 0 HG23 ILE A 250 -4.067 -10.461 -7.281 1.00 0.55 H new ATOM 0 HD11 ILE A 250 -2.005 -13.512 -5.349 1.00 0.54 H new ATOM 0 HD12 ILE A 250 -2.029 -12.083 -4.288 1.00 0.54 H new ATOM 0 HD13 ILE A 250 -3.434 -12.451 -5.317 1.00 0.54 H new ATOM 55 N THR A 251 -2.781 -7.574 -8.496 1.00 0.40 N ATOM 56 CA THR A 251 -3.317 -6.223 -8.593 1.00 0.39 C ATOM 57 C THR A 251 -4.786 -6.213 -8.194 1.00 0.40 C ATOM 58 O THR A 251 -5.603 -6.904 -8.808 1.00 0.48 O ATOM 59 CB THR A 251 -3.183 -5.680 -10.026 1.00 0.46 C ATOM 60 OG1 THR A 251 -2.045 -6.275 -10.668 1.00 0.59 O ATOM 61 CG2 THR A 251 -3.038 -4.168 -10.017 1.00 0.47 C ATOM 0 H THR A 251 -3.054 -8.188 -9.264 1.00 0.40 H new ATOM 0 HA THR A 251 -2.746 -5.587 -7.917 1.00 0.39 H new ATOM 0 HB THR A 251 -4.086 -5.937 -10.579 1.00 0.46 H new ATOM 0 HG1 THR A 251 -1.965 -5.927 -11.581 1.00 0.59 H new ATOM 0 HG21 THR A 251 -2.945 -3.805 -11.041 1.00 0.47 H new ATOM 0 HG22 THR A 251 -3.917 -3.721 -9.552 1.00 0.47 H new ATOM 0 HG23 THR A 251 -2.148 -3.891 -9.452 1.00 0.47 H new ATOM 69 N VAL A 252 -5.127 -5.447 -7.167 1.00 0.36 N ATOM 70 CA VAL A 252 -6.507 -5.383 -6.700 1.00 0.38 C ATOM 71 C VAL A 252 -7.024 -3.947 -6.655 1.00 0.35 C ATOM 72 O VAL A 252 -6.274 -3.016 -6.367 1.00 0.39 O ATOM 73 CB VAL A 252 -6.664 -6.013 -5.296 1.00 0.41 C ATOM 74 CG1 VAL A 252 -6.199 -7.459 -5.301 1.00 0.50 C ATOM 75 CG2 VAL A 252 -5.903 -5.215 -4.245 1.00 0.40 C ATOM 0 H VAL A 252 -4.473 -4.865 -6.644 1.00 0.36 H new ATOM 0 HA VAL A 252 -7.096 -5.953 -7.418 1.00 0.38 H new ATOM 0 HB VAL A 252 -7.723 -5.989 -5.038 1.00 0.41 H new ATOM 0 HG11 VAL A 252 -6.318 -7.883 -4.304 1.00 0.50 H new ATOM 0 HG12 VAL A 252 -6.796 -8.031 -6.012 1.00 0.50 H new ATOM 0 HG13 VAL A 252 -5.149 -7.503 -5.591 1.00 0.50 H new ATOM 0 HG21 VAL A 252 -6.033 -5.682 -3.269 1.00 0.40 H new ATOM 0 HG22 VAL A 252 -4.843 -5.195 -4.500 1.00 0.40 H new ATOM 0 HG23 VAL A 252 -6.288 -4.196 -4.213 1.00 0.40 H new ATOM 85 N THR A 253 -8.302 -3.774 -6.956 1.00 0.39 N ATOM 86 CA THR A 253 -8.922 -2.462 -6.913 1.00 0.40 C ATOM 87 C THR A 253 -9.910 -2.430 -5.755 1.00 0.39 C ATOM 88 O THR A 253 -10.837 -3.240 -5.689 1.00 0.54 O ATOM 89 CB THR A 253 -9.625 -2.090 -8.245 1.00 0.50 C ATOM 90 OG1 THR A 253 -10.372 -0.872 -8.096 1.00 0.76 O ATOM 91 CG2 THR A 253 -10.547 -3.205 -8.716 1.00 0.79 C ATOM 0 H THR A 253 -8.930 -4.529 -7.233 1.00 0.39 H new ATOM 0 HA THR A 253 -8.140 -1.717 -6.765 1.00 0.40 H new ATOM 0 HB THR A 253 -8.850 -1.946 -8.997 1.00 0.50 H new ATOM 0 HG1 THR A 253 -10.808 -0.650 -8.945 1.00 0.76 H new ATOM 0 HG21 THR A 253 -11.024 -2.912 -9.651 1.00 0.79 H new ATOM 0 HG22 THR A 253 -9.967 -4.114 -8.873 1.00 0.79 H new ATOM 0 HG23 THR A 253 -11.312 -3.388 -7.961 1.00 0.79 H new ATOM 99 N LEU A 254 -9.698 -1.515 -4.826 1.00 0.33 N ATOM 100 CA LEU A 254 -10.554 -1.426 -3.660 1.00 0.35 C ATOM 101 C LEU A 254 -11.544 -0.275 -3.773 1.00 0.35 C ATOM 102 O LEU A 254 -11.189 0.832 -4.184 1.00 0.37 O ATOM 103 CB LEU A 254 -9.705 -1.284 -2.397 1.00 0.36 C ATOM 104 CG LEU A 254 -8.641 -2.371 -2.212 1.00 0.39 C ATOM 105 CD1 LEU A 254 -7.802 -2.091 -0.977 1.00 0.46 C ATOM 106 CD2 LEU A 254 -9.290 -3.745 -2.119 1.00 0.45 C ATOM 0 H LEU A 254 -8.945 -0.828 -4.857 1.00 0.33 H new ATOM 0 HA LEU A 254 -11.134 -2.347 -3.599 1.00 0.35 H new ATOM 0 HB2 LEU A 254 -9.212 -0.312 -2.415 1.00 0.36 H new ATOM 0 HB3 LEU A 254 -10.365 -1.290 -1.530 1.00 0.36 H new ATOM 0 HG LEU A 254 -7.985 -2.361 -3.082 1.00 0.39 H new ATOM 0 HD11 LEU A 254 -7.052 -2.873 -0.862 1.00 0.46 H new ATOM 0 HD12 LEU A 254 -7.307 -1.126 -1.085 1.00 0.46 H new ATOM 0 HD13 LEU A 254 -8.445 -2.072 -0.097 1.00 0.46 H new ATOM 0 HD21 LEU A 254 -8.518 -4.504 -1.988 1.00 0.45 H new ATOM 0 HD22 LEU A 254 -9.971 -3.769 -1.268 1.00 0.45 H new ATOM 0 HD23 LEU A 254 -9.846 -3.947 -3.034 1.00 0.45 H new ATOM 118 N ASN A 255 -12.791 -0.562 -3.415 1.00 0.40 N ATOM 119 CA ASN A 255 -13.862 0.429 -3.448 1.00 0.44 C ATOM 120 C ASN A 255 -13.626 1.502 -2.388 1.00 0.40 C ATOM 121 O ASN A 255 -13.558 1.200 -1.193 1.00 0.39 O ATOM 122 CB ASN A 255 -15.215 -0.256 -3.211 1.00 0.50 C ATOM 123 CG ASN A 255 -16.365 0.729 -3.107 1.00 0.55 C ATOM 124 OD1 ASN A 255 -16.646 1.262 -2.033 1.00 0.52 O ATOM 125 ND2 ASN A 255 -17.040 0.969 -4.218 1.00 0.65 N ATOM 0 H ASN A 255 -13.088 -1.484 -3.095 1.00 0.40 H new ATOM 0 HA ASN A 255 -13.870 0.904 -4.429 1.00 0.44 H new ATOM 0 HB2 ASN A 255 -15.412 -0.952 -4.026 1.00 0.50 H new ATOM 0 HB3 ASN A 255 -15.163 -0.844 -2.295 1.00 0.50 H new ATOM 0 HD21 ASN A 255 -17.827 1.617 -4.206 1.00 0.65 H new ATOM 0 HD22 ASN A 255 -16.774 0.506 -5.087 1.00 0.65 H new ATOM 132 N MET A 256 -13.502 2.748 -2.822 1.00 0.41 N ATOM 133 CA MET A 256 -13.266 3.854 -1.904 1.00 0.41 C ATOM 134 C MET A 256 -14.547 4.647 -1.667 1.00 0.44 C ATOM 135 O MET A 256 -14.514 5.789 -1.202 1.00 0.49 O ATOM 136 CB MET A 256 -12.163 4.769 -2.441 1.00 0.43 C ATOM 137 CG MET A 256 -10.765 4.201 -2.257 1.00 0.45 C ATOM 138 SD MET A 256 -10.382 3.840 -0.530 1.00 0.56 S ATOM 139 CE MET A 256 -10.276 5.495 0.151 1.00 0.63 C ATOM 0 H MET A 256 -13.561 3.019 -3.804 1.00 0.41 H new ATOM 0 HA MET A 256 -12.941 3.440 -0.950 1.00 0.41 H new ATOM 0 HB2 MET A 256 -12.337 4.951 -3.502 1.00 0.43 H new ATOM 0 HB3 MET A 256 -12.224 5.734 -1.938 1.00 0.43 H new ATOM 0 HG2 MET A 256 -10.668 3.288 -2.845 1.00 0.45 H new ATOM 0 HG3 MET A 256 -10.035 4.910 -2.646 1.00 0.45 H new ATOM 0 HE1 MET A 256 -9.873 5.447 1.163 1.00 0.63 H new ATOM 0 HE2 MET A 256 -9.621 6.104 -0.472 1.00 0.63 H new ATOM 0 HE3 MET A 256 -11.270 5.942 0.177 1.00 0.63 H new ATOM 149 N GLU A 257 -15.676 4.043 -1.998 1.00 0.46 N ATOM 150 CA GLU A 257 -16.966 4.687 -1.805 1.00 0.51 C ATOM 151 C GLU A 257 -17.492 4.380 -0.410 1.00 0.49 C ATOM 152 O GLU A 257 -17.823 5.284 0.359 1.00 0.56 O ATOM 153 CB GLU A 257 -17.969 4.218 -2.860 1.00 0.56 C ATOM 154 CG GLU A 257 -17.508 4.466 -4.290 1.00 0.67 C ATOM 155 CD GLU A 257 -17.359 5.940 -4.615 1.00 0.86 C ATOM 156 OE1 GLU A 257 -17.815 6.785 -3.817 1.00 1.23 O ATOM 157 OE2 GLU A 257 -16.792 6.262 -5.680 1.00 1.27 O ATOM 0 H GLU A 257 -15.726 3.108 -2.402 1.00 0.46 H new ATOM 0 HA GLU A 257 -16.836 5.764 -1.911 1.00 0.51 H new ATOM 0 HB2 GLU A 257 -18.153 3.152 -2.726 1.00 0.56 H new ATOM 0 HB3 GLU A 257 -18.919 4.728 -2.699 1.00 0.56 H new ATOM 0 HG2 GLU A 257 -16.553 3.965 -4.450 1.00 0.67 H new ATOM 0 HG3 GLU A 257 -18.223 4.017 -4.980 1.00 0.67 H new ATOM 164 N ARG A 258 -17.542 3.094 -0.092 1.00 0.45 N ATOM 165 CA ARG A 258 -18.015 2.635 1.205 1.00 0.45 C ATOM 166 C ARG A 258 -16.914 2.763 2.256 1.00 0.43 C ATOM 167 O ARG A 258 -17.184 2.999 3.429 1.00 0.63 O ATOM 168 CB ARG A 258 -18.483 1.181 1.097 1.00 0.48 C ATOM 169 CG ARG A 258 -18.985 0.582 2.401 1.00 0.56 C ATOM 170 CD ARG A 258 -19.580 -0.794 2.169 1.00 0.64 C ATOM 171 NE ARG A 258 -19.816 -1.517 3.413 1.00 0.75 N ATOM 172 CZ ARG A 258 -19.989 -2.834 3.481 1.00 0.86 C ATOM 173 NH1 ARG A 258 -19.977 -3.569 2.372 1.00 1.01 N ATOM 174 NH2 ARG A 258 -20.179 -3.419 4.653 1.00 1.06 N ATOM 0 H ARG A 258 -17.258 2.344 -0.722 1.00 0.45 H new ATOM 0 HA ARG A 258 -18.854 3.258 1.515 1.00 0.45 H new ATOM 0 HB2 ARG A 258 -19.279 1.123 0.355 1.00 0.48 H new ATOM 0 HB3 ARG A 258 -17.657 0.573 0.727 1.00 0.48 H new ATOM 0 HG2 ARG A 258 -18.164 0.512 3.114 1.00 0.56 H new ATOM 0 HG3 ARG A 258 -19.735 1.238 2.842 1.00 0.56 H new ATOM 0 HD2 ARG A 258 -20.520 -0.693 1.627 1.00 0.64 H new ATOM 0 HD3 ARG A 258 -18.909 -1.375 1.537 1.00 0.64 H new ATOM 0 HE ARG A 258 -19.850 -0.982 4.281 1.00 0.75 H new ATOM 0 HH11 ARG A 258 -19.835 -3.123 1.466 1.00 1.01 H new ATOM 0 HH12 ARG A 258 -20.110 -4.579 2.428 1.00 1.01 H new ATOM 0 HH21 ARG A 258 -20.193 -2.860 5.506 1.00 1.06 H new ATOM 0 HH22 ARG A 258 -20.312 -4.429 4.703 1.00 1.06 H new ATOM 188 N HIS A 259 -15.671 2.620 1.820 1.00 0.37 N ATOM 189 CA HIS A 259 -14.535 2.723 2.726 1.00 0.35 C ATOM 190 C HIS A 259 -14.023 4.151 2.743 1.00 0.40 C ATOM 191 O HIS A 259 -14.255 4.908 1.804 1.00 0.63 O ATOM 192 CB HIS A 259 -13.412 1.770 2.308 1.00 0.38 C ATOM 193 CG HIS A 259 -13.842 0.342 2.196 1.00 0.46 C ATOM 194 ND1 HIS A 259 -13.842 -0.345 1.004 1.00 0.61 N ATOM 195 CD2 HIS A 259 -14.290 -0.529 3.129 1.00 0.58 C ATOM 196 CE1 HIS A 259 -14.269 -1.575 1.205 1.00 0.76 C ATOM 197 NE2 HIS A 259 -14.550 -1.716 2.488 1.00 0.75 N ATOM 0 H HIS A 259 -15.423 2.433 0.848 1.00 0.37 H new ATOM 0 HA HIS A 259 -14.865 2.442 3.726 1.00 0.35 H new ATOM 0 HB2 HIS A 259 -13.011 2.095 1.348 1.00 0.38 H new ATOM 0 HB3 HIS A 259 -12.601 1.840 3.033 1.00 0.38 H new ATOM 0 HD1 HIS A 259 -13.556 0.039 0.103 1.00 0.61 H new ATOM 0 HD2 HIS A 259 -14.419 -0.328 4.182 1.00 0.58 H new ATOM 0 HE1 HIS A 259 -14.372 -2.339 0.449 1.00 0.76 H new ATOM 206 N HIS A 260 -13.327 4.520 3.806 1.00 0.36 N ATOM 207 CA HIS A 260 -12.797 5.872 3.925 1.00 0.42 C ATOM 208 C HIS A 260 -11.277 5.850 4.025 1.00 0.35 C ATOM 209 O HIS A 260 -10.626 6.893 3.987 1.00 0.42 O ATOM 210 CB HIS A 260 -13.404 6.582 5.141 1.00 0.56 C ATOM 211 CG HIS A 260 -14.903 6.637 5.118 1.00 0.71 C ATOM 212 ND1 HIS A 260 -15.622 7.174 4.072 1.00 0.97 N ATOM 213 CD2 HIS A 260 -15.819 6.204 6.017 1.00 0.88 C ATOM 214 CE1 HIS A 260 -16.912 7.068 4.328 1.00 1.09 C ATOM 215 NE2 HIS A 260 -17.060 6.483 5.501 1.00 1.01 N ATOM 0 H HIS A 260 -13.116 3.909 4.595 1.00 0.36 H new ATOM 0 HA HIS A 260 -13.072 6.426 3.027 1.00 0.42 H new ATOM 0 HB2 HIS A 260 -13.081 6.071 6.048 1.00 0.56 H new ATOM 0 HB3 