USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1070 hydrogens (13 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 404 HIS : no HD1:sc= -6.21! K(o=-7.4!,f=-2.5) USER MOD Set 1.2: A 408 ASN : amide:sc= -1.16 K(o=-7.4,f=-3.4!) USER MOD Set 2.1: A 378 THR OG1 : rot 180:sc= 1 USER MOD Set 2.2: A 381 SER OG : rot -71:sc= 1.23 USER MOD Single : A 316 ASN : amide:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 318 GLN : amide:sc= -2.64! C(o=-2.6!,f=-6.2!) USER MOD Single : A 320 SER OG : rot -130:sc= -1.17 USER MOD Single : A 326 GLN : amide:sc= -1.03 K(o=-1,f=-4.3!) USER MOD Single : A 331 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.284) USER MOD Single : A 332 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 GLN : amide:sc= -19.4! C(o=-19!,f=-36!) USER MOD Single : A 341 SER OG : rot -105:sc= -3.07! USER MOD Single : A 346 THR OG1 : rot 22:sc= -0.516 USER MOD Single : A 351 SER OG : rot 28:sc= -5.15! USER MOD Single : A 357 LYS NZ :NH3+ -127:sc= -0.0288 (180deg=-0.479) USER MOD Single : A 358 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 361 ASN : amide:sc= -0.123 K(o=-0.12,f=-2.5!) USER MOD Single : A 368 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 369 SER OG : rot -42:sc= -1.37! USER MOD Single : A 371 HIS : no HD1:sc= -0.0595 K(o=-0.059,f=-0.85) USER MOD Single : A 373 THR OG1 : rot 180:sc= 0 USER MOD Single : A 380 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 383 MET CE :methyl -119:sc= -2.85 (180deg=-9.29!) USER MOD Single : A 384 SER OG : rot -135:sc= -0.517! USER MOD Single : A 387 ASN : amide:sc= -5.47! C(o=-5.5!,f=-4.2!) USER MOD Single : A 390 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.14) USER MOD Single : A 392 MET CE :methyl -150:sc= -0.277 (180deg=-1.68!) USER MOD Single : A 395 LYS NZ :NH3+ -149:sc= -8.42! (180deg=-14.2!) USER MOD Single : A 397 SER OG : rot 117:sc= -4.01! USER MOD Single : A 411 HIS : no HD1:sc= -0.0037 X(o=-0.0037,f=-0.011) USER MOD Single : A 414 THR OG1 : rot 180:sc= 0 USER MOD Single : A 418 GLN : amide:sc= -2.72! C(o=-2.7!,f=-1.9!) USER MOD Single : A 419 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 422 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 426 GLN : amide:sc= -0.0217 K(o=-0.022,f=-2!) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 437 SER OG : rot 180:sc= 0 USER MOD Single : A 446 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1001 ANP O2' : rot -35:sc= 0.113 USER MOD Single : A1001 ANP O3' : rot -53:sc= 0.556 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 316 117.397 -5.494 -5.256 1.00 4.45 N ATOM 2 CA ASN A 316 117.540 -6.468 -4.135 1.00 3.89 C ATOM 3 C ASN A 316 116.918 -5.897 -2.859 1.00 2.72 C ATOM 4 O ASN A 316 117.549 -5.836 -1.822 1.00 2.74 O ATOM 5 CB ASN A 316 119.047 -6.653 -3.962 1.00 4.56 C ATOM 6 CG ASN A 316 119.664 -7.099 -5.289 1.00 5.35 C ATOM 7 OD1 ASN A 316 120.680 -6.580 -5.706 1.00 5.50 O ATOM 8 ND2 ASN A 316 119.087 -8.048 -5.976 1.00 6.08 N ATOM 0 HA ASN A 316 117.035 -7.412 -4.339 1.00 3.89 H new ATOM 0 HB2 ASN A 316 119.503 -5.719 -3.633 1.00 4.56 H new ATOM 0 HB3 ASN A 316 119.246 -7.395 -3.189 1.00 4.56 H new ATOM 0 HD21 ASN A 316 119.490 -8.353 -6.862 1.00 6.08 H new ATOM 0 HD22 ASN A 316 118.234 -8.484 -5.626 1.00 6.08 H new ATOM 15 N ARG A 317 115.683 -5.482 -2.926 1.00 2.20 N ATOM 16 CA ARG A 317 115.020 -4.918 -1.716 1.00 1.30 C ATOM 17 C ARG A 317 113.676 -5.611 -1.473 1.00 1.48 C ATOM 18 O ARG A 317 112.931 -5.885 -2.392 1.00 1.26 O ATOM 19 CB ARG A 317 114.810 -3.437 -2.032 1.00 1.52 C ATOM 20 CG ARG A 317 116.169 -2.754 -2.200 1.00 2.49 C ATOM 21 CD ARG A 317 115.963 -1.254 -2.415 1.00 3.27 C ATOM 22 NE ARG A 317 117.307 -0.732 -2.788 1.00 4.34 N ATOM 23 CZ ARG A 317 117.468 0.536 -3.064 1.00 5.21 C ATOM 24 NH1 ARG A 317 116.450 1.354 -3.015 1.00 5.83 N ATOM 25 NH2 ARG A 317 118.648 0.986 -3.391 1.00 5.72 N ATOM 0 H ARG A 317 115.104 -5.509 -3.766 1.00 2.20 H new ATOM 0 HA ARG A 317 115.617 -5.062 -0.816 1.00 1.30 H new ATOM 0 HB2 ARG A 317 114.221 -3.328 -2.943 1.00 1.52 H new ATOM 0 HB3 ARG A 317 114.247 -2.959 -1.230 1.00 1.52 H new ATOM 0 HG2 ARG A 317 116.785 -2.924 -1.317 1.00 2.49 H new ATOM 0 HG3 ARG A 317 116.702 -3.184 -3.048 1.00 2.49 H new ATOM 0 HD2 ARG A 317 115.233 -1.064 -3.202 1.00 3.27 H new ATOM 0 HD3 ARG A 317 115.589 -0.773 -1.511 1.00 3.27 H new ATOM 0 HE ARG A 317 118.105 -1.366 -2.828 1.00 4.34 H new ATOM 0 HH11 ARG A 317 115.526 1.004 -2.761 1.00 5.83 H new ATOM 0 HH12 ARG A 317 116.579 2.342 -3.231 1.00 5.83 H new ATOM 0 HH21 ARG A 317 119.444 0.349 -3.431 1.00 5.72 H new ATOM 0 HH22 ARG A 317 118.775 1.975 -3.607 1.00 5.72 H new ATOM 39 N GLN A 318 113.356 -5.874 -0.237 1.00 2.19 N ATOM 40 CA GLN A 318 112.051 -6.525 0.076 1.00 2.64 C ATOM 41 C GLN A 318 111.446 -5.912 1.342 1.00 2.16 C ATOM 42 O GLN A 318 112.147 -5.615 2.287 1.00 2.69 O ATOM 43 CB GLN A 318 112.394 -7.998 0.317 1.00 3.37 C ATOM 44 CG GLN A 318 113.255 -8.121 1.576 1.00 4.16 C ATOM 45 CD GLN A 318 113.693 -9.576 1.756 1.00 4.79 C ATOM 46 OE1 GLN A 318 113.982 -10.260 0.795 1.00 4.85 O ATOM 47 NE2 GLN A 318 113.753 -10.082 2.958 1.00 5.58 N ATOM 0 H GLN A 318 113.942 -5.666 0.572 1.00 2.19 H new ATOM 0 HA GLN A 318 111.323 -6.396 -0.725 1.00 2.64 H new ATOM 0 HB2 GLN A 318 111.480 -8.582 0.430 1.00 3.37 H new ATOM 0 HB3 GLN A 318 112.927 -8.404 -0.543 1.00 3.37 H new ATOM 0 HG2 GLN A 318 114.129 -7.474 1.496 1.00 4.16 H new ATOM 0 HG3 GLN A 318 112.692 -7.789 2.448 1.00 4.16 H new ATOM 0 HE21 GLN A 318 113.510 -9.508 3.766 1.00 5.58 H new ATOM 0 HE22 GLN A 318 114.042 -11.051 3.089 1.00 5.58 H new ATOM 56 N ALA A 319 110.147 -5.802 1.411 1.00 1.32 N ATOM 57 CA ALA A 319 109.526 -5.301 2.669 1.00 1.05 C ATOM 58 C ALA A 319 109.745 -6.306 3.796 1.00 0.89 C ATOM 59 O ALA A 319 109.413 -7.469 3.673 1.00 1.18 O ATOM 60 CB ALA A 319 108.037 -5.176 2.367 1.00 1.42 C ATOM 0 H ALA A 319 109.496 -6.034 0.661 1.00 1.32 H new ATOM 0 HA ALA A 319 109.959 -4.352 2.985 1.00 1.05 H new ATOM 0 HB1 ALA A 319 107.516 -4.811 3.252 1.00 1.42 H new ATOM 0 HB2 ALA A 319 107.890 -4.476 1.545 1.00 1.42 H new ATOM 0 HB3 ALA A 319 107.639 -6.152 2.088 1.00 1.42 H new ATOM 66 N SER A 320 110.194 -5.851 4.928 1.00 0.59 N ATOM 67 CA SER A 320 110.303 -6.771 6.094 1.00 0.64 C ATOM 68 C SER A 320 109.230 -6.438 7.135 1.00 0.49 C ATOM 69 O SER A 320 108.689 -7.312 7.783 1.00 0.50 O ATOM 70 CB SER A 320 111.702 -6.538 6.662 1.00 0.78 C ATOM 71 OG SER A 320 112.618 -7.426 6.035 1.00 1.60 O ATOM 0 H SER A 320 110.489 -4.890 5.098 1.00 0.59 H new ATOM 0 HA SER A 320 110.153 -7.813 5.811 1.00 0.64 H new ATOM 0 HB2 SER A 320 112.007 -5.505 6.495 1.00 0.78 H new ATOM 0 HB3 SER A 320 111.701 -6.700 7.740 1.00 0.78 H new ATOM 0 HG SER A 320 113.148 -7.886 6.719 1.00 1.60 H new ATOM 77 N GLU A 321 108.901 -5.184 7.287 1.00 0.45 N ATOM 78 CA GLU A 321 107.843 -4.806 8.267 1.00 0.44 C ATOM 79 C GLU A 321 107.138 -3.522 7.835 1.00 0.37 C ATOM 80 O GLU A 321 107.763 -2.567 7.437 1.00 0.35 O ATOM 81 CB GLU A 321 108.575 -4.587 9.585 1.00 0.59 C ATOM 82 CG GLU A 321 107.571 -4.169 10.661 1.00 0.73 C ATOM 83 CD GLU A 321 108.313 -3.860 11.961 1.00 1.02 C ATOM 84 OE1 GLU A 321 109.530 -3.949 11.961 1.00 1.30 O ATOM 85 OE2 GLU A 321 107.652 -3.539 12.936 1.00 1.82 O ATOM 0 H GLU A 321 109.318 -4.406 6.776 1.00 0.45 H new ATOM 0 HA GLU A 321 107.076 -5.576 8.346 1.00 0.44 H new ATOM 0 HB2 GLU A 321 109.087 -5.501 9.885 1.00 0.59 H new ATOM 0 HB3 GLU A 321 109.339 -3.818 9.466 1.00 0.59 H new ATOM 0 HG2 GLU A 321 107.013 -3.292 10.332 1.00 0.73 H new ATOM 0 HG3 GLU A 321 106.845 -4.966 10.825 1.00 0.73 H new ATOM 92 N PHE A 322 105.856 -3.452 8.037 1.00 0.40 N ATOM 93 CA PHE A 322 105.123 -2.178 7.777 1.00 0.37 C ATOM 94 C PHE A 322 104.506 -1.652 9.073 1.00 0.38 C ATOM 95 O PHE A 322 104.114 -2.409 9.938 1.00 0.42 O ATOM 96 CB PHE A 322 104.043 -2.525 6.746 1.00 0.41 C ATOM 97 CG PHE A 322 103.391 -3.841 7.097 1.00 0.52 C ATOM 98 CD1 PHE A 322 102.604 -3.958 8.253 1.00 0.94 C ATOM 99 CD2 PHE A 322 103.575 -4.952 6.260 1.00 0.67 C ATOM 100 CE1 PHE A 322 102.006 -5.185 8.572 1.00 1.14 C ATOM 101 CE2 PHE A 322 102.975 -6.177 6.579 1.00 0.87 C ATOM 102 CZ PHE A 322 102.192 -6.294 7.735 1.00 1.00 C ATOM 0 H PHE A 322 105.278 -4.223 8.372 1.00 0.40 H new ATOM 0 HA PHE A 322 105.781 -1.393 7.404 1.00 0.37 H new ATOM 0 HB2 PHE A 322 103.292 -1.736 6.715 1.00 0.41 H new ATOM 0 HB3 PHE A 322 104.485 -2.584 5.751 1.00 0.41 H new ATOM 0 HD1 PHE A 322 102.459 -3.103 8.897 1.00 0.94 H new ATOM 0 HD2 PHE A 322 104.179 -4.863 5.369 1.00 0.67 H new ATOM 0 HE1 PHE A 322 101.402 -5.276 9.463 1.00 1.14 H new ATOM 0 HE2 PHE A 322 103.116 -7.031 5.934 1.00 0.87 H new ATOM 0 HZ PHE A 322 101.731 -7.239 7.981 1.00 1.00 H new ATOM 112 N ILE A 323 104.419 -0.359 9.221 1.00 0.37 N ATOM 113 CA ILE A 323 103.821 0.203 10.469 1.00 0.41 C ATOM 114 C ILE A 323 102.783 1.280 10.134 1.00 0.43 C ATOM 115 O ILE A 323 102.944 2.022 9.185 1.00 0.53 O ATOM 116 CB ILE A 323 104.980 0.813 11.251 1.00 0.44 C ATOM 117 CG1 ILE A 323 106.205 -0.103 11.172 1.00 0.46 C ATOM 118 CG2 ILE A 323 104.556 0.967 12.711 1.00 0.48 C ATOM 119 CD1 ILE A 323 107.049 0.276 9.954 1.00 0.52 C ATOM 0 H ILE A 323 104.733 0.330 8.538 1.00 0.37 H new ATOM 0 HA ILE A 323 103.308 -0.568 11.044 1.00 0.41 H new ATOM 0 HB ILE A 323 105.237 1.784 10.828 1.00 0.44 H new ATOM 0 HG12 ILE A 323 106.799 -0.013 12.081 1.00 0.46 H new ATOM 0 HG13 ILE A 323 105.890 -1.144 11.099 1.00 0.46 H new ATOM 0 HG21 ILE A 323 105.375 1.402 13.284 1.00 0.48 H new ATOM 0 HG22 ILE A 323 103.685 1.619 12.770 1.00 0.48 H new ATOM 0 HG23 ILE A 323 104.305 -0.011 13.122 1.00 0.48 H new ATOM 0 HD11 ILE A 323 107.921 -0.376 9.898 1.00 0.52 H new ATOM 0 HD12 ILE A 323 106.453 0.163 9.049 1.00 0.52 H new ATOM 0 HD13 ILE A 323 107.376 1.312 10.046 1.00 0.52 H new ATOM 131 N PRO A 324 101.706 1.274 10.881 1.00 0.36 N ATOM 132 CA PRO A 324 100.580 2.200 10.606 1.00 0.40 C ATOM 133 C PRO A 324 101.002 3.656 10.810 1.00 0.64 C ATOM 134 O PRO A 324 101.861 3.960 11.613 1.00 1.44 O ATOM 135 CB PRO A 324 99.508 1.815 11.625 1.00 0.33 C ATOM 136 CG PRO A 324 99.953 0.521 12.232 1.00 0.30 C ATOM 137 CD PRO A 324 101.439 0.416 12.037 1.00 0.29 C ATOM 0 HA PRO A 324 100.232 2.121 9.576 1.00 0.40 H new ATOM 0 HB2 PRO A 324 99.401 2.586 12.388 1.00 0.33 H new ATOM 0 HB3 PRO A 324 98.536 1.705 11.144 1.00 0.33 H new ATOM 0 HG2 PRO A 324 99.703 0.489 13.292 1.00 0.30 H new ATOM 0 HG3 PRO A 324 99.444 -0.319 11.759 1.00 0.30 H new ATOM 0 HD2 PRO A 324 101.982 0.755 12.919 1.00 0.29 H new ATOM 0 HD3 PRO A 324 101.745 -0.613 11.849 1.00 0.29 H new ATOM 145 N ALA A 325 100.324 4.560 10.162 1.00 0.75 N ATOM 146 CA ALA A 325 100.589 6.005 10.390 1.00 0.98 C ATOM 147 C ALA A 325 99.955 6.449 11.707 1.00 0.81 C ATOM 148 O ALA A 325 99.603 5.643 12.544 1.00 1.11 O ATOM 149 CB ALA A 325 99.925 6.717 9.212 1.00 1.58 C ATOM 0 H ALA A 325 99.593 4.358 9.480 1.00 0.75 H new ATOM 0 HA ALA A 325 101.654 6.228 10.454 1.00 0.98 H new ATOM 0 HB1 ALA A 325 100.075 7.793 9.305 1.00 1.58 H new ATOM 0 HB2 ALA A 325 100.368 6.368 8.279 1.00 1.58 H new ATOM 0 HB3 ALA A 325 98.857 6.499 9.210 1.00 1.58 H new ATOM 155 N GLN A 326 99.829 7.728 11.902 1.00 0.91 N ATOM 156 CA GLN A 326 99.244 8.236 13.174 1.00 1.48 C ATOM 157 C GLN A 326 97.808 7.727 13.344 1.00 1.32 C ATOM 158 O GLN A 326 96.876 8.271 12.784 1.00 1.83 O ATOM 159 CB GLN A 326 99.256 9.758 13.025 1.00 2.25 C ATOM 160 CG GLN A 326 98.915 10.409 14.367 1.00 3.14 C ATOM 161 CD GLN A 326 99.141 11.919 14.270 1.00 3.55 C ATOM 162 OE1 GLN A 326 99.586 12.415 13.254 1.00 4.00 O ATOM 163 NE2 GLN A 326 98.856 12.677 15.294 1.00 3.92 N ATOM 0 H GLN A 326 100.106 8.448 11.235 1.00 0.91 H new ATOM 0 HA GLN A 326 99.802 7.901 14.048 1.00 1.48 H new ATOM 0 HB2 GLN A 326 100.237 10.092 12.686 1.00 2.25 H new ATOM 0 HB3 GLN A 326 98.535 10.065 12.267 1.00 2.25 H new ATOM 0 HG2 GLN A 326 97.878 10.201 14.632 1.00 3.14 H new ATOM 0 HG3 GLN A 326 99.536 9.987 15.157 1.00 3.14 H new ATOM 0 HE21 GLN A 326 98.482 12.262 16.147 1.00 3.92 H new ATOM 0 HE22 GLN A 326 99.007 13.684 15.241 1.00 3.92 H new ATOM 172 N GLY A 327 97.610 6.760 14.201 1.00 1.28 N ATOM 173 CA GLY A 327 96.221 6.309 14.508 1.00 1.48 C ATOM 174 C GLY A 327 95.789 5.211 13.531 1.00 1.24 C ATOM 175 O GLY A 327 94.615 4.938 13.377 1.00 1.52 O ATOM 0 H GLY A 327 98.348 6.264 14.700 1.00 1.28 H new ATOM 0 HA2 GLY A 327 96.171 5.935 15.531 1.00 1.48 H new ATOM 0 HA3 GLY A 327 95.535 7.153 14.443 1.00 1.48 H new ATOM 179 N VAL A 328 96.715 4.605 12.838 1.00 0.93 N ATOM 180 CA VAL A 328 96.331 3.562 11.843 1.00 1.03 C ATOM 181 C VAL A 328 96.601 2.161 12.402 1.00 1.06 C ATOM 182 O VAL A 328 97.496 1.961 13.198 1.00 1.71 O ATOM 183 CB VAL A 328 97.210 3.826 10.624 1.00 1.43 C ATOM 184 CG1 VAL A 328 96.787 2.897 9.485 1.00 1.73 C ATOM 185 CG2 VAL A 328 97.044 5.282 10.183 1.00 1.57 C ATOM 0 H VAL A 328 97.716 4.785 12.917 1.00 0.93 H new ATOM 0 HA VAL A 328 95.270 3.606 11.598 1.00 1.03 H new ATOM 0 HB VAL A 328 98.254 3.640 10.878 1.00 1.43 H new ATOM 0 HG11 VAL A 328 97.413 3.083 8.612 1.00 1.73 H new ATOM 0 HG12 VAL A 328 96.902 1.860 9.800 1.00 1.73 H new ATOM 0 HG13 VAL A 328 95.744 3.085 9.230 1.00 1.73 H new ATOM 0 HG21 VAL A 328 97.671 5.472 9.312 1.00 1.57 H new ATOM 0 HG22 VAL A 328 96.001 5.468 9.926 1.00 1.57 H new ATOM 0 HG23 VAL A 328 97.341 5.945 10.996 1.00 1.57 H new ATOM 195 N ASP A 329 95.851 1.184 11.968 1.00 1.16 N ATOM 196 CA ASP A 329 96.090 -0.211 12.442 1.00 1.20 C ATOM 197 C ASP A 329 97.052 -0.932 11.489 1.00 1.16 C ATOM 198 O ASP A 329 97.059 -0.687 10.299 1.00 1.39 O ATOM 199 CB ASP A 329 94.714 -0.878 12.422 1.00 1.44 C ATOM 200 CG ASP A 329 93.810 -0.216 13.464 1.00 1.37 C ATOM 201 OD1 ASP A 329 94.330 0.517 14.290 1.00 2.02 O ATOM 202 OD2 ASP A 329 92.615 -0.453 13.418 1.00 1.69 O ATOM 0 H ASP A 329 95.083 1.291 11.306 1.00 1.16 H new ATOM 0 HA ASP A 329 96.541 -0.241 13.434 1.00 1.20 H new ATOM 0 HB2 ASP A 329 94.270 -0.789 11.431 1.00 1.44 H new ATOM 0 HB3 ASP A 329 94.811 -1.943 12.634 1.00 1.44 H new ATOM 207 N GLU A 330 97.870 -1.810 12.004 1.00 1.13 N ATOM 208 CA GLU A 330 98.837 -2.535 11.124 1.00 1.11 C ATOM 209 C GLU A 330 98.104 -3.346 10.051 1.00 0.97 C ATOM 210 O GLU A 330 98.576 -3.486 8.944 1.00 0.91 O ATOM 211 CB GLU A 330 99.602 -3.470 12.056 1.00 1.28 C ATOM 212 CG GLU A 330 100.815 -2.735 12.618 1.00 1.68 C ATOM 213 CD GLU A 330 101.582 -3.660 13.565 1.00 2.07 C ATOM 214 OE1 GLU A 330 101.080 -4.736 13.847 1.00 2.70 O ATOM 215 OE2 GLU A 330 102.659 -3.277 13.993 1.00 2.49 O ATOM 0 H GLU A 330 97.912 -2.057 12.993 1.00 1.13 H new ATOM 0 HA GLU A 330 99.494 -1.842 10.598 1.00 1.11 H new ATOM 0 HB2 GLU A 330 98.955 -3.803 12.868 1.00 1.28 H new ATOM 0 HB3 GLU A 330 99.920 -4.362 11.516 1.00 1.28 H new ATOM 0 HG2 GLU A 330 101.465 -2.410 11.805 1.00 1.68 H new ATOM 0 HG3 GLU A 330 100.496 -1.838 13.149 1.00 1.68 H new ATOM 222 N LYS A 331 96.969 -3.902 10.373 1.00 0.98 N ATOM 223 CA LYS A 331 96.241 -4.730 9.366 1.00 0.92 C ATOM 224 C LYS A 331 95.826 -3.874 8.167 1.00 0.81 C ATOM 225 O LYS A 331 96.035 -4.241 7.029 1.00 0.80 O ATOM 226 CB LYS A 331 95.009 -5.260 10.100 1.00 1.02 C ATOM 227 CG LYS A 331 94.291 -6.275 9.211 1.00 1.49 C ATOM 228 CD LYS A 331 93.035 -6.781 9.923 1.00 2.27 C ATOM 229 CE LYS A 331 92.404 -7.911 9.107 1.00 2.60 C ATOM 230 NZ LYS A 331 93.202 -9.122 9.447 1.00 3.03 N ATOM 0 H LYS A 331 96.515 -3.821 11.283 1.00 0.98 H new ATOM 0 HA LYS A 331 96.861 -5.537 8.976 1.00 0.92 H new ATOM 0 HB2 LYS A 331 95.304 -5.727 11.040 