USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=20 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 Single : A 316 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 318 GLN : amide:sc= -2.61! C(o=-2.6!,f=-4.4!) USER MOD Single : A 320 SER OG : rot -140:sc= -1.64! USER MOD Single : A 326 GLN : amide:sc= 0.396 K(o=0.4,f=-0.63) USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 332 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 GLN : amide:sc= -21.9! C(o=-22!,f=-37!) USER MOD Single : A 341 SER OG : rot -26:sc= -3.93! USER MOD Single : A 346 THR OG1 : rot 130:sc= -0.0992 USER MOD Single : A 351 SER OG : rot -168:sc= -1.09 USER MOD Single : A 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 358 GLN : amide:sc= -0.992 K(o=-0.99,f=-0.33) USER MOD Single : A 361 ASN : amide:sc= -2.24! C(o=-2.2!,f=-4.3!) USER MOD Single : A 368 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 369 SER OG : rot 180:sc= 0 USER MOD Single : A 371 HIS : no HD1:sc= -0.143 K(o=-0.14,f=-1) USER MOD Single : A 373 THR OG1 : rot 180:sc= 0 USER MOD Single : A 378 THR OG1 : rot 180:sc= 0 USER MOD Single : A 380 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 381 SER OG : rot 180:sc= 0 USER MOD Single : A 383 MET CE :methyl 135:sc= -4.58! (180deg=-5.07!) USER MOD Single : A 384 SER OG : rot -134:sc= 0.316! USER MOD Single : A 387 ASN : amide:sc= -6.01! K(o=-6!,f=-3.6) USER MOD Single : A 390 ASN : amide:sc= -0.447 K(o=-0.45,f=-3!) USER MOD Single : A 392 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 395 LYS NZ :NH3+ 178:sc= -11! (180deg=-11!) USER MOD Single : A 397 SER OG : rot -120:sc= -1.9! USER MOD Single : A 404 HIS : no HE2:sc= -2.61! C(o=-2.6!,f=-3.8!) USER MOD Single : A 408 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.0092) USER MOD Single : A 411 HIS : no HD1:sc= -0.647 K(o=-0.65,f=-1.5) USER MOD Single : A 414 THR OG1 : rot 180:sc= 0 USER MOD Single : A 418 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 419 LYS NZ :NH3+ -152:sc= -0.188 (180deg=-1.62) USER MOD Single : A 422 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 426 GLN : amide:sc= -0.0877 K(o=-0.088,f=-1.6!) 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= -2.71! USER MOD Single : A1001 ANP O3' : rot 180:sc= 0.203 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 316 119.051 -6.703 -3.860 1.00 4.45 N ATOM 2 CA ASN A 316 117.568 -6.811 -3.975 1.00 3.89 C ATOM 3 C ASN A 316 116.896 -6.193 -2.744 1.00 2.72 C ATOM 4 O ASN A 316 117.487 -6.093 -1.687 1.00 2.74 O ATOM 5 CB ASN A 316 117.285 -8.312 -4.047 1.00 4.56 C ATOM 6 CG ASN A 316 117.922 -8.892 -5.309 1.00 5.35 C ATOM 7 OD1 ASN A 316 118.167 -8.181 -6.264 1.00 5.50 O ATOM 8 ND2 ASN A 316 118.207 -10.166 -5.356 1.00 6.08 N ATOM 0 HA ASN A 316 117.180 -6.282 -4.846 1.00 3.89 H new ATOM 0 HB2 ASN A 316 117.684 -8.811 -3.164 1.00 4.56 H new ATOM 0 HB3 ASN A 316 116.210 -8.490 -4.055 1.00 4.56 H new ATOM 0 HD21 ASN A 316 118.634 -10.562 -6.193 1.00 6.08 H new