HIS A 260 -13.012 7.598 5.191 1.00 0.56 H new ATOM 0 HD2 HIS A 260 -15.611 5.728 6.964 1.00 0.88 H new ATOM 0 HE1 HIS A 260 -17.712 7.404 3.685 1.00 1.09 H new ATOM 0 HE2 HIS A 260 -17.951 6.272 5.951 1.00 1.01 H new ATOM 224 N PHE A 261 -10.718 4.651 4.150 1.00 0.30 N ATOM 225 CA PHE A 261 -9.275 4.478 4.256 1.00 0.25 C ATOM 226 C PHE A 261 -8.877 3.074 3.813 1.00 0.21 C ATOM 227 O PHE A 261 -9.742 2.229 3.556 1.00 0.22 O ATOM 228 CB PHE A 261 -8.786 4.750 5.690 1.00 0.28 C ATOM 229 CG PHE A 261 -9.475 3.937 6.756 1.00 0.32 C ATOM 230 CD1 PHE A 261 -8.985 2.692 7.122 1.00 0.36 C ATOM 231 CD2 PHE A 261 -10.604 4.422 7.397 1.00 0.52 C ATOM 232 CE1 PHE A 261 -9.607 1.948 8.106 1.00 0.44 C ATOM 233 CE2 PHE A 261 -11.230 3.681 8.380 1.00 0.62 C ATOM 234 CZ PHE A 261 -10.732 2.442 8.734 1.00 0.52 C ATOM 0 H PHE A 261 -11.247 3.780 4.180 1.00 0.30 H new ATOM 0 HA PHE A 261 -8.798 5.203 3.597 1.00 0.25 H new ATOM 0 HB2 PHE A 261 -7.715 4.553 5.737 1.00 0.28 H new ATOM 0 HB3 PHE A 261 -8.926 5.808 5.912 1.00 0.28 H new ATOM 0 HD1 PHE A 261 -8.106 2.299 6.632 1.00 0.36 H new ATOM 0 HD2 PHE A 261 -10.998 5.390 7.125 1.00 0.52 H new ATOM 0 HE1 PHE A 261 -9.213 0.981 8.383 1.00 0.44 H new ATOM 0 HE2 PHE A 261 -12.109 4.070 8.872 1.00 0.62 H new ATOM 0 HZ PHE A 261 -11.222 1.861 9.501 1.00 0.52 H new ATOM 244 N LEU A 262 -7.576 2.832 3.730 1.00 0.17 N ATOM 245 CA LEU A 262 -7.055 1.541 3.315 1.00 0.14 C ATOM 246 C LEU A 262 -7.081 0.567 4.486 1.00 0.12 C ATOM 247 O LEU A 262 -7.633 -0.532 4.384 1.00 0.14 O ATOM 248 CB LEU A 262 -5.629 1.700 2.762 1.00 0.14 C ATOM 249 CG LEU A 262 -5.535 1.958 1.253 1.00 0.19 C ATOM 250 CD1 LEU A 262 -4.092 1.855 0.787 1.00 0.23 C ATOM 251 CD2 LEU A 262 -6.412 0.980 0.482 1.00 0.34 C ATOM 0 H LEU A 262 -6.857 3.522 3.948 1.00 0.17 H new ATOM 0 HA LEU A 262 -7.685 1.138 2.522 1.00 0.14 H new ATOM 0 HB2 LEU A 262 -5.144 2.524 3.285 1.00 0.14 H new ATOM 0 HB3 LEU A 262 -5.064 0.798 2.995 1.00 0.14 H new ATOM 0 HG LEU A 262 -5.894 2.968 1.056 1.00 0.19 H new ATOM 0 HD11 LEU A 262 -4.042 2.041 -0.286 1.00 0.23 H new ATOM 0 HD12 LEU A 262 -3.487 2.594 1.312 1.00 0.23 H new ATOM 0 HD13 LEU A 262 -3.711 0.856 1.001 1.00 0.23 H new ATOM 0 HD21 LEU A 262 -6.330 1.182 -0.586 1.00 0.34 H new ATOM 0 HD22 LEU A 262 -6.085 -0.040 0.685 1.00 0.34 H new ATOM 0 HD23 LEU A 262 -7.450 1.097 0.794 1.00 0.34 H new ATOM 263 N GLY A 263 -6.493 0.983 5.599 1.00 0.11 N ATOM 264 CA GLY A 263 -6.474 0.156 6.784 1.00 0.12 C ATOM 265 C GLY A 263 -5.272 -0.761 6.840 1.00 0.11 C ATOM 266 O GLY A 263 -5.408 -1.951 7.130 1.00 0.14 O ATOM 0 H GLY A 263 -6.027 1.884 5.700 1.00 0.11 H new ATOM 0 HA2 GLY A 263 -6.479 0.795 7.667 1.00 0.12 H new ATOM 0 HA3 GLY A 263 -7.384 -0.443 6.818 1.00 0.12 H new ATOM 270 N ILE A 264 -4.093 -0.218 6.561 1.00 0.09 N ATOM 271 CA ILE A 264 -2.865 -1.006 6.585 1.00 0.09 C ATOM 272 C ILE A 264 -1.681 -0.175 7.062 1.00 0.08 C ATOM 273 O ILE A 264 -1.637 1.047 6.867 1.00 0.11 O ATOM 274 CB ILE A 264 -2.515 -1.593 5.194 1.00 0.12 C ATOM 275 CG1 ILE A 264 -2.812 -0.577 4.089 1.00 0.14 C ATOM 276 CG2 ILE A 264 -3.269 -2.893 4.950 1.00 0.17 C ATOM 277 CD1 ILE A 264 -2.244 -0.961 2.741 1.00 0.18 C ATOM 0 H ILE A 264 -3.961 0.763 6.316 1.00 0.09 H new ATOM 0 HA ILE A 264 -3.052 -1.824 7.280 1.00 0.09 H new ATOM 0 HB ILE A 264 -1.448 -1.813 5.176 1.00 0.12 H new ATOM 0 HG12 ILE A 264 -3.892 -0.458 3.998 1.00 0.14 H new ATOM 0 HG13 ILE A 264 -2.408 0.392 4.381 1.00 0.14 H new ATOM 0 HG21 ILE A 264 -3.007 -3.286 3.968 1.00 0.17 H new ATOM 0 HG22 ILE A 264 -2.998 -3.620 5.716 1.00 0.17 H new ATOM 0 HG23 ILE A 264 -4.342 -2.705 4.992 1.00 0.17 H new ATOM 0 HD11 ILE A 264 -2.495 -0.194 2.009 1.00 0.18 H new ATOM 0 HD12 ILE A 264 -1.160 -1.052 2.815 1.00 0.18 H new ATOM 0 HD13 ILE A 264 -2.667 -1.915 2.426 1.00 0.18 H new ATOM 289 N SER A 265 -0.734 -0.847 7.705 1.00 0.09 N ATOM 290 CA SER A 265 0.472 -0.202 8.189 1.00 0.12 C ATOM 291 C SER A 265 1.604 -0.456 7.204 1.00 0.11 C ATOM 292 O SER A 265 1.902 -1.607 6.865 1.00 0.19 O ATOM 293 CB SER A 265 0.840 -0.723 9.581 1.00 0.20 C ATOM 294 OG SER A 265 0.704 -2.133 9.662 1.00 1.00 O ATOM 0 H SER A 265 -0.783 -1.846 7.903 1.00 0.09 H new ATOM 0 HA SER A 265 0.300 0.871 8.270 1.00 0.12 H new ATOM 0 HB2 SER A 265 1.866 -0.441 9.816 1.00 0.20 H new ATOM 0 HB3 SER A 265 0.201 -0.251 10.328 1.00 0.20 H new ATOM 0 HG SER A 265 0.178 -2.366 10.455 1.00 1.00 H new ATOM 300 N ILE A 266 2.220 0.611 6.728 1.00 0.10 N ATOM 301 CA ILE A 266 3.299 0.496 5.760 1.00 0.11 C ATOM 302 C ILE A 266 4.647 0.362 6.462 1.00 0.13 C ATOM 303 O ILE A 266 5.135 1.305 7.084 1.00 0.28 O ATOM 304 CB ILE A 266 3.336 1.705 4.800 1.00 0.13 C ATOM 305 CG1 ILE A 266 1.917 2.191 4.459 1.00 0.14 C ATOM 306 CG2 ILE A 266 4.091 1.341 3.531 1.00 0.19 C ATOM 307 CD1 ILE A 266 1.045 1.133 3.823 1.00 0.16 C ATOM 0 H ILE A 266 1.992 1.569 6.996 1.00 0.10 H new ATOM 0 HA ILE A 266 3.107 -0.403 5.175 1.00 0.11 H new ATOM 0 HB ILE A 266 3.856 2.521 5.302 1.00 0.13 H new ATOM 0 HG12 ILE A 266 1.436 2.545 5.371 1.00 0.14 H new ATOM 0 HG13 ILE A 266 1.988 3.044 3.784 1.00 0.14 H new ATOM 0 HG21 ILE A 266 4.111 2.200 2.861 1.00 0.19 H new ATOM 0 HG22 ILE A 266 5.112 1.054 3.784 1.00 0.19 H new ATOM 0 HG23 ILE A 266 3.592 0.507 3.037 1.00 0.19 H new ATOM 0 HD11 ILE A 266 0.061 1.551 3.612 1.00 0.16 H new ATOM 0 HD12 ILE A 266 1.503 0.795 2.893 1.00 0.16 H new ATOM 0 HD13 ILE A 266 0.942 0.289 4.504 1.00 0.16 H new ATOM 319 N VAL A 267 5.244 -0.815 6.357 1.00 0.12 N ATOM 320 CA VAL A 267 6.530 -1.079 6.982 1.00 0.14 C ATOM 321 C VAL A 267 7.644 -1.118 5.943 1.00 0.14 C ATOM 322 O VAL A 267 7.709 -2.033 5.121 1.00 0.23 O ATOM 323 CB VAL A 267 6.513 -2.411 7.765 1.00 0.24 C ATOM 324 CG1 VAL A 267 7.886 -2.714 8.354 1.00 0.29 C ATOM 325 CG2 VAL A 267 5.458 -2.372 8.859 1.00 0.31 C ATOM 0 H VAL A 267 4.856 -1.606 5.842 1.00 0.12 H new ATOM 0 HA VAL A 267 6.720 -0.264 7.680 1.00 0.14 H new ATOM 0 HB VAL A 267 6.260 -3.211 7.069 1.00 0.24 H new ATOM 0 HG11 VAL A 267 7.848 -3.656 8.900 1.00 0.29 H new ATOM 0 HG12 VAL A 267 8.618 -2.790 7.550 1.00 0.29 H new ATOM 0 HG13 VAL A 267 8.175 -1.912 9.034 1.00 0.29 H new ATOM 0 HG21 VAL A 267 5.460 -3.318 9.400 1.00 0.31 H new ATOM 0 HG22 VAL A 267 5.680 -1.558 9.550 1.00 0.31 H new ATOM 0 HG23 VAL A 267 4.477 -2.211 8.413 1.00 0.31 H new ATOM 335 N GLY A 268 8.510 -0.117 5.973 1.00 0.17 N ATOM 336 CA GLY A 268 9.613 -0.063 5.039 1.00 0.23 C ATOM 337 C GLY A 268 10.869 -0.662 5.634 1.00 0.23 C ATOM 338 O GLY A 268 11.362 -0.189 6.660 1.00 0.37 O ATOM 0 H GLY A 268 8.468 0.662 6.631 1.00 0.17 H new ATOM 0 HA2 GLY A 268 9.348 -0.600 4.129 1.00 0.23 H new ATOM 0 HA3 GLY A 268 9.801 0.972 4.755 1.00 0.23 H new ATOM 342 N GLN A 269 11.380 -1.709 5.006 1.00 0.27 N ATOM 343 CA GLN A 269 12.581 -2.368 5.494 1.00 0.34 C ATOM 344 C GLN A 269 13.809 -1.505 5.228 1.00 0.38 C ATOM 345 O GLN A 269 14.384 -1.534 4.140 1.00 0.50 O ATOM 346 CB GLN A 269 12.742 -3.742 4.843 1.00 0.49 C ATOM 347 CG GLN A 269 13.772 -4.625 5.533 1.00 0.67 C ATOM 348 CD GLN A 269 13.687 -6.072 5.094 1.00 1.19 C ATOM 349 OE1 GLN A 269 12.952 -6.868 5.679 1.00 1.81 O ATOM 350 NE2 GLN A 269 14.437 -6.429 4.062 1.00 1.87 N ATOM 0 H GLN A 269 10.984 -2.120 4.161 1.00 0.27 H new ATOM 0 HA GLN A 269 12.483 -2.507 6.571 1.00 0.34 H new ATOM 0 HB2 GLN A 269 11.778 -4.252 4.846 1.00 0.49 H new ATOM 0 HB3 GLN A 269 13.029 -3.609 3.800 1.00 0.49 H new ATOM 0 HG2 GLN A 269 14.771 -4.244 5.323 1.00 0.67 H new ATOM 0 HG3 GLN A 269 13.630 -4.568 6.612 1.00 0.67 H new ATOM 0 HE21 GLN A 269 15.034 -5.741 3.603 1.00 1.87 H new ATOM 0 HE22 GLN A 269 14.418 -7.392 3.727 1.00 1.87 H new ATOM 359 N SER A 270 14.184 -0.723 6.226 1.00 0.55 N ATOM 360 CA SER A 270 15.332 0.154 6.122 1.00 0.70 C ATOM 361 C SER A 270 16.552 -0.498 6.761 1.00 0.83 C ATOM 362 O SER A 270 16.758 -0.417 7.972 1.00 1.17 O ATOM 363 CB SER A 270 15.025 1.496 6.787 1.00 0.96 C ATOM 364 OG SER A 270 13.722 1.950 6.437 1.00 1.10 O ATOM 0 H SER A 270 13.703 -0.680 7.125 1.00 0.55 H new ATOM 0 HA SER A 270 15.551 0.331 5.069 1.00 0.70 H new ATOM 0 HB2 SER A 270 15.101 1.396 7.870 1.00 0.96 H new ATOM 0 HB3 SER A 270 15.766 2.235 6.483 1.00 0.96 H new ATOM 0 HG SER A 270 13.546 2.809 6.875 1.00 1.10 H new ATOM 370 N ASN A 271 17.342 -1.170 5.941 1.00 0.91 N ATOM 371 CA ASN A 271 18.542 -1.848 6.409 1.00 1.15 C ATOM 372 C ASN A 271 19.754 -0.959 6.160 1.00 1.04 C ATOM 373 O ASN A 271 19.610 0.250 5.972 1.00 1.29 O ATOM 374 CB ASN A 271 18.703 -3.189 5.681 1.00 1.43 C ATOM 375 CG ASN A 271 19.298 -4.270 6.560 1.00 2.09 C ATOM 376 OD1 ASN A 271 19.981 -3.986 7.545 1.00 2.75 O ATOM 377 ND2 ASN A 271 19.042 -5.519 6.207 1.00 2.37 N ATOM 0 H ASN A 271 17.173 -1.262 4.939 1.00 0.91 H new ATOM 0 HA ASN A 271 18.457 -2.043 7.478 1.00 1.15 H new ATOM 0 HB2 ASN A 271 17.730 -3.518 5.318 1.00 1.43 H new ATOM 0 HB3 ASN A 271 19.339 -3.048 4.807 1.00 1.43 H new ATOM 0 HD21 ASN A 271 19.415 -6.292 6.759 1.00 2.37 H new ATOM 0 HD22 ASN A 271 18.471 -5.709 5.383 1.00 2.37 H new ATOM 384 N ASP A 272 20.943 -1.548 6.141 1.00 1.04 N ATOM 385 CA ASP A 272 22.171 -0.791 5.893 1.00 1.02 C ATOM 386 C ASP A 272 22.180 -0.255 4.464 1.00 1.00 C ATOM 387 O ASP A 272 22.878 0.708 4.151 1.00 1.14 O ATOM 388 CB ASP A 272 23.405 -1.665 6.129 1.00 1.26 C ATOM 389 CG ASP A 272 23.584 -2.724 5.058 1.00 1.61 C ATOM 390 OD1 ASP A 272 22.712 -3.612 4.946 1.00 2.08 O ATOM 391 OD2 ASP A 272 24.594 -2.676 4.330 