1.00 1.02 H new ATOM 0 HB3 LYS A 331 94.338 -4.438 10.349 1.00 1.02 H new ATOM 0 HG2 LYS A 331 94.022 -5.815 8.260 1.00 1.49 H new ATOM 0 HG3 LYS A 331 94.955 -7.110 8.985 1.00 1.49 H new ATOM 0 HD2 LYS A 331 93.289 -7.137 10.921 1.00 2.27 H new ATOM 0 HD3 LYS A 331 92.322 -5.966 10.047 1.00 2.27 H new ATOM 0 HE2 LYS A 331 91.353 -8.045 9.365 1.00 2.60 H new ATOM 0 HE3 LYS A 331 92.446 -7.698 8.039 1.00 2.60 H new ATOM 0 HZ1 LYS A 331 93.468 -9.619 8.573 1.00 3.03 H new ATOM 0 HZ2 LYS A 331 94.061 -8.839 9.960 1.00 3.03 H new ATOM 0 HZ3 LYS A 331 92.634 -9.755 10.046 1.00 3.03 H new ATOM 244 N THR A 332 95.268 -2.724 8.410 1.00 0.78 N ATOM 245 CA THR A 332 94.870 -1.837 7.279 1.00 0.74 C ATOM 246 C THR A 332 96.101 -1.428 6.470 1.00 0.65 C ATOM 247 O THR A 332 96.119 -1.505 5.259 1.00 0.66 O ATOM 248 CB THR A 332 94.245 -0.612 7.946 1.00 0.77 C ATOM 249 OG1 THR A 332 93.172 -1.025 8.781 1.00 0.90 O ATOM 250 CG2 THR A 332 93.723 0.344 6.873 1.00 0.82 C ATOM 0 H THR A 332 95.069 -2.358 9.341 1.00 0.78 H new ATOM 0 HA THR A 332 94.183 -2.328 6.590 1.00 0.74 H new ATOM 0 HB THR A 332 94.997 -0.102 8.548 1.00 0.77 H new ATOM 0 HG1 THR A 332 92.771 -0.241 9.211 1.00 0.90 H new ATOM 0 HG21 THR A 332 93.277 1.217 7.349 1.00 0.82 H new ATOM 0 HG22 THR A 332 94.548 0.660 6.235 1.00 0.82 H new ATOM 0 HG23 THR A 332 92.971 -0.163 6.269 1.00 0.82 H new ATOM 258 N LEU A 333 97.138 -1.013 7.139 1.00 0.59 N ATOM 259 CA LEU A 333 98.384 -0.617 6.426 1.00 0.57 C ATOM 260 C LEU A 333 98.876 -1.746 5.521 1.00 0.58 C ATOM 261 O LEU A 333 99.184 -1.544 4.364 1.00 0.54 O ATOM 262 CB LEU A 333 99.390 -0.360 7.546 1.00 0.68 C ATOM 263 CG LEU A 333 100.807 -0.302 6.975 1.00 0.64 C ATOM 264 CD1 LEU A 333 101.013 1.019 6.233 1.00 0.93 C ATOM 265 CD2 LEU A 333 101.804 -0.404 8.126 1.00 0.87 C ATOM 0 H LEU A 333 97.177 -0.930 8.155 1.00 0.59 H new ATOM 0 HA LEU A 333 98.235 0.250 5.783 1.00 0.57 H new ATOM 0 HB2 LEU A 333 99.154 0.577 8.050 1.00 0.68 H new ATOM 0 HB3 LEU A 333 99.323 -1.150 8.294 1.00 0.68 H new ATOM 0 HG LEU A 333 100.958 -1.126 6.278 1.00 0.64 H new ATOM 0 HD11 LEU A 333 102.024 1.055 5.828 1.00 0.93 H new ATOM 0 HD12 LEU A 333 100.293 1.095 5.418 1.00 0.93 H new ATOM 0 HD13 LEU A 333 100.869 1.850 6.923 1.00 0.93 H new ATOM 0 HD21 LEU A 333 102.820 -0.364 7.732 1.00 0.87 H new ATOM 0 HD22 LEU A 333 101.649 0.426 8.816 1.00 0.87 H new ATOM 0 HD23 LEU A 333 101.656 -1.347 8.653 1.00 0.87 H new ATOM 277 N ALA A 334 98.998 -2.927 6.054 1.00 0.66 N ATOM 278 CA ALA A 334 99.530 -4.057 5.243 1.00 0.73 C ATOM 279 C ALA A 334 98.610 -4.340 4.055 1.00 0.68 C ATOM 280 O ALA A 334 99.051 -4.689 2.980 1.00 0.66 O ATOM 281 CB ALA A 334 99.555 -5.248 6.203 1.00 0.87 C ATOM 0 H ALA A 334 98.753 -3.160 7.016 1.00 0.66 H new ATOM 0 HA ALA A 334 100.516 -3.843 4.830 1.00 0.73 H new ATOM 0 HB1 ALA A 334 99.936 -6.127 5.683 1.00 0.87 H new ATOM 0 HB2 ALA A 334 100.202 -5.019 7.050 1.00 0.87 H new ATOM 0 HB3 ALA A 334 98.545 -5.448 6.561 1.00 0.87 H new ATOM 287 N ASP A 335 97.333 -4.249 4.248 1.00 0.67 N ATOM 288 CA ASP A 335 96.398 -4.588 3.141 1.00 0.65 C ATOM 289 C ASP A 335 96.525 -3.590 1.982 1.00 0.62 C ATOM 290 O ASP A 335 96.589 -3.971 0.830 1.00 0.69 O ATOM 291 CB ASP A 335 95.014 -4.495 3.762 1.00 0.67 C ATOM 292 CG ASP A 335 93.966 -4.991 2.763 1.00 1.19 C ATOM 293 OD1 ASP A 335 94.360 -5.468 1.711 1.00 1.61 O ATOM 294 OD2 ASP A 335 92.790 -4.885 3.067 1.00 1.96 O ATOM 0 H ASP A 335 96.892 -3.956 5.120 1.00 0.67 H new ATOM 0 HA ASP A 335 96.607 -5.573 2.724 1.00 0.65 H new ATOM 0 HB2 ASP A 335 94.973 -5.092 4.673 1.00 0.67 H new ATOM 0 HB3 ASP A 335 94.801 -3.464 4.046 1.00 0.67 H new ATOM 299 N ALA A 336 96.554 -2.317 2.273 1.00 0.60 N ATOM 300 CA ALA A 336 96.663 -1.306 1.180 1.00 0.62 C ATOM 301 C ALA A 336 98.017 -1.422 0.486 1.00 0.51 C ATOM 302 O ALA A 336 98.122 -1.272 -0.714 1.00 0.55 O ATOM 303 CB ALA A 336 96.524 0.054 1.864 1.00 0.76 C ATOM 0 H ALA A 336 96.507 -1.934 3.217 1.00 0.60 H new ATOM 0 HA ALA A 336 95.900 -1.450 0.415 1.00 0.62 H new ATOM 0 HB1 ALA A 336 96.595 0.845 1.118 1.00 0.76 H new ATOM 0 HB2 ALA A 336 95.557 0.112 2.364 1.00 0.76 H new ATOM 0 HB3 ALA A 336 97.321 0.175 2.598 1.00 0.76 H new ATOM 309 N ALA A 337 99.051 -1.720 1.218 1.00 0.46 N ATOM 310 CA ALA A 337 100.387 -1.872 0.573 1.00 0.50 C ATOM 311 C ALA A 337 100.366 -3.044 -0.413 1.00 0.62 C ATOM 312 O ALA A 337 101.040 -3.028 -1.423 1.00 0.72 O ATOM 313 CB ALA A 337 101.362 -2.146 1.722 1.00 0.50 C ATOM 0 H ALA A 337 99.033 -1.864 2.228 1.00 0.46 H new ATOM 0 HA ALA A 337 100.674 -0.986 0.006 1.00 0.50 H new ATOM 0 HB1 ALA A 337 102.369 -2.269 1.323 1.00 0.50 H new ATOM 0 HB2 ALA A 337 101.348 -1.308 2.419 1.00 0.50 H new ATOM 0 HB3 ALA A 337 101.064 -3.056 2.243 1.00 0.50 H new ATOM 319 N GLN A 338 99.650 -4.087 -0.094 1.00 0.71 N ATOM 320 CA GLN A 338 99.648 -5.289 -0.976 1.00 0.91 C ATOM 321 C GLN A 338 98.850 -5.042 -2.260 1.00 0.94 C ATOM 322 O GLN A 338 99.307 -5.335 -3.346 1.00 1.06 O ATOM 323 CB GLN A 338 98.992 -6.380 -0.135 1.00 1.03 C ATOM 324 CG GLN A 338 99.843 -6.728 1.109 1.00 1.03 C ATOM 325 CD GLN A 338 101.128 -5.876 1.220 1.00 0.94 C ATOM 326 OE1 GLN A 338 101.968 -5.900 0.348 1.00 1.72 O ATOM 327 NE2 GLN A 338 101.315 -5.128 2.272 1.00 0.69 N ATOM 0 H GLN A 338 99.066 -4.159 0.739 1.00 0.71 H new ATOM 0 HA GLN A 338 100.654 -5.556 -1.299 1.00 0.91 H new ATOM 0 HB2 GLN A 338 98.002 -6.051 0.181 1.00 1.03 H new ATOM 0 HB3 GLN A 338 98.852 -7.274 -0.743 1.00 1.03 H new ATOM 0 HG2 GLN A 338 99.240 -6.585 2.006 1.00 1.03 H new ATOM 0 HG3 GLN A 338 100.115 -7.783 1.073 1.00 1.03 H new ATOM 0 HE21 GLN A 338 100.612 -5.102 3.011 1.00 0.69 H new ATOM 0 HE22 GLN A 338 102.164 -4.569 2.356 1.00 0.69 H new ATOM 336 N LEU A 339 97.639 -4.567 -2.151 1.00 0.86 N ATOM 337 CA LEU A 339 96.817 -4.381 -3.382 1.00 0.90 C ATOM 338 C LEU A 339 97.344 -3.197 -4.201 1.00 0.84 C ATOM 339 O LEU A 339 97.354 -3.232 -5.416 1.00 1.00 O ATOM 340 CB LEU A 339 95.385 -4.131 -2.900 1.00 0.80 C ATOM 341 CG LEU A 339 95.356 -3.021 -1.853 1.00 1.01 C ATOM 342 CD1 LEU A 339 94.698 -1.781 -2.456 1.00 1.34 C ATOM 343 CD2 LEU A 339 94.537 -3.495 -0.649 1.00 1.58 C ATOM 0 H LEU A 339 97.187 -4.303 -1.276 1.00 0.86 H new ATOM 0 HA LEU A 339 96.860 -5.254 -4.034 1.00 0.90 H new ATOM 0 HB2 LEU A 339 94.754 -3.857 -3.745 1.00 0.80 H new ATOM 0 HB3 LEU A 339 94.973 -5.047 -2.478 1.00 0.80 H new ATOM 0 HG LEU A 339 96.371 -2.779 -1.537 1.00 1.01 H new ATOM 0 HD11 LEU A 339 94.674 -0.984 -1.713 1.00 1.34 H new ATOM 0 HD12 LEU A 339 95.270 -1.451 -3.324 1.00 1.34 H new ATOM 0 HD13 LEU A 339 93.680 -2.022 -2.762 1.00 1.34 H new ATOM 0 HD21 LEU A 339 94.510 -2.709 0.105 1.00 1.58 H new ATOM 0 HD22 LEU A 339 93.521 -3.726 -0.968 1.00 1.58 H new ATOM 0 HD23 LEU A 339 94.996 -4.388 -0.226 1.00 1.58 H new ATOM 355 N ALA A 340 97.849 -2.183 -3.553 1.00 0.74 N ATOM 356 CA ALA A 340 98.451 -1.044 -4.303 1.00 0.93 C ATOM 357 C ALA A 340 99.706 -1.510 -5.044 1.00 1.36 C ATOM 358 O ALA A 340 100.191 -0.849 -5.940 1.00 2.24 O ATOM 359 CB ALA A 340 98.813 -0.016 -3.231 1.00 0.82 C ATOM 0 H ALA A 340 97.871 -2.094 -2.537 1.00 0.74 H new ATOM 0 HA ALA A 340 97.773 -0.633 -5.051 1.00 0.93 H new ATOM 0 HB1 ALA A 340 99.264 0.857 -3.702 1.00 0.82 H new ATOM 0 HB2 ALA A 340 97.912 0.285 -2.696 1.00 0.82 H new ATOM 0 HB3 ALA A 340 99.522 -0.456 -2.529 1.00 0.82 H new ATOM 365 N SER A 341 100.215 -2.659 -4.697 1.00 1.07 N ATOM 366 CA SER A 341 101.418 -3.186 -5.406 1.00 1.44 C ATOM 367 C SER A 341 101.002 -4.194 -6.481 1.00 1.51 C ATOM 368 O SER A 341 101.737 -4.463 -7.410 1.00 2.65 O ATOM 369 CB SER A 341 102.266 -3.859 -4.326 1.00 2.84 C ATOM 370 OG SER A 341 101.417 -4.361 -3.304 1.00 3.56 O ATOM 0 H SER A 341 99.852 -3.256 -3.954 1.00 1.07 H new ATOM 0 HA SER A 341 101.972 -2.397 -5.914 1.00 1.44 H new ATOM 0 HB2 SER A 341 102.850 -4.671 -4.760 1.00 2.84 H new ATOM 0 HB3 SER A 341 102.975 -3.145 -3.907 1.00 2.84 H new ATOM 0 HG SER A 341 101.475 -3.781 -2.516 1.00 3.56 H new ATOM 376 N LEU A 342 99.799 -4.693 -6.410 1.00 1.19 N ATOM 377 CA LEU A 342 99.316 -5.608 -7.483 1.00 2.40 C ATOM 378 C LEU A 342 99.412 -4.909 -8.840 1.00 2.59 C ATOM 379 O LEU A 342 99.516 -5.541 -9.873 1.00 3.62 O ATOM 380 CB LEU A 342 97.852 -5.893 -7.146 1.00 3.39 C ATOM 381 CG LEU A 342 97.762 -6.681 -5.842 1.00 3.93 C ATOM 382 CD1 LEU A 342 96.299 -7.030 -5.564 1.00 4.36 C ATOM 383 CD2 LEU A 342 98.577 -7.970 -5.970 1.00 3.74 C ATOM 0 H LEU A 342 99.133 -4.508 -5.660 1.00 1.19 H new ATOM 0 HA LEU A 342 99.906 -6.523 -7.538 1.00 2.40 H new ATOM 0 HB2 LEU A 342 97.302 -4.956 -7.053 1.00 3.39 H new ATOM 0 HB3 LEU A 342 97.387 -6.457 -7.955 1.00 3.39 H new ATOM 0 HG LEU A 342 98.157 -6.081 -5.023 1.00 3.93 H new ATOM 0 HD11 LEU A 342 96.230 -7.593 -4.633 1.00 4.36 H new ATOM 0 HD12 LEU A 342 95.716 -6.113 -5.477 1.00 4.36 H new ATOM 0 HD13 LEU A 342 95.907 -7.633 -6.383 1.00 4.36 H new ATOM 0 HD21 LEU A 342 98.514 -8.534 -5.040 1.00 3.74 H new ATOM 0 HD22 LEU A 342 98.180 -8.572 -6.787 1.00 3.74 H new ATOM 0 HD23 LEU A 342 99.619 -7.723 -6.175 1.00 3.74 H new ATOM 395 N ALA A 343 99.355 -3.606 -8.843 1.00 2.04 N ATOM 396 CA ALA A 343 99.416 -2.855 -10.129 1.00 2.90 C ATOM 397 C ALA A 343 100.870 -2.615 -10.548 1.00 2.34 C ATOM 398 O ALA A 343 101.162 -2.423 -11.712 1.00 2.96 O ATOM 399 CB ALA A 343 98.708 -1.530 -9.845 1.00 3.81 C ATOM 0 H ALA A 343 99.269 -3.027 -8.008 1.00 2.04 H new ATOM 0 HA ALA A 343 98.947 -3.403 -10.946 1.00 2.90 H new ATOM 0 HB1 ALA A 343 98.710 -0.916 -10.746 1.00 3.81 H new ATOM 0 HB2 ALA A 343 97.680 -1.725 -9.541 1.00 3.81 H new ATOM 0 HB3 ALA A 343 99.229 -1.003 -9.046 1.00 3.81 H new ATOM 405 N ASP A 344 101.786 -2.622 -9.618 1.00 1.46 N ATOM 406 CA ASP A 344 103.214 -2.391 -9.989 1.00 1.77 C ATOM 407 C ASP A 344 103.818 -3.669 -10.580 1.00 1.92 C ATOM 408 O ASP A 344 103.580 -4.759 -10.101 1.00 1.99 O ATOM 409 CB ASP A 344 103.914 -2.003 -8.682 1.00 1.69 C ATOM 410 CG ASP A 344 104.168 -3.248 -7.828 1.00 2.00 C ATOM 411 OD1 ASP A 344 104.890 -4.120 -8.284 1.00 1.89 O ATOM 412 OD2 ASP A 344 103.641 -3.305 -6.729 1.00 2.84 O ATOM 0 H ASP A 344 101.611 -2.776 -8.625 1.00 1.46 H new ATOM 0 HA ASP A 344 103.325 -1.614 -10.745 1.00 1.77 H new ATOM 0 HB2 ASP A 344 104.858 -1.504 -8.901 1.00 1.69 H new ATOM 0 HB3 ASP A 344 103.299 -1.293 -8.129 1.00 1.69 H new ATOM 417 N GLU A 345 104.593 -3.543 -11.623 1.00 2.10 N ATOM 418 CA GLU A 345 105.207 -4.751 -12.245 1.00 2.37 C ATOM 419 C GLU A 345 106.620 -4.967 -11.702 1.00 2.30 C ATOM 420 O GLU A 345 107.343 -5.837 -12.147 1.00 2.51 O ATOM 421 CB GLU A 345 105.244 -4.454 -13.745 1.00 2.66 C ATOM 422 CG GLU A 345 103.820 -4.236 -14.258 1.00 2.29 C ATOM 423 CD GLU A 345 103.851 -4.017 -15.771 1.00 2.60 C ATOM 424 OE1 GLU A 345 104.937 -3.875 -16.308 1.00 2.87 O ATOM 425 OE2 GLU A 345 102.787 -3.994 -16.368 1.00 2.99 O ATOM 0 H GLU A 345 104.827 -2.657 -12.071 1.00 2.10 H new ATOM 0 HA GLU A 345 104.643 -5.658 -12.026 1.00 2.37 H new ATOM 0 HB2 GLU A 345 105.850 -3.568 -13.936 1.00 2.66 H new ATOM 0 HB3 GLU A 345 105.711 -5.281 -14.279 1.00 2.66 H new ATOM 0 HG2 GLU A 345 103.199 -5.099 -14.017 1.00 2.29 H new ATOM 0 HG3 GLU A 345 103.372 -3.374 -13.764 1.00 2.29 H new ATOM 432 N THR A 346 107.013 -4.195 -10.728 1.00 2.06 N ATOM 433 CA THR A 346 108.371 -4.367 -10.139 1.00 2.06 C ATOM 434 C THR A 346 108.396 -5.594 -9.224 1.00 1.91 C ATOM 435 O THR A 346 107.429 -5.881 -8.544 1.00 1.73 O ATOM 436 CB THR A 346 108.620 -3.092 -9.333 1.00 2.02 C ATOM 437 OG1 THR A 346 107.509 -2.850 -8.479 1.00 1.96 O ATOM 438 CG2 THR A 346 108.801 -1.910 -10.287 1.00 2.07 C ATOM 0 H THR A 346 106.452 -3.451 -10.313 1.00 2.06 H new ATOM 0 HA THR A 346 109.135 -4.521 -10.901 1.00 2.06 H new ATOM 0 HB THR A 346 109.522 -3.211 -8.732 1.00 2.02 H new ATOM 0 HG1 THR A 346 107.024 -3.688 -8.328 1.00 1.96 H new ATOM 0 HG21 THR A 346 108.978 -1.002 -9.711 1.00 2.07 H new ATOM 0 HG22 THR A 346 109.653 -2.097 -10.941 1.00 2.07 H new ATOM 0 HG23 THR A 346 107.901 -1.788 -10.890 1.00 2.07 H new ATOM 446 N PRO A 347 109.509 -6.275 -9.231 1.00 2.03 N ATOM 447 CA PRO A 347 109.667 -7.480 -8.383 1.00 1.99 C ATOM 448 C PRO A 347 109.486 -7.114 -6.906 1.00 1.79 C ATOM 449 O PRO A 347 108.955 -7.881 -6.128 1.00 1.68 O ATOM 450 CB PRO A 347 111.098 -7.950 -8.656 1.00 2.25 C ATOM 451 CG PRO A 347 111.777 -6.809 -9.352 1.00 2.38 C ATOM 452 CD PRO A 347 110.708 -5.988 -10.018 1.00 2.29 C ATOM 0 HA PRO A 347 108.931 -8.253 -8.604 1.00 1.99 H new ATOM 0 HB2 PRO A 347 111.610 -8.202 -7.728 1.00 2.25 H new ATOM 0 HB3 PRO A 347 111.104 -8.846 -9.277 1.00 2.25 H new ATOM 0 HG2 PRO A 347 112.338 -6.204 -8.640 1.00 2.38 H new ATOM 0 HG3 PRO A 347 112.491 -7.179 -10.088 1.00 2.38 H new ATOM 0 HD2 PRO A 347 110.952 -4.926 -10.003 1.00 2.29 H new ATOM 0 HD3 PRO A 347 110.578 -6.271 -11.063 1.00 2.29 H new ATOM 460 N GLU A 348 109.908 -5.940 -6.521 1.00 1.76 N ATOM 461 CA GLU A 348 109.740 -5.519 -5.100 1.00 1.64 C ATOM 462 C GLU A 348 108.252 -5.409 -4.755 1.00 1.41 C ATOM 463 O GLU A 348 107.836 -5.712 -3.656 1.00 1.31 O ATOM 464 CB GLU A 348 110.411 -4.148 -5.013 1.00 1.72 C ATOM 465 CG GLU A 348 111.910 -4.297 -5.281 1.00 2.14 C ATOM 466 CD GLU A 348 112.595 -2.936 -5.127 1.00 2.49 C ATOM 467 OE1 GLU A 348 111.886 -1.951 -4.999 1.00 3.25 O ATOM 468 OE2 GLU A 348 113.814 -2.903 -5.141 1.00 2.49 O ATOM 0 H GLU A 348 110.361 -5.256 -7.127 1.00 1.76 H new ATOM 0 HA GLU A 348 110.177 -6.233 -4.402 1.00 1.64 H new ATOM 0 HB2 GLU A 348 109.967 -3.467 -5.739 1.00 1.72 H new ATOM 0 HB3 GLU A 348 110.248 -3.713 -4.027 1.00 1.72 H new ATOM 0 HG2 GLU A 348 112.345 -5.015 -4.586 1.00 2.14 H new ATOM 0 HG3 GLU A 348 112.074 -4.687 -6.286 1.00 2.14 H new ATOM 475 N GLY A 349 107.448 -4.980 -5.687 1.00 1.42 N ATOM 476 CA GLY A 349 105.988 -4.852 -5.413 1.00 1.30 C ATOM 477 C GLY A 349 105.418 -6.211 -5.003 1.00 1.23 C ATOM 478 O GLY A 349 104.534 -6.297 -4.174 1.00 1.23 O ATOM 0 H GLY A 349 107.738 -4.712 -6.627 1.00 1.42 H new ATOM 0 HA2 GLY A 349 105.820 -4.123 -4.621 1.00 1.30 H new ATOM 0 HA3 GLY A 349 105.473 -4.484 -6.300 1.00 1.30 H new ATOM 482 N ARG A 350 106.005 -7.277 -5.470 1.00 1.19 N ATOM 483 CA ARG A 350 105.583 -8.623 -4.989 1.00 1.15 C ATOM 484 C ARG A 350 106.160 -8.873 -3.601 1.00 1.06 C ATOM 485 O ARG A 350 105.516 -9.431 -2.740 1.00 0.94 O ATOM 486 CB ARG A 350 106.161 -9.611 -5.997 1.00 1.18 C ATOM 487 CG ARG A 350 105.863 -9.115 -7.409 1.00 1.81 C ATOM 488 CD ARG A 350 106.313 -10.163 -8.428 1.00 2.33 C ATOM 489 NE ARG A 350 106.157 -9.502 -9.754 1.00 2.77 N ATOM 490 CZ ARG A 350 106.420 -10.159 -10.852 1.00 3.16 C ATOM 491 NH1 ARG A 350 106.821 -11.401 -10.796 1.00 3.46 N ATOM 492 NH2 ARG A 350 106.282 -9.572 -12.010 1.00 3.62 N ATOM 0 H ARG A 350 106.755 -7.276 -6.161 1.00 1.19 H new ATOM 0 HA ARG A 350 104.500 -8.718 -4.913 1.00 1.15 H new ATOM 0 HB2 ARG A 350 107.237 -9.710 -5.852 1.00 1.18 H new ATOM 0 HB3 ARG A 350 105.727 -10.599 -5.846 1.00 1.18 H new ATOM 0 HG2 ARG A 350 104.796 -8.921 -7.519 1.00 1.81 H new ATOM 0 HG3 ARG A 350 106.379 -8.172 -7.590 1.00 1.81 H new ATOM 0 HD2 ARG A 350 107.347 -10.463 -8.256 1.00 2.33 H new ATOM 0 HD3 ARG A 350 105.704 -11.065 -8.362 1.00 2.33 H new ATOM 0 HE ARG A 350 105.844 -8.533 -9.805 1.00 2.77 H new ATOM 0 HH11 ARG A 350 106.930 -11.862 -9.892 1.00 3.46 H new ATOM 0 HH12 ARG A 350 107.025 -11.910 -11.656 1.00 3.46 H new ATOM 0 HH21 ARG A 350 105.969 -8.602 -12.056 1.00 3.62 H new ATOM 0 HH22 ARG A 350 106.487 -10.083 -12.869 1.00 3.62 H new ATOM 506 N SER A 351 107.349 -8.409 -3.358 1.00 1.15 N ATOM 