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= -2.89! K(o=-3.4!,f=-1.8) USER MOD Set 1.2: A 408 ASN : amide:sc= -0.536 K(o=-3.4,f=-1.9) USER MOD Set 2.1: A 378 THR OG1 : rot -170:sc= 1 USER MOD Set 2.2: A 381 SER OG : rot -85:sc= 1.22 USER MOD Set 2.3: A 383 MET CE :methyl -123:sc= -4.23! (180deg=-6.53!) USER MOD Single : A 316 ASN : amide:sc= -0.0784 X(o=-0.078,f=0) USER MOD Single : A 318 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 320 SER OG : rot -150:sc= -0.0671 USER MOD Single : A 326 GLN : amide:sc= -0.625 K(o=-0.62,f=-2.4!) USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 332 THR OG1 : rot -170:sc= -0.451 USER MOD Single : A 338 GLN : amide:sc= -15.8! C(o=-16!,f=-32!) USER MOD Single : A 341 SER OG : rot -9:sc= -3.97! USER MOD Single : A 346 THR OG1 : rot -31:sc= 0.127 USER MOD Single : A 351 SER OG : rot -168:sc= -1.59! USER MOD Single : A 357 LYS NZ :NH3+ -137:sc= 0.873 (180deg=0.0678) USER MOD Single : A 358 GLN : amide:sc= -0.146 X(o=-0.15,f=0) USER MOD Single : A 361 ASN : amide:sc= -1.78! C(o=-1.8!,f=-5.4!) USER MOD Single : A 368 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 369 SER OG : rot 180:sc= 0 USER MOD Single : A 371 HIS : no HD1:sc= -0.0562 X(o=-0.056,f=-0.029) 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 384 SER OG : rot -135:sc= 1.34 USER MOD Single : A 387 ASN : amide:sc= -4.99! K(o=-5!,f=-2.4) USER MOD Single : A 390 ASN : amide:sc= -0.159 K(o=-0.16,f=-2.4!) USER MOD Single : A 392 MET CE :methyl -141:sc= -0.607 (180deg=-2.73!) USER MOD Single : A 395 LYS NZ :NH3+ -178:sc= -11.4! (180deg=-11.5!) USER MOD Single : A 397 SER OG : rot -130:sc= -0.116 USER MOD Single : A 411 HIS : no HD1:sc= -0.462 K(o=-0.46,f=-1.3) USER MOD Single : A 414 THR OG1 : rot 180:sc= 0 USER MOD Single : A 418 GLN : amide:sc= -2.48! C(o=-2.5!,f=-3.1!) USER MOD Single : A 419 LYS NZ :NH3+ 141:sc= -1.05! (180deg=-2.04!) USER MOD Single : A 422 GLN : amide:sc= -1.96! K(o=-2!,f=-1.2) USER MOD Single : A 426 GLN : amide:sc=-0.00259 K(o=-0.0026,f=-1.7!) 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 -16:sc= -4.87! USER MOD Single : A1001 ANP O3' : rot -82:sc= 0.43 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 316 115.909 -9.356 -4.157 1.00 4.45 N ATOM 2 CA ASN A 316 116.409 -7.972 -3.913 1.00 3.89 C ATOM 3 C ASN A 316 115.629 -7.320 -2.771 1.00 2.72 C ATOM 4 O ASN A 316 114.975 -7.985 -1.992 1.00 2.74 O ATOM 5 CB ASN A 316 116.165 -7.223 -5.221 1.00 4.56 C ATOM 6 CG ASN A 316 116.790 -8.002 -6.380 1.00 5.35 C ATOM 7 OD1 ASN A 316 116.175 -8.173 -7.414 1.00 5.50 O ATOM 8 ND2 ASN A 316 117.996 -8.484 -6.251 1.00 6.08 N ATOM 0 HA ASN A 316 117.461 -7.961 -3.627 1.00 3.89 H new ATOM 0 HB2 ASN A 316 115.095 -7.099 -5.387 1.00 4.56 H new ATOM 0 HB3 ASN A 316 116.597 -6.224 -5.166 1.00 4.56 H new ATOM 0 HD21 ASN A 316 118.422 -9.004 -7.018 1.00 6.08 H new ATOM 0 HD22 ASN A 316 118.512 -8.341 -5.383 1.00 6.08 H new ATOM 15 N ARG A 317 115.742 -6.028 -2.634 1.00 2.20 N ATOM 16 CA ARG A 317 115.066 -5.331 -1.502 1.00 1.30 C ATOM 17 C ARG A 317 113.656 -5.888 -1.298 1.00 1.48 C ATOM 18 O ARG A 317 112.971 -6.238 -2.238 1.00 1.26 O ATOM 19 CB ARG A 317 115.007 -3.861 -1.921 1.00 1.52 C ATOM 20 CG ARG A 317 116.428 -3.304 -2.033 1.00 2.49 C ATOM 21 CD ARG A 317 116.367 -1.808 -2.348 1.00 3.27 C ATOM 22 NE ARG A 317 117.774 -1.421 -2.648 1.00 4.34 N ATOM 23 CZ ARG A 317 118.140 -0.168 -2.582 1.00 5.21 C ATOM 24 NH1 ARG A 317 117.274 0.754 -2.254 1.00 5.83 N ATOM 25 NH2 ARG A 317 119.374 0.163 -2.846 1.00 5.72 N ATOM 0 H ARG A 317 116.275 -5.422 -3.259 1.00 2.20 H new ATOM 0 HA ARG A 317 115.597 -5.467 -0.560 1.00 1.30 H new ATOM 0 HB2 ARG A 317 114.491 -3.765 -2.876 1.00 1.52 H new ATOM 0 HB3 ARG A 317 114.436 -3.287 -1.191 1.00 1.52 H new ATOM 0 HG2 ARG A 317 116.969 -3.468 -1.101 1.00 2.49 H new ATOM 0 HG3 ARG A 317 116.975 -3.829 -2.816 1.00 2.49 H new ATOM 0 HD2 ARG A 317 115.713 -1.610 -3.197 1.00 3.27 H new ATOM 0 HD3 ARG A 317 115.973 -1.242 -1.504 1.00 3.27 H new ATOM 0 HE ARG A 317 118.454 -2.136 -2.906 1.00 4.34 H new ATOM 0 HH11 ARG A 317 116.309 0.497 -2.048 1.00 5.83 H new ATOM 0 HH12 ARG A 317 117.563 1.731 -2.204 1.00 5.83 H new ATOM 0 HH21 ARG A 317 120.051 -0.555 -3.103 1.00 5.72 H new ATOM 0 HH22 ARG A 317 119.662 1.140 -2.795 1.00 5.72 H new ATOM 39 N GLN A 318 113.248 -6.028 -0.068 1.00 2.19 N ATOM 40 CA GLN A 318 111.913 -6.629 0.216 1.00 2.64 C ATOM 41 C GLN A 318 111.319 -6.029 1.492 1.00 2.16 C ATOM 42 O GLN A 318 111.999 -5.864 2.484 1.00 2.69 O ATOM 43 CB GLN A 318 112.190 -8.121 0.407 1.00 3.37 C ATOM 44 CG GLN A 318 110.984 -8.788 1.073 1.00 4.16 C ATOM 45 CD GLN A 318 111.332 -10.236 1.425 1.00 4.79 C ATOM 46 OE1 GLN A 318 112.316 -10.491 2.090 1.00 4.85 O ATOM 47 NE2 GLN A 318 110.559 -11.200 1.005 1.00 5.58 N ATOM 0 H GLN A 318 113.782 -5.752 0.756 1.00 2.19 H new ATOM 0 HA GLN A 318 111.197 -6.441 -0.584 1.00 2.64 H new ATOM 0 HB2 GLN A 318 112.391 -8.590 -0.556 1.00 3.37 H new ATOM 0 HB3 GLN A 318 113.080 -8.260 1.021 1.00 3.37 H new ATOM 0 HG2 GLN A 318 110.703 -8.241 1.973 1.00 4.16 H new ATOM 0 HG3 GLN A 318 110.124 -8.762 0.403 1.00 4.16 H new ATOM 0 HE21 GLN A 318 109.733 -10.985 0.447 1.00 5.58 H new ATOM 0 HE22 GLN A 318 110.781 -12.169 1.235 1.00 5.58 H new ATOM 56 N ALA A 319 110.038 -5.774 1.506 1.00 1.32 N ATOM 57 CA ALA A 319 109.404 -5.273 2.757 1.00 1.05 C ATOM 58 C ALA A 319 109.539 -6.311 3.865 1.00 0.89 C ATOM 59 O ALA A 319 109.216 -7.469 3.684 1.00 1.18 O ATOM 60 CB ALA A 319 107.933 -5.073 2.411 1.00 1.42 C ATOM 0 H ALA A 319 109.409 -5.890 0.712 1.00 1.32 H new ATOM 0 HA ALA A 319 109.872 -4.354 3.110 1.00 1.05 H new ATOM 0 HB1 ALA A 319 107.400 -4.704 3.287 1.00 1.42 H new ATOM 0 HB2 ALA A 319 107.845 -4.349 1.601 1.00 1.42 H new ATOM 0 HB3 ALA A 319 107.501 -6.023 2.097 1.00 1.42 H new ATOM 66 N SER A 320 109.908 -5.889 5.038 1.00 0.59 N ATOM 67 CA SER A 320 109.937 -6.843 6.178 1.00 0.64 C ATOM 68 C SER A 320 108.841 -6.501 7.193 1.00 0.49 C ATOM 69 O SER A 320 108.219 -7.376 7.762 1.00 0.50 O ATOM 70 CB SER A 320 111.323 -6.681 6.801 1.00 0.78 C ATOM 71 OG SER A 320 112.226 -7.588 6.182 1.00 1.60 O ATOM 0 H SER A 320 110.189 -4.933 5.257 1.00 0.59 H new ATOM 0 HA SER A 320 109.755 -7.869 5.858 1.00 0.64 H new ATOM 0 HB2 SER A 320 111.674 -5.657 6.674 1.00 0.78 H new ATOM 0 HB3 SER A 320 111.277 -6.871 7.873 1.00 0.78 H new ATOM 0 HG SER A 320 112.921 -7.847 6.823 1.00 1.60 H new ATOM 77 N GLU A 321 108.623 -5.239 7.453 1.00 0.45 N ATOM 78 CA GLU A 321 107.593 -4.860 8.466 1.00 0.44 C ATOM 79 C GLU A 321 106.856 -3.589 8.048 1.00 0.37 C ATOM 80 O GLU A 321 107.449 -2.646 7.575 1.00 0.35 O ATOM 81 CB GLU A 321 108.372 -4.621 9.753 1.00 0.59 C ATOM 82 CG GLU A 321 107.407 -4.199 10.860 1.00 0.73 C ATOM 83 CD GLU A 321 108.194 -3.873 12.130 1.00 1.02 C ATOM 84 OE1 GLU A 321 109.410 -3.949 12.085 1.00 1.30 O ATOM 85 OE2 GLU A 321 107.566 -3.553 13.126 1.00 1.82 O ATOM 0 H GLU A 321 109.109 -4.459 7.012 1.00 0.45 H new ATOM 0 HA GLU A 321 106.835 -5.635 8.579 1.00 0.44 H new ATOM 0 HB2 GLU A 321 108.902 -5.528 10.044 1.00 0.59 H new ATOM 0 HB3 GLU A 321 109.125 -3.848 9.597 1.00 0.59 H new ATOM 0 HG2 GLU A 321 106.832 -3.329 10.543 1.00 0.73 H new ATOM 0 HG3 GLU A 321 106.693 -4.998 11.058 1.00 0.73 H new ATOM 92 N PHE A 322 105.589 -3.515 8.335 1.00 0.40 N ATOM 93 CA PHE A 322 104.834 -2.251 8.080 1.00 0.37 C ATOM 94 C PHE A 322 104.300 -1.675 9.392 1.00 0.38 C ATOM 95 O PHE A 322 103.882 -2.397 10.275 1.00 0.42 O ATOM 96 CB PHE A 322 103.685 -2.649 7.154 1.00 0.41 C ATOM 97 CG PHE A 322 102.963 -3.844 7.725 1.00 0.52 C ATOM 98 CD1 PHE A 322 103.445 -5.134 7.473 1.00 0.94 C ATOM 99 CD2 PHE A 322 101.810 -3.665 8.503 1.00 0.67 C ATOM 100 CE1 PHE A 322 102.776 -6.247 7.998 1.00 1.14 C ATOM 101 CE2 PHE A 322 101.141 -4.779 9.028 1.00 0.87 C ATOM 102 CZ PHE A 322 101.624 -6.070 8.775 1.00 1.00 C ATOM 0 H PHE A 322 105.039 -4.275 8.736 1.00 0.40 H new ATOM 0 HA PHE A 322 105.463 -1.481 7.634 1.00 0.37 H new ATOM 0 HB2 PHE A 322 102.993 -1.815 7.038 1.00 0.41 H new ATOM 0 HB3 PHE A 322 104.070 -2.884 6.162 1.00 0.41 H new ATOM 0 HD1 PHE A 322 104.333 -5.271 6.874 1.00 0.94 H new ATOM 0 HD2 PHE A 322 101.438 -2.670 8.697 1.00 0.67 H new ATOM 0 HE1 PHE A 322 103.148 -7.242 7.804 1.00 1.14 H new ATOM 0 HE2 PHE A 322 100.253 -4.643 9.628 1.00 0.87 H new ATOM 0 HZ PHE A 322 101.108 -6.928 9.179 1.00 1.00 H new ATOM 112 N ILE A 323 104.227 -0.377 9.488 1.00 0.37 N ATOM 113 CA ILE A 323 103.622 0.247 10.703 1.00 0.41 C ATOM 114 C ILE A 323 102.587 1.302 10.303 1.00 0.43 C ATOM 115 O ILE A 323 102.793 2.051 9.368 1.00 0.53 O ATOM 116 CB ILE A 323 104.777 0.908 11.448 1.00 0.44 C ATOM 117 CG1 ILE A 323 105.996 -0.017 11.444 1.00 0.46 C ATOM 118 CG2 ILE A 323 104.346 1.174 12.890 1.00 0.48 C ATOM 119 CD1 ILE A 323 105.623 -1.352 12.089 1.00 0.52 C ATOM 0 H ILE A 323 104.558 0.279 8.781 1.00 0.37 H new ATOM 0 HA ILE A 323 103.111 -0.493 11.319 1.00 0.41 H new ATOM 0 HB ILE A 323 105.040 1.845 10.957 1.00 0.44 H new ATOM 0 HG12 ILE A 323 106.341 -0.178 10.423 1.00 0.46 H new ATOM 0 HG13 ILE A 323 106.819 0.445 11.989 1.00 0.46 H new ATOM 0 HG21 ILE A 323 105.164 1.647 13.433 1.00 0.48 H new ATOM 0 HG22 ILE A 323 103.478 1.834 12.895 1.00 0.48 H new ATOM 0 HG23 ILE A 323 104.087 0.231 13.372 1.00 0.48 H new ATOM 0 HD11 ILE A 323 106.490 -2.012 12.087 1.00 0.52 H new ATOM 0 HD12 ILE A 323 105.299 -1.182 13.116 1.00 0.52 H new ATOM 0 HD13 ILE A 323 104.813 -1.815 11.525 1.00 0.52 H new ATOM 131 N PRO A 324 101.494 1.303 11.017 1.00 0.36 N ATOM 132 CA PRO A 324 100.391 2.248 10.722 1.00 0.40 C ATOM 133 C PRO A 324 100.844 3.697 10.893 1.00 0.64 C ATOM 134 O PRO A 324 101.691 4.004 11.708 1.00 1.44 O ATOM 135 CB PRO A 324 99.313 1.919 11.750 1.00 0.33 C ATOM 136 CG PRO A 324 99.720 0.634 12.397 1.00 0.30 C ATOM 137 CD PRO A 324 101.191 0.434 12.154 1.00 0.29 C ATOM 0 HA PRO A 324 100.042 2.149 9.694 1.00 0.40 H new ATOM 0 HB2 PRO A 324 99.227 2.715 12.489 1.00 0.33 H new ATOM 0 HB3 PRO A 324 98.338 1.821 11.272 1.00 0.33 H new ATOM 0 HG2 PRO A 324 99.511 0.664 13.466 1.00 0.30 H new ATOM 0 HG3 PRO A 324 99.149 -0.198 11.984 1.00 0.30 H new ATOM 0 HD2 PRO A 324 101.779 0.707 13.030 1.00 0.29 H new ATOM 0 HD3 PRO A 324 101.418 -0.608 11.929 1.00 0.29 H new ATOM 145 N ALA A 325 100.169 4.602 10.244 1.00 0.75 N ATOM 146 CA ALA A 325 100.422 6.045 10.488 1.00 0.98 C ATOM 147 C ALA A 325 99.726 6.478 11.776 1.00 0.81 C ATOM 148 O ALA A 325 99.357 5.664 12.599 1.00 1.11 O ATOM 149 CB ALA A 325 99.814 6.763 9.284 1.00 1.58 C ATOM 0 H ALA A 325 99.448 4.401 9.551 1.00 0.75 H new ATOM 0 HA ALA A 325 101.482 6.271 10.600 1.00 0.98 H new ATOM 0 HB1 ALA A 325 99.960 7.838 9.389 1.00 1.58 H new ATOM 0 HB2 ALA A 325 100.300 6.418 8.371 1.00 1.58 H new ATOM 0 HB3 ALA A 325 98.747 6.545 9.231 1.00 1.58 H new ATOM 155 N GLN A 326 99.589 7.754 11.980 1.00 0.91 N ATOM 156 CA GLN A 326 98.967 8.243 13.242 1.00 1.48 C ATOM 157 C GLN A 326 97.510 7.774 13.337 1.00 1.32 C ATOM 158 O GLN A 326 96.624 8.347 12.734 1.00 1.83 O ATOM 159 CB GLN A 326 99.035 9.767 13.138 1.00 2.25 C ATOM 160 CG GLN A 326 98.722 10.391 14.499 1.00 3.14 C ATOM 161 CD GLN A 326 98.923 11.905 14.423 1.00 3.55 C ATOM 162 OE1 GLN A 326 99.346 12.422 13.408 1.00 4.00 O ATOM 163 NE2 GLN A 326 98.642 12.643 15.462 1.00 3.92 N ATOM 0 H GLN A 326 99.880 8.483 11.328 1.00 0.91 H new ATOM 0 HA GLN A 326 99.475 7.866 14.130 1.00 1.48 H new ATOM 0 HB2 GLN A 326 100.026 10.075 12.805 1.00 2.25 H new ATOM 0 HB3 GLN A 326 98.324 10.122 12.392 1.00 2.25 H new ATOM 0 HG2 GLN A 326 97.696 10.164 14.788 1.00 3.14 H new ATOM 0 HG3 GLN A 326 99.371 9.965 15.264 1.00 3.14 H new ATOM 0 HE21 GLN A 326 98.287 12.210 16.314 1.00 3.92 H new ATOM 0 HE22 GLN A 326 98.777 13.653 15.422 1.00 3.92 H new ATOM 172 N GLY A 327 97.243 6.793 14.160 1.00 1.28 N ATOM 173 CA GLY A 327 95.830 6.360 14.374 1.00 1.48 C ATOM 174 C GLY A 327 95.451 5.261 13.375 1.00 1.24 C ATOM 175 O GLY A 327 94.288 5.032 13.108 1.00 1.52 O ATOM 0 H GLY A 327 97.941 6.274 14.692 1.00 1.28 H new ATOM 0 HA2 GLY A 327 95.706 5.993 15.393 1.00 1.48 H new ATOM 0 HA3 GLY A 327 95.160 7.212 14.258 1.00 1.48 H new ATOM 179 N VAL A 328 96.417 4.623 12.771 1.00 0.93 N ATOM 180 CA VAL A 328 96.097 3.593 11.738 1.00 1.03 C ATOM 181 C VAL A 328 96.304 2.179 12.296 1.00 1.06 C ATOM 182 O VAL A 328 97.155 1.949 13.131 1.00 1.71 O ATOM 183 CB VAL A 328 97.074 3.863 10.595 1.00 1.43 C ATOM 184 CG1 VAL A 328 96.807 2.877 9.457 1.00 1.73 C ATOM 185 CG2 VAL A 328 96.877 5.292 10.085 1.00 1.57 C ATOM 0 H VAL A 328 97.411 4.769 12.947 1.00 0.93 H new ATOM 0 HA VAL A 328 95.058 3.651 11.415 1.00 1.03 H new ATOM 0 HB VAL A 328 98.097 3.741 10.952 1.00 1.43 H new ATOM 0 HG11 VAL A 328 97.503 3.067 8.640 1.00 1.73 H new ATOM 0 HG12 VAL A 328 96.943 1.858 9.819 1.00 1.73 H new ATOM 0 HG13 VAL A 328 95.785 3.002 9.100 1.00 1.73 H new ATOM 0 HG21 VAL A 328 97.573 5.486 9.269 1.00 1.57 H new ATOM 0 HG22 VAL A 328 95.855 5.413 9.726 1.00 1.57 H new ATOM 0 HG23 VAL A 328 97.062 5.996 10.896 1.00 1.57 H new ATOM 195 N ASP A 329 95.549 1.224 11.817 1.00 1.16 N ATOM 196 CA ASP A 329 95.728 -0.182 12.290 1.00 1.20 C ATOM 197 C ASP A 329 96.804 -0.892 11.457 1.00 1.16 C ATOM 198 O ASP A 329 96.943 -0.654 10.273 1.00 1.39 O ATOM 199 CB ASP A 329 94.365 -0.844 12.081 1.00 1.44 C ATOM 200 CG ASP A 329 93.337 -0.203 13.014 1.00 1.37 C ATOM 201 OD1 ASP A 329 93.747 0.504 13.919 1.00 1.69 O ATOM 202 OD2 ASP A 329 92.156 -0.429 12.807 1.00 2.02 O ATOM 0 H ASP A 329 94.817 1.357 11.119 1.00 1.16 H new ATOM 0 HA ASP A 329 96.051 -0.230 13.330 1.00 1.20 H new ATOM 0 HB2 ASP A 329 94.050 -0.732 11.044 1.00 1.44 H new ATOM 0 HB3 ASP A 329 94.434 -1.914 12.279 1.00 1.44 H new ATOM 207 N GLU A 330 97.606 -1.717 12.080 1.00 1.13 N ATOM 208 CA GLU A 330 98.719 -2.388 11.339 1.00 1.11 C ATOM 209 C GLU A 330 98.166 -3.330 10.265 1.00 0.97 C ATOM 210 O GLU A 330 98.657 -3.372 9.155 1.00 0.91 O ATOM 211 CB GLU A 330 99.470 -3.184 12.407 1.00 1.28 C ATOM 212 CG GLU A 330 98.637 -4.400 12.821 1.00 1.68 C ATOM 213 CD GLU A 330 99.331 -5.124 13.975 1.00 2.07 C ATOM 214 OE1 GLU A 330 100.430 -4.725 14.325 1.00 2.70 O ATOM 215 OE2 GLU A 330 98.752 -6.067 14.490 1.00 2.49 O ATOM 0 H GLU A 330 97.539 -1.956 13.069 1.00 1.13 H new ATOM 0 HA GLU A 330 99.359 -1.671 10.825 1.00 1.11 H new ATOM 0 HB2 GLU A 330 100.437 -3.507 12.021 1.00 1.28 H new ATOM 0 HB3 GLU A 330 99.667 -2.553 13.274 1.00 1.28 H new ATOM 0 HG2 GLU A 330 97.639 -4.084 13.124 1.00 1.68 H new ATOM 0 HG3 GLU A 330 98.515 -5.076 11.975 1.00 1.68 H new ATOM 222 N LYS A 331 97.139 -4.070 10.574 1.00 0.98 N ATOM 223 CA LYS A 331 96.557 -4.989 9.554 1.00 0.92 C ATOM 224 C LYS A 331 96.061 -4.191 8.345 1.00 0.81 C ATOM 225 O LYS A 331 96.283 -4.561 7.210 1.00 0.80 O ATOM 226 CB LYS A 331 95.389 -5.678 10.258 1.00 1.02 C ATOM 227 CG LYS A 331 95.920 -6.527 11.414 1.00 1.49 C ATOM 228 CD LYS A 331 94.769 -7.319 12.038 1.00 2.27 C ATOM 229 CE LYS A 331 95.280 -8.082 13.262 1.00 2.60 C ATOM 230 NZ LYS A 331 95.019 -7.176 14.415 1.00 3.03 N ATOM 0 H LYS A 331 96.678 -4.080 11.484 1.00 0.98 H new ATOM 0 HA LYS A 331 97.288 -5.707 9.182 1.00 0.92 H new ATOM 0 HB2 LYS A 331 94.686 -4.934 10.632 1.00 1.02 H new ATOM 0 HB3 LYS A 331 94.844 -6.305 9.552 1.00 1.02 H new ATOM 0 HG2 LYS A 331 96.691 -7.208 11.054 1.00 1.49 H new ATOM 0 HG3 LYS A 331 96.385 -5.888 12.165 1.00 1.49 H new ATOM 0 HD2 LYS A 331 93.964 -6.644 12.327 1.00 2.27 H new ATOM 0 HD3 LYS A 331 94.355 -8.015 11.309 1.00 2.27 H