USER MOD reduce.3.24.130724 H: found=0, std=0, add=653, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 658 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 305 ASN : amide:sc= 0.00593 K(o=0.0062,f=-0.53) USER MOD Set 1.2: A 332 SER OG : rot 82:sc=0.000255 USER MOD Set 2.1: A 265 SER OG : rot -105:sc= 1.4 USER MOD Set 2.2: A 282 SER OG : rot 59:sc= 1.2 USER MOD Set 3.1: A 269 GLN : amide:sc= 0 X(o=0.07,f=0.07) USER MOD Set 3.2: A 279 TYR OH : rot -106:sc= 0.0697 USER MOD Single : A 248 ASN : amide:sc= 0 X(o=0,f=-0.35) 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= 0.874 K(o=0.87,f=-6.3!) USER MOD Single : A 256 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 259 HIS : no HE2:sc= 0.00108 X(o=0.0011,f=-0.12) USER MOD Single : A 260 HIS : no HD1:sc= -0.026 X(o=-0.026,f=-0.0051) USER MOD Single : A 284 MET CE :methyl 154:sc= -0.148 (180deg=-0.761) USER MOD Single : A 285 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.115) USER MOD Single : A 300 MET CE :methyl -138:sc= 0 (180deg=-0.831) USER MOD Single : A 303 GLN : amide:sc= -0.0586 K(o=-0.059,f=-2.8!) USER MOD Single : A 308 ASN : amide:sc= 0.693 K(o=0.69,f=-2.6) USER MOD Single : A 311 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 312 MET CE :methyl 171:sc= 0 (180deg=-0.136) USER MOD Single : A 313 SER OG : rot -126:sc= 1.81 USER MOD Single : A 314 ASN : amide:sc= 0.938 K(o=0.94,f=-0.81) USER MOD Single : A 326 SER OG : rot 74:sc= 1.24 USER MOD Single : A 327 GLN : amide:sc= -0.583 X(o=-0.58,f=-0.12) USER MOD Single : A 328 THR OG1 : rot 180:sc= 0.00744 USER MOD Single : A 334 THR OG1 : rot 77:sc= -0.0131 USER MOD Single : A 337 LYS NZ :NH3+ -173:sc= 1.65! (180deg=1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 248 4.470 -13.535 -7.233 1.00 0.52 N ATOM 2 CA ASN A 248 3.114 -13.429 -7.822 1.00 0.49 C ATOM 3 C ASN A 248 2.600 -12.003 -7.690 1.00 0.44 C ATOM 4 O ASN A 248 2.446 -11.497 -6.584 1.00 0.47 O ATOM 5 CB ASN A 248 2.162 -14.406 -7.126 1.00 0.57 C ATOM 6 CG ASN A 248 0.768 -14.398 -7.720 1.00 0.70 C ATOM 7 OD1 ASN A 248 -0.127 -13.731 -7.213 1.00 0.99 O ATOM 8 ND2 ASN A 248 0.573 -15.146 -8.795 1.00 1.26 N ATOM 0 HA ASN A 248 3.164 -13.686 -8.880 1.00 0.49 H new ATOM 0 HB2 ASN A 248 2.573 -15.414 -7.191 1.00 0.57 H new ATOM 0 HB3 ASN A 248 2.101 -14.154 -6.067 1.00 0.57 H new ATOM 0 HD21 ASN A 248 -0.348 -15.181 -9.231 1.00 1.26 H new ATOM 0 HD22 ASN A 248 1.344 -15.687 -9.187 1.00 1.26 H new ATOM 17 N ILE A 249 2.334 -11.356 -8.812 1.00 0.45 N ATOM 18 CA ILE A 249 1.864 -9.977 -8.798 1.00 0.43 C ATOM 19 C ILE A 249 0.369 -9.900 -9.090 1.00 0.42 C ATOM 20 O ILE A 249 -0.118 -10.506 -10.046 1.00 0.50 O ATOM 21 CB ILE A 249 2.636 -9.120 -9.823 1.00 0.47 C ATOM 22 CG1 ILE A 249 4.145 -9.345 -9.676 1.00 0.54 C ATOM 23 CG2 ILE A 249 2.302 -7.644 -9.648 1.00 0.50 C ATOM 24 CD1 ILE A 249 4.961 -8.762 -10.807 1.00 0.65 C ATOM 0 H ILE A 249 2.434 -11.760 -9.743 1.00 0.45 H new ATOM 0 HA ILE A 249 2.046 -9.583 -7.798 1.00 0.43 H new ATOM 0 HB ILE A 249 2.333 -9.425 -10.824 1.00 0.47 H new ATOM 0 HG12 ILE A 249 4.479 -8.906 -8.736 1.00 0.54 H new ATOM 0 HG13 ILE A 249 4.339 -10.416 -9.615 1.00 0.54 H new ATOM 0 HG21 ILE A 249 2.856 -7.056 -10.380 1.00 0.50 H new ATOM 0 HG22 ILE A 249 1.233 -7.493 -9.796 1.00 0.50 H new ATOM 0 HG23 ILE A 249 2.578 -7.325 -8.643 1.00 0.50 H new ATOM 0 HD11 ILE A 249 6.018 -8.961 -10.633 1.00 0.65 H new ATOM 0 HD12 ILE A 249 4.656 -9.219 -11.749 1.00 0.65 H new ATOM 0 HD13 ILE A 249 4.798 -7.685 -10.856 1.00 0.65 H new ATOM 36 N ILE A 250 -0.357 -9.165 -8.253 1.00 0.39 N ATOM 37 CA ILE A 250 -1.799 -9.005 -8.422 1.00 0.41 C ATOM 38 C ILE A 250 -2.199 -7.535 -8.325 1.00 0.37 C ATOM 39 O ILE A 250 -1.687 -6.795 -7.481 1.00 0.36 O ATOM 40 CB ILE A 250 -2.601 -9.801 -7.362 1.00 0.44 C ATOM 41 CG1 ILE A 250 -2.163 -11.267 -7.337 1.00 0.48 C ATOM 42 CG2 ILE A 250 -4.099 -9.703 -7.638 1.00 0.55 C ATOM 43 CD1 ILE A 250 -2.875 -12.096 -6.288 1.00 0.54 C ATOM 0 H ILE A 250 0.030 -8.670 -7.449 1.00 0.39 H new ATOM 0 HA ILE A 250 -2.037 -9.394 -9.412 1.00 0.41 H new ATOM 0 HB ILE A 250 -2.397 -9.363 -6.385 1.00 0.44 H new ATOM 0 HG12 ILE A 250 -2.341 -11.707 -8.318 1.00 0.48 H new ATOM 0 HG13 ILE A 250 -1.089 -11.313 -7.157 1.00 0.48 H new ATOM 0 HG21 ILE A 250 -4.646 -10.268 -6.883 1.00 0.55 H new ATOM 0 HG22 ILE A 250 -4.408 -8.658 -7.603 1.00 0.55 H new ATOM 0 HG23 ILE A 250 -4.315 -10.112 -8.625 1.00 0.55 H new ATOM 0 HD11 ILE A 250 -2.514 -13.123 -6.329 1.00 0.54 H new ATOM 0 HD12 ILE A 250 -2.677 -11.681 -5.300 1.00 0.54 H new ATOM 0 HD13 ILE A 250 -3.948 -12.081 -6.479 1.00 0.54 H new ATOM 55 N THR A 251 -3.098 -7.117 -9.204 1.00 0.40 N ATOM 56 CA THR A 251 -3.598 -5.753 -9.211 1.00 0.39 C ATOM 57 C THR A 251 -5.036 -5.746 -8.707 1.00 0.40 C ATOM 58 O THR A 251 -5.938 -6.242 -9.383 1.00 0.48 O ATOM 59 CB THR A 251 -3.551 -5.144 -10.624 1.00 0.46 C ATOM 60 OG1 THR A 251 -2.496 -5.753 -11.380 1.00 0.59 O ATOM 61 CG2 THR A 251 -3.331 -3.639 -10.559 1.00 0.47 C ATOM 0 H THR A 251 -3.499 -7.712 -9.929 1.00 0.40 H new ATOM 0 HA THR A 251 -2.963 -5.152 -8.561 1.00 0.39 H new ATOM 0 HB THR A 251 -4.507 -5.333 -11.112 1.00 0.46 H new ATOM 0 HG1 THR A 251 -2.471 -5.364 -12.279 1.00 0.59 H new ATOM 0 HG21 THR A 251 -3.301 -3.232 -11.570 1.00 0.47 H new ATOM 0 HG22 THR A 251 -4.147 -3.176 -10.005 1.00 0.47 H new ATOM 0 HG23 THR A 251 -2.387 -3.431 -10.056 1.00 0.47 H new ATOM 69 N VAL A 252 -5.246 -5.205 -7.519 1.00 0.36 N ATOM 70 CA VAL A 252 -6.578 -5.169 -6.931 1.00 0.38 C ATOM 71 C VAL A 252 -7.160 -3.762 -6.952 1.00 0.35 C ATOM 72 O VAL A 252 -6.430 -2.775 -7.060 1.00 0.39 O ATOM 73 CB VAL A 252 -6.576 -5.694 -5.476 1.00 0.41 C ATOM 74 CG1 VAL A 252 -6.077 -7.128 -5.426 1.00 0.50 C ATOM 75 CG2 VAL A 252 -5.732 -4.800 -4.576 1.00 0.40 C ATOM 0 H VAL A 252 -4.516 -4.786 -6.943 1.00 0.36 H new ATOM 0 HA VAL A 252 -7.201 -5.823 -7.542 1.00 0.38 H new ATOM 0 HB VAL A 252 -7.601 -5.673 -5.107 1.00 0.41 H new ATOM 0 HG11 VAL A 252 -6.083 -7.480 -4.394 1.00 0.50 H new ATOM 0 HG12 VAL A 252 -6.728 -7.761 -6.029 1.00 0.50 H new ATOM 0 HG13 VAL A 252 -5.061 -7.174 -5.819 1.00 0.50 H new ATOM 0 HG21 VAL A 252 -5.747 -5.190 -3.558 1.00 0.40 H new ATOM 0 HG22 VAL A 252 -4.706 -4.780 -4.942 1.00 0.40 H new ATOM 0 HG23 VAL A 252 -6.139 -3.789 -4.583 1.00 0.40 H new ATOM 85 N THR A 253 -8.477 -3.689 -6.857 1.00 0.39 N ATOM 86 CA THR A 253 -9.187 -2.423 -6.841 1.00 0.40 C ATOM 87 C THR A 253 -10.042 -2.351 -5.576 1.00 0.39 C ATOM 88 O THR A 253 -10.781 -3.287 -5.258 1.00 0.54 O ATOM 89 CB THR A 253 -10.063 -2.237 -8.108 1.00 0.50 C ATOM 90 OG1 THR A 253 -10.748 -0.977 -8.064 1.00 0.76 O ATOM 91 CG2 THR A 253 -11.076 -3.365 -8.252 1.00 0.79 C ATOM 0 H THR A 253 -9.083 -4.506 -6.789 1.00 0.39 H new ATOM 0 HA THR A 253 -8.458 -1.613 -6.841 1.00 0.40 H new ATOM 0 HB THR A 253 -9.399 -2.257 -8.972 1.00 0.50 H new ATOM 0 HG1 THR A 253 -11.295 -0.874 -8.871 1.00 0.76 H new ATOM 0 HG21 THR A 253 -11.674 -3.205 -9.149 1.00 0.79 H new ATOM 0 HG22 THR A 253 -10.551 -4.317 -8.331 1.00 0.79 H new ATOM 0 HG23 THR A 253 -11.729 -3.381 -7.379 1.00 0.79 H new ATOM 99 N LEU A 254 -9.922 -1.259 -4.838 1.00 0.33 N ATOM 100 CA LEU A 254 -10.673 -1.107 -3.602 1.00 0.35 C ATOM 101 C LEU A 254 -11.721 -0.008 -3.707 1.00 0.35 C ATOM 102 O LEU A 254 -11.485 1.041 -4.311 1.00 0.37 O ATOM 103 CB LEU A 254 -9.721 -0.824 -2.442 1.00 0.36 C ATOM 104 CG LEU A 254 -8.677 -1.916 -2.187 1.00 0.39 C ATOM 105 CD1 LEU A 254 -7.776 -1.534 -1.027 1.00 0.46 C ATOM 106 CD2 LEU A 254 -9.348 -3.251 -1.906 1.00 0.45 C ATOM 0 H LEU A 254 -9.317 -0.471 -5.070 1.00 0.33 H new ATOM 0 HA LEU A 254 -11.199 -2.043 -3.416 1.00 0.35 H new ATOM 0 HB2 LEU A 254 -9.204 0.116 -2.636 1.00 0.36 H new ATOM 0 HB3 LEU A 254 -10.308 -0.683 -1.535 1.00 0.36 H new ATOM 0 HG LEU A 254 -8.069 -2.015 -3.086 1.00 0.39 H new ATOM 0 HD11 LEU A 254 -7.042 -2.322 -0.862 1.00 0.46 H new ATOM 0 HD12 LEU A 254 -7.261 -0.601 -1.258 1.00 0.46 H new ATOM 0 HD13 LEU A 254 -8.377 -1.404 -0.127 1.00 0.46 H new ATOM 0 HD21 LEU A 254 -8.587 -4.011 -1.728 1.00 0.45 H new ATOM 0 HD22 LEU A 254 -9.983 -3.161 -1.025 1.00 0.45 H new ATOM 0 HD23 LEU A 254 -9.956 -3.540 -2.763 1.00 0.45 H new ATOM 118 N ASN A 255 -12.876 -0.263 -3.105 1.00 0.40 N ATOM 119 CA ASN A 255 -13.983 0.680 -3.115 1.00 0.44 C ATOM 120 C ASN A 255 -13.796 1.739 -2.035 1.00 0.40 C ATOM 121 O ASN A 255 -13.944 1.461 -0.841 1.00 0.39 O ATOM 122 CB ASN A 255 -15.311 -0.059 -2.909 1.00 0.50 C ATOM 123 CG ASN A 255 -16.489 0.888 -2.774 1.00 0.55 C ATOM 124 OD1 ASN A 255 -16.849 1.299 -1.669 1.00 0.52 O ATOM 125 ND2 ASN A 255 -17.091 1.245 -3.895 1.00 0.65 N ATOM 0 H ASN A 255 -13.070 -1.127 -2.598 1.00 0.40 H new ATOM 0 HA ASN A 255 -14.004 1.177 -4.085 1.00 0.44 H new ATOM 0 HB2 ASN A 255 -15.484 -0.730 -3.750 1.00 0.50 H new ATOM 0 HB3 ASN A 255 -15.243 -0.679 -2.015 1.00 0.50 H new ATOM 0 HD21 ASN A 255 -17.886 1.884 -3.866 1.00 0.65 H new ATOM 0 HD22 ASN A 255 -16.761 0.882 -4.789 1.00 0.65 H new ATOM 132 N MET A 256 -13.478 2.952 -2.459 1.00 0.41 N ATOM 133 CA MET A 256 -13.268 4.054 -1.533 1.00 0.41 C ATOM 134 C MET A 256 -14.553 4.859 -1.343 1.00 0.44 C ATOM 135 O MET A 256 -14.521 6.030 -0.964 1.00 0.49 O ATOM 136 CB MET A 256 -12.134 4.954 -2.026 1.00 0.43 