507 CA SER A 351 107.933 -8.570 -1.998 1.00 1.10 C ATOM 508 C SER A 351 106.975 -7.992 -0.951 1.00 0.97 C ATOM 509 O SER A 351 106.658 -8.628 0.032 1.00 0.87 O ATOM 510 CB SER A 351 109.235 -7.774 -2.030 1.00 1.25 C ATOM 511 OG SER A 351 109.919 -7.950 -0.798 1.00 2.40 O ATOM 0 H SER A 351 107.941 -7.928 -4.035 1.00 1.15 H new ATOM 0 HA SER A 351 108.104 -9.615 -1.737 1.00 1.10 H new ATOM 0 HB2 SER A 351 109.860 -8.109 -2.858 1.00 1.25 H new ATOM 0 HB3 SER A 351 109.025 -6.717 -2.196 1.00 1.25 H new ATOM 0 HG SER A 351 109.682 -8.820 -0.413 1.00 2.40 H new ATOM 517 N ILE A 352 106.480 -6.809 -1.180 1.00 1.00 N ATOM 518 CA ILE A 352 105.505 -6.203 -0.227 1.00 0.93 C ATOM 519 C ILE A 352 104.207 -7.031 -0.170 1.00 0.80 C ATOM 520 O ILE A 352 103.713 -7.343 0.899 1.00 0.70 O ATOM 521 CB ILE A 352 105.277 -4.794 -0.791 1.00 1.08 C ATOM 522 CG1 ILE A 352 106.335 -3.853 -0.212 1.00 1.16 C ATOM 523 CG2 ILE A 352 103.882 -4.273 -0.431 1.00 1.16 C ATOM 524 CD1 ILE A 352 106.340 -2.544 -0.999 1.00 1.39 C ATOM 0 H ILE A 352 106.709 -6.232 -1.989 1.00 1.00 H new ATOM 0 HA ILE A 352 105.863 -6.176 0.802 1.00 0.93 H new ATOM 0 HB ILE A 352 105.355 -4.835 -1.877 1.00 1.08 H new ATOM 0 HG12 ILE A 352 106.125 -3.656 0.839 1.00 1.16 H new ATOM 0 HG13 ILE A 352 107.318 -4.321 -0.259 1.00 1.16 H new ATOM 0 HG21 ILE A 352 103.749 -3.273 -0.844 1.00 1.16 H new ATOM 0 HG22 ILE A 352 103.126 -4.940 -0.846 1.00 1.16 H new ATOM 0 HG23 ILE A 352 103.776 -4.235 0.653 1.00 1.16 H new ATOM 0 HD11 ILE A 352 107.094 -1.874 -0.586 1.00 1.39 H new ATOM 0 HD12 ILE A 352 106.570 -2.749 -2.045 1.00 1.39 H new ATOM 0 HD13 ILE A 352 105.359 -2.074 -0.929 1.00 1.39 H new ATOM 536 N VAL A 353 103.638 -7.376 -1.298 1.00 0.86 N ATOM 537 CA VAL A 353 102.362 -8.160 -1.279 1.00 0.82 C ATOM 538 C VAL A 353 102.552 -9.474 -0.508 1.00 0.77 C ATOM 539 O VAL A 353 101.697 -9.891 0.250 1.00 0.77 O ATOM 540 CB VAL A 353 102.039 -8.441 -2.749 1.00 0.97 C ATOM 541 CG1 VAL A 353 100.860 -9.412 -2.837 1.00 1.18 C ATOM 542 CG2 VAL A 353 101.668 -7.132 -3.452 1.00 1.10 C ATOM 0 H VAL A 353 103.998 -7.151 -2.226 1.00 0.86 H new ATOM 0 HA VAL A 353 101.557 -7.617 -0.784 1.00 0.82 H new ATOM 0 HB VAL A 353 102.912 -8.880 -3.232 1.00 0.97 H new ATOM 0 HG11 VAL A 353 100.630 -9.612 -3.884 1.00 1.18 H new ATOM 0 HG12 VAL A 353 101.120 -10.346 -2.338 1.00 1.18 H new ATOM 0 HG13 VAL A 353 99.989 -8.971 -2.352 1.00 1.18 H new ATOM 0 HG21 VAL A 353 101.438 -7.333 -4.498 1.00 1.10 H new ATOM 0 HG22 VAL A 353 100.796 -6.693 -2.967 1.00 1.10 H new ATOM 0 HG23 VAL A 353 102.505 -6.437 -3.392 1.00 1.10 H new ATOM 552 N ILE A 354 103.738 -10.010 -0.531 1.00 0.79 N ATOM 553 CA ILE A 354 104.056 -11.156 0.371 1.00 0.84 C ATOM 554 C ILE A 354 104.090 -10.692 1.825 1.00 0.72 C ATOM 555 O ILE A 354 103.627 -11.375 2.713 1.00 0.77 O ATOM 556 CB ILE A 354 105.439 -11.621 -0.063 1.00 0.97 C ATOM 557 CG1 ILE A 354 105.392 -12.052 -1.531 1.00 1.21 C ATOM 558 CG2 ILE A 354 105.881 -12.798 0.809 1.00 1.11 C ATOM 559 CD1 ILE A 354 106.815 -12.148 -2.084 1.00 1.36 C ATOM 0 H ILE A 354 104.503 -9.706 -1.134 1.00 0.79 H new ATOM 0 HA ILE A 354 103.312 -11.950 0.306 1.00 0.84 H new ATOM 0 HB ILE A 354 106.152 -10.804 0.051 1.00 0.97 H new ATOM 0 HG12 ILE A 354 104.890 -13.015 -1.622 1.00 1.21 H new ATOM 0 HG13 ILE A 354 104.813 -11.335 -2.113 1.00 1.21 H new ATOM 0 HG21 ILE A 354 106.871 -13.130 0.497 1.00 1.11 H new ATOM 0 HG22 ILE A 354 105.915 -12.485 1.853 1.00 1.11 H new ATOM 0 HG23 ILE A 354 105.172 -13.619 0.699 1.00 1.11 H new ATOM 0 HD11 ILE A 354 106.779 -12.455 -3.129 1.00 1.36 H new ATOM 0 HD12 ILE A 354 107.301 -11.175 -2.008 1.00 1.36 H new ATOM 0 HD13 ILE A 354 107.380 -12.882 -1.509 1.00 1.36 H new ATOM 571 N LEU A 355 104.744 -9.604 2.088 1.00 0.63 N ATOM 572 CA LEU A 355 104.931 -9.180 3.503 1.00 0.62 C ATOM 573 C LEU A 355 103.604 -9.256 4.264 1.00 0.55 C ATOM 574 O LEU A 355 103.500 -9.911 5.280 1.00 0.61 O ATOM 575 CB LEU A 355 105.398 -7.731 3.413 1.00 0.64 C ATOM 576 CG LEU A 355 105.769 -7.231 4.809 1.00 0.73 C ATOM 577 CD1 LEU A 355 106.882 -8.109 5.382 1.00 1.14 C ATOM 578 CD2 LEU A 355 106.261 -5.783 4.722 1.00 1.15 C ATOM 0 H LEU A 355 105.158 -8.988 1.389 1.00 0.63 H new ATOM 0 HA LEU A 355 105.640 -9.816 4.033 1.00 0.62 H new ATOM 0 HB2 LEU A 355 106.257 -7.655 2.747 1.00 0.64 H new ATOM 0 HB3 LEU A 355 104.610 -7.109 2.989 1.00 0.64 H new ATOM 0 HG LEU A 355 104.893 -7.279 5.456 1.00 0.73 H new ATOM 0 HD11 LEU A 355 107.149 -7.755 6.378 1.00 1.14 H new ATOM 0 HD12 LEU A 355 106.536 -9.141 5.445 1.00 1.14 H new ATOM 0 HD13 LEU A 355 107.756 -8.058 4.733 1.00 1.14 H new ATOM 0 HD21 LEU A 355 106.525 -5.428 5.718 1.00 1.15 H new ATOM 0 HD22 LEU A 355 107.137 -5.735 4.075 1.00 1.15 H new ATOM 0 HD23 LEU A 355 105.471 -5.155 4.310 1.00 1.15 H new ATOM 590 N ALA A 356 102.569 -8.662 3.740 1.00 0.52 N ATOM 591 CA ALA A 356 101.238 -8.788 4.405 1.00 0.54 C ATOM 592 C ALA A 356 100.782 -10.248 4.367 1.00 0.53 C ATOM 593 O ALA A 356 100.148 -10.744 5.283 1.00 0.57 O ATOM 594 CB ALA A 356 100.291 -7.907 3.589 1.00 0.61 C ATOM 0 H ALA A 356 102.583 -8.100 2.889 1.00 0.52 H new ATOM 0 HA ALA A 356 101.265 -8.482 5.451 1.00 0.54 H new ATOM 0 HB1 ALA A 356 99.291 -7.951 4.021 1.00 0.61 H new ATOM 0 HB2 ALA A 356 100.648 -6.877 3.604 1.00 0.61 H new ATOM 0 HB3 ALA A 356 100.258 -8.264 2.560 1.00 0.61 H new ATOM 600 N LYS A 357 101.058 -10.936 3.297 1.00 0.57 N ATOM 601 CA LYS A 357 100.584 -12.345 3.195 1.00 0.68 C ATOM 602 C LYS A 357 101.049 -13.161 4.405 1.00 0.79 C ATOM 603 O LYS A 357 100.267 -13.799 5.069 1.00 0.93 O ATOM 604 CB LYS A 357 101.211 -12.898 1.921 1.00 0.88 C ATOM 605 CG LYS A 357 100.829 -14.371 1.792 1.00 0.97 C ATOM 606 CD LYS A 357 99.411 -14.486 1.234 1.00 1.16 C ATOM 607 CE LYS A 357 99.074 -15.959 0.990 1.00 0.90 C ATOM 608 NZ LYS A 357 99.817 -16.322 -0.248 1.00 1.15 N ATOM 0 H LYS A 357 101.586 -10.590 2.495 1.00 0.57 H new ATOM 0 HA LYS A 357 99.496 -12.398 3.171 1.00 0.68 H new ATOM 0 HB2 LYS A 357 100.861 -12.339 1.053 1.00 0.88 H new ATOM 0 HB3 LYS A 357 102.295 -12.789 1.954 1.00 0.88 H new ATOM 0 HG2 LYS A 357 101.532 -14.883 1.135 1.00 0.97 H new ATOM 0 HG3 LYS A 357 100.889 -14.859 2.765 1.00 0.97 H new ATOM 0 HD2 LYS A 357 98.698 -14.050 1.933 1.00 1.16 H new ATOM 0 HD3 LYS A 357 99.329 -13.925 0.303 1.00 1.16 H new ATOM 0 HE2 LYS A 357 99.382 -16.579 1.832 1.00 0.90 H new ATOM 0 HE3 LYS A 357 98.001 -16.103 0.863 1.00 0.90 H new ATOM 0 HZ1 LYS A 357 99.161 -16.743 -0.936 1.00 1.15 H new ATOM 0 HZ2 LYS A 357 100.247 -15.468 -0.658 1.00 1.15 H new ATOM 0 HZ3 LYS A 357 100.563 -17.009 -0.016 1.00 1.15 H new ATOM 622 N GLN A 358 102.319 -13.184 4.678 1.00 0.80 N ATOM 623 CA GLN A 358 102.803 -14.004 5.824 1.00 1.01 C ATOM 624 C GLN A 358 102.294 -13.415 7.145 1.00 1.05 C ATOM 625 O GLN A 358 101.908 -14.133 8.046 1.00 1.25 O ATOM 626 CB GLN A 358 104.330 -13.943 5.741 1.00 1.03 C ATOM 627 CG GLN A 358 104.799 -12.496 5.877 1.00 0.99 C ATOM 628 CD GLN A 358 106.284 -12.406 5.524 1.00 1.21 C ATOM 629 OE1 GLN A 358 106.645 -12.397 4.364 1.00 1.62 O ATOM 630 NE2 GLN A 358 107.168 -12.337 6.480 1.00 1.90 N ATOM 0 H GLN A 358 103.040 -12.677 4.165 1.00 0.80 H new ATOM 0 HA GLN A 358 102.443 -15.032 5.784 1.00 1.01 H new ATOM 0 HB2 GLN A 358 104.771 -14.553 6.529 1.00 1.03 H new ATOM 0 HB3 GLN A 358 104.668 -14.357 4.791 1.00 1.03 H new ATOM 0 HG2 GLN A 358 104.218 -11.851 5.218 1.00 0.99 H new ATOM 0 HG3 GLN A 358 104.634 -12.143 6.895 1.00 0.99 H new ATOM 0 HE21 GLN A 358 106.867 -12.344 7.455 1.00 1.90 H new ATOM 0 HE22 GLN A 358 108.161 -12.276 6.253 1.00 1.90 H new ATOM 639 N ARG A 359 102.319 -12.116 7.277 1.00 0.93 N ATOM 640 CA ARG A 359 101.868 -11.482 8.551 1.00 1.10 C ATOM 641 C ARG A 359 100.347 -11.584 8.734 1.00 1.09 C ATOM 642 O ARG A 359 99.862 -11.739 9.837 1.00 1.55 O ATOM 643 CB ARG A 359 102.295 -10.021 8.424 1.00 1.08 C ATOM 644 CG ARG A 359 103.821 -9.937 8.502 1.00 1.26 C ATOM 645 CD ARG A 359 104.266 -8.489 8.308 1.00 1.27 C ATOM 646 NE ARG A 359 105.749 -8.522 8.431 1.00 1.47 N ATOM 647 CZ ARG A 359 106.310 -8.662 9.603 1.00 1.98 C ATOM 648 NH1 ARG A 359 105.572 -8.774 10.676 1.00 2.63 N ATOM 649 NH2 ARG A 359 107.611 -8.691 9.702 1.00 2.38 N ATOM 0 H ARG A 359 102.633 -11.465 6.557 1.00 0.93 H new ATOM 0 HA ARG A 359 102.303 -11.977 9.420 1.00 1.10 H new ATOM 0 HB2 ARG A 359 101.943 -9.607 7.479 1.00 1.08 H new ATOM 0 HB3 ARG A 359 101.845 -9.427 9.219 1.00 1.08 H new ATOM 0 HG2 ARG A 359 104.167 -10.308 9.467 1.00 1.26 H new ATOM 0 HG3 ARG A 359 104.270 -10.571 7.737 1.00 1.26 H new ATOM 0 HD2 ARG A 359 103.959 -8.109 7.334 1.00 1.27 H new ATOM 0 HD3 ARG A 359 103.822 -7.836 9.059 1.00 1.27 H new ATOM 0 HE ARG A 359 106.330 -8.435 7.597 1.00 1.47 H new ATOM 0 HH11 ARG A 359 104.555 -8.752 10.600 1.00 2.63 H new ATOM 0 HH12 ARG A 359 106.013 -8.883 11.589 1.00 2.63 H new ATOM 0 HH21 ARG A 359 108.188 -8.604 8.865 1.00 2.38 H new ATOM 0 HH22 ARG A 359 108.051 -8.800 10.616 1.00 2.38 H new ATOM 663 N PHE A 360 99.582 -11.426 7.685 1.00 0.70 N ATOM 664 CA PHE A 360 98.096 -11.438 7.851 1.00 0.74 C ATOM 665 C PHE A 360 97.488 -12.624 7.111 1.00 0.74 C ATOM 666 O PHE A 360 96.340 -12.972 7.304 1.00 1.09 O ATOM 667 CB PHE A 360 97.612 -10.117 7.258 1.00 0.85 C ATOM 668 CG PHE A 360 97.893 -9.005 8.239 1.00 1.28 C ATOM 669 CD1 PHE A 360 96.960 -8.709 9.243 1.00 1.78 C ATOM 670 CD2 PHE A 360 99.086 -8.275 8.153 1.00 2.03 C ATOM 671 CE1 PHE A 360 97.222 -7.682 10.162 1.00 2.74 C ATOM 672 CE2 PHE A 360 99.347 -7.248 9.070 1.00 3.03 C ATOM 673 CZ PHE A 360 98.415 -6.951 10.076 1.00 3.32 C ATOM 0 H PHE A 360 99.916 -11.291 6.731 1.00 0.70 H new ATOM 0 HA PHE A 360 97.801 -11.539 8.896 1.00 0.74 H new ATOM 0 HB2 PHE A 360 98.118 -9.921 6.312 1.00 0.85 H new ATOM 0 HB3 PHE A 360 96.545 -10.169 7.044 1.00 0.85 H new ATOM 0 HD1 PHE A 360 96.040 -9.271 9.309 1.00 1.78 H new ATOM 0 HD2 PHE A 360 99.804 -8.504 7.380 1.00 2.03 H new ATOM 0 HE1 PHE A 360 96.504 -7.454 10.936 1.00 2.74 H new ATOM 0 HE2 PHE A 360 100.266 -6.685 9.002 1.00 3.03 H new ATOM 0 HZ PHE A 360 98.617 -6.160 10.783 1.00 3.32 H new ATOM 683 N ASN A 361 98.246 -13.236 6.254 1.00 0.72 N ATOM 684 CA ASN A 361 97.709 -14.388 5.478 1.00 0.77 C ATOM 685 C ASN A 361 96.516 -13.948 4.641 1.00 0.91 C ATOM 686 O ASN A 361 95.461 -14.550 4.661 1.00 1.34 O ATOM 687 CB ASN A 361 97.288 -15.401 6.540 1.00 0.79 C ATOM 688 CG ASN A 361 97.206 -16.795 5.917 1.00 1.27 C ATOM 689 OD1 ASN A 361 97.775 -17.040 4.872 1.00 1.68 O ATOM 690 ND2 ASN A 361 96.515 -17.726 6.517 1.00 1.90 N ATOM 0 H ASN A 361 99.216 -12.991 6.054 1.00 0.72 H new ATOM 0 HA ASN A 361 98.438 -14.804 4.783 1.00 0.77 H new ATOM 0 HB2 ASN A 361 98.005 -15.401 7.361 1.00 0.79 H new ATOM 0 HB3 ASN A 361 96.322 -15.122 6.960 1.00 0.79 H new ATOM 0 HD21 ASN A 361 96.453 -18.659 6.108 1.00 1.90 H new ATOM 0 HD22 ASN A 361 96.037 -17.521 7.394 1.00 1.90 H new ATOM 697 N LEU A 362 96.688 -12.888 3.911 1.00 0.88 N ATOM 698 CA LEU A 362 95.585 -12.367 3.064 1.00 1.13 C ATOM 699 C LEU A 362 95.885 -12.665 1.589 1.00 1.12 C ATOM 700 O LEU A 362 96.946 -13.156 1.260 1.00 1.73 O ATOM 701 CB LEU A 362 95.584 -10.864 3.327 1.00 1.68 C ATOM 702 CG LEU A 362 95.644 -10.626 4.837 1.00 2.21 C ATOM 703 CD1 LEU A 362 95.797 -9.129 5.115 1.00 2.65 C ATOM 704 CD2 LEU A 362 94.349 -11.133 5.476 1.00 2.80 C ATOM 0 H LEU A 362 97.555 -12.353 3.864 1.00 0.88 H new ATOM 0 HA LEU A 362 94.620 -12.820 3.289 1.00 1.13 H new ATOM 0 HB2 LEU A 362 96.437 -10.395 2.837 1.00 1.68 H new ATOM 0 HB3 LEU A 362 94.686 -10.409 2.909 1.00 1.68 H new ATOM 0 HG LEU A 362 96.496 -11.159 5.258 1.00 2.21 H new ATOM 0 HD11 LEU A 362 95.840 -8.961 6.191 1.00 2.65 H new ATOM 0 HD12 LEU A 362 96.716 -8.765 4.654 1.00 2.65 H new ATOM 0 HD13 LEU A 362 94.945 -8.592 4.698 1.00 2.65 H new ATOM 0 HD21 LEU A 362 94.385 -10.966 6.553 1.00 2.80 H new ATOM 0 HD22 LEU A 362 93.500 -10.595 5.054 1.00 2.80 H new ATOM 0 HD23 LEU A 362 94.238 -12.199 5.277 1.00 2.80 H new ATOM 716 N ARG A 363 94.961 -12.413 0.701 1.00 1.10 N ATOM 717 CA ARG A 363 95.218 -12.732 -0.731 1.00 1.09 C ATOM 718 C ARG A 363 95.156 -11.459 -1.577 1.00 0.86 C ATOM 719 O ARG A 363 94.390 -10.557 -1.303 1.00 1.03 O ATOM 720 CB ARG A 363 94.094 -13.689 -1.126 1.00 1.21 C ATOM 721 CG ARG A 363 92.778 -12.916 -1.216 1.00 2.11 C ATOM 722 CD ARG A 363 91.617 -13.900 -1.370 1.00 2.74 C ATOM 723 NE ARG A 363 90.414 -13.045 -1.575 1.00 3.36 N ATOM 724 CZ ARG A 363 89.217 -13.556 -1.464 1.00 3.92 C ATOM 725 NH1 ARG A 363 89.065 -14.820 -1.171 1.00 4.21 N ATOM 726 NH2 ARG A 363 88.168 -12.801 -1.645 1.00 4.40 N ATOM 0 H ARG A 363 94.049 -12.004 0.903 1.00 1.10 H new ATOM 0 HA ARG A 363 96.204 -13.169 -0.887 1.00 1.09 H new ATOM 0 HB2 ARG A 363 94.320 -14.157 -2.084 1.00 1.21 H new ATOM 0 HB3 ARG A 363 94.009 -14.490 -0.392 1.00 1.21 H new ATOM 0 HG2 ARG A 363 92.638 -12.310 -0.321 1.00 2.11 H new ATOM 0 HG3 ARG A 363 92.803 -12.232 -2.064 1.00 2.11 H new ATOM 0 HD2 ARG A 363 91.775 -14.568 -2.216 1.00 2.74 H new ATOM 0 HD3 ARG A 363 91.510 -14.527 -0.485 1.00 2.74 H new ATOM 0 HE ARG A 363 90.526 -12.057 -1.803 1.00 3.36 H new ATOM 0 HH11 ARG A 363 89.883 -15.412 -1.028 1.00 4.21 H new ATOM 0 HH12 ARG A 363 88.128 -15.215 -1.085 1.00 4.21 H new ATOM 0 HH21 ARG A 363 88.284 -11.813 -1.873 1.00 4.40 H new ATOM 0 HH22 ARG A 363 87.233 -13.198 -1.559 1.00 4.40 H new ATOM 740 N GLU A 364 95.893 -11.418 -2.652 1.00 0.74 N ATOM 741 CA GLU A 364 95.804 -10.248 -3.568 1.00 0.86 C ATOM 742 C GLU A 364 94.360 -10.076 -4.037 1.00 1.02 C ATOM 743 O GLU A 364 93.622 -11.034 -4.155 1.00 0.95 O ATOM 744 CB GLU A 364 96.717 -10.595 -4.745 1.00 0.96 C ATOM 745 CG GLU A 364 98.152 -10.773 -4.246 1.00 1.26 C ATOM 746 CD GLU A 364 99.077 -11.043 -5.432 1.00 1.69 C ATOM 747 OE1 GLU A 364 98.566 -11.242 -6.523 1.00 2.21 O ATOM 748 OE2 GLU A 364 100.280 -11.047 -5.232 1.00 2.24 O ATOM 0 H GLU A 364 96.552 -12.143 -2.935 1.00 0.74 H new ATOM 0 HA GLU A 364 96.103 -9.315 -3.090 1.00 0.86 H new ATOM 0 HB2 GLU A 364 96.373 -11.510 -5.228 1.00 0.96 H new ATOM 0 HB3 GLU A 364 96.677 -9.805 -5.495 1.00 0.96 H new ATOM 0 HG2 GLU A 364 98.477 -9.878 -3.715 1.00 1.26 H new ATOM 0 HG3 GLU A 364 98.202 -11.600 -3.538 1.00 1.26 H new ATOM 755 N ARG A 365 93.939 -8.869 -4.294 1.00 1.36 N ATOM 756 CA ARG A 365 92.531 -8.669 -4.738 1.00 1.73 C ATOM 757 C ARG A 365 92.469 -8.529 -6.257 1.00 1.59 C ATOM 758 O ARG A 365 93.240 -7.810 -6.859 1.00 1.56 O ATOM 759 CB ARG A 365 92.063 -7.385 -4.055 1.00 1.83 C ATOM 760 CG ARG A 365 93.046 -6.264 -4.363 1.00 2.15 C ATOM 761 CD ARG A 365 92.404 -4.913 -4.035 1.00 2.41 C ATOM 762 NE ARG A 365 92.300 -4.889 -2.549 1.00 3.18 N ATOM 763 CZ ARG A 365 91.456 -4.081 -1.962 1.00 3.60 C ATOM 764 NH1 ARG A 365 90.703 -3.285 -2.673 1.00 4.16 N ATOM 765 NH2 ARG A 365 91.367 -4.070 -0.660 1.00 3.72 N ATOM 0 H ARG A 365 94.501 -8.021 -4.217 1.00 1.36 H new ATOM 0 HA ARG A 365 91.897 -9.515 -4.473 1.00 1.73 H new ATOM 0 HB2 ARG A 365 91.066 -7.116 -4.404 1.00 1.83 H new ATOM 0 HB3 ARG A 365 91.993 -7.537 -2.978 1.00 1.83 H new ATOM 0 HG2 ARG A 365 93.958 -6.396 -3.780 1.00 2.15 H new ATOM 0 HG3 ARG A 365 93.332 -6.296 -5.414 1.00 2.15 H new ATOM 0 HD2 ARG A 365 93.013 -4.087 -4.402 1.00 2.41 H new ATOM 0 HD3 ARG A 365 91.423 -4.818 -4.501 1.00 2.41 H new ATOM 0 HE ARG A 365 92.889 -5.505 -1.988 1.00 3.18 H new ATOM 0 HH11 ARG A 365 90.772 -3.292 -3.691 1.00 4.16 H new ATOM 0 HH12 ARG A 365 90.046 -2.656 -2.211 1.00 4.16 H new ATOM 0 HH21 ARG A 365 91.955 -4.690 -0.103 1.00 3.72 H new ATOM 0 HH22 ARG A 365 90.710 -3.441 -0.199 1.00 3.72 H new ATOM 779 N ASP A 366 91.541 -9.199 -6.881 1.00 1.70 N ATOM 780 CA ASP A 366 91.413 -9.088 -8.359 1.00 1.93 C ATOM 781 C ASP A 366 90.831 -7.724 -8.722 1.00 2.04 C ATOM 782 O ASP A 366 89.702 -7.410 -8.400 1.00 2.65 O ATOM 783 CB ASP A 366 90.456 -10.210 -8.757 1.00 2.62 C ATOM 784 CG ASP A 366 91.147 -11.562 -8.566 1.00 2.50 C ATOM 785 OD1 ASP A 366 92.346 -11.565 -8.338 1.00 2.86 O ATOM 786 OD2 ASP A 366 90.466 -12.570 -8.651 1.00 2.50 O ATOM 0 H ASP A 366 90.867 -9.818 -6.431 1.00 1.70 H new ATOM 0 HA ASP A 366 92.370 -9.175 -8.873 1.00 1.93 H new ATOM 0 HB2 ASP A 366 89.551 -10.163 -8.151 1.00 2.62 H new ATOM 0 HB3 ASP A 366 90.150 -10.090 -9.796 1.00 2.62 H new ATOM 791 N VAL A 367 91.608 -6.897 -9.360 1.00 1.75 N ATOM 792 CA VAL A 367 91.121 -5.536 -9.711 1.00 2.31 C ATOM 793 C VAL A 367 90.052 -5.614 -10.808 1.00 2.53 C ATOM 794 O VAL A 367 89.059 -4.916 -10.767 1.00 3.04 O ATOM 795 CB VAL A 367 92.362 -4.800 -10.216 1.00 2.28 C ATOM 796 CG1 VAL A 367 91.947 -3.461 -10.822 1.00 2.89 C ATOM 797 CG2 VAL A 367 93.325 -4.555 -9.052 1.00 2.52 C ATOM 0 H VAL A 367 92.562 -7.105 -9.654 1.00 1.75 H new ATOM 0 HA VAL A 367 90.658 -5.029 -8.864 1.00 2.31 H new ATOM 0 HB VAL A 367 92.858 -5.406 -10.974 1.00 2.28 H new ATOM 0 HG11 VAL A 367 92.831 -2.935 -11.182 1.00 2.89 H new ATOM 0 HG12 VAL A 367 91.264 -3.634 -11.653 1.00 2.89 H new ATOM 0 HG13 VAL A 367 91.450 -2.857 -10.063 1.00 2.89 H new ATOM 0 HG21 VAL A 367 94.209 -4.030 -9.415 1.00 2.52 H new ATOM 0 HG22 VAL A 367 92.831 -3.950 -8.292 1.00 2.52 H new ATOM 0 HG23 VAL A 367 93.623 -5.510 -8.619 1.00 2.52 H new ATOM 807 N GLN A 368 90.279 -6.406 -11.820 1.00 2.20 N ATOM 808 CA GLN A 368 89.310 -6.464 -12.953 1.00 2.40 C ATOM 809 C GLN A 368 88.030 -7.199 -12.545 1.00 2.11 C ATOM 810 O GLN A 368 86.960 -6.910 -13.045 1.00 2.30 O ATOM 811 CB GLN A 368 90.026 -7.219 -14.069 1.00 2.46 C ATOM 812 CG GLN A 368 89.183 -7.141 -15.343 1.00 3.09 C ATOM 813 CD GLN A 368 89.937 -7.804 -16.498 1.00 3.29 C ATOM 814 OE1 GLN A 368 91.090 -8.161 -16.361 1.00 3.32 O ATOM 815 NE2 GLN A 368 89.329 -7.984 -17.639 1.00 3.69 N ATOM 0 H GLN A 368 91.092 -7.015 -11.912 1.00 2.20 H new ATOM 0 HA GLN A 368 89.008 -5.465 -13.267 1.00 2.40 H new ATOM 0 HB2 GLN A 368 91.012 -6.788 -14.243 1.00 2.46 H new ATOM 0 HB3 GLN A 368 90.179 -8.259 -13.782 1.00 2.46 H new ATOM 0 HG2 GLN A 368 88.225 -7.637 -15.188 1.00 3.09 H new ATOM 0 HG3 GLN A 368 88.968 -6.100 -15.586 1.00 3.09 H new ATOM 0 HE21 GLN A 368 88.361 -7.684 -17.754 1.00 3.69 H new ATOM 0 HE22 GLN A 368 89.822 -8.424 -18.416 1.00 3.69 H new ATOM 824 N SER A 369 88.093 -8.013 -11.528 1.00 1.80 N ATOM 825 CA SER A 369 86.833 -8.590 -10.976 1.00 1.87 C ATOM 826 C SER A 369 86.093 -7.510 -10.190 1.00 1.79 C ATOM 827 O SER A 369 84.878 -7.463 -10.171 1.00 2.27 O ATOM 828 CB SER A 369 87.269 -9.733 -10.061 1.00 2.47 C ATOM 829 OG SER A 369 87.876 -9.193 -8.895 1.00 3.05 O ATOM 0 H SER A 369 88.951 -8.302 -11.059 1.00 1.80 H new ATOM 0 HA SER A 369 86.159 -8.951 -11.753 1.00 1.87 H new ATOM 0 HB2 SER A 369 86.409 -10.344 -9.788 1.00 2.47 H new ATOM 0 HB3 SER A 369 87.970 -10.385 -10.582 1.00 2.47 H new ATOM 0 HG SER A 369 88.459 -8.446 -9.146 1.00 3.05 H new ATOM 835 N LEU A 370 86.815 -6.540 -9.709 1.00 1.38 N ATOM 836 CA LEU A 370 86.158 -5.343 -9.118 1.00 1.39 C ATOM 837 C LEU A 370 85.962 -4.278 -10.201 1.00 1.12 C ATOM 838 O LEU A 370 85.618 -3.149 -9.913 1.00 1.30 O ATOM 839 CB LEU A 370 87.138 -4.846 -8.058 1.00 1.54 C ATOM 840 CG LEU A 370 87.484 -5.990 -7.105 1.00 1.39 C ATOM 841 CD1 LEU A 370 88.614 -5.551 -6.173 1.00 1.80 C ATOM 842 CD2 LEU A 370 86.249 -6.348 -6.275 1.00 2.14 C ATOM 0 H LEU A 370 87.835 -6.524 -9.699 1.00 1.38 H new ATOM 0 HA LEU A 370 85.177 -5.565 -8.697 1.00 1.39 H new ATOM 0 HB2 LEU A 370 88.043 -4.468 -8.533 1.00 1.54 H new ATOM 0 HB3 LEU A 370 86.700 -4.017 -7.503 1.00 1.54 H new ATOM 0 HG LEU A 370 87.803 -6.860 -7.679 1.00 1.39 H new ATOM 0 HD11 LEU A 370 88.862 -6.366 -5.493 1.00 1.80 H new ATOM 0 HD12 LEU A 370 89.493 -5.291 -6.764 1.00 1.80 H new ATOM 0 HD13 LEU A 370 88.294 -4.682 -5.597 1.00 1.80 H new ATOM 0 HD21 LEU A 370 86.492 -7.164 -5.594 1.00 2.14 H new ATOM 0 HD22 LEU A 370 85.932 -5.478 -5.700 1.00 2.14 H new ATOM 0 HD23 LEU A 370 85.442 -6.658 -6.939 1.00 2.14 H new ATOM 854 N HIS A 371 86.328 -4.584 -11.420 1.00 1.29 N ATOM 855 CA HIS A 371 86.321 -3.532 -12.473 1.00 1.13 C ATOM 856 C HIS A 371 87.186 -2.364 -12.010 1.00 1.00 C ATOM 857 O HIS A 371 86.960 -1.222 -12.362 1.00 1.35 O ATOM 858 CB HIS A 371 84.867 -3.099 -12.592 1.00 1.54 C ATOM 859 CG HIS A 371 84.008 -4.294 -12.905 1.00 1.50 C ATOM 860 ND1 HIS A 371 83.383 -5.034 -11.914 1.00 1.97 N ATOM 861 CD2 HIS A 371 83.662 -4.890 -14.091 1.00 1.80 C ATOM 862 CE1 HIS A 371 82.699 -6.024 -12.517 1.00 2.10 C ATOM 863 NE2 HIS A 371 82.835 -5.982 -13.845 1.00 1.80 N ATOM 0 H HIS A 371 86.628 -5.509 -11.727 1.00 1.29 H new ATOM 0 HA HIS A 371 86.714 -3.883 -13.427 1.00 1.13 H new ATOM 0 HB2 HIS A 371 84.538 -2.636 -11.662 1.00 1.54 H new ATOM 0 HB3 HIS A 371 84.764 -2.349 -13.376 1.00 1.54 H new ATOM 0 HD2 HIS A 371 83.983 -4.561 -15.068 1.00 1.80 H new ATOM 0 HE1 HIS A 371 82.112 -6.762 -11.991 1.00 2.10 H new ATOM 0 HE2 HIS A 371 82.422 -6.614 -14.531 1.00 1.80 H new ATOM 871 N ALA A 372 88.176 -2.655 -11.224 1.00 0.75 N ATOM 872 CA ALA A 372 89.082 -1.587 -10.719 1.00 0.94 C ATOM 873 C ALA A 372 90.224 -1.345 -11.712 1.00 0.90 C ATOM 874 O ALA A 372 90.177 -1.765 -12.851 1.00 1.04 O ATOM 875 CB ALA A 372 89.626 -2.121 -9.393 1.00 1.12 C ATOM 0 H ALA A 372 88.402 -3.597 -10.904 1.00 0.75 H new ATOM 0 HA ALA A 372 88.566 -0.635 -10.593 1.00 0.94 H new ATOM 0 HB1 ALA A 372 90.305 -1.388 -8.957 1.00 1.12 H new ATOM 0 HB2 ALA A 372 88.799 -2.303 -8.707 1.00 1.12 H new ATOM 0 HB3 ALA A 372 90.163 -3.053 -9.569 1.00 1.12 H new ATOM 881 N THR A 373 91.231 -0.635 -11.290 1.00 0.85 N ATOM 882 CA THR A 373 92.371 -0.310 -12.193 1.00 0.95 C ATOM 883 C THR A 373 93.700 -0.470 -11.456 1.00 0.93 C ATOM 884 O THR A 373 93.844 -0.056 -10.327 1.00 0.95 O ATOM 885 CB THR A 373 92.166 1.154 -12.569 1.00 1.32 C ATOM 886 OG1 THR A 373 91.022 1.278 -13.402 1.00 2.11 O ATOM 887 CG2 THR A 373 93.403 1.678 -13.300 1.00 1.90 C ATOM 0 H THR A 373 91.315 -0.260 -10.345 1.00 0.85 H new ATOM 0 HA THR A 373 92.402 -0.967 -13.062 1.00 0.95 H new ATOM 0 HB THR A 373 92.013 1.741 -11.663 1.00 1.32 H new ATOM 0 HG1 THR A 373 90.892 2.220 -13.641 1.00 2.11 H new ATOM 0 HG21 THR A 373 93.252 2.724 -13.567 1.00 1.90 H new ATOM 0 HG22 THR A 373 94.274 1.591 -12.650 1.00 1.90 H new ATOM 0 HG23 THR A 373 93.566 1.093 -14.205 1.00 1.90 H new ATOM 895 N PHE A 374 94.707 -0.934 -12.132 1.00 1.01 N ATOM 896 CA PHE A 374 96.067 -0.960 -11.517 1.00 1.25 C ATOM 897 C PHE A 374 96.797 0.352 -11.837 1.00 1.63 C ATOM 898 O PHE A 374 96.799 0.804 -12.965 1.00 1.61 O ATOM 899 CB PHE A 374 96.791 -2.126 -12.199 1.00 1.33 C ATOM 900 CG PHE A 374 96.195 -3.449 -11.773 1.00 1.63 C ATOM 901 CD1 PHE A 374 96.514 -3.998 -10.521 1.00 1.41 C ATOM 902 CD2 PHE A 374 95.338 -4.139 -12.641 1.00 2.53 C ATOM 903 CE1 PHE A 374 95.973 -5.232 -10.138 1.00 1.89 C ATOM 904 CE2 PHE A 374 94.799 -5.375 -12.259 1.00 3.09 C ATOM 905 CZ PHE A 374 95.116 -5.921 -11.007 1.00 2.72 C ATOM 0 H PHE A 374 94.653 -1.297 -13.084 1.00 1.01 H new ATOM 0 HA PHE A 374 96.029 -1.073 -10.434 1.00 1.25 H new ATOM 0 HB2 PHE A 374 96.720 -2.021 -13.282 1.00 1.33 H new ATOM 0 HB3 PHE A 374 97.851 -2.101 -11.945 1.00 1.33 H new ATOM 0 HD1 PHE A 374 97.177 -3.469 -9.853 1.00 1.41 H new ATOM 0 HD2 PHE A 374 95.093 -3.718 -13.605 1.00 2.53 H new ATOM 0 HE1 PHE A 374 96.216 -5.652 -9.173 1.00 1.89 H new ATOM 0 HE2 PHE A 374 94.140 -5.907 -12.929 1.00 3.09 H new ATOM 0 HZ PHE A 374 94.700 -6.873 -10.712 1.00 2.72 H new ATOM 915 N VAL A 375 97.502 0.910 -10.893 1.00 2.14 N ATOM 916 CA VAL A 375 98.321 2.122 -11.196 1.00 2.61 C ATOM 917 C VAL A 375 99.796 1.729 -11.325 1.00 2.22 C ATOM 918 O VAL A 375 100.401 1.288 -10.367 1.00 1.65 O ATOM 919 CB VAL A 375 98.123 3.054 -10.001 1.00 3.32 C ATOM 920 CG1 VAL A 375 98.760 4.412 -10.303 1.00 4.00 C ATOM 921 CG2 VAL A 375 96.626 3.241 -9.739 1.00 3.65 C ATOM 0 H VAL A 375 97.548 0.583 -9.928 1.00 2.14 H new ATOM 0 HA VAL A 375 98.025 2.598 -12.131 1.00 2.61 H new ATOM 0 HB VAL A 375 98.594 2.618 -9.120 1.00 3.32 H new ATOM 0 HG11 VAL A 375 98.619 5.077 -9.451 1.00 4.00 H new ATOM 0 HG12 VAL A 375 99.826 4.281 -10.489 1.00 4.00 H new ATOM 0 HG13 VAL A 375 98.289 4.847 -11.185 1.00 4.00 H new ATOM 0 HG21 VAL A 375 96.486 3.906 -8.887 1.00 3.65 H new ATOM 0 HG22 VAL A 375 96.154 3.676 -10.620 1.00 3.65 H new ATOM 0 HG23 VAL A 375 96.171 2.274 -9.524 1.00 3.65 H new ATOM 931 N PRO A 376 100.296 1.820 -12.528 1.00 2.87 N ATOM 932 CA PRO A 376 101.680 1.371 -12.820 1.00 2.67 C ATOM 933 C PRO A 376 102.689 2.052 -11.890 1.00 2.48 C ATOM 934 O PRO A 376 102.493 3.165 -11.445 1.00 3.24 O ATOM 935 CB PRO A 376 101.917 1.788 -14.275 1.00 3.84 C ATOM 936 CG PRO A 376 100.767 2.675 -14.644 1.00 4.63 C ATOM 937 CD PRO A 376 99.630 2.345 -13.719 1.00 4.03 C ATOM 0 HA PRO A 376 101.805 0.299 -12.667 1.00 2.67 H new ATOM 0 HB2 PRO A 376 102.865 2.315 -14.380 1.00 3.84 H new ATOM 0 HB3 PRO A 376 101.963 0.916 -14.928 1.00 3.84 H new ATOM 0 HG2 PRO A 376 101.046 3.724 -14.550 1.00 4.63 H new ATOM 0 HG3 PRO A 376 100.476 2.514 -15.682 1.00 4.63 H new ATOM 0 HD2 PRO A 376 99.032 3.227 -13.488 1.00 4.03 H new ATOM 0 HD3 PRO A 376 98.956 1.609 -14.159 1.00 4.03 H new ATOM 945 N PHE A 377 103.786 1.394 -11.623 1.00 2.13 N ATOM 946 CA PHE A 377 104.842 1.994 -10.757 1.00 3.07 C ATOM 947 C PHE A 377 105.916 2.651 -11.626 1.00 3.61 C ATOM 948 O PHE A 377 106.570 2.002 -12.419 1.00 4.10 O ATOM 949 CB PHE A 377 105.421 0.799 -9.989 1.00 3.15 C ATOM 950 CG PHE A 377 106.557 1.238 -9.086 1.00 3.91 C ATOM 951 CD1 PHE A 377 106.808 2.601 -8.863 1.00 4.01 C ATOM 952 CD2 PHE A 377 107.368 0.271 -8.474 1.00 4.73 C ATOM 953 CE1 PHE A 377 107.867 2.993 -8.032 1.00 4.92 C ATOM 954 CE2 PHE A 377 108.427 0.664 -7.643 1.00 5.70 C ATOM 955 CZ PHE A 377 108.676 2.025 -7.422 1.00 5.79 C ATOM 0 H PHE A 377 103.997 0.459 -11.971 1.00 2.13 H new ATOM 0 HA PHE A 377 104.460 2.767 -10.091 1.00 3.07 H new ATOM 0 HB2 PHE A 377 104.638 0.330 -9.394 1.00 3.15 H new ATOM 0 HB3 PHE A 377 105.780 0.048 -10.693 1.00 3.15 H new ATOM 0 HD1 PHE A 377 106.185 3.348 -9.332 1.00 4.01 H new ATOM 0 HD2 PHE A 377 107.176 -0.778 -8.643 1.00 4.73 H new ATOM 0 HE1 PHE A 377 108.059 4.042 -7.862 1.00 4.92 H new ATOM 0 HE2 PHE A 377 109.051 -0.082 -7.173 1.00 5.70 H new ATOM 0 HZ PHE A 377 109.491 2.328 -6.782 1.00 5.79 H new ATOM 965 N THR A 378 106.145 3.921 -11.439 1.00 3.85 N ATOM 966 CA THR A 378 107.228 4.602 -12.205 1.00 4.47 C ATOM 967 C THR A 378 108.383 4.952 -11.266 1.00 4.28 C ATOM 968 O THR A 378 108.177 5.338 -10.133 1.00 3.71 O ATOM 969 CB THR A 378 106.584 5.873 -12.761 1.00 4.59 C ATOM 970 OG1 THR A 378 106.294 6.762 -11.691 1.00 4.26 O ATOM 971 CG2 THR A 378 105.290 5.514 -13.494 1.00 5.29 C ATOM 0 H THR A 378 105.631 4.517 -10.790 1.00 3.85 H new ATOM 0 HA THR A 378 107.635 3.976 -12.999 1.00 4.47 H new ATOM 0 HB THR A 378 107.271 6.354 -13.457 1.00 4.59 H new ATOM 0 HG1 THR A 378 105.883 7.578 -12.046 1.00 4.26 H new ATOM 0 HG21 THR A 378 104.832 6.421 -13.890 1.00 5.29 H new ATOM 0 HG22 THR A 378 105.514 4.833 -14.315 1.00 5.29 H new ATOM 0 HG23 THR A 378 104.601 5.032 -12.801 1.00 5.29 H new ATOM 979 N ALA A 379 109.596 4.782 -11.721 1.00 5.01 N ATOM 980 CA ALA A 379 110.769 5.066 -10.847 1.00 5.10 C ATOM 981 C ALA A 379 110.984 6.575 -10.711 1.00 5.05 C ATOM 982 O ALA A 379 111.501 7.049 -9.720 1.00 5.37 O ATOM 983 CB ALA A 379 111.957 4.419 -11.561 1.00 6.13 C ATOM 0 H ALA A 379 109.824 4.458 -12.661 1.00 5.01 H new ATOM 0 HA ALA A 379 110.633 4.676 -9.838 1.00 5.10 H new ATOM 0 HB1 ALA A 379 112.864 4.583 -10.980 1.00 6.13 H new ATOM 0 HB2 ALA A 379 111.781 3.348 -11.664 1.00 6.13 H new ATOM 0 HB3 ALA A 379 112.074 4.864 -12.549 1.00 6.13 H new ATOM 989 N GLN A 380 110.645 7.328 -11.724 1.00 4.87 N ATOM 990 CA GLN A 380 110.898 8.797 -11.668 1.00 4.93 C ATOM 991 C GLN A 380 110.178 9.407 -10.463 1.00 4.05 C ATOM 992 O GLN A 380 110.760 10.137 -9.687 1.00 3.84 O ATOM 993 CB GLN A 380 110.323 9.348 -12.973 1.00 5.65 C ATOM 994 CG GLN A 380 111.095 8.766 -14.158 1.00 6.07 C ATOM 995 CD GLN A 380 110.592 9.399 -15.457 1.00 7.03 C ATOM 996 OE1 GLN A 380 110.950 10.514 -15.781 1.00 7.74 O ATOM 997 NE2 GLN A 380 109.770 8.730 -16.219 1.00 7.22 N ATOM 0 H GLN A 380 110.207 6.992 -12.582 1.00 4.87 H new ATOM 0 HA GLN A 380 111.957 9.032 -11.560 1.00 4.93 H new ATOM 0 HB2 GLN A 380 109.266 9.093 -13.053 1.00 5.65 H new ATOM 0 HB3 GLN A 380 110.390 10.436 -12.981 1.00 5.65 H new ATOM 0 HG2 GLN A 380 112.162 8.955 -14.038 1.00 6.07 H new ATOM 0 HG3 GLN A 380 110.965 7.684 -14.194 1.00 6.07 H new ATOM 0 HE21 GLN A 380 109.470 7.794 -15.947 1.00 7.22 H new ATOM 0 HE22 GLN A 380 109.428 9.143 -17.087 1.00 7.22 H new ATOM 1006 N SER A 381 108.950 9.028 -10.244 1.00 3.64 N ATOM 1007 CA SER A 381 108.235 9.492 -9.022 1.00 3.06 C ATOM 1008 C SER A 381 108.438 8.486 -7.888 1.00 2.42 C ATOM 1009 O SER A 381 108.214 8.786 -6.734 1.00 3.00 O ATOM 1010 CB SER A 381 106.763 9.559 -9.424 1.00 3.49 C ATOM 1011 OG SER A 381 106.259 8.239 -9.580 1.00 3.82 O ATOM 0 H SER A 381 108.411 8.417 -10.858 1.00 3.64 H new ATOM 0 HA SER A 381 108.601 10.455 -8.666 1.00 3.06 H new ATOM 0 HB2 SER A 381 106.191 10.092 -8.665 1.00 3.49 H new ATOM 0 HB3 SER A 381 106.653 10.115 -10.355 1.00 3.49 H new ATOM 0 HG SER A 381 106.643 7.835 -10.386 1.00 3.82 H new ATOM 1017 N ARG A 382 108.809 7.278 -8.221 1.00 1.65 N ATOM 1018 CA ARG A 382 108.965 6.223 -7.177 1.00 1.74 C ATOM 1019 C ARG A 382 107.606 5.918 -6.544 1.00 1.57 C ATOM 1020 O ARG A 382 107.435 6.026 -5.346 1.00 2.08 O ATOM 1021 CB ARG A 382 109.914 6.820 -6.134 1.00 2.53 C ATOM 1022 CG ARG A 382 111.082 7.509 -6.839 1.00 2.69 C ATOM 1023 CD ARG A 382 112.132 7.921 -5.805 1.00 2.89 C ATOM 1024 NE ARG A 382 113.114 8.747 -6.562 1.00 3.36 N ATOM 1025 CZ ARG A 382 113.949 8.179 -7.392 1.00 3.67 C ATOM 1026 NH1 ARG A 382 113.932 6.885 -7.562 1.00 3.72 N ATOM 1027 NH2 ARG A 382 114.805 8.911 -8.053 1.00 4.25 N ATOM 0 H ARG A 382 109.011 6.976 -9.174 1.00 1.65 H new ATOM 0 HA ARG A 382 109.353 5.291 -7.588 1.00 1.74 H new ATOM 0 HB2 ARG A 382 109.380 7.536 -5.509 1.00 2.53 H new ATOM 0 HB3 ARG A 382 110.286 6.036 -5.474 1.00 2.53 H new ATOM 0 HG2 ARG A 382 111.524 6.837 -7.574 1.00 2.69 H new ATOM 0 HG3 ARG A 382 110.727 8.385 -7.381 1.00 2.69 H new ATOM 0 HD2 ARG A 382 111.683 8.489 -4.991 1.00 2.89 H new ATOM 0 HD3 ARG A 382 112.610 7.049 -5.359 1.00 2.89 H new ATOM 0 HE ARG A 382 113.135 9.759 -6.432 1.00 3.36 H new ATOM 0 HH11 ARG A 382 113.265 6.312 -7.046 1.00 3.72 H new ATOM 0 HH12 ARG A 382 114.586 6.447 -8.211 1.00 3.72 H new ATOM 0 HH21 ARG A 382 114.820 9.922 -7.921 1.00 4.25 H new ATOM 0 HH22 ARG A 382 115.458 8.471 -8.702 1.00 4.25 H new ATOM 1041 N MET A 383 106.616 5.614 -7.342 1.00 1.27 N ATOM 1042 CA MET A 383 105.257 5.396 -6.769 1.00 1.19 C ATOM 1043 C MET A 383 104.468 4.372 -7.585 1.00 1.07 C ATOM 1044 O MET A 383 104.454 4.402 -8.801 1.00 1.14 O ATOM 1045 CB MET A 383 104.575 6.763 -6.837 1.00 1.32 C ATOM 1046 CG MET A 383 105.363 7.779 -6.008 1.00 1.51 C ATOM 1047 SD MET A 383 104.472 9.354 -5.977 1.00 2.09 S ATOM 1048 CE MET A 383 103.142 8.839 -4.863 1.00 1.57 C ATOM 0 H MET A 383 106.688 5.508 -8.354 1.00 1.27 H new ATOM 0 HA MET A 383 105.310 