new ATOM 0 HE2 LYS A 331 94.760 -9.032 13.381 1.00 2.60 H new ATOM 0 HE3 LYS A 331 96.342 -8.309 13.171 1.00 2.60 H new ATOM 0 HZ1 LYS A 331 95.343 -7.630 15.293 1.00 3.03 H new ATOM 0 HZ2 LYS A 331 95.532 -6.282 14.277 1.00 3.03 H new ATOM 0 HZ3 LYS A 331 93.999 -6.983 14.481 1.00 3.03 H new ATOM 244 N THR A 332 95.427 -3.079 8.580 1.00 0.78 N ATOM 245 CA THR A 332 94.953 -2.241 7.443 1.00 0.74 C ATOM 246 C THR A 332 96.136 -1.801 6.580 1.00 0.65 C ATOM 247 O THR A 332 96.084 -1.846 5.367 1.00 0.66 O ATOM 248 CB THR A 332 94.297 -1.027 8.101 1.00 0.77 C ATOM 249 OG1 THR A 332 93.255 -1.462 8.963 1.00 0.90 O ATOM 250 CG2 THR A 332 93.724 -0.107 7.022 1.00 0.82 C ATOM 0 H THR A 332 95.216 -2.713 9.508 1.00 0.78 H new ATOM 0 HA THR A 332 94.266 -2.780 6.791 1.00 0.74 H new ATOM 0 HB THR A 332 95.041 -0.481 8.681 1.00 0.77 H new ATOM 0 HG1 THR A 332 92.733 -0.688 9.262 1.00 0.90 H new ATOM 0 HG21 THR A 332 93.257 0.758 7.492 1.00 0.82 H new ATOM 0 HG22 THR A 332 94.527 0.227 6.365 1.00 0.82 H new ATOM 0 HG23 THR A 332 92.980 -0.649 6.439 1.00 0.82 H new ATOM 258 N LEU A 333 97.189 -1.342 7.193 1.00 0.59 N ATOM 259 CA LEU A 333 98.357 -0.858 6.404 1.00 0.57 C ATOM 260 C LEU A 333 98.934 -1.976 5.531 1.00 0.58 C ATOM 261 O LEU A 333 99.232 -1.780 4.370 1.00 0.54 O ATOM 262 CB LEU A 333 99.377 -0.420 7.452 1.00 0.68 C ATOM 263 CG LEU A 333 100.755 -0.297 6.802 1.00 0.64 C ATOM 264 CD1 LEU A 333 100.675 0.646 5.602 1.00 0.93 C ATOM 265 CD2 LEU A 333 101.743 0.260 7.823 1.00 0.87 C ATOM 0 H LEU A 333 97.293 -1.280 8.206 1.00 0.59 H new ATOM 0 HA LEU A 333 98.082 -0.051 5.725 1.00 0.57 H new ATOM 0 HB2 LEU A 333 99.081 0.535 7.886 1.00 0.68 H new ATOM 0 HB3 LEU A 333 99.411 -1.143 8.267 1.00 0.68 H new ATOM 0 HG LEU A 333 101.089 -1.279 6.465 1.00 0.64 H new ATOM 0 HD11 LEU A 333 101.659 0.732 5.141 1.00 0.93 H new ATOM 0 HD12 LEU A 333 99.966 0.250 4.875 1.00 0.93 H new ATOM 0 HD13 LEU A 333 100.343 1.630 5.934 1.00 0.93 H new ATOM 0 HD21 LEU A 333 102.728 0.350 7.365 1.00 0.87 H new ATOM 0 HD22 LEU A 333 101.407 1.242 8.156 1.00 0.87 H new ATOM 0 HD23 LEU A 333 101.801 -0.413 8.678 1.00 0.87 H new ATOM 277 N ALA A 334 99.109 -3.141 6.081 1.00 0.66 N ATOM 278 CA ALA A 334 99.690 -4.253 5.281 1.00 0.73 C ATOM 279 C ALA A 334 98.781 -4.565 4.092 1.00 0.68 C ATOM 280 O ALA A 334 99.230 -4.861 3.004 1.00 0.66 O ATOM 281 CB ALA A 334 99.752 -5.441 6.244 1.00 0.87 C ATOM 0 H ALA A 334 98.876 -3.373 7.047 1.00 0.66 H new ATOM 0 HA ALA A 334 100.673 -4.011 4.876 1.00 0.73 H new ATOM 0 HB1 ALA A 334 100.171 -6.305 5.729 1.00 0.87 H new ATOM 0 HB2 ALA A 334 100.382 -5.186 7.096 1.00 0.87 H new ATOM 0 HB3 ALA A 334 98.747 -5.679 6.594 1.00 0.87 H new ATOM 287 N ASP A 335 97.503 -4.522 4.299 1.00 0.67 N ATOM 288 CA ASP A 335 96.563 -4.852 3.191 1.00 0.65 C ATOM 289 C ASP A 335 96.655 -3.825 2.056 1.00 0.62 C ATOM 290 O ASP A 335 96.684 -4.177 0.893 1.00 0.69 O ATOM 291 CB ASP A 335 95.184 -4.794 3.828 1.00 0.67 C ATOM 292 CG ASP A 335 95.063 -5.886 4.894 1.00 1.19 C ATOM 293 OD1 ASP A 335 95.897 -6.776 4.899 1.00 1.96 O ATOM 294 OD2 ASP A 335 94.137 -5.813 5.685 1.00 1.61 O ATOM 0 H ASP A 335 97.063 -4.273 5.185 1.00 0.67 H new ATOM 0 HA ASP A 335 96.789 -5.823 2.750 1.00 0.65 H new ATOM 0 HB2 ASP A 335 95.021 -3.814 4.277 1.00 0.67 H new ATOM 0 HB3 ASP A 335 94.415 -4.928 3.067 1.00 0.67 H new ATOM 299 N ALA A 336 96.678 -2.559 2.376 1.00 0.60 N ATOM 300 CA ALA A 336 96.733 -1.522 1.303 1.00 0.62 C ATOM 301 C ALA A 336 98.052 -1.615 0.541 1.00 0.51 C ATOM 302 O ALA A 336 98.094 -1.452 -0.660 1.00 0.55 O ATOM 303 CB ALA A 336 96.618 -0.179 2.025 1.00 0.76 C ATOM 0 H ALA A 336 96.661 -2.198 3.330 1.00 0.60 H new ATOM 0 HA ALA A 336 95.936 -1.652 0.571 1.00 0.62 H new ATOM 0 HB1 ALA A 336 96.651 0.630 1.296 1.00 0.76 H new ATOM 0 HB2 ALA A 336 95.675 -0.138 2.569 1.00 0.76 H new ATOM 0 HB3 ALA A 336 97.446 -0.070 2.726 1.00 0.76 H new ATOM 309 N ALA A 337 99.123 -1.912 1.215 1.00 0.46 N ATOM 310 CA ALA A 337 100.423 -2.050 0.495 1.00 0.50 C ATOM 311 C ALA A 337 100.357 -3.219 -0.490 1.00 0.62 C ATOM 312 O ALA A 337 100.977 -3.199 -1.535 1.00 0.72 O ATOM 313 CB ALA A 337 101.463 -2.322 1.583 1.00 0.50 C ATOM 0 H ALA A 337 99.160 -2.065 2.223 1.00 0.46 H new ATOM 0 HA ALA A 337 100.669 -1.159 -0.082 1.00 0.50 H new ATOM 0 HB1 ALA A 337 102.446 -2.435 1.126 1.00 0.50 H new ATOM 0 HB2 ALA A 337 101.482 -1.488 2.285 1.00 0.50 H new ATOM 0 HB3 ALA A 337 101.203 -3.237 2.115 1.00 0.50 H new ATOM 319 N GLN A 338 99.636 -4.252 -0.149 1.00 0.71 N ATOM 320 CA GLN A 338 99.559 -5.440 -1.050 1.00 0.91 C ATOM 321 C GLN A 338 98.771 -5.124 -2.325 1.00 0.94 C ATOM 322 O GLN A 338 99.217 -5.401 -3.419 1.00 1.06 O ATOM 323 CB GLN A 338 98.845 -6.508 -0.224 1.00 1.03 C ATOM 324 CG GLN A 338 99.737 -7.040 0.922 1.00 1.03 C ATOM 325 CD GLN A 338 101.087 -6.298 1.022 1.00 0.94 C ATOM 326 OE1 GLN A 338 101.913 -6.395 0.141 1.00 1.72 O ATOM 327 NE2 GLN A 338 101.342 -5.565 2.069 1.00 0.69 N ATOM 0 H GLN A 338 99.097 -4.326 0.714 1.00 0.71 H new ATOM 0 HA GLN A 338 100.547 -5.761 -1.381 1.00 0.91 H new ATOM 0 HB2 GLN A 338 97.928 -6.092 0.193 1.00 1.03 H new ATOM 0 HB3 GLN A 338 98.555 -7.335 -0.872 1.00 1.03 H new ATOM 0 HG2 GLN A 338 99.203 -6.943 1.867 1.00 1.03 H new ATOM 0 HG3 GLN A 338 99.922 -8.103 0.769 1.00 1.03 H new ATOM 0 HE21 GLN A 338 100.650 -5.480 2.813 1.00 0.69 H new ATOM 0 HE22 GLN A 338 102.234 -5.076 2.144 1.00 0.69 H new ATOM 336 N LEU A 339 97.580 -4.605 -2.203 1.00 0.86 N ATOM 337 CA LEU A 339 96.773 -4.355 -3.437 1.00 0.90 C ATOM 338 C LEU A 339 97.378 -3.202 -4.248 1.00 0.84 C ATOM 339 O LEU A 339 97.409 -3.240 -5.461 1.00 1.00 O ATOM 340 CB LEU A 339 95.351 -4.015 -2.970 1.00 0.80 C ATOM 341 CG LEU A 339 95.378 -3.040 -1.794 1.00 1.01 C ATOM 342 CD1 LEU A 339 94.651 -1.756 -2.189 1.00 1.34 C ATOM 343 CD2 LEU A 339 94.659 -3.683 -0.605 1.00 1.58 C ATOM 0 H LEU A 339 97.135 -4.347 -1.322 1.00 0.86 H new ATOM 0 HA LEU A 339 96.765 -5.229 -4.088 1.00 0.90 H new ATOM 0 HB2 LEU A 339 94.788 -3.579 -3.795 1.00 0.80 H new ATOM 0 HB3 LEU A 339 94.833 -4.928 -2.678 1.00 0.80 H new ATOM 0 HG LEU A 339 96.408 -2.807 -1.525 1.00 1.01 H new ATOM 0 HD11 LEU A 339 94.667 -1.057 -1.353 1.00 1.34 H new ATOM 0 HD12 LEU A 339 95.148 -1.306 -3.048 1.00 1.34 H new ATOM 0 HD13 LEU A 339 93.618 -1.988 -2.448 1.00 1.34 H new ATOM 0 HD21 LEU A 339 94.671 -2.997 0.242 1.00 1.58 H new ATOM 0 HD22 LEU A 339 93.627 -3.903 -0.879 1.00 1.58 H new ATOM 0 HD23 LEU A 339 95.166 -4.608 -0.330 1.00 1.58 H new ATOM 355 N ALA A 340 97.903 -2.205 -3.591 1.00 0.74 N ATOM 356 CA ALA A 340 98.555 -1.086 -4.328 1.00 0.93 C ATOM 357 C ALA A 340 99.829 -1.576 -5.020 1.00 1.36 C ATOM 358 O ALA A 340 100.375 -0.915 -5.881 1.00 2.24 O ATOM 359 CB ALA A 340 98.896 -0.053 -3.254 1.00 0.82 C ATOM 0 H ALA A 340 97.909 -2.117 -2.575 1.00 0.74 H new ATOM 0 HA ALA A 340 97.911 -0.674 -5.105 1.00 0.93 H new ATOM 0 HB1 ALA A 340 99.381 0.806 -3.717 1.00 0.82 H new ATOM 0 HB2 ALA A 340 97.981 0.271 -2.757 1.00 0.82 H new ATOM 0 HB3 ALA A 340 99.569 -0.499 -2.521 1.00 0.82 H new ATOM 365 N SER A 341 100.293 -2.743 -4.667 1.00 1.07 N ATOM 366 CA SER A 341 101.516 -3.288 -5.328 1.00 1.44 C ATOM 367 C SER A 341 101.127 -4.256 -6.449 1.00 1.51 C ATOM 368 O SER A 341 101.917 -4.564 -7.318 1.00 2.65 O ATOM 369 CB SER A 341 102.285 -4.012 -4.221 1.00 2.84 C ATOM 370 OG SER A 341 101.495 -5.078 -3.720 1.00 3.56 O ATOM 0 H SER A 341 99.881 -3.342 -3.952 1.00 1.07 H new ATOM 0 HA SER A 341 102.119 -2.505 -5.787 1.00 1.44 H new ATOM 0 HB2 SER A 341 103.229 -4.395 -4.609 1.00 2.84 H new ATOM 0 HB3 SER A 341 102.529 -3.317 -3.418 1.00 2.84 H new ATOM 0 HG SER A 341 100.589 -5.014 -4.087 1.00 3.56 H new ATOM 376 N LEU A 342 99.904 -4.707 -6.461 1.00 1.19 N ATOM 377 CA LEU A 342 99.459 -5.616 -7.556 1.00 2.40 C ATOM 378 C LEU A 342 99.621 -4.927 -8.911 1.00 2.59 C ATOM 379 O LEU A 342 99.767 -5.567 -9.934 1.00 3.62 O ATOM 380 CB LEU A 342 97.979 -5.885 -7.280 1.00 3.39 C ATOM 381 CG LEU A 342 97.823 -6.580 -5.929 1.00 3.93 C ATOM 382 CD1 LEU A 342 96.361 -6.993 -5.739 1.00 4.36 C ATOM 383 CD2 LEU A 342 98.712 -7.826 -5.890 1.00 3.74 C ATOM 0 H LEU A 342 99.194 -4.487 -5.762 1.00 1.19 H new ATOM 0 HA LEU A 342 100.044 -6.535 -7.586 1.00 2.40 H new ATOM 0 HB2 LEU A 342 97.423 -4.948 -7.284 1.00 3.39 H new ATOM 0 HB3 LEU A 342 97.559 -6.508 -8.070 1.00 3.39 H new ATOM 0 HG LEU A 342 98.118 -5.898 -5.132 1.00 3.93 H new ATOM 0 HD11 LEU A 342 96.245 -7.490 -4.776 1.00 4.36 H new ATOM 0 HD12 LEU A 342 95.726 -6.108 -5.769 1.00 4.36 H new ATOM 0 HD13 LEU A 342 96.069 -7.676 -6.537 1.00 4.36 H new ATOM 0 HD21 LEU A 342 98.601 -8.322 -4.926 1.00 3.74 H new ATOM 0 HD22 LEU A 342 98.416 -8.509 -6.686 1.00 3.74 H new ATOM 0 HD23 LEU A 342 99.753 -7.535 -6.030 1.00 3.74 H new ATOM 395 N ALA A 343 99.535 -3.624 -8.934 1.00 2.04 N ATOM 396 CA ALA A 343 99.618 -2.891 -10.229 1.00 2.90 C ATOM 397 C ALA A 343 101.074 -2.568 -10.583 1.00 2.34 C ATOM 398 O ALA A 343 101.400 -2.329 -11.729 1.00 2.96 O ATOM 399 CB ALA A 343 98.816 -1.608 -10.008 1.00 3.81 C ATOM 0 H ALA A 343 99.411 -3.035 -8.110 1.00 2.04 H new ATOM 0 HA ALA A 343 99.227 -3.482 -11.057 1.00 2.90 H new ATOM 0 HB1 ALA A 343 98.828 -1.010 -10.919 1.00 3.81 H new ATOM 0 HB2 ALA A 343 97.787 -1.861 -9.754 1.00 3.81 H new ATOM 0 HB3 ALA A 343 99.261 -1.037 -9.193 1.00 3.81 H new ATOM 405 N ASP A 344 101.955 -2.564 -9.619 1.00 1.46 N ATOM 406 CA ASP A 344 103.383 -2.260 -9.932 1.00 1.77 C ATOM 407 C ASP A 344 104.054 -3.485 -10.560 1.00 1.92 C ATOM 408 O ASP A 344 103.849 -4.605 -10.135 1.00 1.99 O ATOM 409 CB ASP A 344 104.027 -1.905 -8.586 1.00 1.69 C ATOM 410 CG ASP A 344 104.324 -3.177 -7.786 1.00 2.00 C ATOM 411 OD1 ASP A 344 105.098 -3.989 -8.266 1.00 1.89 O ATOM 412 OD2 ASP A 344 103.782 -3.311 -6.702 1.00 2.84 O ATOM 0 H ASP A 344 101.752 -2.756 -8.638 1.00 1.46 H new ATOM 0 HA ASP A 344 103.487 -1.444 -10.647 1.00 1.77 H new ATOM 0 HB2 ASP A 344 104.949 -1.348 -8.752 1.00 1.69 H new ATOM 0 HB3 ASP A 344 103.361 -1.256 -8.017 1.00 1.69 H new ATOM 417 N GLU A 345 104.848 -3.284 -11.577 1.00 2.10 N ATOM 418 CA GLU A 345 105.525 -4.439 -12.234 1.00 2.37 C ATOM 419 C GLU A 345 106.931 -4.625 -11.662 1.00 2.30 C ATOM 420 O GLU A 345 107.696 -5.449 -12.121 1.00 2.51 O ATOM 421 CB GLU A 345 105.590 -4.074 -13.718 1.00 2.66 C ATOM 422 CG GLU A 345 104.171 -3.884 -14.259 1.00 2.29 C ATOM 423 CD GLU A 345 104.233 -3.597 -15.761 1.00 2.60 C ATOM 424 OE1 GLU A 345 105.327 -3.390 -16.260 1.00 2.99 O ATOM 425 OE2 GLU A 345 103.185 -3.586 -16.386 1.00 2.87 O ATOM 0 H GLU A 345 105.057 -2.371 -11.981 1.00 2.10 H new ATOM 0 HA GLU A 345 104.991 -5.375 -12.071 1.00 2.37 H new ATOM 0 HB2 GLU A 345 106.168 -3.160 -13.854 1.00 2.66 H new ATOM 0 HB3 GLU A 345 106.101 -4.860 -14.275 1.00 2.66 H new ATOM 0 HG2 GLU A 345 103.576 -4.778 -14.073 1.00 2.29 H new ATOM 0 HG3 GLU A 345 103.680 -3.061 -13.740 1.00 2.29 H new ATOM 432 N THR A 346 107.266 -3.883 -10.644 1.00 2.06 N ATOM 433 CA THR A 346 108.611 -4.036 -10.021 1.00 2.06 C ATOM 434 C THR A 346 108.645 -5.293 -9.147 1.00 1.91 C ATOM 435 O THR A 346 107.678 -5.616 -8.488 1.00 1.73 O ATOM 436 CB THR A 346 108.797 -2.782 -9.165 1.00 2.02 C ATOM 437 OG1 THR A 346 107.872 -2.806 -8.085 1.00 1.96 O ATOM 438 CG2 THR A 346 108.554 -1.538 -10.019 1.00 2.07 C ATOM 0 H THR A 346 106.667 -3.177 -10.216 1.00 2.06 H new ATOM 0 HA THR A 346 109.402 -4.142 -10.763 1.00 2.06 H new ATOM 0 HB THR A 346 109.814 -2.757 -8.773 1.00 2.02 H new ATOM 0 HG1 THR A 346 107.059 -3.278 -8.361 1.00 1.96 H new ATOM 0 HG21 THR A 346 108.687 -0.645 -9.408 1.00 2.07 H new ATOM 0 HG22 THR A 346 109.264 -1.520 -10.846 1.00 2.07 H new ATOM 0 HG23 THR A 346 107.538 -1.560 -10.413 1.00 2.07 H new ATOM 446 N PRO A 347 109.768 -5.958 -9.169 1.00 2.03 N ATOM 447 CA PRO A 347 109.934 -7.191 -8.363 1.00 1.99 C ATOM 448 C PRO A 347 109.724 -6.882 -6.877 1.00 1.79 C ATOM 449 O PRO A 347 109.177 -7.678 -6.140 1.00 1.68 O ATOM 450 CB PRO A 347 111.378 -7.626 -8.630 1.00 2.25 C ATOM 451 CG PRO A 347 112.045 -6.453 -9.280 1.00 2.38 C ATOM 452 CD PRO A 347 110.970 -5.629 -9.934 1.00 2.29 C ATOM 0 HA PRO A 347 109.215 -7.968 -8.624 1.00 1.99 H new ATOM 0 HB2 PRO A 347 111.882 -7.898 -7.703 1.00 2.25 H new ATOM 0 HB3 PRO A 347 111.409 -8.502 -9.278 1.00 2.25 H new ATOM 0 HG2 PRO A 347 112.586 -5.861 -8.541 1.00 2.38 H new ATOM 0 HG3 PRO A 347 112.775 -6.787 -10.018 1.00 2.38 H new ATOM 0 HD2 PRO A 347 111.197 -4.564 -9.886 1.00 2.29 H new ATOM 0 HD3 PRO A 347 110.856 -5.883 -10.988 1.00 2.29 H new ATOM 460 N GLU A 348 110.133 -5.723 -6.440 1.00 1.76 N ATOM 461 CA GLU A 348 109.931 -5.354 -5.010 1.00 1.64 C ATOM 462 C GLU A 348 108.435 -5.264 -4.695 1.00 1.41 C ATOM 463 O GLU A 348 107.990 -5.651 -3.634 1.00 1.31 O ATOM 464 CB GLU A 348 110.598 -3.987 -4.859 1.00 1.72 C ATOM 465 CG GLU A 348 112.103 -4.126 -5.096 1.00 2.14 C ATOM 466 CD GLU A 348 112.783 -2.772 -4.887 1.00 2.49 C ATOM 467 OE1 GLU A 348 112.074 -1.789 -4.756 1.00 3.25 O ATOM 468 OE2 GLU A 348 114.002 -2.741 -4.861 1.00 2.49 O ATOM 0 H GLU A 348 110.598 -5.016 -7.010 1.00 1.76 H new ATOM 0 HA GLU A 348 110.354 -6.090 -4.326 1.00 1.64 H new ATOM 0 HB2 GLU A 348 110.170 -3.281 -5.571 1.00 1.72 H new ATOM 0 HB3 GLU A 348 110.411 -3.587 -3.862 1.00 1.72 H new ATOM 0 HG2 GLU A 348 112.522 -4.864 -4.412 1.00 2.14 H new ATOM 0 HG3 GLU A 348 112.290 -4.486 -6.108 1.00 2.14 H new ATOM 475 N GLY A 349 107.651 -4.798 -5.625 1.00 1.42 N ATOM 476 CA GLY A 349 106.179 -4.734 -5.395 1.00 1.30 C ATOM 477 C GLY A 349 105.650 -6.133 -5.076 1.00 1.23 C ATOM 478 O GLY A 349 104.764 -6.301 -4.262 1.00 1.23 O ATOM 0 H GLY A 349 107.964 -4.458 -6.534 1.00 1.42 H new ATOM 0 HA2 GLY A 349 105.958 -4.054 -4.572 1.00 1.30 H new ATOM 0 HA3 GLY A 349 105.679 -4.338 -6.279 1.00 1.30 H new ATOM 482 N ARG A 350 106.297 -7.146 -5.582 1.00 1.19 N ATOM 483 CA ARG A 350 105.942 -8.532 -5.162 1.00 1.15 C ATOM 484 C ARG A 350 106.486 -8.793 -3.764 1.00 1.06 C ATOM 485 O ARG A 350 105.854 -9.429 -2.947 1.00 0.94 O ATOM 486 CB ARG A 350 106.618 -9.444 -6.180 1.00 1.18 C ATOM 487 CG ARG A 350 106.328 -8.925 -7.585 1.00 1.81 C ATOM 488 CD ARG A 350 106.875 -9.910 -8.621 1.00 2.33 C ATOM 489 NE ARG A 350 108.326 -10.032 -8.307 1.00 2.77 N ATOM 490 CZ ARG A 350 109.068 -10.894 -8.949 1.00 3.16 C ATOM 491 NH1 ARG A 350 108.544 -11.655 -9.872 1.00 3.46 N ATOM 492 NH2 ARG A 350 110.339 -10.993 -8.670 1.00 3.62 N ATOM 0 H ARG A 350 107.052 -7.076 -6.264 1.00 1.19 H new ATOM 0 HA ARG A 350 104.865 -8.698 -5.130 1.00 1.15 H new ATOM 0 HB2 ARG A 350 107.693 -9.472 -6.004 1.00 1.18 H new ATOM 0 HB3 ARG A 350 106.251 -10.465 -6.073 1.00 1.18 H new ATOM 0 HG2 ARG A 350 105.254 -8.797 -7.722 1.00 1.81 H new ATOM 0 HG3 ARG A 350 106.786 -7.945 -7.723 1.00 1.81 H new ATOM 0 HD2 ARG A 350 106.373 -10.875 -8.551 1.00 2.33 H new ATOM 0 HD3 ARG A 350 106.720 -9.543 -9.635 1.00 2.33 H new ATOM 0 HE ARG A 350 108.742 -9.440 -7.588 1.00 2.77 H new ATOM 0 HH11 ARG A 350 107.551 -11.578 -10.094 1.00 3.46 H new ATOM 0 HH12 ARG A 350 109.127 -12.327 -10.371 1.00 3.46 H new ATOM 0 HH21 ARG A 350 110.751 -10.398 -7.952 1.00 3.62 H new ATOM 0 HH22 ARG A 350 110.920 -11.666 -9.170 1.00 3.62 H new ATOM 506 N SER A 351 107.634 -8.265 -3.466 1.00 1.15 N ATOM 507 CA SER A 351 108.192 -8.444 -2.097 1.00 1.10 C ATOM 508 C SER A 351 107.172 -7.975 -1.055 1.00 0.97 C ATOM 509 O SER A 351 106.916 -8.643 -0.076 1.00 0.87 O ATOM 510 CB SER A 351 109.440 -7.565 -2.063 1.00 1.25 C ATOM 511 OG SER A 351 110.269 -7.883 -3.173 1.00 2.40 O ATOM 0 H SER A 351 108.211 -7.719 -4.106 1.00 1.15 H new ATOM 0 HA SER A 351 108.424 -9.485 -1.872 1.00 1.10 H new ATOM 0 HB2 SER A 351 109.158 -6.512 -2.095 1.00 1.25 H new ATOM 0 HB3 SER A 351 109.984 -7.722 -1.132 1.00 1.25 H new ATOM 0 HG SER A 351 111.145 -7.459 -3.059 1.00 2.40 H new ATOM 517 N ILE A 352 106.559 -6.845 -1.276 1.00 1.00 N ATOM 518 CA ILE A 352 105.526 -6.350 -0.322 1.00 0.93 C ATOM 519 C ILE A 352 104.281 -7.255 -0.337 1.00 0.80 C ATOM 520 O ILE A 352 103.793 -7.660 0.701 1.00 0.70 O ATOM 521 CB ILE A 352 105.224 -4.933 -0.814 1.00 1.08 C ATOM 522 CG1 ILE A 352 106.261 -3.982 -0.217 1.00 1.16 C ATOM 523 CG2 ILE A 352 103.821 -4.495 -0.389 1.00 1.16 C ATOM 524 CD1 ILE A 352 106.187 -2.632 -0.924 1.00 1.39 C ATOM 0 H ILE A 352 106.730 -6.240 -2.080 1.00 1.00 H new ATOM 0 HA ILE A 352 105.861 -6.357 0.715 1.00 0.93 H new ATOM 0 HB ILE A 352 105.269 -4.914 -1.903 1.00 1.08 H new ATOM 0 HG12 ILE A 352 106.080 -3.855 0.850 1.00 1.16 H new ATOM 0 HG13 ILE A 352 107.260 -4.405 -0.323 1.00 1.16 H new ATOM 0 HG21 ILE A 352 103.630 -3.485 -0.751 1.00 1.16 H new ATOM 0 HG22 ILE A 352 103.083 -5.177 -0.812 1.00 1.16 H new ATOM 0 HG23 ILE A 352 103.749 -4.511 0.698 1.00 1.16 H new ATOM 0 HD11 ILE A 352 106.927 -1.956 -0.496 1.00 1.39 H new ATOM 0 HD12 ILE A 352 106.389 -2.766 -1.987 1.00 1.39 H new ATOM 0 HD13 ILE A 352 105.191 -2.208 -0.795 1.00 1.39 H new ATOM 536 N VAL A 353 103.779 -7.610 -1.493 1.00 0.86 N ATOM 537 CA VAL A 353 102.595 -8.525 -1.536 1.00 0.82 C ATOM 538 C VAL A 353 102.889 -9.804 -0.739 1.00 0.77 C ATOM 539 O VAL A 353 102.059 -10.290 0.006 1.00 0.77 O ATOM 540 CB VAL A 353 102.391 -8.857 -3.017 1.00 0.97 C ATOM 541 CG1 VAL A 353 101.320 -9.942 -3.154 1.00 1.18 C ATOM 542 CG2 VAL A 353 101.935 -7.603 -3.765 1.00 1.10 C ATOM 0 H VAL A 353 104.133 -7.310 -2.401 1.00 0.86 H new ATOM 0 HA VAL A 353 101.708 -8.067 -1.098 1.00 0.82 H new ATOM 0 HB VAL A 353 103.331 -9.213 -3.439 1.00 0.97 H new ATOM 0 HG11 VAL A 353 101.174 -10.179 -4.208 1.00 1.18 H new ATOM 0 HG12 VAL A 353 101.640 -10.838 -2.622 1.00 1.18 H new ATOM 0 HG13 VAL A 353 100.382 -9.583 -2.730 1.00 1.18 H new ATOM 0 HG21 VAL A 353 101.790 -7.840 -4.819 1.00 1.10 H new ATOM 0 HG22 VAL A 353 100.996 -7.248 -3.341 1.00 1.10 H new ATOM 0 HG23 VAL A 353 102.694 -6.826 -3.669 1.00 1.10 H new ATOM 552 N ILE A 354 104.124 -10.215 -0.723 1.00 0.79 N ATOM 553 CA ILE A 354 104.536 -11.305 0.209 1.00 0.84 C ATOM 554 C ILE A 354 104.469 -10.820 1.655 1.00 0.72 C ATOM 555 O ILE A 354 104.059 -11.538 2.540 1.00 0.77 O ATOM 556 CB ILE A 354 105.976 -11.614 -0.173 1.00 0.97 C ATOM 557 CG1 ILE A 354 106.027 -12.073 -1.632 1.00 1.21 C ATOM 558 CG2 ILE A 354 106.521 -12.713 0.739 1.00 1.11 C ATOM 559 CD1 ILE A 354 107.445 -11.902 -2.176 1.00 1.36 C ATOM 0 H ILE A 354 104.868 -9.845 -1.314 1.00 0.79 H new ATOM 0 HA ILE A 354 103.888 -12.179 0.135 1.00 0.84 H new ATOM 0 HB ILE A 354 106.587 -10.719 -0.057 1.00 0.97 H new ATOM 0 HG12 ILE A 354 105.722 -13.117 -1.706 1.00 1.21 H new ATOM 0 HG13 ILE A 354 105.325 -11.493 -2.231 1.00 1.21 H new ATOM 0 HG21 ILE A 354 107.553 -12.934 0.465 1.00 1.11 H new ATOM 0 HG22 ILE A 354 106.484 -12.377 1.775 1.00 1.11 H new ATOM 0 HG23 ILE A 354 105.915 -13.612 0.627 1.00 1.11 H new ATOM 0 HD11 ILE A 354 107.478 -12.230 -3.215 1.00 1.36 H new ATOM 0 HD12 ILE A 354 107.733 -10.852 -2.117 1.00 1.36 H new ATOM 0 HD13 ILE A 354 108.137 -12.502 -1.584 1.00 1.36 H new ATOM 571 N LEU A 355 104.972 -9.654 1.916 1.00 0.63 N ATOM 572 CA LEU A 355 105.050 -9.181 3.329 1.00 0.62 C ATOM 573 C LEU A 355 103.717 -9.411 4.046 1.00 0.55 C ATOM 574 O LEU A 355 103.657 -10.053 5.077 1.00 0.61 O ATOM 575 CB LEU A 355 105.323 -7.684 3.216 1.00 0.64 C ATOM 576 CG LEU A 355 105.363 -7.060 4.613 1.00 0.73 C ATOM 577 CD1 LEU A 355 106.274 -5.831 4.605 1.00 1.14 C ATOM 578 CD2 LEU A 355 103.950 -6.638 5.018 1.00 1.15 C ATOM 0 H LEU A 355 105.334 -9.004 1.218 1.00 0.63 H new ATOM 0 HA LEU A 355 105.815 -9.709 3.897 1.00 0.62 H new ATOM 0 HB2 LEU A 355 106.271 -7.515 2.704 1.00 0.64 H new ATOM 0 HB3 LEU A 355 104.548 -7.207 2.616 1.00 0.64 H new ATOM 0 HG LEU A 355 105.749 -7.791 5.324 1.00 0.73 H new ATOM 0 HD11 LEU A 355 106.299 -5.390 5.602 1.00 1.14 H new ATOM 0 HD12 LEU A 355 107.282 -6.127 4.314 1.00 1.14 H new ATOM 0 HD13 LEU A 355 105.891 -5.099 3.894 1.00 1.14 H new ATOM 0 HD21 LEU A 355 103.974 -6.193 6.013 1.00 1.15 H new ATOM 0 HD22 LEU A 355 103.569 -5.908 4.303 1.00 1.15 H new ATOM 0 HD23 LEU A 355 103.298 -7.511 5.027 1.00 1.15 H new ATOM 590 N ALA A 356 102.640 -8.941 3.487 1.00 0.52 N ATOM 591 CA ALA A 356 101.316 -9.191 4.125 1.00 0.54 C ATOM 592 C ALA A 356 101.006 -10.689 4.096 1.00 0.53 C ATOM 593 O ALA A 356 100.394 -11.229 4.998 1.00 0.57 O ATOM 594 CB ALA A 356 100.306 -8.414 3.280 1.00 0.61 C ATOM 0 H ALA A 356 102.616 -8.399 2.623 1.00 0.52 H new ATOM 0 HA ALA A 356 101.290 -8.875 5.168 1.00 0.54 H new ATOM 0 HB1 ALA A 356 99.306 -8.551 3.691 1.00 0.61 H new ATOM 0 HB2 ALA A 356 100.561 -7.354 3.292 1.00 0.61 H new ATOM 0 HB3 ALA A 356 100.330 -8.782 2.254 1.00 0.61 H new ATOM 600 N LYS A 357 101.381 -11.361 3.046 1.00 0.57 N ATOM 601 CA LYS A 357 101.049 -12.811 2.955 1.00 0.68 C ATOM 602 C LYS A 357 101.643 -13.581 4.140 1.00 0.79 C ATOM 603 O LYS A 357 100.975 -14.361 4.782 1.00 0.93 O ATOM 604 CB LYS A 357 101.674 -13.293 1.653 1.00 0.88 C ATOM 605 CG LYS A 357 101.352 -14.775 1.484 1.00 0.97 C ATOM 606 CD LYS A 357 99.961 -14.928 0.866 1.00 1.16 C ATOM 607 CE LYS A 357 99.678 -16.409 0.603 1.00 0.90 C ATOM 608 NZ LYS A 357 98.295 -16.445 0.054 1.00 1.15 N ATOM 0 H LYS A 357 101.897 -10.977 2.255 1.00 0.57 H new ATOM 0 HA LYS A 357 99.971 -12.974 2.977 1.00 0.68 H new ATOM 0 HB2 LYS A 357 101.284 -12.722 0.811 1.00 0.88 H new ATOM 0 HB3 LYS A 357 102.753 -13.139 1.670 1.00 0.88 H new ATOM 0 HG2 LYS A 357 102.099 -15.250 0.847 1.00 0.97 H new ATOM 0 HG3 LYS A 357 101.390 -15.279 2.450 1.00 0.97 H new ATOM 0 HD2 LYS A 357 99.207 -14.516 1.536 1.00 1.16 H new ATOM 0 HD3 LYS A 357 99.901 -14.365 -0.065 1.00 1.16 H new ATOM 0 HE2 LYS A 357 100.394 -16.828 -0.104 1.00 0.90 H new ATOM 0 HE3 LYS A 357 99.754 -16.994 1.519 1.00 0.90 H new ATOM 0 HZ1 LYS A 357 97.769 -17.230 0.488 1.00 1.15 H new ATOM 0 HZ2 LYS A 357 97.814 -15.547 0.265 1.00 1.15 H new ATOM 0 HZ3 LYS A 357 98.334 -16.583 -0.976 1.00 1.15 H new ATOM 622 N GLN A 358 102.895 -13.390 4.432 1.00 0.80 N ATOM 623 CA GLN A 358 103.494 -14.137 5.570 1.00 1.01 C ATOM 624 C GLN A 358 102.832 -13.699 6.881 1.00 1.05 C ATOM 625 O GLN A 358 102.583 -14.502 7.758 1.00 1.25 O ATOM 626 CB GLN A 358 104.984 -13.783 5.559 1.00 1.03 C ATOM 627 CG GLN A 358 105.161 -12.268 5.657 1.00 0.99 C ATOM 628 CD GLN A 358 106.648 -11.934 5.791 1.00 1.21 C ATOM 629 OE1 GLN A 358 107.186 -11.936 6.880 1.00 1.62 O ATOM 630 NE2 GLN A 358 107.338 -11.646 4.721 1.00 1.90 N ATOM 0 H GLN A 358 103.525 -12.757 3.939 1.00 0.80 H new ATOM 0 HA GLN A 358 103.348 -15.214 5.482 1.00 1.01 H new ATOM 0 HB2 GLN A 358 105.489 -14.271 6.393 1.00 1.03 H new ATOM 0 HB3 GLN A 358 105.448 -14.153 4.645 1.00 1.03 H new ATOM 0 HG2 GLN A 358 104.748 -11.785 4.772 1.00 0.99 H new ATOM 0 HG3 GLN A 358 104.612 -11.882 6.516 1.00 0.99 H new ATOM 0 HE21 GLN A 358 106.885 -11.645 3.807 1.00 1.90 H new ATOM 0 HE22 GLN A 358 108.330 -11.422 4.799 1.00 1.90 H new ATOM 639 N ARG A 359 102.556 -12.429 7.026 1.00 0.93 N ATOM 640 CA ARG A 359 101.925 -11.943 8.287 1.00 1.10 C ATOM 641 C ARG A 359 100.443 -12.340 8.365 1.00 1.09 C ATOM 642 O ARG A 359 99.967 -12.760 9.402 1.00 1.55 O ATOM 643 CB ARG A 359 102.062 -10.419 8.244 1.00 1.08 C ATOM 644 CG ARG A 359 103.535 -10.032 8.394 1.00 1.26 C ATOM 645 CD ARG A 359 104.052 -10.506 9.754 1.00 1.27 C ATOM 646 NE ARG A 359 105.443 -9.982 9.841 1.00 1.47 N ATOM 647 CZ ARG A 359 106.235 -10.371 10.804 1.00 1.98 C ATOM 648 NH1 ARG A 359 105.812 -11.223 11.701 1.00 2.63 N ATOM 649 NH2 ARG A 359 107.454 -9.909 10.871 1.00 2.38 N ATOM 0 H ARG A 359 102.740 -11.709 6.327 1.00 0.93 H new ATOM 0 HA ARG A 359 102.406 -12.380 9.162 1.00 1.10 H new ATOM 0 HB2 ARG A 359 101.669 -10.035 7.303 1.00 1.08 H new ATOM 0 HB3 ARG A 359 101.474 -9.968 9.043 1.00 1.08 H new ATOM 0 HG2 ARG A 359 104.123 -10.480 7.593 1.00 1.26 H new ATOM 0 HG3 ARG A 359 103.649 -8.951 8.306 1.00 1.26 H new ATOM 0 HD2 ARG A 359 103.434 -10.123 10.566 1.00 1.27 H new ATOM 0 HD3 ARG A 359 104.035 -11.593 9.826 1.00 1.27 H new ATOM 0 HE ARG A 359 105.779 -9.316 9.145 1.00 1.47 H new ATOM 0 HH11 ARG A 359 104.860 -11.586 11.650 1.00 2.63 H new ATOM 0 HH12 ARG A 359 106.434 -11.524 12.451 1.00 2.63 H new ATOM 0 HH21 ARG A 359 107.787 -9.245 10.172 1.00 2.38 H new ATOM 0 HH22 ARG A 359 108.074 -10.212 11.623 1.00 2.38 H new ATOM 663 N PHE A 360 99.687 -12.152 7.311 1.00 0.70 N ATOM 664 CA PHE A 360 98.226 -12.459 7.394 1.00 0.74 C ATOM 665 C PHE A 360 97.865 -13.596 6.442 1.00 0.74 C ATOM 666 O PHE A 360 96.787 -14.155 6.502 1.00 1.09 O ATOM 667 CB PHE A 360 97.522 -11.171 6.971 1.00 0.85 C ATOM 668 CG PHE A 360 97.918 -10.049 7.899 1.00 1.28 C ATOM 669 CD1 PHE A 360 97.467 -10.044 9.227 1.00 2.03 C ATOM 670 CD2 PHE A 360 98.737 -9.012 7.433 1.00 1.78 C ATOM 671 CE1 PHE A 360 97.835 -9.001 10.088 1.00 3.03 C ATOM 672 CE2 PHE A 360 99.106 -7.969 8.293 1.00 2.74 C ATOM 673 CZ PHE A 360 98.656 -7.963 9.621 1.00 3.32 C ATOM 0 H PHE A 360 100.013 -11.804 6.409 1.00 0.70 H new ATOM 0 HA PHE A 360 97.933 -12.777 8.395 1.00 0.74 H new ATOM 0 HB2 PHE A 360 97.789 -10.919 5.945 1.00 0.85 H new ATOM 0 HB3 PHE A 360 96.441 -11.311 6.994 1.00 0.85 H new ATOM 0 HD1 PHE A 360 96.836 -10.844 9.586 1.00 2.03 H new ATOM 0 HD2 PHE A 360 99.084 -9.017 6.410 1.00 1.78 H new ATOM 0 HE1 PHE A 360 97.487 -8.996 11.110 1.00 3.03 H new ATOM 0 HE2 PHE A 360 99.737 -7.170 7.933 1.00 2.74 H new ATOM 0 HZ PHE A 360 98.941 -7.160 10.284 1.00 3.32 H new ATOM 683 N ASN A 361 98.738 -13.901 5.532 1.00 0.72 N ATOM 684 CA ASN A 361 98.431 -14.956 4.529 1.00 0.77 C ATOM 685 C ASN A 361 97.171 -14.585 3.752 1.00 0.91 C ATOM 686 O ASN A 361 96.370 -15.427 3.398 1.00 1.34 O ATOM 687 CB ASN A 361 98.216 -16.222 5.353 1.00 0.79 C ATOM 688 CG ASN A 361 98.371 -17.453 4.459 1.00 1.27 C ATOM 689 OD1 ASN A 361 98.615 -17.330 3.275 1.00 1.68 O ATOM 690 ND2 ASN A 361 98.238 -18.642 4.977 1.00 1.90 N ATOM 0 H ASN A 361 99.655 -13.465 5.437 1.00 0.72 H new ATOM 0 HA ASN A 361 99.225 -15.084 3.793 1.00 0.77 H new ATOM 0 HB2 ASN A 361 98.936 -16.262 6.171 1.00 0.79 H new ATOM 0 HB3 ASN A 361 97.223 -16.210 5.803 1.00 0.79 H new ATOM 0 HD21 ASN A 361 98.339 -19.469 4.388 1.00 1.90 H new ATOM 0 HD22 ASN A 361 98.033 -18.745 5.971 1.00 1.90 H new ATOM 697 N LEU A 362 97.050 -13.339 3.404 1.00 0.88 N ATOM 698 CA LEU A 362 95.909 -12.904 2.553 1.00 1.13 C ATOM 699 C LEU A 362 96.194 -13.249 1.087 1.00 1.12 C ATOM 700 O LEU A 362 97.209 -13.833 0.765 1.00 1.73 O ATOM 701 CB LEU A 362 95.846 -11.390 2.735 1.00 1.68 C ATOM 702 CG LEU A 362 97.214 -10.786 2.407 1.00 2.21 C ATOM 703 CD1 LEU A 362 97.089 -9.872 1.186 1.00 2.65 C ATOM 704 CD2 LEU A 362 97.711 -9.972 3.602 1.00 2.80 C ATOM 0 H LEU A 362 97.696 -12.597 3.673 1.00 0.88 H new ATOM 0 HA LEU A 362 94.973 -13.392 2.826 1.00 1.13 H new ATOM 0 HB2 LEU A 362 95.082 -10.965 2.084 1.00 1.68 H new ATOM 0 HB3 LEU A 362 95.564 -11.146 3.759 1.00 1.68 H new ATOM 0 HG LEU A 362 97.922 -11.586 2.191 1.00 2.21 H new ATOM 0 HD11 LEU A 362 98.063 -9.442 0.952 1.00 2.65 H new ATOM 0 HD12 LEU A 362 96.734 -10.451 0.333 1.00 2.65 H new ATOM 0 HD13 LEU A 362 96.381 -9.072 1.402 1.00 2.65 H new ATOM 0 HD21 LEU A 362 98.685 -9.542 3.369 1.00 2.80 H new ATOM 0 HD22 LEU A 362 97.003 -9.172 3.817 1.00 2.80 H new ATOM 0 HD23 LEU A 362 97.800 -10.621 4.473 1.00 2.80 H new ATOM 716 N ARG A 363 95.320 -12.873 0.194 1.00 1.10 N ATOM 717 CA ARG A 363 95.559 -13.158 -1.245 1.00 1.09 C ATOM 718 C ARG A 363 95.502 -11.857 -2.050 1.00 0.86 C ATOM 719 O ARG A 363 94.778 -10.942 -1.713 1.00 1.03 O ATOM 720 CB ARG A 363 94.414 -14.084 -1.643 1.00 1.21 C ATOM 721 CG ARG A 363 93.107 -13.288 -1.701 1.00 2.11 C ATOM 722 CD ARG A 363 91.929 -14.251 -1.853 1.00 2.74 C ATOM 723 NE ARG A 363 90.735 -13.375 -2.019 1.00 3.36 N ATOM 724 CZ ARG A 363 90.555 -12.712 -3.131 1.00 3.92 C ATOM 725 NH1 ARG A 363 91.419 -12.814 -4.105 1.00 4.21 N ATOM 726 NH2 ARG A 363 89.508 -11.946 -3.269 1.00 4.40 N ATOM 0 H ARG A 363 94.451 -12.381 0.401 1.00 1.10 H new ATOM 0 HA ARG A 363 96.535 -13.605 -1.432 1.00 1.09 H new ATOM 0 HB2 ARG A 363 94.619 -14.537 -2.613 1.00 1.21 H new ATOM 0 HB3 ARG A 363 94.324 -14.898 -0.924 1.00 1.21 H new ATOM 0 HG2 ARG A 363 92.990 -12.694 -0.795 1.00 2.11 H new ATOM 0 HG3 ARG A 363 93.131 -12.591 -2.538 1.00 2.11 H new ATOM 0 HD2 ARG A 363 92.062 -14.905 -2.715 1.00 2.74 H new ATOM 0 HD3 ARG A 363 91.829 -14.894 -0.978 1.00 2.74 H new ATOM 0 HE ARG A 363 90.056 -13.292 -1.262 1.00 3.36 H new ATOM 0 HH11 ARG A 363 92.238 -13.413 -4.000 1.00 4.21 H new ATOM 0 HH12 ARG A 363 91.275 -12.295 -4.971 1.00 4.21 H new ATOM 0 HH21 ARG A 363 88.832 -11.865 -2.510 1.00 4.40 H new ATOM 0 HH22 ARG A 363 89.366 -11.428 -4.136 1.00 4.40 H new ATOM 740 N GLU A 364 96.202 -11.793 -3.149 1.00 0.74 N ATOM 741 CA GLU A 364 96.116 -10.578 -4.008 1.00 0.86 C ATOM 742 C GLU A 364 94.651 -10.295 -4.342 1.00 1.02 C ATOM 743 O GLU A 364 93.843 -11.198 -4.429 1.00 0.95 O ATOM 744 CB GLU A 364 96.901 -10.927 -5.273 1.00 0.96 C ATOM 745 CG GLU A 364 98.360 -11.204 -4.908 1.00 1.26 C ATOM 746 CD GLU A 364 99.163 -11.477 -6.182 1.00 1.69 C ATOM 747 OE1 GLU A 364 98.549 -11.607 -7.229 1.00 2.24 O ATOM 748 OE2 GLU A 364 100.377 -11.551 -6.090 1.00 2.21 O ATOM 0 H GLU A 364 96.826 -12.525 -3.488 1.00 0.74 H new ATOM 0 HA GLU A 364 96.517 -9.689 -3.522 1.00 0.86 H new ATOM 0 HB2 GLU A 364 96.464 -11.801 -5.756 1.00 0.96 H new ATOM 0 HB3 GLU A 364 96.843 -10.106 -5.988 1.00 0.96 H new ATOM 0 HG2 GLU A 364 98.781 -10.351 -4.376 1.00 1.26 H new ATOM 0 HG3 GLU A 364 98.422 -12.060 -4.236 1.00 1.26 H new ATOM 755 N ARG A 365 94.292 -9.053 -4.516 1.00 1.36 N ATOM 756 CA ARG A 365 92.879 -8.735 -4.826 1.00 1.73 C ATOM 757 C ARG A 365 92.699 -8.572 -6.334 1.00 1.59 C ATOM 758 O ARG A 365 93.539 -8.027 -7.021 1.00 1.56 O ATOM 759 CB ARG A 365 92.613 -7.428 -4.081 1.00 1.83 C ATOM 760 CG ARG A 365 91.417 -6.715 -4.700 1.00 2.15 C ATOM 761 CD ARG A 365 91.179 -5.387 -3.978 1.00 2.41 C ATOM 762 NE ARG A 365 90.930 -5.761 -2.558 1.00 3.18 N ATOM 763 CZ ARG A 365 90.661 -4.839 -1.672 1.00 3.60 C ATOM 764 NH1 ARG A 365 90.608 -3.582 -2.025 1.00 4.16 N ATOM 765 NH2 ARG A 365 90.444 -5.173 -0.430 1.00 3.72 N ATOM 0 H ARG A 365 94.918 -8.250 -4.456 1.00 1.36 H new ATOM 0 HA ARG A 365 92.185 -9.519 -4.522 1.00 1.73 H new ATOM 0 HB2 ARG A 365 92.421 -7.632 -3.028 1.00 1.83 H new ATOM 0 HB3 ARG A 365 93.494 -6.787 -4.126 1.00 1.83 H new ATOM 0 HG2 ARG A 365 91.596 -6.537 -5.760 1.00 2.15 H new ATOM 0 HG3 ARG A 365 90.529 -7.343 -4.628 1.00 2.15 H new ATOM 0 HD2 ARG A 365 92.043 -4.729 -4.067 1.00 2.41 H new ATOM 0 HD3 ARG A 365 90.327 -4.854 -4.401 1.00 2.41 H new ATOM 0 HE ARG A 365 90.970 -6.740 -2.276 1.00 3.18 H new ATOM 0 HH11 ARG A 365 90.777 -3.317 -2.995 1.00 4.16 H new ATOM 0 HH12 ARG A 365 90.398 -2.866 -1.330 1.00 4.16 H new ATOM 0 HH21 ARG A 365 90.484 -6.153 -0.151 1.00 3.72 H new ATOM 0 HH22 ARG A 365 90.234 -4.454 0.262 1.00 3.72 H new ATOM 779 N ASP A 366 91.596 -9.032 -6.844 1.00 1.70 N ATOM 780 CA ASP A 366 91.337 -8.900 -8.303 1.00 1.93 C ATOM 781 C ASP A 366 90.779 -7.514 -8.607 1.00 2.04 C