1.00 1.91 O ATOM 0 H ASP A 272 21.087 -2.546 6.294 1.00 1.04 H new ATOM 0 HA ASP A 272 22.201 0.047 6.589 1.00 1.02 H new ATOM 0 HB2 ASP A 272 24.292 -1.033 6.161 1.00 1.26 H new ATOM 0 HB3 ASP A 272 23.322 -2.148 7.102 1.00 1.26 H new ATOM 396 N ARG A 273 21.392 -0.894 3.608 1.00 1.07 N ATOM 397 CA ARG A 273 21.274 -0.498 2.210 1.00 1.28 C ATOM 398 C ARG A 273 20.325 0.692 2.078 1.00 1.10 C ATOM 399 O ARG A 273 20.329 1.400 1.071 1.00 1.41 O ATOM 400 CB ARG A 273 20.759 -1.679 1.375 1.00 1.59 C ATOM 401 CG ARG A 273 21.375 -1.773 -0.013 1.00 1.84 C ATOM 402 CD ARG A 273 20.712 -0.818 -0.995 1.00 1.60 C ATOM 403 NE ARG A 273 21.308 -0.908 -2.327 1.00 1.78 N ATOM 404 CZ ARG A 273 20.606 -1.042 -3.453 1.00 2.01 C ATOM 405 NH1 ARG A 273 19.277 -1.012 -3.422 1.00 1.92 N ATOM 406 NH2 ARG A 273 21.236 -1.168 -4.619 1.00 2.63 N ATOM 0 H ARG A 273 20.819 -1.698 3.862 1.00 1.07 H new ATOM 0 HA ARG A 273 22.257 -0.204 1.841 1.00 1.28 H new ATOM 0 HB2 ARG A 273 20.959 -2.605 1.913 1.00 1.59 H new ATOM 0 HB3 ARG A 273 19.677 -1.595 1.276 1.00 1.59 H new ATOM 0 HG2 ARG A 273 22.440 -1.550 0.047 1.00 1.84 H new ATOM 0 HG3 ARG A 273 21.283 -2.794 -0.382 1.00 1.84 H new ATOM 0 HD2 ARG A 273 19.647 -1.042 -1.057 1.00 1.60 H new ATOM 0 HD3 ARG A 273 20.801 0.203 -0.625 1.00 1.60 H new ATOM 0 HE ARG A 273 22.325 -0.866 -2.400 1.00 1.78 H new ATOM 0 HH11 ARG A 273 18.790 -0.886 -2.535 1.00 1.92 H new ATOM 0 HH12 ARG A 273 18.744 -1.115 -4.286 1.00 1.92 H new ATOM 0 HH21 ARG A 273 22.255 -1.162 -4.651 1.00 2.63 H new ATOM 0 HH22 ARG A 273 20.699 -1.271 -5.480 1.00 2.63 H new ATOM 420 N GLY A 274 19.525 0.915 3.110 1.00 0.89 N ATOM 421 CA GLY A 274 18.575 2.006 3.092 1.00 0.89 C ATOM 422 C GLY A 274 17.247 1.581 2.508 1.00 0.72 C ATOM 423 O GLY A 274 16.304 1.279 3.244 1.00 0.97 O ATOM 0 H GLY A 274 19.518 0.356 3.963 1.00 0.89 H new ATOM 0 HA2 GLY A 274 18.425 2.375 4.107 1.00 0.89 H new ATOM 0 HA3 GLY A 274 18.981 2.833 2.509 1.00 0.89 H new ATOM 427 N ASP A 275 17.173 1.541 1.186 1.00 0.65 N ATOM 428 CA ASP A 275 15.952 1.135 0.508 1.00 0.66 C ATOM 429 C ASP A 275 15.838 -0.379 0.525 1.00 0.69 C ATOM 430 O ASP A 275 16.843 -1.091 0.501 1.00 1.44 O ATOM 431 CB ASP A 275 15.921 1.652 -0.936 1.00 0.91 C ATOM 432 CG ASP A 275 16.913 0.942 -1.841 1.00 1.10 C ATOM 433 OD1 ASP A 275 18.126 1.230 -1.745 1.00 1.75 O ATOM 434 OD2 ASP A 275 16.482 0.102 -2.662 1.00 1.53 O ATOM 0 H ASP A 275 17.943 1.784 0.563 1.00 0.65 H new ATOM 0 HA ASP A 275 15.104 1.569 1.037 1.00 0.66 H new ATOM 0 HB2 ASP A 275 14.916 1.528 -1.339 1.00 0.91 H new ATOM 0 HB3 ASP A 275 16.136 2.721 -0.938 1.00 0.91 H new ATOM 439 N GLY A 276 14.617 -0.862 0.603 1.00 0.48 N ATOM 440 CA GLY A 276 14.386 -2.291 0.629 1.00 0.43 C ATOM 441 C GLY A 276 13.010 -2.640 0.122 1.00 0.37 C ATOM 442 O GLY A 276 12.818 -3.662 -0.535 1.00 0.52 O ATOM 0 H GLY A 276 13.773 -0.291 0.649 1.00 0.48 H new ATOM 0 HA2 GLY A 276 15.137 -2.793 0.019 1.00 0.43 H new ATOM 0 HA3 GLY A 276 14.504 -2.661 1.648 1.00 0.43 H new ATOM 446 N GLY A 277 12.050 -1.784 0.431 1.00 0.30 N ATOM 447 CA GLY A 277 10.693 -2.009 0.001 1.00 0.29 C ATOM 448 C GLY A 277 9.711 -1.818 1.128 1.00 0.24 C ATOM 449 O GLY A 277 10.068 -1.958 2.302 1.00 0.27 O ATOM 0 H GLY A 277 12.191 -0.933 0.975 1.00 0.30 H new ATOM 0 HA2 GLY A 277 10.451 -1.325 -0.812 1.00 0.29 H new ATOM 0 HA3 GLY A 277 10.600 -3.020 -0.395 1.00 0.29 H new ATOM 453 N ILE A 278 8.483 -1.479 0.780 1.00 0.21 N ATOM 454 CA ILE A 278 7.443 -1.271 1.770 1.00 0.19 C ATOM 455 C ILE A 278 6.522 -2.483 1.826 1.00 0.18 C ATOM 456 O ILE A 278 5.908 -2.861 0.826 1.00 0.23 O ATOM 457 CB ILE A 278 6.627 0.008 1.483 1.00 0.20 C ATOM 458 CG1 ILE A 278 6.326 0.146 -0.014 1.00 0.23 C ATOM 459 CG2 ILE A 278 7.385 1.229 1.986 1.00 0.23 C ATOM 460 CD1 ILE A 278 5.338 1.248 -0.336 1.00 0.27 C ATOM 0 H ILE A 278 8.181 -1.342 -0.185 1.00 0.21 H new ATOM 0 HA ILE A 278 7.928 -1.142 2.738 1.00 0.19 H new ATOM 0 HB ILE A 278 5.676 -0.065 2.010 1.00 0.20 H new ATOM 0 HG12 ILE A 278 7.257 0.338 -0.547 1.00 0.23 H new ATOM 0 HG13 ILE A 278 5.935 -0.801 -0.386 1.00 0.23 H new ATOM 0 HG21 ILE A 278 6.804 2.128 1.780 1.00 0.23 H new ATOM 0 HG22 ILE A 278 7.547 1.139 3.060 1.00 0.23 H new ATOM 0 HG23 ILE A 278 8.347 1.295 1.478 1.00 0.23 H new ATOM 0 HD11 ILE A 278 5.174 1.286 -1.413 1.00 0.27 H new ATOM 0 HD12 ILE A 278 4.393 1.048 0.168 1.00 0.27 H new ATOM 0 HD13 ILE A 278 5.736 2.204 0.005 1.00 0.27 H new ATOM 472 N TYR A 279 6.455 -3.101 2.993 1.00 0.15 N ATOM 473 CA TYR A 279 5.635 -4.285 3.193 1.00 0.16 C ATOM 474 C TYR A 279 4.434 -3.979 4.073 1.00 0.15 C ATOM 475 O TYR A 279 4.420 -2.993 4.811 1.00 0.18 O ATOM 476 CB TYR A 279 6.457 -5.398 3.850 1.00 0.19 C ATOM 477 CG TYR A 279 7.704 -5.790 3.089 1.00 0.24 C ATOM 478 CD1 TYR A 279 8.912 -5.144 3.320 1.00 0.42 C ATOM 479 CD2 TYR A 279 7.678 -6.809 2.145 1.00 0.44 C ATOM 480 CE1 TYR A 279 10.057 -5.505 2.636 1.00 0.55 C ATOM 481 CE2 TYR A 279 8.819 -7.172 1.456 1.00 0.57 C ATOM 482 CZ TYR A 279 10.003 -6.518 1.704 1.00 0.55 C ATOM 483 OH TYR A 279 11.141 -6.880 1.023 1.00 0.72 O ATOM 0 H TYR A 279 6.964 -2.799 3.824 1.00 0.15 H new ATOM 0 HA TYR A 279 5.285 -4.610 2.213 1.00 0.16 H new ATOM 0 HB2 TYR A 279 6.744 -5.078 4.852 1.00 0.19 H new ATOM 0 HB3 TYR A 279 5.825 -6.279 3.966 1.00 0.19 H new ATOM 0 HD1 TYR A 279 8.957 -4.346 4.046 1.00 0.42 H new ATOM 0 HD2 TYR A 279 6.751 -7.326 1.947 1.00 0.44 H new ATOM 0 HE1 TYR A 279 10.989 -4.996 2.831 1.00 0.55 H new ATOM 0 HE2 TYR A 279 8.781 -7.966 0.725 1.00 0.57 H new ATOM 0 HH TYR A 279 10.933 -7.610 0.404 1.00 0.72 H new ATOM 493 N ILE A 280 3.426 -4.830 3.979 1.00 0.16 N ATOM 494 CA ILE A 280 2.225 -4.688 4.780 1.00 0.16 C ATOM 495 C ILE A 280 2.482 -5.233 6.177 1.00 0.17 C ATOM 496 O ILE A 280 2.702 -6.431 6.346 1.00 0.21 O ATOM 497 CB ILE A 280 1.033 -5.444 4.155 1.00 0.19 C ATOM 498 CG1 ILE A 280 0.786 -4.975 2.717 1.00 0.21 C ATOM 499 CG2 ILE A 280 -0.224 -5.263 4.999 1.00 0.21 C ATOM 500 CD1 ILE A 280 0.412 -3.513 2.607 1.00 0.24 C ATOM 0 H ILE A 280 3.418 -5.633 3.350 1.00 0.16 H new ATOM 0 HA ILE A 280 1.973 -3.628 4.824 1.00 0.16 H new ATOM 0 HB ILE A 280 1.281 -6.505 4.132 1.00 0.19 H new ATOM 0 HG12 ILE A 280 1.684 -5.156 2.126 1.00 0.21 H new ATOM 0 HG13 ILE A 280 -0.010 -5.578 2.280 1.00 0.21 H new ATOM 0 HG21 ILE A 280 -1.051 -5.804 4.540 1.00 0.21 H new ATOM 0 HG22 ILE A 280 -0.048 -5.652 6.002 1.00 0.21 H new ATOM 0 HG23 ILE A 280 -0.472 -4.203 5.059 1.00 0.21 H new ATOM 0 HD11 ILE A 280 0.253 -3.256 1.560 1.00 0.24 H new ATOM 0 HD12 ILE A 280 -0.504 -3.328 3.169 1.00 0.24 H new ATOM 0 HD13 ILE A 280 1.217 -2.900 3.013 1.00 0.24 H new ATOM 512 N GLY A 281 2.489 -4.353 7.164 1.00 0.20 N ATOM 513 CA GLY A 281 2.725 -4.783 8.529 1.00 0.23 C ATOM 514 C GLY A 281 1.536 -5.518 9.113 1.00 0.24 C ATOM 515 O GLY A 281 1.660 -6.652 9.576 1.00 0.42 O ATOM 0 H GLY A 281 2.336 -3.351 7.048 1.00 0.20 H new ATOM 0 HA2 GLY A 281 3.600 -5.432 8.557 1.00 0.23 H new ATOM 0 HA3 GLY A 281 2.952 -3.915 9.147 1.00 0.23 H new ATOM 519 N SER A 282 0.381 -4.872 9.087 1.00 0.25 N ATOM 520 CA SER A 282 -0.837 -5.464 9.610 1.00 0.29 C ATOM 521 C SER A 282 -2.051 -4.874 8.908 1.00 0.26 C ATOM 522 O SER A 282 -1.981 -3.771 8.363 1.00 0.30 O ATOM 523 CB SER A 282 -0.927 -5.223 11.118 1.00 0.35 C ATOM 524 OG SER A 282 -0.515 -3.905 11.445 1.00 0.75 O ATOM 0 H SER A 282 0.263 -3.933 8.707 1.00 0.25 H new ATOM 0 HA SER A 282 -0.817 -6.538 9.425 1.00 0.29 H new ATOM 0 HB2 SER A 282 -1.951 -5.383 11.455 1.00 0.35 H new ATOM 0 HB3 SER A 282 -0.302 -5.945 11.644 1.00 0.35 H new ATOM 0 HG SER A 282 -0.582 -3.772 12.414 1.00 0.75 H new ATOM 530 N ILE A 283 -3.147 -5.614 8.916 1.00 0.24 N ATOM 531 CA ILE A 283 -4.380 -5.166 8.290 1.00 0.23 C ATOM 532 C ILE A 283 -5.395 -4.770 9.355 1.00 0.23 C ATOM 533 O ILE A 283 -5.557 -5.469 10.358 1.00 0.30 O ATOM 534 CB ILE A 283 -4.989 -6.261 7.387 1.00 0.27 C ATOM 535 CG1 ILE A 283 -3.927 -6.821 6.437 1.00 0.32 C ATOM 536 CG2 ILE A 283 -6.174 -5.710 6.600 1.00 0.29 C ATOM 537 CD1 ILE A 283 -4.353 -8.088 5.730 1.00 0.53 C ATOM 0 H ILE A 283 -3.208 -6.534 9.352 1.00 0.24 H new ATOM 0 HA ILE A 283 -4.138 -4.303 7.669 1.00 0.23 H new ATOM 0 HB ILE A 283 -5.347 -7.071 8.022 1.00 0.27 H new ATOM 0 HG12 ILE A 283 -3.683 -6.064 5.692 1.00 0.32 H new ATOM 0 HG13 ILE A 283 -3.015 -7.019 7.001 1.00 0.32 H new ATOM 0 HG21 ILE A 283 -6.589 -6.496 5.970 1.00 0.29 H new ATOM 0 HG22 ILE A 283 -6.939 -5.358 7.292 1.00 0.29 H new ATOM 0 HG23 ILE A 283 -5.842 -4.881 5.975 1.00 0.29 H new ATOM 0 HD11 ILE A 283 -3.551 -8.426 5.074 1.00 0.53 H new ATOM 0 HD12 ILE A 283 -4.569 -8.861 6.467 1.00 0.53 H new ATOM 0 HD13 ILE A 283 -5.247 -7.891 5.138 1.00 0.53 H new ATOM 549 N MET A 284 -6.055 -3.645 9.143 1.00 0.20 N ATOM 550 CA MET A 284 -7.052 -3.150 10.078 1.00 0.21 C ATOM 551 C MET A 284 -8.450 -3.541 9.617 1.00 0.22 C ATOM 552 O MET A 284 -8.784 -3.408 8.438 1.00 0.23 O ATOM 553 CB MET A 284 -6.942 -1.626 10.218 1.00 0.24 C ATOM 554 CG MET A 284 -5.677 -1.166 10.924 1.00 0.35 C ATOM 555 SD MET A 284 -5.487 -1.891 12.568 1.00 0.54 S ATOM 556 CE MET A 284 -4.112 -3.004 12.285 1.00 0.74 C ATOM 0 H MET A 284 -5.917 -3.052 8.325 1.00 0.20 H new ATOM 0 HA MET A 284 -6.869 -3.602 11.053 1.00 0.21 H new ATOM 0 HB2 MET A 284 -6.978 -1.176 9.226 1.00 0.24 H new ATOM 0 HB3 MET A 284 -7.808 -1.257 10.767 1.00 0.24 H new ATOM 0 HG2 MET A 284 -4.812 -1.427 10.315 1.00 0.35 H new ATOM 0 HG3 MET A 284 -5.690 -0.080 11.011 1.00 0.35 H new ATOM 0 HE1 MET A 284 -4.310 -3.958 12.773 1.00 0.74 H new ATOM 0 HE2 MET A 284 -3.987 -3.163 11.214 1.00 0.74 H new ATOM 0 HE3 MET A 284 -3.201 -2.569 12.696 1.00 0.74 H new ATOM 566 N LYS A 285 -9.257 -4.028 10.549 1.00 0.28 N ATOM 567 CA LYS A 285 -10.617 -4.444 10.244 1.00 0.33 C ATOM 568 C LYS A 285 -11.480 -3.224 9.940 1.00 0.33 C ATOM 569 O LYS A 285 -11.402 -2.210 10.633 1.00 0.46 O ATOM 570 CB LYS A 285 -11.201 -5.239 11.415 1.00 0.43 C ATOM 571 CG LYS A 285 -12.427 -6.062 11.051 1.00 0.49 C ATOM 572 CD LYS A 285 -12.106 -7.127 10.012 1.00 0.63 C ATOM 573 CE LYS A 285 -13.252 -8.111 9.857 1.00 0.83 C ATOM 574 NZ LYS A 285 -13.178 -8.862 8.575 1.00 1.01 N ATOM 0 H LYS A 285 -8.991 -4.145 11.527 1.00 0.28 H new ATOM 0 HA LYS A 285 -10.603 -5.087 9.364 1.00 0.33 H new ATOM 0 HB2 LYS A 285 -10.433 -5.904 11.809 1.00 0.43 H new ATOM 0 HB3 LYS A 285 -11.464 -4.547 12.215 1.00 0.43 H new ATOM 0 HG2 LYS A 285 -12.825 -6.537 11.948 1.00 0.49 H new ATOM 0 HG3 LYS A 285 -13.206 -5.403 10.667 1.00 0.49 H new ATOM 0 HD2 LYS A 285 -11.900 -6.652 9.053 1.00 0.63 H new ATOM 0 HD3 LYS A 285 -11.202 -7.662 10.304 1.00 0.63 H new ATOM 0 HE2 LYS A 285 -13.240 -8.814 10.689 1.00 0.83 H new ATOM 0 HE3 LYS A 285 -14.199 -7.574 9.907 1.00 0.83 H new ATOM 0 HZ1 LYS A 285 -13.980 -9.522 8.512 1.00 1.01 H new ATOM 0 HZ2 LYS A 285 -13.216 -8.194 7.779 1.00 1.01 H new ATOM 0 HZ3 LYS A 285 -12.286 -9.396 8.537 1.00 1.01 H new ATOM 588 N GLY A 286 -12.287 -3.323 8.892 1.00 0.33 N ATOM 589 CA GLY A 286 -13.140 -2.218 8.505 1.00 0.35 C ATOM 590 C GLY A 286 -12.531 -1.399 7.386 1.00 0.30 C ATOM 591 O GLY A 286 -13.188 -0.529 6.805 1.00 0.36 O ATOM 0 H GLY A 286 -12.366 -4.151 8.302 1.00 0.33 H new ATOM 0 HA2 GLY A 286 -14.110 -2.602 8.188 1.00 0.35 H new ATOM 0 HA3 GLY A 286 -13.318 -1.577 9.369 1.00 0.35 H new ATOM 595 N GLY A 287 -11.267 -1.671 7.090 1.00 0.26 N ATOM 596 CA GLY A 287 -10.582 -0.963 6.032 1.00 0.24 C ATOM 597 C GLY A 287 -10.893 -1.539 4.666 1.00 0.22 C ATOM 598 O GLY A 287 -11.595 -2.548 4.553 1.00 0.24 O ATOM 0 H GLY A 287 -10.703 -2.374 7.568 1.00 0.26 H new ATOM 0 HA2 GLY A 287 -10.869 0.088 6.055 1.00 0.24 H new ATOM 0 HA3 GLY A 287 -9.507 -1.004 6.206 1.00 0.24 H new ATOM 602 N ALA A 288 -10.373 -0.905 3.630 1.00 0.21 N ATOM 603 CA ALA A 288 -10.598 -1.356 2.266 1.00 0.22 C ATOM 604 C ALA A 288 -9.898 -2.686 2.005 1.00 0.22 C ATOM 605 O ALA A 288 -10.438 -3.558 1.325 1.00 0.25 O ATOM 606 CB ALA A 288 -10.128 -0.300 1.277 1.00 0.24 C ATOM 0 H ALA A 288 -9.789 -0.072 3.707 1.00 0.21 H new ATOM 0 HA ALA A 288 -11.669 -1.510 2.130 1.00 0.22 H new ATOM 0 HB1 ALA A 288 -10.302 -0.651 0.260 1.00 0.24 H new ATOM 0 HB2 ALA A 288 -10.681 0.625 1.442 1.00 0.24 H new ATOM 0 HB3 ALA A 288 -9.063 -0.116 1.420 1.00 0.24 H new ATOM 612 N VAL A 289 -8.705 -2.843 2.569 1.00 0.20 N ATOM 613 CA VAL A 289 -7.925 -4.064 2.390 1.00 0.21 C ATOM 614 C VAL A 289 -8.585 -5.251 3.089 1.00 0.23 C ATOM 615 O VAL A 289 -8.529 -6.384 2.607 1.00 0.26 O ATOM 616 CB VAL A 289 -6.488 -3.889 2.924 1.00 0.20 C ATOM 617 CG1 VAL A 289 -5.661 -5.149 2.699 1.00 0.23 C ATOM 618 CG2 VAL A 289 -5.821 -2.691 2.271 1.00 0.20 C ATOM 0 H VAL A 289 -8.256 -2.139 3.155 1.00 0.20 H new ATOM 0 HA VAL A 289 -7.884 -4.264 1.319 1.00 0.21 H new ATOM 0 HB VAL A 289 -6.547 -3.713 3.998 1.00 0.20 H new ATOM 0 HG11 VAL A 289 -4.653 -4.996 3.085 1.00 0.23 H new ATOM 0 HG12 VAL A 289 -6.126 -5.987 3.219 1.00 0.23 H new ATOM 0 HG13 VAL A 289 -5.612 -5.366 1.632 1.00 0.23 H new ATOM 0 HG21 VAL A 289 -4.808 -2.582 2.659 1.00 0.20 H new ATOM 0 HG22 VAL A 289 -5.782 -2.840 1.192 1.00 0.20 H new ATOM 0 HG23 VAL A 289 -6.393 -1.790 2.493 1.00 0.20 H new ATOM 628 N ALA A 290 -9.238 -4.978 4.211 1.00 0.23 N ATOM 629 CA ALA A 290 -9.909 -6.016 4.985 1.00 0.27 C ATOM 630 C ALA A 290 -11.072 -6.632 4.211 1.00 0.29 C ATOM 631 O ALA A 290 -11.491 -7.756 4.491 1.00 0.37 O ATOM 632 CB ALA A 290 -10.394 -5.447 6.309 1.00 0.29 C ATOM 0 H ALA A 290 -9.318 -4.042 4.608 1.00 0.23 H new ATOM 0 HA ALA A 290 -9.187 -6.810 5.179 1.00 0.27 H new ATOM 0 HB1 ALA A 290 -10.894 -6.229 6.880 1.00 0.29 H new ATOM 0 HB2 ALA A 290 -9.543 -5.071 6.877 1.00 0.29 H new ATOM 0 HB3 ALA A 290 -11.093 -4.632 6.121 1.00 0.29 H new ATOM 638 N ALA A 291 -11.583 -5.897 3.232 1.00 0.29 N ATOM 639 CA ALA A 291 -12.700 -6.370 2.423 1.00 0.32 C ATOM 640 C ALA A 291 -12.220 -7.244 1.266 1.00 0.32 C ATOM 641 O ALA A 291 -13.012 -7.962 0.654 1.00 0.41 O ATOM 642 CB ALA A 291 -13.511 -5.193 1.902 1.00 0.38 C ATOM 0 H ALA A 291 -11.242 -4.970 2.978 1.00 0.29 H new ATOM 0 HA ALA A 291 -13.338 -6.983 3.059 1.00 0.32 H new ATOM 0 HB1 ALA A 291 -14.341 -5.561 1.300 1.00 0.38 H new ATOM 0 HB2 ALA A 291 -13.899 -4.618 2.743 1.00 0.38 H new ATOM 0 HB3 ALA A 291 -12.874 -4.555 1.290 1.00 0.38 H new ATOM 648 N ASP A 292 -10.925 -7.192 0.981 1.00 0.31 N ATOM 649 CA ASP A 292 -10.358 -7.978 -0.109 1.00 0.32 C ATOM 650 C ASP A 292 -10.010 -9.387 0.358 1.00 0.30 C ATOM 651 O ASP A 292 -10.702 -10.349 0.020 1.00 0.38 O ATOM 652 CB ASP A 292 -9.119 -7.298 -0.681 1.00 0.37 C ATOM 653 CG ASP A 292 -8.712 -7.902 -2.006 1.00 0.43 C ATOM 654 OD1 ASP A 292 -7.966 -8.902 -2.002 1.00 0.45 O ATOM 655 OD2 ASP A 292 -9.156 -7.395 -3.053 1.00 0.55 O ATOM 0 H ASP A 292 -10.250 -6.617 1.486 1.00 0.31 H new ATOM 0 HA ASP A 292 -11.112 -8.048 -0.893 1.00 0.32 H new ATOM 0 HB2 ASP A 292 -9.315 -6.234 -0.811 1.00 0.37 H new ATOM 0 HB3 ASP A 292 -8.295 -7.386 0.028 1.00 0.37 H new ATOM 660 N GLY A 293 -8.934 -9.510 1.125 1.00 0.29 N ATOM 661 CA GLY A 293 -8.538 -10.806 1.638 1.00 0.33 C ATOM 662 C GLY A 293 -7.335 -11.411 0.933 1.00 0.33 C ATOM 663 O GLY A 293 -6.729 -12.348 1.450 1.00 0.39 O ATOM 0 H GLY A 293 -8.329 -8.736 1.400 1.00 0.29 H new ATOM 0 HA2 GLY A 293 -8.313 -10.711 2.700 1.00 0.33 H new ATOM 0 HA3 GLY A 293 -9.380 -11.492 1.550 1.00 0.33 H new ATOM 667 N ARG A 294 -6.982 -10.893 -0.239 1.00 0.31 N ATOM 668 CA ARG A 294 -5.837 -11.424 -0.978 1.00 0.32 C ATOM 669 C ARG A 294 -4.525 -10.873 -0.422 1.00 0.30 C ATOM 670 O ARG A 294 -3.487 -11.536 -0.477 1.00 0.37 O ATOM 671 CB ARG A 294 -5.963 -11.110 -2.471 1.00 0.35 C ATOM 672 CG ARG A 294 -7.017 -11.952 -3.176 1.00 0.41 C ATOM 673 CD ARG A 294 -7.337 -11.413 -4.558 1.00 0.44 C ATOM 674 NE ARG A 294 -8.084 -10.160 -4.498 1.00 0.43 N ATOM 675 CZ ARG A 294 -8.845 -9.696 -5.489 1.00 0.54 C ATOM 676 NH1 ARG A 294 -8.963 -10.370 -6.630 1.00 0.68 N ATOM 677 NH2 ARG A 294 -9.482 -8.546 -5.341 1.00 0.58 N ATOM 0 H ARG A 294 -7.463 -10.117 -0.694 1.00 0.31 H new ATOM 0 HA ARG A 294 -5.830 -12.507 -0.854 1.00 0.32 H new ATOM 0 HB2 ARG A 294 -6.209 -10.055 -2.594 1.00 0.35 H new ATOM 0 HB3 ARG A 294 -4.998 -11.271 -2.952 1.00 0.35 H new ATOM 0 HG2 ARG A 294 -6.665 -12.980 -3.259 1.00 0.41 H new ATOM 0 HG3 ARG A 294 -7.926 -11.974 -2.575 1.00 0.41 H new ATOM 0 HD2 ARG A 294 -6.410 -11.256 -5.109 1.00 0.44 H new ATOM 0 HD3 ARG A 294 -7.915 -12.153 -5.111 1.00 0.44 H new ATOM 0 HE ARG A 294 -8.019 -9.605 -3.645 1.00 0.43 H new ATOM 0 HH11 ARG A 294 -8.468 -11.253 -6.754 1.00 0.68 H new ATOM 0 HH12 ARG A 294 -9.549 -10.004 -7.380 1.00 0.68 H new ATOM 0 HH21 ARG A 294 -9.389 -8.020 -4.472 1.00 0.58 H new ATOM 0 HH22 ARG A 294 -10.066 -8.186 -6.096 1.00 0.58 H new ATOM 691 N ILE A 295 -4.579 -9.660 0.115 1.00 0.26 N ATOM 692 CA ILE A 295 -3.398 -9.031 0.696 1.00 0.25 C ATOM 693 C ILE A 295 -3.224 -9.495 2.140 1.00 0.25 C ATOM 694 O ILE A 295 -4.200 -9.596 2.885 1.00 0.29 O ATOM 695 CB ILE A 295 -3.495 -7.491 0.650 1.00 0.25 C ATOM 696 CG1 ILE A 295 -3.852 -7.026 -0.766 1.00 0.27 C ATOM 697 CG2 ILE A 295 -2.185 -6.860 1.107 1.00 0.27 C ATOM 698 CD1 ILE A 295 -4.091 -5.536 -0.880 1.00 0.37 C ATOM 0 H ILE A 295 -5.426 -9.093 0.160 1.00 0.26 H new ATOM 0 HA ILE A 295 -2.532 -9.331 0.105 1.00 0.25 H new ATOM 0 HB ILE A 295 -4.284 -7.170 1.330 1.00 0.25 H new ATOM 0 HG12 ILE A 295 -3.047 -7.308 -1.444 1.00 0.27 H new ATOM 0 HG13 ILE A 295 -4.747 -7.554 -1.097 1.00 0.27 H new ATOM 0 HG21 ILE A 295 -2.271 -5.774 1.068 1.00 0.27 H new ATOM 0 HG22 ILE A 295 -1.969 -7.171 2.129 1.00 0.27 H new ATOM 0 HG23 ILE A 295 -1.377 -7.183 0.451 1.00 0.27 H new ATOM 0 HD11 ILE A 295 -4.338 -5.285 -1.911 1.00 0.37 H new ATOM 0 HD12 ILE A 295 -4.917 -5.249 -0.229 1.00 0.37 H new ATOM 0 HD13 ILE A 295 -3.190 -4.999 -0.582 1.00 0.37 H new ATOM 710 N GLU A 296 -1.992 -9.789 2.525 1.00 0.24 N ATOM 711 CA GLU A 296 -1.703 -10.263 3.871 1.00 0.26 C ATOM 712 C GLU A 296 -0.458 -9.579 4.435 1.00 0.24 C ATOM 713 O GLU A 296 0.307 -8.957 3.690 1.00 0.22 O ATOM 714 CB GLU A 296 -1.479 -11.779 3.843 1.00 0.31 C ATOM 715 CG GLU A 296 -0.096 -12.172 3.339 1.00 0.36 C ATOM 716 CD GLU A 296 0.058 -13.660 3.147 1.00 0.49 C ATOM 717 OE1 GLU A 296 -0.342 -14.162 2.080 1.00 0.56 O ATOM 718 OE2 GLU A 296 0.583 -14.335 4.056 1.00 0.69 O ATOM 0 H GLU A 296 -1.173 -9.708 1.923 1.00 0.24 H new ATOM 0 HA GLU A 296 -2.552 -10.022 4.510 1.00 0.26 H new ATOM 0 HB2 GLU A 296 -1.620 -12.179 4.847 1.00 0.31 H new ATOM 0 HB3 GLU A 296 -2.235 -12.240 3.207 1.00 0.31 H new ATOM 0 HG2 GLU A 296 0.097 -11.667 2.393 1.00 0.36 H new ATOM 0 HG3 GLU A 296 0.656 -11.822 4.046 1.00 0.36 H new ATOM 725 N PRO A 297 -0.246 -9.662 5.762 1.00 0.26 N ATOM 726 CA PRO A 297 0.937 -9.084 6.402 1.00 0.27 C ATOM 727 C PRO A 297 2.208 -9.753 5.886 1.00 0.27 C ATOM 728 O PRO A 297 2.449 -10.939 6.135 1.00 0.41 O ATOM 729 CB PRO A 297 0.734 -9.384 7.894 