5.005 -5.753 1.00 1.19 H new ATOM 0 HB2 MET A 383 104.512 7.096 -7.873 1.00 1.32 H new ATOM 0 HB3 MET A 383 103.554 6.689 -6.463 1.00 1.32 H new ATOM 0 HG2 MET A 383 105.501 7.407 -4.993 1.00 1.51 H new ATOM 0 HG3 MET A 383 106.357 7.919 -6.434 1.00 1.51 H new ATOM 0 HE1 MET A 383 102.184 8.927 -5.375 1.00 1.57 H new ATOM 0 HE2 MET A 383 103.299 7.803 -4.563 1.00 1.57 H new ATOM 0 HE3 MET A 383 103.141 9.476 -3.979 1.00 1.57 H new ATOM 1058 N SER A 384 103.673 3.599 -6.907 1.00 0.97 N ATOM 1059 CA SER A 384 102.701 2.705 -7.588 1.00 1.02 C ATOM 1060 C SER A 384 101.430 2.652 -6.740 1.00 0.93 C ATOM 1061 O SER A 384 101.413 3.134 -5.627 1.00 0.83 O ATOM 1062 CB SER A 384 103.381 1.338 -7.632 1.00 1.23 C ATOM 1063 OG SER A 384 103.315 0.741 -6.343 1.00 1.18 O ATOM 0 H SER A 384 103.655 3.548 -5.888 1.00 0.97 H new ATOM 0 HA SER A 384 102.428 3.039 -8.589 1.00 1.02 H new ATOM 0 HB2 SER A 384 102.892 0.699 -8.367 1.00 1.23 H new ATOM 0 HB3 SER A 384 104.420 1.445 -7.943 1.00 1.23 H new ATOM 0 HG SER A 384 104.187 0.357 -6.115 1.00 1.18 H new ATOM 1069 N GLY A 385 100.353 2.141 -7.257 1.00 1.02 N ATOM 1070 CA GLY A 385 99.095 2.153 -6.458 1.00 1.00 C ATOM 1071 C GLY A 385 97.983 1.448 -7.216 1.00 0.95 C ATOM 1072 O GLY A 385 98.214 0.675 -8.122 1.00 1.13 O ATOM 0 H GLY A 385 100.285 1.721 -8.184 1.00 1.02 H new ATOM 0 HA2 GLY A 385 99.260 1.661 -5.500 1.00 1.00 H new ATOM 0 HA3 GLY A 385 98.803 3.181 -6.242 1.00 1.00 H new ATOM 1076 N ILE A 386 96.777 1.685 -6.812 1.00 0.80 N ATOM 1077 CA ILE A 386 95.621 1.012 -7.450 1.00 0.78 C ATOM 1078 C ILE A 386 94.397 1.911 -7.338 1.00 0.77 C ATOM 1079 O ILE A 386 94.240 2.642 -6.384 1.00 0.80 O ATOM 1080 CB ILE A 386 95.437 -0.256 -6.630 1.00 0.81 C ATOM 1081 CG1 ILE A 386 94.266 -1.077 -7.151 1.00 0.86 C ATOM 1082 CG2 ILE A 386 95.154 0.121 -5.184 1.00 0.84 C ATOM 1083 CD1 ILE A 386 94.186 -2.351 -6.315 1.00 1.26 C ATOM 0 H ILE A 386 96.537 2.326 -6.056 1.00 0.80 H new ATOM 0 HA ILE A 386 95.768 0.798 -8.509 1.00 0.78 H new ATOM 0 HB ILE A 386 96.349 -0.848 -6.706 1.00 0.81 H new ATOM 0 HG12 ILE A 386 93.338 -0.511 -7.075 1.00 0.86 H new ATOM 0 HG13 ILE A 386 94.407 -1.319 -8.204 1.00 0.86 H new ATOM 0 HG21 ILE A 386 95.021 -0.784 -4.591 1.00 0.84 H new ATOM 0 HG22 ILE A 386 95.991 0.695 -4.787 1.00 0.84 H new ATOM 0 HG23 ILE A 386 94.246 0.723 -5.136 1.00 0.84 H new ATOM 0 HD11 ILE A 386 93.355 -2.963 -6.664 1.00 1.26 H new ATOM 0 HD12 ILE A 386 95.116 -2.911 -6.415 1.00 1.26 H new ATOM 0 HD13 ILE A 386 94.030 -2.090 -5.268 1.00 1.26 H new ATOM 1095 N ASN A 387 93.472 1.771 -8.225 1.00 0.78 N ATOM 1096 CA ASN A 387 92.195 2.511 -8.075 1.00 0.83 C ATOM 1097 C ASN A 387 91.046 1.514 -8.168 1.00 0.92 C ATOM 1098 O ASN A 387 91.059 0.635 -8.996 1.00 0.86 O ATOM 1099 CB ASN A 387 92.144 3.487 -9.253 1.00 0.91 C ATOM 1100 CG ASN A 387 93.513 4.140 -9.442 1.00 1.31 C ATOM 1101 OD1 ASN A 387 93.924 4.407 -10.554 1.00 2.04 O ATOM 1102 ND2 ASN A 387 94.240 4.408 -8.397 1.00 1.81 N ATOM 0 H ASN A 387 93.539 1.177 -9.051 1.00 0.78 H new ATOM 0 HA ASN A 387 92.120 3.037 -7.123 1.00 0.83 H new ATOM 0 HB2 ASN A 387 91.853 2.960 -10.162 1.00 0.91 H new ATOM 0 HB3 ASN A 387 91.388 4.251 -9.072 1.00 0.91 H new ATOM 0 HD21 ASN A 387 95.156 4.843 -8.511 1.00 1.81 H new ATOM 0 HD22 ASN A 387 93.894 4.184 -7.464 1.00 1.81 H new ATOM 1109 N ILE A 388 90.027 1.662 -7.383 1.00 1.18 N ATOM 1110 CA ILE A 388 88.875 0.731 -7.524 1.00 1.31 C ATOM 1111 C ILE A 388 87.568 1.462 -7.245 1.00 1.70 C ATOM 1112 O ILE A 388 87.560 2.602 -6.828 1.00 1.89 O ATOM 1113 CB ILE A 388 89.120 -0.366 -6.496 1.00 1.24 C ATOM 1114 CG1 ILE A 388 87.967 -1.369 -6.535 1.00 1.66 C ATOM 1115 CG2 ILE A 388 89.202 0.259 -5.110 1.00 1.50 C ATOM 1116 CD1 ILE A 388 88.417 -2.682 -5.898 1.00 2.11 C ATOM 0 H ILE A 388 89.936 2.374 -6.659 1.00 1.18 H new ATOM 0 HA ILE A 388 88.793 0.323 -8.532 1.00 1.31 H new ATOM 0 HB ILE A 388 90.054 -0.880 -6.724 1.00 1.24 H new ATOM 0 HG12 ILE A 388 87.105 -0.970 -6.001 1.00 1.66 H new ATOM 0 HG13 ILE A 388 87.654 -1.540 -7.565 1.00 1.66 H new ATOM 0 HG21 ILE A 388 89.377 -0.521 -4.369 1.00 1.50 H new ATOM 0 HG22 ILE A 388 90.022 0.977 -5.082 1.00 1.50 H new ATOM 0 HG23 ILE A 388 88.265 0.769 -4.885 1.00 1.50 H new ATOM 0 HD11 ILE A 388 87.597 -3.399 -5.924 1.00 2.11 H new ATOM 0 HD12 ILE A 388 89.267 -3.082 -6.451 1.00 2.11 H new ATOM 0 HD13 ILE A 388 88.709 -2.503 -4.863 1.00 2.11 H new ATOM 1128 N ASP A 389 86.470 0.865 -7.613 1.00 1.97 N ATOM 1129 CA ASP A 389 85.162 1.579 -7.547 1.00 2.37 C ATOM 1130 C ASP A 389 84.739 1.955 -6.111 1.00 2.14 C ATOM 1131 O ASP A 389 83.671 2.499 -5.913 1.00 2.92 O ATOM 1132 CB ASP A 389 84.176 0.569 -8.124 1.00 2.65 C ATOM 1133 CG ASP A 389 84.398 0.441 -9.633 1.00 3.31 C ATOM 1134 OD1 ASP A 389 85.148 1.238 -10.171 1.00 3.63 O ATOM 1135 OD2 ASP A 389 83.813 -0.452 -10.223 1.00 3.85 O ATOM 0 H ASP A 389 86.421 -0.093 -7.959 1.00 1.97 H new ATOM 0 HA ASP A 389 85.208 2.527 -8.083 1.00 2.37 H new ATOM 0 HB2 ASP A 389 84.309 -0.400 -7.643 1.00 2.65 H new ATOM 0 HB3 ASP A 389 83.153 0.888 -7.922 1.00 2.65 H new ATOM 1140 N ASN A 390 85.579 1.779 -5.125 1.00 1.20 N ATOM 1141 CA ASN A 390 85.210 2.254 -3.758 1.00 1.12 C ATOM 1142 C ASN A 390 86.444 2.750 -2.985 1.00 0.97 C ATOM 1143 O ASN A 390 86.366 3.018 -1.803 1.00 1.15 O ATOM 1144 CB ASN A 390 84.606 1.030 -3.069 1.00 1.13 C ATOM 1145 CG ASN A 390 83.843 1.472 -1.819 1.00 1.53 C ATOM 1146 OD1 ASN A 390 82.904 2.239 -1.906 1.00 2.33 O ATOM 1147 ND2 ASN A 390 84.208 1.018 -0.652 1.00 1.89 N ATOM 0 H ASN A 390 86.493 1.333 -5.204 1.00 1.20 H new ATOM 0 HA ASN A 390 84.518 3.096 -3.798 1.00 1.12 H new ATOM 0 HB2 ASN A 390 83.935 0.509 -3.752 1.00 1.13 H new ATOM 0 HB3 ASN A 390 85.393 0.327 -2.798 1.00 1.13 H new ATOM 0 HD21 ASN A 390 83.706 1.307 0.187 1.00 1.89 H new ATOM 0 HD22 ASN A 390 84.996 0.374 -0.579 1.00 1.89 H new ATOM 1154 N ARG A 391 87.604 2.759 -3.595 1.00 0.83 N ATOM 1155 CA ARG A 391 88.838 3.100 -2.830 1.00 0.73 C ATOM 1156 C ARG A 391 89.942 3.587 -3.770 1.00 0.74 C ATOM 1157 O ARG A 391 90.077 3.103 -4.873 1.00 1.10 O ATOM 1158 CB ARG A 391 89.265 1.792 -2.156 1.00 0.94 C ATOM 1159 CG ARG A 391 88.224 1.377 -1.114 1.00 1.05 C ATOM 1160 CD ARG A 391 88.761 0.199 -0.298 1.00 1.30 C ATOM 1161 NE ARG A 391 89.868 0.768 0.519 1.00 1.92 N ATOM 1162 CZ ARG A 391 89.601 1.478 1.583 1.00 2.13 C ATOM 1163 NH1 ARG A 391 88.361 1.694 1.937 1.00 2.15 N ATOM 1164 NH2 ARG A 391 90.576 1.974 2.295 1.00 2.69 N ATOM 0 H ARG A 391 87.747 2.546 -4.582 1.00 0.83 H new ATOM 0 HA ARG A 391 88.657 3.899 -2.111 1.00 0.73 H new ATOM 0 HB2 ARG A 391 89.376 1.007 -2.904 1.00 0.94 H new ATOM 0 HB3 ARG A 391 90.237 1.919 -1.680 1.00 0.94 H new ATOM 0 HG2 ARG A 391 87.998 2.216 -0.456 1.00 1.05 H new ATOM 0 HG3 ARG A 391 87.292 1.098 -1.606 1.00 1.05 H new ATOM 0 HD2 ARG A 391 87.984 -0.230 0.335 1.00 1.30 H new ATOM 0 HD3 ARG A 391 89.120 -0.600 -0.947 1.00 1.30 H new ATOM 0 HE ARG A 391 90.837 0.603 0.247 1.00 1.92 H new ATOM 0 HH11 ARG A 391 87.597 1.308 1.382 1.00 2.15 H new ATOM 0 HH12 ARG A 391 88.157 2.249 2.768 1.00 2.15 H new ATOM 0 HH21 ARG A 391 91.544 1.807 2.020 1.00 2.69 H new ATOM 0 HH22 ARG A 391 90.370 2.529 3.126 1.00 2.69 H new ATOM 1178 N MET A 392 90.867 4.346 -3.256 1.00 0.48 N ATOM 1179 CA MET A 392 92.110 4.620 -4.031 1.00 0.51 C ATOM 1180 C MET A 392 93.330 4.348 -3.145 1.00 0.48 C ATOM 1181 O MET A 392 93.357 4.729 -1.991 1.00 0.52 O ATOM 1182 CB MET A 392 92.032 6.099 -4.409 1.00 0.59 C ATOM 1183 CG MET A 392 90.822 6.332 -5.316 1.00 1.14 C ATOM 1184 SD MET A 392 90.836 8.040 -5.915 1.00 1.31 S ATOM 1185 CE MET A 392 90.764 8.849 -4.298 1.00 2.02 C ATOM 0 H MET A 392 90.818 4.787 -2.338 1.00 0.48 H new ATOM 0 HA MET A 392 92.202 3.990 -4.916 1.00 0.51 H new ATOM 0 HB2 MET A 392 91.949 6.711 -3.511 1.00 0.59 H new ATOM 0 HB3 MET A 392 92.946 6.403 -4.919 1.00 0.59 H new ATOM 0 HG2 MET A 392 90.847 5.640 -6.158 1.00 1.14 H new ATOM 0 HG3 MET A 392 89.900 6.135 -4.768 1.00 1.14 H new ATOM 0 HE1 MET A 392 90.248 9.804 -4.392 1.00 2.02 H new ATOM 0 HE2 MET A 392 90.225 8.212 -3.596 1.00 2.02 H new ATOM 0 HE3 MET A 392 91.776 9.018 -3.930 1.00 2.02 H new ATOM 1195 N ILE A 393 94.372 3.771 -3.682 1.00 0.45 N ATOM 1196 CA ILE A 393 95.603 3.582 -2.861 1.00 0.45 C ATOM 1197 C ILE A 393 96.821 4.109 -3.619 1.00 0.50 C ATOM 1198 O ILE A 393 96.983 3.859 -4.795 1.00 0.60 O ATOM 1199 CB ILE A 393 95.718 2.073 -2.634 1.00 0.43 C ATOM 1200 CG1 ILE A 393 94.389 1.535 -2.098 1.00 1.21 C ATOM 1201 CG2 ILE A 393 96.825 1.801 -1.613 1.00 0.98 C ATOM 1202 CD1 ILE A 393 94.050 2.226 -0.777 1.00 1.68 C ATOM 0 H ILE A 393 94.425 3.426 -4.641 1.00 0.45 H new ATOM 0 HA ILE A 393 95.554 4.123 -1.916 1.00 0.45 H new ATOM 0 HB ILE A 393 95.956 1.578 -3.575 1.00 0.43 H new ATOM 0 HG12 ILE A 393 93.595 1.709 -2.825 1.00 1.21 H new ATOM 0 HG13 ILE A 393 94.455 0.457 -1.950 1.00 1.21 H new ATOM 0 HG21 ILE A 393 96.911 0.727 -1.447 1.00 0.98 H new ATOM 0 HG22 ILE A 393 97.772 2.187 -1.991 1.00 0.98 H new ATOM 0 HG23 ILE A 393 96.582 2.295 -0.672 1.00 0.98 H new ATOM 0 HD11 ILE A 393 93.103 1.841 -0.398 1.00 1.68 H new ATOM 0 HD12 ILE A 393 94.839 2.030 -0.051 1.00 1.68 H new ATOM 0 HD13 ILE A 393 93.966 3.301 -0.940 1.00 1.68 H new ATOM 1214 N ARG A 394 97.729 4.745 -2.932 1.00 0.63 N ATOM 1215 CA ARG A 394 98.992 5.176 -3.596 1.00 0.72 C ATOM 1216 C ARG A 394 100.177 4.972 -2.652 1.00 0.60 C ATOM 1217 O ARG A 394 100.049 5.065 -1.451 1.00 0.54 O ATOM 1218 CB ARG A 394 98.802 6.659 -3.913 1.00 0.78 C ATOM 1219 CG ARG A 394 99.949 7.140 -4.803 1.00 1.27 C ATOM 1220 CD ARG A 394 99.816 6.509 -6.191 1.00 1.04 C ATOM 1221 NE ARG A 394 101.022 6.964 -6.940 1.00 1.47 N ATOM 1222 CZ ARG A 394 101.066 8.165 -7.452 1.00 1.92 C ATOM 1223 NH1 ARG A 394 100.058 8.983 -7.304 1.00 2.78 N ATOM 1224 NH2 ARG A 394 102.122 8.551 -8.114 1.00 2.09 N ATOM 0 H ARG A 394 97.652 4.984 -1.943 1.00 0.63 H new ATOM 0 HA ARG A 394 99.199 4.599 -4.497 1.00 0.72 H new ATOM 0 HB2 ARG A 394 97.847 6.815 -4.415 1.00 0.78 H new ATOM 0 HB3 ARG A 394 98.775 7.239 -2.990 1.00 0.78 H new ATOM 0 HG2 ARG A 394 99.931 8.227 -4.883 1.00 1.27 H new ATOM 0 HG3 ARG A 394 100.907 6.869 -4.359 1.00 1.27 H new ATOM 0 HD2 ARG A 394 99.778 5.421 -6.128 1.00 1.04 H new ATOM 0 HD3 ARG A 394 98.900 6.832 -6.685 1.00 1.04 H new ATOM 0 HE ARG A 394 101.817 6.335 -7.053 1.00 1.47 H new ATOM 0 HH11 ARG A 394 99.231 8.685 -6.786 1.00 2.78 H new ATOM 0 HH12 ARG A 394 100.098 9.920 -7.706 1.00 2.78 H new ATOM 0 HH21 ARG A 394 102.911 7.915 -8.231 1.00 2.09 H new ATOM 0 HH22 ARG A 394 102.158 9.488 -8.515 1.00 2.09 H new ATOM 1238 N LYS A 395 101.306 4.614 -3.187 1.00 0.63 N ATOM 1239 CA LYS A 395 102.485 4.306 -2.330 1.00 0.58 C ATOM 1240 C LYS A 395 103.772 4.668 -3.071 1.00 0.60 C ATOM 1241 O LYS A 395 103.863 4.519 -4.268 1.00 0.68 O ATOM 1242 CB LYS A 395 102.414 2.798 -2.109 1.00 0.72 C ATOM 1243 CG LYS A 395 103.616 2.341 -1.289 1.00 0.80 C ATOM 1244 CD LYS A 395 104.738 1.974 -2.252 1.00 1.11 C ATOM 1245 CE LYS A 395 104.751 0.458 -2.456 1.00 1.15 C ATOM 1246 NZ LYS A 395 106.140 0.038 -2.127 1.00 1.57 N ATOM 0 H LYS A 395 101.467 4.520 -4.190 1.00 0.63 H new ATOM 0 HA LYS A 395 102.481 4.864 -1.393 1.00 0.58 H new ATOM 0 HB2 LYS A 395 101.490 2.540 -1.592 1.00 0.72 H new ATOM 0 HB3 LYS A 395 102.398 2.281 -3.068 1.00 0.72 H new ATOM 0 HG2 LYS A 395 103.939 3.133 -0.614 1.00 0.80 H new ATOM 0 HG3 LYS A 395 103.350 1.484 -0.671 1.00 0.80 H new ATOM 0 HD2 LYS A 395 104.594 2.480 -3.207 1.00 1.11 H new ATOM 0 HD3 LYS A 395 105.697 2.308 -1.856 1.00 1.11 H new ATOM 0 HE2 LYS A 395 104.026 -0.034 -1.808 1.00 1.15 H new ATOM 0 HE3 LYS A 395 104.492 0.195 -3.482 1.00 1.15 H new ATOM 0 HZ1 LYS A 395 106.396 -0.793 -2.698 1.00 1.57 H new ATOM 0 HZ2 LYS A 395 106.797 0.817 -2.335 1.00 1.57 H new ATOM 0 HZ3 LYS A 395 106.199 -0.205 -1.117 1.00 1.57 H new ATOM 1260 N GLY A 396 104.791 5.070 -2.368 1.00 0.56 N ATOM 1261 CA GLY A 396 106.086 5.347 -3.056 1.00 0.60 C ATOM 1262 C GLY A 396 107.080 5.981 -2.086 1.00 0.55 C ATOM 1263 O GLY A 396 107.128 5.640 -0.923 1.00 0.82 O ATOM 0 H GLY A 396 104.788 5.218 -1.359 1.00 0.56 H new ATOM 0 HA2 GLY A 396 106.498 4.420 -3.455 1.00 0.60 H new ATOM 0 HA3 GLY A 396 105.920 6.013 -3.903 1.00 0.60 H new ATOM 1267 N SER A 397 107.928 6.847 -2.574 1.00 0.50 N ATOM 1268 CA SER A 397 108.978 7.427 -1.692 1.00 0.60 C ATOM 1269 C SER A 397 108.361 8.432 -0.718 1.00 0.48 C ATOM 1270 O SER A 397 107.278 8.937 -0.933 1.00 0.61 O ATOM 1271 CB SER A 397 109.972 8.113 -2.629 1.00 0.91 C ATOM 1272 OG SER A 397 109.546 9.445 -2.884 1.00 1.17 O ATOM 0 H SER A 397 107.938 7.175 -3.540 1.00 0.50 H new ATOM 0 HA SER A 397 109.466 6.664 -1.086 1.00 0.60 H new ATOM 0 HB2 SER A 397 110.966 8.118 -2.181 1.00 0.91 H new ATOM 0 HB3 SER A 397 110.047 7.559 -3.565 1.00 0.91 H new ATOM 0 HG SER A 397 110.213 10.074 -2.537 1.00 1.17 H new ATOM 1278 N VAL A 398 109.028 8.706 0.368 1.00 0.53 N ATOM 1279 CA VAL A 398 108.457 9.655 1.362 1.00 0.47 C ATOM 1280 C VAL A 398 108.209 11.007 0.698 1.00 0.51 C ATOM 1281 O VAL A 398 107.115 11.531 0.734 1.00 0.51 O ATOM 1282 CB VAL A 398 109.517 9.779 2.453 1.00 0.46 C ATOM 1283 CG1 VAL A 398 109.127 10.904 3.412 1.00 0.50 C ATOM 1284 CG2 VAL A 398 109.607 8.461 3.222 1.00 0.51 C ATOM 0 H VAL A 398 109.939 8.316 0.609 1.00 0.53 H new ATOM 0 HA VAL A 398 107.504 9.312 1.766 1.00 0.47 H new ATOM 0 HB VAL A 398 110.483 10.004 2.002 1.00 0.46 H new ATOM 0 HG11 VAL A 398 109.882 10.995 4.193 1.00 0.50 H new ATOM 0 HG12 VAL A 398 109.058 11.843 2.863 1.00 0.50 H new ATOM 0 HG13 VAL A 398 108.162 10.677 3.866 1.00 0.50 H new ATOM 0 HG21 VAL A 398 110.363 8.546 4.002 1.00 0.51 H new ATOM 0 HG22 VAL A 398 108.641 8.238 3.675 1.00 0.51 H new ATOM 0 HG23 VAL A 398 109.881 7.658 2.537 1.00 0.51 H new ATOM 1294 N ASP A 399 109.170 11.509 -0.024 1.00 0.55 N ATOM 1295 CA ASP A 399 108.925 12.743 -0.816 1.00 0.62 C ATOM 1296 C ASP A 399 107.830 12.470 -1.844 1.00 0.64 C ATOM 1297 O ASP A 399 106.976 13.294 -2.102 1.00 0.64 O ATOM 1298 CB ASP A 399 110.255 13.039 -1.512 1.00 0.71 C ATOM 1299 CG ASP A 399 111.308 13.411 -0.466 1.00 1.10 C ATOM 1300 OD1 ASP A 399 110.928 13.655 0.667 1.00 1.59 O ATOM 1301 OD2 ASP A 399 112.476 13.445 -0.816 1.00 1.46 O ATOM 0 H ASP A 399 110.110 11.120 -0.100 1.00 0.55 H new ATOM 0 HA ASP A 399 108.599 13.583 -0.203 1.00 0.62 H new ATOM 0 HB2 ASP A 399 110.583 12.168 -2.079 1.00 0.71 H new ATOM 0 HB3 ASP A 399 110.131 13.855 -2.224 1.00 0.71 H new ATOM 1306 N ALA A 400 107.846 11.301 -2.422 1.00 0.70 N ATOM 1307 CA ALA A 400 106.810 10.947 -3.429 1.00 0.76 C ATOM 1308 C ALA A 400 105.412 10.988 -2.799 1.00 0.72 C ATOM 1309 O ALA A 400 104.491 11.560 -3.347 1.00 0.75 O ATOM 1310 CB ALA A 400 107.167 9.524 -3.864 1.00 0.85 C ATOM 0 H ALA A 400 108.536 10.573 -2.238 1.00 0.70 H new ATOM 0 HA ALA A 400 106.791 11.642 -4.268 1.00 0.76 H new ATOM 0 HB1 ALA A 400 106.450 9.181 -4.610 1.00 0.85 H new ATOM 0 HB2 ALA A 400 108.169 9.515 -4.292 1.00 0.85 H new ATOM 0 HB3 ALA A 400 107.136 8.861 -3.000 1.00 0.85 H new ATOM 1316 N ILE A 401 105.234 10.368 -1.665 1.00 0.67 N ATOM 1317 CA ILE A 401 103.879 10.355 -1.038 1.00 0.66 C ATOM 1318 C ILE A 401 103.477 11.756 -0.572 1.00 0.59 C ATOM 1319 O ILE A 401 102.341 12.156 -0.708 1.00 0.64 O ATOM 1320 CB ILE A 401 103.996 9.401 0.149 1.00 0.64 C ATOM 1321 CG1 ILE A 401 104.379 8.005 -0.351 1.00 0.81 C ATOM 1322 CG2 ILE A 401 102.654 9.330 0.879 1.00 0.68 C ATOM 1323 CD1 ILE A 401 103.499 7.623 -1.543 1.00 0.62 C ATOM 0 H ILE A 401 105.961 9.873 -1.148 1.00 