ATOM 782 O ASP A 366 89.670 -7.182 -8.236 1.00 2.65 O ATOM 783 CB ASP A 366 90.304 -9.980 -8.621 1.00 2.62 C ATOM 784 CG ASP A 366 90.944 -11.361 -8.471 1.00 2.50 C ATOM 785 OD1 ASP A 366 92.157 -11.420 -8.348 1.00 2.86 O ATOM 786 OD2 ASP A 366 90.212 -12.336 -8.480 1.00 2.50 O ATOM 0 H ASP A 366 90.859 -9.496 -6.313 1.00 1.70 H new ATOM 0 HA ASP A 366 92.241 -9.018 -8.900 1.00 1.93 H new ATOM 0 HB2 ASP A 366 89.450 -9.889 -7.950 1.00 2.62 H new ATOM 0 HB3 ASP A 366 89.928 -9.850 -9.636 1.00 2.62 H new ATOM 791 N VAL A 367 91.544 -6.700 -9.271 1.00 1.75 N ATOM 792 CA VAL A 367 91.072 -5.329 -9.593 1.00 2.31 C ATOM 793 C VAL A 367 89.954 -5.384 -10.639 1.00 2.53 C ATOM 794 O VAL A 367 88.938 -4.737 -10.506 1.00 3.04 O ATOM 795 CB VAL A 367 92.305 -4.619 -10.150 1.00 2.28 C ATOM 796 CG1 VAL A 367 91.910 -3.253 -10.706 1.00 2.89 C ATOM 797 CG2 VAL A 367 93.334 -4.434 -9.031 1.00 2.52 C ATOM 0 H VAL A 367 92.480 -6.926 -9.606 1.00 1.75 H new ATOM 0 HA VAL A 367 90.660 -4.813 -8.726 1.00 2.31 H new ATOM 0 HB VAL A 367 92.736 -5.222 -10.950 1.00 2.28 H new ATOM 0 HG11 VAL A 367 92.793 -2.752 -11.102 1.00 2.89 H new ATOM 0 HG12 VAL A 367 91.179 -3.383 -11.504 1.00 2.89 H new ATOM 0 HG13 VAL A 367 91.476 -2.648 -9.910 1.00 2.89 H new ATOM 0 HG21 VAL A 367 94.214 -3.928 -9.426 1.00 2.52 H new ATOM 0 HG22 VAL A 367 92.899 -3.834 -8.232 1.00 2.52 H new ATOM 0 HG23 VAL A 367 93.622 -5.409 -8.637 1.00 2.52 H new ATOM 807 N GLN A 368 90.146 -6.129 -11.694 1.00 2.20 N ATOM 808 CA GLN A 368 89.104 -6.188 -12.763 1.00 2.40 C ATOM 809 C GLN A 368 87.897 -7.014 -12.308 1.00 2.11 C ATOM 810 O GLN A 368 86.786 -6.782 -12.742 1.00 2.30 O ATOM 811 CB GLN A 368 89.783 -6.848 -13.959 1.00 2.46 C ATOM 812 CG GLN A 368 88.852 -6.757 -15.170 1.00 3.09 C ATOM 813 CD GLN A 368 89.560 -7.319 -16.405 1.00 3.29 C ATOM 814 OE1 GLN A 368 90.737 -7.615 -16.362 1.00 3.32 O ATOM 815 NE2 GLN A 368 88.887 -7.480 -17.511 1.00 3.69 N ATOM 0 H GLN A 368 90.976 -6.698 -11.863 1.00 2.20 H new ATOM 0 HA GLN A 368 88.726 -5.195 -13.006 1.00 2.40 H new ATOM 0 HB2 GLN A 368 90.731 -6.354 -14.174 1.00 2.46 H new ATOM 0 HB3 GLN A 368 90.010 -7.890 -13.736 1.00 2.46 H new ATOM 0 HG2 GLN A 368 87.935 -7.314 -14.979 1.00 3.09 H new ATOM 0 HG3 GLN A 368 88.565 -5.720 -15.343 1.00 3.09 H new ATOM 0 HE21 GLN A 368 87.898 -7.231 -17.547 1.00 3.69 H new ATOM 0 HE22 GLN A 368 89.349 -7.854 -18.339 1.00 3.69 H new ATOM 824 N SER A 369 88.065 -7.835 -11.309 1.00 1.80 N ATOM 825 CA SER A 369 86.873 -8.490 -10.695 1.00 1.87 C ATOM 826 C SER A 369 86.094 -7.457 -9.883 1.00 1.79 C ATOM 827 O SER A 369 84.880 -7.475 -9.835 1.00 2.27 O ATOM 828 CB SER A 369 87.426 -9.595 -9.800 1.00 2.47 C ATOM 829 OG SER A 369 86.352 -10.237 -9.127 1.00 3.05 O ATOM 0 H SER A 369 88.964 -8.080 -10.894 1.00 1.80 H new ATOM 0 HA SER A 369 86.189 -8.901 -11.437 1.00 1.87 H new ATOM 0 HB2 SER A 369 87.980 -10.319 -10.397 1.00 2.47 H new ATOM 0 HB3 SER A 369 88.125 -9.176 -9.076 1.00 2.47 H new ATOM 0 HG SER A 369 86.705 -10.948 -8.552 1.00 3.05 H new ATOM 835 N LEU A 370 86.778 -6.475 -9.371 1.00 1.38 N ATOM 836 CA LEU A 370 86.078 -5.339 -8.710 1.00 1.39 C ATOM 837 C LEU A 370 85.789 -4.240 -9.735 1.00 1.12 C ATOM 838 O LEU A 370 85.419 -3.138 -9.384 1.00 1.30 O ATOM 839 CB LEU A 370 87.066 -4.841 -7.657 1.00 1.54 C ATOM 840 CG LEU A 370 87.504 -6.011 -6.777 1.00 1.39 C ATOM 841 CD1 LEU A 370 88.717 -5.597 -5.944 1.00 1.80 C ATOM 842 CD2 LEU A 370 86.355 -6.402 -5.844 1.00 2.14 C ATOM 0 H LEU A 370 87.796 -6.409 -9.381 1.00 1.38 H new ATOM 0 HA LEU A 370 85.122 -5.629 -8.273 1.00 1.39 H new ATOM 0 HB2 LEU A 370 87.933 -4.391 -8.140 1.00 1.54 H new ATOM 0 HB3 LEU A 370 86.603 -4.066 -7.046 1.00 1.54 H new ATOM 0 HG LEU A 370 87.769 -6.861 -7.406 1.00 1.39 H new ATOM 0 HD11 LEU A 370 89.029 -6.432 -5.316 1.00 1.80 H new ATOM 0 HD12 LEU A 370 89.535 -5.316 -6.607 1.00 1.80 H new ATOM 0 HD13 LEU A 370 88.453 -4.748 -5.314 1.00 1.80 H new ATOM 0 HD21 LEU A 370 86.665 -7.237 -5.215 1.00 2.14 H new ATOM 0 HD22 LEU A 370 86.092 -5.552 -5.215 1.00 2.14 H new ATOM 0 HD23 LEU A 370 85.489 -6.697 -6.437 1.00 2.14 H new ATOM 854 N HIS A 371 86.107 -4.481 -10.982 1.00 1.29 N ATOM 855 CA HIS A 371 86.015 -3.391 -11.994 1.00 1.13 C ATOM 856 C HIS A 371 86.915 -2.240 -11.558 1.00 1.00 C ATOM 857 O HIS A 371 86.698 -1.092 -11.892 1.00 1.35 O ATOM 858 CB HIS A 371 84.554 -2.958 -11.983 1.00 1.54 C ATOM 859 CG HIS A 371 83.670 -4.165 -12.133 1.00 1.50 C ATOM 860 ND1 HIS A 371 83.550 -4.850 -13.332 1.00 1.97 N ATOM 861 CD2 HIS A 371 82.855 -4.821 -11.243 1.00 1.80 C ATOM 862 CE1 HIS A 371 82.692 -5.868 -13.133 1.00 2.10 C ATOM 863 NE2 HIS A 371 82.239 -5.896 -11.876 1.00 1.80 N ATOM 0 H HIS A 371 86.425 -5.382 -11.340 1.00 1.29 H new ATOM 0 HA HIS A 371 86.329 -3.706 -12.989 1.00 1.13 H new ATOM 0 HB2 HIS A 371 84.325 -2.440 -11.052 1.00 1.54 H new ATOM 0 HB3 HIS A 371 84.367 -2.254 -12.794 1.00 1.54 H new ATOM 0 HD2 HIS A 371 82.714 -4.544 -10.209 1.00 1.80 H new ATOM 0 HE1 HIS A 371 82.405 -6.576 -13.896 1.00 2.10 H new ATOM 0 HE2 HIS A 371 81.583 -6.562 -11.468 1.00 1.80 H new ATOM 871 N ALA A 372 87.934 -2.559 -10.822 1.00 0.75 N ATOM 872 CA ALA A 372 88.890 -1.523 -10.350 1.00 0.94 C ATOM 873 C ALA A 372 89.998 -1.311 -11.388 1.00 0.90 C ATOM 874 O ALA A 372 89.882 -1.708 -12.531 1.00 1.04 O ATOM 875 CB ALA A 372 89.468 -2.088 -9.053 1.00 1.12 C ATOM 0 H ALA A 372 88.151 -3.509 -10.521 1.00 0.75 H new ATOM 0 HA ALA A 372 88.413 -0.555 -10.198 1.00 0.94 H new ATOM 0 HB1 ALA A 372 90.186 -1.382 -8.637 1.00 1.12 H new ATOM 0 HB2 ALA A 372 88.663 -2.251 -8.337 1.00 1.12 H new ATOM 0 HB3 ALA A 372 89.967 -3.035 -9.259 1.00 1.12 H new ATOM 881 N THR A 373 91.044 -0.635 -11.006 1.00 0.85 N ATOM 882 CA THR A 373 92.145 -0.321 -11.962 1.00 0.95 C ATOM 883 C THR A 373 93.509 -0.485 -11.285 1.00 0.93 C ATOM 884 O THR A 373 93.701 -0.074 -10.164 1.00 0.95 O ATOM 885 CB THR A 373 91.930 1.141 -12.341 1.00 1.32 C ATOM 886 OG1 THR A 373 90.730 1.270 -13.089 1.00 2.11 O ATOM 887 CG2 THR A 373 93.116 1.641 -13.167 1.00 1.90 C ATOM 0 H THR A 373 91.186 -0.281 -10.060 1.00 0.85 H new ATOM 0 HA THR A 373 92.133 -0.985 -12.827 1.00 0.95 H new ATOM 0 HB THR A 373 91.851 1.740 -11.434 1.00 1.32 H new ATOM 0 HG1 THR A 373 90.594 2.210 -13.329 1.00 2.11 H new ATOM 0 HG21 THR A 373 92.958 2.686 -13.435 1.00 1.90 H new ATOM 0 HG22 THR A 373 94.031 1.551 -12.581 1.00 1.90 H new ATOM 0 HG23 THR A 373 93.206 1.043 -14.074 1.00 1.90 H new ATOM 895 N PHE A 374 94.484 -0.957 -12.002 1.00 1.01 N ATOM 896 CA PHE A 374 95.868 -0.996 -11.441 1.00 1.25 C ATOM 897 C PHE A 374 96.588 0.325 -11.752 1.00 1.63 C ATOM 898 O PHE A 374 96.483 0.851 -12.843 1.00 1.61 O ATOM 899 CB PHE A 374 96.569 -2.142 -12.177 1.00 1.33 C ATOM 900 CG PHE A 374 95.991 -3.475 -11.763 1.00 1.63 C ATOM 901 CD1 PHE A 374 96.302 -4.018 -10.508 1.00 2.53 C ATOM 902 CD2 PHE A 374 95.160 -4.178 -12.645 1.00 1.41 C ATOM 903 CE1 PHE A 374 95.780 -5.265 -10.136 1.00 3.09 C ATOM 904 CE2 PHE A 374 94.636 -5.424 -12.272 1.00 1.89 C ATOM 905 CZ PHE A 374 94.946 -5.968 -11.018 1.00 2.72 C ATOM 0 H PHE A 374 94.388 -1.318 -12.951 1.00 1.01 H new ATOM 0 HA PHE A 374 95.868 -1.137 -10.360 1.00 1.25 H new ATOM 0 HB2 PHE A 374 96.459 -2.011 -13.253 1.00 1.33 H new ATOM 0 HB3 PHE A 374 97.637 -2.120 -11.961 1.00 1.33 H new ATOM 0 HD1 PHE A 374 96.943 -3.476 -9.829 1.00 2.53 H new ATOM 0 HD2 PHE A 374 94.923 -3.760 -13.612 1.00 1.41 H new ATOM 0 HE1 PHE A 374 96.020 -5.684 -9.170 1.00 3.09 H new ATOM 0 HE2 PHE A 374 93.993 -5.965 -12.951 1.00 1.89 H new ATOM 0 HZ PHE A 374 94.543 -6.928 -10.731 1.00 2.72 H new ATOM 915 N VAL A 375 97.393 0.812 -10.847 1.00 2.14 N ATOM 916 CA VAL A 375 98.198 2.035 -11.149 1.00 2.61 C ATOM 917 C VAL A 375 99.680 1.666 -11.276 1.00 2.22 C ATOM 918 O VAL A 375 100.287 1.221 -10.321 1.00 1.65 O ATOM 919 CB VAL A 375 97.982 2.964 -9.955 1.00 3.32 C ATOM 920 CG1 VAL A 375 98.475 4.368 -10.306 1.00 4.00 C ATOM 921 CG2 VAL A 375 96.491 3.019 -9.612 1.00 3.65 C ATOM 0 H VAL A 375 97.529 0.420 -9.915 1.00 2.14 H new ATOM 0 HA VAL A 375 97.899 2.504 -12.086 1.00 2.61 H new ATOM 0 HB VAL A 375 98.538 2.586 -9.097 1.00 3.32 H new ATOM 0 HG11 VAL A 375 98.321 5.031 -9.455 1.00 4.00 H new ATOM 0 HG12 VAL A 375 99.537 4.330 -10.549 1.00 4.00 H new ATOM 0 HG13 VAL A 375 97.919 4.745 -11.164 1.00 4.00 H new ATOM 0 HG21 VAL A 375 96.338 3.682 -8.760 1.00 3.65 H new ATOM 0 HG22 VAL A 375 95.934 3.396 -10.470 1.00 3.65 H new ATOM 0 HG23 VAL A 375 96.138 2.019 -9.361 1.00 3.65 H new ATOM 931 N PRO A 376 100.189 1.792 -12.474 1.00 2.87 N ATOM 932 CA PRO A 376 101.588 1.381 -12.762 1.00 2.67 C ATOM 933 C PRO A 376 102.578 2.070 -11.815 1.00 2.48 C ATOM 934 O PRO A 376 102.357 3.173 -11.357 1.00 3.24 O ATOM 935 CB PRO A 376 101.824 1.828 -14.208 1.00 3.84 C ATOM 936 CG PRO A 376 100.658 2.697 -14.569 1.00 4.63 C ATOM 937 CD PRO A 376 99.522 2.325 -13.659 1.00 4.03 C ATOM 0 HA PRO A 376 101.737 0.310 -12.622 1.00 2.67 H new ATOM 0 HB2 PRO A 376 102.762 2.376 -14.298 1.00 3.84 H new ATOM 0 HB3 PRO A 376 101.891 0.969 -14.876 1.00 3.84 H new ATOM 0 HG2 PRO A 376 100.914 3.750 -14.453 1.00 4.63 H new ATOM 0 HG3 PRO A 376 100.378 2.550 -15.612 1.00 4.63 H new ATOM 0 HD2 PRO A 376 98.904 3.189 -13.416 1.00 4.03 H new ATOM 0 HD3 PRO A 376 98.867 1.584 -14.118 1.00 4.03 H new ATOM 945 N PHE A 377 103.688 1.432 -11.556 1.00 2.13 N ATOM 946 CA PHE A 377 104.735 2.041 -10.682 1.00 3.07 C ATOM 947 C PHE A 377 105.835 2.666 -11.543 1.00 3.61 C ATOM 948 O PHE A 377 106.494 1.993 -12.310 1.00 4.10 O ATOM 949 CB PHE A 377 105.286 0.857 -9.876 1.00 3.15 C ATOM 950 CG PHE A 377 106.401 1.309 -8.953 1.00 3.91 C ATOM 951 CD1 PHE A 377 106.647 2.675 -8.748 1.00 4.01 C ATOM 952 CD2 PHE A 377 107.200 0.352 -8.310 1.00 4.73 C ATOM 953 CE1 PHE A 377 107.686 3.081 -7.899 1.00 4.92 C ATOM 954 CE2 PHE A 377 108.239 0.759 -7.462 1.00 5.70 C ATOM 955 CZ PHE A 377 108.481 2.124 -7.259 1.00 5.79 C ATOM 0 H PHE A 377 103.917 0.506 -11.916 1.00 2.13 H new ATOM 0 HA PHE A 377 104.348 2.834 -10.042 1.00 3.07 H new ATOM 0 HB2 PHE A 377 104.485 0.404 -9.292 1.00 3.15 H new ATOM 0 HB3 PHE A 377 105.658 0.090 -10.555 1.00 3.15 H new ATOM 0 HD1 PHE A 377 106.036 3.414 -9.244 1.00 4.01 H new ATOM 0 HD2 PHE A 377 107.014 -0.700 -8.469 1.00 4.73 H new ATOM 0 HE1 PHE A 377 107.873 4.133 -7.739 1.00 4.92 H new ATOM 0 HE2 PHE A 377 108.852 0.021 -6.966 1.00 5.70 H new ATOM 0 HZ PHE A 377 109.283 2.438 -6.607 1.00 5.79 H new ATOM 965 N THR A 378 106.082 3.936 -11.374 1.00 3.85 N ATOM 966 CA THR A 378 107.191 4.584 -12.130 1.00 4.47 C ATOM 967 C THR A 378 108.311 4.979 -11.167 1.00 4.28 C ATOM 968 O THR A 378 108.063 5.410 -10.057 1.00 3.71 O ATOM 969 CB THR A 378 106.566 5.827 -12.766 1.00 4.59 C ATOM 970 OG1 THR A 378 106.272 6.779 -11.754 1.00 4.26 O ATOM 971 CG2 THR A 378 105.279 5.437 -13.494 1.00 5.29 C ATOM 0 H THR A 378 105.565 4.552 -10.746 1.00 3.85 H new ATOM 0 HA THR A 378 107.627 3.923 -12.879 1.00 4.47 H new ATOM 0 HB THR A 378 107.266 6.262 -13.479 1.00 4.59 H new ATOM 0 HG1 THR A 378 105.732 7.504 -12.133 1.00 4.26 H new ATOM 0 HG21 THR A 378 104.834 6.323 -13.947 1.00 5.29 H new ATOM 0 HG22 THR A 378 105.507 4.708 -14.271 1.00 5.29 H new ATOM 0 HG23 THR A 378 104.577 5.001 -12.783 1.00 5.29 H new ATOM 979 N ALA A 379 109.539 4.799 -11.571 1.00 5.01 N ATOM 980 CA ALA A 379 110.679 5.125 -10.669 1.00 5.10 C ATOM 981 C ALA A 379 110.878 6.640 -10.581 1.00 5.05 C ATOM 982 O ALA A 379 111.365 7.153 -9.594 1.00 5.37 O ATOM 983 CB ALA A 379 111.896 4.462 -11.316 1.00 6.13 C ATOM 0 H ALA A 379 109.802 4.440 -12.489 1.00 5.01 H new ATOM 0 HA ALA A 379 110.511 4.771 -9.652 1.00 5.10 H new ATOM 0 HB1 ALA A 379 112.781 4.656 -10.710 1.00 6.13 H new ATOM 0 HB2 ALA A 379 111.731 3.387 -11.384 1.00 6.13 H new ATOM 0 HB3 ALA A 379 112.044 4.870 -12.316 1.00 6.13 H new ATOM 989 N GLN A 380 110.563 7.354 -11.628 1.00 4.87 N ATOM 990 CA GLN A 380 110.805 8.826 -11.616 1.00 4.93 C ATOM 991 C GLN A 380 110.049 9.469 -10.452 1.00 4.05 C ATOM 992 O GLN A 380 110.614 10.195 -9.657 1.00 3.84 O ATOM 993 CB GLN A 380 110.258 9.329 -12.952 1.00 5.65 C ATOM 994 CG GLN A 380 111.055 8.703 -14.098 1.00 6.07 C ATOM 995 CD GLN A 380 110.576 9.283 -15.430 1.00 7.03 C ATOM 996 OE1 GLN A 380 110.959 10.375 -15.803 1.00 7.74 O ATOM 997 NE2 GLN A 380 109.748 8.596 -16.168 1.00 7.22 N ATOM 0 H GLN A 380 110.151 6.985 -12.485 1.00 4.87 H new ATOM 0 HA GLN A 380 111.859 9.073 -11.490 1.00 4.93 H new ATOM 0 HB2 GLN A 380 109.203 9.071 -13.045 1.00 5.65 H new ATOM 0 HB3 GLN A 380 110.326 10.416 -12.999 1.00 5.65 H new ATOM 0 HG2 GLN A 380 112.119 8.900 -13.965 1.00 6.07 H new ATOM 0 HG3 GLN A 380 110.928 7.620 -14.094 1.00 6.07 H new ATOM 0 HE21 GLN A 380 109.426 7.680 -15.856 1.00 7.22 H new ATOM 0 HE22 GLN A 380 109.422 8.975 -17.057 1.00 7.22 H new ATOM 1006 N SER A 381 108.807 9.113 -10.276 1.00 3.64 N ATOM 1007 CA SER A 381 108.057 9.599 -9.084 1.00 3.06 C ATOM 1008 C SER A 381 108.203 8.596 -7.940 1.00 2.42 C ATOM 1009 O SER A 381 107.860 8.873 -6.810 1.00 3.00 O ATOM 1010 CB SER A 381 106.601 9.686 -9.542 1.00 3.49 C ATOM 1011 OG SER A 381 106.048 8.379 -9.601 1.00 3.82 O ATOM 0 H SER A 381 108.279 8.508 -10.905 1.00 3.64 H new ATOM 0 HA SER A 381 108.424 10.559 -8.720 1.00 3.06 H new ATOM 0 HB2 SER A 381 106.027 10.305 -8.852 1.00 3.49 H new ATOM 0 HB3 SER A 381 106.544 10.162 -10.521 1.00 3.49 H new ATOM 0 HG SER A 381 106.261 7.973 -10.467 1.00 3.82 H new ATOM 1017 N ARG A 382 108.693 7.423 -8.235 1.00 1.65 N ATOM 1018 CA ARG A 382 108.842 6.388 -7.174 1.00 1.74 C ATOM 1019 C ARG A 382 107.483 6.101 -6.535 1.00 1.57 C ATOM 1020 O ARG A 382 107.327 6.184 -5.332 1.00 2.08 O ATOM 1021 CB ARG A 382 109.790 7.005 -6.145 1.00 2.53 C ATOM 1022 CG ARG A 382 111.076 7.453 -6.839 1.00 2.69 C ATOM 1023 CD ARG A 382 112.091 7.913 -5.790 1.00 2.89 C ATOM 1024 NE ARG A 382 113.208 8.510 -6.572 1.00 3.36 N ATOM 1025 CZ ARG A 382 114.042 9.339 -6.001 1.00 3.67 C ATOM 1026 NH1 ARG A 382 113.903 9.649 -4.740 1.00 3.72 N ATOM 1027 NH2 ARG A 382 115.017 9.860 -6.694 1.00 4.25 N ATOM 0 H ARG A 382 108.997 7.137 -9.166 1.00 1.65 H new ATOM 0 HA ARG A 382 109.224 5.445 -7.566 1.00 1.74 H new ATOM 0 HB2 ARG A 382 109.312 7.855 -5.658 1.00 2.53 H new ATOM 0 HB3 ARG A 382 110.019 6.279 -5.365 1.00 2.53 H new ATOM 0 HG2 ARG A 382 111.490 6.632 -7.425 1.00 2.69 H new ATOM 0 HG3 ARG A 382 110.862 8.265 -7.534 1.00 2.69 H new ATOM 0 HD2 ARG A 382 111.652 8.642 -5.109 1.00 2.89 H new ATOM 0 HD3 ARG A 382 112.437 7.077 -5.182 1.00 2.89 H new ATOM 0 HE ARG A 382 113.323 8.271 -7.557 1.00 3.36 H new ATOM 0 HH11 ARG A 382 113.141 9.244 -4.196 1.00 3.72 H new ATOM 0 HH12 ARG A 382 114.556 10.296 -4.299 1.00 3.72 H new ATOM 0 HH21 ARG A 382 115.127 9.620 -7.679 1.00 4.25 H new ATOM 0 HH22 ARG A 382 115.669 10.507 -6.251 1.00 4.25 H new ATOM 1041 N MET A 383 106.488 5.789 -7.323 1.00 1.27 N ATOM 1042 CA MET A 383 105.147 5.533 -6.730 1.00 1.19 C ATOM 1043 C MET A 383 104.328 4.577 -7.593 1.00 1.07 C ATOM 1044 O MET A 383 104.374 4.608 -8.807 1.00 1.14 O ATOM 1045 CB MET A 383 104.462 6.897 -6.659 1.00 1.32 C ATOM 1046 CG MET A 383 105.151 7.765 -5.607 1.00 1.51 C ATOM 1047 SD MET A 383 104.137 9.227 -5.276 1.00 2.09 S ATOM 1048 CE MET A 383 103.893 9.720 -6.998 1.00 1.57 C ATOM 0 H MET A 383 106.546 5.702 -8.338 1.00 1.27 H new ATOM 0 HA MET A 383 105.237 5.065 -5.750 1.00 1.19 H new ATOM 0 HB2 MET A 383 104.503 7.386 -7.632 1.00 1.32 H new ATOM 0 HB3 MET A 383 103.408 6.773 -6.409 1.00 1.32 H new ATOM 0 HG2 MET