C ATOM 137 CG MET A 256 -10.797 4.236 -2.132 1.00 0.45 C ATOM 138 SD MET A 256 -10.311 3.421 -0.598 1.00 0.56 S ATOM 139 CE MET A 256 -9.807 4.829 0.389 1.00 0.63 C ATOM 0 H MET A 256 -13.359 3.199 -3.442 1.00 0.41 H new ATOM 0 HA MET A 256 -12.985 3.639 -0.565 1.00 0.41 H new ATOM 0 HB2 MET A 256 -12.399 5.359 -3.003 1.00 0.43 H new ATOM 0 HB3 MET A 256 -12.031 5.801 -1.348 1.00 0.43 H new ATOM 0 HG2 MET A 256 -10.851 3.495 -2.929 1.00 0.45 H new ATOM 0 HG3 MET A 256 -10.027 4.954 -2.415 1.00 0.45 H new ATOM 0 HE1 MET A 256 -9.478 4.487 1.370 1.00 0.63 H new ATOM 0 HE2 MET A 256 -8.987 5.347 -0.108 1.00 0.63 H new ATOM 0 HE3 MET A 256 -10.649 5.511 0.506 1.00 0.63 H new ATOM 149 N GLU A 257 -15.685 4.224 -1.621 1.00 0.46 N ATOM 150 CA GLU A 257 -16.979 4.864 -1.454 1.00 0.51 C ATOM 151 C GLU A 257 -17.540 4.506 -0.085 1.00 0.49 C ATOM 152 O GLU A 257 -17.997 5.369 0.664 1.00 0.56 O ATOM 153 CB GLU A 257 -17.945 4.420 -2.553 1.00 0.56 C ATOM 154 CG GLU A 257 -17.471 4.764 -3.957 1.00 0.67 C ATOM 155 CD GLU A 257 -17.393 6.258 -4.209 1.00 0.86 C ATOM 156 OE1 GLU A 257 -17.996 7.036 -3.442 1.00 1.23 O ATOM 157 OE2 GLU A 257 -16.728 6.659 -5.184 1.00 1.27 O ATOM 0 H GLU A 257 -15.730 3.264 -1.964 1.00 0.46 H new ATOM 0 HA GLU A 257 -16.856 5.945 -1.528 1.00 0.51 H new ATOM 0 HB2 GLU A 257 -18.092 3.342 -2.482 1.00 0.56 H new ATOM 0 HB3 GLU A 257 -18.915 4.886 -2.382 1.00 0.56 H new ATOM 0 HG2 GLU A 257 -16.488 4.322 -4.121 1.00 0.67 H new ATOM 0 HG3 GLU A 257 -18.148 4.314 -4.683 1.00 0.67 H new ATOM 164 N ARG A 258 -17.487 3.219 0.230 1.00 0.45 N ATOM 165 CA ARG A 258 -17.958 2.709 1.507 1.00 0.45 C ATOM 166 C ARG A 258 -16.840 2.810 2.541 1.00 0.43 C ATOM 167 O ARG A 258 -17.086 2.942 3.739 1.00 0.63 O ATOM 168 CB ARG A 258 -18.409 1.252 1.349 1.00 0.48 C ATOM 169 CG ARG A 258 -18.902 0.606 2.632 1.00 0.56 C ATOM 170 CD ARG A 258 -19.226 -0.863 2.415 1.00 0.64 C ATOM 171 NE ARG A 258 -19.564 -1.547 3.659 1.00 0.75 N ATOM 172 CZ ARG A 258 -19.816 -2.852 3.743 1.00 0.86 C ATOM 173 NH1 ARG A 258 -19.752 -3.619 2.660 1.00 1.01 N ATOM 174 NH2 ARG A 258 -20.134 -3.392 4.911 1.00 1.06 N ATOM 0 H ARG A 258 -17.116 2.501 -0.393 1.00 0.45 H new ATOM 0 HA ARG A 258 -18.807 3.303 1.846 1.00 0.45 H new ATOM 0 HB2 ARG A 258 -19.205 1.209 0.606 1.00 0.48 H new ATOM 0 HB3 ARG A 258 -17.576 0.667 0.958 1.00 0.48 H new ATOM 0 HG2 ARG A 258 -18.142 0.703 3.407 1.00 0.56 H new ATOM 0 HG3 ARG A 258 -19.790 1.129 2.988 1.00 0.56 H new ATOM 0 HD2 ARG A 258 -20.059 -0.949 1.718 1.00 0.64 H new ATOM 0 HD3 ARG A 258 -18.371 -1.357 1.953 1.00 0.64 H new ATOM 0 HE ARG A 258 -19.610 -0.993 4.514 1.00 0.75 H new ATOM 0 HH11 ARG A 258 -19.509 -3.209 1.758 1.00 1.01 H new ATOM 0 HH12 ARG A 258 -19.946 -4.618 2.730 1.00 1.01 H new ATOM 0 HH21 ARG A 258 -20.186 -2.808 5.746 1.00 1.06 H new ATOM 0 HH22 ARG A 258 -20.327 -4.392 4.975 1.00 1.06 H new ATOM 188 N HIS A 259 -15.605 2.758 2.059 1.00 0.37 N ATOM 189 CA HIS A 259 -14.437 2.836 2.926 1.00 0.35 C ATOM 190 C HIS A 259 -13.743 4.175 2.736 1.00 0.40 C ATOM 191 O HIS A 259 -13.565 4.628 1.610 1.00 0.63 O ATOM 192 CB HIS A 259 -13.464 1.694 2.618 1.00 0.38 C ATOM 193 CG HIS A 259 -14.056 0.333 2.807 1.00 0.46 C ATOM 194 ND1 HIS A 259 -14.408 -0.490 1.756 1.00 0.61 N ATOM 195 CD2 HIS A 259 -14.366 -0.349 3.935 1.00 0.58 C ATOM 196 CE1 HIS A 259 -14.910 -1.615 2.232 1.00 0.76 C ATOM 197 NE2 HIS A 259 -14.895 -1.553 3.549 1.00 0.75 N ATOM 0 H HIS A 259 -15.386 2.662 1.067 1.00 0.37 H new ATOM 0 HA HIS A 259 -14.763 2.744 3.962 1.00 0.35 H new ATOM 0 HB2 HIS A 259 -13.118 1.791 1.589 1.00 0.38 H new ATOM 0 HB3 HIS A 259 -12.588 1.792 3.259 1.00 0.38 H new ATOM 0 HD1 HIS A 259 -14.298 -0.265 0.767 1.00 0.61 H new ATOM 0 HD2 HIS A 259 -14.223 -0.008 4.950 1.00 0.58 H new ATOM 0 HE1 HIS A 259 -15.271 -2.445 1.643 1.00 0.76 H new ATOM 206 N HIS A 260 -13.360 4.814 3.830 1.00 0.36 N ATOM 207 CA HIS A 260 -12.697 6.114 3.750 1.00 0.42 C ATOM 208 C HIS A 260 -11.195 5.986 3.967 1.00 0.35 C ATOM 209 O HIS A 260 -10.470 6.978 3.914 1.00 0.42 O ATOM 210 CB HIS A 260 -13.286 7.080 4.779 1.00 0.56 C ATOM 211 CG HIS A 260 -14.713 7.458 4.515 1.00 0.71 C ATOM 212 ND1 HIS A 260 -15.108 8.739 4.204 1.00 0.97 N ATOM 213 CD2 HIS A 260 -15.845 6.712 4.525 1.00 0.88 C ATOM 214 CE1 HIS A 260 -16.418 8.766 4.035 1.00 1.09 C ATOM 215 NE2 HIS A 260 -16.888 7.548 4.222 1.00 1.01 N ATOM 0 H HIS A 260 -13.493 4.461 4.778 1.00 0.36 H new ATOM 0 HA HIS A 260 -12.867 6.508 2.748 1.00 0.42 H new ATOM 0 HB2 HIS A 260 -13.218 6.627 5.768 1.00 0.56 H new ATOM 0 HB3 HIS A 260 -12.679 7.985 4.801 1.00 0.56 H new ATOM 0 HD2 HIS A 260 -15.912 5.654 4.733 1.00 0.88 H new ATOM 0 HE1 HIS A 260 -17.005 9.638 3.786 1.00 1.09 H new ATOM 0 HE2 HIS A 260 -17.868 7.273 4.152 1.00 1.01 H new ATOM 224 N PHE A 261 -10.731 4.768 4.204 1.00 0.30 N ATOM 225 CA PHE A 261 -9.313 4.530 4.434 1.00 0.25 C ATOM 226 C PHE A 261 -8.912 3.137 3.968 1.00 0.21 C ATOM 227 O PHE A 261 -9.766 2.263 3.779 1.00 0.22 O ATOM 228 CB PHE A 261 -8.962 4.726 5.918 1.00 0.28 C ATOM 229 CG PHE A 261 -9.606 3.740 6.861 1.00 0.32 C ATOM 230 CD1 PHE A 261 -10.965 3.794 7.129 1.00 0.52 C ATOM 231 CD2 PHE A 261 -8.844 2.765 7.486 1.00 0.36 C ATOM 232 CE1 PHE A 261 -11.551 2.893 7.998 1.00 0.62 C ATOM 233 CE2 PHE A 261 -9.425 1.863 8.358 1.00 0.44 C ATOM 234 CZ PHE A 261 -10.781 1.927 8.613 1.00 0.52 C ATOM 0 H PHE A 261 -11.313 3.931 4.242 1.00 0.30 H new ATOM 0 HA PHE A 261 -8.750 5.258 3.849 1.00 0.25 H new ATOM 0 HB2 PHE A 261 -7.880 4.661 6.032 1.00 0.28 H new ATOM 0 HB3 PHE A 261 -9.254 5.733 6.215 1.00 0.28 H new ATOM 0 HD1 PHE A 261 -11.573 4.549 6.653 1.00 0.52 H new ATOM 0 HD2 PHE A 261 -7.784 2.709 7.289 1.00 0.36 H new ATOM 0 HE1 PHE A 261 -12.611 2.945 8.196 1.00 0.62 H new ATOM 0 HE2 PHE A 261 -8.819 1.109 8.839 1.00 0.44 H new ATOM 0 HZ PHE A 261 -11.238 1.222 9.292 1.00 0.52 H new ATOM 244 N LEU A 262 -7.613 2.941 3.784 1.00 0.17 N ATOM 245 CA LEU A 262 -7.083 1.666 3.340 1.00 0.14 C ATOM 246 C LEU A 262 -7.096 0.679 4.497 1.00 0.12 C ATOM 247 O LEU A 262 -7.615 -0.433 4.375 1.00 0.14 O ATOM 248 CB LEU A 262 -5.658 1.843 2.790 1.00 0.14 C ATOM 249 CG LEU A 262 -5.563 2.213 1.304 1.00 0.19 C ATOM 250 CD1 LEU A 262 -4.190 1.862 0.757 1.00 0.23 C ATOM 251 CD2 LEU A 262 -6.646 1.517 0.495 1.00 0.34 C ATOM 0 H LEU A 262 -6.904 3.658 3.938 1.00 0.17 H new ATOM 0 HA LEU A 262 -7.709 1.275 2.537 1.00 0.14 H new ATOM 0 HB2 LEU A 262 -5.157 2.617 3.372 1.00 0.14 H new ATOM 0 HB3 LEU A 262 -5.108 0.916 2.951 1.00 0.14 H new ATOM 0 HG LEU A 262 -5.713 3.289 1.216 1.00 0.19 H new ATOM 0 HD11 LEU A 262 -4.139 2.131 -0.298 1.00 0.23 H new ATOM 0 HD12 LEU A 262 -3.427 2.412 1.309 1.00 0.23 H new ATOM 0 HD13 LEU A 262 -4.017 0.791 0.867 1.00 0.23 H new ATOM 0 HD21 LEU A 262 -6.554 1.798 -0.554 1.00 0.34 H new ATOM 0 HD22 LEU A 262 -6.535 0.437 0.592 1.00 0.34 H new ATOM 0 HD23 LEU A 262 -7.626 1.816 0.866 1.00 0.34 H new ATOM 263 N GLY A 263 -6.540 1.107 5.624 1.00 0.11 N ATOM 264 CA GLY A 263 -6.503 0.270 6.802 1.00 0.12 C ATOM 265 C GLY A 263 -5.320 -0.668 6.810 1.00 0.11 C ATOM 266 O GLY A 263 -5.473 -1.866 7.043 1.00 0.14 O ATOM 0 H GLY A 263 -6.112 2.026 5.740 1.00 0.11 H new ATOM 0 HA2 GLY A 263 -6.468 0.901 7.690 1.00 0.12 H new ATOM 0 HA3 GLY A 263 -7.423 -0.311 6.859 1.00 0.12 H new ATOM 270 N ILE A 264 -4.137 -0.130 6.564 1.00 0.09 N ATOM 271 CA ILE A 264 -2.929 -0.940 6.547 1.00 0.09 C ATOM 272 C ILE A 264 -1.729 -0.172 7.078 1.00 0.08 C ATOM 273 O ILE A 264 -1.651 1.059 6.965 1.00 0.11 O ATOM 274 CB ILE A 264 -2.584 -1.460 5.132 1.00 0.12 C ATOM 275 CG1 ILE A 264 -2.945 -0.419 4.068 1.00 0.14 C ATOM 276 CG2 ILE A 264 -3.284 -2.781 4.858 1.00 0.17 C ATOM 277 CD1 ILE A 264 -2.412 -0.749 2.689 1.00 0.18 C ATOM 0 H ILE A 264 -3.987 0.861 6.374 1.00 0.09 H new ATOM 0 HA ILE A 264 -3.142 -1.790 7.196 1.00 0.09 H new ATOM 0 HB ILE A 264 -1.509 -1.632 5.085 1.00 0.12 H new ATOM 0 HG12 ILE A 264 -4.030 -0.326 4.016 1.00 0.14 H new ATOM 0 HG13 ILE A 264 -2.556 0.552 4.375 1.00 0.14 H new ATOM 0 HG21 ILE A 264 -3.027 -3.128 3.857 1.00 0.17 H new ATOM 0 HG22 ILE A 264 -2.965 -3.521 5.592 1.00 0.17 H new ATOM 0 HG23 ILE A 264 -4.363 -2.642 4.928 1.00 0.17 H new ATOM 0 HD11 ILE A 264 -2.707 0.032 1.988 1.00 0.18 H new ATOM 0 HD12 ILE A 264 -1.324 -0.813 2.725 1.00 0.18 H new ATOM 0 HD13 ILE A 264 -2.821 -1.704 2.360 1.00 0.18 H new ATOM 289 N SER A 265 -0.809 -0.913 7.676 1.00 0.09 N ATOM 290 CA SER A 265 0.417 -0.348 8.211 1.00 0.12 C ATOM 291 C SER A 265 1.547 -0.602 7.225 1.00 0.11 C ATOM 292 O SER A 265 1.825 -1.754 6.882 1.00 0.19 O ATOM 293 CB SER A 265 0.743 -0.983 9.563 1.00 0.20 C ATOM 294 OG SER A 265 -0.258 -1.920 9.933 1.00 1.00 O ATOM 0 H SER A 265 -0.892 -1.922 7.803 1.00 0.09 H new ATOM 0 HA SER A 265 0.293 0.725 8.357 1.00 0.12 H new ATOM 0 HB2 SER A 265 1.712 -1.480 9.513 1.00 0.20 H new ATOM 0 HB3 SER A 265 0.821 -0.208 10.325 1.00 0.20 H new ATOM 0 HG SER A 265 -0.825 -1.533 10.632 1.00 1.00 H new ATOM 300 N ILE A 266 2.179 0.457 6.760 1.00 0.10 N ATOM 301 CA ILE A 266 3.259 0.327 5.802 1.00 0.11 C ATOM 302 C ILE A 266 4.594 0.153 6.518 1.00 0.13 C ATOM 303 O ILE A 266 4.975 0.970 7.349 1.00 0.28 O ATOM 304 CB ILE A 266 3.343 1.546 4.849 1.00 0.13 C ATOM 305 CG1 ILE A 266 1.945 2.038 