0.67 H new ATOM 0 HA ILE A 401 103.111 10.036 -1.743 1.00 0.66 H new ATOM 0 HB ILE A 401 104.764 9.765 0.832 1.00 0.64 H new ATOM 0 HG12 ILE A 401 105.429 7.988 -0.642 1.00 0.81 H new ATOM 0 HG13 ILE A 401 104.259 7.276 0.450 1.00 0.81 H new ATOM 0 HG21 ILE A 401 102.736 8.649 1.726 1.00 0.68 H new ATOM 0 HG22 ILE A 401 102.381 10.323 1.236 1.00 0.68 H new ATOM 0 HG23 ILE A 401 101.887 8.967 0.195 1.00 0.68 H new ATOM 0 HD11 ILE A 401 103.775 6.629 -1.895 1.00 0.62 H new ATOM 0 HD12 ILE A 401 102.453 7.622 -1.237 1.00 0.62 H new ATOM 0 HD13 ILE A 401 103.641 8.345 -2.347 1.00 0.62 H new ATOM 1335 N ARG A 402 104.394 12.516 -0.046 1.00 0.50 N ATOM 1336 CA ARG A 402 104.043 13.896 0.394 1.00 0.47 C ATOM 1337 C ARG A 402 103.490 14.701 -0.786 1.00 0.54 C ATOM 1338 O ARG A 402 102.514 15.411 -0.660 1.00 0.62 O ATOM 1339 CB ARG A 402 105.352 14.500 0.894 1.00 0.44 C ATOM 1340 CG ARG A 402 105.079 15.881 1.492 1.00 1.17 C ATOM 1341 CD ARG A 402 106.390 16.476 2.005 1.00 1.24 C ATOM 1342 NE ARG A 402 107.244 16.598 0.793 1.00 1.71 N ATOM 1343 CZ ARG A 402 107.106 17.617 -0.014 1.00 2.17 C ATOM 1344 NH1 ARG A 402 106.200 18.529 0.221 1.00 2.62 N ATOM 1345 NH2 ARG A 402 107.870 17.719 -1.067 1.00 2.61 N ATOM 0 H ARG A 402 105.367 12.245 0.098 1.00 0.50 H new ATOM 0 HA ARG A 402 103.275 13.901 1.168 1.00 0.47 H new ATOM 0 HB2 ARG A 402 105.802 13.850 1.644 1.00 0.44 H new ATOM 0 HB3 ARG A 402 106.065 14.581 0.073 1.00 0.44 H new ATOM 0 HG2 ARG A 402 104.639 16.535 0.740 1.00 1.17 H new ATOM 0 HG3 ARG A 402 104.359 15.802 2.306 1.00 1.17 H new ATOM 0 HD2 ARG A 402 106.228 17.446 2.476 1.00 1.24 H new ATOM 0 HD3 ARG A 402 106.852 15.832 2.753 1.00 1.24 H new ATOM 0 HE ARG A 402 107.942 15.882 0.590 1.00 1.71 H new ATOM 0 HH11 ARG A 402 105.595 18.448 1.038 1.00 2.62 H new ATOM 0 HH12 ARG A 402 106.098 19.322 -0.413 1.00 2.62 H new ATOM 0 HH21 ARG A 402 108.572 17.005 -1.259 1.00 2.61 H new ATOM 0 HH22 ARG A 402 107.765 18.513 -1.699 1.00 2.61 H new ATOM 1359 N ARG A 403 104.082 14.570 -1.942 1.00 0.54 N ATOM 1360 CA ARG A 403 103.558 15.302 -3.132 1.00 0.62 C ATOM 1361 C ARG A 403 102.179 14.771 -3.535 1.00 0.72 C ATOM 1362 O ARG A 403 101.292 15.525 -3.881 1.00 0.82 O ATOM 1363 CB ARG A 403 104.576 15.045 -4.235 1.00 0.63 C ATOM 1364 CG ARG A 403 105.906 15.683 -3.841 1.00 0.83 C ATOM 1365 CD ARG A 403 106.728 15.936 -5.100 1.00 0.96 C ATOM 1366 NE ARG A 403 108.071 16.352 -4.609 1.00 1.38 N ATOM 1367 CZ ARG A 403 108.983 16.759 -5.454 1.00 2.01 C ATOM 1368 NH1 ARG A 403 108.722 16.805 -6.733 1.00 2.48 N ATOM 1369 NH2 ARG A 403 110.158 17.122 -5.016 1.00 2.46 N ATOM 0 H ARG A 403 104.903 13.990 -2.114 1.00 0.54 H new ATOM 0 HA ARG A 403 103.432 16.366 -2.931 1.00 0.62 H new ATOM 0 HB2 ARG A 403 104.703 13.973 -4.388 1.00 0.63 H new ATOM 0 HB3 ARG A 403 104.223 15.462 -5.178 1.00 0.63 H new ATOM 0 HG2 ARG A 403 105.732 16.619 -3.311 1.00 0.83 H new ATOM 0 HG3 ARG A 403 106.451 15.028 -3.161 1.00 0.83 H new ATOM 0 HD2 ARG A 403 106.794 15.038 -5.715 1.00 0.96 H new ATOM 0 HD3 ARG A 403 106.276 16.713 -5.717 1.00 0.96 H new ATOM 0 HE ARG A 403 108.280 16.320 -3.611 1.00 1.38 H new ATOM 0 HH11 ARG A 403 107.804 16.523 -7.077 1.00 2.48 H new ATOM 0 HH12 ARG A 403 109.436 17.123 -7.388 1.00 2.48 H new ATOM 0 HH21 ARG A 403 110.363 17.088 -4.017 1.00 2.46 H new ATOM 0 HH22 ARG A 403 110.871 17.440 -5.672 1.00 2.46 H new ATOM 1383 N HIS A 404 101.975 13.485 -3.455 1.00 0.74 N ATOM 1384 CA HIS A 404 100.636 12.924 -3.797 1.00 0.86 C ATOM 1385 C HIS A 404 99.573 13.417 -2.809 1.00 0.84 C ATOM 1386 O HIS A 404 98.472 13.765 -3.190 1.00 0.94 O ATOM 1387 CB HIS A 404 100.808 11.410 -3.701 1.00 0.92 C ATOM 1388 CG HIS A 404 99.513 10.733 -4.060 1.00 1.32 C ATOM 1389 ND1 HIS A 404 98.657 10.217 -3.100 1.00 1.39 N ATOM 1390 CD2 HIS A 404 98.914 10.484 -5.270 1.00 2.29 C ATOM 1391 CE1 HIS A 404 97.600 9.687 -3.743 1.00 1.88 C ATOM 1392 NE2 HIS A 404 97.706 9.823 -5.068 1.00 2.43 N ATOM 0 H HIS A 404 102.674 12.800 -3.169 1.00 0.74 H new ATOM 0 HA HIS A 404 100.301 13.234 -4.787 1.00 0.86 H new ATOM 0 HB2 HIS A 404 101.601 11.080 -4.372 1.00 0.92 H new ATOM 0 HB3 HIS A 404 101.109 11.131 -2.691 1.00 0.92 H new ATOM 0 HD2 HIS A 404 99.319 10.759 -6.233 1.00 2.29 H new ATOM 0 HE1 HIS A 404 96.767 9.210 -3.248 1.00 1.88 H new ATOM 0 HE2 HIS A 404 97.044 9.510 -5.778 1.00 2.43 H new ATOM 1400 N VAL A 405 99.901 13.490 -1.551 1.00 0.76 N ATOM 1401 CA VAL A 405 98.916 14.000 -0.557 1.00 0.79 C ATOM 1402 C VAL A 405 98.597 15.474 -0.827 1.00 0.85 C ATOM 1403 O VAL A 405 97.458 15.886 -0.785 1.00 0.94 O ATOM 1404 CB VAL A 405 99.598 13.833 0.801 1.00 0.76 C ATOM 1405 CG1 VAL A 405 98.712 14.430 1.895 1.00 0.80 C ATOM 1406 CG2 VAL A 405 99.820 12.345 1.080 1.00 0.76 C ATOM 0 H VAL A 405 100.807 13.219 -1.167 1.00 0.76 H new ATOM 0 HA VAL A 405 97.969 13.462 -0.604 1.00 0.79 H new ATOM 0 HB VAL A 405 100.558 14.349 0.791 1.00 0.76 H new ATOM 0 HG11 VAL A 405 99.199 14.311 2.863 1.00 0.80 H new ATOM 0 HG12 VAL A 405 98.554 15.490 1.697 1.00 0.80 H new ATOM 0 HG13 VAL A 405 97.751 13.915 1.906 1.00 0.80 H new ATOM 0 HG21 VAL A 405 100.306 12.225 2.048 1.00 0.76 H new ATOM 0 HG22 VAL A 405 98.860 11.829 1.090 1.00 0.76 H new ATOM 0 HG23 VAL A 405 100.452 11.919 0.301 1.00 0.76 H new ATOM 1416 N GLU A 406 99.590 16.280 -1.070 1.00 0.84 N ATOM 1417 CA GLU A 406 99.327 17.732 -1.295 1.00 0.95 C ATOM 1418 C GLU A 406 98.462 17.940 -2.543 1.00 1.05 C ATOM 1419 O GLU A 406 97.631 18.826 -2.588 1.00 1.19 O ATOM 1420 CB GLU A 406 100.708 18.361 -1.488 1.00 0.91 C ATOM 1421 CG GLU A 406 101.509 18.242 -0.191 1.00 0.88 C ATOM 1422 CD GLU A 406 102.866 18.926 -0.364 1.00 1.43 C ATOM 1423 OE1 GLU A 406 103.183 19.294 -1.483 1.00 1.86 O ATOM 1424 OE2 GLU A 406 103.565 19.070 0.625 1.00 2.16 O ATOM 0 H GLU A 406 100.570 16.001 -1.123 1.00 0.84 H new ATOM 0 HA GLU A 406 98.785 18.181 -0.463 1.00 0.95 H new ATOM 0 HB2 GLU A 406 101.236 17.862 -2.301 1.00 0.91 H new ATOM 0 HB3 GLU A 406 100.606 19.409 -1.770 1.00 0.91 H new ATOM 0 HG2 GLU A 406 100.960 18.702 0.631 1.00 0.88 H new ATOM 0 HG3 GLU A 406 101.649 17.192 0.067 1.00 0.88 H new ATOM 1431 N ALA A 407 98.645 17.137 -3.557 1.00 1.02 N ATOM 1432 CA ALA A 407 97.825 17.303 -4.792 1.00 1.17 C ATOM 1433 C ALA A 407 96.362 16.980 -4.487 1.00 1.32 C ATOM 1434 O ALA A 407 95.466 17.735 -4.809 1.00 1.53 O ATOM 1435 CB ALA A 407 98.400 16.299 -5.790 1.00 1.12 C ATOM 0 H ALA A 407 99.324 16.376 -3.584 1.00 1.02 H new ATOM 0 HA ALA A 407 97.857 18.321 -5.181 1.00 1.17 H new ATOM 0 HB1 ALA A 407 97.847 16.361 -6.728 1.00 1.12 H new ATOM 0 HB2 ALA A 407 99.450 16.528 -5.972 1.00 1.12 H new ATOM 0 HB3 ALA A 407 98.313 15.291 -5.383 1.00 1.12 H new ATOM 1441 N ASN A 408 96.136 15.945 -3.731 1.00 1.23 N ATOM 1442 CA ASN A 408 94.765 15.661 -3.239 1.00 1.37 C ATOM 1443 C ASN A 408 94.344 16.752 -2.261 1.00 1.44 C ATOM 1444 O ASN A 408 93.174 16.978 -2.020 1.00 1.60 O ATOM 1445 CB ASN A 408 94.887 14.315 -2.530 1.00 1.27 C ATOM 1446 CG ASN A 408 95.124 13.213 -3.563 1.00 1.88 C ATOM 1447 OD1 ASN A 408 94.889 13.405 -4.740 1.00 2.75 O ATOM 1448 ND2 ASN A 408 95.583 12.056 -3.171 1.00 2.02 N ATOM 0 H ASN A 408 96.849 15.280 -3.431 1.00 1.23 H new ATOM 0 HA ASN A 408 94.019 15.635 -4.033 1.00 1.37 H new ATOM 0 HB2 ASN A 408 95.710 14.342 -1.816 1.00 1.27 H new ATOM 0 HB3 ASN A 408 93.980 14.107 -1.963 1.00 1.27 H new ATOM 0 HD21 ASN A 408 95.744 11.314 -3.852 1.00 2.02 H new ATOM 0 HD22 ASN A 408 95.781 11.894 -2.184 1.00 2.02 H new ATOM 1455 N GLY A 409 95.302 17.365 -1.628 1.00 1.37 N ATOM 1456 CA GLY A 409 94.990 18.371 -0.583 1.00 1.51 C ATOM 1457 C GLY A 409 95.042 17.704 0.792 1.00 1.69 C ATOM 1458 O GLY A 409 94.451 18.171 1.745 1.00 2.28 O ATOM 0 H GLY A 409 96.297 17.209 -1.793 1.00 1.37 H new ATOM 0 HA2 GLY A 409 95.704 19.193 -0.628 1.00 1.51 H new ATOM 0 HA3 GLY A 409 94.002 18.797 -0.756 1.00 1.51 H new ATOM 1462 N GLY A 410 95.777 16.631 0.907 1.00 1.39 N ATOM 1463 CA GLY A 410 95.908 15.948 2.226 1.00 1.72 C ATOM 1464 C GLY A 410 97.132 16.496 2.963 1.00 1.26 C ATOM 1465 O GLY A 410 97.743 17.457 2.540 1.00 1.69 O ATOM 0 H GLY A 410 96.294 16.197 0.142 1.00 1.39 H new ATOM 0 HA2 GLY A 410 95.009 16.108 2.822 1.00 1.72 H new ATOM 0 HA3 GLY A 410 96.008 14.872 2.082 1.00 1.72 H new ATOM 1469 N HIS A 411 97.515 15.874 4.045 1.00 0.88 N ATOM 1470 CA HIS A 411 98.723 16.343 4.784 1.00 1.32 C ATOM 1471 C HIS A 411 99.533 15.148 5.297 1.00 1.27 C ATOM 1472 O HIS A 411 98.991 14.107 5.609 1.00 1.52 O ATOM 1473 CB HIS A 411 98.182 17.166 5.953 1.00 1.83 C ATOM 1474 CG HIS A 411 99.329 17.774 6.712 1.00 2.66 C ATOM 1475 ND1 HIS A 411 100.156 18.736 6.155 1.00 3.39 N ATOM 1476 CD2 HIS A 411 99.797 17.569 7.985 1.00 3.34 C ATOM 1477 CE1 HIS A 411 101.071 19.071 7.083 1.00 4.16 C ATOM 1478 NE2 HIS A 411 100.898 18.387 8.218 1.00 4.13 N ATOM 0 H HIS A 411 97.045 15.063 4.449 1.00 0.88 H new ATOM 0 HA HIS A 411 99.390 16.927 4.150 1.00 1.32 H new ATOM 0 HB2 HIS A 411 97.520 17.950 5.584 1.00 1.83 H new ATOM 0 HB3 HIS A 411 97.590 16.533 6.614 1.00 1.83 H new ATOM 0 HD2 HIS A 411 99.375 16.877 8.699 1.00 3.34 H new ATOM 0 HE1 HIS A 411 101.850 19.803 6.929 1.00 4.16 H new ATOM 0 HE2 HIS A 411 101.453 18.451 9.071 1.00 4.13 H new ATOM 1486 N PHE A 412 100.825 15.299 5.401 1.00 1.04 N ATOM 1487 CA PHE A 412 101.671 14.182 5.912 1.00 1.06 C ATOM 1488 C PHE A 412 101.897 14.339 7.421 1.00 1.03 C ATOM 1489 O PHE A 412 102.573 15.251 7.856 1.00 1.05 O ATOM 1490 CB PHE A 412 102.993 14.316 5.153 1.00 1.03 C ATOM 1491 CG PHE A 412 103.599 12.950 4.945 1.00 1.36 C ATOM 1492 CD1 PHE A 412 104.208 12.283 6.016 1.00 1.73 C ATOM 1493 CD2 PHE A 412 103.555 12.350 3.678 1.00 1.90 C ATOM 1494 CE1 PHE A 412 104.775 11.015 5.822 1.00 2.70 C ATOM 1495 CE2 PHE A 412 104.122 11.082 3.483 1.00 2.91 C ATOM 1496 CZ PHE A 412 104.731 10.415 4.555 1.00 3.31 C ATOM 0 H PHE A 412 101.332 16.149 5.154 1.00 1.04 H new ATOM 0 HA PHE A 412 101.209 13.206 5.761 1.00 1.06 H new ATOM 0 HB2 PHE A 412 102.824 14.800 4.191 1.00 1.03 H new ATOM 0 HB3 PHE A 412 103.682 14.949 5.712 1.00 1.03 H new ATOM 0 HD1 PHE A 412 104.241 12.745 6.991 1.00 1.73 H new ATOM 0 HD2 PHE A 412 103.085 12.864 2.853 1.00 1.90 H new ATOM 0 HE1 PHE A 412 105.245 10.501 6.647 1.00 2.70 H new ATOM 0 HE2 PHE A 412 104.089 10.620 2.507 1.00 2.91 H new ATOM 0 HZ PHE A 412 105.167 9.438 4.405 1.00 3.31 H new ATOM 1506 N PRO A 413 101.276 13.469 8.173 1.00 1.03 N ATOM 1507 CA PRO A 413 101.359 13.539 9.656 1.00 1.06 C ATOM 1508 C PRO A 413 102.810 13.402 10.130 1.00 0.96 C ATOM 1509 O PRO A 413 103.576 12.622 9.599 1.00 0.88 O ATOM 1510 CB PRO A 413 100.527 12.349 10.134 1.00 1.16 C ATOM 1511 CG PRO A 413 99.705 11.928 8.955 1.00 1.23 C ATOM 1512 CD PRO A 413 100.448 12.352 7.718 1.00 1.05 C ATOM 0 HA PRO A 413 100.998 14.491 10.046 1.00 1.06 H new ATOM 0 HB2 PRO A 413 101.167 11.536 10.475 1.00 1.16 H new ATOM 0 HB3 PRO A 413 99.892 12.628 10.974 1.00 1.16 H new ATOM 0 HG2 PRO A 413 99.551 10.849 8.960 1.00 1.23 H new ATOM 0 HG3 PRO A 413 98.719 12.391 8.989 1.00 1.23 H new ATOM 0 HD2 PRO A 413 101.056 11.540 7.319 1.00 1.05 H new ATOM 0 HD3 PRO A 413 99.764 12.658 6.926 1.00 1.05 H new ATOM 1520 N THR A 414 103.178 14.123 11.156 1.00 1.01 N ATOM 1521 CA THR A 414 104.561 13.999 11.700 1.00 0.97 C ATOM 1522 C THR A 414 104.842 12.551 12.108 1.00 0.92 C ATOM 1523 O THR A 414 105.916 12.033 11.892 1.00 0.84 O ATOM 1524 CB THR A 414 104.587 14.923 12.926 1.00 1.09 C ATOM 1525 OG1 THR A 414 105.935 15.220 13.262 1.00 1.63 O ATOM 1526 CG2 THR A 414 103.904 14.239 14.116 1.00 1.75 C ATOM 0 H THR A 414 102.580 14.792 11.641 1.00 1.01 H new ATOM 0 HA THR A 414 105.321 14.272 10.968 1.00 0.97 H new ATOM 0 HB THR A 414 104.053 15.844 12.691 1.00 1.09 H new ATOM 0 HG1 THR A 414 105.955 15.811 14.043 1.00 1.63 H new ATOM 0 HG21 THR A 414 103.928 14.903 14.980 1.00 1.75 H new ATOM 0 HG22 THR A 414 102.869 14.013 13.861 1.00 1.75 H new ATOM 0 HG23 THR A 414 104.429 13.314 14.354 1.00 1.75 H new ATOM 1534 N ASP A 415 103.904 11.917 12.753 1.00 0.99 N ATOM 1535 CA ASP A 415 104.144 10.530 13.238 1.00 0.97 C ATOM 1536 C ASP A 415 104.549 9.622 12.074 1.00 0.83 C ATOM 1537 O ASP A 415 105.402 8.775 12.206 1.00 0.84 O ATOM 1538 CB ASP A 415 102.813 10.084 13.836 1.00 1.08 C ATOM 1539 CG ASP A 415 102.540 10.878 15.114 1.00 1.27 C ATOM 1540 OD1 ASP A 415 103.441 11.568 15.563 1.00 1.87 O ATOM 1541 OD2 ASP A 415 101.435 10.784 15.623 1.00 1.80 O ATOM 0 H ASP A 415 102.982 12.299 12.965 1.00 0.99 H new ATOM 0 HA ASP A 415 104.952 10.481 13.968 1.00 0.97 H new ATOM 0 HB2 ASP A 415 102.008 10.241 13.118 1.00 1.08 H new ATOM 0 HB3 ASP A 415 102.840 9.017 14.056 1.00 1.08 H new ATOM 1546 N VAL A 416 103.998 9.825 10.915 1.00 0.71 N ATOM 1547 CA VAL A 416 104.430 9.006 9.750 1.00 0.60 C ATOM 1548 C VAL A 416 105.842 9.406 9.319 1.00 0.51 C ATOM 1549 O VAL A 416 106.655 8.574 8.974 1.00 0.46 O ATOM 1550 CB VAL A 416 103.417 9.316 8.651 1.00 0.58 C ATOM 1551 CG1 VAL A 416 103.880 8.693 7.333 1.00 0.51 C ATOM 1552 CG2 VAL A 416 102.055 8.732 9.037 1.00 0.71 C ATOM 0 H VAL A 416 103.273 10.516 10.722 1.00 0.71 H new ATOM 0 HA VAL A 416 104.462 7.941 9.980 1.00 0.60 H new ATOM 0 HB VAL A 416 103.333 10.396 8.531 1.00 0.58 H new ATOM 0 HG11 VAL A 416 103.155 8.916 6.551 1.00 0.51 H new ATOM 0 HG12 VAL A 416 104.850 9.105 7.057 1.00 0.51 H new ATOM 0 HG13 VAL A 416 103.965 7.613 7.451 1.00 0.51 H new ATOM 0 HG21 VAL A 416 101.330 8.952 8.254 1.00 0.71 H new ATOM 0 HG22 VAL A 416 102.143 7.652 9.157 1.00 0.71 H new ATOM 0 HG23 VAL A 416 101.722 9.176 9.975 1.00 0.71 H new ATOM 1562 N ASP A 417 106.166 10.664 9.415 1.00 0.53 N ATOM 1563 CA ASP A 417 107.556 11.097 9.094 1.00 0.53 C ATOM 1564 C ASP A 417 108.558 10.438 10.048 1.00 0.58 C ATOM 1565 O ASP A 417 109.587 9.942 9.636 1.00 0.60 O ATOM 1566 CB ASP A 417 107.547 12.613 9.283 1.00 0.61 C ATOM 1567 CG ASP A 417 106.750 13.264 8.152 1.00 1.03 C ATOM 1568 OD1 ASP A 417 106.483 12.584 7.176 1.00 1.81 O ATOM 1569 OD2 ASP A 417 106.422 14.431 8.281 1.00 1.15 O ATOM 0 H ASP A 417 105.532 11.410 9.701 1.00 0.53 H new ATOM 0 HA ASP A 417 107.854 10.812 8.085 1.00 0.53 H new ATOM 0 HB2 ASP A 417 107.105 12.867 10.246 1.00 0.61 H new ATOM 0 HB3 ASP A 417 108.568 12.995 9.290 1.00 0.61 H new ATOM 1574 N GLN A 418 108.256 10.402 11.314 1.00 0.62 N ATOM 1575 CA GLN A 418 109.185 9.750 12.279 1.00 0.68 C ATOM 1576 C GLN A 418 109.213 8.231 12.056 1.00 0.69 C ATOM 1577 O GLN A 418 110.249 7.613 12.146 1.00 0.81 O ATOM 1578 CB GLN A 418 108.643 10.106 13.666 1.00 0.73 C ATOM 1579 CG GLN A 418 107.226 9.567 13.824 1.00 1.31 C ATOM 1580 CD GLN A 418 106.816 9.634 15.296 1.00 1.86 C ATOM 1581 OE1 GLN A 418 107.036 8.702 16.043 1.00 1.96 O ATOM 1582 NE2 GLN A 418 106.229 10.709 15.749 1.00 2.60 N ATOM 0 H GLN A 418 107.408 10.795 11.723 1.00 0.62 H new ATOM 0 HA GLN A 418 110.213 10.092 12.158 1.00 0.68 H new ATOM 0 HB2 GLN A 418 109.289 9.686 14.437 1.00 0.73 H new ATOM 0 HB3 GLN A 418 108.647 11.188 13.801 1.00 0.73 H new ATOM 0 HG2 GLN A 418 106.534 10.150 13.216 1.00 1.31 H new ATOM 0 HG3 GLN A 418 107.175 8.538 13.468 1.00 1.31 H new ATOM 0 HE21 GLN A 418 106.044 11.492 15.122 1.00 2.60 H new ATOM 0 HE22 GLN A 418 105.955 10.766 16.730 1.00 2.60 H new ATOM 1591 N LYS A 419 108.109 7.632 11.693 1.00 0.61 N ATOM 1592 CA LYS A 419 108.131 6.169 11.387 1.00 0.63 C ATOM 1593 C LYS A 419 109.078 5.877 10.214 1.00 0.62 C ATOM 1594 O LYS A 419 109.835 4.930 10.237 1.00 0.71 O ATOM 1595 CB LYS A 419 106.692 5.823 11.004 1.00 0.57 C ATOM 1596 CG LYS A 419 105.774 