A 383 105.298 7.196 -4.689 1.00 1.51 H new ATOM 0 HG3 MET A 383 106.138 8.065 -5.957 1.00 1.51 H new ATOM 0 HE1 MET A 383 104.249 10.741 -7.138 1.00 1.57 H new ATOM 0 HE2 MET A 383 104.450 9.049 -7.651 1.00 1.57 H new ATOM 0 HE3 MET A 383 102.832 9.668 -7.244 1.00 1.57 H new ATOM 1058 N SER A 384 103.483 3.831 -6.952 1.00 0.97 N ATOM 1059 CA SER A 384 102.515 2.961 -7.664 1.00 1.02 C ATOM 1060 C SER A 384 101.248 2.888 -6.819 1.00 0.93 C ATOM 1061 O SER A 384 101.212 3.399 -5.723 1.00 0.83 O ATOM 1062 CB SER A 384 103.191 1.596 -7.740 1.00 1.23 C ATOM 1063 OG SER A 384 103.065 0.939 -6.486 1.00 1.18 O ATOM 0 H SER A 384 103.421 3.786 -5.935 1.00 0.97 H new ATOM 0 HA SER A 384 102.248 3.321 -8.658 1.00 1.02 H new ATOM 0 HB2 SER A 384 102.734 0.995 -8.526 1.00 1.23 H new ATOM 0 HB3 SER A 384 104.244 1.712 -7.998 1.00 1.23 H new ATOM 0 HG SER A 384 103.927 0.546 -6.234 1.00 1.18 H new ATOM 1069 N GLY A 385 100.212 2.266 -7.289 1.00 1.02 N ATOM 1070 CA GLY A 385 98.985 2.196 -6.450 1.00 1.00 C ATOM 1071 C GLY A 385 97.887 1.447 -7.181 1.00 0.95 C ATOM 1072 O GLY A 385 98.118 0.731 -8.134 1.00 1.13 O ATOM 0 H GLY A 385 100.156 1.810 -8.200 1.00 1.02 H new ATOM 0 HA2 GLY A 385 99.209 1.697 -5.507 1.00 1.00 H new ATOM 0 HA3 GLY A 385 98.646 3.203 -6.205 1.00 1.00 H new ATOM 1076 N ILE A 386 96.693 1.593 -6.709 1.00 0.80 N ATOM 1077 CA ILE A 386 95.546 0.887 -7.317 1.00 0.78 C ATOM 1078 C ILE A 386 94.285 1.712 -7.096 1.00 0.77 C ATOM 1079 O ILE A 386 94.138 2.378 -6.094 1.00 0.80 O ATOM 1080 CB ILE A 386 95.471 -0.437 -6.568 1.00 0.81 C ATOM 1081 CG1 ILE A 386 94.142 -1.125 -6.859 1.00 0.86 C ATOM 1082 CG2 ILE A 386 95.580 -0.192 -5.064 1.00 0.84 C ATOM 1083 CD1 ILE A 386 94.126 -2.454 -6.118 1.00 1.26 C ATOM 0 H ILE A 386 96.458 2.184 -5.911 1.00 0.80 H new ATOM 0 HA ILE A 386 95.650 0.733 -8.391 1.00 0.78 H new ATOM 0 HB ILE A 386 96.294 -1.071 -6.899 1.00 0.81 H new ATOM 0 HG12 ILE A 386 93.310 -0.499 -6.536 1.00 0.86 H new ATOM 0 HG13 ILE A 386 94.023 -1.285 -7.931 1.00 0.86 H new ATOM 0 HG21 ILE A 386 95.525 -1.144 -4.535 1.00 0.84 H new ATOM 0 HG22 ILE A 386 96.531 0.292 -4.842 1.00 0.84 H new ATOM 0 HG23 ILE A 386 94.761 0.450 -4.740 1.00 0.84 H new ATOM 0 HD11 ILE A 386 93.183 -2.967 -6.310 1.00 1.26 H new ATOM 0 HD12 ILE A 386 94.953 -3.074 -6.464 1.00 1.26 H new ATOM 0 HD13 ILE A 386 94.230 -2.275 -5.048 1.00 1.26 H new ATOM 1095 N ASN A 387 93.352 1.627 -7.985 1.00 0.78 N ATOM 1096 CA ASN A 387 92.073 2.353 -7.783 1.00 0.83 C ATOM 1097 C ASN A 387 90.934 1.344 -7.797 1.00 0.92 C ATOM 1098 O ASN A 387 90.937 0.418 -8.573 1.00 0.86 O ATOM 1099 CB ASN A 387 91.950 3.307 -8.974 1.00 0.91 C ATOM 1100 CG ASN A 387 93.298 3.977 -9.240 1.00 1.31 C ATOM 1101 OD1 ASN A 387 93.632 4.271 -10.371 1.00 2.04 O ATOM 1102 ND2 ASN A 387 94.092 4.230 -8.239 1.00 1.81 N ATOM 0 H ASN A 387 93.415 1.086 -8.847 1.00 0.78 H new ATOM 0 HA ASN A 387 92.039 2.895 -6.838 1.00 0.83 H new ATOM 0 HB2 ASN A 387 91.625 2.759 -9.859 1.00 0.91 H new ATOM 0 HB3 ASN A 387 91.192 4.063 -8.770 1.00 0.91 H new ATOM 0 HD21 ASN A 387 94.995 4.675 -8.404 1.00 1.81 H new ATOM 0 HD22 ASN A 387 93.811 3.983 -7.290 1.00 1.81 H new ATOM 1109 N ILE A 388 89.928 1.540 -7.009 1.00 1.18 N ATOM 1110 CA ILE A 388 88.774 0.607 -7.077 1.00 1.31 C ATOM 1111 C ILE A 388 87.474 1.360 -6.828 1.00 1.70 C ATOM 1112 O ILE A 388 87.479 2.515 -6.451 1.00 1.89 O ATOM 1113 CB ILE A 388 89.030 -0.425 -5.987 1.00 1.24 C ATOM 1114 CG1 ILE A 388 87.886 -1.438 -5.963 1.00 1.66 C ATOM 1115 CG2 ILE A 388 89.114 0.281 -4.641 1.00 1.50 C ATOM 1116 CD1 ILE A 388 88.421 -2.789 -5.491 1.00 2.11 C ATOM 0 H ILE A 388 89.849 2.294 -6.327 1.00 1.18 H new ATOM 0 HA ILE A 388 88.677 0.137 -8.055 1.00 1.31 H new ATOM 0 HB ILE A 388 89.967 -0.945 -6.187 1.00 1.24 H new ATOM 0 HG12 ILE A 388 87.094 -1.094 -5.298 1.00 1.66 H new ATOM 0 HG13 ILE A 388 87.448 -1.534 -6.957 1.00 1.66 H new ATOM 0 HG21 ILE A 388 89.297 -0.453 -3.856 1.00 1.50 H new ATOM 0 HG22 ILE A 388 89.930 1.004 -4.660 1.00 1.50 H new ATOM 0 HG23 ILE A 388 88.175 0.798 -4.442 1.00 1.50 H new ATOM 0 HD11 ILE A 388 87.609 -3.516 -5.472 1.00 2.11 H new ATOM 0 HD12 ILE A 388 89.198 -3.131 -6.174 1.00 2.11 H new ATOM 0 HD13 ILE A 388 88.838 -2.685 -4.489 1.00 2.11 H new ATOM 1128 N ASP A 389 86.369 0.760 -7.163 1.00 1.97 N ATOM 1129 CA ASP A 389 85.067 1.485 -7.110 1.00 2.37 C ATOM 1130 C ASP A 389 84.667 1.927 -5.685 1.00 2.14 C ATOM 1131 O ASP A 389 83.604 2.483 -5.495 1.00 2.92 O ATOM 1132 CB ASP A 389 84.067 0.460 -7.631 1.00 2.65 C ATOM 1133 CG ASP A 389 84.263 0.272 -9.136 1.00 3.31 C ATOM 1134 OD1 ASP A 389 85.010 1.042 -9.718 1.00 3.85 O ATOM 1135 OD2 ASP A 389 83.664 -0.640 -9.682 1.00 3.63 O ATOM 0 H ASP A 389 86.309 -0.210 -7.474 1.00 1.97 H new ATOM 0 HA ASP A 389 85.112 2.409 -7.687 1.00 2.37 H new ATOM 0 HB2 ASP A 389 84.203 -0.490 -7.115 1.00 2.65 H new ATOM 0 HB3 ASP A 389 83.049 0.792 -7.425 1.00 2.65 H new ATOM 1140 N ASN A 390 85.521 1.787 -4.703 1.00 1.20 N ATOM 1141 CA ASN A 390 85.174 2.320 -3.352 1.00 1.12 C ATOM 1142 C ASN A 390 86.412 2.890 -2.639 1.00 0.97 C ATOM 1143 O ASN A 390 86.351 3.230 -1.474 1.00 1.15 O ATOM 1144 CB ASN A 390 84.626 1.115 -2.586 1.00 1.13 C ATOM 1145 CG ASN A 390 83.868 1.599 -1.348 1.00 1.53 C ATOM 1146 OD1 ASN A 390 83.504 2.755 -1.258 1.00 2.33 O ATOM 1147 ND2 ASN A 390 83.615 0.758 -0.383 1.00 1.89 N ATOM 0 H ASN A 390 86.431 1.333 -4.776 1.00 1.20 H new ATOM 0 HA ASN A 390 84.457 3.138 -3.415 1.00 1.12 H new ATOM 0 HB2 ASN A 390 83.963 0.534 -3.227 1.00 1.13 H new ATOM 0 HB3 ASN A 390 85.443 0.456 -2.291 1.00 1.13 H new ATOM 0 HD21 ASN A 390 83.112 1.071 0.447 1.00 1.89 H new ATOM 0 HD22 ASN A 390 83.921 -0.212 -0.459 1.00 1.89 H new ATOM 1154 N ARG A 391 87.559 2.880 -3.272 1.00 0.83 N ATOM 1155 CA ARG A 391 88.800 3.292 -2.552 1.00 0.73 C ATOM 1156 C ARG A 391 89.882 3.744 -3.535 1.00 0.74 C ATOM 1157 O ARG A 391 89.975 3.240 -4.634 1.00 1.10 O ATOM 1158 CB ARG A 391 89.266 2.036 -1.809 1.00 0.94 C ATOM 1159 CG ARG A 391 88.251 1.664 -0.726 1.00 1.05 C ATOM 1160 CD ARG A 391 88.827 0.547 0.148 1.00 1.30 C ATOM 1161 NE ARG A 391 87.700 0.125 1.026 1.00 1.92 N ATOM 1162 CZ ARG A 391 87.906 -0.722 1.999 1.00 2.13 C ATOM 1163 NH1 ARG A 391 89.102 -1.206 2.209 1.00 2.15 N ATOM 1164 NH2 ARG A 391 86.914 -1.088 2.764 1.00 2.69 N ATOM 0 H ARG A 391 87.688 2.607 -4.246 1.00 0.83 H new ATOM 0 HA ARG A 391 88.611 4.131 -1.882 1.00 0.73 H new ATOM 0 HB2 ARG A 391 89.381 1.210 -2.511 1.00 0.94 H new ATOM 0 HB3 ARG A 391 90.243 2.211 -1.359 1.00 0.94 H new ATOM 0 HG2 ARG A 391 88.019 2.536 -0.115 1.00 1.05 H new ATOM 0 HG3 ARG A 391 87.317 1.338 -1.184 1.00 1.05 H new ATOM 0 HD2 ARG A 391 89.187 -0.284 -0.459 1.00 1.30 H new ATOM 0 HD3 ARG A 391 89.674 0.902 0.736 1.00 1.30 H new ATOM 0 HE ARG A 391 86.764 0.499 0.867 1.00 1.92 H new ATOM 0 HH11 ARG A 391 89.879 -0.923 1.612 1.00 2.15 H new ATOM 0 HH12 ARG A 391 89.258 -1.867 2.970 1.00 2.15 H new ATOM 0 HH21 ARG A 391 85.979 -0.713 2.602 1.00 2.69 H new ATOM 0 HH22 ARG A 391 87.073 -1.749 3.524 1.00 2.69 H new ATOM 1178 N MET A 392 90.841 4.485 -3.056 1.00 0.48 N ATOM 1179 CA MET A 392 92.072 4.718 -3.863 1.00 0.51 C ATOM 1180 C MET A 392 93.303 4.424 -2.997 1.00 0.48 C ATOM 1181 O MET A 392 93.332 4.750 -1.827 1.00 0.52 O ATOM 1182 CB MET A 392 92.025 6.195 -4.257 1.00 0.59 C ATOM 1183 CG MET A 392 90.805 6.448 -5.144 1.00 1.14 C ATOM 1184 SD MET A 392 90.856 8.147 -5.769 1.00 1.31 S ATOM 1185 CE MET A 392 90.844 8.980 -4.162 1.00 2.02 C ATOM 0 H MET A 392 90.827 4.939 -2.143 1.00 0.48 H new ATOM 0 HA MET A 392 92.128 4.077 -4.743 1.00 0.51 H new ATOM 0 HB2 MET A 392 91.975 6.819 -3.365 1.00 0.59 H new ATOM 0 HB3 MET A 392 92.937 6.470 -4.787 1.00 0.59 H new ATOM 0 HG2 MET A 392 90.794 5.743 -5.976 1.00 1.14 H new ATOM 0 HG3 MET A 392 89.889 6.285 -4.576 1.00 1.14 H new ATOM 0 HE1 MET A 392 90.219 9.871 -4.219 1.00 2.02 H new ATOM 0 HE2 MET A 392 90.446 8.304 -3.405 1.00 2.02 H new ATOM 0 HE3 MET A 392 91.861 9.267 -3.893 1.00 2.02 H new ATOM 1195 N ILE A 393 94.320 3.814 -3.547 1.00 0.45 N ATOM 1196 CA ILE A 393 95.529 3.518 -2.725 1.00 0.45 C ATOM 1197 C ILE A 393 96.792 3.961 -3.468 1.00 0.50 C ATOM 1198 O ILE A 393 96.937 3.722 -4.648 1.00 0.60 O ATOM 1199 CB ILE A 393 95.519 1.999 -2.536 1.00 0.43 C ATOM 1200 CG1 ILE A 393 94.154 1.565 -1.996 1.00 1.21 C ATOM 1201 CG2 ILE A 393 96.615 1.604 -1.542 1.00 0.98 C ATOM 1202 CD1 ILE A 393 94.023 1.985 -0.532 1.00 1.68 C ATOM 0 H ILE A 393 94.366 3.511 -4.520 1.00 0.45 H new ATOM 0 HA ILE A 393 95.521 4.045 -1.771 1.00 0.45 H new ATOM 0 HB ILE A 393 95.703 1.508 -3.492 1.00 0.43 H new ATOM 0 HG12 ILE A 393 93.358 2.017 -2.587 1.00 1.21 H new ATOM 0 HG13 ILE A 393 94.043 0.484 -2.086 1.00 1.21 H new ATOM 0 HG21 ILE A 393 96.610 0.523 -1.406 1.00 0.98 H new ATOM 0 HG22 ILE A 393 97.586 1.917 -1.927 1.00 0.98 H new ATOM 0 HG23 ILE A 393 96.431 2.091 -0.585 1.00 0.98 H new ATOM 0 HD11 ILE A 393 93.050 1.675 -0.150 1.00 1.68 H new ATOM 0 HD12 ILE A 393 94.811 1.512 0.054 1.00 1.68 H new ATOM 0 HD13 ILE A 393 94.114 3.068 -0.455 1.00 1.68 H new ATOM 1214 N ARG A 394 97.742 4.522 -2.770 1.00 0.63 N ATOM 1215 CA ARG A 394 99.031 4.879 -3.433 1.00 0.72 C ATOM 1216 C ARG A 394 100.208 4.621 -2.487 1.00 0.60 C ATOM 1217 O ARG A 394 100.112 4.809 -1.294 1.00 0.54 O ATOM 1218 CB ARG A 394 98.915 6.367 -3.762 1.00 0.78 C ATOM 1219 CG ARG A 394 99.974 6.743 -4.800 1.00 1.27 C ATOM 1220 CD ARG A 394 99.621 6.093 -6.140 1.00 1.04 C ATOM 1221 NE ARG A 394 100.705 6.511 -7.073 1.00 1.47 N ATOM 1222 CZ ARG A 394 100.688 7.702 -7.612 1.00 1.92 C ATOM 1223 NH1 ARG A 394 99.732 8.543 -7.321 1.00 2.78 N ATOM 1224 NH2 ARG A 394 101.631 8.052 -8.443 1.00 2.09 N ATOM 0 H ARG A 394 97.684 4.748 -1.777 1.00 0.63 H new ATOM 0 HA ARG A 394 99.212 4.281 -4.327 1.00 0.72 H new ATOM 0 HB2 ARG A 394 97.919 6.589 -4.146 1.00 0.78 H new ATOM 0 HB3 ARG A 394 99.049 6.962 -2.858 1.00 0.78 H new ATOM 0 HG2 ARG A 394 100.024 7.826 -4.910 1.00 1.27 H new ATOM 0 HG3 ARG A 394 100.958 6.411 -4.469 1.00 1.27 H new ATOM 0 HD2 ARG A 394 99.574 5.008 -6.051 1.00 1.04 H new ATOM 0 HD3 ARG A 394 98.646 6.426 -6.495 1.00 1.04 H new ATOM 0 HE ARG A 394 101.464 5.865 -7.292 1.00 1.47 H new ATOM 0 HH11 ARG A 394 98.994 8.272 -6.671 1.00 2.78 H new ATOM 0 HH12 ARG A 394 99.723 9.471 -7.744 1.00 2.78 H new ATOM 0 HH21 ARG A 394 102.379 7.397 -8.671 1.00 2.09 H new ATOM 0 HH22 ARG A 394 101.620 8.981 -8.865 1.00 2.09 H new ATOM 1238 N LYS A 395 101.317 4.192 -3.019 1.00 0.63 N ATOM 1239 CA LYS A 395 102.514 3.916 -2.170 1.00 0.58 C ATOM 1240 C LYS A 395 103.787 4.247 -2.954 1.00 0.60 C ATOM 1241 O LYS A 395 103.847 4.054 -4.147 1.00 0.68 O ATOM 1242 CB LYS A 395 102.450 2.418 -1.879 1.00 0.72 C ATOM 1243 CG LYS A 395 103.453 2.063 -0.781 1.00 0.80 C ATOM 1244 CD LYS A 395 104.799 1.720 -1.419 1.00 1.11 C ATOM 1245 CE LYS A 395 104.651 0.460 -2.272 1.00 1.15 C ATOM 1246 NZ LYS A 395 106.001 -0.162 -2.259 1.00 1.57 N ATOM 0 H LYS A 395 101.449 4.018 -4.015 1.00 0.63 H new ATOM 0 HA LYS A 395 102.526 4.511 -1.257 1.00 0.58 H new ATOM 0 HB2 LYS A 395 101.443 2.141 -1.568 1.00 0.72 H new ATOM 0 HB3 LYS A 395 102.671 1.852 -2.784 1.00 0.72 H new ATOM 0 HG2 LYS A 395 103.567 2.900 -0.092 1.00 0.80 H new ATOM 0 HG3 LYS A 395 103.088 1.217 -0.198 1.00 0.80 H new ATOM 0 HD2 LYS A 395 105.144 2.551 -2.035 1.00 1.11 H new ATOM 0 HD3 LYS A 395 105.551 1.563 -0.646 1.00 1.11 H new ATOM 0 HE2 LYS A 395 103.900 -0.213 -1.858 1.00 1.15 H new ATOM 0 HE3 LYS A 395 104.336 0.703 -3.287 1.00 1.15 H new ATOM 0 HZ1 LYS A 395 105.995 -1.017 -2.851 1.00 1.57 H new ATOM 0 HZ2 LYS A 395 106.698 0.513 -2.633 1.00 1.57 H new ATOM 0 HZ3 LYS A 395 106.256 -0.418 -1.284 1.00 1.57 H new ATOM 1260 N GLY A 396 104.815 4.703 -2.297 1.00 0.56 N ATOM 1261 CA GLY A 396 106.084 4.989 -3.032 1.00 0.60 C ATOM 1262 C GLY A 396 107.118 5.604 -2.092 1.00 0.55 C ATOM 1263 O GLY A 396 107.141 5.324 -0.910 1.00 0.82 O ATOM 0 H GLY A 396 104.836 4.889 -1.294 1.00 0.56 H new ATOM 0 HA2 GLY A 396 106.477 4.068 -3.463 1.00 0.60 H new ATOM 0 HA3 GLY A 396 105.886 5.669 -3.860 1.00 0.60 H new ATOM 1267 N SER A 397 107.999 6.416 -2.616 1.00 0.50 N ATOM 1268 CA SER A 397 109.062 7.016 -1.759 1.00 0.60 C ATOM 1269 C SER A 397 108.460 8.038 -0.792 1.00 0.48 C ATOM 1270 O SER A 397 107.398 8.579 -1.023 1.00 0.61 O ATOM 1271 CB SER A 397 110.042 7.680 -2.726 1.00 0.91 C ATOM 1272 OG SER A 397 111.007 6.723 -3.144 1.00 1.17 O ATOM 0 H SER A 397 108.028 6.689 -3.598 1.00 0.50 H new ATOM 0 HA SER A 397 109.560 6.267 -1.143 1.00 0.60 H new ATOM 0 HB2 SER A 397 109.507 8.076 -3.589 1.00 0.91 H new ATOM 0 HB3 SER A 397 110.535 8.523 -2.242 1.00 0.91 H new ATOM 0 HG SER A 397 111.907 7.096 -3.035 1.00 1.17 H new ATOM 1278 N VAL A 398 109.095 8.243 0.329 1.00 0.53 N ATOM 1279 CA VAL A 398 108.517 9.156 1.355 1.00 0.47 C ATOM 1280 C VAL A 398 108.353 10.559 0.777 1.00 0.51 C ATOM 1281 O VAL A 398 107.270 11.106 0.763 1.00 0.51 O ATOM 1282 CB VAL A 398 109.529 9.159 2.496 1.00 0.46 C ATOM 1283 CG1 VAL A 398 109.035 10.081 3.612 1.00 0.50 C ATOM 1284 CG2 VAL A 398 109.682 7.737 3.036 1.00 0.51 C ATOM 0 H VAL A 398 109.988 7.818 0.579 1.00 0.53 H new ATOM 0 HA VAL A 398 107.531 8.834 1.688 1.00 0.47 H new ATOM 0 HB VAL A 398 110.492 9.517 2.132 1.00 0.46 H new ATOM 0 HG11 VAL A 398 109.758 10.084 4.428 1.00 0.50 H new ATOM 0 HG12 VAL A 398 108.922 11.093 3.224 1.00 0.50 H new ATOM 0 HG13 VAL A 398 108.073 9.724 3.980 1.00 0.50 H new ATOM 0 HG21 VAL A 398 110.405 7.733 3.852 1.00 0.51 H new ATOM 0 HG22 VAL A 398 108.719 7.381 3.402 1.00 0.51 H new ATOM 0 HG23 VAL A 398 110.032 7.081 2.239 1.00 0.51 H new ATOM 1294 N ASP A 399 109.375 11.084 0.164 1.00 0.55 N ATOM 1295 CA ASP A 399 109.207 12.372 -0.561 1.00 0.62 C ATOM 1296 C ASP A 399 108.147 12.198 -1.647 1.00 0.64 C ATOM 1297 O ASP A 399 107.335 13.068 -1.892 1.00 0.64 O ATOM 1298 CB ASP A 399 110.575 12.663 -1.181 1.00 0.71 C ATOM 1299 CG ASP A 399 111.590 12.942 -0.070 1.00 1.10 C ATOM 1300 OD1 ASP A 399 111.166 13.135 1.058 1.00 1.59 O ATOM 1301 OD2 ASP A 399 112.773 12.958 -0.367 1.00 1.46 O ATOM 0 H ASP A 399 110.312 10.681 0.133 1.00 0.55 H new ATOM 0 HA ASP A 399 108.884 13.186 0.088 1.00 0.62 H new ATOM 0 HB2 ASP A 399 110.902 11.814 -1.782 1.00 0.71 H new ATOM 0 HB3 ASP A 399 110.508 13.521 -1.850 1.00 0.71 H new ATOM 1306 N ALA A 400 108.134 11.058 -2.278 1.00 0.70 N ATOM 1307 CA ALA A 400 107.116 10.792 -3.330 1.00 0.76 C ATOM 1308 C ALA A 400 105.701 10.859 -2.742 1.00 0.72 C ATOM 1309 O ALA A 400 104.828 11.512 -3.276 1.00 0.75 O ATOM 1310 CB ALA A 400 107.432 9.377 -3.819 1.00 0.85 C ATOM 0 H ALA A 400 108.789 10.295 -2.109 1.00 0.70 H new ATOM 0 HA ALA A 400 107.149 11.526 -4.135 1.00 0.76 H new ATOM 0 HB1 ALA A 400 106.726 9.096 -4.601 1.00 0.85 H new ATOM 0 HB2 ALA A 400 108.446 9.348 -4.218 1.00 0.85 H new ATOM 0 HB3 ALA A 400 107.349 8.678 -2.987 1.00 0.85 H new ATOM 1316 N ILE A 401 105.450 10.164 -1.663 1.00 0.67 N ATOM 1317 CA ILE A 401 104.074 10.172 -1.086 1.00 0.66 C ATOM 1318 C ILE A 401 103.692 11.568 -0.589 1.00 0.59 C ATOM 1319 O ILE A 401 102.576 12.009 -0.760 1.00 0.64 O ATOM 1320 CB ILE A 401 104.118 9.179 0.076 1.00 0.64 C ATOM 1321 CG1 ILE A 401 104.455 7.782 -0.453 1.00 0.81 C ATOM 1322 CG2 ILE A 401 102.756 9.144 0.770 1.00 0.68 C ATOM 1323 CD1 ILE A 401 103.582 7.469 -1.671 1.00 0.62 C ATOM 0 H ILE A 401 106.132 9.596 -1.160 1.00 0.67 H new ATOM 0 HA ILE A 401 103.326 9.897 -1.830 1.00 0.66 H new ATOM 0 HB ILE A 401 104.882 9.491 0.788 1.00 0.64 H