1.00 0.32 C ATOM 730 CG PRO A 297 -0.713 -9.699 8.046 1.00 0.34 C ATOM 731 CD PRO A 297 -1.142 -10.304 6.741 1.00 0.32 C ATOM 0 HA PRO A 297 1.048 -8.019 6.199 1.00 0.27 H new ATOM 0 HB2 PRO A 297 1.353 -10.222 8.213 1.00 0.32 H new ATOM 0 HB3 PRO A 297 1.015 -8.528 8.508 1.00 0.32 H new ATOM 0 HG2 PRO A 297 -0.877 -10.393 8.871 1.00 0.34 H new ATOM 0 HG3 PRO A 297 -1.287 -8.799 8.267 1.00 0.34 H new ATOM 0 HD2 PRO A 297 -1.027 -11.388 6.742 1.00 0.32 H new ATOM 0 HD3 PRO A 297 -2.190 -10.095 6.525 1.00 0.32 H new ATOM 739 N GLY A 298 3.002 -8.999 5.147 1.00 0.27 N ATOM 740 CA GLY A 298 4.224 -9.532 4.587 1.00 0.28 C ATOM 741 C GLY A 298 4.340 -9.219 3.112 1.00 0.25 C ATOM 742 O GLY A 298 5.431 -9.264 2.544 1.00 0.29 O ATOM 0 H GLY A 298 2.821 -8.020 4.923 1.00 0.27 H new ATOM 0 HA2 GLY A 298 5.080 -9.115 5.117 1.00 0.28 H new ATOM 0 HA3 GLY A 298 4.252 -10.612 4.734 1.00 0.28 H new ATOM 746 N ASP A 299 3.209 -8.891 2.493 1.00 0.22 N ATOM 747 CA ASP A 299 3.182 -8.557 1.074 1.00 0.22 C ATOM 748 C ASP A 299 3.887 -7.227 0.837 1.00 0.20 C ATOM 749 O ASP A 299 3.853 -6.341 1.693 1.00 0.21 O ATOM 750 CB ASP A 299 1.739 -8.479 0.559 1.00 0.24 C ATOM 751 CG ASP A 299 1.035 -9.823 0.562 1.00 0.27 C ATOM 752 OD1 ASP A 299 1.719 -10.866 0.629 1.00 0.34 O ATOM 753 OD2 ASP A 299 -0.210 -9.846 0.495 1.00 0.28 O ATOM 0 H ASP A 299 2.300 -8.850 2.953 1.00 0.22 H new ATOM 0 HA ASP A 299 3.702 -9.344 0.528 1.00 0.22 H new ATOM 0 HB2 ASP A 299 1.176 -7.779 1.176 1.00 0.24 H new ATOM 0 HB3 ASP A 299 1.742 -8.079 -0.455 1.00 0.24 H new ATOM 758 N MET A 300 4.524 -7.090 -0.316 1.00 0.21 N ATOM 759 CA MET A 300 5.243 -5.867 -0.650 1.00 0.21 C ATOM 760 C MET A 300 4.450 -5.027 -1.640 1.00 0.19 C ATOM 761 O MET A 300 3.884 -5.552 -2.596 1.00 0.21 O ATOM 762 CB MET A 300 6.617 -6.204 -1.234 1.00 0.27 C ATOM 763 CG MET A 300 7.424 -4.987 -1.654 1.00 0.32 C ATOM 764 SD MET A 300 9.111 -5.403 -2.138 1.00 0.50 S ATOM 765 CE MET A 300 9.610 -3.898 -2.975 1.00 1.26 C ATOM 0 H MET A 300 4.559 -7.810 -1.037 1.00 0.21 H new ATOM 0 HA MET A 300 5.376 -5.289 0.265 1.00 0.21 H new ATOM 0 HB2 MET A 300 7.186 -6.768 -0.495 1.00 0.27 H new ATOM 0 HB3 MET A 300 6.484 -6.855 -2.098 1.00 0.27 H new ATOM 0 HG2 MET A 300 6.923 -4.494 -2.487 1.00 0.32 H new ATOM 0 HG3 MET A 300 7.452 -4.273 -0.831 1.00 0.32 H new ATOM 0 HE1 MET A 300 10.696 -3.874 -3.064 1.00 1.26 H new ATOM 0 HE2 MET A 300 9.164 -3.870 -3.969 1.00 1.26 H new ATOM 0 HE3 MET A 300 9.274 -3.034 -2.402 1.00 1.26 H new ATOM 775 N LEU A 301 4.412 -3.726 -1.403 1.00 0.19 N ATOM 776 CA LEU A 301 3.703 -2.809 -2.280 1.00 0.19 C ATOM 777 C LEU A 301 4.629 -2.335 -3.387 1.00 0.20 C ATOM 778 O LEU A 301 5.704 -1.797 -3.116 1.00 0.24 O ATOM 779 CB LEU A 301 3.187 -1.600 -1.494 1.00 0.23 C ATOM 780 CG LEU A 301 2.087 -1.898 -0.478 1.00 0.33 C ATOM 781 CD1 LEU A 301 2.074 -0.837 0.609 1.00 0.48 C ATOM 782 CD2 LEU A 301 0.731 -1.976 -1.166 1.00 0.47 C ATOM 0 H LEU A 301 4.866 -3.280 -0.606 1.00 0.19 H new ATOM 0 HA LEU A 301 2.853 -3.335 -2.714 1.00 0.19 H new ATOM 0 HB2 LEU A 301 4.027 -1.143 -0.971 1.00 0.23 H new ATOM 0 HB3 LEU A 301 2.813 -0.861 -2.202 1.00 0.23 H new ATOM 0 HG LEU A 301 2.292 -2.864 -0.017 1.00 0.33 H new ATOM 0 HD11 LEU A 301 1.285 -1.061 1.327 1.00 0.48 H new ATOM 0 HD12 LEU A 301 3.037 -0.827 1.119 1.00 0.48 H new ATOM 0 HD13 LEU A 301 1.890 0.140 0.162 1.00 0.48 H new ATOM 0 HD21 LEU A 301 -0.041 -2.189 -0.426 1.00 0.47 H new ATOM 0 HD22 LEU A 301 0.515 -1.025 -1.652 1.00 0.47 H new ATOM 0 HD23 LEU A 301 0.747 -2.770 -1.913 1.00 0.47 H new ATOM 794 N LEU A 302 4.225 -2.552 -4.627 1.00 0.20 N ATOM 795 CA LEU A 302 5.029 -2.133 -5.764 1.00 0.22 C ATOM 796 C LEU A 302 4.466 -0.856 -6.377 1.00 0.22 C ATOM 797 O LEU A 302 4.977 0.239 -6.148 1.00 0.29 O ATOM 798 CB LEU A 302 5.077 -3.233 -6.830 1.00 0.27 C ATOM 799 CG LEU A 302 5.626 -4.587 -6.372 1.00 0.37 C ATOM 800 CD1 LEU A 302 5.635 -5.571 -7.531 1.00 0.53 C ATOM 801 CD2 LEU A 302 7.024 -4.434 -5.798 1.00 0.46 C ATOM 0 H LEU A 302 3.349 -3.014 -4.872 1.00 0.20 H new ATOM 0 HA LEU A 302 6.040 -1.942 -5.405 1.00 0.22 H new ATOM 0 HB2 LEU A 302 4.068 -3.383 -7.214 1.00 0.27 H new ATOM 0 HB3 LEU A 302 5.686 -2.879 -7.662 1.00 0.27 H new ATOM 0 HG LEU A 302 4.975 -4.974 -5.588 1.00 0.37 H new ATOM 0 HD11 LEU A 302 6.028 -6.529 -7.192 1.00 0.53 H new ATOM 0 HD12 LEU A 302 4.619 -5.706 -7.902 1.00 0.53 H new ATOM 0 HD13 LEU A 302 6.265 -5.184 -8.332 1.00 0.53 H new ATOM 0 HD21 LEU A 302 7.395 -5.408 -5.479 1.00 0.46 H new ATOM 0 HD22 LEU A 302 7.687 -4.025 -6.560 1.00 0.46 H new ATOM 0 HD23 LEU A 302 6.994 -3.759 -4.943 1.00 0.46 H new ATOM 813 N GLN A 303 3.397 -1.005 -7.143 1.00 0.21 N ATOM 814 CA GLN A 303 2.765 0.123 -7.805 1.00 0.22 C ATOM 815 C GLN A 303 1.379 0.390 -7.239 1.00 0.21 C ATOM 816 O GLN A 303 0.586 -0.534 -7.043 1.00 0.25 O ATOM 817 CB GLN A 303 2.670 -0.144 -9.307 1.00 0.27 C ATOM 818 CG GLN A 303 1.963 0.951 -10.087 1.00 0.32 C ATOM 819 CD GLN A 303 1.520 0.496 -11.464 1.00 0.51 C ATOM 820 OE1 GLN A 303 0.525 0.983 -12.000 1.00 0.68 O ATOM 821 NE2 GLN A 303 2.253 -0.441 -12.048 1.00 0.73 N ATOM 0 H GLN A 303 2.947 -1.903 -7.322 1.00 0.21 H new ATOM 0 HA GLN A 303 3.378 1.007 -7.629 1.00 0.22 H new ATOM 0 HB2 GLN A 303 3.676 -0.269 -9.707 1.00 0.27 H new ATOM 0 HB3 GLN A 303 2.144 -1.086 -9.465 1.00 0.27 H new ATOM 0 HG2 GLN A 303 1.093 1.289 -9.523 1.00 0.32 H new ATOM 0 HG3 GLN A 303 2.630 1.807 -10.189 1.00 0.32 H new ATOM 0 HE21 GLN A 303 3.071 -0.820 -11.571 1.00 0.73 H new ATOM 0 HE22 GLN A 303 1.999 -0.783 -12.975 1.00 0.73 H new ATOM 830 N VAL A 304 1.092 1.653 -6.972 1.00 0.20 N ATOM 831 CA VAL A 304 -0.203 2.048 -6.449 1.00 0.21 C ATOM 832 C VAL A 304 -0.794 3.153 -7.311 1.00 0.22 C ATOM 833 O VAL A 304 -0.492 4.329 -7.119 1.00 0.26 O ATOM 834 CB VAL A 304 -0.120 2.530 -4.984 1.00 0.24 C ATOM 835 CG1 VAL A 304 -1.508 2.867 -4.458 1.00 0.29 C ATOM 836 CG2 VAL A 304 0.546 1.482 -4.106 1.00 0.27 C ATOM 0 H VAL A 304 1.743 2.426 -7.110 1.00 0.20 H new ATOM 0 HA VAL A 304 -0.844 1.167 -6.474 1.00 0.21 H new ATOM 0 HB VAL A 304 0.491 3.432 -4.954 1.00 0.24 H new ATOM 0 HG11 VAL A 304 -1.433 3.205 -3.424 1.00 0.29 H new ATOM 0 HG12 VAL A 304 -1.946 3.657 -5.068 1.00 0.29 H new ATOM 0 HG13 VAL A 304 -2.140 1.980 -4.505 1.00 0.29 H new ATOM 0 HG21 VAL A 304 0.593 1.844 -3.079 1.00 0.27 H new ATOM 0 HG22 VAL A 304 -0.032 0.559 -4.139 1.00 0.27 H new ATOM 0 HG23 VAL A 304 1.556 1.291 -4.470 1.00 0.27 H new ATOM 846 N ASN A 305 -1.620 2.754 -8.274 1.00 0.27 N ATOM 847 CA ASN A 305 -2.265 3.689 -9.193 1.00 0.33 C ATOM 848 C ASN A 305 -1.234 4.475 -10.004 1.00 0.31 C ATOM 849 O ASN A 305 -0.963 5.646 -9.713 1.00 0.34 O ATOM 850 CB ASN A 305 -3.199 4.646 -8.439 1.00 0.39 C ATOM 851 CG ASN A 305 -4.646 4.188 -8.446 1.00 0.78 C ATOM 852 OD1 ASN A 305 -4.939 3.006 -8.607 1.00 1.71 O ATOM 853 ND2 ASN A 305 -5.565 5.122 -8.255 1.00 1.14 N ATOM 0 H ASN A 305 -1.861 1.777 -8.440 1.00 0.27 H new ATOM 0 HA ASN A 305 -2.864 3.102 -9.889 1.00 0.33 H new ATOM 0 HB2 ASN A 305 -2.858 4.741 -7.408 1.00 0.39 H new ATOM 0 HB3 ASN A 305 -3.135 5.637 -8.888 1.00 0.39 H new ATOM 0 HD21 ASN A 305 -6.553 4.869 -8.238 1.00 1.14 H new ATOM 0 HD22 ASN A 305 -5.285 6.094 -8.125 1.00 1.14 H new ATOM 860 N ASP A 306 -0.651 3.798 -11.001 1.00 0.32 N ATOM 861 CA ASP A 306 0.348 4.378 -11.913 1.00 0.35 C ATOM 862 C ASP A 306 1.728 4.500 -11.280 1.00 0.31 C ATOM 863 O ASP A 306 2.692 3.898 -11.764 1.00 0.35 O ATOM 864 CB ASP A 306 -0.098 5.745 -12.436 1.00 0.42 C ATOM 865 CG ASP A 306 -1.170 5.641 -13.499 1.00 0.66 C ATOM 866 OD1 ASP A 306 -1.111 4.707 -14.324 1.00 1.06 O ATOM 867 OD2 ASP A 306 -2.079 6.496 -13.515 1.00 1.11 O ATOM 0 H ASP A 306 -0.861 2.820 -11.201 1.00 0.32 H new ATOM 0 HA ASP A 306 0.425 3.681 -12.747 1.00 0.35 H new ATOM 0 HB2 ASP A 306 -0.472 6.343 -11.605 1.00 0.42 H new ATOM 0 HB3 ASP A 306 0.764 6.272 -12.845 1.00 0.42 H new ATOM 872 N VAL A 307 1.826 5.279 -10.208 1.00 0.30 N ATOM 873 CA VAL A 307 3.102 5.495 -9.537 1.00 0.29 C ATOM 874 C VAL A 307 3.665 4.203 -8.950 1.00 0.25 C ATOM 875 O VAL A 307 3.000 3.494 -8.189 1.00 0.28 O ATOM 876 CB VAL A 307 3.008 6.575 -8.433 1.00 0.34 C ATOM 877 CG1 VAL A 307 2.823 7.951 -9.050 1.00 0.71 C ATOM 878 CG2 VAL A 307 1.876 6.280 -7.459 1.00 0.53 C ATOM 0 H VAL A 307 1.038 5.771 -9.786 1.00 0.30 H new ATOM 0 HA VAL A 307 3.786 5.853 -10.306 1.00 0.29 H new ATOM 0 HB VAL A 307 3.944 6.559 -7.875 1.00 0.34 H new ATOM 0 HG11 VAL A 307 2.759 8.699 -8.259 1.00 0.71 H new ATOM 0 HG12 VAL A 307 3.672 8.177 -9.695 1.00 0.71 H new ATOM 0 HG13 VAL A 307 1.906 7.966 -9.638 1.00 0.71 H new ATOM 0 HG21 VAL A 307 1.839 7.059 -6.697 1.00 0.53 H new ATOM 0 HG22 VAL A 307 0.929 6.255 -7.998 1.00 0.53 H new ATOM 0 HG23 VAL A 307 2.048 5.315 -6.983 1.00 0.53 H new ATOM 888 N ASN A 308 4.897 3.903 -9.325 1.00 0.25 N ATOM 889 CA ASN A 308 5.578 2.706 -8.859 1.00 0.25 C ATOM 890 C ASN A 308 6.640 3.079 -7.835 1.00 0.24 C ATOM 891 O ASN A 308 7.427 4.000 -8.057 1.00 0.33 O ATOM 892 CB ASN A 308 6.221 1.977 -10.039 1.00 0.33 C ATOM 893 CG ASN A 308 6.618 0.551 -9.710 1.00 0.46 C ATOM 894 OD1 ASN A 308 6.781 0.190 -8.550 1.00 0.58 O ATOM 895 ND2 ASN A 308 6.786 -0.267 -10.734 1.00 0.74 N ATOM 0 H ASN A 308 5.452 4.479 -9.958 1.00 0.25 H new ATOM 0 HA ASN A 308 4.850 2.044 -8.390 1.00 0.25 H new ATOM 0 HB2 ASN A 308 5.525 1.970 -10.878 1.00 0.33 H new ATOM 0 HB3 ASN A 308 7.104 2.529 -10.362 1.00 0.33 H new