ATOM 0 HD22 ASN A 316 118.002 -10.764 -4.556 1.00 6.08 H new ATOM 15 N ARG A 317 115.674 -5.759 -2.879 1.00 2.20 N ATOM 16 CA ARG A 317 114.978 -5.127 -1.721 1.00 1.30 C ATOM 17 C ARG A 317 113.579 -5.723 -1.548 1.00 1.48 C ATOM 18 O ARG A 317 112.862 -5.940 -2.505 1.00 1.26 O ATOM 19 CB ARG A 317 114.889 -3.643 -2.079 1.00 1.52 C ATOM 20 CG ARG A 317 116.299 -3.058 -2.180 1.00 2.49 C ATOM 21 CD ARG A 317 116.212 -1.553 -2.443 1.00 3.27 C ATOM 22 NE ARG A 317 117.611 -1.133 -2.736 1.00 4.34 N ATOM 23 CZ ARG A 317 118.489 -1.051 -1.771 1.00 5.21 C ATOM 24 NH1 ARG A 317 118.146 -1.337 -0.544 1.00 5.83 N ATOM 25 NH2 ARG A 317 119.713 -0.684 -2.035 1.00 5.72 N ATOM 0 H ARG A 317 115.127 -5.814 -3.738 1.00 2.20 H new ATOM 0 HA ARG A 317 115.507 -5.292 -0.782 1.00 1.30 H new ATOM 0 HB2 ARG A 317 114.363 -3.517 -3.025 1.00 1.52 H new ATOM 0 HB3 ARG A 317 114.315 -3.109 -1.322 1.00 1.52 H new ATOM 0 HG2 ARG A 317 116.848 -3.245 -1.257 1.00 2.49 H new ATOM 0 HG3 ARG A 317 116.850 -3.547 -2.984 1.00 2.49 H new ATOM 0 HD2 ARG A 317 115.551 -1.336 -3.282 1.00 3.27 H new ATOM 0 HD3 ARG A 317 115.814 -1.023 -1.578 1.00 3.27 H new ATOM 0 HE ARG A 317 117.885 -0.909 -3.693 1.00 4.34 H new ATOM 0 HH11 ARG A 317 117.190 -1.626 -0.336 1.00 5.83 H new ATOM 0 HH12 ARG A 317 118.834 -1.272 0.206 1.00 5.83 H new ATOM 0 HH21 ARG A 317 119.983 -0.462 -2.993 1.00 5.72 H new ATOM 0 HH22 ARG A 317 120.399 -0.619 -1.283 1.00 5.72 H new ATOM 39 N GLN A 318 113.176 -5.955 -0.330 1.00 2.19 N ATOM 40 CA GLN A 318 111.807 -6.496 -0.087 1.00 2.64 C ATOM 41 C GLN A 318 111.232 -5.915 1.206 1.00 2.16 C ATOM 42 O GLN A 318 111.950 -5.647 2.145 1.00 2.69 O ATOM 43 CB GLN A 318 112.000 -8.007 0.051 1.00 3.37 C ATOM 44 CG GLN A 318 112.793 -8.307 1.324 1.00 4.16 C ATOM 45 CD GLN A 318 113.186 -9.785 1.346 1.00 4.79 C ATOM 46 OE1 GLN A 318 113.549 -10.342 0.329 1.00 4.85 O ATOM 47 NE2 GLN A 318 113.130 -10.446 2.469 1.00 5.58 N ATOM 0 H GLN A 318 113.734 -5.794 0.508 1.00 2.19 H new ATOM 0 HA GLN A 318 111.114 -6.241 -0.889 1.00 2.64 H new ATOM 0 HB2 GLN A 318 111.032 -8.506 0.087 1.00 3.37 H new ATOM 0 HB3 GLN A 318 112.528 -8.398 -0.819 1.00 3.37 H new ATOM 0 HG2 GLN A 318 113.685 -7.682 1.365 1.00 4.16 H new ATOM 0 HG3 GLN A 318 112.195 -8.066 2.203 1.00 4.16 H new ATOM 0 HE21 GLN A 318 112.825 -9.977 3.322 1.00 5.58 H new ATOM 0 HE22 GLN A 318 113.391 -11.432 2.494 1.00 5.58 H new ATOM 56 N ALA A 319 109.936 -5.787 1.294 1.00 1.32 N ATOM 57 CA ALA A 319 109.331 -5.300 2.567 1.00 1.05 C ATOM 58 C ALA A 319 109.504 -6.344 3.664 1.00 0.89 C ATOM 59 O ALA A 319 109.192 -7.503 3.483 1.00 1.18 O ATOM 60 CB ALA A 319 107.851 -5.111 2.262 1.00 1.42 C ATOM 0 H ALA A 319 109.274 -5.996 0.546 1.00 1.32 H new ATOM 0 HA ALA A 319 109.801 -4.379 2.914 1.00 1.05 H new ATOM 0 HB1 ALA A 319 107.338 -4.753 3.155 1.00 1.42 H new ATOM 0 HB2 ALA A 319 107.735 -4.382 1.460 1.00 1.42 H new ATOM 0 HB3 ALA A 319 107.419 -6.063 1.953 1.00 1.42 H new ATOM 66 N SER A 320 109.877 -5.922 