new ATOM 0 HG12 ILE A 401 105.509 7.730 -0.726 1.00 0.81 H new ATOM 0 HG13 ILE A 401 104.290 7.038 0.326 1.00 0.81 H new ATOM 0 HG21 ILE A 401 102.788 8.436 1.598 1.00 0.68 H new ATOM 0 HG22 ILE A 401 102.516 10.137 1.150 1.00 0.68 H new ATOM 0 HG23 ILE A 401 101.992 8.834 0.057 1.00 0.68 H new ATOM 0 HD11 ILE A 401 103.824 6.474 -2.046 1.00 0.62 H new ATOM 0 HD12 ILE A 401 102.531 7.503 -1.384 1.00 0.62 H new ATOM 0 HD13 ILE A 401 103.769 8.206 -2.452 1.00 0.62 H new ATOM 1335 N ARG A 402 104.607 12.281 0.005 1.00 0.50 N ATOM 1336 CA ARG A 402 104.277 13.655 0.480 1.00 0.47 C ATOM 1337 C ARG A 402 103.805 14.519 -0.694 1.00 0.54 C ATOM 1338 O ARG A 402 102.834 15.240 -0.593 1.00 0.62 O ATOM 1339 CB ARG A 402 105.582 14.201 1.060 1.00 0.44 C ATOM 1340 CG ARG A 402 105.330 15.580 1.671 1.00 1.17 C ATOM 1341 CD ARG A 402 106.629 16.115 2.280 1.00 1.24 C ATOM 1342 NE ARG A 402 107.508 16.404 1.113 1.00 1.71 N ATOM 1343 CZ ARG A 402 108.717 16.865 1.299 1.00 2.17 C ATOM 1344 NH1 ARG A 402 109.162 17.078 2.508 1.00 2.62 N ATOM 1345 NH2 ARG A 402 109.482 17.115 0.272 1.00 2.61 N ATOM 0 H ARG A 402 105.564 11.975 0.182 1.00 0.50 H new ATOM 0 HA ARG A 402 103.475 13.656 1.218 1.00 0.47 H new ATOM 0 HB2 ARG A 402 105.968 13.520 1.819 1.00 0.44 H new ATOM 0 HB3 ARG A 402 106.339 14.270 0.279 1.00 0.44 H new ATOM 0 HG2 ARG A 402 104.964 16.266 0.907 1.00 1.17 H new ATOM 0 HG3 ARG A 402 104.557 15.514 2.437 1.00 1.17 H new ATOM 0 HD2 ARG A 402 106.448 17.013 2.870 1.00 1.24 H new ATOM 0 HD3 ARG A 402 107.084 15.382 2.946 1.00 1.24 H new ATOM 0 HE ARG A 402 107.166 16.242 0.166 1.00 1.71 H new ATOM 0 HH11 ARG A 402 108.565 16.885 3.312 1.00 2.62 H new ATOM 0 HH12 ARG A 402 110.106 17.438 2.648 1.00 2.62 H new ATOM 0 HH21 ARG A 402 109.136 16.951 -0.673 1.00 2.61 H new ATOM 0 HH22 ARG A 402 110.426 17.475 0.415 1.00 2.61 H new ATOM 1359 N ARG A 403 104.457 14.421 -1.820 1.00 0.54 N ATOM 1360 CA ARG A 403 104.012 15.205 -3.008 1.00 0.62 C ATOM 1361 C ARG A 403 102.643 14.720 -3.498 1.00 0.72 C ATOM 1362 O ARG A 403 101.800 15.503 -3.884 1.00 0.82 O ATOM 1363 CB ARG A 403 105.079 14.963 -4.067 1.00 0.63 C ATOM 1364 CG ARG A 403 106.401 15.551 -3.580 1.00 0.83 C ATOM 1365 CD ARG A 403 107.294 15.831 -4.783 1.00 0.96 C ATOM 1366 NE ARG A 403 108.617 16.201 -4.207 1.00 1.38 N ATOM 1367 CZ ARG A 403 109.641 16.406 -4.991 1.00 2.01 C ATOM 1368 NH1 ARG A 403 109.514 16.289 -6.286 1.00 2.48 N ATOM 1369 NH2 ARG A 403 110.797 16.731 -4.479 1.00 2.46 N ATOM 0 H ARG A 403 105.277 13.833 -1.969 1.00 0.54 H new ATOM 0 HA ARG A 403 103.900 16.264 -2.777 1.00 0.62 H new ATOM 0 HB2 ARG A 403 105.188 13.895 -4.255 1.00 0.63 H new ATOM 0 HB3 ARG A 403 104.786 15.424 -5.010 1.00 0.63 H new ATOM 0 HG2 ARG A 403 106.221 16.470 -3.023 1.00 0.83 H new ATOM 0 HG3 ARG A 403 106.894 14.857 -2.899 1.00 0.83 H new ATOM 0 HD2 ARG A 403 107.375 14.955 -5.426 1.00 0.96 H new ATOM 0 HD3 ARG A 403 106.890 16.638 -5.394 1.00 0.96 H new ATOM 0 HE ARG A 403 108.723 16.295 -3.197 1.00 1.38 H new ATOM 0 HH11 ARG A 403 108.612 16.036 -6.689 1.00 2.48 H new ATOM 0 HH12 ARG A 403 110.317 16.450 -6.894 1.00 2.48 H new ATOM 0 HH21 ARG A 403 110.899 16.824 -3.468 1.00 2.46 H new ATOM 0 HH22 ARG A 403 111.598 16.892 -5.090 1.00 2.46 H new ATOM 1383 N HIS A 404 102.393 13.442 -3.433 1.00 0.74 N ATOM 1384 CA HIS A 404 101.054 12.926 -3.842 1.00 0.86 C ATOM 1385 C HIS A 404 99.960 13.476 -2.920 1.00 0.84 C ATOM 1386 O HIS A 404 98.903 13.877 -3.366 1.00 0.94 O ATOM 1387 CB HIS A 404 101.160 11.408 -3.715 1.00 0.92 C ATOM 1388 CG HIS A 404 99.871 10.774 -4.160 1.00 1.32 C ATOM 1389 ND1 HIS A 404 99.429 10.840 -5.472 1.00 1.39 N ATOM 1390 CD2 HIS A 404 98.916 10.060 -3.478 1.00 2.29 C ATOM 1391 CE1 HIS A 404 98.257 10.182 -5.538 1.00 1.88 C ATOM 1392 NE2 HIS A 404 97.898 9.687 -4.351 1.00 2.43 N ATOM 0 H HIS A 404 103.055 12.733 -3.116 1.00 0.74 H new ATOM 0 HA HIS A 404 100.787 13.231 -4.854 1.00 0.86 H new ATOM 0 HB2 HIS A 404 101.987 11.039 -4.322 1.00 0.92 H new ATOM 0 HB3 HIS A 404 101.375 11.133 -2.682 1.00 0.92 H new ATOM 0 HD2 HIS A 404 98.950 9.824 -2.425 1.00 2.29 H new ATOM 0 HE1 HIS A 404 97.677 10.068 -6.442 1.00 1.88 H new ATOM 0 HE2 HIS A 404 97.059 9.151 -4.131 1.00 2.43 H new ATOM 1400 N VAL A 405 100.219 13.549 -1.645 1.00 0.76 N ATOM 1401 CA VAL A 405 99.207 14.127 -0.716 1.00 0.79 C ATOM 1402 C VAL A 405 98.977 15.608 -1.031 1.00 0.85 C ATOM 1403 O VAL A 405 97.859 16.076 -1.058 1.00 0.94 O ATOM 1404 CB VAL A 405 99.803 13.956 0.681 1.00 0.76 C ATOM 1405 CG1 VAL A 405 98.895 14.630 1.711 1.00 0.80 C ATOM 1406 CG2 VAL A 405 99.923 12.465 1.006 1.00 0.76 C ATOM 0 H VAL A 405 101.084 13.235 -1.206 1.00 0.76 H new ATOM 0 HA VAL A 405 98.239 13.635 -0.806 1.00 0.79 H new ATOM 0 HB VAL A 405 100.791 14.416 0.712 1.00 0.76 H new ATOM 0 HG11 VAL A 405 99.321 14.507 2.707 1.00 0.80 H new ATOM 0 HG12 VAL A 405 98.810 15.692 1.481 1.00 0.80 H new ATOM 0 HG13 VAL A 405 97.907 14.171 1.680 1.00 0.80 H new ATOM 0 HG21 VAL A 405 100.348 12.343 2.002 1.00 0.76 H new ATOM 0 HG22 VAL A 405 98.935 12.005 0.974 1.00 0.76 H new ATOM 0 HG23 VAL A 405 100.571 11.984 0.274 1.00 0.76 H new ATOM 1416 N GLU A 406 100.022 16.360 -1.231 1.00 0.84 N ATOM 1417 CA GLU A 406 99.843 17.817 -1.493 1.00 0.95 C ATOM 1418 C GLU A 406 99.038 18.044 -2.779 1.00 1.05 C ATOM 1419 O GLU A 406 98.238 18.955 -2.865 1.00 1.19 O ATOM 1420 CB GLU A 406 101.260 18.370 -1.644 1.00 0.91 C ATOM 1421 CG GLU A 406 102.011 18.221 -0.319 1.00 0.88 C ATOM 1422 CD GLU A 406 103.405 18.837 -0.450 1.00 1.43 C ATOM 1423 OE1 GLU A 406 103.776 19.184 -1.559 1.00 2.16 O ATOM 1424 OE2 GLU A 406 104.077 18.952 0.561 1.00 1.86 O ATOM 0 H GLU A 406 100.988 16.033 -1.225 1.00 0.84 H new ATOM 0 HA GLU A 406 99.293 18.309 -0.691 1.00 0.95 H new ATOM 0 HB2 GLU A 406 101.787 17.837 -2.435 1.00 0.91 H new ATOM 0 HB3 GLU A 406 101.223 19.419 -1.937 1.00 0.91 H new ATOM 0 HG2 GLU A 406 101.458 18.713 0.482 1.00 0.88 H new ATOM 0 HG3 GLU A 406 102.091 17.168 -0.051 1.00 0.88 H new ATOM 1431 N ALA A 407 99.231 17.222 -3.774 1.00 1.02 N ATOM 1432 CA ALA A 407 98.464 17.397 -5.042 1.00 1.17 C ATOM 1433 C ALA A 407 96.980 17.132 -4.786 1.00 1.32 C ATOM 1434 O ALA A 407 96.125 17.912 -5.156 1.00 1.53 O ATOM 1435 CB ALA A 407 99.039 16.356 -6.002 1.00 1.12 C ATOM 0 H ALA A 407 99.884 16.439 -3.765 1.00 1.02 H new ATOM 0 HA ALA A 407 98.547 18.406 -5.446 1.00 1.17 H new ATOM 0 HB1 ALA A 407 98.525 16.422 -6.961 1.00 1.12 H new ATOM 0 HB2 ALA A 407 100.103 16.544 -6.147 1.00 1.12 H new ATOM 0 HB3 ALA A 407 98.900 15.359 -5.583 1.00 1.12 H new ATOM 1441 N ASN A 408 96.690 16.124 -4.015 1.00 1.23 N ATOM 1442 CA ASN A 408 95.291 15.901 -3.567 1.00 1.37 C ATOM 1443 C ASN A 408 94.871 17.045 -2.650 1.00 1.44 C ATOM 1444 O ASN A 408 93.701 17.322 -2.469 1.00 1.60 O ATOM 1445 CB ASN A 408 95.342 14.582 -2.801 1.00 1.27 C ATOM 1446 CG ASN A 408 95.567 13.430 -3.781 1.00 1.88 C ATOM 1447 OD1 ASN A 408 96.362 12.547 -3.528 1.00 2.75 O ATOM 1448 ND2 ASN A 408 94.895 13.401 -4.900 1.00 2.02 N ATOM 0 H ASN A 408 97.367 15.441 -3.674 1.00 1.23 H new ATOM 0 HA ASN A 408 94.575 15.864 -4.388 1.00 1.37 H new ATOM 0 HB2 ASN A 408 96.145 14.608 -2.064 1.00 1.27 H new ATOM 0 HB3 ASN A 408 94.412 14.431 -2.254 1.00 1.27 H new ATOM 0 HD21 ASN A 408 95.038 12.637 -5.561 1.00 2.02 H new ATOM 0 HD22 ASN A 408 94.227 14.142 -5.113 1.00 2.02 H new ATOM 1455 N GLY A 409 95.826 17.651 -2.005 1.00 1.37 N ATOM 1456 CA GLY A 409 95.512 18.712 -1.018 1.00 1.51 C ATOM 1457 C GLY A 409 95.484 18.105 0.384 1.00 1.69 C ATOM 1458 O GLY A 409 94.895 18.648 1.298 1.00 2.28 O ATOM 0 H GLY A 409 96.820 17.453 -2.122 1.00 1.37 H new ATOM 0 HA2 GLY A 409 96.259 19.504 -1.069 1.00 1.51 H new ATOM 0 HA3 GLY A 409 94.549 19.166 -1.249 1.00 1.51 H new ATOM 1462 N GLY A 410 96.147 16.995 0.566 1.00 1.39 N ATOM 1463 CA GLY A 410 96.197 16.363 1.916 1.00 1.72 C ATOM 1464 C GLY A 410 97.440 16.850 2.663 1.00 1.26 C ATOM 1465 O GLY A 410 98.174 17.690 2.182 1.00 1.69 O ATOM 0 H GLY A 410 96.657 16.497 -0.164 1.00 1.39 H new ATOM 0 HA2 GLY A 410 95.299 16.615 2.480 1.00 1.72 H new ATOM 0 HA3 GLY A 410 96.220 15.277 1.820 1.00 1.72 H new ATOM 1469 N HIS A 411 97.716 16.286 3.807 1.00 0.88 N ATOM 1470 CA HIS A 411 98.952 16.671 4.548 1.00 1.32 C ATOM 1471 C HIS A 411 99.630 15.427 5.131 1.00 1.27 C ATOM 1472 O HIS A 411 98.982 14.457 5.472 1.00 1.52 O ATOM 1473 CB HIS A 411 98.474 17.599 5.666 1.00 1.83 C ATOM 1474 CG HIS A 411 97.899 18.852 5.065 1.00 2.66 C ATOM 1475 ND1 HIS A 411 96.555 18.976 4.757 1.00 3.39 N ATOM 1476 CD2 HIS A 411 98.476 20.047 4.710 1.00 3.34 C ATOM 1477 CE1 HIS A 411 96.367 20.205 4.242 1.00 4.16 C ATOM 1478 NE2 HIS A 411 97.508 20.899 4.191 1.00 4.13 N ATOM 0 H HIS A 411 97.141 15.576 4.261 1.00 0.88 H new ATOM 0 HA HIS A 411 99.684 17.157 3.903 1.00 1.32 H new ATOM 0 HB2 HIS A 411 97.722 17.096 6.274 1.00 1.83 H new ATOM 0 HB3 HIS A 411 99.304 17.848 6.327 1.00 1.83 H new ATOM 0 HD2 HIS A 411 99.523 20.288 4.818 1.00 3.34 H new ATOM 0 HE1 HIS A 411 95.411 20.584 3.911 1.00 4.16 H new ATOM 0 HE2 HIS A 411 97.640 21.850 3.845 1.00 4.13 H new ATOM 1486 N PHE A 412 100.930 15.452 5.253 1.00 1.04 N ATOM 1487 CA PHE A 412 101.650 14.276 5.822 1.00 1.06 C ATOM 1488 C PHE A 412 101.777 14.421 7.343 1.00 1.03 C ATOM 1489 O PHE A 412 102.452 15.308 7.827 1.00 1.05 O ATOM 1490 CB PHE A 412 103.029 14.308 5.160 1.00 1.03 C ATOM 1491 CG PHE A 412 103.565 12.902 5.036 1.00 1.36 C ATOM 1492 CD1 PHE A 412 104.177 12.285 6.136 1.00 1.73 C ATOM 1493 CD2 PHE A 412 103.452 12.215 3.820 1.00 1.90 C ATOM 1494 CE1 PHE A 412 104.677 10.980 6.019 1.00 2.70 C ATOM 1495 CE2 PHE A 412 103.953 10.911 3.702 1.00 2.91 C ATOM 1496 CZ PHE A 412 104.565 10.294 4.802 1.00 3.31 C ATOM 0 H PHE A 412 101.525 16.236 4.983 1.00 1.04 H new ATOM 0 HA PHE A 412 101.129 13.337 5.637 1.00 1.06 H new ATOM 0 HB2 PHE A 412 102.960 14.770 4.175 1.00 1.03 H new ATOM 0 HB3 PHE A 412 103.713 14.918 5.751 1.00 1.03 H new ATOM 0 HD1 PHE A 412 104.263 12.815 7.073 1.00 1.73 H new ATOM 0 HD2 PHE A 412 102.979 12.690 2.973 1.00 1.90 H new ATOM 0 HE1 PHE A 412 105.148 10.504 6.866 1.00 2.70 H new ATOM 0 HE2 PHE A 412 103.868 10.382 2.764 1.00 2.91 H new ATOM 0 HZ PHE A 412 104.950 9.289 4.712 1.00 3.31 H new ATOM 1506 N PRO A 413 101.091 13.560 8.049 1.00 1.03 N ATOM 1507 CA PRO A 413 101.094 13.613 9.534 1.00 1.06 C ATOM 1508 C PRO A 413 102.522 13.476 10.076 1.00 0.96 C ATOM 1509 O PRO A 413 103.338 12.763 9.525 1.00 0.88 O ATOM 1510 CB PRO A 413 100.240 12.416 9.954 1.00 1.16 C ATOM 1511 CG PRO A 413 99.463 12.027 8.735 1.00 1.23 C ATOM 1512 CD PRO A 413 100.258 12.469 7.537 1.00 1.05 C ATOM 0 HA PRO A 413 100.709 14.557 9.920 1.00 1.06 H new ATOM 0 HB2 PRO A 413 100.864 11.592 10.300 1.00 1.16 H new ATOM 0 HB3 PRO A 413 99.574 12.679 10.776 1.00 1.16 H new ATOM 0 HG2 PRO A 413 99.300 10.950 8.711 1.00 1.23 H new ATOM 0 HG3 PRO A 413 98.480 12.499 8.739 1.00 1.23 H new ATOM 0 HD2 PRO A 413 100.865 11.656 7.139 1.00 1.05 H new ATOM 0 HD3 PRO A 413 99.609 12.807 6.729 1.00 1.05 H new ATOM 1520 N THR A 414 102.835 14.175 11.133 1.00 1.01 N ATOM 1521 CA THR A 414 104.218 14.107 11.688 1.00 0.97 C ATOM 1522 C THR A 414 104.556 12.672 12.107 1.00 0.92 C ATOM 1523 O THR A 414 105.644 12.190 11.874 1.00 0.84 O ATOM 1524 CB THR A 414 104.208 15.047 12.903 1.00 1.09 C ATOM 1525 OG1 THR A 414 105.539 15.446 13.199 1.00 1.63 O ATOM 1526 CG2 THR A 414 103.606 14.337 14.121 1.00 1.75 C ATOM 0 H THR A 414 102.195 14.789 11.636 1.00 1.01 H new ATOM 0 HA THR A 414 104.971 14.401 10.957 1.00 0.97 H new ATOM 0 HB THR A 414 103.601 15.922 12.669 1.00 1.09 H new ATOM 0 HG1 THR A 414 105.536 16.047 13.973 1.00 1.63 H new ATOM 0 HG21 THR A 414 103.606 15.015 14.974 1.00 1.75 H new ATOM 0 HG22 THR A 414 102.583 14.035 13.897 1.00 1.75 H new ATOM 0 HG23 THR A 414 104.201 13.455 14.359 1.00 1.75 H new ATOM 1534 N ASP A 415 103.651 12.006 12.770 1.00 0.99 N ATOM 1535 CA ASP A 415 103.948 10.628 13.254 1.00 0.97 C ATOM 1536 C ASP A 415 104.346 9.727 12.083 1.00 0.83 C ATOM 1537 O ASP A 415 105.217 8.892 12.196 1.00 0.84 O ATOM 1538 CB ASP A 415 102.648 10.140 13.890 1.00 1.08 C ATOM 1539 CG ASP A 415 102.359 10.955 15.153 1.00 1.27 C ATOM 1540 OD1 ASP A 415 103.247 11.667 15.590 1.00 1.80 O ATOM 1541 OD2 ASP A 415 101.254 10.852 15.660 1.00 1.87 O ATOM 0 H ASP A 415 102.720 12.356 12.997 1.00 0.99 H new ATOM 0 HA ASP A 415 104.777 10.611 13.961 1.00 0.97 H new ATOM 0 HB2 ASP A 415 101.825 10.241 13.183 1.00 1.08 H new ATOM 0 HB3 ASP A 415 102.727 9.081 14.138 1.00 1.08 H new ATOM 1546 N VAL A 416 103.754 9.915 10.942 1.00 0.71 N ATOM 1547 CA VAL A 416 104.158 9.098 9.767 1.00 0.60 C ATOM 1548 C VAL A 416 105.553 9.514 9.288 1.00 0.51 C ATOM 1549 O VAL A 416 106.362 8.687 8.922 1.00 0.46 O ATOM 1550 CB VAL A 416 103.102 9.394 8.704 1.00 0.58 C ATOM 1551 CG1 VAL A 416 103.518 8.767 7.371 1.00 0.51 C ATOM 1552 CG2 VAL A 416 101.760 8.803 9.146 1.00 0.71 C ATOM 0 H VAL A 416 103.012 10.594 10.771 1.00 0.71 H new ATOM 0 HA VAL A 416 104.213 8.034 9.996 1.00 0.60 H new ATOM 0 HB VAL A 416 103.007 10.473 8.580 1.00 0.58 H new ATOM 0 HG11 VAL A 416 102.761 8.981 6.616 1.00 0.51 H new ATOM 0 HG12 VAL A 416 104.474 9.185 7.055 1.00 0.51 H new ATOM 0 HG13 VAL A 416 103.615 7.688 7.491 1.00 0.51 H new ATOM 0 HG21 VAL A 416 101.004 9.012 8.390 1.00 0.71 H new ATOM 0 HG22 VAL A 416 101.860 7.725 9.270 1.00 0.71 H new ATOM 0 HG23 VAL A 416 101.460 9.251 10.093 1.00 0.71 H new ATOM 1562 N ASP A 417 105.866 10.778 9.348 1.00 0.53 N ATOM 1563 CA ASP A 417 107.238 11.219 8.958 1.00 0.53 C ATOM 1564 C ASP A 417 108.281 10.618 9.906 1.00 0.58 C ATOM 1565 O ASP A 417 109.288 10.088 9.481 1.00 0.60 O ATOM 1566 CB ASP A 417 107.216 12.743 9.074 1.00 0.61 C ATOM 1567 CG ASP A 417 108.509 13.319 8.492 1.00 1.03 C ATOM 1568 OD1 ASP A 417 109.293 12.546 7.964 1.00 1.81 O ATOM 1569 OD2 ASP A 417 108.694 14.521 8.585 1.00 1.15 O ATOM 0 H ASP A 417 105.237 11.523 9.648 1.00 0.53 H new ATOM 0 HA ASP A 417 107.504 10.893 7.952 1.00 0.53 H new ATOM 0 HB2 ASP A 417 106.354 13.146 8.542 1.00 0.61 H new ATOM 0 HB3 ASP A 417 107.112 13.037 10.118 1.00 0.61 H new ATOM 1574 N GLN A 418 108.024 10.638 11.184 1.00 0.62 N ATOM 1575 CA GLN A 418 108.975 10.009 12.141 1.00 0.68 C ATOM 1576 C GLN A 418 109.009 8.490 11.938 1.00 0.69 C ATOM 1577 O GLN A 418 110.051 7.877 12.009 1.00 0.81 O ATOM 1578 CB GLN A 418 108.457 10.374 13.536 1.00 0.73 C ATOM 1579 CG GLN A 418 107.047 9.825 13.731 1.00 1.31 C ATOM 1580 CD GLN A 418 106.633 9.989 15.194 1.00 1.86 C ATOM 1581 OE1 GLN A 418 106.179 11.043 15.596 1.00 1.96 O ATOM 1582 NE2 GLN A 418 106.771 8.984 16.015 1.00 2.60 N ATOM 0 H GLN A 418 107.198 11.062 11.606 1.00 0.62 H new ATOM 0 HA GLN A 418 109.996 10.362 11.996 1.00 0.68 H new ATOM 0 HB2 GLN A 418 109.123 9.968 14.298 1.00 0.73 H new ATOM 0 HB3 GLN A 418 108.455 11.457 13.660 1.00 0.73 H new ATOM 0 HG2 GLN A 418 106.347 10.352 13.083 1.00 1.31 H new ATOM 0 HG3 GLN A 418 107.013 8.773 13.448 1.00 1.31 H new ATOM 0 HE21 GLN A 418 107.152 8.099 15.679 1.00 2.60 H new ATOM 0 HE22 GLN A 418 106.498 9.083 16.993 1.00 2.60 H new ATOM 1591 N LYS A 419 107.896 7.881 11.633 1.00 0.61 N ATOM 1592 CA LYS A 419 107.907 6.411 11.372 1.00 0.63 C ATOM 1593 C LYS A 419 108.795 6.087 10.163 1.00 0.62 C ATOM 1594 O LYS A 419 109.545 5.134 10.167 1.00 0.71 O ATOM 1595 CB LYS A 419 106.450 6.057 11.078 1.00 0.57 C ATOM 1596 CG LYS A 419 106.296 4.537 11.000 1.00 0.81 C ATOM 1597 CD LYS A 419 106.009 3.980 12.397 1.00 0.93 C ATOM 1598 