4.442 1.00 0.14 C ATOM 306 CG2 ILE A 266 4.154 1.189 3.615 1.00 0.19 C ATOM 307 CD1 ILE A 266 1.068 0.958 3.854 1.00 0.16 C ATOM 0 H ILE A 266 1.964 1.417 7.030 1.00 0.10 H new ATOM 0 HA ILE A 266 3.045 -0.558 5.203 1.00 0.11 H new ATOM 0 HB ILE A 266 3.840 2.356 5.383 1.00 0.13 H new ATOM 0 HG12 ILE A 266 1.449 2.460 5.316 1.00 0.14 H new ATOM 0 HG13 ILE A 266 2.050 2.844 3.715 1.00 0.14 H new ATOM 0 HG21 ILE A 266 4.207 2.053 2.952 1.00 0.19 H new ATOM 0 HG22 ILE A 266 5.161 0.898 3.913 1.00 0.19 H new ATOM 0 HG23 ILE A 266 3.677 0.360 3.093 1.00 0.19 H new ATOM 0 HD11 ILE A 266 0.098 1.380 3.591 1.00 0.16 H new ATOM 0 HD12 ILE A 266 1.541 0.551 2.960 1.00 0.16 H new ATOM 0 HD13 ILE A 266 0.931 0.162 4.586 1.00 0.16 H new ATOM 319 N VAL A 267 5.286 -0.929 6.213 1.00 0.12 N ATOM 320 CA VAL A 267 6.576 -1.198 6.820 1.00 0.14 C ATOM 321 C VAL A 267 7.694 -0.930 5.822 1.00 0.14 C ATOM 322 O VAL A 267 7.804 -1.611 4.800 1.00 0.23 O ATOM 323 CB VAL A 267 6.674 -2.653 7.327 1.00 0.24 C ATOM 324 CG1 VAL A 267 8.063 -2.947 7.879 1.00 0.29 C ATOM 325 CG2 VAL A 267 5.615 -2.922 8.383 1.00 0.31 C ATOM 0 H VAL A 267 4.976 -1.637 5.547 1.00 0.12 H new ATOM 0 HA VAL A 267 6.681 -0.531 7.676 1.00 0.14 H new ATOM 0 HB VAL A 267 6.498 -3.317 6.481 1.00 0.24 H new ATOM 0 HG11 VAL A 267 8.105 -3.978 8.229 1.00 0.29 H new ATOM 0 HG12 VAL A 267 8.805 -2.800 7.094 1.00 0.29 H new ATOM 0 HG13 VAL A 267 8.275 -2.273 8.709 1.00 0.29 H new ATOM 0 HG21 VAL A 267 5.699 -3.952 8.729 1.00 0.31 H new ATOM 0 HG22 VAL A 267 5.760 -2.244 9.224 1.00 0.31 H new ATOM 0 HG23 VAL A 267 4.625 -2.763 7.955 1.00 0.31 H new ATOM 335 N GLY A 268 8.503 0.076 6.108 1.00 0.17 N ATOM 336 CA GLY A 268 9.602 0.410 5.234 1.00 0.23 C ATOM 337 C GLY A 268 10.836 -0.411 5.543 1.00 0.23 C ATOM 338 O GLY A 268 11.525 -0.155 6.533 1.00 0.37 O ATOM 0 H GLY A 268 8.417 0.669 6.934 1.00 0.17 H new ATOM 0 HA2 GLY A 268 9.306 0.245 4.198 1.00 0.23 H new ATOM 0 HA3 GLY A 268 9.836 1.470 5.333 1.00 0.23 H new ATOM 342 N GLN A 269 11.112 -1.404 4.714 1.00 0.27 N ATOM 343 CA GLN A 269 12.272 -2.254 4.911 1.00 0.34 C ATOM 344 C GLN A 269 13.529 -1.512 4.477 1.00 0.38 C ATOM 345 O GLN A 269 13.743 -1.282 3.288 1.00 0.50 O ATOM 346 CB GLN A 269 12.116 -3.561 4.131 1.00 0.49 C ATOM 347 CG GLN A 269 13.316 -4.486 4.234 1.00 0.67 C ATOM 348 CD GLN A 269 12.986 -5.908 3.834 1.00 1.19 C ATOM 349 OE1 GLN A 269 12.637 -6.734 4.675 1.00 1.81 O ATOM 350 NE2 GLN A 269 13.083 -6.204 2.547 1.00 1.87 N ATOM 0 H GLN A 269 10.548 -1.641 3.898 1.00 0.27 H new ATOM 0 HA GLN A 269 12.358 -2.503 5.969 1.00 0.34 H new ATOM 0 HB2 GLN A 269 11.233 -4.086 4.494 1.00 0.49 H new ATOM 0 HB3 GLN A 269 11.939 -3.327 3.081 1.00 0.49 H new ATOM 0 HG2 GLN A 269 14.117 -4.109 3.598 1.00 0.67 H new ATOM 0 HG3 GLN A 269 13.691 -4.477 5.257 1.00 0.67 H new ATOM 0 HE21 GLN A 269 13.376 -5.490 1.880 1.00 1.87 H new ATOM 0 HE22 GLN A 269 12.864 -7.146 2.222 1.00 1.87 H new ATOM 446 N GLY A 277 12.152 -1.665 0.195 1.00 0.30 N ATOM 447 CA GLY A 277 10.786 -1.540 -0.259 1.00 0.29 C ATOM 448 C GLY A 277 9.797 -1.485 0.885 1.00 0.24 C ATOM 449 O GLY A 277 10.152 -1.729 2.041 1.00 0.27 O ATOM 0 HA2 GLY A 277 10.689 -0.638 -0.863 1.00 0.29 H new ATOM 0 HA3 GLY A 277 10.543 -2.384 -0.905 1.00 0.29 H new ATOM 453 N ILE A 278 8.552 -1.170 0.565 1.00 0.21 N ATOM 454 CA ILE A 278 7.510 -1.078 1.570 1.00 0.19 C ATOM 455 C ILE A 278 6.636 -2.329 1.568 1.00 0.18 C ATOM 456 O ILE A 278 6.155 -2.769 0.520 1.00 0.23 O ATOM 457 CB ILE A 278 6.641 0.180 1.363 1.00 0.20 C ATOM 458 CG1 ILE A 278 6.322 0.381 -0.121 1.00 0.23 C ATOM 459 CG2 ILE A 278 7.355 1.403 1.924 1.00 0.23 C ATOM 460 CD1 ILE A 278 5.210 1.379 -0.374 1.00 0.27 C ATOM 0 H ILE A 278 8.240 -0.974 -0.386 1.00 0.21 H new ATOM 0 HA ILE A 278 7.999 -0.999 2.541 1.00 0.19 H new ATOM 0 HB ILE A 278 5.700 0.044 1.896 1.00 0.20 H new ATOM 0 HG12 ILE A 278 7.223 0.716 -0.635 1.00 0.23 H new ATOM 0 HG13 ILE A 278 6.044 -0.578 -0.557 1.00 0.23 H new ATOM 0 HG21 ILE A 278 6.735 2.287 1.774 1.00 0.23 H new ATOM 0 HG22 ILE A 278 7.535 1.262 2.990 1.00 0.23 H new ATOM 0 HG23 ILE A 278 8.307 1.536 1.410 1.00 0.23 H new ATOM 0 HD11 ILE A 278 5.040 1.470 -1.447 1.00 0.27 H new ATOM 0 HD12 ILE A 278 4.296 1.036 0.111 1.00 0.27 H new ATOM 0 HD13 ILE A 278 5.494 2.350 0.032 1.00 0.27 H new ATOM 472 N TYR A 279 6.449 -2.906 2.744 1.00 0.15 N ATOM 473 CA TYR A 279 5.651 -4.116 2.893 1.00 0.16 C ATOM 474 C TYR A 279 4.442 -3.859 3.779 1.00 0.15 C ATOM 475 O TYR A 279 4.397 -2.870 4.510 1.00 0.18 O ATOM 476 CB TYR A 279 6.496 -5.239 3.502 1.00 0.19 C ATOM 477 CG TYR A 279 7.650 -5.693 2.634 1.00 0.24 C ATOM 478 CD1 TYR A 279 8.823 -4.950 2.552 1.00 0.42 C ATOM 479 CD2 TYR A 279 7.570 -6.871 1.902 1.00 0.44 C ATOM 480 CE1 TYR A 279 9.879 -5.367 1.767 1.00 0.55 C ATOM 481 CE2 TYR A 279 8.624 -7.293 1.114 1.00 0.57 C ATOM 482 CZ TYR A 279 9.775 -6.537 1.051 1.00 0.55 C ATOM 483 OH TYR A 279 10.827 -6.952 0.267 1.00 0.72 O ATOM 0 H TYR A 279 6.842 -2.554 3.617 1.00 0.15 H new ATOM 0 HA TYR A 279 5.308 -4.416 1.903 1.00 0.16 H new ATOM 0 HB2 TYR A 279 6.889 -4.902 4.461 1.00 0.19 H new ATOM 0 HB3 TYR A 279 5.851 -6.094 3.704 1.00 0.19 H new ATOM 0 HD1 TYR A 279 8.909 -4.031 3.112 1.00 0.42 H new ATOM 0 HD2 TYR A 279 6.670 -7.466 1.949 1.00 0.44 H new ATOM 0 HE1 TYR A 279 10.782 -4.778 1.715 1.00 0.55 H new ATOM 0 HE2 TYR A 279 8.546 -8.211 0.550 1.00 0.57 H new ATOM 0 HH TYR A 279 10.607 -6.810 -0.677 1.00 0.72 H new ATOM 493 N ILE A 280 3.463 -4.747 3.706 1.00 0.16 N ATOM 494 CA ILE A 280 2.261 -4.631 4.519 1.00 0.16 C ATOM 495 C ILE A 280 2.499 -5.251 5.895 1.00 0.17 C ATOM 496 O ILE A 280 2.693 -6.462 6.010 1.00 0.21 O ATOM 497 CB ILE A 280 1.053 -5.328 3.849 1.00 0.19 C ATOM 498 CG1 ILE A 280 0.772 -4.713 2.473 1.00 0.21 C ATOM 499 CG2 ILE A 280 -0.184 -5.243 4.741 1.00 0.21 C ATOM 500 CD1 ILE A 280 0.307 -3.273 2.534 1.00 0.24 C ATOM 0 H ILE A 280 3.477 -5.560 3.090 1.00 0.16 H new ATOM 0 HA ILE A 280 2.033 -3.570 4.622 1.00 0.16 H new ATOM 0 HB ILE A 280 1.299 -6.381 3.710 1.00 0.19 H new ATOM 0 HG12 ILE A 280 1.677 -4.768 1.868 1.00 0.21 H new ATOM 0 HG13 ILE A 280 0.013 -5.309 1.966 1.00 0.21 H new ATOM 0 HG21 ILE A 280 -1.021 -5.739 4.250 1.00 0.21 H new ATOM 0 HG22 ILE A 280 0.020 -5.732 5.694 1.00 0.21 H new ATOM 0 HG23 ILE A 280 -0.435 -4.197 4.917 1.00 0.21 H new ATOM 0 HD11 ILE A 280 0.128 -2.905 1.524 1.00 0.24 H new ATOM 0 HD12 ILE A 280 -0.616 -3.213 3.111 1.00 0.24 H new ATOM 0 HD13 ILE A 280 1.074 -2.663 3.012 1.00 0.24 H new ATOM 512 N GLY A 281 2.499 -4.420 6.931 1.00 0.20 N ATOM 513 CA GLY A 281 2.718 -4.912 8.279 1.00 0.23 C ATOM 514 C GLY A 281 1.497 -5.601 8.849 1.00 0.24 C ATOM 515 O GLY A 281 1.517 -6.804 9.103 1.00 0.42 O ATOM 0 H GLY A 281 2.351 -3.413 6.862 1.00 0.20 H new ATOM 0 HA2 GLY A 281 3.556 -5.608 8.277 1.00 0.23 H new ATOM 0 HA3 GLY A 281 2.997 -4.080 8.925 1.00 0.23 H new ATOM 519 N SER A 282 0.433 -4.842 9.044 1.00 0.25 N ATOM 520 CA SER A 282 -0.800 -5.388 9.585 1.00 0.29 C ATOM 521 C SER A 282 -2.010 -4.774 8.890 1.00 0.26 C ATOM 522 O SER A 282 -1.945 -3.650 8.386 1.00 0.30 O ATOM 523 CB SER A 282 -0.868 -5.141 11.098 1.00 0.35 C ATOM 524 OG SER A 282 0.080 -4.160 11.504 1.00 0.75 O ATOM 0 H SER A 282 0.398 -3.844 8.836 1.00 0.25 H new ATOM 0 HA SER A 282 -0.812 -6.463 9.405 1.00 0.29 H new ATOM 0 HB2 SER A 282 -1.872 -4.815 11.371 1.00 0.35 H new ATOM 0 HB3 SER A 282 -0.680 -6.074 11.630 1.00 0.35 H new ATOM 0 HG SER A 282 -0.097 -3.319 11.033 1.00 0.75 H new ATOM 530 N ILE A 283 -3.101 -5.521 8.854 1.00 0.24 N ATOM 531 CA ILE A 283 -4.330 -5.059 8.230 1.00 0.23 C ATOM 532 C ILE A 283 -5.342 -4.669 9.302 1.00 0.23 C ATOM 533 O ILE A 283 -5.571 -5.417 10.252 1.00 0.30 O ATOM 534 CB ILE A 283 -4.941 -6.144 7.314 1.00 0.27 C ATOM 535 CG1 ILE A 283 -3.905 -6.626 6.294 1.00 0.32 C ATOM 536 CG2 ILE A 283 -6.178 -5.612 6.604 1.00 0.29 C ATOM 537 CD1 ILE A 283 -4.354 -7.827 5.487 1.00 0.53 C ATOM 0 H ILE A 283 -3.160 -6.458 9.253 1.00 0.24 H new ATOM 0 HA ILE A 283 -4.087 -4.191 7.617 1.00 0.23 H new ATOM 0 HB ILE A 283 -5.238 -6.990 7.934 1.00 0.27 H new ATOM 0 HG12 ILE A 283 -3.673 -5.808 5.612 1.00 0.32 H new ATOM 0 HG13 ILE A 283 -2.982 -6.876 6.818 1.00 0.32 H new ATOM 0 HG21 ILE A 283 -6.593 -6.391 5.964 1.00 0.29 H new ATOM 0 HG22 ILE A 283 -6.922 -5.314 7.343 1.00 0.29 H new ATOM 0 HG23 ILE A 283 -5.906 -4.749 5.996 1.00 0.29 H new ATOM 0 HD11 ILE A 283 -3.568 -8.109 4.787 1.00 0.53 H new ATOM 0 HD12 ILE A 283 -4.558 -8.661 6.159 1.00 0.53 H new ATOM 0 HD13 ILE A 283 -5.259 -7.576 4.934 1.00 0.53 H new ATOM 549 N MET A 284 -5.934 -3.496 9.154 1.00 0.20 N ATOM 550 CA MET A 284 -6.912 -3.010 10.115 1.00 0.21 C ATOM 551 C MET A 284 -8.319 -3.390 9.686 1.00 0.22 C ATOM 552 O MET A 284 -8.736 -3.106 8.558 1.00 0.23 O ATOM 553 CB MET A 284 -6.803 -1.493 10.277 1.00 0.24 C ATOM 554 CG MET A 284 -5.500 -1.037 10.914 1.00 0.35 C ATOM 555 SD MET A 284 -5.228 -1.750 12.550 1.00 0.54 S ATOM 556 CE MET A 284 -3.936 -2.941 12.193 1.00 0.74 C ATOM 0 H MET A 284 -5.755 -2.861 8.376 1.00 0.20 H new ATOM 0 HA MET A 284 -6.702 -3.478 11.077 1.00 0.21 H new ATOM 0 HB2 MET A 284 -6.902 -1.024 9.298 1.00 0.24 H new ATOM 0 HB3 MET A 284 -7.637 -1.141 10.885 1.00 0.24 H new ATOM 0 HG2 MET A 284 -4.669 -1.308 10.263 1.00 0.35 H new ATOM 0 HG3 MET A 284 -5.501 0.050 10.993 1.00 0.35 H new ATOM 0 HE1 MET A 284 -3.349 -3.122 13.093 1.00 0.74 H new ATOM 0 HE2 MET A 284 -4.385 -3.876 11.859 1.00 0.74 H new ATOM 0 HE3 MET A 284 -3.287 -2.550 11.409 1.00 0.74 H new ATOM 566 N LYS A 285 -9.040 -4.040 10.585 1.00 0.28 N ATOM 567 CA LYS A 285 -10.402 -4.460 10.309 1.00 0.33 C ATOM 568 C LYS A 285 -11.295 -3.236 10.126 1.00 0.33 C ATOM 569 O LYS A 285 -11.298 -2.326 10.955 1.00 0.46 O ATOM 570 CB LYS A 285 -10.923 -5.351 11.441 1.00 0.43 C ATOM 571 CG LYS A 285 -12.026 -6.307 11.007 1.00 0.49 C ATOM 572 CD LYS A 285 -11.608 -7.158 9.814 1.00 0.63 C ATOM 573 CE LYS A 285 -12.512 -8.371 9.646 1.00 0.83 C ATOM 574 NZ LYS A 285 -13.954 -8.003 9.617 1.00 1.01 N ATOM 0 H LYS A 285 -8.702 -4.288 11.515 1.00 0.28 H new ATOM 0 HA LYS A 285 -10.417 -5.041 9.387 1.00 0.33 H new ATOM 0 HB2 LYS A 285 -10.093 -5.928 11.849 1.00 0.43 H new ATOM 0 HB3 LYS A 285 -11.298 -4.719 12.246 1.00 0.43 H new ATOM 0 HG2 LYS A 285 -12.291 -6.957 11.841 1.00 0.49 H new ATOM 0 HG3 LYS A 285 -12.919 -5.737 10.751 1.00 0.49 H new ATOM 0 HD2 LYS A 285 -11.637 -6.554 8.907 1.00 0.63 H new ATOM 0 HD3 LYS A 285 -10.577 -7.487 9.945 1.00 0.63 H new ATOM 0 HE2 LYS A 285 -12.253 -8.889 8.722 1.00 0.83 H new ATOM 0 HE3 LYS A 285 -12.334 -9.070 10.464 1.00 0.83 H new ATOM 0 HZ1 LYS A 285 -14.516 -8.825 9.317 1.00 1.01 H new ATOM 0 HZ2 LYS A 285 -14.255 -7.705 10.567 1.00 1.01 H new ATOM 0 HZ3 LYS A 285 -14.099 -7.221 8.947 1.00 1.01 H new ATOM 588 N GLY A 286 -12.031 -3.212 9.026 1.00 0.33 N ATOM 589 CA GLY A 286 -12.902 -2.089 8.735 1.00 0.35 C ATOM 590 C GLY A 286 -12.377 -1.264 7.580 1.00 0.30 C ATOM 591 O GLY A 286 -13.083 -0.412 7.036 1.00 0.36 O ATOM 0 H GLY A 286 -12.042 -3.953 8.325 1.00 0.33 H new ATOM 0 HA2 GLY A 286 -13.901 -2.454 8.498 1.00 0.35 H new ATOM 0 HA3 GLY A 286 -12.994 -1.460 9.620 1.00 0.35 H new ATOM 595 N GLY A 287 -11.129 -1.516 7.209 1.00 0.26 N ATOM 596 CA GLY A 287 -10.522 -0.801 6.109 1.00 0.24 C ATOM 597 C GLY A 287 -10.862 -1.430 4.777 1.00 0.22 C ATOM 598 O GLY A 287 -11.432 -2.523 4.729 1.00 0.24 O ATOM 0 H GLY A 287 -10.525 -2.207 7.654 1.00 0.26 H new ATOM 0 HA2 GLY A 287 -10.859 0.235 6.119 1.00 0.24 H new ATOM 0 HA3 GLY A 287 -9.440 -0.785 6.238 1.00 0.24 H new ATOM 602 N ALA A 288 -10.509 -0.750 3.696 1.00 0.21 N ATOM 603 CA ALA A 288 -10.783 -1.248 2.355 1.00 0.22 C ATOM 604 C ALA A 288 -10.053 -2.564 2.093 1.00 0.22 C ATOM 605 O ALA A 288 -10.598 -3.469 1.462 1.00 0.25 O ATOM 606 CB ALA A 288 -10.390 -0.207 1.320 1.00 0.24 C ATOM 0 H ALA A 288 -10.031 0.151 3.721 1.00 0.21 H new ATOM 0 HA ALA A 288 -11.853 -1.439 2.276 1.00 0.22 H new ATOM 0 HB1 ALA A 288 -10.599 -0.590 0.321 1.00 0.24 H new ATOM 0 HB2 ALA A 288 -10.963 0.705 1.486 1.00 0.24 H new ATOM 0 HB3 ALA A 288 -9.326 0.011 1.409 1.00 0.24 H new ATOM 612 N VAL A 289 -8.833 -2.674 2.609 1.00 0.20 N ATOM 613 CA VAL A 289 -8.028 -3.878 2.430 1.00 0.21 C ATOM 614 C VAL A 289 -8.644 -5.066 3.172 1.00 0.23 C ATOM 615 O VAL A 289 -8.592 -6.203 2.702 1.00 0.26 O ATOM 616 CB VAL A 289 -6.580 -3.658 2.920 1.00 0.20 C ATOM 617 CG1 VAL A 289 -5.728 -4.897 2.683 1.00 0.23 C ATOM 618 CG2 VAL A 289 -5.960 -2.446 2.237 1.00 0.20 C ATOM 0 H VAL A 289 -8.379 -1.942 3.156 1.00 0.20 H new ATOM 0 HA VAL A 289 -8.009 -4.099 1.363 1.00 0.21 H new ATOM 0 HB VAL A 289 -6.614 -3.471 3.993 1.00 0.20 H new ATOM 0 HG11 VAL A 289 -4.714 -4.714 3.037 1.00 0.23 H new ATOM 0 HG12 VAL A 289 -6.155 -5.741 3.225 1.00 0.23 H new ATOM 0 HG13 VAL A 289 -5.705 -5.124 1.617 1.00 0.23 H new ATOM 0 HG21 VAL A 289 -4.940 -2.308 2.596 1.00 0.20 H new ATOM 0 HG22 VAL A 289 -5.947 -2.603 1.158 1.00 0.20 H new ATOM 0 HG23 VAL A 289 -6.549 -1.558 2.467 1.00 0.20 H new ATOM 628 N ALA A 290 -9.259 -4.789 4.314 1.00 0.23 N ATOM 629 CA ALA A 290 -9.880 -5.831 5.123 1.00 0.27 C ATOM 630 C ALA A 290 -11.111 -6.418 4.436 1.00 0.29 C ATOM 631 O ALA A 290 -11.543 -7.526 4.753 1.00 0.37 O ATOM 632 CB ALA A 290 -10.253 -5.281 6.488 1.00 0.29 C ATOM 0 H ALA A 290 -9.342 -3.849 4.702 1.00 0.23 H new ATOM 0 HA ALA A 290 -9.154 -6.635 5.246 1.00 0.27 H new ATOM 0 HB1 ALA A 290 -10.716 -6.068 7.083 1.00 0.29 H new ATOM 0 HB2 ALA A 290 -9.356 -4.923 6.994 1.00 0.29 H new ATOM 0 HB3 ALA A 290 -10.955 -4.456 6.368 1.00 0.29 H new ATOM 638 N ALA A 291 -11.676 -5.671 3.496 1.00 0.29 N ATOM 639 CA ALA A 291 -12.858 -6.122 2.772 1.00 0.32 C ATOM 640 C ALA A 291 -12.470 -6.882 1.510 1.00 0.32 C ATOM 641 O ALA A 291 -13.326 -7.449 0.828 1.00 0.41 O ATOM 642 CB ALA A 291 -13.754 -4.942 2.429 1.00 0.38 C ATOM 0 H ALA A 291 -11.335 -4.751 3.217 1.00 0.29 H new ATOM 0 HA ALA A 291 -13.411 -6.803 3.419 1.00 0.32 H new ATOM 0 HB1 ALA A 291 -14.632 -5.297 1.889 1.00 0.38 H new ATOM 0 HB2 ALA A 291 -14.069 -4.445 3.347 1.00 0.38 H new ATOM 0 HB3 ALA A 291 -13.204 -4.237 1.805 1.00 0.38 H new ATOM 648 N ASP A 292 -11.180 -6.895 1.203 1.00 0.31 N ATOM 649 CA ASP A 292 -10.684 -7.590 0.025 1.00 0.32 C ATOM 650 C ASP A 292 -10.311 -9.025 0.386 1.00 0.30 C ATOM 651 O ASP A 292 -11.052 -9.963 0.082 1.00 0.38 O ATOM 652 CB ASP A 292 -9.479 -6.854 -0.564 1.00 0.37 C ATOM 653 CG ASP A 292 -9.059 -7.423 -1.901 1.00 0.43 C ATOM 654 OD1 ASP A 292 -8.311 -8.419 -1.917 1.00 0.45 O ATOM 655 OD2 ASP A 292 -9.478 -6.879 -2.940 1.00 0.55 O ATOM 0 H ASP A 292 -10.458 -6.431 1.755 1.00 0.31 H new ATOM 0 HA ASP A 292 -11.471 -7.611 -0.728 1.00 0.32 H new ATOM 0 HB2 ASP A 292 -9.722 -5.798 -0.681 1.00 0.37 H new ATOM 0 HB3 ASP A 292 -8.643 -6.913 0.133 1.00 0.37 H new ATOM 660 N GLY A 293 -9.168 -9.198 1.042 1.00 0.29 N ATOM 661 CA GLY A 293 -8.751 -10.526 1.452 1.00 0.33 C ATOM 662 C GLY A 293 -7.566 -11.073 0.676 1.00 0.33 C ATOM 663 O GLY A 293 -6.934 -12.034 1.116 1.00 0.39 O ATOM 0 H GLY A 293 -8.526 -8.447 1.296 1.00 0.29 H new ATOM 0 HA2 GLY A 293 -8.498 -10.504 2.512 1.00 0.33 H new ATOM 0 HA3 GLY A 293 -9.592 -11.210 1.339 1.00 0.33 H new ATOM 667 N ARG A 294 -7.260 -10.484 -0.476 1.00 0.31 N ATOM 668 CA ARG A 294 -6.136 -10.947 -1.290 1.00 0.32 C ATOM 669 C ARG A 294 -4.812 -10.479 -0.705 1.00 0.30 C ATOM 670 O ARG A 294 -3.807 -11.187 -0.775 1.00 0.37 O ATOM 671 CB ARG A 294 -6.274 -10.466 -2.734 1.00 0.35 C ATOM 672 CG ARG A 294 -7.274 -11.275 -3.538 1.00 0.41 C ATOM 673 CD ARG A 294 -7.657 -10.565 -4.821 1.00 0.44 C ATOM 674 NE ARG A 294 -8.555 -9.439 -4.582 1.00 0.43 N ATOM 675 CZ ARG A 294 -9.532 -9.078 -5.413 1.00 0.54 C ATOM 676 NH1 ARG A 294 -9.761 -9.767 -6.525 1.00 0.68 N ATOM 677 NH2 ARG A 294 -10.278 -8.023 -5.125 1.00 0.58 N ATOM 0 H ARG A 294 -7.769 -9.691 -0.867 1.00 0.31 H new ATOM 0 HA ARG A 294 -6.150 -12.037 -1.285 1.00 0.32 H new ATOM 0 HB2 ARG A 294 -6.578 -9.419 -2.734 1.00 0.35 H new ATOM 0 HB3 ARG A 294 -5.300 -10.515 -3.222 1.00 0.35 H new ATOM 0 HG2 ARG A 294 -6.849 -12.251 -3.773 1.00 0.41 H new ATOM 0 HG3 ARG A 294 -8.167 -11.452 -2.938 1.00 0.41 H new ATOM 0 HD2 ARG A 294 -6.756 -10.209 -5.320 1.00 0.44 H new ATOM 0 HD3 ARG A 294 -8.137 -11.273 -5.497 1.00 0.44 H new ATOM 0 HE ARG A 294 -8.427 -8.896 -3.728 1.00 0.43 H new ATOM 0 HH11 ARG A 294 -9.187 -10.580 -6.749 1.00 0.68 H new ATOM 0 HH12 ARG A 294 -10.511 -9.483 -7.155 1.00 0.68 H new ATOM 0 HH21 ARG A 294 -10.103 -7.492 -4.272 1.00 0.58 H new ATOM 0 HH22 ARG A 294 -11.028 -7.741 -5.756 1.00 0.58 H new ATOM 691 N ILE A 295 -4.814 -9.286 -0.130 1.00 0.26 N ATOM 692 CA ILE A 295 -3.611 -8.737 0.478 1.00 0.25 C ATOM 693 C ILE A 295 -3.436 -9.312 1.882 1.00 0.25 C ATOM 694 O ILE A 295 -4.403 -9.423 2.638 1.00 0.29 O ATOM 695 CB ILE A 295 -3.662 -7.194 0.538 1.00 0.25 C ATOM 696 CG1 ILE A 295 -3.897 -6.619 -0.863 1.00 0.27 C ATOM 697 CG2 ILE A 295 -2.372 -6.635 1.131 1.00 0.27 C ATOM 698 CD1 ILE A 295 -4.095 -5.118 -0.883 1.00 0.37 C ATOM 0 H ILE A 295 -5.633 -8.681 -0.071 1.00 0.26 H new ATOM 0 HA ILE A 295 -2.758 -9.017 -0.140 1.00 0.25 H new ATOM 0 HB ILE A 295 -4.490 -6.900 1.183 1.00 0.25 H new ATOM 0 HG12 ILE A 295 -3.047 -6.872 -1.497 1.00 0.27 H new ATOM 0 HG13 ILE A 295 -4.774 -7.097 -1.299 1.00 0.27 H new ATOM 0 HG21 ILE A 295 -2.428 -5.547 1.164 1.00 0.27 H new ATOM 0 HG22 ILE A 295 -2.238 -7.023 2.141 1.00 0.27 H new ATOM 0 HG23 ILE A 295 -1.527 -6.936 0.512 1.00 0.27 H new ATOM 0 HD11 ILE A 295 -4.255 -4.786 -1.909 1.00 0.37 H new ATOM 0 HD12 ILE A 295 -4.963 -4.857 -0.277 1.00 0.37 H new ATOM 0 HD13 ILE A 295 -3.209 -4.629 -0.478 1.00 0.37 H new ATOM 710 N GLU A 296 -2.213 -9.695 2.216 1.00 0.24 N ATOM 711 CA GLU A 296 -1.920 -10.266 3.521 1.00 0.26 C ATOM 712 C GLU A 296 -0.670 -9.626 4.122 1.00 0.24 C ATOM 713 O GLU A 296 0.144 -9.045 3.396 1.00 0.22 O ATOM 714 CB GLU A 296 -1.731 -11.784 3.392 1.00 0.31 C ATOM 715 CG GLU A 296 -0.498 -12.186 2.596 1.00 0.36 C ATOM 716 CD GLU A 296 -0.476 -13.661 2.255 1.00 0.49 C ATOM 717 OE1 GLU A 296 0.012 -14.462 3.080 1.00 0.69 O ATOM 718 OE2 GLU A 296 -0.932 -14.025 1.151 1.00 0.56 O ATOM 0 H GLU A 296 -1.405 -9.620 1.598 1.00 0.24 H new ATOM 0 HA GLU A 296 -2.759 -10.065 4.187 1.00 0.26 H new ATOM 0 HB2 GLU A 296 -1.665 -12.218 4.390 1.00 0.31 H new ATOM 0 HB3 GLU A 296 -2.614 -12.211 2.916 1.00 0.31 H new ATOM 0 HG2 GLU A 296 -0.460 -11.604 1.675 1.00 0.36 H new ATOM 0 HG3 GLU A 296 0.396 -11.936 3.168 1.00 0.36 H new ATOM 725 N PRO A 