6.016 12.214 1.00 0.81 C ATOM 1597 CD LYS A 419 105.860 4.792 13.125 1.00 0.93 C ATOM 1598 CE LYS A 419 104.687 4.813 14.111 1.00 1.33 C ATOM 1599 NZ LYS A 419 105.278 5.264 15.401 1.00 2.49 N ATOM 0 H LYS A 419 107.201 8.086 11.596 1.00 0.61 H new ATOM 0 HA LYS A 419 108.486 5.581 12.234 1.00 0.63 H new ATOM 0 HB2 LYS A 419 106.362 6.457 10.181 1.00 0.57 H new ATOM 0 HB3 LYS A 419 106.637 4.792 10.654 1.00 0.57 H new ATOM 0 HG2 LYS A 419 106.064 6.912 12.764 1.00 0.81 H new ATOM 0 HG3 LYS A 419 104.746 6.164 11.883 1.00 0.81 H new ATOM 0 HD2 LYS A 419 105.834 3.879 12.530 1.00 0.93 H new ATOM 0 HD3 LYS A 419 106.806 4.793 13.667 1.00 0.93 H new ATOM 0 HE2 LYS A 419 103.903 5.492 13.777 1.00 1.33 H new ATOM 0 HE3 LYS A 419 104.234 3.826 14.208 1.00 1.33 H new ATOM 0 HZ1 LYS A 419 104.535 5.304 16.128 1.00 2.49 H new ATOM 0 HZ2 LYS A 419 106.017 4.595 15.697 1.00 2.49 H new ATOM 0 HZ3 LYS A 419 105.695 6.209 15.280 1.00 2.49 H new ATOM 1613 N VAL A 420 109.061 6.702 9.204 1.00 0.56 N ATOM 1614 CA VAL A 420 109.971 6.495 8.037 1.00 0.62 C ATOM 1615 C VAL A 420 111.428 6.687 8.465 1.00 0.71 C ATOM 1616 O VAL A 420 112.319 5.993 8.024 1.00 0.79 O ATOM 1617 CB VAL A 420 109.561 7.578 7.038 1.00 0.60 C ATOM 1618 CG1 VAL A 420 110.557 7.618 5.876 1.00 0.70 C ATOM 1619 CG2 VAL A 420 108.163 7.271 6.497 1.00 0.59 C ATOM 0 H VAL A 420 108.452 7.517 9.135 1.00 0.56 H new ATOM 0 HA VAL A 420 109.894 5.492 7.617 1.00 0.62 H new ATOM 0 HB VAL A 420 109.556 8.545 7.541 1.00 0.60 H new ATOM 0 HG11 VAL A 420 110.259 8.391 5.168 1.00 0.70 H new ATOM 0 HG12 VAL A 420 111.553 7.840 6.258 1.00 0.70 H new ATOM 0 HG13 VAL A 420 110.569 6.651 5.373 1.00 0.70 H new ATOM 0 HG21 VAL A 420 107.871 8.043 5.785 1.00 0.59 H new ATOM 0 HG22 VAL A 420 108.171 6.302 5.999 1.00 0.59 H new ATOM 0 HG23 VAL A 420 107.450 7.249 7.322 1.00 0.59 H new ATOM 1629 N ASP A 421 111.672 7.648 9.300 1.00 0.72 N ATOM 1630 CA ASP A 421 113.067 7.925 9.747 1.00 0.84 C ATOM 1631 C ASP A 421 113.584 6.797 10.643 1.00 0.91 C ATOM 1632 O ASP A 421 114.694 6.327 10.489 1.00 1.00 O ATOM 1633 CB ASP A 421 112.961 9.226 10.533 1.00 0.88 C ATOM 1634 CG ASP A 421 112.738 10.392 9.569 1.00 1.14 C ATOM 1635 OD1 ASP A 421 112.840 10.172 8.372 1.00 1.25 O ATOM 1636 OD2 ASP A 421 112.471 11.483 10.042 1.00 2.05 O ATOM 0 H ASP A 421 110.962 8.262 9.699 1.00 0.72 H new ATOM 0 HA ASP A 421 113.763 7.997 8.911 1.00 0.84 H new ATOM 0 HB2 ASP A 421 112.137 9.167 11.244 1.00 0.88 H new ATOM 0 HB3 ASP A 421 113.871 9.388 11.111 1.00 0.88 H new ATOM 1641 N GLN A 422 112.771 6.328 11.545 1.00 0.89 N ATOM 1642 CA GLN A 422 113.191 5.196 12.417 1.00 0.98 C ATOM 1643 C GLN A 422 113.380 3.938 11.572 1.00 0.98 C ATOM 1644 O GLN A 422 114.312 3.188 11.761 1.00 1.07 O ATOM 1645 CB GLN A 422 112.047 5.018 13.417 1.00 0.99 C ATOM 1646 CG GLN A 422 111.895 6.293 14.251 1.00 1.32 C ATOM 1647 CD GLN A 422 110.733 6.125 15.232 1.00 1.77 C ATOM 1648 OE1 GLN A 422 109.915 5.239 15.076 1.00 2.33 O ATOM 1649 NE2 GLN A 422 110.625 6.943 16.242 1.00 2.33 N ATOM 0 H GLN A 422 111.830 6.681 11.717 1.00 0.89 H new ATOM 0 HA GLN A 422 114.138 5.384 12.924 1.00 0.98 H new ATOM 0 HB2 GLN A 422 111.118 4.803 12.889 1.00 0.99 H new ATOM 0 HB3 GLN A 422 112.248 4.167 14.068 1.00 0.99 H new ATOM 0 HG2 GLN A 422 112.817 6.497 14.795 1.00 1.32 H new ATOM 0 HG3 GLN A 422 111.714 7.147 13.599 1.00 1.32 H new ATOM 0 HE21 GLN A 422 111.312 7.686 16.372 1.00 2.33 H new ATOM 0 HE22 GLN A 422 109.854 6.840 16.902 1.00 2.33 H new ATOM 1658 N VAL A 423 112.606 3.804 10.535 1.00 0.91 N ATOM 1659 CA VAL A 423 112.858 2.714 9.560 1.00 0.94 C ATOM 1660 C VAL A 423 114.266 2.858 8.979 1.00 0.96 C ATOM 1661 O VAL A 423 115.016 1.906 8.900 1.00 1.00 O ATOM 1662 CB VAL A 423 111.807 2.940 8.482 1.00 0.92 C ATOM 1663 CG1 VAL A 423 112.040 1.981 7.317 1.00 0.95 C ATOM 1664 CG2 VAL A 423 110.414 2.715 9.070 1.00 0.99 C ATOM 0 H VAL A 423 111.809 4.403 10.321 1.00 0.91 H new ATOM 0 HA VAL A 423 112.797 1.718 9.999 1.00 0.94 H new ATOM 0 HB VAL A 423 111.883 3.964 8.116 1.00 0.92 H new ATOM 0 HG11 VAL A 423 111.284 2.149 6.550 1.00 0.95 H new ATOM 0 HG12 VAL A 423 113.030 2.155 6.895 1.00 0.95 H new ATOM 0 HG13 VAL A 423 111.973 0.953 7.673 1.00 0.95 H new ATOM 0 HG21 VAL A 423 109.662 2.877 8.297 1.00 0.99 H new ATOM 0 HG22 VAL A 423 110.337 1.694 9.443 1.00 0.99 H new ATOM 0 HG23 VAL A 423 110.248 3.414 9.890 1.00 0.99 H new ATOM 1674 N ALA A 424 114.659 4.058 8.652 1.00 0.98 N ATOM 1675 CA ALA A 424 116.051 4.282 8.167 1.00 1.07 C ATOM 1676 C ALA A 424 117.044 4.043 9.305 1.00 1.17 C ATOM 1677 O ALA A 424 118.002 3.309 9.163 1.00 1.24 O ATOM 1678 CB ALA A 424 116.085 5.745 7.739 1.00 1.09 C ATOM 0 H ALA A 424 114.076 4.894 8.700 1.00 0.98 H new ATOM 0 HA ALA A 424 116.321 3.609 7.354 1.00 1.07 H new ATOM 0 HB1 ALA A 424 117.079 5.992 7.368 1.00 1.09 H new ATOM 0 HB2 ALA A 424 115.351 5.910 6.950 1.00 1.09 H new ATOM 0 HB3 ALA A 424 115.848 6.380 8.593 1.00 1.09 H new ATOM 1684 N ARG A 425 116.792 4.617 10.450 1.00 1.23 N ATOM 1685 CA ARG A 425 117.689 4.377 11.615 1.00 1.39 C ATOM 1686 C ARG A 425 117.794 2.876 11.889 1.00 1.38 C ATOM 1687 O ARG A 425 118.742 2.408 12.486 1.00 1.53 O ATOM 1688 CB ARG A 425 117.020 5.093 12.789 1.00 1.57 C ATOM 1689 CG ARG A 425 116.993 6.600 12.521 1.00 2.17 C ATOM 1690 CD ARG A 425 116.417 7.325 13.739 1.00 2.43 C ATOM 1691 NE ARG A 425 116.235 8.735 13.296 1.00 2.68 N ATOM 1692 CZ ARG A 425 117.263 9.538 13.214 1.00 3.44 C ATOM 1693 NH1 ARG A 425 118.459 9.109 13.521 1.00 4.11 N ATOM 1694 NH2 ARG A 425 117.095 10.771 12.826 1.00 3.73 N ATOM 0 H ARG A 425 116.005 5.241 10.628 1.00 1.23 H new ATOM 0 HA ARG A 425 118.701 4.744 11.443 1.00 1.39 H new ATOM 0 HB2 ARG A 425 116.005 4.719 12.926 1.00 1.57 H new ATOM 0 HB3 ARG A 425 117.563 4.887 13.711 1.00 1.57 H new ATOM 0 HG2 ARG A 425 118.000 6.961 12.312 1.00 2.17 H new ATOM 0 HG3 ARG A 425 116.389 6.812 11.639 1.00 2.17 H new ATOM 0 HD2 ARG A 425 115.470 6.883 14.050 1.00 2.43 H new ATOM 0 HD3 ARG A 425 117.093 7.263 14.592 1.00 2.43 H new ATOM 0 HE ARG A 425 115.304 9.076 13.056 1.00 2.68 H new ATOM 0 HH11 ARG A 425 118.592 8.145 13.826 1.00 4.11 H new ATOM 0 HH12 ARG A 425 119.259 9.738 13.456 1.00 4.11 H new ATOM 0 HH21 ARG A 425 116.162 11.108 12.587 1.00 3.73 H new ATOM 0 HH22 ARG A 425 117.896 11.399 12.761 1.00 3.73 H new ATOM 1708 N GLN A 426 116.831 2.118 11.443 1.00 1.26 N ATOM 1709 CA GLN A 426 116.883 0.640 11.665 1.00 1.33 C ATOM 1710 C GLN A 426 117.566 -0.060 10.489 1.00 1.26 C ATOM 1711 O GLN A 426 117.650 -1.271 10.440 1.00 1.33 O ATOM 1712 CB GLN A 426 115.426 0.203 11.783 1.00 1.34 C ATOM 1713 CG GLN A 426 114.848 0.739 13.091 1.00 1.95 C ATOM 1714 CD GLN A 426 113.346 0.459 13.143 1.00 2.42 C ATOM 1715 OE1 GLN A 426 112.732 0.178 12.132 1.00 2.68 O ATOM 1716 NE2 GLN A 426 112.720 0.524 14.287 1.00 2.92 N ATOM 0 H GLN A 426 116.012 2.453 10.936 1.00 1.26 H new ATOM 0 HA GLN A 426 117.458 0.381 12.554 1.00 1.33 H new ATOM 0 HB2 GLN A 426 114.851 0.578 10.936 1.00 1.34 H new ATOM 0 HB3 GLN A 426 115.356 -0.885 11.759 1.00 1.34 H new ATOM 0 HG2 GLN A 426 115.345 0.269 13.939 1.00 1.95 H new ATOM 0 HG3 GLN A 426 115.031 1.811 13.169 1.00 1.95 H new ATOM 0 HE21 GLN A 426 113.233 0.760 15.136 1.00 2.92 H new ATOM 0 HE22 GLN A 426 111.718 0.339 14.331 1.00 2.92 H new ATOM 1725 N GLY A 427 118.102 0.691 9.573 1.00 1.16 N ATOM 1726 CA GLY A 427 118.837 0.066 8.436 1.00 1.14 C ATOM 1727 C GLY A 427 117.838 -0.483 7.416 1.00 1.07 C ATOM 1728 O GLY A 427 118.061 -1.505 6.799 1.00 1.11 O ATOM 0 H GLY A 427 118.065 1.710 9.559 1.00 1.16 H new ATOM 0 HA2 GLY A 427 119.488 0.801 7.963 1.00 1.14 H new ATOM 0 HA3 GLY A 427 119.477 -0.737 8.802 1.00 1.14 H new ATOM 1732 N ALA A 428 116.752 0.209 7.212 1.00 1.07 N ATOM 1733 CA ALA A 428 115.750 -0.244 6.204 1.00 1.00 C ATOM 1734 C ALA A 428 115.357 0.927 5.307 1.00 0.94 C ATOM 1735 O ALA A 428 115.462 2.073 5.691 1.00 0.97 O ATOM 1736 CB ALA A 428 114.550 -0.717 7.025 1.00 1.04 C ATOM 0 H ALA A 428 116.513 1.072 7.701 1.00 1.07 H new ATOM 0 HA ALA A 428 116.134 -1.033 5.557 1.00 1.00 H new ATOM 0 HB1 ALA A 428 113.766 -1.068 6.354 1.00 1.04 H new ATOM 0 HB2 ALA A 428 114.857 -1.531 7.682 1.00 1.04 H new ATOM 0 HB3 ALA A 428 114.171 0.110 7.625 1.00 1.04 H new ATOM 1742 N THR A 429 114.808 0.646 4.158 1.00 0.92 N ATOM 1743 CA THR A 429 114.297 1.749 3.295 1.00 0.88 C ATOM 1744 C THR A 429 112.814 1.963 3.588 1.00 0.65 C ATOM 1745 O THR A 429 111.997 1.121 3.277 1.00 0.62 O ATOM 1746 CB THR A 429 114.494 1.266 1.854 1.00 1.00 C ATOM 1747 OG1 THR A 429 115.855 1.434 1.484 1.00 1.21 O ATOM 1748 CG2 THR A 429 113.601 2.078 0.905 1.00 1.00 C ATOM 0 H THR A 429 114.691 -0.294 3.780 1.00 0.92 H new ATOM 0 HA THR A 429 114.813 2.693 3.470 1.00 0.88 H new ATOM 0 HB THR A 429 114.222 0.213 1.786 1.00 1.00 H new ATOM 0 HG1 THR A 429 115.984 1.124 0.563 1.00 1.21 H new ATOM 0 HG21 THR A 429 113.746 1.730 -0.118 1.00 1.00 H new ATOM 0 HG22 THR A 429 112.556 1.948 1.188 1.00 1.00 H new ATOM 0 HG23 THR A 429 113.866 3.133 0.970 1.00 1.00 H new ATOM 1756 N PRO A 430 112.523 3.061 4.223 1.00 0.70 N ATOM 1757 CA PRO A 430 111.133 3.367 4.608 1.00 0.55 C ATOM 1758 C PRO A 430 110.363 3.920 3.410 1.00 0.54 C ATOM 1759 O PRO A 430 110.430 5.097 3.118 1.00 0.68 O ATOM 1760 CB PRO A 430 111.271 4.445 5.687 1.00 0.81 C ATOM 1761 CG PRO A 430 112.746 4.693 5.852 1.00 1.20 C ATOM 1762 CD PRO A 430 113.439 4.113 4.650 1.00 1.04 C ATOM 0 HA PRO A 430 110.591 2.488 4.957 1.00 0.55 H new ATOM 0 HB2 PRO A 430 110.754 5.358 5.392 1.00 0.81 H new ATOM 0 HB3 PRO A 430 110.825 4.115 6.625 1.00 0.81 H new ATOM 0 HG2 PRO A 430 112.949 5.761 5.933 1.00 1.20 H new ATOM 0 HG3 PRO A 430 113.113 4.229 6.767 1.00 1.20 H new ATOM 0 HD2 PRO A 430 113.588 4.860 3.870 1.00 1.04 H new ATOM 0 HD3 PRO A 430 114.422 3.715 4.903 1.00 1.04 H new ATOM 1770 N LEU A 431 109.476 3.145 2.855 1.00 0.47 N ATOM 1771 CA LEU A 431 108.544 3.725 1.857 1.00 0.56 C ATOM 1772 C LEU A 431 107.262 4.156 2.580 1.00 0.54 C ATOM 1773 O LEU A 431 107.005 3.732 3.683 1.00 0.59 O ATOM 1774 CB LEU A 431 108.291 2.602 0.837 1.00 0.59 C ATOM 1775 CG LEU A 431 107.068 1.768 1.227 1.00 0.59 C ATOM 1776 CD1 LEU A 431 105.841 2.271 0.473 1.00 1.14 C ATOM 1777 CD2 LEU A 431 107.321 0.303 0.867 1.00 1.40 C ATOM 0 H LEU A 431 109.358 2.150 3.046 1.00 0.47 H new ATOM 0 HA LEU A 431 108.935 4.608 1.352 1.00 0.56 H new ATOM 0 HB2 LEU A 431 108.140 3.033 -0.153 1.00 0.59 H new ATOM 0 HB3 LEU A 431 109.169 1.959 0.775 1.00 0.59 H new ATOM 0 HG LEU A 431 106.894 1.859 2.299 1.00 0.59 H new ATOM 0 HD11 LEU A 431 104.972 1.675 0.753 1.00 1.14 H new ATOM 0 HD12 LEU A 431 105.661 3.316 0.726 1.00 1.14 H new ATOM 0 HD13 LEU A 431 106.011 2.182 -0.600 1.00 1.14 H new ATOM 0 HD21 LEU A 431 106.452 -0.295 1.143 1.00 1.40 H new ATOM 0 HD22 LEU A 431 107.495 0.217 -0.206 1.00 1.40 H new ATOM 0 HD23 LEU A 431 108.196 -0.058 1.407 1.00 1.40 H new ATOM 1789 N VAL A 432 106.468 4.994 1.992 1.00 0.49 N ATOM 1790 CA VAL A 432 105.230 5.428 2.697 1.00 0.48 C ATOM 1791 C VAL A 432 103.993 5.074 1.872 1.00 0.48 C ATOM 1792 O VAL A 432 103.976 5.214 0.665 1.00 0.52 O ATOM 1793 CB VAL A 432 105.368 6.940 2.845 1.00 0.43 C ATOM 1794 CG1 VAL A 432 104.148 7.496 3.584 1.00 0.45 C ATOM 1795 CG2 VAL A 432 106.635 7.261 3.642 1.00 0.51 C ATOM 0 H VAL A 432 106.614 5.396 1.066 1.00 0.49 H new ATOM 0 HA VAL A 432 105.112 4.935 3.662 1.00 0.48 H new ATOM 0 HB VAL A 432 105.433 7.396 1.857 1.00 0.43 H new ATOM 0 HG11 VAL A 432 104.248 8.576 3.689 1.00 0.45 H new ATOM 0 HG12 VAL A 432 103.245 7.268 3.018 1.00 0.45 H new ATOM 0 HG13 VAL A 432 104.082 7.040 4.572 1.00 0.45 H new ATOM 0 HG21 VAL A 432 106.734 8.341 3.748 1.00 0.51 H new ATOM 0 HG22 VAL A 432 106.569 6.804 4.629 1.00 0.51 H new ATOM 0 HG23 VAL A 432 107.505 6.867 3.117 1.00 0.51 H new ATOM 1805 N VAL A 433 102.957 4.619 2.520 1.00 0.44 N ATOM 1806 CA VAL A 433 101.709 4.258 1.791 1.00 0.45 C ATOM 1807 C VAL A 433 100.551 5.110 2.306 1.00 0.37 C ATOM 1808 O VAL A 433 100.362 5.253 3.500 1.00 0.37 O ATOM 1809 CB VAL A 433 101.473 2.785 2.123 1.00 0.56 C ATOM 1810 CG1 VAL A 433 100.373 2.227 1.218 1.00 0.59 C ATOM 1811 CG2 VAL A 433 102.766 1.999 1.900 1.00 1.08 C ATOM 0 H VAL A 433 102.921 4.481 3.530 1.00 0.44 H new ATOM 0 HA VAL A 433 101.786 4.426 0.717 1.00 0.45 H new ATOM 0 HB VAL A 433 101.167 2.692 3.165 1.00 0.56 H new ATOM 0 HG11 VAL A 433 100.205 1.176 1.455 1.00 0.59 H new ATOM 0 HG12 VAL A 433 99.452 2.787 1.378 1.00 0.59 H new ATOM 0 HG13 VAL A 433 100.678 2.319 0.176 1.00 0.59 H new ATOM 0 HG21 VAL A 433 102.598 0.948 2.137 1.00 1.08 H new ATOM 0 HG22 VAL A 433 103.073 2.092 0.858 1.00 1.08 H new ATOM 0 HG23 VAL A 433 103.549 2.396 2.546 1.00 1.08 H new ATOM 1821 N VAL A 434 99.733 5.617 1.424 1.00 0.43 N ATOM 1822 CA VAL A 434 98.547 6.391 1.884 1.00 0.43 C ATOM 1823 C VAL A 434 97.281 5.921 1.178 1.00 0.48 C ATOM 1824 O VAL A 434 97.299 5.528 0.030 1.00 0.90 O ATOM 1825 CB VAL A 434 98.832 7.855 1.536 1.00 0.53 C ATOM 1826 CG1 VAL A 434 100.284 8.191 1.873 1.00 0.70 C ATOM 1827 CG2 VAL A 434 98.581 8.100 0.044 1.00 0.49 C ATOM 0 H VAL A 434 99.834 5.529 0.413 1.00 0.43 H new ATOM 0 HA VAL A 434 98.385 6.254 2.953 1.00 0.43 H new ATOM 0 HB VAL A 434 98.167 8.493 2.118 1.00 0.53 H new ATOM 0 HG11 VAL A 434 100.483 9.233 1.624 1.00 0.70 H new ATOM 0 HG12 VAL A 434 100.456 8.033 2.938 1.00 0.70 H new ATOM 0 HG13 VAL A 434 100.949 7.547 1.298 1.00 0.70 H new ATOM 0 HG21 VAL A 434 98.787 9.144 -0.193 1.00 0.49 H new ATOM 0 HG22 VAL A 434 99.236 7.458 -0.545 1.00 0.49 H new ATOM 0 HG23 VAL A 434 97.542 7.872 -0.192 1.00 0.49 H new ATOM 1837 N GLU A 435 96.172 6.104 1.819 1.00 0.61 N ATOM 1838 CA GLU A 435 94.870 5.833 1.156 1.00 0.60 C ATOM 1839 C GLU A 435 94.307 7.139 0.620 1.00 0.62 C ATOM 1840 O GLU A 435 94.334 8.152 1.291 1.00 0.67 O ATOM 1841 CB GLU A 435 93.971 5.273 2.255 1.00 0.70 C ATOM 1842 CG GLU A 435 93.982 3.748 2.179 1.00 0.76 C ATOM 1843 CD GLU A 435 93.013 3.175 3.213 1.00 1.13 C ATOM 1844 OE1 GLU A 435 92.472 3.952 3.983 1.00 1.79 O ATOM 1845 OE2 GLU A 435 92.827 1.969 3.218 1.00 1.34 O ATOM 0 H GLU A 435 96.106 6.432 2.782 1.00 0.61 H new ATOM 0 HA GLU A 435 94.956 5.139 0.320 1.00 0.60 H new ATOM 0 HB2 GLU A 435 94.322 5.604 3.233 1.00 0.70 H new ATOM 0 HB3 GLU A 435 92.954 5.648 2.137 1.00 0.70 H new ATOM 0 HG2 GLU A 435 93.697 3.422 1.179 1.00 0.76 H new ATOM 0 HG3 GLU A 435 94.989 3.372 2.362 1.00 0.76 H new ATOM 1852 N GLY A 436 93.906 7.169 -0.612 1.00 0.61 N ATOM 1853 CA GLY A 436 93.481 8.469 -1.187 1.00 0.64 C ATOM 1854 C GLY A 436 94.573 9.504 -0.906 1.00 0.68 C ATOM 1855 O GLY A 436 95.637 9.473 -1.491 1.00 1.42 O ATOM 0 H GLY A 436 93.853 6.366 -1.239 1.00 0.61 H new ATOM 0 HA2 GLY A 436 93.317 8.373 -2.260 1.00 0.64 H new ATOM 0 HA3 GLY A 436 92.536 8.787 -0.747 1.00 0.64 H new ATOM 1859 N SER A 437 94.305 10.439 -0.036 1.00 0.84 N ATOM 1860 CA SER A 437 95.311 11.500 0.259 1.00 0.81 C ATOM 1861 C SER A 437 95.805 11.406 1.711 1.00 0.83 C ATOM 1862 O SER A 437 96.361 12.349 2.240 1.00 1.35 O ATOM 1863 CB SER A 437 94.563 12.813 0.041 1.00 0.80 C ATOM 1864 OG SER A 437 93.859 13.155 1.227 1.00 1.42 O ATOM 0 H SER A 437 93.431 10.515 0.485 1.00 0.84 H new ATOM 0 HA SER A 437 96.194 11.408 -0.374 1.00 0.81 H new ATOM 0 HB2 SER A 437 95.264 13.605 -0.221 1.00 0.80 H new ATOM 0 HB3 SER A 437 93.868 12.715 -0.793 1.00 0.80 H new ATOM 0 HG SER A 437 93.379 13.999 1.091 1.00 1.42 H new ATOM 1870 N ARG A 438 95.566 10.308 2.383 1.00 0.53 N ATOM 1871 CA ARG A 438 95.981 10.217 3.815 1.00 0.62 