CE LYS A 419 104.773 4.669 12.978 1.00 1.33 C ATOM 1599 NZ LYS A 419 105.308 5.651 13.961 1.00 2.49 N ATOM 0 H LYS A 419 106.985 8.332 11.553 1.00 0.61 H new ATOM 0 HA LYS A 419 108.306 5.845 12.214 1.00 0.63 H new ATOM 0 HB2 LYS A 419 105.803 6.458 11.858 1.00 0.57 H new ATOM 0 HB3 LYS A 419 106.137 6.513 10.139 1.00 0.57 H new ATOM 0 HG2 LYS A 419 105.485 4.278 10.320 1.00 0.81 H new ATOM 0 HG3 LYS A 419 107.205 4.089 10.598 1.00 0.81 H new ATOM 0 HD2 LYS A 419 105.847 2.903 12.344 1.00 0.93 H new ATOM 0 HD3 LYS A 419 106.868 4.142 13.048 1.00 0.93 H new ATOM 0 HE2 LYS A 419 104.194 5.165 12.199 1.00 1.33 H new ATOM 0 HE3 LYS A 419 104.109 3.950 13.459 1.00 1.33 H new ATOM 0 HZ1 LYS A 419 104.753 6.529 13.912 1.00 2.49 H new ATOM 0 HZ2 LYS A 419 105.243 5.253 14.920 1.00 2.49 H new ATOM 0 HZ3 LYS A 419 106.303 5.858 13.739 1.00 2.49 H new ATOM 1613 N VAL A 420 108.749 6.905 9.148 1.00 0.56 N ATOM 1614 CA VAL A 420 109.614 6.686 7.950 1.00 0.62 C ATOM 1615 C VAL A 420 111.090 6.821 8.325 1.00 0.71 C ATOM 1616 O VAL A 420 111.940 6.101 7.843 1.00 0.79 O ATOM 1617 CB VAL A 420 109.213 7.801 6.987 1.00 0.60 C ATOM 1618 CG1 VAL A 420 110.244 7.913 5.862 1.00 0.70 C ATOM 1619 CG2 VAL A 420 107.839 7.490 6.388 1.00 0.59 C ATOM 0 H VAL A 420 108.144 7.724 9.095 1.00 0.56 H new ATOM 0 HA VAL A 420 109.487 5.692 7.521 1.00 0.62 H new ATOM 0 HB VAL A 420 109.170 8.745 7.531 1.00 0.60 H new ATOM 0 HG11 VAL A 420 109.952 8.710 5.179 1.00 0.70 H new ATOM 0 HG12 VAL A 420 111.222 8.139 6.286 1.00 0.70 H new ATOM 0 HG13 VAL A 420 110.293 6.969 5.319 1.00 0.70 H new ATOM 0 HG21 VAL A 420 107.553 8.286 5.701 1.00 0.59 H new ATOM 0 HG22 VAL A 420 107.883 6.544 5.849 1.00 0.59 H new ATOM 0 HG23 VAL A 420 107.101 7.418 7.187 1.00 0.59 H new ATOM 1629 N ASP A 421 111.396 7.786 9.138 1.00 0.72 N ATOM 1630 CA ASP A 421 112.814 8.044 9.511 1.00 0.84 C ATOM 1631 C ASP A 421 113.354 6.929 10.410 1.00 0.91 C ATOM 1632 O ASP A 421 114.445 6.434 10.213 1.00 1.00 O ATOM 1633 CB ASP A 421 112.766 9.370 10.264 1.00 0.88 C ATOM 1634 CG ASP A 421 112.529 10.511 9.274 1.00 1.14 C ATOM 1635 OD1 ASP A 421 112.576 10.255 8.082 1.00 1.25 O ATOM 1636 OD2 ASP A 421 112.304 11.623 9.724 1.00 2.05 O ATOM 0 H ASP A 421 110.718 8.416 9.567 1.00 0.72 H new ATOM 0 HA ASP A 421 113.473 8.078 8.644 1.00 0.84 H new ATOM 0 HB2 ASP A 421 111.970 9.349 11.008 1.00 0.88 H new ATOM 0 HB3 ASP A 421 113.701 9.529 10.802 1.00 0.88 H new ATOM 1641 N GLN A 422 112.580 6.499 11.364 1.00 0.89 N ATOM 1642 CA GLN A 422 113.025 5.378 12.241 1.00 0.98 C ATOM 1643 C GLN A 422 113.152 4.098 11.418 1.00 0.98 C ATOM 1644 O GLN A 422 114.062 3.318 11.606 1.00 1.07 O ATOM 1645 CB GLN A 422 111.932 5.245 13.301 1.00 0.99 C ATOM 1646 CG GLN A 422 111.806 6.563 14.071 1.00 1.32 C ATOM 1647 CD GLN A 422 113.138 6.885 14.751 1.00 1.77 C ATOM 1648 OE1 GLN A 422 113.711 6.049 15.421 1.00 2.33 O ATOM 1649 NE2 GLN A 422 113.660 8.072 14.606 1.00 2.33 N ATOM 0 H GLN A 422 111.656 6.875 11.577 1.00 0.89 H new ATOM 0 HA GLN A 422 113.999 5.560 12.695 1.00 0.98 H new ATOM 0 HB2 GLN A 422 110.982 4.994 12.830 1.00 0.99 H new ATOM 0 HB3 GLN A 422 112.172 4.432 13.986 1.00 0.99 H new ATOM 0 HG2 GLN A 422 111.528 7.369 13.391 1.00 1.32 H new ATOM 0 HG3 GLN A 422 111.014 6.487 14.816 1.00 1.32 H new ATOM 0 HE21 GLN A 422 113.180 8.775 14.044 1.00 2.33 H new ATOM 0 HE22 GLN A 422 114.548 8.297 15.055 1.00 2.33 H new ATOM 1658 N VAL A 423 112.351 3.962 10.402 1.00 0.91 N ATOM 1659 CA VAL A 423 112.543 2.836 9.455 1.00 0.94 C ATOM 1660 C VAL A 423 113.933 2.928 8.820 1.00 0.96 C ATOM 1661 O VAL A 423 114.648 1.951 8.719 1.00 1.00 O ATOM 1662 CB VAL A 423 111.457 3.048 8.409 1.00 0.92 C ATOM 1663 CG1 VAL A 423 111.620 2.035 7.277 1.00 0.95 C ATOM 1664 CG2 VAL A 423 110.083 2.881 9.057 1.00 0.99 C ATOM 0 H VAL A 423 111.571 4.583 10.187 1.00 0.91 H new ATOM 0 HA VAL A 423 112.476 1.857 9.929 1.00 0.94 H new ATOM 0 HB VAL A 423 111.544 4.055 8.000 1.00 0.92 H new ATOM 0 HG11 VAL A 423 110.840 2.193 6.532 1.00 0.95 H new ATOM 0 HG12 VAL A 423 112.597 2.164 6.811 1.00 0.95 H new ATOM 0 HG13 VAL A 423 111.540 1.025 7.678 1.00 0.95 H new ATOM 0 HG21 VAL A 423 109.306 3.033 8.307 1.00 0.99 H new ATOM 0 HG22 VAL A 423 109.996 1.877 9.471 1.00 0.99 H new ATOM 0 HG23 VAL A 423 109.966 3.614 9.855 1.00 0.99 H new ATOM 1674 N ALA A 424 114.334 4.106 8.425 1.00 0.98 N ATOM 1675 CA ALA A 424 115.693 4.277 7.835 1.00 1.07 C ATOM 1676 C ALA A 424 116.764 4.119 8.917 1.00 1.17 C ATOM 1677 O ALA A 424 117.717 3.382 8.758 1.00 1.24 O ATOM 1678 CB ALA A 424 115.703 5.703 7.292 1.00 1.09 C ATOM 0 H ALA A 424 113.778 4.959 8.486 1.00 0.98 H new ATOM 0 HA ALA A 424 115.905 3.537 7.064 1.00 1.07 H new ATOM 0 HB1 ALA A 424 116.672 5.913 6.838 1.00 1.09 H new ATOM 0 HB2 ALA A 424 114.920 5.812 6.542 1.00 1.09 H new ATOM 0 HB3 ALA A 424 115.525 6.404 8.107 1.00 1.09 H new ATOM 1684 N ARG A 425 116.610 4.804 10.018 1.00 1.23 N ATOM 1685 CA ARG A 425 117.615 4.689 11.112 1.00 1.39 C ATOM 1686 C ARG A 425 117.804 3.220 11.490 1.00 1.38 C ATOM 1687 O ARG A 425 118.828 2.830 12.016 1.00 1.53 O ATOM 1688 CB ARG A 425 117.022 5.474 12.283 1.00 1.57 C ATOM 1689 CG ARG A 425 116.929 6.955 11.912 1.00 2.17 C ATOM 1690 CD ARG A 425 116.420 7.752 13.115 1.00 2.43 C ATOM 1691 NE ARG A 425 116.172 9.124 12.590 1.00 2.68 N ATOM 1692 CZ ARG A 425 117.176 9.920 12.330 1.00 3.44 C ATOM 1693 NH1 ARG A 425 118.404 9.520 12.528 1.00 4.11 N ATOM 1694 NH2 ARG A 425 116.951 11.122 11.872 1.00 3.73 N ATOM 0 H ARG A 425 115.833 5.437 10.206 1.00 1.23 H new ATOM 0 HA ARG A 425 118.592 5.075 10.822 1.00 1.39 H new ATOM 0 HB2 ARG A 425 116.033 5.088 12.530 1.00 1.57 H new ATOM 0 HB3 ARG A 425 117.643 5.349 13.170 1.00 1.57 H new ATOM 0 HG2 ARG A 425 117.907 7.326 11.604 1.00 2.17 H new ATOM 0 HG3 ARG A 425 116.257 7.087 11.064 1.00 2.17 H new ATOM 0 HD2 ARG A 425 115.508 7.314 13.522 1.00 2.43 H new ATOM 0 HD3 ARG A 425 117.155 7.764 13.920 1.00 2.43 H new ATOM 0 HE ARG A 425 115.216 9.443 12.433 1.00 2.68 H new ATOM 0 HH11 ARG A 425 118.583 8.582 12.887 1.00 4.11 H new ATOM 0 HH12 ARG A 425 119.183 10.145 12.323 1.00 4.11 H new ATOM 0 HH21 ARG A 425 115.994 11.438 11.718 1.00 3.73 H new ATOM 0 HH22 ARG A 425 117.733 11.745 11.668 1.00 3.73 H new ATOM 1708 N GLN A 426 116.840 2.396 11.186 1.00 1.26 N ATOM 1709 CA GLN A 426 116.987 0.940 11.487 1.00 1.33 C ATOM 1710 C GLN A 426 117.638 0.209 10.309 1.00 1.26 C ATOM 1711 O GLN A 426 117.843 -0.988 10.347 1.00 1.33 O ATOM 1712 CB GLN A 426 115.566 0.433 11.723 1.00 1.34 C ATOM 1713 CG GLN A 426 115.023 1.049 13.011 1.00 1.95 C ATOM 1714 CD GLN A 426 113.552 0.665 13.183 1.00 2.42 C ATOM 1715 OE1 GLN A 426 112.909 0.240 12.244 1.00 2.68 O ATOM 1716 NE2 GLN A 426 112.988 0.799 14.353 1.00 2.92 N ATOM 0 H GLN A 426 115.960 2.664 10.744 1.00 1.26 H new ATOM 0 HA GLN A 426 117.627 0.765 12.352 1.00 1.33 H new ATOM 0 HB2 GLN A 426 114.927 0.699 10.881 1.00 1.34 H new ATOM 0 HB3 GLN A 426 115.562 -0.655 11.795 1.00 1.34 H new ATOM 0 HG2 GLN A 426 115.603 0.700 13.866 1.00 1.95 H new ATOM 0 HG3 GLN A 426 115.125 2.134 12.978 1.00 1.95 H new ATOM 0 HE21 GLN A 426 113.528 1.156 15.141 1.00 2.92 H new ATOM 0 HE22 GLN A 426 112.008 0.547 14.478 1.00 2.92 H new ATOM 1725 N GLY A 427 118.043 0.931 9.303 1.00 1.16 N ATOM 1726 CA GLY A 427 118.772 0.288 8.171 1.00 1.14 C ATOM 1727 C GLY A 427 117.769 -0.231 7.137 1.00 1.07 C ATOM 1728 O GLY A 427 118.124 -0.930 6.209 1.00 1.11 O ATOM 0 H GLY A 427 117.902 1.937 9.214 1.00 1.16 H new ATOM 0 HA2 GLY A 427 119.448 1.006 7.707 1.00 1.14 H new ATOM 0 HA3 GLY A 427 119.385 -0.534 8.541 1.00 1.14 H new ATOM 1732 N ALA A 428 116.527 0.135 7.272 1.00 1.07 N ATOM 1733 CA ALA A 428 115.503 -0.301 6.279 1.00 1.00 C ATOM 1734 C ALA A 428 115.151 0.859 5.350 1.00 0.94 C ATOM 1735 O ALA A 428 115.228 2.010 5.729 1.00 0.97 O ATOM 1736 CB ALA A 428 114.289 -0.705 7.116 1.00 1.04 C ATOM 0 H ALA A 428 116.173 0.720 8.029 1.00 1.07 H new ATOM 0 HA ALA A 428 115.854 -1.119 5.650 1.00 1.00 H new ATOM 0 HB1 ALA A 428 113.488 -1.040 6.457 1.00 1.04 H new ATOM 0 HB2 ALA A 428 114.566 -1.515 7.791 1.00 1.04 H new ATOM 0 HB3 ALA A 428 113.947 0.151 7.698 1.00 1.04 H new ATOM 1742 N THR A 429 114.646 0.562 4.186 1.00 0.92 N ATOM 1743 CA THR A 429 114.150 1.652 3.299 1.00 0.88 C ATOM 1744 C THR A 429 112.661 1.849 3.544 1.00 0.65 C ATOM 1745 O THR A 429 111.865 0.986 3.235 1.00 0.62 O ATOM 1746 CB THR A 429 114.389 1.163 1.868 1.00 1.00 C ATOM 1747 OG1 THR A 429 115.766 1.305 1.546 1.00 1.21 O ATOM 1748 CG2 THR A 429 113.545 1.992 0.891 1.00 1.00 C ATOM 0 H THR A 429 114.555 -0.382 3.811 1.00 0.92 H new ATOM 0 HA THR A 429 114.654 2.601 3.483 1.00 0.88 H new ATOM 0 HB THR A 429 114.102 0.114 1.790 1.00 1.00 H new ATOM 0 HG1 THR A 429 115.922 0.991 0.631 1.00 1.21 H new ATOM 0 HG21 THR A 429 113.717 1.642 -0.127 1.00 1.00 H new ATOM 0 HG22 THR A 429 112.489 1.882 1.139 1.00 1.00 H new ATOM 0 HG23 THR A 429 113.828 3.042 0.966 1.00 1.00 H new ATOM 1756 N PRO A 430 112.337 2.949 4.158 1.00 0.70 N ATOM 1757 CA PRO A 430 110.934 3.224 4.515 1.00 0.55 C ATOM 1758 C PRO A 430 110.147 3.648 3.276 1.00 0.54 C ATOM 1759 O PRO A 430 110.220 4.784 2.852 1.00 0.68 O ATOM 1760 CB PRO A 430 111.019 4.382 5.513 1.00 0.81 C ATOM 1761 CG PRO A 430 112.482 4.656 5.722 1.00 1.20 C ATOM 1762 CD PRO A 430 113.227 4.024 4.580 1.00 1.04 C ATOM 0 HA PRO A 430 110.427 2.352 4.928 1.00 0.55 H new ATOM 0 HB2 PRO A 430 110.510 5.265 5.127 1.00 0.81 H new ATOM 0 HB3 PRO A 430 110.535 4.120 6.454 1.00 0.81 H new ATOM 0 HG2 PRO A 430 112.670 5.729 5.756 1.00 1.20 H new ATOM 0 HG3 PRO A 430 112.817 4.244 6.674 1.00 1.20 H new ATOM 0 HD2 PRO A 430 113.409 4.736 3.775 1.00 1.04 H new ATOM 0 HD3 PRO A 430 114.199 3.643 4.894 1.00 1.04 H new ATOM 1770 N LEU A 431 109.203 2.848 2.878 1.00 0.47 N ATOM 1771 CA LEU A 431 108.205 3.336 1.896 1.00 0.56 C ATOM 1772 C LEU A 431 107.038 3.949 2.662 1.00 0.54 C ATOM 1773 O LEU A 431 106.819 3.635 3.810 1.00 0.59 O ATOM 1774 CB LEU A 431 107.734 2.105 1.123 1.00 0.59 C ATOM 1775 CG LEU A 431 108.901 1.489 0.357 1.00 0.59 C ATOM 1776 CD1 LEU A 431 108.385 0.322 -0.486 1.00 1.14 C ATOM 1777 CD2 LEU A 431 109.518 2.543 -0.564 1.00 1.40 C ATOM 0 H LEU A 431 109.080 1.884 3.188 1.00 0.47 H new ATOM 0 HA LEU A 431 108.616 4.087 1.221 1.00 0.56 H new ATOM 0 HB2 LEU A 431 107.314 1.372 1.812 1.00 0.59 H new ATOM 0 HB3 LEU A 431 106.940 2.383 0.430 1.00 0.59 H new ATOM 0 HG LEU A 431 109.655 1.133 1.059 1.00 0.59 H new ATOM 0 HD11 LEU A 431 109.214 -0.123 -1.037 1.00 1.14 H new ATOM 0 HD12 LEU A 431 107.938 -0.428 0.166 1.00 1.14 H new ATOM 0 HD13 LEU A 431 107.635 0.685 -1.189 1.00 1.14 H new ATOM 0 HD21 LEU A 431 110.352 2.104 -1.112 1.00 1.40 H new ATOM 0 HD22 LEU A 431 108.765 2.895 -1.270 1.00 1.40 H new ATOM 0 HD23 LEU A 431 109.877 3.382 0.032 1.00 1.40 H new ATOM 1789 N VAL A 432 106.237 4.746 2.030 1.00 0.49 N ATOM 1790 CA VAL A 432 105.037 5.268 2.736 1.00 0.48 C ATOM 1791 C VAL A 432 103.775 4.955 1.934 1.00 0.48 C ATOM 1792 O VAL A 432 103.755 5.049 0.723 1.00 0.52 O ATOM 1793 CB VAL A 432 105.257 6.774 2.848 1.00 0.43 C ATOM 1794 CG1 VAL A 432 104.092 7.407 3.611 1.00 0.45 C ATOM 1795 CG2 VAL A 432 106.563 7.042 3.599 1.00 0.51 C ATOM 0 H VAL A 432 106.354 5.059 1.066 1.00 0.49 H new ATOM 0 HA VAL A 432 104.905 4.812 3.717 1.00 0.48 H new ATOM 0 HB VAL A 432 105.314 7.208 1.850 1.00 0.43 H new ATOM 0 HG11 VAL A 432 104.251 8.483 3.690 1.00 0.45 H new ATOM 0 HG12 VAL A 432 103.161 7.216 3.078 1.00 0.45 H new ATOM 0 HG13 VAL A 432 104.033 6.974 4.610 1.00 0.45 H new ATOM 0 HG21 VAL A 432 106.722 8.117 3.680 1.00 0.51 H new ATOM 0 HG22 VAL A 432 106.505 6.608 4.597 1.00 0.51 H new ATOM 0 HG23 VAL A 432 107.394 6.592 3.056 1.00 0.51 H new ATOM 1805 N VAL A 433 102.732 4.556 2.608 1.00 0.44 N ATOM 1806 CA VAL A 433 101.467 4.203 1.906 1.00 0.45 C ATOM 1807 C VAL A 433 100.353 5.151 2.347 1.00 0.37 C ATOM 1808 O VAL A 433 100.209 5.452 3.518 1.00 0.37 O ATOM 1809 CB VAL A 433 101.155 2.772 2.346 1.00 0.56 C ATOM 1810 CG1 VAL A 433 99.945 2.250 1.568 1.00 0.59 C ATOM 1811 CG2 VAL A 433 102.364 1.876 2.065 1.00 1.08 C ATOM 0 H VAL A 433 102.702 4.459 3.623 1.00 0.44 H new ATOM 0 HA VAL A 433 101.554 4.284 0.822 1.00 0.45 H new ATOM 0 HB VAL A 433 100.934 2.762 3.413 1.00 0.56 H new ATOM 0 HG11 VAL A 433 99.723 1.230 1.882 1.00 0.59 H new ATOM 0 HG12 VAL A 433 99.083 2.887 1.766 1.00 0.59 H new ATOM 0 HG13 VAL A 433 100.166 2.261 0.501 1.00 0.59 H new ATOM 0 HG21 VAL A 433 102.142 0.856 2.379 1.00 1.08 H new ATOM 0 HG22 VAL A 433 102.585 1.887 0.998 1.00 1.08 H new ATOM 0 HG23 VAL A 433 103.227 2.246 2.618 1.00 1.08 H new ATOM 1821 N VAL A 434 99.538 5.583 1.426 1.00 0.43 N ATOM 1822 CA VAL A 434 98.400 6.470 1.791 1.00 0.43 C ATOM 1823 C VAL A 434 97.092 5.896 1.247 1.00 0.48 C ATOM 1824 O VAL A 434 97.074 5.259 0.213 1.00 0.90 O ATOM 1825 CB VAL A 434 98.709 7.825 1.138 1.00 0.53 C ATOM 1826 CG1 VAL A 434 100.183 8.171 1.348 1.00 0.70 C ATOM 1827 CG2 VAL A 434 98.405 7.767 -0.363 1.00 0.49 C ATOM 0 H VAL A 434 99.612 5.359 0.434 1.00 0.43 H new ATOM 0 HA VAL A 434 98.284 6.564 2.871 1.00 0.43 H new ATOM 0 HB VAL A 434 98.085 8.591 1.598 1.00 0.53 H new ATOM 0 HG11 VAL A 434 100.401 9.133 0.884 1.00 0.70 H new ATOM 0 HG12 VAL A 434 100.395 8.227 2.416 1.00 0.70 H new ATOM 0 HG13 VAL A 434 100.806 7.400 0.894 1.00 0.70 H new ATOM 0 HG21 VAL A 434 98.627 8.733 -0.817 1.00 0.49 H new ATOM 0 HG22 VAL A 434 99.019 6.997 -0.829 1.00 0.49 H new ATOM 0 HG23 VAL A 434 97.352 7.530 -0.512 1.00 0.49 H new ATOM 1837 N GLU A 435 95.995 6.351 1.775 1.00 0.61 N ATOM 1838 CA GLU A 435 94.694 6.089 1.107 1.00 0.60 C ATOM 1839 C GLU A 435 94.083 7.417 0.680 1.00 0.62 C ATOM 1840 O GLU A 435 94.032 8.359 1.445 1.00 0.67 O ATOM 1841 CB GLU A 435 93.824 5.403 2.157 1.00 0.70 C ATOM 1842 CG GLU A 435 93.809 3.902 1.891 1.00 0.76 C ATOM 1843 CD GLU A 435 92.905 3.208 2.912 1.00 1.13 C ATOM 1844 OE1 GLU A 435 92.452 3.878 3.825 1.00 1.34 O ATOM 1845 OE2 GLU A 435 92.681 2.018 2.761 1.00 1.79 O ATOM 0 H GLU A 435 95.942 6.892 2.638 1.00 0.61 H new ATOM 0 HA GLU A 435 94.793 5.467 0.217 1.00 0.60 H new ATOM 0 HB2 GLU A 435 94.212 5.604 3.156 1.00 0.70 H new ATOM 0 HB3 GLU A 435 92.810 5.801 2.123 1.00 0.70 H new ATOM 0 HG2 GLU A 435 93.451 3.705 0.880 1.00 0.76 H new ATOM 0 HG3 GLU A 435 94.821 3.501 1.954 1.00 0.76 H new ATOM 1852 N GLY A 436 93.776 7.552 -0.575 1.00 0.61 N ATOM 1853 CA GLY A 436 93.354 8.885 -1.076 1.00 0.64 C ATOM 1854 C GLY A 436 94.542 9.848 -0.986 1.00 0.68 C ATOM 1855 O GLY A 436 95.486 9.756 -1.746 1.00 1.42 O ATOM 0 H GLY A 436 93.798 6.806 -1.270 1.00 0.61 H new ATOM 0 HA2 GLY A 436 93.008 8.808 -2.107 1.00 0.64 H new ATOM 0 HA3 GLY A 436 92.518 9.262 -0.487 1.00 0.64 H new ATOM 1859 N SER A 437 94.483 10.796 -0.092 1.00 0.84 N ATOM 1860 CA SER A 437 95.584 11.796 0.016 1.00 0.81 C ATOM 1861 C SER A 437 96.235 11.749 1.405 1.00 0.83 C ATOM 1862 O SER A 437 96.990 12.629 1.770 1.00 1.35 O ATOM 1863 CB SER A 437 94.906 13.147 -0.203 1.00 0.80 C ATOM 1864 OG SER A 437 94.232 13.533 0.987 1.00 1.42 O ATOM 0 H SER A 437 93.718 10.922 0.571 1.00 0.84 H new ATOM 0 HA SER A 437 96.378 11.604 -0.706 1.00 0.81 H new ATOM 0 HB2 SER A 437 95.647 13.899 -0.475 1.00 0.80 H new ATOM 0 HB3 SER A 437 94.199 13.082 -1.030 1.00 0.80 H new ATOM 0 HG SER A 437 93.797 14.401 0.850 1.00 1.42 H new ATOM 1870 N ARG A 438 95.914 10.767 2.206 1.00 0.53 N ATOM 1871 CA ARG A 438 96.479 10.730 3.587 1.00 0.62 C ATOM 1872 C ARG A 438 97.282 9.441 3.799 