297 -0.507 -9.701 5.457 1.00 0.26 N ATOM 726 CA PRO A 297 0.668 -9.148 6.140 1.00 0.27 C ATOM 727 C PRO A 297 1.958 -9.805 5.652 1.00 0.27 C ATOM 728 O PRO A 297 2.300 -10.918 6.061 1.00 0.41 O ATOM 729 CB PRO A 297 0.421 -9.477 7.618 1.00 0.32 C ATOM 730 CG PRO A 297 -1.041 -9.725 7.726 1.00 0.34 C ATOM 731 CD PRO A 297 -1.458 -10.308 6.408 1.00 0.32 C ATOM 0 HA PRO A 297 0.791 -8.081 5.954 1.00 0.27 H new ATOM 0 HB2 PRO A 297 0.992 -10.352 7.927 1.00 0.32 H new ATOM 0 HB3 PRO A 297 0.729 -8.653 8.261 1.00 0.32 H new ATOM 0 HG2 PRO A 297 -1.261 -10.411 8.544 1.00 0.34 H new ATOM 0 HG3 PRO A 297 -1.580 -8.800 7.932 1.00 0.34 H new ATOM 0 HD2 PRO A 297 -1.389 -11.396 6.408 1.00 0.32 H new ATOM 0 HD3 PRO A 297 -2.490 -10.055 6.164 1.00 0.32 H new ATOM 739 N GLY A 298 2.656 -9.121 4.762 1.00 0.27 N ATOM 740 CA GLY A 298 3.887 -9.643 4.215 1.00 0.28 C ATOM 741 C GLY A 298 4.025 -9.317 2.746 1.00 0.25 C ATOM 742 O GLY A 298 5.113 -9.422 2.181 1.00 0.29 O ATOM 0 H GLY A 298 2.388 -8.204 4.406 1.00 0.27 H new ATOM 0 HA2 GLY A 298 4.734 -9.228 4.762 1.00 0.28 H new ATOM 0 HA3 GLY A 298 3.918 -10.724 4.353 1.00 0.28 H new ATOM 746 N ASP A 299 2.915 -8.924 2.127 1.00 0.22 N ATOM 747 CA ASP A 299 2.911 -8.568 0.713 1.00 0.22 C ATOM 748 C ASP A 299 3.725 -7.297 0.484 1.00 0.20 C ATOM 749 O ASP A 299 3.760 -6.408 1.339 1.00 0.21 O ATOM 750 CB ASP A 299 1.481 -8.360 0.200 1.00 0.24 C ATOM 751 CG ASP A 299 0.708 -9.656 0.031 1.00 0.27 C ATOM 752 OD1 ASP A 299 1.334 -10.712 -0.196 1.00 0.34 O ATOM 753 OD2 ASP A 299 -0.536 -9.627 0.116 1.00 0.28 O ATOM 0 H ASP A 299 2.006 -8.844 2.584 1.00 0.22 H new ATOM 0 HA ASP A 299 3.362 -9.392 0.161 1.00 0.22 H new ATOM 0 HB2 ASP A 299 0.944 -7.713 0.894 1.00 0.24 H new ATOM 0 HB3 ASP A 299 1.518 -7.840 -0.757 1.00 0.24 H new ATOM 758 N MET A 300 4.380 -7.219 -0.666 1.00 0.21 N ATOM 759 CA MET A 300 5.199 -6.066 -1.007 1.00 0.21 C ATOM 760 C MET A 300 4.446 -5.126 -1.940 1.00 0.19 C ATOM 761 O MET A 300 3.806 -5.568 -2.895 1.00 0.21 O ATOM 762 CB MET A 300 6.497 -6.534 -1.667 1.00 0.27 C ATOM 763 CG MET A 300 7.467 -5.409 -1.997 1.00 0.32 C ATOM 764 SD MET A 300 9.027 -6.024 -2.670 1.00 0.50 S ATOM 765 CE MET A 300 9.873 -4.486 -3.021 1.00 1.26 C ATOM 0 H MET A 300 4.359 -7.945 -1.382 1.00 0.21 H new ATOM 0 HA MET A 300 5.435 -5.522 -0.092 1.00 0.21 H new ATOM 0 HB2 MET A 300 6.993 -7.244 -1.005 1.00 0.27 H new ATOM 0 HB3 MET A 300 6.253 -7.070 -2.584 1.00 0.27 H new ATOM 0 HG2 MET A 300 7.005 -4.733 -2.716 1.00 0.32 H new ATOM 0 HG3 MET A 300 7.666 -4.828 -1.096 1.00 0.32 H new ATOM 0 HE1 MET A 300 10.376 -4.559 -3.985 1.00 1.26 H new ATOM 0 HE2 MET A 300 9.150 -3.671 -3.050 1.00 1.26 H new ATOM 0 HE3 MET A 300 10.609 -4.290 -2.242 1.00 1.26 H new ATOM 775 N LEU A 301 4.518 -3.836 -1.654 1.00 0.19 N ATOM 776 CA LEU A 301 3.852 -2.834 -2.471 1.00 0.19 C ATOM 777 C LEU A 301 4.792 -2.347 -3.563 1.00 0.20 C ATOM 778 O LEU A 301 5.847 -1.784 -3.274 1.00 0.24 O ATOM 779 CB LEU A 301 3.401 -1.655 -1.608 1.00 0.23 C ATOM 780 CG LEU A 301 2.285 -1.962 -0.609 1.00 0.33 C ATOM 781 CD1 LEU A 301 2.274 -0.930 0.512 1.00 0.48 C ATOM 782 CD2 LEU A 301 0.939 -1.995 -1.317 1.00 0.47 C ATOM 0 H LEU A 301 5.033 -3.457 -0.859 1.00 0.19 H new ATOM 0 HA LEU A 301 2.973 -3.287 -2.930 1.00 0.19 H new ATOM 0 HB2 LEU A 301 4.264 -1.278 -1.059 1.00 0.23 H new ATOM 0 HB3 LEU A 301 3.066 -0.853 -2.265 1.00 0.23 H new ATOM 0 HG LEU A 301 2.471 -2.942 -0.170 1.00 0.33 H new ATOM 0 HD11 LEU A 301 1.474 -1.164 1.214 1.00 0.48 H new ATOM 0 HD12 LEU A 301 3.231 -0.949 1.033 1.00 0.48 H new ATOM 0 HD13 LEU A 301 2.110 0.062 0.092 1.00 0.48 H new ATOM 0 HD21 LEU A 301 0.153 -2.215 -0.594 1.00 0.47 H new ATOM 0 HD22 LEU A 301 0.747 -1.027 -1.779 1.00 0.47 H new ATOM 0 HD23 LEU A 301 0.951 -2.768 -2.086 1.00 0.47 H new ATOM 794 N LEU A 302 4.416 -2.577 -4.812 1.00 0.20 N ATOM 795 CA LEU A 302 5.237 -2.161 -5.941 1.00 0.22 C ATOM 796 C LEU A 302 4.698 -0.878 -6.555 1.00 0.22 C ATOM 797 O LEU A 302 5.361 0.160 -6.547 1.00 0.29 O ATOM 798 CB LEU A 302 5.281 -3.259 -7.010 1.00 0.27 C ATOM 799 CG LEU A 302 5.810 -4.617 -6.540 1.00 0.37 C ATOM 800 CD1 LEU A 302 5.799 -5.613 -7.688 1.00 0.53 C ATOM 801 CD2 LEU A 302 7.213 -4.474 -5.970 1.00 0.46 C ATOM 0 H LEU A 302 3.549 -3.049 -5.070 1.00 0.20 H new ATOM 0 HA LEU A 302 6.246 -1.981 -5.571 1.00 0.22 H new ATOM 0 HB2 LEU A 302 4.275 -3.398 -7.405 1.00 0.27 H new ATOM 0 HB3 LEU A 302 5.902 -2.913 -7.836 1.00 0.27 H new ATOM 0 HG LEU A 302 5.157 -4.990 -5.751 1.00 0.37 H new ATOM 0 HD11 LEU A 302 6.178 -6.574 -7.340 1.00 0.53 H new ATOM 0 HD12 LEU A 302 4.779 -5.736 -8.054 1.00 0.53 H new ATOM 0 HD13 LEU A 302 6.432 -5.245 -8.495 1.00 0.53 H new ATOM 0 HD21 LEU A 302 7.573 -5.449 -5.641 1.00 0.46 H new ATOM 0 HD22 LEU A 302 7.879 -4.081 -6.738 1.00 0.46 H new ATOM 0 HD23 LEU A 302 7.193 -3.789 -5.122 1.00 0.46 H new ATOM 813 N GLN A 303 3.483 -0.954 -7.073 1.00 0.21 N ATOM 814 CA GLN A 303 2.853 0.192 -7.705 1.00 0.22 C ATOM 815 C GLN A 303 1.478 0.449 -7.114 1.00 0.21 C ATOM 816 O GLN A 303 0.678 -0.476 -6.946 1.00 0.25 O ATOM 817 CB GLN A 303 2.732 -0.034 -9.215 1.00 0.27 C ATOM 818 CG GLN A 303 1.827 0.972 -9.914 1.00 0.32 C ATOM 819 CD GLN A 303 1.263 0.450 -11.219 1.00 0.51 C ATOM 820 OE1 GLN A 303 0.127 0.756 -11.583 1.00 0.68 O ATOM 821 NE2 GLN A 303 2.054 -0.333 -11.937 1.00 0.73 N ATOM 0 H GLN A 303 2.913 -1.800 -7.068 1.00 0.21 H new ATOM 0 HA GLN A 303 3.479 1.065 -7.521 1.00 0.22 H new ATOM 0 HB2 GLN A 303 3.725 0.013 -9.661 1.00 0.27 H new ATOM 0 HB3 GLN A 303 2.349 -1.039 -9.394 1.00 0.27 H new ATOM 0 HG2 GLN A 303 1.005 1.237 -9.249 1.00 0.32 H new ATOM 0 HG3 GLN A 303 2.389 1.886 -10.107 1.00 0.32 H new ATOM 0 HE21 GLN A 303 2.989 -0.562 -11.599 1.00 0.73 H new ATOM 0 HE22 GLN A 303 1.729 -0.707 -12.828 1.00 0.73 H new ATOM 830 N VAL A 304 1.207 1.701 -6.792 1.00 0.20 N ATOM 831 CA VAL A 304 -0.080 2.079 -6.245 1.00 0.21 C ATOM 832 C VAL A 304 -0.751 3.088 -7.161 1.00 0.22 C ATOM 833 O VAL A 304 -0.587 4.292 -6.997 1.00 0.26 O ATOM 834 CB VAL A 304 0.035 2.665 -4.825 1.00 0.24 C ATOM 835 CG1 VAL A 304 -1.345 2.958 -4.256 1.00 0.29 C ATOM 836 CG2 VAL A 304 0.800 1.715 -3.916 1.00 0.27 C ATOM 0 H VAL A 304 1.864 2.474 -6.901 1.00 0.20 H new ATOM 0 HA VAL A 304 -0.683 1.173 -6.177 1.00 0.21 H new ATOM 0 HB VAL A 304 0.588 3.603 -4.882 1.00 0.24 H new ATOM 0 HG11 VAL A 304 -1.245 3.371 -3.252 1.00 0.29 H new ATOM 0 HG12 VAL A 304 -1.857 3.677 -4.895 1.00 0.29 H new ATOM 0 HG13 VAL A 304 -1.924 2.035 -4.212 1.00 0.29 H new ATOM 0 HG21 VAL A 304 0.871 2.146 -2.917 1.00 0.27 H new ATOM 0 HG22 VAL A 304 0.276 0.761 -3.863 1.00 0.27 H new ATOM 0 HG23 VAL A 304 1.802 1.557 -4.315 1.00 0.27 H new ATOM 846 N ASN A 305 -1.484 2.572 -8.138 1.00 0.27 N ATOM 847 CA ASN A 305 -2.194 3.394 -9.113 1.00 0.33 C ATOM 848 C ASN A 305 -1.225 4.227 -9.953 1.00 0.31 C ATOM 849 O ASN A 305 -0.968 5.395 -9.651 1.00 0.34 O ATOM 850 CB ASN A 305 -3.223 4.303 -8.427 1.00 0.39 C ATOM 851 CG ASN A 305 -4.225 4.878 -9.409 1.00 0.78 C ATOM 852 OD1 ASN A 305 -5.267 4.275 -9.670 1.00 1.71 O ATOM 853 ND2 ASN A 305 -3.921 6.043 -9.956 1.00 1.14 N ATOM 0 H ASN A 305 -1.604 1.569 -8.279 1.00 0.27 H new ATOM 0 HA ASN A 305 -2.725 2.716 -9.781 1.00 0.33 H new ATOM 0 HB2 ASN A 305 -3.752 3.736 -7.661 1.00 0.39 H new ATOM 0 HB3 ASN A 305 -2.705 5.117 -7.920 1.00 0.39 H new ATOM 0 HD21 ASN A 305 -4.561 6.476 -10.622 1.00 1.14 H new ATOM 0 HD22 ASN A 305 -3.047 6.509 -9.712 1.00 1.14 H new ATOM 860 N ASP A 306 -0.678 3.594 -10.993 1.00 0.32 N ATOM 861 CA ASP A 306 0.251 4.229 -11.936 1.00 0.35 C ATOM 862 C ASP A 306 1.650 4.430 -11.356 1.00 0.31 C ATOM 863 O ASP A 306 2.621 3.903 -11.896 1.00 0.35 O ATOM 864 CB ASP A 306 -0.295 5.566 -12.447 1.00 0.42 C ATOM 865 CG ASP A 306 -1.277 5.394 -13.585 1.00 0.66 C ATOM 866 OD1 ASP A 306 -0.834 5.167 -14.729 1.00 1.06 O ATOM 867 OD2 ASP A 306 -2.501 5.490 -13.347 1.00 1.11 O ATOM 0 H ASP A 306 -0.868 2.615 -11.208 1.00 0.32 H new ATOM 0 HA ASP A 306 0.340 3.535 -12.772 1.00 0.35 H new ATOM 0 HB2 ASP A 306 -0.783 6.093 -11.627 1.00 0.42 H new ATOM 0 HB3 ASP A 306 0.534 6.191 -12.778 1.00 0.42 H new ATOM 872 N VAL A 307 1.759 5.182 -10.267 1.00 0.30 N ATOM 873 CA VAL A 307 3.062 5.456 -9.660 1.00 0.29 C ATOM 874 C VAL A 307 3.733 4.192 -9.122 1.00 0.25 C ATOM 875 O VAL A 307 3.157 3.451 -8.320 1.00 0.28 O ATOM 876 CB VAL A 307 2.975 6.514 -8.537 1.00 0.34 C ATOM 877 CG1 VAL A 307 2.805 7.902 -9.133 1.00 0.71 C ATOM 878 CG2 VAL A 307 1.839 6.210 -7.574 1.00 0.53 C ATOM 0 H VAL A 307 0.968 5.612 -9.787 1.00 0.30 H new ATOM 0 HA VAL A 307 3.678 5.856 -10.465 1.00 0.29 H new ATOM 0 HB VAL A 307 3.907 6.481 -7.974 1.00 0.34 H new ATOM 0 HG11 VAL A 307 2.745 8.638 -8.331 1.00 0.71 H new ATOM 0 HG12 VAL A 307 3.658 8.131 -9.772 1.00 0.71 H new ATOM 0 HG13 VAL A 307 1.890 7.935 -9.724 1.00 0.71 H new ATOM 0 HG21 VAL A 307 1.807 6.974 -6.797 1.00 0.53 H new ATOM 0 HG22 VAL A 307 0.894 6.204 -8.117 1.00 0.53 H new ATOM 0 HG23 VAL A 307 2.001 5.234 -7.117 1.00 0.53 H new ATOM 888 N ASN A 308 4.954 3.954 -9.583 1.00 0.25 N ATOM 889 CA ASN A 308 5.736 2.794 -9.174 1.00 0.25 C ATOM 890 C ASN A 308 6.771 3.214 -8.138 1.00 0.24 C ATOM 891 O ASN A 308 7.507 4.176 -8.350 1.00 0.33 O ATOM 892 CB ASN A 308 6.430 