ATOM 0 HD21 ASN A 308 7.061 -1.236 -10.573 1.00 0.74 H new ATOM 0 HD22 ASN A 308 6.641 0.071 -11.686 1.00 0.74 H new ATOM 902 N PHE A 309 6.668 2.361 -6.722 1.00 0.22 N ATOM 903 CA PHE A 309 7.627 2.632 -5.660 1.00 0.24 C ATOM 904 C PHE A 309 8.753 1.600 -5.648 1.00 0.26 C ATOM 905 O PHE A 309 9.539 1.545 -4.701 1.00 0.30 O ATOM 906 CB PHE A 309 6.917 2.646 -4.303 1.00 0.28 C ATOM 907 CG PHE A 309 5.707 3.540 -4.271 1.00 0.26 C ATOM 908 CD1 PHE A 309 5.828 4.900 -4.509 1.00 0.29 C ATOM 909 CD2 PHE A 309 4.451 3.018 -4.012 1.00 0.31 C ATOM 910 CE1 PHE A 309 4.722 5.723 -4.485 1.00 0.33 C ATOM 911 CE2 PHE A 309 3.337 3.837 -3.988 1.00 0.33 C ATOM 912 CZ PHE A 309 3.473 5.190 -4.227 1.00 0.33 C ATOM 0 H PHE A 309 6.036 1.584 -6.530 1.00 0.22 H new ATOM 0 HA PHE A 309 8.069 3.610 -5.849 1.00 0.24 H new ATOM 0 HB2 PHE A 309 6.616 1.630 -4.048 1.00 0.28 H new ATOM 0 HB3 PHE A 309 7.620 2.971 -3.537 1.00 0.28 H new ATOM 0 HD1 PHE A 309 6.801 5.321 -4.716 1.00 0.29 H new ATOM 0 HD2 PHE A 309 4.340 1.960 -3.827 1.00 0.31 H new ATOM 0 HE1 PHE A 309 4.831 6.782 -4.667 1.00 0.33 H new ATOM 0 HE2 PHE A 309 2.363 3.419 -3.783 1.00 0.33 H new ATOM 0 HZ PHE A 309 2.604 5.831 -4.212 1.00 0.33 H new ATOM 922 N GLU A 310 8.823 0.786 -6.700 1.00 0.29 N ATOM 923 CA GLU A 310 9.858 -0.244 -6.823 1.00 0.33 C ATOM 924 C GLU A 310 11.253 0.355 -6.685 1.00 0.35 C ATOM 925 O GLU A 310 12.142 -0.243 -6.077 1.00 0.47 O ATOM 926 CB GLU A 310 9.749 -0.960 -8.174 1.00 0.40 C ATOM 927 CG GLU A 310 8.859 -2.192 -8.149 1.00 0.54 C ATOM 928 CD GLU A 310 8.659 -2.800 -9.525 1.00 0.67 C ATOM 929 OE1 GLU A 310 9.647 -3.290 -10.118 1.00 1.21 O ATOM 930 OE2 GLU A 310 7.512 -2.800 -10.024 1.00 1.04 O ATOM 0 H GLU A 310 8.172 0.819 -7.485 1.00 0.29 H new ATOM 0 HA GLU A 310 9.701 -0.961 -6.017 1.00 0.33 H new ATOM 0 HB2 GLU A 310 9.363 -0.260 -8.915 1.00 0.40 H new ATOM 0 HB3 GLU A 310 10.747 -1.252 -8.501 1.00 0.40 H new ATOM 0 HG2 GLU A 310 9.298 -2.939 -7.487 1.00 0.54 H new ATOM 0 HG3 GLU A 310 7.889 -1.925 -7.730 1.00 0.54 H new ATOM 937 N ASN A 311 11.441 1.539 -7.246 1.00 0.35 N ATOM 938 CA ASN A 311 12.735 2.203 -7.195 1.00 0.41 C ATOM 939 C ASN A 311 12.609 3.592 -6.577 1.00 0.37 C ATOM 940 O ASN A 311 12.928 4.602 -7.210 1.00 0.48 O ATOM 941 CB ASN A 311 13.345 2.301 -8.596 1.00 0.54 C ATOM 942 CG ASN A 311 13.405 0.960 -9.304 1.00 0.89 C ATOM 943 OD1 ASN A 311 14.368 0.204 -9.157 1.00 1.27 O ATOM 944 ND2 ASN A 311 12.377 0.659 -10.084 1.00 1.32 N ATOM 0 H ASN A 311 10.716 2.059 -7.741 1.00 0.35 H new ATOM 0 HA ASN A 311 13.396 1.606 -6.567 1.00 0.41 H new ATOM 0 HB2 ASN A 311 12.759 2.998 -9.195 1.00 0.54 H new ATOM 0 HB3 ASN A 311 14.351 2.713 -8.522 1.00 0.54 H new ATOM 0 HD21 ASN A 311 12.363 -0.226 -10.590 1.00 1.32 H new ATOM 0 HD22 ASN A 311 11.600 1.313 -10.178 1.00 1.32 H new ATOM 951 N MET A 312 12.128 3.634 -5.343 1.00 0.30 N ATOM 952 CA MET A 312 11.964 4.887 -4.619 1.00 0.28 C ATOM 953 C MET A 312 12.364 4.704 -3.162 1.00 0.26 C ATOM 954 O MET A 312 12.483 3.574 -2.687 1.00 0.34 O ATOM 955 CB MET A 312 10.515 5.377 -4.702 1.00 0.28 C ATOM 956 CG MET A 312 10.154 5.999 -6.039 1.00 0.39 C ATOM 957 SD MET A 312 8.455 6.595 -6.096 1.00 0.37 S ATOM 958 CE MET A 312 8.503 7.896 -4.866 1.00 0.51 C ATOM 0 H MET A 312 11.842 2.807 -4.818 1.00 0.30 H new ATOM 0 HA MET A 312 12.610 5.635 -5.079 1.00 0.28 H new ATOM 0 HB2 MET A 312 9.846 4.538 -4.510 1.00 0.28 H new ATOM 0 HB3 MET A 312 10.343 6.109 -3.913 1.00 0.28 H new ATOM 0 HG2 MET A 312 10.832 6.828 -6.244 1.00 0.39 H new ATOM 0 HG3 MET A 312 10.303 5.263 -6.829 1.00 0.39 H new ATOM 0 HE1 MET A 312 7.836 8.704 -5.165 1.00 0.51 H new ATOM 0 HE2 MET A 312 8.182 7.498 -3.903 1.00 0.51 H new ATOM 0 HE3 MET A 312 9.520 8.278 -4.780 1.00 0.51 H new ATOM 968 N SER A 313 12.586 5.810 -2.459 1.00 0.26 N ATOM 969 CA SER A 313 12.963 5.759 -1.054 1.00 0.28 C ATOM 970 C SER A 313 11.775 5.284 -0.215 1.00 0.24 C ATOM 971 O SER A 313 10.624 5.561 -0.552 1.00 0.26 O ATOM 972 CB SER A 313 13.437 7.142 -0.592 1.00 0.36 C ATOM 973 OG SER A 313 14.121 7.823 -1.637 1.00 0.97 O ATOM 0 H SER A 313 12.511 6.753 -2.841 1.00 0.26 H new ATOM 0 HA SER A 313 13.782 5.052 -0.924 1.00 0.28 H new ATOM 0 HB2 SER A 313 12.581 7.734 -0.267 1.00 0.36 H new ATOM 0 HB3 SER A 313 14.096 7.035 0.269 1.00 0.36 H new ATOM 0 HG SER A 313 14.412 8.703 -1.318 1.00 0.97 H new ATOM 979 N ASN A 314 12.061 4.564 0.868 1.00 0.26 N ATOM 980 CA ASN A 314 11.017 4.037 1.751 1.00 0.27 C ATOM 981 C ASN A 314 10.064 5.143 2.196 1.00 0.25 C ATOM 982 O ASN A 314 8.844 4.982 2.143 1.00 0.33 O ATOM 983 CB ASN A 314 11.629 3.372 2.992 1.00 0.35 C ATOM 984 CG ASN A 314 12.675 2.320 2.669 1.00 0.37 C ATOM 985 OD1 ASN A 314 12.634 1.669 1.622 1.00 0.45 O ATOM 986 ND2 ASN A 314 13.615 2.138 3.579 1.00 0.48 N ATOM 0 H ASN A 314 13.011 4.330 1.158 1.00 0.26 H new ATOM 0 HA ASN A 314 10.460 3.292 1.182 1.00 0.27 H new ATOM 0 HB2 ASN A 314 12.081 4.140 3.619 1.00 0.35 H new ATOM 0 HB3 ASN A 314 10.832 2.912 3.577 1.00 0.35 H new ATOM 0 HD21 ASN A 314 14.342 1.438 3.428 1.00 0.48 H new ATOM 0 HD22 ASN A 314 13.614 2.697 4.432 1.00 0.48 H new ATOM 993 N ASP A 315 10.632 6.263 2.626 1.00 0.26 N ATOM 994 CA ASP A 315 9.857 7.410 3.090 1.00 0.28 C ATOM 995 C ASP A 315 9.001 7.979 1.965 1.00 0.23 C ATOM 996 O ASP A 315 7.795 8.175 2.122 1.00 0.24 O ATOM 997 CB ASP A 315 10.790 8.509 3.621 1.00 0.37 C ATOM 998 CG ASP A 315 12.024 7.955 4.308 1.00 0.83 C ATOM 999 OD1 ASP A 315 12.863 7.336 3.620 1.00 1.40 O ATOM 1000 OD2 ASP A 315 12.159 8.143 5.536 1.00 1.36 O ATOM 0 H ASP A 315 11.642 6.403 2.663 1.00 0.26 H new ATOM 0 HA ASP A 315 9.205 7.067 3.893 1.00 0.28 H new ATOM 0 HB2 ASP A 315 11.097 9.149 2.794 1.00 0.37 H new ATOM 0 HB3 ASP A 315 10.241 9.137 4.323 1.00 0.37 H new ATOM 1005 N ASP A 316 9.635 8.223 0.824 1.00 0.23 N ATOM 1006 CA ASP A 316 8.958 8.789 -0.342 1.00 0.24 C ATOM 1007 C ASP A 316 7.837 7.887 -0.839 1.00 0.19 C ATOM 1008 O ASP A 316 6.806 8.368 -1.313 1.00 0.20 O ATOM 1009 CB ASP A 316 9.958 9.043 -1.472 1.00 0.32 C ATOM 1010 CG ASP A 316 10.258 10.515 -1.661 1.00 0.50 C ATOM 1011 OD1 ASP A 316 9.656 11.350 -0.954 1.00 0.69 O ATOM 1012 OD2 ASP A 316 11.106 10.848 -2.513 1.00 0.88 O ATOM 0 H ASP A 316 10.627 8.036 0.679 1.00 0.23 H new ATOM 0 HA ASP A 316 8.516 9.735 -0.031 1.00 0.24 H new ATOM 0 HB2 ASP A 316 10.885 8.511 -1.259 1.00 0.32 H new ATOM 0 HB3 ASP A 316 9.562 8.634 -2.402 1.00 0.32 H new ATOM 1017 N ALA A 317 8.044 6.583 -0.726 1.00 0.17 N ATOM 1018 CA ALA A 317 7.060 5.604 -1.158 1.00 0.16 C ATOM 1019 C ALA A 317 5.730 5.808 -0.439 1.00 0.14 C ATOM 1020 O ALA A 317 4.676 5.874 -1.074 1.00 0.17 O ATOM 1021 CB ALA A 317 7.578 4.194 -0.921 1.00 0.20 C ATOM 0 H ALA A 317 8.894 6.177 -0.335 1.00 0.17 H new ATOM 0 HA ALA A 317 6.892 5.743 -2.226 1.00 0.16 H new ATOM 0 HB1 ALA A 317 6.830 3.472 -1.249 1.00 0.20 H new ATOM 0 HB2 ALA A 317 8.499 4.045 -1.485 1.00 0.20 H new ATOM 0 HB3 ALA A 317 7.777 4.053 0.141 1.00 0.20 H new ATOM 1027 N VAL A 318 5.783 5.933 0.884 1.00 0.12 N ATOM 1028 CA VAL A 318 4.571 6.124 1.670 1.00 0.12 C ATOM 1029 C VAL A 318 4.055 7.553 1.536 1.00 0.11 C ATOM 1030 O VAL A 318 2.852 7.797 1.661 1.00 0.14 O ATOM 1031 CB VAL A 318 4.777 5.790 3.163 1.00 0.15 C ATOM 1032 CG1 VAL A 318 3.439 5.487 3.821 1.00 0.18 C ATOM 1033 CG2 VAL A 318 5.739 4.622 3.324 1.00 0.21 C ATOM 0 H VAL A 318 6.645 5.906 1.429 1.00 0.12 H new ATOM 0 HA VAL A 318 3.832 5.430 1.270 1.00 0.12 H new ATOM 0 HB VAL A 318 5.216 6.656 3.658 1.00 0.15 H new ATOM 0 HG11 VAL A 318 3.596 5.253 4.874 1.00 0.18 H new ATOM 0 HG12 VAL A 318 2.787 6.356 3.736 1.00 0.18 H new ATOM 0 HG13 VAL A 318 2.974 4.635 3.325 1.00 0.18 H new ATOM 0 HG21 VAL A 318 5.871 4.402 4.384 1.00 0.21 H new ATOM 0 HG22 VAL A 318 5.334 3.745 2.819 1.00 0.21 H new ATOM 0 HG23 VAL A 318 6.702 4.881 2.885 1.00 0.21 H new ATOM 1043 N ARG A 319 4.965 8.492 1.281 1.00 0.12 N ATOM 1044 CA ARG A 319 4.596 9.897 1.116 1.00 0.16 C ATOM 1045 C ARG A 319 3.527 10.047 0.041 1.00 0.14 C ATOM 1046 O ARG A 319 2.477 10.650 0.272 1.00 0.22 O ATOM 1047 CB ARG A 319 5.813 10.746 0.739 1.00 0.21 C ATOM 1048 CG ARG A 319 6.670 11.150 1.925 1.00 0.35 C ATOM 1049 CD ARG A 319 7.823 12.041 1.496 1.00 0.40 C ATOM 1050 NE ARG A 319 8.685 12.407 2.616 1.00 0.50 N ATOM 1051 CZ ARG A 319 10.012 12.516 2.533 1.00 0.61 C ATOM 1052 NH1 ARG A 319 10.637 12.265 1.386 1.00 0.83 N ATOM 1053 NH2 ARG A 319 10.714 12.878 3.602 1.00 0.81 N ATOM 0 H ARG A 319 5.963 8.305 1.184 1.00 0.12 H new ATOM 0 HA ARG A 319 4.203 10.247 2.070 1.00 0.16 H new ATOM 0 HB2 ARG A 319 6.428 10.189 0.032 1.00 0.21 H new ATOM 0 HB3 ARG A 319 5.472 11.645 0.226 1.00 0.21 H new ATOM 0 HG2 ARG A 319 6.056 11.674 2.658 1.00 0.35 H new ATOM 0 HG3 ARG A 319 7.060 10.258 2.415 1.00 0.35 H new ATOM 0 HD2 ARG A 319 8.414 11.527 0.738 1.00 0.40 H new ATOM 0 HD3 ARG A 319 7.428 12.945 1.033 1.00 0.40 H new ATOM 0 HE ARG A 319 8.245 12.591 3.518 1.00 0.50 H new ATOM 0 HH11 ARG A 319 10.101 11.987 0.563 1.00 0.83 H new ATOM 0 HH12 ARG A 319 11.652 12.350 1.329 1.00 0.83 H new ATOM 0 HH21 ARG A 319 10.238 13.072 4.483 1.00 0.81 H new ATOM 0 HH22 ARG A 319 11.729 12.962 3.541 1.00 0.81 H new ATOM 1067 N VAL A 320 3.796 9.477 -1.126 1.00 0.10 N ATOM 1068 CA VAL A 320 2.863 9.544 -2.241 1.00 0.10 C ATOM 1069 C VAL A 320 1.630 8.686 -1.963 1.00 0.09 C ATOM 1070 O VAL A 320 0.506 9.086 -2.271 1.00 0.11 O ATOM 1071 CB VAL A 320 3.522 9.078 -3.557 1.00 