C ATOM 1872 C ARG A 438 96.868 8.986 4.035 1.00 0.65 C ATOM 1873 O ARG A 438 96.682 7.956 3.417 1.00 0.69 O ATOM 1874 CB ARG A 438 94.672 10.092 4.594 1.00 0.78 C ATOM 1875 CG ARG A 438 94.145 8.662 4.488 1.00 1.34 C ATOM 1876 CD ARG A 438 92.676 8.629 4.904 1.00 1.53 C ATOM 1877 NE ARG A 438 92.326 7.183 4.975 1.00 2.25 N ATOM 1878 CZ ARG A 438 92.687 6.469 6.009 1.00 2.95 C ATOM 1879 NH1 ARG A 438 93.361 7.018 6.985 1.00 3.49 N ATOM 1880 NH2 ARG A 438 92.373 5.204 6.066 1.00 3.52 N ATOM 0 H ARG A 438 95.106 9.479 2.007 1.00 0.53 H new ATOM 0 HA ARG A 438 96.564 11.081 4.135 1.00 0.62 H new ATOM 0 HB2 ARG A 438 94.833 10.354 5.640 1.00 0.78 H new ATOM 0 HB3 ARG A 438 93.935 10.792 4.200 1.00 0.78 H new ATOM 0 HG2 ARG A 438 94.253 8.298 3.466 1.00 1.34 H new ATOM 0 HG3 ARG A 438 94.730 7.999 5.126 1.00 1.34 H new ATOM 0 HD2 ARG A 438 92.528 9.118 5.867 1.00 1.53 H new ATOM 0 HD3 ARG A 438 92.050 9.151 4.181 1.00 1.53 H new ATOM 0 HE ARG A 438 91.803 6.748 4.215 1.00 2.25 H new ATOM 0 HH11 ARG A 438 93.607 8.007 6.942 1.00 3.49 H new ATOM 0 HH12 ARG A 438 93.641 6.458 7.790 1.00 3.49 H new ATOM 0 HH21 ARG A 438 91.847 4.774 5.305 1.00 3.52 H new ATOM 0 HH22 ARG A 438 92.653 4.645 6.872 1.00 3.52 H new ATOM 1894 N VAL A 439 97.884 9.121 4.839 1.00 0.67 N ATOM 1895 CA VAL A 439 98.863 8.009 5.009 1.00 0.74 C ATOM 1896 C VAL A 439 98.311 6.921 5.933 1.00 0.93 C ATOM 1897 O VAL A 439 97.950 7.177 7.064 1.00 1.41 O ATOM 1898 CB VAL A 439 100.093 8.664 5.639 1.00 0.89 C ATOM 1899 CG1 VAL A 439 101.216 7.633 5.762 1.00 0.99 C ATOM 1900 CG2 VAL A 439 100.560 9.824 4.757 1.00 0.86 C ATOM 0 H VAL A 439 98.081 9.957 5.389 1.00 0.67 H new ATOM 0 HA VAL A 439 99.087 7.522 4.060 1.00 0.74 H new ATOM 0 HB VAL A 439 99.836 9.040 6.630 1.00 0.89 H new ATOM 0 HG11 VAL A 439 102.092 8.101 6.211 1.00 0.99 H new ATOM 0 HG12 VAL A 439 100.884 6.807 6.390 1.00 0.99 H new ATOM 0 HG13 VAL A 439 101.474 7.256 4.772 1.00 0.99 H new ATOM 0 HG21 VAL A 439 101.437 10.292 5.205 1.00 0.86 H new ATOM 0 HG22 VAL A 439 100.816 9.448 3.766 1.00 0.86 H new ATOM 0 HG23 VAL A 439 99.761 10.560 4.670 1.00 0.86 H new ATOM 1910 N LEU A 440 98.335 5.689 5.491 1.00 0.79 N ATOM 1911 CA LEU A 440 97.913 4.574 6.387 1.00 1.07 C ATOM 1912 C LEU A 440 99.101 4.084 7.220 1.00 0.74 C ATOM 1913 O LEU A 440 98.947 3.703 8.361 1.00 0.88 O ATOM 1914 CB LEU A 440 97.389 3.456 5.474 1.00 1.60 C ATOM 1915 CG LEU A 440 98.332 3.238 4.289 1.00 1.48 C ATOM 1916 CD1 LEU A 440 98.514 1.739 4.050 1.00 1.79 C ATOM 1917 CD2 LEU A 440 97.722 3.876 3.042 1.00 1.57 C ATOM 0 H LEU A 440 98.627 5.410 4.554 1.00 0.79 H new ATOM 0 HA LEU A 440 97.142 4.897 7.087 1.00 1.07 H new ATOM 0 HB2 LEU A 440 97.292 2.531 6.043 1.00 1.60 H new ATOM 0 HB3 LEU A 440 96.394 3.713 5.111 1.00 1.60 H new ATOM 0 HG LEU A 440 99.300 3.692 4.503 1.00 1.48 H new ATOM 0 HD11 LEU A 440 99.186 1.584 3.206 1.00 1.79 H new ATOM 0 HD12 LEU A 440 98.939 1.277 4.941 1.00 1.79 H new ATOM 0 HD13 LEU A 440 97.547 1.285 3.832 1.00 1.79 H new ATOM 0 HD21 LEU A 440 98.388 3.725 2.193 1.00 1.57 H new ATOM 0 HD22 LEU A 440 96.757 3.415 2.832 1.00 1.57 H new ATOM 0 HD23 LEU A 440 97.585 4.944 3.210 1.00 1.57 H new ATOM 1929 N GLY A 441 100.296 4.131 6.686 1.00 0.64 N ATOM 1930 CA GLY A 441 101.473 3.707 7.502 1.00 1.02 C ATOM 1931 C GLY A 441 102.761 3.780 6.678 1.00 0.82 C ATOM 1932 O GLY A 441 102.763 4.185 5.535 1.00 0.96 O ATOM 0 H GLY A 441 100.505 4.439 5.736 1.00 0.64 H new ATOM 0 HA2 GLY A 441 101.561 4.346 8.380 1.00 1.02 H new ATOM 0 HA3 GLY A 441 101.324 2.689 7.862 1.00 1.02 H new ATOM 1936 N VAL A 442 103.860 3.382 7.264 1.00 0.56 N ATOM 1937 CA VAL A 442 105.166 3.412 6.540 1.00 0.44 C ATOM 1938 C VAL A 442 105.746 1.995 6.467 1.00 0.41 C ATOM 1939 O VAL A 442 105.379 1.130 7.237 1.00 0.41 O ATOM 1940 CB VAL A 442 106.062 4.310 7.387 1.00 0.42 C ATOM 1941 CG1 VAL A 442 107.417 4.464 6.702 1.00 0.44 C ATOM 1942 CG2 VAL A 442 105.409 5.687 7.539 1.00 0.57 C ATOM 0 H VAL A 442 103.909 3.034 8.222 1.00 0.56 H new ATOM 0 HA VAL A 442 105.072 3.778 5.518 1.00 0.44 H new ATOM 0 HB VAL A 442 106.199 3.863 8.371 1.00 0.42 H new ATOM 0 HG11 VAL A 442 108.059 5.105 7.306 1.00 0.44 H new ATOM 0 HG12 VAL A 442 107.883 3.485 6.592 1.00 0.44 H new ATOM 0 HG13 VAL A 442 107.278 4.912 5.718 1.00 0.44 H new ATOM 0 HG21 VAL A 442 106.049 6.329 8.144 1.00 0.57 H new ATOM 0 HG22 VAL A 442 105.272 6.135 6.555 1.00 0.57 H new ATOM 0 HG23 VAL A 442 104.440 5.578 8.026 1.00 0.57 H new ATOM 1952 N ILE A 443 106.572 1.716 5.493 1.00 0.42 N ATOM 1953 CA ILE A 443 107.069 0.316 5.329 1.00 0.43 C ATOM 1954 C ILE A 443 108.598 0.273 5.385 1.00 0.44 C ATOM 1955 O ILE A 443 109.272 0.952 4.642 1.00 0.51 O ATOM 1956 CB ILE A 443 106.594 -0.118 3.946 1.00 0.47 C ATOM 1957 CG1 ILE A 443 105.141 0.319 3.729 1.00 0.51 C ATOM 1958 CG2 ILE A 443 106.689 -1.634 3.827 1.00 0.56 C ATOM 1959 CD1 ILE A 443 104.258 -0.250 4.841 1.00 1.05 C ATOM 0 H ILE A 443 106.922 2.388 4.810 1.00 0.42 H new ATOM 0 HA ILE A 443 106.699 -0.334 6.122 1.00 0.43 H new ATOM 0 HB ILE A 443 107.225 0.350 3.191 1.00 0.47 H new ATOM 0 HG12 ILE A 443 105.076 1.407 3.721 1.00 0.51 H new ATOM 0 HG13 ILE A 443 104.788 -0.028 2.758 1.00 0.51 H new ATOM 0 HG21 ILE A 443 106.349 -1.943 2.839 1.00 0.56 H new ATOM 0 HG22 ILE A 443 107.724 -1.946 3.969 1.00 0.56 H new ATOM 0 HG23 ILE A 443 106.062 -2.099 4.588 1.00 0.56 H new ATOM 0 HD11 ILE A 443 103.226 0.063 4.682 1.00 1.05 H new ATOM 0 HD12 ILE A 443 104.313 -1.339 4.828 1.00 1.05 H new ATOM 0 HD13 ILE A 443 104.605 0.119 5.806 1.00 1.05 H new ATOM 1971 N ALA A 444 109.141 -0.552 6.227 1.00 0.40 N ATOM 1972 CA ALA A 444 110.625 -0.682 6.303 1.00 0.44 C ATOM 1973 C ALA A 444 111.089 -1.898 5.499 1.00 0.43 C ATOM 1974 O ALA A 444 110.650 -3.004 5.733 1.00 0.45 O ATOM 1975 CB ALA A 444 110.921 -0.889 7.788 1.00 0.46 C ATOM 0 H ALA A 444 108.622 -1.148 6.872 1.00 0.40 H new ATOM 0 HA ALA A 444 111.139 0.188 5.895 1.00 0.44 H new ATOM 0 HB1 ALA A 444 111.996 -0.994 7.933 1.00 0.46 H new ATOM 0 HB2 ALA A 444 110.561 -0.030 8.354 1.00 0.46 H new ATOM 0 HB3 ALA A 444 110.418 -1.791 8.137 1.00 0.46 H new ATOM 1981 N LEU A 445 111.934 -1.703 4.525 1.00 0.57 N ATOM 1982 CA LEU A 445 112.370 -2.857 3.687 1.00 0.63 C ATOM 1983 C LEU A 445 113.780 -3.302 4.074 1.00 0.75 C ATOM 1984 O LEU A 445 114.696 -2.506 4.116 1.00 0.92 O ATOM 1985 CB LEU A 445 112.366 -2.334 2.252 1.00 0.81 C ATOM 1986 CG LEU A 445 110.953 -2.416 1.677 1.00 1.23 C ATOM 1987 CD1 LEU A 445 109.957 -1.826 2.676 1.00 2.11 C ATOM 1988 CD2 LEU A 445 110.891 -1.624 0.370 1.00 1.91 C ATOM 0 H LEU A 445 112.340 -0.802 4.273 1.00 0.57 H new ATOM 0 HA LEU A 445 111.715 -3.718 3.817 1.00 0.63 H new ATOM 0 HB2 LEU A 445 112.719 -1.303 2.230 1.00 0.81 H new ATOM 0 HB3 LEU A 445 113.052 -2.919 1.640 1.00 0.81 H new ATOM 0 HG LEU A 445 110.699 -3.459 1.486 1.00 1.23 H new ATOM 0 HD11 LEU A 445 108.950 -1.885 2.264 1.00 2.11 H new ATOM 0 HD12 LEU A 445 110.001 -2.388 3.609 1.00 2.11 H new ATOM 0 HD13 LEU A 445 110.209 -0.783 2.868 1.00 2.11 H new ATOM 0 HD21 LEU A 445 109.884 -1.681 -0.042 1.00 1.91 H new ATOM 0 HD22 LEU A 445 111.146 -0.582 0.564 1.00 1.91 H new ATOM 0 HD23 LEU A 445 111.600 -2.044 -0.344 1.00 1.91 H new ATOM 2000 N LYS A 446 113.989 -4.585 4.176 1.00 0.89 N ATOM 2001 CA LYS A 446 115.369 -5.107 4.349 1.00 1.15 C ATOM 2002 C LYS A 446 115.994 -5.352 2.977 1.00 1.27 C ATOM 2003 O LYS A 446 115.326 -5.755 2.048 1.00 1.87 O ATOM 2004 CB LYS A 446 115.192 -6.424 5.090 1.00 1.92 C ATOM 2005 CG LYS A 446 116.549 -6.942 5.558 1.00 2.25 C ATOM 2006 CD LYS A 446 116.357 -8.312 6.205 1.00 2.85 C ATOM 2007 CE LYS A 446 117.662 -8.753 6.872 1.00 3.64 C ATOM 2008 NZ LYS A 446 117.283 -9.091 8.271 1.00 4.48 N ATOM 0 H LYS A 446 113.258 -5.296 4.147 1.00 0.89 H new ATOM 0 HA LYS A 446 116.019 -4.418 4.888 1.00 1.15 H new ATOM 0 HB2 LYS A 446 114.531 -6.284 5.946 1.00 1.92 H new ATOM 0 HB3 LYS A 446 114.718 -7.158 4.438 1.00 1.92 H new ATOM 0 HG2 LYS A 446 117.236 -7.016 4.715 1.00 2.25 H new ATOM 0 HG3 LYS A 446 116.993 -6.247 6.271 1.00 2.25 H new ATOM 0 HD2 LYS A 446 115.556 -8.268 6.943 1.00 2.85 H new ATOM 0 HD3 LYS A 446 116.057 -9.042 5.453 1.00 2.85 H new ATOM 0 HE2 LYS A 446 118.095 -9.613 6.362 1.00 3.64 H new ATOM 0 HE3 LYS A 446 118.407 -7.958 6.846 1.00 3.64 H new ATOM 0 HZ1 LYS A 446 118.126 -9.403 8.793 1.00 4.48 H new ATOM 0 HZ2 LYS A 446 116.880 -8.252 8.734 1.00 4.48 H new ATOM 0 HZ3 LYS A 446 116.578 -9.855 8.265 1.00 4.48 H new ATOM 2022 N ASP A 447 117.264 -5.115 2.837 1.00 1.33 N ATOM 2023 CA ASP A 447 117.914 -5.347 1.517 1.00 2.04 C ATOM 2024 C ASP A 447 118.567 -6.731 1.483 1.00 1.83 C ATOM 2025 O ASP A 447 119.219 -7.143 2.421 1.00 2.21 O ATOM 2026 CB ASP A 447 118.970 -4.252 1.392 1.00 2.93 C ATOM 2027 CG ASP A 447 118.285 -2.885 1.335 1.00 3.02 C ATOM 2028 OD1 ASP A 447 117.085 -2.854 1.122 1.00 2.75 O ATOM 2029 OD2 ASP A 447 118.974 -1.892 1.506 1.00 3.91 O ATOM 0 H ASP A 447 117.880 -4.772 3.574 1.00 1.33 H new ATOM 0 HA ASP A 447 117.198 -5.314 0.696 1.00 2.04 H new ATOM 0 HB2 ASP A 447 119.653 -4.293 2.240 1.00 2.93 H new ATOM 0 HB3 ASP A 447 119.567 -4.409 0.494 1.00 2.93 H new ATOM 2034 N ILE A 448 118.418 -7.441 0.399 1.00 2.00 N ATOM 2035 CA ILE A 448 119.058 -8.784 0.296 1.00 2.26 C ATOM 2036 C ILE A 448 120.562 -8.651 0.487 1.00 2.39 C ATOM 2037 O ILE A 448 121.179 -9.368 1.250 1.00 2.75 O ATOM 2038 CB ILE A 448 118.753 -9.255 -1.128 1.00 2.53 C ATOM 2039 CG1 ILE A 448 117.255 -9.095 -1.437 1.00 3.34 C ATOM 2040 CG2 ILE A 448 119.151 -10.721 -1.272 1.00 2.71 C ATOM 2041 CD1 ILE A 448 116.420 -9.454 -0.207 1.00 3.61 C ATOM 0 H ILE A 448 117.882 -7.151 -0.419 1.00 2.00 H new ATOM 0 HA ILE A 448 118.690 -9.480 1.049 1.00 2.26 H new ATOM 0 HB ILE A 448 119.322 -8.647 -1.831 1.00 2.53 H new ATOM 0 HG12 ILE A 448 117.046 -8.069 -1.740 1.00 3.34 H new ATOM 0 HG13 ILE A 448 116.978 -9.737 -2.273 1.00 3.34 H new ATOM 0 HG21 ILE A 448 118.935 -11.059 -2.285 1.00 2.71 H new ATOM 0 HG22 ILE A 448 120.217 -10.830 -1.073 1.00 2.71 H new ATOM 0 HG23 ILE A 448 118.586 -11.323 -0.560 1.00 2.71 H new ATOM 0 HD11 ILE A 448 115.361 -9.337 -0.439 1.00 3.61 H new ATOM 0 HD12 ILE A 448 116.617 -10.488 0.077 1.00 3.61 H new ATOM 0 HD13 ILE A 448 116.686 -8.794 0.619 1.00 3.61 H new ATOM 2053 N VAL A 449 121.152 -7.748 -0.232 1.00 2.65 N ATOM 2054 CA VAL A 449 122.628 -7.555 -0.144 1.00 3.38 C ATOM 2055 C VAL A 449 122.952 -6.319 0.699 1.00 3.99 C ATOM 2056 O VAL A 449 122.394 -5.259 0.501 1.00 4.70 O ATOM 2057 CB VAL A 449 123.081 -7.349 -1.588 1.00 4.18 C ATOM 2058 CG1 VAL A 449 124.605 -7.226 -1.633 1.00 5.09 C ATOM 2059 CG2 VAL A 449 122.642 -8.546 -2.436 1.00 4.27 C ATOM 0 H VAL A 449 120.675 -7.126 -0.885 1.00 2.65 H new ATOM 0 HA VAL A 449 123.129 -8.400 0.328 1.00 3.38 H new ATOM 0 HB VAL A 449 122.631 -6.438 -1.983 1.00 4.18 H new ATOM 0 HG11 VAL A 449 124.928 -7.079 -2.664 1.00 5.09 H new ATOM 0 HG12 VAL A 449 124.919 -6.375 -1.029 1.00 5.09 H new ATOM 0 HG13 VAL A 449 125.055 -8.137 -1.238 1.00 5.09 H new ATOM 0 HG21 VAL A 449 122.965 -8.400 -3.467 1.00 4.27 H new ATOM 0 HG22 VAL A 449 123.092 -9.457 -2.041 1.00 4.27 H new ATOM 0 HG23 VAL A 449 121.556 -8.635 -2.405 1.00 4.27 H new ATOM 2069 N LYS A 450 123.899 -6.428 1.590 1.00 4.08 N ATOM 2070 CA LYS A 450 124.314 -5.237 2.384 1.00 5.12 C ATOM 2071 C LYS A 450 125.820 -5.283 2.655 1.00 5.65 C ATOM 2072 O LYS A 450 126.352 -6.282 3.096 1.00 6.68 O ATOM 2073 CB LYS A 450 123.527 -5.334 3.692 1.00 5.87 C ATOM 2074 CG LYS A 450 123.798 -4.093 4.545 1.00 5.93 C ATOM 2075 CD LYS A 450 123.059 -4.218 5.878 1.00 6.39 C ATOM 2076 CE LYS A 450 123.194 -2.910 6.661 1.00 6.77 C ATOM 2077 NZ LYS A 450 122.887 -3.273 8.073 1.00 7.50 N ATOM 0 H LYS A 450 124.403 -7.289 1.802 1.00 4.08 H new ATOM 0 HA LYS A 450 124.114 -4.302 1.861 1.00 5.12 H new ATOM 0 HB2 LYS A 450 122.461 -5.418 3.482 1.00 5.87 H new ATOM 0 HB3 LYS A 450 123.816 -6.233 4.237 1.00 5.87 H new ATOM 0 HG2 LYS A 450 124.869 -3.985 4.719 1.00 5.93 H new ATOM 0 HG3 LYS A 450 123.469 -3.197 4.018 1.00 5.93 H new ATOM 0 HD2 LYS A 450 122.007 -4.443 5.703 1.00 6.39 H new ATOM 0 HD3 LYS A 450 123.469 -5.045 6.457 1.00 6.39 H new ATOM 0 HE2 LYS A 450 124.198 -2.497 6.569 1.00 6.77 H new ATOM 0 HE3 LYS A 450 122.503 -2.154 6.289 1.00 6.77 H new ATOM 0 HZ1 LYS A 450 122.959 -2.426 8.673 1.00 7.50 H new ATOM 0 HZ2 LYS A 450 121.922 -3.657 8.131 1.00 7.50 H new ATOM 0 HZ3 LYS A 450 123.565 -3.989 8.403 1.00 7.50 H new ATOM 2091 N GLY A 451 126.512 -4.207 2.393 1.00 5.14 N ATOM 2092 CA GLY A 451 127.982 -4.190 2.635 1.00 5.92 C ATOM 2093 C GLY A 451 128.373 -2.877 3.314 1.00 6.73 C ATOM 2094 O GLY A 451 128.866 -2.932 4.429 1.00 7.01 O ATOM 2095 OXT GLY A 451 128.174 -1.836 2.707 1.00 7.30 O ATOM 0 H GLY A 451 126.123 -3.340 2.022 1.00 5.14 H new ATOM 0 HA2 GLY A 451 128.268 -5.035 3.262 1.00 5.92 H new ATOM 0 HA3 GLY A 451 128.518 -4.297 1.692 1.00 5.92 H new TER 2099 GLY A 451 HETATM 2100 PG ANP A1001 119.054 1.635 -8.784 1.00 0.00 P HETATM 2101 O1G ANP A1001 118.909 2.561 -9.965 1.00 0.00 O HETATM 2102 O2G ANP A1001 120.191 2.065 -7.894 1.00 0.00 O HETATM 2103 O3G ANP A1001 119.224 0.206 -9.231 1.00 0.00 O HETATM 2104 PB ANP A1001 116.924 3.139 -7.974 1.00 0.00 P HETATM 2105 O1B ANP A1001 117.602 4.075 -7.014 1.00 0.00 O HETATM 2106 O2B ANP A1001 116.973 3.646 -9.387 1.00 0.00 O HETATM 2107 N3B ANP A1001 117.695 1.718 -7.922 1.00 0.00 N HETATM 2108 PA ANP A1001 115.127 1.736 -6.283 1.00 0.00 P HETATM 2109 O1A ANP A1001 114.453 0.523 -6.808 1.00 0.00 O HETATM 2110 O2A ANP A1001 116.375 1.506 -5.518 1.00 0.00 O HETATM 2111 O3A ANP A1001 115.430 2.750 -7.507 1.00 0.00 O HETATM 2112 O5' ANP A1001 114.085 2.571 -5.368 1.00 0.00 O HETATM 2113 C5' ANP A1001 112.678 2.681 -5.682 1.00 0.00 C HETATM 2114 C4' ANP A1001 111.892 3.025 -4.425 1.00 0.00 C HETATM 2115 O4' ANP A1001 110.479 2.866 -4.723 1.00 0.00 O HETATM 2116 C3' ANP A1001 112.272 1.920 -3.459 1.00 0.00 C HETATM 2117 O3' ANP A1001 113.429 2.249 -2.701 1.00 0.00 O HETATM 2118 C2' ANP A1001 111.052 1.839 -2.581 1.00 0.00 C HETATM 2119 O2' ANP A1001 111.138 2.733 -1.478 1.00 0.00 O HETATM 2120 C1' ANP A1001 109.923 2.248 -3.527 1.00 0.00 C HETATM 2121 N9 ANP A1001 109.151 1.038 -3.980 1.00 0.00 N HETATM 2122 C8 ANP A1001 109.624 -0.216 -3.997 1.00 0.00 C HETATM 2123 N7 ANP A1001 108.689 -1.062 -4.435 1.00 0.00 N HETATM 2124 C5 ANP A1001 107.602 -0.354 -4.710 1.00 0.00 C HETATM 2125 C6 ANP A1001 106.292 -0.645 -5.185 1.00 0.00 C HETATM 2126 N6 ANP A1001 105.937 -1.895 -5.450 1.00 0.00 N HETATM 2127 N1 ANP A1001 105.382 0.374 -5.360 1.00 0.00 N HETATM 2128 C2 ANP A1001 105.674 1.684 -5.094 1.00 0.00 C HETATM 2129 N3 ANP A1001 106.930 1.981 -4.644 1.00 0.00 N HETATM 2130 C4 ANP A1001 107.892 1.001 -4.430 1.00 0.00 C HETATM 0 HO3' ANP A1001 114.156 2.502 -3.307 1.00 0.00 H new HETATM 0 HO2' ANP A1001 112.069 2.796 -1.180 1.00 0.00 H new HETATM 0 HNB1 ANP A1001 117.345 0.928 -7.380 1.00 0.00 H new HETATM 0 HN62 ANP A1001 104.997 -2.097 -5.790 1.00 0.00 H new HETATM 0 HN61 ANP A1001 106.604 -2.654 -5.314 1.00 0.00 H new HETATM 0 H5'2 ANP A1001 112.525 3.450 -6.439 1.00 0.00 H new HETATM 0 H5'1 ANP A1001 112.316 1.743 -6.102 1.00 0.00 H new HETATM 0 H8 ANP A1001 110.631 -0.504 -3.695 1.00 0.00 H new HETATM 0 H4' ANP A1001 112.086 4.031 -4.053 1.00 0.00 H new HETATM 0 H3' ANP A1001 112.528 0.983 -3.954 1.00 0.00 H new HETATM 0 H2' ANP A1001 110.915 0.853 -2.138 1.00 0.00 H new HETATM 0 H2 ANP A1001 104.928 2.466 -5.236 1.00 0.00 H new HETATM 0 H1' ANP A1001 109.274 2.939 -2.989 1.00 0.00 H new