2.188 -10.395 1.00 0.33 C ATOM 893 CG ASN A 308 6.968 0.792 -10.147 1.00 0.46 C ATOM 894 OD1 ASN A 308 6.361 -0.011 -9.440 1.00 0.58 O ATOM 895 ND2 ASN A 308 8.113 0.493 -10.742 1.00 0.74 N ATOM 0 H ASN A 308 5.430 4.560 -10.251 1.00 0.25 H new ATOM 0 HA ASN A 308 5.076 2.047 -8.733 1.00 0.25 H new ATOM 0 HB2 ASN A 308 5.726 2.156 -11.226 1.00 0.33 H new ATOM 0 HB3 ASN A 308 7.251 2.838 -10.698 1.00 0.33 H new ATOM 0 HD21 ASN A 308 8.524 -0.433 -10.622 1.00 0.74 H new ATOM 0 HD22 ASN A 308 8.584 1.189 -11.320 1.00 0.74 H new ATOM 902 N PHE A 309 6.835 2.495 -7.023 1.00 0.22 N ATOM 903 CA PHE A 309 7.771 2.831 -5.953 1.00 0.24 C ATOM 904 C PHE A 309 8.932 1.848 -5.883 1.00 0.26 C ATOM 905 O PHE A 309 9.661 1.807 -4.891 1.00 0.30 O ATOM 906 CB PHE A 309 7.046 2.854 -4.604 1.00 0.28 C ATOM 907 CG PHE A 309 5.843 3.754 -4.577 1.00 0.26 C ATOM 908 CD1 PHE A 309 5.975 5.115 -4.794 1.00 0.29 C ATOM 909 CD2 PHE A 309 4.581 3.240 -4.333 1.00 0.31 C ATOM 910 CE1 PHE A 309 4.872 5.947 -4.771 1.00 0.33 C ATOM 911 CE2 PHE A 309 3.474 4.066 -4.309 1.00 0.33 C ATOM 912 CZ PHE A 309 3.619 5.421 -4.527 1.00 0.33 C ATOM 0 H PHE A 309 6.253 1.679 -6.835 1.00 0.22 H new ATOM 0 HA PHE A 309 8.175 3.819 -6.176 1.00 0.24 H new ATOM 0 HB2 PHE A 309 6.735 1.840 -4.352 1.00 0.28 H new ATOM 0 HB3 PHE A 309 7.745 3.174 -3.832 1.00 0.28 H new ATOM 0 HD1 PHE A 309 6.953 5.532 -4.984 1.00 0.29 H new ATOM 0 HD2 PHE A 309 4.460 2.181 -4.159 1.00 0.31 H new ATOM 0 HE1 PHE A 309 4.990 7.007 -4.944 1.00 0.33 H new ATOM 0 HE2 PHE A 309 2.495 3.651 -4.120 1.00 0.33 H new ATOM 0 HZ PHE A 309 2.755 6.068 -4.507 1.00 0.33 H new ATOM 922 N GLU A 310 9.117 1.072 -6.943 1.00 0.29 N ATOM 923 CA GLU A 310 10.186 0.078 -6.987 1.00 0.33 C ATOM 924 C GLU A 310 11.571 0.718 -6.898 1.00 0.35 C ATOM 925 O GLU A 310 12.494 0.131 -6.336 1.00 0.47 O ATOM 926 CB GLU A 310 10.088 -0.759 -8.262 1.00 0.40 C ATOM 927 CG GLU A 310 8.968 -1.783 -8.232 1.00 0.54 C ATOM 928 CD GLU A 310 8.913 -2.610 -9.497 1.00 0.67 C ATOM 929 OE1 GLU A 310 9.053 -2.032 -10.594 1.00 1.21 O ATOM 930 OE2 GLU A 310 8.726 -3.838 -9.408 1.00 1.04 O ATOM 0 H GLU A 310 8.542 1.110 -7.785 1.00 0.29 H new ATOM 0 HA GLU A 310 10.058 -0.566 -6.117 1.00 0.33 H new ATOM 0 HB2 GLU A 310 9.938 -0.094 -9.113 1.00 0.40 H new ATOM 0 HB3 GLU A 310 11.035 -1.274 -8.423 1.00 0.40 H new ATOM 0 HG2 GLU A 310 9.104 -2.443 -7.375 1.00 0.54 H new ATOM 0 HG3 GLU A 310 8.015 -1.272 -8.093 1.00 0.54 H new ATOM 937 N ASN A 311 11.720 1.919 -7.445 1.00 0.35 N ATOM 938 CA ASN A 311 13.010 2.603 -7.423 1.00 0.41 C ATOM 939 C ASN A 311 12.929 3.906 -6.641 1.00 0.37 C ATOM 940 O ASN A 311 13.576 4.894 -6.989 1.00 0.48 O ATOM 941 CB ASN A 311 13.503 2.882 -8.848 1.00 0.54 C ATOM 942 CG ASN A 311 13.656 1.617 -9.669 1.00 0.89 C ATOM 943 OD1 ASN A 311 14.676 0.930 -9.592 1.00 1.27 O ATOM 944 ND2 ASN A 311 12.643 1.297 -10.460 1.00 1.32 N ATOM 0 H ASN A 311 10.971 2.437 -7.906 1.00 0.35 H new ATOM 0 HA ASN A 311 13.721 1.944 -6.925 1.00 0.41 H new ATOM 0 HB2 ASN A 311 12.802 3.552 -9.346 1.00 0.54 H new ATOM 0 HB3 ASN A 311 14.461 3.399 -8.802 1.00 0.54 H new ATOM 0 HD21 ASN A 311 12.690 0.455 -11.034 1.00 1.32 H new ATOM 0 HD22 ASN A 311 11.816 1.892 -10.495 1.00 1.32 H new ATOM 951 N MET A 312 12.137 3.910 -5.581 1.00 0.30 N ATOM 952 CA MET A 312 11.985 5.098 -4.753 1.00 0.28 C ATOM 953 C MET A 312 12.347 4.778 -3.313 1.00 0.26 C ATOM 954 O MET A 312 12.494 3.610 -2.950 1.00 0.34 O ATOM 955 CB MET A 312 10.553 5.638 -4.838 1.00 0.28 C ATOM 956 CG MET A 312 10.231 6.289 -6.177 1.00 0.39 C ATOM 957 SD MET A 312 8.484 6.694 -6.363 1.00 0.37 S ATOM 958 CE MET A 312 8.303 7.989 -5.139 1.00 0.51 C ATOM 0 H MET A 312 11.590 3.106 -5.273 1.00 0.30 H new ATOM 0 HA MET A 312 12.661 5.869 -5.123 1.00 0.28 H new ATOM 0 HB2 MET A 312 9.853 4.821 -4.662 1.00 0.28 H new ATOM 0 HB3 MET A 312 10.399 6.366 -4.042 1.00 0.28 H new ATOM 0 HG2 MET A 312 10.822 7.198 -6.284 1.00 0.39 H new ATOM 0 HG3 MET A 312 10.530 5.618 -6.982 1.00 0.39 H new ATOM 0 HE1 MET A 312 7.322 8.452 -5.242 1.00 0.51 H new ATOM 0 HE2 MET A 312 8.400 7.562 -4.141 1.00 0.51 H new ATOM 0 HE3 MET A 312 9.077 8.742 -5.288 1.00 0.51 H new ATOM 968 N SER A 313 12.499 5.811 -2.500 1.00 0.26 N ATOM 969 CA SER A 313 12.852 5.625 -1.103 1.00 0.28 C ATOM 970 C SER A 313 11.638 5.151 -0.314 1.00 0.24 C ATOM 971 O SER A 313 10.496 5.414 -0.700 1.00 0.26 O ATOM 972 CB SER A 313 13.390 6.930 -0.505 1.00 0.36 C ATOM 973 OG SER A 313 12.339 7.845 -0.227 1.00 0.97 O ATOM 0 H SER A 313 12.384 6.784 -2.783 1.00 0.26 H new ATOM 0 HA SER A 313 13.633 4.867 -1.042 1.00 0.28 H new ATOM 0 HB2 SER A 313 13.938 6.713 0.412 1.00 0.36 H new ATOM 0 HB3 SER A 313 14.097 7.385 -1.198 1.00 0.36 H new ATOM 0 HG SER A 313 12.531 8.704 -0.657 1.00 0.97 H new ATOM 979 N ASN A 314 11.888 4.458 0.792 1.00 0.26 N ATOM 980 CA ASN A 314 10.815 3.948 1.640 1.00 0.27 C ATOM 981 C ASN A 314 9.924 5.079 2.137 1.00 0.25 C ATOM 982 O ASN A 314 8.721 4.903 2.317 1.00 0.33 O ATOM 983 CB ASN A 314 11.384 3.183 2.842 1.00 0.35 C ATOM 984 CG ASN A 314 11.992 1.847 2.458 1.00 0.37 C ATOM 985 OD1 ASN A 314 11.593 1.228 1.474 1.00 0.45 O ATOM 986 ND2 ASN A 314 12.961 1.393 3.236 1.00 0.48 N ATOM 0 H ASN A 314 12.827 4.236 1.123 1.00 0.26 H new ATOM 0 HA ASN A 314 10.217 3.267 1.033 1.00 0.27 H new ATOM 0 HB2 ASN A 314 12.143 3.795 3.330 1.00 0.35 H new ATOM 0 HB3 ASN A 314 10.590 3.019 3.571 1.00 0.35 H new ATOM 0 HD21 ASN A 314 13.405 0.499 3.028 1.00 0.48 H new ATOM 0 HD22 ASN A 314 13.264 1.937 4.044 1.00 0.48 H new ATOM 993 N ASP A 315 10.520 6.245 2.347 1.00 0.26 N ATOM 994 CA ASP A 315 9.781 7.404 2.832 1.00 0.28 C ATOM 995 C ASP A 315 8.922 8.004 1.731 1.00 0.23 C ATOM 996 O ASP A 315 7.727 8.230 1.921 1.00 0.24 O ATOM 997 CB ASP A 315 10.738 8.464 3.379 1.00 0.37 C ATOM 998 CG ASP A 315 10.984 8.309 4.865 1.00 0.83 C ATOM 999 OD1 ASP A 315 10.185 8.839 5.665 1.00 1.36 O ATOM 1000 OD2 ASP A 315 11.976 7.655 5.239 1.00 1.40 O ATOM 0 H ASP A 315 11.513 6.414 2.189 1.00 0.26 H new ATOM 0 HA ASP A 315 9.128 7.067 3.637 1.00 0.28 H new ATOM 0 HB2 ASP A 315 11.688 8.401 2.848 1.00 0.37 H new ATOM 0 HB3 ASP A 315 10.329 9.455 3.183 1.00 0.37 H new ATOM 1005 N ASP A 316 9.531 8.240 0.572 1.00 0.23 N ATOM 1006 CA ASP A 316 8.819 8.826 -0.564 1.00 0.24 C ATOM 1007 C ASP A 316 7.679 7.927 -1.014 1.00 0.19 C ATOM 1008 O ASP A 316 6.630 8.408 -1.436 1.00 0.20 O ATOM 1009 CB ASP A 316 9.765 9.079 -1.738 1.00 0.32 C ATOM 1010 CG ASP A 316 10.650 10.292 -1.534 1.00 0.50 C ATOM 1011 OD1 ASP A 316 10.113 11.409 -1.375 1.00 0.69 O ATOM 1012 OD2 ASP A 316 11.891 10.128 -1.542 1.00 0.88 O ATOM 0 H ASP A 316 10.514 8.035 0.393 1.00 0.23 H new ATOM 0 HA ASP A 316 8.409 9.780 -0.232 1.00 0.24 H new ATOM 0 HB2 ASP A 316 10.392 8.200 -1.888 1.00 0.32 H new ATOM 0 HB3 ASP A 316 9.179 9.212 -2.647 1.00 0.32 H new ATOM 1017 N ALA A 317 7.895 6.622 -0.919 1.00 0.17 N ATOM 1018 CA ALA A 317 6.889 5.643 -1.306 1.00 0.16 C ATOM 1019 C ALA A 317 5.595 5.840 -0.522 1.00 0.14 C ATOM 1020 O ALA A 317 4.513 5.930 -1.103 1.00 0.17 O ATOM 1021 CB ALA A 317 7.427 4.236 -1.102 1.00 0.20 C ATOM 0 H ALA A 317 8.765 6.215 -0.575 1.00 0.17 H new ATOM 0 HA ALA A 317 6.662 5.786 -2.362 1.00 0.16 H new ATOM 0 HB1 ALA A 317 6.668 3.510 -1.394 1.00 0.20 H new ATOM 0 HB2 ALA A 317 8.318 4.095 -1.714 1.00 0.20 H new ATOM 0 HB3 ALA A 317 7.681 4.092 -0.052 1.00 0.20 H new ATOM 1027 N VAL A 318 5.709 5.931 0.799 1.00 0.12 N ATOM 1028 CA VAL A 318 4.539 6.115 1.646 1.00 0.12 C ATOM 1029 C VAL A 318 4.003 7.538 1.528 1.00 0.11 C ATOM 1030 O VAL A 318 2.797 7.759 1.628 1.00 0.14 O ATOM 1031 CB VAL A 318 4.832 5.795 3.128 1.00 0.15 C ATOM 1032 CG1 VAL A 318 3.535 5.617 3.906 1.00 0.18 C ATOM 1033 CG2 VAL A 318 5.704 4.556 3.248 1.00 0.21 C ATOM 0 H VAL A 318 6.595 5.881 1.303 1.00 0.12 H new ATOM 0 HA VAL A 318 3.785 5.411 1.293 1.00 0.12 H new ATOM 0 HB VAL A 318 5.375 6.637 3.558 1.00 0.15 H new ATOM 0 HG11 VAL A 318 3.764 5.392 4.948 1.00 0.18 H new ATOM 0 HG12 VAL A 318 2.950 6.535 3.853 1.00 0.18 H new ATOM 0 HG13 VAL A 318 2.962 4.796 3.475 1.00 0.18 H new ATOM 0 HG21 VAL A 318 5.898 4.348 4.300 1.00 0.21 H new ATOM 0 HG22 VAL A 318 5.191 3.705 2.799 1.00 0.21 H new ATOM 0 HG23 VAL A 318 6.649 4.724 2.731 1.00 0.21 H new ATOM 1043 N ARG A 319 4.899 8.497 1.299 1.00 0.12 N ATOM 1044 CA ARG A 319 4.501 9.895 1.155 1.00 0.16 C ATOM 1045 C ARG A 319 3.453 10.037 0.058 1.00 0.14 C ATOM 1046 O ARG A 319 2.395 10.630 0.271 1.00 0.22 O ATOM 1047 CB ARG A 319 5.713 10.780 0.840 1.00 0.21 C ATOM 1048 CG ARG A 319 6.564 11.107 2.057 1.00 0.35 C ATOM 1049 CD ARG A 319 7.824 11.872 1.680 1.00 0.40 C ATOM 1050 NE ARG A 319 8.781 11.909 2.782 1.00 0.50 N ATOM 1051 CZ ARG A 319 10.097 12.027 2.625 1.00 0.61 C ATOM 1052 NH1 ARG A 319 10.622 12.115 1.407 1.00 0.83 N ATOM 1053 NH2 ARG A 319 10.890 12.050 3.690 1.00 0.81 N ATOM 0 H ARG A 319 5.902 8.332 1.210 1.00 0.12 H new ATOM 0 HA ARG A 319 4.072 10.223 2.102 1.00 0.16 H new ATOM 0 HB2 ARG A 319 6.334 10.279 0.097 1.00 0.21 H new ATOM 0 HB3 ARG A 319 5.365 11.710 0.390 1.00 0.21 H new ATOM 0 HG2 ARG A 319 5.978 11.697 2.761 1.00 0.35 H new ATOM 0 HG3 ARG A 319 6.839 10.183 2.566 1.00 0.35 H new ATOM 0 HD2 ARG A 319 8.287 11.405 0.811 1.00 0.40 H new ATOM 0 HD3 