1.00 0.65 C ATOM 1873 O ARG A 438 96.940 8.393 3.292 1.00 0.69 O ATOM 1874 CB ARG A 438 95.263 10.766 4.512 1.00 0.78 C ATOM 1875 CG ARG A 438 94.582 9.399 4.507 1.00 1.34 C ATOM 1876 CD ARG A 438 93.188 9.521 5.122 1.00 1.53 C ATOM 1877 NE ARG A 438 92.675 8.124 5.196 1.00 2.25 N ATOM 1878 CZ ARG A 438 91.455 7.892 5.601 1.00 2.95 C ATOM 1879 NH1 ARG A 438 90.676 8.883 5.944 1.00 3.49 N ATOM 1880 NH2 ARG A 438 91.013 6.666 5.665 1.00 3.52 N ATOM 0 H ARG A 438 95.291 9.996 1.967 1.00 0.53 H new ATOM 0 HA ARG A 438 97.160 11.559 3.777 1.00 0.62 H new ATOM 0 HB2 ARG A 438 95.570 11.028 5.525 1.00 0.78 H new ATOM 0 HB3 ARG A 438 94.564 11.534 4.182 1.00 0.78 H new ATOM 0 HG2 ARG A 438 94.509 9.021 3.487 1.00 1.34 H new ATOM 0 HG3 ARG A 438 95.178 8.682 5.071 1.00 1.34 H new ATOM 0 HD2 ARG A 438 93.231 9.978 6.110 1.00 1.53 H new ATOM 0 HD3 ARG A 438 92.540 10.147 4.509 1.00 1.53 H new ATOM 0 HE ARG A 438 93.279 7.346 4.929 1.00 2.25 H new ATOM 0 HH11 ARG A 438 91.020 9.842 5.896 1.00 3.49 H new ATOM 0 HH12 ARG A 438 89.724 8.698 6.260 1.00 3.49 H new ATOM 0 HH21 ARG A 438 91.620 5.891 5.399 1.00 3.52 H new ATOM 0 HH22 ARG A 438 90.061 6.483 5.981 1.00 3.52 H new ATOM 1894 N VAL A 439 98.367 9.525 4.515 1.00 0.67 N ATOM 1895 CA VAL A 439 99.229 8.324 4.718 1.00 0.74 C ATOM 1896 C VAL A 439 98.606 7.379 5.747 1.00 0.93 C ATOM 1897 O VAL A 439 98.289 7.773 6.852 1.00 1.41 O ATOM 1898 CB VAL A 439 100.556 8.877 5.236 1.00 0.89 C ATOM 1899 CG1 VAL A 439 101.564 7.735 5.383 1.00 0.99 C ATOM 1900 CG2 VAL A 439 101.098 9.910 4.246 1.00 0.86 C ATOM 0 H VAL A 439 98.697 10.376 4.971 1.00 0.67 H new ATOM 0 HA VAL A 439 99.351 7.749 3.800 1.00 0.74 H new ATOM 0 HB VAL A 439 100.398 9.349 6.206 1.00 0.89 H new ATOM 0 HG11 VAL A 439 102.510 8.130 5.752 1.00 0.99 H new ATOM 0 HG12 VAL A 439 101.179 6.998 6.088 1.00 0.99 H new ATOM 0 HG13 VAL A 439 101.722 7.262 4.414 1.00 0.99 H new ATOM 0 HG21 VAL A 439 102.045 10.305 4.614 1.00 0.86 H new ATOM 0 HG22 VAL A 439 101.255 9.437 3.276 1.00 0.86 H new ATOM 0 HG23 VAL A 439 100.381 10.724 4.141 1.00 0.86 H new ATOM 1910 N LEU A 440 98.455 6.130 5.403 1.00 0.79 N ATOM 1911 CA LEU A 440 97.882 5.157 6.376 1.00 1.07 C ATOM 1912 C LEU A 440 98.993 4.520 7.218 1.00 0.74 C ATOM 1913 O LEU A 440 98.763 4.105 8.335 1.00 0.88 O ATOM 1914 CB LEU A 440 97.162 4.099 5.534 1.00 1.60 C ATOM 1915 CG LEU A 440 98.107 3.531 4.473 1.00 1.48 C ATOM 1916 CD1 LEU A 440 98.274 2.029 4.692 1.00 1.79 C ATOM 1917 CD2 LEU A 440 97.509 3.776 3.087 1.00 1.57 C ATOM 0 H LEU A 440 98.703 5.741 4.493 1.00 0.79 H new ATOM 0 HA LEU A 440 97.199 5.642 7.074 1.00 1.07 H new ATOM 0 HB2 LEU A 440 96.802 3.296 6.177 1.00 1.60 H new ATOM 0 HB3 LEU A 440 96.288 4.539 5.054 1.00 1.60 H new ATOM 0 HG LEU A 440 99.079 4.020 4.548 1.00 1.48 H new ATOM 0 HD11 LEU A 440 98.947 1.624 3.936 1.00 1.79 H new ATOM 0 HD12 LEU A 440 98.691 1.850 5.683 1.00 1.79 H new ATOM 0 HD13 LEU A 440 97.303 1.540 4.613 1.00 1.79 H new ATOM 0 HD21 LEU A 440 98.178 3.374 2.326 1.00 1.57 H new ATOM 0 HD22 LEU A 440 96.540 3.282 3.016 1.00 1.57 H new ATOM 0 HD23 LEU A 440 97.383 4.847 2.929 1.00 1.57 H new ATOM 1929 N GLY A 441 100.199 4.458 6.714 1.00 0.64 N ATOM 1930 CA GLY A 441 101.303 3.870 7.533 1.00 1.02 C ATOM 1931 C GLY A 441 102.627 3.897 6.765 1.00 0.82 C ATOM 1932 O GLY A 441 102.690 4.312 5.627 1.00 0.96 O ATOM 0 H GLY A 441 100.465 4.784 5.785 1.00 0.64 H new ATOM 0 HA2 GLY A 441 101.407 4.427 8.464 1.00 1.02 H new ATOM 0 HA3 GLY A 441 101.055 2.843 7.802 1.00 1.02 H new ATOM 1936 N VAL A 442 103.685 3.443 7.386 1.00 0.56 N ATOM 1937 CA VAL A 442 105.017 3.421 6.709 1.00 0.44 C ATOM 1938 C VAL A 442 105.557 1.986 6.671 1.00 0.41 C ATOM 1939 O VAL A 442 105.223 1.169 7.505 1.00 0.41 O ATOM 1940 CB VAL A 442 105.912 4.305 7.574 1.00 0.42 C ATOM 1941 CG1 VAL A 442 107.310 4.366 6.961 1.00 0.44 C ATOM 1942 CG2 VAL A 442 105.323 5.717 7.642 1.00 0.57 C ATOM 0 H VAL A 442 103.683 3.084 8.341 1.00 0.56 H new ATOM 0 HA VAL A 442 104.968 3.775 5.679 1.00 0.44 H new ATOM 0 HB VAL A 442 105.973 3.888 8.579 1.00 0.42 H new ATOM 0 HG11 VAL A 442 107.950 4.997 7.577 1.00 0.44 H new ATOM 0 HG12 VAL A 442 107.730 3.361 6.912 1.00 0.44 H new ATOM 0 HG13 VAL A 442 107.249 4.783 5.956 1.00 0.44 H new ATOM 0 HG21 VAL A 442 105.962 6.348 8.260 1.00 0.57 H new ATOM 0 HG22 VAL A 442 105.262 6.135 6.637 1.00 0.57 H new ATOM 0 HG23 VAL A 442 104.325 5.674 8.078 1.00 0.57 H new ATOM 1952 N ILE A 443 106.336 1.655 5.677 1.00 0.42 N ATOM 1953 CA ILE A 443 106.831 0.248 5.555 1.00 0.43 C ATOM 1954 C ILE A 443 108.358 0.207 5.561 1.00 0.44 C ATOM 1955 O ILE A 443 109.009 0.882 4.797 1.00 0.51 O ATOM 1956 CB ILE A 443 106.302 -0.254 4.213 1.00 0.47 C ATOM 1957 CG1 ILE A 443 104.818 0.099 4.074 1.00 0.51 C ATOM 1958 CG2 ILE A 443 106.470 -1.772 4.139 1.00 0.56 C ATOM 1959 CD1 ILE A 443 104.077 -0.288 5.354 1.00 1.05 C ATOM 0 H ILE A 443 106.651 2.292 4.946 1.00 0.42 H new ATOM 0 HA ILE A 443 106.492 -0.367 6.389 1.00 0.43 H new ATOM 0 HB ILE A 443 106.861 0.219 3.406 1.00 0.47 H new ATOM 0 HG12 ILE A 443 104.704 1.166 3.884 1.00 0.51 H new ATOM 0 HG13 ILE A 443 104.388 -0.424 3.220 1.00 0.51 H new ATOM 0 HG21 ILE A 443 106.093 -2.134 3.182 1.00 0.56 H new ATOM 0 HG22 ILE A 443 107.526 -2.026 4.233 1.00 0.56 H new ATOM 0 HG23 ILE A 443 105.911 -2.240 4.949 1.00 0.56 H new ATOM 0 HD11 ILE A 443 103.021 -0.036 5.254 1.00 1.05 H new ATOM 0 HD12 ILE A 443 104.180 -1.360 5.524 1.00 1.05 H new ATOM 0 HD13 ILE A 443 104.501 0.256 6.198 1.00 1.05 H new ATOM 1971 N ALA A 444 108.928 -0.605 6.400 1.00 0.40 N ATOM 1972 CA ALA A 444 110.414 -0.722 6.441 1.00 0.44 C ATOM 1973 C ALA A 444 110.869 -1.950 5.650 1.00 0.43 C ATOM 1974 O ALA A 444 110.471 -3.059 5.937 1.00 0.45 O ATOM 1975 CB ALA A 444 110.749 -0.892 7.922 1.00 0.46 C ATOM 0 H ALA A 444 108.429 -1.197 7.064 1.00 0.40 H new ATOM 0 HA ALA A 444 110.911 0.143 6.001 1.00 0.44 H new ATOM 0 HB1 ALA A 444 111.828 -0.986 8.042 1.00 0.46 H new ATOM 0 HB2 ALA A 444 110.396 -0.023 8.477 1.00 0.46 H new ATOM 0 HB3 ALA A 444 110.262 -1.789 8.305 1.00 0.46 H new ATOM 1981 N LEU A 445 111.683 -1.765 4.649 1.00 0.57 N ATOM 1982 CA LEU A 445 112.140 -2.931 3.839 1.00 0.63 C ATOM 1983 C LEU A 445 113.551 -3.346 4.257 1.00 0.75 C ATOM 1984 O LEU A 445 114.452 -2.533 4.285 1.00 0.92 O ATOM 1985 CB LEU A 445 112.158 -2.433 2.394 1.00 0.81 C ATOM 1986 CG LEU A 445 110.762 -2.538 1.776 1.00 1.23 C ATOM 1987 CD1 LEU A 445 109.715 -2.018 2.762 1.00 2.11 C ATOM 1988 CD2 LEU A 445 110.713 -1.698 0.498 1.00 1.91 C ATOM 0 H LEU A 445 112.051 -0.860 4.356 1.00 0.57 H new ATOM 0 HA LEU A 445 111.490 -3.796 3.972 1.00 0.63 H new ATOM 0 HB2 LEU A 445 112.499 -1.398 2.364 1.00 0.81 H new ATOM 0 HB3 LEU A 445 112.867 -3.020 1.809 1.00 0.81 H new ATOM 0 HG LEU A 445 110.549 -3.581 1.544 1.00 1.23 H new ATOM 0 HD11 LEU A 445 108.724 -2.096 2.315 1.00 2.11 H new ATOM 0 HD12 LEU A 445 109.749 -2.612 3.675 1.00 2.11 H new ATOM 0 HD13 LEU A 445 109.925 -0.975 2.999 1.00 2.11 H new ATOM 0 HD21 LEU A 445 109.720 -1.769 0.054 1.00 1.91 H new ATOM 0 HD22 LEU A 445 110.929 -0.657 0.738 1.00 1.91 H new ATOM 0 HD23 LEU A 445 111.455 -2.068 -0.210 1.00 1.91 H new ATOM 2000 N LYS A 446 113.791 -4.622 4.382 1.00 0.89 N ATOM 2001 CA LYS A 446 115.188 -5.093 4.562 1.00 1.15 C ATOM 2002 C LYS A 446 115.832 -5.286 3.192 1.00 1.27 C ATOM 2003 O LYS A 446 115.191 -5.706 2.251 1.00 1.87 O ATOM 2004 CB LYS A 446 115.061 -6.427 5.281 1.00 1.92 C ATOM 2005 CG LYS A 446 116.430 -6.877 5.782 1.00 2.25 C ATOM 2006 CD LYS A 446 116.289 -8.249 6.436 1.00 2.85 C ATOM 2007 CE LYS A 446 117.612 -8.644 7.097 1.00 3.64 C ATOM 2008 NZ LYS A 446 117.225 -9.517 8.239 1.00 4.48 N ATOM 0 H LYS A 446 113.081 -5.355 4.367 1.00 0.89 H new ATOM 0 HA LYS A 446 115.805 -4.390 5.121 1.00 1.15 H new ATOM 0 HB2 LYS A 446 114.370 -6.335 6.119 1.00 1.92 H new ATOM 0 HB3 LYS A 446 114.646 -7.176 4.606 1.00 1.92 H new ATOM 0 HG2 LYS A 446 117.138 -6.925 4.954 1.00 2.25 H new ATOM 0 HG3 LYS A 446 116.825 -6.157 6.498 1.00 2.25 H new ATOM 0 HD2 LYS A 446 115.492 -8.228 7.179 1.00 2.85 H new ATOM 0 HD3 LYS A 446 116.009 -8.992 5.689 1.00 2.85 H new ATOM 0 HE2 LYS A 446 118.260 -9.172 6.398 1.00 3.64 H new ATOM 0 HE3 LYS A 446 118.160 -7.766 7.439 1.00 3.64 H new ATOM 0 HZ1 LYS A 446 118.080 -9.829 8.743 1.00 4.48 H new ATOM 0 HZ2 LYS A 446 116.614 -8.985 8.891 1.00 4.48 H new ATOM 0 HZ3 LYS A 446 116.711 -10.348 7.882 1.00 4.48 H new ATOM 2022 N ASP A 447 117.065 -4.908 3.049 1.00 1.33 N ATOM 2023 CA ASP A 447 117.708 -4.992 1.707 1.00 2.04 C ATOM 2024 C ASP A 447 118.505 -6.292 1.574 1.00 1.83 C ATOM 2025 O ASP A 447 119.369 -6.587 2.376 1.00 2.21 O ATOM 2026 CB ASP A 447 118.635 -3.783 1.632 1.00 2.93 C ATOM 2027 CG ASP A 447 117.805 -2.498 1.675 1.00 3.02 C ATOM 2028 OD1 ASP A 447 116.604 -2.586 1.481 1.00 3.91 O ATOM 2029 OD2 ASP A 447 118.386 -1.449 1.901 1.00 2.75 O ATOM 0 H ASP A 447 117.657 -4.546 3.796 1.00 1.33 H new ATOM 0 HA ASP A 447 116.974 -4.992 0.902 1.00 2.04 H new ATOM 0 HB2 ASP A 447 119.340 -3.801 2.463 1.00 2.93 H new ATOM 0 HB3 ASP A 447 119.222 -3.818 0.714 1.00 2.93 H new ATOM 2034 N ILE A 448 118.288 -7.019 0.514 1.00 2.00 N ATOM 2035 CA ILE A 448 119.106 -8.241 0.267 1.00 2.26 C ATOM 2036 C ILE A 448 120.585 -7.857 0.175 1.00 2.39 C ATOM 2037 O ILE A 448 121.438 -8.463 0.791 1.00 2.75 O ATOM 2038 CB ILE A 448 118.602 -8.789 -1.075 1.00 2.53 C ATOM 2039 CG1 ILE A 448 117.292 -9.563 -0.872 1.00 3.34 C ATOM 2040 CG2 ILE A 448 119.648 -9.731 -1.676 1.00 2.71 C ATOM 2041 CD1 ILE A 448 116.378 -8.826 0.112 1.00 3.61 C ATOM 0 H ILE A 448 117.580 -6.821 -0.193 1.00 2.00 H new ATOM 0 HA ILE A 448 119.014 -8.980 1.063 1.00 2.26 H new ATOM 0 HB ILE A 448 118.428 -7.951 -1.750 1.00 2.53 H new ATOM 0 HG12 ILE A 448 116.783 -9.685 -1.828 1.00 3.34 H new ATOM 0 HG13 ILE A 448 117.508 -10.563 -0.497 1.00 3.34 H new ATOM 0 HG21 ILE A 448 119.285 -10.117 -2.629 1.00 2.71 H new ATOM 0 HG22 ILE A 448 120.579 -9.187 -1.836 1.00 2.71 H new ATOM 0 HG23 ILE A 448 119.826 -10.561 -0.992 1.00 2.71 H new ATOM 0 HD11 ILE A 448 115.454 -9.390 0.243 1.00 3.61 H new ATOM 0 HD12 ILE A 448 116.882 -8.727 1.073 1.00 3.61 H new ATOM 0 HD13 ILE A 448 116.146 -7.835 -0.279 1.00 3.61 H new ATOM 2053 N VAL A 449 120.889 -6.862 -0.609 1.00 2.65 N ATOM 2054 CA VAL A 449 122.310 -6.441 -0.769 1.00 3.38 C ATOM 2055 C VAL A 449 122.589 -5.188 0.068 1.00 3.99 C ATOM 2056 O VAL A 449 121.820 -4.247 0.067 1.00 4.70 O ATOM 2057 CB VAL A 449 122.464 -6.133 -2.256 1.00 4.18 C ATOM 2058 CG1 VAL A 449 123.919 -5.769 -2.556 1.00 5.09 C ATOM 2059 CG2 VAL A 449 122.068 -7.363 -3.075 1.00 4.27 C ATOM 0 H VAL A 449 120.214 -6.320 -1.148 1.00 2.65 H new ATOM 0 HA VAL A 449 123.008 -7.209 -0.435 1.00 3.38 H new ATOM 0 HB VAL A 449 121.819 -5.295 -2.521 1.00 4.18 H new ATOM 0 HG11 VAL A 449 124.028 -5.549 -3.618 1.00 5.09 H new ATOM 0 HG12 VAL A 449 124.202 -4.892 -1.973 1.00 5.09 H new ATOM 0 HG13 VAL A 449 124.565 -6.606 -2.291 1.00 5.09 H new ATOM 0 HG21 VAL A 449 122.178 -7.144 -4.137 1.00 4.27 H new ATOM 0 HG22 VAL A 449 122.713 -8.200 -2.809 1.00 4.27 H new ATOM 0 HG23 VAL A 449 121.031 -7.622 -2.863 1.00 4.27 H new ATOM 2069 N LYS A 450 123.682 -5.169 0.779 1.00 4.08 N ATOM 2070 CA LYS A 450 124.008 -3.977 1.613 1.00 5.12 C ATOM 2071 C LYS A 450 124.899 -3.010 0.828 1.00 5.65 C ATOM 2072 O LYS A 450 125.731 -3.418 0.041 1.00 6.68 O ATOM 2073 CB LYS A 450 124.757 -4.533 2.825 1.00 5.87 C ATOM 2074 CG LYS A 450 123.891 -5.586 3.520 1.00 5.93 C ATOM 2075 CD LYS A 450 122.615 -4.927 4.051 1.00 6.39 C ATOM 2076 CE LYS A 450 121.829 -5.939 4.889 1.00 6.77 C ATOM 2077 NZ LYS A 450 121.368 -5.174 6.081 1.00 7.50 N ATOM 0 H LYS A 450 124.364 -5.927 0.819 1.00 4.08 H new ATOM 0 HA LYS A 450 123.117 -3.422 1.905 1.00 5.12 H new ATOM 0 HB2 LYS A 450 125.703 -4.974 2.511 1.00 5.87 H new ATOM 0 HB3 LYS A 450 124.996 -3.727 3.519 1.00 5.87 H new ATOM 0 HG2 LYS A 450 123.638 -6.383 2.821 1.00 5.93 H new ATOM 0 HG3 LYS A 450 124.445 -6.045 4.339 1.00 5.93 H new ATOM 0 HD2 LYS A 450 122.867 -4.056 4.656 1.00 6.39 H new ATOM 0 HD3 LYS A 450 122.003 -4.573 3.221 1.00 6.39 H new ATOM 0 HE2 LYS A 450 120.986 -6.345 4.330 1.00 6.77 H new ATOM 0 HE3 LYS A 450 122.455 -6.783 5.179 1.00 6.77 H new ATOM 0 HZ1 LYS A 450 120.821 -5.800 6.705 1.00 7.50 H new ATOM 0 HZ2 LYS A 450 122.192 -4.805 6.597 1.00 7.50 H new ATOM 0 HZ3 LYS A 450 120.769 -4.381 5.774 1.00 7.50 H new ATOM 2091 N GLY A 451 124.732 -1.733 1.035 1.00 5.14 N ATOM 2092 CA GLY A 451 125.568 -0.742 0.300 1.00 5.92 C ATOM 2093 C GLY A 451 127.019 -0.847 0.773 1.00 6.73 C ATOM 2094 O GLY A 451 127.273 -0.517 1.920 1.00 7.01 O ATOM 2095 OXT GLY A 451 127.853 -1.256 -0.018 1.00 7.30 O ATOM 0 H GLY A 451 124.052 -1.333 1.682 1.00 5.14 H new ATOM 0 HA2 GLY A 451 125.510 -0.926 -0.773 1.00 5.92 H new ATOM 0 HA3 GLY A 451 125.191 0.266 0.471 1.00 5.92 H new TER 2099 GLY A 451 HETATM 2100 PG ANP A1001 120.332 3.155 -8.006 1.00 0.00 P HETATM 2101 O1G ANP A1001 120.296 4.117 -9.167 1.00 0.00 O HETATM 2102 O2G ANP A1001 120.704 3.863 -6.729 1.00 0.00 O HETATM 2103 O3G ANP A1001 121.264 2.005 -8.283 1.00 0.00 O HETATM 2104 PB ANP A1001 117.953 3.247 -6.671 1.00 0.00 P HETATM 2105 O1B ANP A1001 118.112 2.449 -5.408 1.00 0.00 O HETATM 2106 O2B ANP A1001 118.421 4.665 -6.506 1.00 0.00 O HETATM 2107 N3B ANP A1001 118.850 2.551 -7.822 1.00 0.00 N HETATM 2108 PA ANP A1001 115.342 2.133 -6.711 1.00 0.00 P HETATM 2109 O1A ANP A1001 114.902 1.233 -7.805 1.00 0.00 O HETATM 2110 O2A ANP A1001 115.861 1.468 -5.491 1.00 0.00 O HETATM 2111 O3A ANP A1001 116.462 3.154 -7.279 1.00 0.00 O HETATM 2112 O5' ANP A1001 114.123 3.116 -6.306 1.00 0.00 O HETATM 2113 C5' ANP A1001 112.739 2.696 -6.315 1.00 0.00 C HETATM 2114 C4' ANP A1001 112.068 3.104 -5.012 1.00 0.00 C HETATM 2115 O4' ANP A1001 110.632 2.963 -5.184 1.00 0.00 O HETATM 2116 C3' ANP A1001 112.505 2.026 -4.038 1.00 0.00 C HETATM 2117 O3' ANP A1001 113.731 2.354 -3.397 1.00 0.00 O HETATM 2118 C2' ANP A1001 111.364 2.013 -3.058 1.00 0.00 C HETATM 2119 O2' ANP A1001 111.565 2.948 -2.006 1.00 0.00 O HETATM 2120 C1' ANP A1001 110.165 2.411 -3.919 1.00 0.00 C HETATM 2121 N9 ANP A1001 109.335 1.199 -4.250 1.00 0.00 N HETATM 2122 C8 ANP A1001 109.803 -0.053 -4.323 1.00 0.00 C HETATM 2123 N7 ANP A1001 108.818 -0.904 -4.625 1.00 0.00 N HETATM 2124 C5 ANP A1001 107.704 -0.198 -4.753 1.00 0.00 C HETATM 2125 C6 ANP A1001 106.341 -0.489 -5.041 1.00 0.00 C HETATM 2126 N6 ANP A1001 105.951 -1.740 -5.251 1.00 0.00 N HETATM 2127 N1 ANP A1001 105.418 0.530 -5.091 1.00 0.00 N HETATM 2128 C2 ANP A1001 105.744 1.840 -4.869 1.00 0.00 C HETATM 2129 N3 ANP A1001 107.048 2.138 -4.595 1.00 0.00 N HETATM 2130 C4 ANP A1001 108.031 1.161 -4.518 1.00 0.00 C HETATM 0 HO3' ANP A1001 114.480 2.125 -3.986 1.00 0.00 H new HETATM 0 HO2' ANP A1001 112.504 3.228 -1.992 1.00 0.00 H new HETATM 0 HNB1 ANP A1001 118.501 1.781 -8.393 1.00 0.00 H new HETATM 0 HN62 ANP A1001 104.973 -1.941 -5.457 1.00 0.00 H new HETATM 0 HN61 ANP A1001 106.630 -2.500 -5.206 1.00 0.00 H new HETATM 0 H5'2 ANP A1001 112.218 3.147 -7.160 1.00 0.00 H new HETATM 0 H5'1 ANP A1001 112.678 1.615 -6.443 1.00 0.00 H new HETATM 0 H8 ANP A1001 110.842 -0.338 -4.159 1.00 0.00 H new HETATM 0 H4' ANP A1001 112.312 4.119 -4.698 1.00 0.00 H new HETATM 0 H3' ANP A1001 112.695 1.064 -4.513 1.00 0.00 H new HETATM 0 H2' ANP A1001 111.244 1.049 -2.564 1.00 0.00 H new HETATM 0 H2 ANP A1001 104.986 2.622 -4.910 1.00 0.00 H new HETATM 0 H1' ANP A1001 109.577 3.140 -3.362 1.00 0.00 H new