0.14 C ATOM 1072 CG1 VAL A 320 2.631 9.390 -4.750 1.00 0.17 C ATOM 1073 CG2 VAL A 320 4.893 9.717 -3.729 1.00 0.17 C ATOM 0 H VAL A 320 4.654 8.963 -1.325 1.00 0.10 H new ATOM 0 HA VAL A 320 2.564 10.586 -2.351 1.00 0.10 H new ATOM 0 HB VAL A 320 3.653 7.997 -3.505 1.00 0.14 H new ATOM 0 HG11 VAL A 320 3.117 9.052 -5.665 1.00 0.17 H new ATOM 0 HG12 VAL A 320 1.676 8.877 -4.635 1.00 0.17 H new ATOM 0 HG13 VAL A 320 2.460 10.465 -4.805 1.00 0.17 H new ATOM 0 HG21 VAL A 320 5.339 9.375 -4.663 1.00 0.17 H new ATOM 0 HG22 VAL A 320 4.788 10.802 -3.753 1.00 0.17 H new ATOM 0 HG23 VAL A 320 5.534 9.433 -2.895 1.00 0.17 H new ATOM 1083 N LEU A 321 1.851 7.516 -1.361 1.00 0.08 N ATOM 1084 CA LEU A 321 0.767 6.589 -1.036 1.00 0.09 C ATOM 1085 C LEU A 321 -0.320 7.270 -0.210 1.00 0.09 C ATOM 1086 O LEU A 321 -1.504 7.186 -0.534 1.00 0.10 O ATOM 1087 CB LEU A 321 1.307 5.379 -0.264 1.00 0.11 C ATOM 1088 CG LEU A 321 0.291 4.267 0.012 1.00 0.20 C ATOM 1089 CD1 LEU A 321 -0.430 3.862 -1.263 1.00 0.38 C ATOM 1090 CD2 LEU A 321 0.986 3.067 0.639 1.00 0.29 C ATOM 0 H LEU A 321 2.777 7.187 -1.088 1.00 0.08 H new ATOM 0 HA LEU A 321 0.331 6.256 -1.978 1.00 0.09 H new ATOM 0 HB2 LEU A 321 2.140 4.955 -0.824 1.00 0.11 H new ATOM 0 HB3 LEU A 321 1.707 5.727 0.689 1.00 0.11 H new ATOM 0 HG LEU A 321 -0.453 4.646 0.712 1.00 0.20 H new ATOM 0 HD11 LEU A 321 -1.146 3.071 -1.040 1.00 0.38 H new ATOM 0 HD12 LEU A 321 -0.957 4.724 -1.672 1.00 0.38 H new ATOM 0 HD13 LEU A 321 0.295 3.500 -1.992 1.00 0.38 H new ATOM 0 HD21 LEU A 321 0.254 2.282 0.831 1.00 0.29 H new ATOM 0 HD22 LEU A 321 1.750 2.692 -0.042 1.00 0.29 H new ATOM 0 HD23 LEU A 321 1.452 3.366 1.578 1.00 0.29 H new ATOM 1102 N ARG A 322 0.094 7.961 0.844 1.00 0.10 N ATOM 1103 CA ARG A 322 -0.845 8.637 1.730 1.00 0.12 C ATOM 1104 C ARG A 322 -1.656 9.691 0.990 1.00 0.13 C ATOM 1105 O ARG A 322 -2.845 9.857 1.256 1.00 0.21 O ATOM 1106 CB ARG A 322 -0.112 9.258 2.917 1.00 0.15 C ATOM 1107 CG ARG A 322 0.561 8.233 3.820 1.00 0.19 C ATOM 1108 CD ARG A 322 0.674 8.736 5.252 1.00 0.34 C ATOM 1109 NE ARG A 322 -0.606 8.669 5.957 1.00 0.49 N ATOM 1110 CZ ARG A 322 -1.360 9.732 6.252 1.00 1.05 C ATOM 1111 NH1 ARG A 322 -0.984 10.949 5.874 1.00 1.57 N ATOM 1112 NH2 ARG A 322 -2.497 9.572 6.916 1.00 1.28 N ATOM 0 H ARG A 322 1.074 8.068 1.106 1.00 0.10 H new ATOM 0 HA ARG A 322 -1.543 7.888 2.104 1.00 0.12 H new ATOM 0 HB2 ARG A 322 0.641 9.953 2.545 1.00 0.15 H new ATOM 0 HB3 ARG A 322 -0.820 9.840 3.507 1.00 0.15 H new ATOM 0 HG2 ARG A 322 -0.009 7.304 3.804 1.00 0.19 H new ATOM 0 HG3 ARG A 322 1.555 8.005 3.435 1.00 0.19 H new ATOM 0 HD2 ARG A 322 1.415 8.142 5.788 1.00 0.34 H new ATOM 0 HD3 ARG A 322 1.033 9.765 5.248 1.00 0.34 H new ATOM 0 HE ARG A 322 -0.945 7.750 6.242 1.00 0.49 H new ATOM 0 HH11 ARG A 322 -0.115 11.076 5.355 1.00 1.57 H new ATOM 0 HH12 ARG A 322 -1.564 11.756 6.103 1.00 1.57 H new ATOM 0 HH21 ARG A 322 -2.794 8.639 7.201 1.00 1.28 H new ATOM 0 HH22 ARG A 322 -3.074 10.382 7.142 1.00 1.28 H new ATOM 1126 N GLU A 323 -1.025 10.389 0.059 1.00 0.12 N ATOM 1127 CA GLU A 323 -1.714 11.418 -0.708 1.00 0.15 C ATOM 1128 C GLU A 323 -2.805 10.803 -1.582 1.00 0.14 C ATOM 1129 O GLU A 323 -3.887 11.374 -1.740 1.00 0.21 O ATOM 1130 CB GLU A 323 -0.728 12.192 -1.575 1.00 0.20 C ATOM 1131 CG GLU A 323 0.175 13.128 -0.787 1.00 0.62 C ATOM 1132 CD GLU A 323 0.790 14.199 -1.659 1.00 1.27 C ATOM 1133 OE1 GLU A 323 0.107 14.674 -2.589 1.00 1.87 O ATOM 1134 OE2 GLU A 323 1.959 14.568 -1.425 1.00 1.76 O ATOM 0 H GLU A 323 -0.042 10.264 -0.184 1.00 0.12 H new ATOM 0 HA GLU A 323 -2.179 12.107 -0.003 1.00 0.15 H new ATOM 0 HB2 GLU A 323 -0.110 11.484 -2.127 1.00 0.20 H new ATOM 0 HB3 GLU A 323 -1.283 12.772 -2.312 1.00 0.20 H new ATOM 0 HG2 GLU A 323 -0.400 13.598 0.011 1.00 0.62 H new ATOM 0 HG3 GLU A 323 0.967 12.550 -0.311 1.00 0.62 H new ATOM 1141 N ILE A 324 -2.518 9.634 -2.136 1.00 0.12 N ATOM 1142 CA ILE A 324 -3.469 8.933 -2.986 1.00 0.14 C ATOM 1143 C ILE A 324 -4.649 8.416 -2.164 1.00 0.14 C ATOM 1144 O ILE A 324 -5.803 8.521 -2.580 1.00 0.18 O ATOM 1145 CB ILE A 324 -2.796 7.757 -3.724 1.00 0.18 C ATOM 1146 CG1 ILE A 324 -1.647 8.268 -4.600 1.00 0.21 C ATOM 1147 CG2 ILE A 324 -3.814 6.996 -4.563 1.00 0.23 C ATOM 1148 CD1 ILE A 324 -0.815 7.163 -5.211 1.00 0.29 C ATOM 0 H ILE A 324 -1.629 9.149 -2.011 1.00 0.12 H new ATOM 0 HA ILE A 324 -3.834 9.645 -3.726 1.00 0.14 H new ATOM 0 HB ILE A 324 -2.387 7.071 -2.982 1.00 0.18 H new ATOM 0 HG12 ILE A 324 -2.057 8.887 -5.398 1.00 0.21 H new ATOM 0 HG13 ILE A 324 -1.001 8.909 -4.000 1.00 0.21 H new ATOM 0 HG21 ILE A 324 -3.319 6.171 -5.075 1.00 0.23 H new ATOM 0 HG22 ILE A 324 -4.598 6.603 -3.916 1.00 0.23 H new ATOM 0 HG23 ILE A 324 -4.254 7.668 -5.299 1.00 0.23 H new ATOM 0 HD11 ILE A 324 -0.021 7.598 -5.818 1.00 0.29 H new ATOM 0 HD12 ILE A 324 -0.375 6.558 -4.418 1.00 0.29 H new ATOM 0 HD13 ILE A 324 -1.448 6.535 -5.838 1.00 0.29 H new ATOM 1160 N VAL A 325 -4.356 7.881 -0.980 1.00 0.11 N ATOM 1161 CA VAL A 325 -5.396 7.353 -0.102 1.00 0.13 C ATOM 1162 C VAL A 325 -6.257 8.482 0.473 1.00 0.16 C ATOM 1163 O VAL A 325 -7.386 8.259 0.913 1.00 0.24 O ATOM 1164 CB VAL A 325 -4.792 6.495 1.041 1.00 0.15 C ATOM 1165 CG1 VAL A 325 -5.885 5.853 1.881 1.00 0.19 C ATOM 1166 CG2 VAL A 325 -3.874 5.431 0.469 1.00 0.16 C ATOM 0 H VAL A 325 -3.409 7.802 -0.608 1.00 0.11 H new ATOM 0 HA VAL A 325 -6.034 6.708 -0.706 1.00 0.13 H new ATOM 0 HB VAL A 325 -4.212 7.153 1.688 1.00 0.15 H new ATOM 0 HG11 VAL A 325 -5.432 5.258 2.674 1.00 0.19 H new ATOM 0 HG12 VAL A 325 -6.509 6.630 2.322 1.00 0.19 H new ATOM 0 HG13 VAL A 325 -6.498 5.210 1.250 1.00 0.19 H new ATOM 0 HG21 VAL A 325 -3.457 4.836 1.281 1.00 0.16 H new ATOM 0 HG22 VAL A 325 -4.440 4.784 -0.201 1.00 0.16 H new ATOM 0 HG23 VAL A 325 -3.065 5.908 -0.084 1.00 0.16 H new ATOM 1176 N SER A 326 -5.733 9.701 0.444 1.00 0.19 N ATOM 1177 CA SER A 326 -6.465 10.855 0.950 1.00 0.24 C ATOM 1178 C SER A 326 -7.277 11.506 -0.170 1.00 0.27 C ATOM 1179 O SER A 326 -7.947 12.519 0.037 1.00 0.44 O ATOM 1180 CB SER A 326 -5.494 11.870 1.560 1.00 0.32 C ATOM 1181 OG SER A 326 -4.685 11.265 2.557 1.00 0.37 O ATOM 0 H SER A 326 -4.806 9.916 0.076 1.00 0.19 H new ATOM 0 HA SER A 326 -7.153 10.518 1.725 1.00 0.24 H new ATOM 0 HB2 SER A 326 -4.861 12.288 0.778 1.00 0.32 H new ATOM 0 HB3 SER A 326 -6.054 12.698 1.994 1.00 0.32 H new ATOM 0 HG SER A 326 -4.102 10.595 2.143 1.00 0.37 H new ATOM 1187 N GLN A 327 -7.218 10.914 -1.355 1.00 0.27 N ATOM 1188 CA GLN A 327 -7.937 11.430 -2.508 1.00 0.32 C ATOM 1189 C GLN A 327 -9.131 10.543 -2.835 1.00 0.34 C ATOM 1190 O GLN A 327 -9.032 9.314 -2.802 1.00 0.53 O ATOM 1191 CB GLN A 327 -6.996 11.524 -3.712 1.00 0.41 C ATOM 1192 CG GLN A 327 -7.454 12.517 -4.767 1.00 0.63 C ATOM 1193 CD GLN A 327 -7.761 13.885 -4.183 1.00 0.75 C ATOM 1194 OE1 GLN A 327 -8.899 14.173 -3.814 1.00 1.16 O ATOM 1195 NE2 GLN A 327 -6.747 14.729 -4.085 1.00 0.94 N ATOM 0 H GLN A 327 -6.675 10.071 -1.542 1.00 0.27 H new ATOM 0 HA GLN A 327 -8.307 12.427 -2.271 1.00 0.32 H new ATOM 0 HB2 GLN A 327 -6.003 11.808 -3.365 1.00 0.41 H new ATOM 0 HB3 GLN A 327 -6.904 10.538 -4.168 1.00 0.41 H new ATOM 0 HG2 GLN A 327 -6.680 12.616 -5.529 1.00 0.63 H new ATOM 0 HG3 GLN A 327 -8.343 12.130 -5.264 1.00 0.63 H new ATOM 0 HE21 GLN A 327 -5.819 14.450 -4.403 1.00 0.94 H new ATOM 0 HE22 GLN A 327 -6.893 15.659 -3.691 1.00 0.94 H new ATOM 1204 N THR A 328 -10.254 11.171 -3.152 1.00 0.42 N ATOM 1205 CA THR A 328 -11.475 10.454 -3.474 1.00 0.49 C ATOM 1206 C THR A 328 -11.416 9.830 -4.865 1.00 0.51 C ATOM 1207 O THR A 328 -11.624 10.509 -5.871 1.00 0.84 O ATOM 1208 CB THR A 328 -12.688 11.397 -3.391 1.00 0.66 C ATOM 1209 OG1 THR A 328 -12.241 12.763 -3.426 1.00 0.88 O ATOM 1210 CG2 THR A 328 -13.483 11.145 -2.119 1.00 0.89 C ATOM 0 H THR A 328 -10.343 12.186 -3.193 1.00 0.42 H new ATOM 0 HA THR A 328 -11.580 9.652 -2.743 1.00 0.49 H new ATOM 0 HB THR A 328 -13.337 11.204 -4.245 1.00 0.66 H new ATOM 0 HG1 THR A 328 -13.015 13.362 -3.375 1.00 0.88 H new ATOM 0 HG21 THR A 328 -14.335 11.823 -2.082 1.00 0.89 H new ATOM 0 HG22 THR A 328 -13.838 10.115 -2.110 1.00 0.89 H new ATOM 0 HG23 THR A 328 -12.846 11.316 -1.252 1.00 0.89 H new ATOM 1218 N GLY A 329 -11.117 8.538 -4.915 1.00 0.45 N ATOM 1219 CA GLY A 329 -11.044 7.837 -6.179 1.00 0.44 C ATOM 1220 C GLY A 329 -10.631 6.390 -5.996 1.00 0.39 C ATOM 1221 O GLY A 329 -10.063 6.045 -4.959 1.00 0.43 O ATOM 0 H GLY A 329 -10.923 7.962 -4.096 1.00 0.45 H new ATOM 0 HA2 GLY A 329 -12.014 7.878 -6.674 1.00 0.44 H new ATOM 0 HA3 GLY A 329 -10.331 8.339 -6.833 1.00 0.44 H new ATOM 1225 N PRO A 330 -10.902 5.521 -6.986 1.00 0.40 N ATOM 1226 CA PRO A 330 -10.547 4.096 -6.915 1.00 0.39 C ATOM 1227 C PRO A 330 -9.042 3.882 -6.778 1.00 0.36 C ATOM 1228 O PRO A 330 -8.250 4.447 -7.537 1.00 0.56 O ATOM 1229 CB PRO A 330 -11.044 3.527 -8.251 1.00 0.47 C ATOM 1230 CG PRO A 330 -12.031 4.516 -8.761 1.00 0.58 C ATOM 1231 CD PRO A 330 -11.574 5.854 -8.256 1.00 0.52 C ATOM 0 HA PRO A 330 -10.990 3.614 -6.043 1.00 0.39 H new ATOM 0 HB2 PRO A 330 -10.220 3.397 -8.953 1.00 0.47 H new ATOM 0 HB3 PRO A 330 -11.504 2.548 -8.114 1.00 0.47 H new ATOM 0 HG2 PRO A 330 -12.070 4.502 -9.850 1.00 0.58 H new ATOM 0 HG3 PRO A 330 -13.035 4.286 -8.403 1.00 0.58 H new ATOM 0 HD2 PRO A 330 -10.894 6.338 -8.957 1.00 0.52 H new ATOM 0 HD3 PRO A 330 -12.412 6.534 -8.102 1.00 0.52 H new ATOM 1239 N ILE A 331 -8.653 