ARG A 319 7.560 12.890 1.392 1.00 0.40 H new ATOM 0 HE ARG A 319 8.418 11.840 3.733 1.00 0.50 H new ATOM 0 HH11 ARG A 319 10.015 12.092 0.587 1.00 0.83 H new ATOM 0 HH12 ARG A 319 11.631 12.205 1.292 1.00 0.83 H new ATOM 0 HH21 ARG A 319 10.490 11.977 4.625 1.00 0.81 H new ATOM 0 HH22 ARG A 319 11.899 12.140 3.573 1.00 0.81 H new ATOM 1067 N VAL A 320 3.742 9.471 -1.106 1.00 0.10 N ATOM 1068 CA VAL A 320 2.814 9.525 -2.227 1.00 0.10 C ATOM 1069 C VAL A 320 1.592 8.655 -1.939 1.00 0.09 C ATOM 1070 O VAL A 320 0.460 9.052 -2.217 1.00 0.11 O ATOM 1071 CB VAL A 320 3.484 9.063 -3.542 1.00 0.14 C ATOM 1072 CG1 VAL A 320 2.547 9.254 -4.729 1.00 0.17 C ATOM 1073 CG2 VAL A 320 4.789 9.813 -3.771 1.00 0.17 C ATOM 0 H VAL A 320 4.610 8.970 -1.298 1.00 0.10 H new ATOM 0 HA VAL A 320 2.504 10.563 -2.351 1.00 0.10 H new ATOM 0 HB VAL A 320 3.705 8.000 -3.451 1.00 0.14 H new ATOM 0 HG11 VAL A 320 3.043 8.921 -5.641 1.00 0.17 H new ATOM 0 HG12 VAL A 320 1.640 8.669 -4.575 1.00 0.17 H new ATOM 0 HG13 VAL A 320 2.287 10.309 -4.821 1.00 0.17 H new ATOM 0 HG21 VAL A 320 5.245 9.474 -4.701 1.00 0.17 H new ATOM 0 HG22 VAL A 320 4.588 10.882 -3.834 1.00 0.17 H new ATOM 0 HG23 VAL A 320 5.470 9.620 -2.942 1.00 0.17 H new ATOM 1083 N LEU A 321 1.835 7.484 -1.355 1.00 0.08 N ATOM 1084 CA LEU A 321 0.769 6.544 -1.009 1.00 0.09 C ATOM 1085 C LEU A 321 -0.318 7.222 -0.186 1.00 0.09 C ATOM 1086 O LEU A 321 -1.505 7.102 -0.486 1.00 0.10 O ATOM 1087 CB LEU A 321 1.341 5.368 -0.211 1.00 0.11 C ATOM 1088 CG LEU A 321 0.350 4.258 0.147 1.00 0.20 C ATOM 1089 CD1 LEU A 321 -0.461 3.840 -1.067 1.00 0.38 C ATOM 1090 CD2 LEU A 321 1.089 3.064 0.724 1.00 0.29 C ATOM 0 H LEU A 321 2.770 7.160 -1.109 1.00 0.08 H new ATOM 0 HA LEU A 321 0.331 6.183 -1.939 1.00 0.09 H new ATOM 0 HB2 LEU A 321 2.158 4.928 -0.784 1.00 0.11 H new ATOM 0 HB3 LEU A 321 1.772 5.756 0.712 1.00 0.11 H new ATOM 0 HG LEU A 321 -0.340 4.645 0.897 1.00 0.20 H new ATOM 0 HD11 LEU A 321 -1.157 3.050 -0.785 1.00 0.38 H new ATOM 0 HD12 LEU A 321 -1.018 4.697 -1.445 1.00 0.38 H new ATOM 0 HD13 LEU A 321 0.210 3.472 -1.844 1.00 0.38 H new ATOM 0 HD21 LEU A 321 0.374 2.280 0.975 1.00 0.29 H new ATOM 0 HD22 LEU A 321 1.799 2.685 -0.011 1.00 0.29 H new ATOM 0 HD23 LEU A 321 1.625 3.368 1.623 1.00 0.29 H new ATOM 1102 N ARG A 322 0.098 7.945 0.842 1.00 0.10 N ATOM 1103 CA ARG A 322 -0.835 8.630 1.720 1.00 0.12 C ATOM 1104 C ARG A 322 -1.645 9.680 0.973 1.00 0.13 C ATOM 1105 O ARG A 322 -2.841 9.821 1.211 1.00 0.21 O ATOM 1106 CB ARG A 322 -0.101 9.261 2.897 1.00 0.15 C ATOM 1107 CG ARG A 322 0.660 8.247 3.734 1.00 0.19 C ATOM 1108 CD ARG A 322 0.906 8.757 5.141 1.00 0.34 C ATOM 1109 NE ARG A 322 -0.272 8.590 5.988 1.00 0.49 N ATOM 1110 CZ ARG A 322 -1.017 9.592 6.449 1.00 1.05 C ATOM 1111 NH1 ARG A 322 -0.739 10.847 6.118 1.00 1.57 N ATOM 1112 NH2 ARG A 322 -2.055 9.334 7.231 1.00 1.28 N ATOM 0 H ARG A 322 1.080 8.072 1.089 1.00 0.10 H new ATOM 0 HA ARG A 322 -1.533 7.884 2.101 1.00 0.12 H new ATOM 0 HB2 ARG A 322 0.595 10.012 2.524 1.00 0.15 H new ATOM 0 HB3 ARG A 322 -0.820 9.780 3.530 1.00 0.15 H new ATOM 0 HG2 ARG A 322 0.097 7.315 3.778 1.00 0.19 H new ATOM 0 HG3 ARG A 322 1.613 8.022 3.256 1.00 0.19 H new ATOM 0 HD2 ARG A 322 1.749 8.223 5.580 1.00 0.34 H new ATOM 0 HD3 ARG A 322 1.181 9.811 5.103 1.00 0.34 H new ATOM 0 HE ARG A 322 -0.542 7.640 6.244 1.00 0.49 H new ATOM 0 HH11 ARG A 322 0.051 11.050 5.506 1.00 1.57 H new ATOM 0 HH12 ARG A 322 -1.315 11.609 6.476 1.00 1.57 H new ATOM 0 HH21 ARG A 322 -2.281 8.370 7.478 1.00 1.28 H new ATOM 0 HH22 ARG A 322 -2.628 10.099 7.586 1.00 1.28 H new ATOM 1126 N GLU A 323 -1.004 10.392 0.057 1.00 0.12 N ATOM 1127 CA GLU A 323 -1.686 11.423 -0.718 1.00 0.15 C ATOM 1128 C GLU A 323 -2.741 10.798 -1.623 1.00 0.14 C ATOM 1129 O GLU A 323 -3.804 11.377 -1.849 1.00 0.21 O ATOM 1130 CB GLU A 323 -0.677 12.229 -1.542 1.00 0.20 C ATOM 1131 CG GLU A 323 0.387 12.907 -0.694 1.00 0.62 C ATOM 1132 CD GLU A 323 -0.202 13.746 0.425 1.00 1.27 C ATOM 1133 OE1 GLU A 323 -0.548 13.181 1.484 1.00 1.87 O ATOM 1134 OE2 GLU A 323 -0.321 14.973 0.250 1.00 1.76 O ATOM 0 H GLU A 323 -0.016 10.277 -0.168 1.00 0.12 H new ATOM 0 HA GLU A 323 -2.185 12.102 -0.027 1.00 0.15 H new ATOM 0 HB2 GLU A 323 -0.192 11.566 -2.259 1.00 0.20 H new ATOM 0 HB3 GLU A 323 -1.210 12.986 -2.117 1.00 0.20 H new ATOM 0 HG2 GLU A 323 1.043 12.149 -0.267 1.00 0.62 H new ATOM 0 HG3 GLU A 323 1.004 13.540 -1.331 1.00 0.62 H new ATOM 1141 N ILE A 324 -2.446 9.604 -2.121 1.00 0.12 N ATOM 1142 CA ILE A 324 -3.372 8.885 -2.986 1.00 0.14 C ATOM 1143 C ILE A 324 -4.572 8.394 -2.179 1.00 0.14 C ATOM 1144 O ILE A 324 -5.716 8.527 -2.608 1.00 0.18 O ATOM 1145 CB ILE A 324 -2.684 7.683 -3.674 1.00 0.18 C ATOM 1146 CG1 ILE A 324 -1.526 8.165 -4.550 1.00 0.21 C ATOM 1147 CG2 ILE A 324 -3.687 6.891 -4.507 1.00 0.23 C ATOM 1148 CD1 ILE A 324 -0.596 7.057 -4.986 1.00 0.29 C ATOM 0 H ILE A 324 -1.571 9.112 -1.940 1.00 0.12 H new ATOM 0 HA ILE A 324 -3.708 9.576 -3.759 1.00 0.14 H new ATOM 0 HB ILE A 324 -2.287 7.025 -2.901 1.00 0.18 H new ATOM 0 HG12 ILE A 324 -1.931 8.657 -5.434 1.00 0.21 H new ATOM 0 HG13 ILE A 324 -0.954 8.914 -4.002 1.00 0.21 H new ATOM 0 HG21 ILE A 324 -3.182 6.050 -4.982 1.00 0.23 H new ATOM 0 HG22 ILE A 324 -4.483 6.519 -3.862 1.00 0.23 H new ATOM 0 HG23 ILE A 324 -4.114 7.538 -5.273 1.00 0.23 H new ATOM 0 HD11 ILE A 324 0.200 7.472 -5.604 1.00 0.29 H new ATOM 0 HD12 ILE A 324 -0.162 6.579 -4.108 1.00 0.29 H new ATOM 0 HD13 ILE A 324 -1.154 6.319 -5.562 1.00 0.29 H new ATOM 1160 N VAL A 325 -4.302 7.849 -0.999 1.00 0.11 N ATOM 1161 CA VAL A 325 -5.361 7.345 -0.127 1.00 0.13 C ATOM 1162 C VAL A 325 -6.172 8.506 0.459 1.00 0.16 C ATOM 1163 O VAL A 325 -7.303 8.330 0.913 1.00 0.24 O ATOM 1164 CB VAL A 325 -4.790 6.453 1.004 1.00 0.15 C ATOM 1165 CG1 VAL A 325 -5.905 5.874 1.864 1.00 0.19 C ATOM 1166 CG2 VAL A 325 -3.947 5.336 0.414 1.00 0.16 C ATOM 0 H VAL A 325 -3.360 7.744 -0.622 1.00 0.11 H new ATOM 0 HA VAL A 325 -6.023 6.726 -0.733 1.00 0.13 H new ATOM 0 HB VAL A 325 -4.162 7.075 1.641 1.00 0.15 H new ATOM 0 HG11 VAL A 325 -5.474 5.253 2.649 1.00 0.19 H new ATOM 0 HG12 VAL A 325 -6.475 6.686 2.316 1.00 0.19 H new ATOM 0 HG13 VAL A 325 -6.566 5.268 1.244 1.00 0.19 H new ATOM 0 HG21 VAL A 325 -3.551 4.716 1.218 1.00 0.16 H new ATOM 0 HG22 VAL A 325 -4.563 4.725 -0.246 1.00 0.16 H new ATOM 0 HG23 VAL A 325 -3.121 5.765 -0.154 1.00 0.16 H new ATOM 1176 N SER A 326 -5.596 9.702 0.426 1.00 0.19 N ATOM 1177 CA SER A 326 -6.277 10.890 0.924 1.00 0.24 C ATOM 1178 C SER A 326 -7.134 11.509 -0.180 1.00 0.27 C ATOM 1179 O SER A 326 -7.727 12.575 -0.002 1.00 0.44 O ATOM 1180 CB SER A 326 -5.263 11.913 1.440 1.00 0.32 C ATOM 1181 OG SER A 326 -4.493 11.377 2.506 1.00 0.37 O ATOM 0 H SER A 326 -4.660 9.874 0.060 1.00 0.19 H new ATOM 0 HA SER A 326 -6.924 10.596 1.750 1.00 0.24 H new ATOM 0 HB2 SER A 326 -4.603 12.217 0.628 1.00 0.32 H new ATOM 0 HB3 SER A 326 -5.785 12.808 1.779 1.00 0.32 H new ATOM 0 HG SER A 326 -3.842 10.737 2.150 1.00 0.37 H new ATOM 1187 N GLN A 327 -7.190 10.833 -1.320 1.00 0.27 N ATOM 1188 CA GLN A 327 -7.967 11.303 -2.453 1.00 0.32 C ATOM 1189 C GLN A 327 -9.174 10.397 -2.669 1.00 0.34 C ATOM 1190 O GLN A 327 -9.183 9.247 -2.223 1.00 0.53 O ATOM 1191 CB GLN A 327 -7.099 11.338 -3.715 1.00 0.41 C ATOM 1192 CG GLN A 327 -7.158 12.663 -4.458 1.00 0.63 C ATOM 1193 CD GLN A 327 -6.605 13.823 -3.648 1.00 0.75 C ATOM 1194 OE1 GLN A 327 -7.110 14.942 -3.727 1.00 1.16 O ATOM 1195 NE2 GLN A 327 -5.556 13.573 -2.881 1.00 0.94 N ATOM 0 H GLN A 327 -6.702 9.952 -1.482 1.00 0.27 H new ATOM 0 HA GLN A 327 -8.317 12.314 -2.244 1.00 0.32 H new ATOM 0 HB2 GLN A 327 -6.065 11.131 -3.440 1.00 0.41 H new ATOM 0 HB3 GLN A 327 -7.416 10.540 -4.386 1.00 0.41 H new ATOM 0 HG2 GLN A 327 -6.597 12.577 -5.389 1.00 0.63 H new ATOM 0 HG3 GLN A 327 -8.192 12.876 -4.728 1.00 0.63 H new ATOM 0 HE21 GLN A 327 -5.166 12.632 -2.842 1.00 0.94 H new ATOM 0 HE22 GLN A 327 -5.138 14.322 -2.329 1.00 0.94 H new ATOM 1204 N THR A 328 -10.187 10.911 -3.345 1.00 0.42 N ATOM 1205 CA THR A 328 -11.391 10.144 -3.607 1.00 0.49 C ATOM 1206 C THR A 328 -11.327 9.473 -4.977 1.00 0.51 C ATOM 1207 O THR A 328 -11.176 10.143 -5.997 1.00 0.84 O ATOM 1208 CB THR A 328 -12.633 11.049 -3.542 1.00 0.66 C ATOM 1209 OG1 THR A 328 -12.286 12.301 -2.928 1.00 0.88 O ATOM 1210 CG2 THR A 328 -13.750 10.381 -2.755 1.00 0.89 C ATOM 0 H THR A 328 -10.199 11.858 -3.723 1.00 0.42 H new ATOM 0 HA THR A 328 -11.464 9.373 -2.840 1.00 0.49 H new ATOM 0 HB THR A 328 -12.987 11.225 -4.558 1.00 0.66 H new ATOM 0 HG1 THR A 328 -13.078 12.877 -2.889 1.00 0.88 H new ATOM 0 HG21 THR A 328 -14.617 11.040 -2.723 1.00 0.89 H new ATOM 0 HG22 THR A 328 -14.025 9.443 -3.238 1.00 0.89 H new ATOM 0 HG23 THR A 328 -13.410 10.180 -1.739 1.00 0.89 H new ATOM 1218 N GLY A 329 -11.414 8.151 -4.994 1.00 0.45 N ATOM 1219 CA GLY A 329 -11.375 7.424 -6.247 1.00 0.44 C ATOM 1220 C GLY A 329 -10.900 5.998 -6.061 1.00 0.39 C ATOM 1221 O GLY A 329 -10.425 5.645 -4.982 1.00 0.43 O ATOM 0 H GLY A 329 -11.511 7.568 -4.163 1.00 0.45 H new ATOM 0 HA2 GLY A 329 -12.369 7.420 -6.695 1.00 0.44 H new ATOM 0 HA3 GLY A 329 -10.714 7.938 -6.944 1.00 0.44 H new ATOM 1225 N PRO A 330 -11.027 5.149 -7.094 1.00 0.40 N ATOM 1226 CA PRO A 330 -10.597 3.750 -7.032 1.00 0.39 C ATOM 1227 C PRO A 330 -9.076 3.626 -7.039 1.00 0.36 C ATOM 1228 O PRO A 330 -8.402 4.143 -7.931 1.00 0.56 O ATOM 1229 CB PRO A 330 -11.188 3.123 -8.306 1.00 0.47 C ATOM 1230 CG PRO A 330 -12.107 4.148 -8.883 1.00 0.58 C ATOM 1231 CD PRO A 330 -11.605 5.476 -8.404 1.00 0.52 C ATOM 0 HA PRO A 330 -10.931 3.262 -6.116 1.00 0.39 H new ATOM 0 HB2 PRO A 330 -10.401 2.863 -9.014 1.00 0.47 H new ATOM 0 HB3 PRO A 330 -11.726 2.203 -8.075 1.00 0.47 H new ATOM 0 HG2 PRO A 330 -12.107 4.102 -9.972 1.00 0.58 H new ATOM 0 HG3 PRO A 330 -13.133 3.979 -8.556 1.00 0.58 H new ATOM 0 HD2 PRO A 330 -10.861 5.896 -9.081 1.00 0.52 H new ATOM 0 HD3 PRO A 330 -12.409 6.207 -8.321 1.00 0.52 H new ATOM 1239 N ILE A 331 -8.540 2.940 -6.044 1.00 0.27 N ATOM 1240 CA ILE A 331 -7.102 2.760 -5.934 1.00 0.25 C ATOM 1241 C ILE A 331 -6.685 1.382 -6.440 1.00 0.25 C ATOM 1242 O ILE A 331 -7.113 0.357 -5.903 1.00 0.30 O ATOM 1243 CB ILE A 331 -6.620 2.941 -4.476 1.00 0.29 C ATOM 1244 CG1 ILE A 331 -7.094 4.288 -3.925 1.00 0.31 C ATOM 1245 CG2 ILE A 331 -5.102 2.838 -4.396 1.00 0.37 C ATOM 1246 CD1 ILE A 331 -6.808 4.478 -2.451 1.00 0.35 C ATOM 0 H ILE A 331 -9.080 2.498 -5.300 1.00 0.27 H new ATOM 0 HA ILE A 331 -6.634 3.525 -6.553 1.00 0.25 H new ATOM 0 HB ILE A 331 -7.049 2.144 -3.868 1.00 0.29 H new ATOM 0 HG12 ILE A 331 -6.613 5.089 -4.486 1.00 0.31 H new ATOM 0 HG13 ILE A 331 -8.167 4.382 -4.093 1.00 0.31 H new ATOM 0 HG21 ILE A 331 -4.782 2.968 -3.362 1.00 0.37 H new ATOM 0 HG22 ILE A 331 -4.784 1.858 -4.753 1.00 0.37 H new ATOM 0 HG23 ILE A 331 -4.652 3.614 -5.015 1.00 0.37 H new ATOM 0 HD11 ILE A 331 -7.172 5.455 -2.133 1.00 0.35 H new ATOM 0 HD12 ILE A 331 -7.312 3.699 -1.879 1.00 0.35 H new ATOM 0 HD13 ILE A 331 -5.734 4.417 -2.278 1.00 0.35 H new ATOM 1258 N SER A 332 -5.872 1.367 -7.491 1.00 0.28 N ATOM 1259 CA SER A 332 -5.383 0.120 -8.069 1.00 0.31 C ATOM 1260 C SER A 332 -4.059 -0.278 -7.416 1.00 0.27 C ATOM 1261 O SER A 332 -3.005 0.272 -7.735 1.00 0.31 O ATOM 1262 CB SER A 332 -5.199 0.275 -9.579 1.00 0.41 C ATOM 1263 OG SER A 332 -6.227 1.081 -10.131 1.00 1.09 O ATOM 0 H SER A 332 -5.537 2.208 -7.962 1.00 0.28 H new ATOM 0 HA SER A 332 -6.117 -0.664 -7.884 1.00 0.31 H new ATOM 0 HB2 SER A 332 -4.228 0.723 -9.787 1.00 0.41 H new ATOM 0 HB3 SER A 332 -5.206 -0.706 -10.053 1.00 0.41 H new ATOM 0 HG SER A 332 -6.004 2.027 -10.006 1.00 1.09 H new ATOM 1269 N LEU A 333 -4.117 -1.235 -6.505 1.00 0.27 N ATOM 1270 CA LEU A 333 -2.930 -1.686 -5.794 1.00 0.26 C ATOM 1271 C LEU A 333 -2.274 -2.878 -6.482 1.00 0.26 C ATOM 1272 O LEU A 333 -2.912 -3.904 -6.711 1.00 0.30 O ATOM 1273 CB LEU A 333 -3.291 -2.062 -4.357 1.00 0.29 C ATOM 1274 CG LEU A 333 -3.555 -0.886 -3.417 1.00 0.27 C ATOM 1275 CD1 LEU A 333 -4.394 -1.333 -2.229 1.00 0.48 C ATOM 1276 CD2 LEU A 333 -2.242 -0.287 -2.941 1.00 0.39 C ATOM 0 H LEU A 333 -4.976 -1.717 -6.239 1.00 0.27 H new ATOM 0 HA LEU A 333 -2.217 -0.862 -5.794 1.00 0.26 H new ATOM 0 HB2 LEU A 333 -4.178 -2.695 -4.377 1.00 0.29 H new ATOM 0 HB3 LEU A 333 -2.481 -2.662 -3.942 1.00 0.29 H new ATOM 0 HG LEU A 333 -4.109 -0.123 -3.964 1.00 0.27 H new ATOM 0 HD11 LEU A 333 -4.573 -0.484 -1.570 1.00 0.48 H new ATOM 0 HD12 LEU A 333 -5.348 -1.724 -2.584 1.00 0.48 H new ATOM 0 HD13 LEU A 333 -3.863 -2.112 -1.681 1.00 0.48 H new ATOM 0 HD21 LEU A 333 -2.445 0.550 -2.272 1.00 0.39 H new ATOM 0 HD22 LEU A 333 -1.668 -1.046 -2.409 1.00 0.39 H new ATOM 0 HD23 LEU A 333 -1.670 0.065 -3.800 1.00 0.39 H new ATOM 1288 N THR A 334 -1.004 -2.724 -6.820 1.00 0.24 N ATOM 1289 CA THR A 334 -0.239 -3.786 -7.446 1.00 0.26 C ATOM 1290 C THR A 334 0.748 -4.340 -6.424 1.00 0.26 C ATOM 1291 O THR A 334 1.802 -3.747 -6.175 1.00 0.28 O ATOM 1292 CB THR A 334 0.516 -3.280 -8.689 1.00 0.31 C ATOM 1293 OG1 THR A 334 -0.271 -2.283 -9.360 1.00 0.50 O ATOM 1294 CG2 THR A 334 0.810 -4.423 -9.645 1.00 0.42 C ATOM 0 H THR A 334 -0.478 -1.863 -6.668 1.00 0.24 H new ATOM 0 HA THR A 334 -0.923 -4.568 -7.776 1.00 0.26 H new ATOM 0 HB THR A 334 1.462 -2.846 -8.365 1.00 0.31 H new ATOM 0 HG1 THR A 334 -0.210 -1.435 -8.872 1.00 0.50 H new ATOM 0 HG21 THR A 334 1.344 -4.041 -10.515 1.00 0.42 H new ATOM 0 HG22 THR A 334 1.424 -5.170 -9.141 1.00 0.42 H new ATOM 0 HG23 THR A 334 -0.127 -4.880 -9.965 1.00 0.42 H new ATOM 1302 N VAL A 335 0.388 -5.459 -5.814 1.00 0.26 N ATOM 1303 CA VAL A 335 1.219 -6.065 -4.783 1.00 0.28 C ATOM 1304 C VAL A 335 1.960 -7.298 -5.291 1.00 0.28 C ATOM 1305 O VAL A 335 1.544 -7.944 -6.256 1.00 0.32 O ATOM 1306 CB VAL A 335 0.383 -6.459 -3.544 1.00 0.30 C ATOM 1307 CG1 VAL A 335 -0.207 -5.223 -2.879 1.00 0.33 C ATOM 1308 CG2 VAL A 335 -0.716 -7.447 -3.921 1.00 0.31 C ATOM 0 H VAL A 335 -0.474 -5.966 -6.014 1.00 0.26 H new ATOM 0 HA VAL A 335 1.951 -5.308 -4.503 1.00 0.28 H new ATOM 0 HB VAL A 335 1.045 -6.948 -2.830 1.00 0.30 H new ATOM 0 HG11 VAL A 335 -0.792 -5.522 -2.009 1.00 0.33 H new ATOM 0 HG12 VAL A 335 0.599 -4.560 -2.564 1.00 0.33 H new ATOM 0 HG13 VAL A 335 -0.851 -4.701 -3.587 1.00 0.33 H new ATOM 0 HG21 VAL A 335 -1.290 -7.709 -3.032 1.00 0.31 H new ATOM 0 HG22 VAL A 335 -1.377 -6.992 -4.659 1.00 0.31 H new ATOM 0 HG23 VAL A 335 -0.268 -8.347 -4.341 1.00 0.31 H new ATOM 1318 N ALA A 336 3.070 -7.601 -4.633 1.00 0.28 N ATOM 1319 CA ALA A 336 3.887 -8.755 -4.968 1.00 0.31 C ATOM 1320 C ALA A 336 3.828 -9.774 -3.840 1.00 0.33 C ATOM 1321 O ALA A 336 4.339 -9.537 -2.738 1.00 0.38 O ATOM 1322 CB ALA A 336 5.325 -8.334 -5.233 1.00 0.34 C ATOM 0 H ALA A 336 3.428 -7.052 -3.851 1.00 0.28 H new ATOM 0 HA ALA A 336 3.495 -9.212 -5.877 1.00 0.31 H new ATOM 0 HB1 ALA A 336 5.921 -9.212 -5.482 1.00 0.34 H new ATOM 0 HB2 ALA A 336 5.351 -7.630 -6.065 1.00 0.34 H new ATOM 0 HB3 ALA A 336 5.735 -7.858 -4.342 1.00 0.34 H new ATOM 1328 N LYS A 337 3.191 -10.895 -4.115 1.00 0.36 N ATOM 1329 CA LYS A 337 3.039 -11.956 -3.137 1.00 0.40 C ATOM 1330 C LYS A 337 4.052 -13.060 -3.400 1.00 0.47 C ATOM 1331 O LYS A 337 4.402 -13.275 -4.582 1.00 0.60 O ATOM 1332 CB LYS A 337 1.618 -12.518 -3.191 1.00 0.41 C ATOM 1333 CG LYS A 337 0.544 -11.441 -3.169 1.00 0.37 C ATOM 1334 CD LYS A 337 -0.858 -12.028 -3.237 1.00 0.41 C ATOM 1335 CE LYS A 337 -1.166 -12.905 -2.032 1.00 0.39 C ATOM 1336 NZ LYS A 337 -1.210 -12.129 -0.765 1.00 0.38 N ATOM 1337 OXT LYS A 337 4.504 -13.700 -2.427 1.00 0.70 O ATOM 0 H LYS A 337 2.765 -11.097 -5.020 1.00 0.36 H new ATOM 0 HA LYS A 337 3.218 -11.548 -2.142 1.00 0.40 H new ATOM 0 HB2 LYS A 337 1.505 -13.116 -4.096 1.00 0.41 H new ATOM 0 HB3 LYS A 337 1.468 -13.189 -2.345 1.00 0.41 H new ATOM 0 HG2 LYS A 337 0.644 -10.848 -2.260 1.00 0.37 H new ATOM 0 HG3 LYS A 337 0.694 -10.763 -4.009 1.00 0.37 H new ATOM 0 HD2 LYS A 337 -1.587 -11.220 -3.294 1.00 0.41 H new ATOM 0 HD3 LYS A 337 -0.962 -12.615 -4.149 1.00 0.41 H new ATOM 0 HE2 LYS A 337 -2.124 -13.403 -2.184 1.00 0.39 H new ATOM 0 HE3 LYS A 337 -0.410 -13.686 -1.951 1.00 0.39 H new ATOM 0 HZ1 LYS A 337 -1.304 -12.782 0.039 1.00 0.38 H new ATOM 0 HZ2 LYS A 337 -0.333 -11.580 -0.664 1.00 0.38 H new ATOM 0 HZ3 LYS A 337 -2.024 -11.482 -0.783 1.00 0.38 H new ATOM 1369 N TRP B 2 0.909 5.044 7.806 1.00 0.14 N ATOM 1370 CA TRP B 2 -0.406 4.472 8.073 1.00 0.13 C ATOM 1371 C TRP B 2 -1.457 5.099 7.171 1.00 0.14 C ATOM 1372 O TRP B 2 -1.493 6.323 7.015 1.00 0.23 O ATOM 1373 CB TRP B 2 -0.806 4.709 9.529 1.00 0.19 C ATOM 1374 CG TRP B 2 -0.264 3.698 10.493 1.00 0.21 C ATOM 1375 CD1 TRP B 2 0.950 3.722 11.120 1.00 0.30 C ATOM 1376 CD2 TRP B 2 -0.931 2.517 10.954 1.00 0.24 C ATOM 1377 NE1 TRP B 2 1.077 2.627 11.941 1.00 0.32 N ATOM 1378 CE2 TRP B 2 -0.064 1.873 11.856 1.00 0.28 C ATOM 1379 CE3 TRP B 2 -2.177 1.942 10.690 1.00 0.32 C ATOM 1380 CZ2 TRP B 2 -0.405 0.683 12.496 1.00 0.33 C ATOM 1381 CZ3 TRP B 2 -2.513 0.763 11.325 1.00 0.40 C ATOM 1382 CH2 TRP B 2 -1.631 0.145 12.220 1.00 0.39 C ATOM 0 HA TRP B 2 -0.349 3.401 7.876 1.00 0.13 H new ATOM 0 HB2 TRP B 2 -0.465 5.699 9.830 1.00 0.19 H new ATOM 0 HB3 TRP B 2 -1.894 4.712 9.598 1.00 0.19 H new ATOM 0 HD1 TRP B 2 1.699 4.489 10.990 1.00 0.30 H new ATOM 0 HE1 TRP B 2 1.889 2.411 12.520 1.00 0.32 H new ATOM 0 HE3 TRP B 2 -2.865 2.411 10.002 1.00 0.32 H new ATOM 0 HZ2 TRP B 2 0.275 0.203 13.185 1.00 0.33 H new ATOM 0 HZ3 TRP B 2 -3.473 0.309 11.128 1.00 0.40 H new ATOM 0 HH2 TRP B 2 -1.925 -0.776 12.702 1.00 0.39 H new ATOM 1393 N VAL B 3 -2.290 4.267 6.561 1.00 0.09 N ATOM 1394 CA VAL B 3 -3.363 4.752 5.707 1.00 0.11 C ATOM 1395 C VAL B 3 -4.540 3.795 5.758 1.00 0.14 C ATOM 1396 O VAL B 3 -5.603 4.122 5.191 1.00 0.24 O ATOM 1397 CB VAL B 3 -2.954 4.967 4.230 1.00 0.14 C ATOM 1398 CG1 VAL B 3 -2.689 6.436 3.969 1.00 0.21 C ATOM 1399 CG2 VAL B 3 -1.745 4.128 3.827 1.00 0.11 C ATOM 1400 OXT VAL B 3 -4.401 2.726 6.387 1.00 0.27 O ATOM 0 H VAL B 3 -2.242 3.251 6.643 1.00 0.09 H new ATOM 0 HA VAL B 3 -3.632 5.731 6.103 1.00 0.11 H new ATOM 0 HB VAL B 3 -3.789 4.634 3.614 1.00 0.14 H new ATOM 0 HG11 VAL B 3 -2.402 6.574 2.927 1.00 0.21 H new ATOM 0 HG12 VAL B 3 -3.591 7.011 4.176 1.00 0.21 H new ATOM 0 HG13 VAL B 3 -1.882 6.781 4.616 1.00 0.21 H new ATOM 0 HG21 VAL B 3 -1.502 4.318 2.782 1.00 0.11 H new ATOM 0 HG22 VAL B 3 -0.893 4.395 4.452 1.00 0.11 H new ATOM 0 HG23 VAL B 3 -1.975 3.071 3.959 1.00 0.11 H new