3.064 -5.811 1.00 0.27 N ATOM 1240 CA ILE A 331 -7.246 2.783 -5.568 1.00 0.25 C ATOM 1241 C ILE A 331 -6.908 1.335 -5.907 1.00 0.25 C ATOM 1242 O ILE A 331 -7.494 0.403 -5.356 1.00 0.30 O ATOM 1243 CB ILE A 331 -6.858 3.066 -4.100 1.00 0.29 C ATOM 1244 CG1 ILE A 331 -7.167 4.523 -3.744 1.00 0.31 C ATOM 1245 CG2 ILE A 331 -5.384 2.759 -3.861 1.00 0.37 C ATOM 1246 CD1 ILE A 331 -7.025 4.831 -2.269 1.00 0.35 C ATOM 0 H ILE A 331 -9.294 2.582 -5.181 1.00 0.27 H new ATOM 0 HA ILE A 331 -6.674 3.446 -6.217 1.00 0.25 H new ATOM 0 HB ILE A 331 -7.448 2.415 -3.455 1.00 0.29 H new ATOM 0 HG12 ILE A 331 -6.500 5.175 -4.308 1.00 0.31 H new ATOM 0 HG13 ILE A 331 -8.184 4.757 -4.059 1.00 0.31 H new ATOM 0 HG21 ILE A 331 -5.133 2.966 -2.821 1.00 0.37 H new ATOM 0 HG22 ILE A 331 -5.191 1.709 -4.079 1.00 0.37 H new ATOM 0 HG23 ILE A 331 -4.772 3.383 -4.512 1.00 0.37 H new ATOM 0 HD11 ILE A 331 -7.259 5.881 -2.092 1.00 0.35 H new ATOM 0 HD12 ILE A 331 -7.711 4.205 -1.699 1.00 0.35 H new ATOM 0 HD13 ILE A 331 -6.002 4.629 -1.952 1.00 0.35 H new ATOM 1258 N SER A 332 -5.974 1.159 -6.829 1.00 0.28 N ATOM 1259 CA SER A 332 -5.534 -0.165 -7.234 1.00 0.31 C ATOM 1260 C SER A 332 -4.154 -0.452 -6.656 1.00 0.27 C ATOM 1261 O SER A 332 -3.196 0.283 -6.908 1.00 0.31 O ATOM 1262 CB SER A 332 -5.514 -0.265 -8.760 1.00 0.41 C ATOM 1263 OG SER A 332 -6.729 0.222 -9.305 1.00 1.09 O ATOM 0 H SER A 332 -5.504 1.924 -7.313 1.00 0.28 H new ATOM 0 HA SER A 332 -6.231 -0.909 -6.850 1.00 0.31 H new ATOM 0 HB2 SER A 332 -4.675 0.307 -9.157 1.00 0.41 H new ATOM 0 HB3 SER A 332 -5.363 -1.302 -9.061 1.00 0.41 H new ATOM 0 HG SER A 332 -6.700 0.153 -10.282 1.00 1.09 H new ATOM 1269 N LEU A 333 -4.062 -1.515 -5.874 1.00 0.27 N ATOM 1270 CA LEU A 333 -2.813 -1.895 -5.236 1.00 0.26 C ATOM 1271 C LEU A 333 -2.174 -3.083 -5.937 1.00 0.26 C ATOM 1272 O LEU A 333 -2.811 -4.115 -6.144 1.00 0.30 O ATOM 1273 CB LEU A 333 -3.060 -2.248 -3.768 1.00 0.29 C ATOM 1274 CG LEU A 333 -3.618 -1.116 -2.906 1.00 0.27 C ATOM 1275 CD1 LEU A 333 -4.200 -1.671 -1.617 1.00 0.48 C ATOM 1276 CD2 LEU A 333 -2.533 -0.105 -2.591 1.00 0.39 C ATOM 0 H LEU A 333 -4.845 -2.135 -5.665 1.00 0.27 H new ATOM 0 HA LEU A 333 -2.133 -1.046 -5.303 1.00 0.26 H new ATOM 0 HB2 LEU A 333 -3.752 -3.089 -3.726 1.00 0.29 H new ATOM 0 HB3 LEU A 333 -2.121 -2.586 -3.330 1.00 0.29 H new ATOM 0 HG LEU A 333 -4.410 -0.617 -3.465 1.00 0.27 H new ATOM 0 HD11 LEU A 333 -4.593 -0.853 -1.014 1.00 0.48 H new ATOM 0 HD12 LEU A 333 -5.004 -2.368 -1.852 1.00 0.48 H new ATOM 0 HD13 LEU A 333 -3.420 -2.190 -1.060 1.00 0.48 H new ATOM 0 HD21 LEU A 333 -2.948 0.694 -1.977 1.00 0.39 H new ATOM 0 HD22 LEU A 333 -1.724 -0.596 -2.050 1.00 0.39 H new ATOM 0 HD23 LEU A 333 -2.146 0.315 -3.520 1.00 0.39 H new ATOM 1288 N THR A 334 -0.918 -2.920 -6.314 1.00 0.24 N ATOM 1289 CA THR A 334 -0.165 -3.979 -6.959 1.00 0.26 C ATOM 1290 C THR A 334 0.834 -4.535 -5.956 1.00 0.26 C ATOM 1291 O THR A 334 1.894 -3.944 -5.730 1.00 0.28 O ATOM 1292 CB THR A 334 0.579 -3.463 -8.207 1.00 0.31 C ATOM 1293 OG1 THR A 334 -0.193 -2.438 -8.847 1.00 0.50 O ATOM 1294 CG2 THR A 334 0.841 -4.588 -9.194 1.00 0.42 C ATOM 0 H THR A 334 -0.395 -2.055 -6.182 1.00 0.24 H new ATOM 0 HA THR A 334 -0.855 -4.757 -7.287 1.00 0.26 H new ATOM 0 HB THR A 334 1.537 -3.056 -7.883 1.00 0.31 H new ATOM 0 HG1 THR A 334 -0.082 -1.594 -8.362 1.00 0.50 H new ATOM 0 HG21 THR A 334 1.367 -4.194 -10.064 1.00 0.42 H new ATOM 0 HG22 THR A 334 1.452 -5.355 -8.718 1.00 0.42 H new ATOM 0 HG23 THR A 334 -0.107 -5.023 -9.510 1.00 0.42 H new ATOM 1302 N VAL A 335 0.484 -5.650 -5.332 1.00 0.26 N ATOM 1303 CA VAL A 335 1.338 -6.251 -4.321 1.00 0.28 C ATOM 1304 C VAL A 335 2.149 -7.421 -4.865 1.00 0.28 C ATOM 1305 O VAL A 335 1.742 -8.101 -5.809 1.00 0.32 O ATOM 1306 CB VAL A 335 0.521 -6.730 -3.099 1.00 0.30 C ATOM 1307 CG1 VAL A 335 -0.169 -5.559 -2.420 1.00 0.33 C ATOM 1308 CG2 VAL A 335 -0.500 -7.788 -3.497 1.00 0.31 C ATOM 0 H VAL A 335 -0.384 -6.155 -5.508 1.00 0.26 H new ATOM 0 HA VAL A 335 2.028 -5.466 -4.011 1.00 0.28 H new ATOM 0 HB VAL A 335 1.217 -7.181 -2.392 1.00 0.30 H new ATOM 0 HG11 VAL A 335 -0.738 -5.919 -1.563 1.00 0.33 H new ATOM 0 HG12 VAL A 335 0.579 -4.841 -2.083 1.00 0.33 H new ATOM 0 HG13 VAL A 335 -0.844 -5.075 -3.126 1.00 0.33 H new ATOM 0 HG21 VAL A 335 -1.058 -8.104 -2.616 1.00 0.31 H new ATOM 0 HG22 VAL A 335 -1.188 -7.371 -4.232 1.00 0.31 H new ATOM 0 HG23 VAL A 335 0.015 -8.647 -3.928 1.00 0.31 H new ATOM 1318 N ALA A 336 3.306 -7.634 -4.259 1.00 0.28 N ATOM 1319 CA ALA A 336 4.193 -8.716 -4.637 1.00 0.31 C ATOM 1320 C ALA A 336 4.264 -9.744 -3.519 1.00 0.33 C ATOM 1321 O ALA A 336 4.779 -9.465 -2.430 1.00 0.38 O ATOM 1322 CB ALA A 336 5.579 -8.178 -4.954 1.00 0.34 C ATOM 0 H ALA A 336 3.654 -7.060 -3.491 1.00 0.28 H new ATOM 0 HA ALA A 336 3.799 -9.198 -5.532 1.00 0.31 H new ATOM 0 HB1 ALA A 336 6.234 -9.003 -5.236 1.00 0.34 H new ATOM 0 HB2 ALA A 336 5.514 -7.468 -5.778 1.00 0.34 H new ATOM 0 HB3 ALA A 336 5.985 -7.677 -4.075 1.00 0.34 H new ATOM 1328 N LYS A 337 3.723 -10.919 -3.783 1.00 0.36 N ATOM 1329 CA LYS A 337 3.718 -11.994 -2.809 1.00 0.40 C ATOM 1330 C LYS A 337 4.772 -13.028 -3.177 1.00 0.47 C ATOM 1331 O LYS A 337 4.551 -13.781 -4.146 1.00 0.60 O ATOM 1332 CB LYS A 337 2.334 -12.650 -2.750 1.00 0.41 C ATOM 1333 CG LYS A 337 1.205 -11.672 -2.463 1.00 0.37 C ATOM 1334 CD LYS A 337 -0.144 -12.370 -2.406 1.00 0.41 C ATOM 1335 CE LYS A 337 -0.289 -13.226 -1.157 1.00 0.39 C ATOM 1336 NZ LYS A 337 -0.747 -12.435 0.017 1.00 0.38 N ATOM 1337 OXT LYS A 337 5.820 -13.078 -2.503 1.00 0.70 O ATOM 0 H LYS A 337 3.278 -11.154 -4.671 1.00 0.36 H new ATOM 0 HA LYS A 337 3.950 -11.583 -1.827 1.00 0.40 H new ATOM 0 HB2 LYS A 337 2.138 -13.149 -3.699 1.00 0.41 H new ATOM 0 HB3 LYS A 337 2.340 -13.421 -1.979 1.00 0.41 H new ATOM 0 HG2 LYS A 337 1.393 -11.167 -1.516 1.00 0.37 H new ATOM 0 HG3 LYS A 337 1.184 -10.903 -3.236 1.00 0.37 H new ATOM 0 HD2 LYS A 337 -0.939 -11.625 -2.429 1.00 0.41 H new ATOM 0 HD3 LYS A 337 -0.267 -12.995 -3.290 1.00 0.41 H new ATOM 0 HE2 LYS A 337 -0.999 -14.030 -1.350 1.00 0.39 H new ATOM 0 HE3 LYS A 337 0.668 -13.694 -0.926 1.00 0.39 H new ATOM 0 HZ1 LYS A 337 -0.718 -13.030 0.869 1.00 0.38 H new ATOM 0 HZ2 LYS A 337 -0.123 -11.613 0.147 1.00 0.38 H new ATOM 0 HZ3 LYS A 337 -1.721 -12.108 -0.144 1.00 0.38 H new TER 1351 LYS A 337 HETATM 1352 C1 PHQ B 1 1.923 4.502 7.740 1.00 0.19 C HETATM 1353 O1 PHQ B 1 1.924 3.271 7.818 1.00 0.22 O HETATM 1354 O2 PHQ B 1 3.225 5.264 7.514 1.00 0.26 O HETATM 1355 C2 PHQ B 1 4.375 4.300 7.230 1.00 0.31 C HETATM 1356 C3 PHQ B 1 5.721 4.975 7.088 1.00 0.38 C HETATM 1357 C4 PHQ B 1 6.900 4.250 7.331 1.00 1.30 C HETATM 1358 C5 PHQ B 1 8.147 4.814 7.004 1.00 1.42 C HETATM 1359 C6 PHQ B 1 8.214 6.132 6.516 1.00 0.84 C HETATM 1360 C7 PHQ B 1 7.037 6.885 6.363 1.00 1.38 C HETATM 1361 C8 PHQ B 1 5.796 6.325 6.706 1.00 1.29 C HETATM 0 H81 PHQ B 1 4.894 6.936 6.676 1.00 1.29 H new HETATM 0 H71 PHQ B 1 7.088 7.904 5.978 1.00 1.38 H new HETATM 0 H61 PHQ B 1 9.178 6.569 6.257 1.00 0.84 H new HETATM 0 H51 PHQ B 1 9.059 4.231 7.129 1.00 1.42 H new HETATM 0 H41 PHQ B 1 6.849 3.254 7.771 1.00 1.30 H new HETATM 0 H22 PHQ B 1 4.430 3.568 8.036 1.00 0.31 H new HETATM 0 H21 PHQ B 1 4.157 3.750 6.314 1.00 0.31 H new ATOM 1369 N TRP B 2 0.786 5.175 7.858 1.00 0.14 N ATOM 1370 CA TRP B 2 -0.498 4.511 8.082 1.00 0.13 C ATOM 1371 C TRP B 2 -1.570 5.104 7.183 1.00 0.14 C ATOM 1372 O TRP B 2 -1.677 6.330 7.070 1.00 0.23 O ATOM 1373 CB TRP B 2 -0.932 4.669 9.543 1.00 0.19 C ATOM 1374 CG TRP B 2 -0.383 3.621 10.464 1.00 0.21 C ATOM 1375 CD1 TRP B 2 0.875 3.566 10.988 1.00 0.30 C ATOM 1376 CD2 TRP B 2 -1.081 2.478 10.972 1.00 0.24 C ATOM 1377 NE1 TRP B 2 1.002 2.460 11.794 1.00 0.32 N ATOM 1378 CE2 TRP B 2 -0.183 1.777 11.801 1.00 0.28 C ATOM 1379 CE3 TRP B 2 -2.378 1.980 10.813 1.00 0.32 C ATOM 1380 CZ2 TRP B 2 -0.540 0.605 12.462 1.00 0.33 C ATOM 1381 CZ3 TRP B 2 -2.727 0.816 11.468 1.00 0.40 C ATOM 1382 CH2 TRP B 2 -1.815 0.142 12.288 1.00 0.39 C ATOM 0 HA TRP B 2 -0.374 3.453 7.849 1.00 0.13 H new ATOM 0 HB2 TRP B 2 -0.618 5.650 9.899 1.00 0.19 H new ATOM 0 HB3 TRP B 2 -2.021 4.645 9.592 1.00 0.19 H new ATOM 0 HD1 TRP B 2 1.657 4.286 10.797 1.00 0.30 H new ATOM 0 HE1 TRP B 2 1.844 2.192 12.304 1.00 0.32 H new ATOM 0 HE3 TRP B 2 -3.093 2.496 10.190 1.00 0.32 H new ATOM 0 HZ2 TRP B 2 0.165 0.080 13.090 1.00 0.33 H new ATOM 0 HZ3 TRP B 2 -3.723 0.418 11.345 1.00 0.40 H new ATOM 0 HH2 TRP B 2 -2.124 -0.761 12.793 1.00 0.39 H new ATOM 1393 N VAL B 3 -2.345 4.242 6.544 1.00 0.09 N ATOM 1394 CA VAL B 3 -3.428 4.680 5.673 1.00 0.11 C ATOM 1395 C VAL B 3 -4.514 3.622 5.620 1.00 0.14 C ATOM 1396 O VAL B 3 -5.650 3.949 5.230 1.00 0.24 O ATOM 1397 CB VAL B 3 -2.970 5.006 4.233 1.00 0.14 C ATOM 1398 CG1 VAL B 3 -2.616 6.474 4.100 1.00 0.21 C ATOM 1399 CG2 VAL B 3 -1.801 4.136 3.789 1.00 0.11 C ATOM 1400 OXT VAL B 3 -4.224 2.467 5.982 1.00 0.27 O ATOM 0 H VAL B 3 -2.244 3.229 6.612 1.00 0.09 H new ATOM 0 HA VAL B 3 -3.808 5.605 6.106 1.00 0.11 H new ATOM 0 HB VAL B 3 -3.810 4.784 3.575 1.00 0.14 H new ATOM 0 HG11 VAL B 3 -2.297 6.680 3.078 1.00 0.21 H new ATOM 0 HG12 VAL B 3 -3.489 7.082 4.337 1.00 0.21 H new ATOM 0 HG13 VAL B 3 -1.807 6.717 4.789 1.00 0.21 H new ATOM 0 HG21 VAL B 3 -1.515 4.402 2.771 1.00 0.11 H new ATOM 0 HG22 VAL B 3 -0.955 4.295 4.457 1.00 0.11 H new ATOM 0 HG23 VAL B 3 -2.096 3.087 3.821 1.00 0.11 H new TER 1410 VAL B 3