4.836 1.00 0.59 N ATOM 67 CA SER A 320 109.921 -6.877 5.973 1.00 0.64 C ATOM 68 C SER A 320 108.793 -6.579 6.966 1.00 0.49 C ATOM 69 O SER A 320 108.181 -7.476 7.509 1.00 0.50 O ATOM 70 CB SER A 320 111.288 -6.667 6.624 1.00 0.78 C ATOM 71 OG SER A 320 112.237 -7.538 6.020 1.00 1.60 O ATOM 0 H SER A 320 110.152 -4.964 5.055 1.00 0.59 H new ATOM 0 HA SER A 320 109.785 -7.908 5.647 1.00 0.64 H new ATOM 0 HB2 SER A 320 111.603 -5.630 6.507 1.00 0.78 H new ATOM 0 HB3 SER A 320 111.227 -6.863 7.694 1.00 0.78 H new ATOM 0 HG SER A 320 112.834 -7.899 6.708 1.00 1.60 H new ATOM 77 N GLU A 321 108.529 -5.327 7.227 1.00 0.45 N ATOM 78 CA GLU A 321 107.458 -4.985 8.209 1.00 0.44 C ATOM 79 C GLU A 321 106.761 -3.679 7.822 1.00 0.37 C ATOM 80 O GLU A 321 107.384 -2.745 7.369 1.00 0.35 O ATOM 81 CB GLU A 321 108.180 -4.822 9.543 1.00 0.59 C ATOM 82 CG GLU A 321 107.178 -4.389 10.613 1.00 0.73 C ATOM 83 CD GLU A 321 106.228 -5.548 10.922 1.00 1.02 C ATOM 84 OE1 GLU A 321 106.618 -6.683 10.702 1.00 1.82 O ATOM 85 OE2 GLU A 321 105.126 -5.279 11.373 1.00 1.30 O ATOM 0 H GLU A 321 109.005 -4.530 6.806 1.00 0.45 H new ATOM 0 HA GLU A 321 106.686 -5.753 8.247 1.00 0.44 H new ATOM 0 HB2 GLU A 321 108.653 -5.761 9.830 1.00 0.59 H new ATOM 0 HB3 GLU A 321 108.974 -4.081 9.451 1.00 0.59 H new ATOM 0 HG2 GLU A 321 107.705 -4.085 11.518 1.00 0.73 H new ATOM 0 HG3 GLU A 321 106.612 -3.524 10.268 1.00 0.73 H new ATOM 92 N PHE A 322 105.493 -3.574 8.101 1.00 0.40 N ATOM 93 CA PHE A 322 104.777 -2.284 7.862 1.00 0.37 C ATOM 94 C PHE A 322 104.254 -1.715 9.182 1.00 0.38 C ATOM 95 O PHE A 322 103.837 -2.442 10.061 1.00 0.42 O ATOM 96 CB PHE A 322 103.619 -2.635 6.924 1.00 0.41 C ATOM 97 CG PHE A 322 102.940 -3.896 7.400 1.00 0.52 C ATOM 98 CD1 PHE A 322 103.450 -5.147 7.025 1.00 0.67 C ATOM 99 CD2 PHE A 322 101.799 -3.817 8.209 1.00 0.94 C ATOM 100 CE1 PHE A 322 102.820 -6.320 7.461 1.00 0.87 C ATOM 101 CE2 PHE A 322 101.169 -4.992 8.647 1.00 1.14 C ATOM 102 CZ PHE A 322 101.679 -6.243 8.272 1.00 1.00 C ATOM 0 H PHE A 322 104.918 -4.324 8.485 1.00 0.40 H new ATOM 0 HA PHE A 322 105.429 -1.525 7.430 1.00 0.37 H new ATOM 0 HB2 PHE A 322 102.902 -1.814 6.893 1.00 0.41 H new ATOM 0 HB3 PHE A 322 103.990 -2.772 5.908 1.00 0.41 H new ATOM 0 HD1 PHE A 322 104.329 -5.206 6.400 1.00 0.67 H new ATOM 0 HD2 PHE A 322 101.405 -2.853 8.495 1.00 0.94 H new ATOM 0 HE1 PHE A 322 103.213 -7.284 7.172 1.00 0.87 H new ATOM 0 HE2 PHE A 322 100.291 -4.933 9.273 1.00 1.14 H new ATOM 0 HZ PHE A 322 101.193 -7.147 8.608 1.00 1.00 H new ATOM 112 N ILE A 323 104.219 -0.415 9.303 1.00 0.37 N ATOM 113 CA ILE A 323 103.657 0.199 10.545 1.00 0.41 C ATOM 114 C ILE A 323 102.589 1.241 10.197 1.00 0.43 C ATOM 115 O ILE A 323 102.744 1.993 9.255 1.00 0.53 O ATOM 116 CB ILE A 323 104.828 0.877 11.249 1.00 0.44 C ATOM 117 CG1 ILE A 323 106.081 0.003 11.148 1.00 0.46 C ATOM 118 CG2 ILE A 323 104.458 1.068 12.718 1.00 0.48 C ATOM 119 CD1 ILE A 323 105.832 -1.329 11.855 1.00 0.52 C ATOM 0 H ILE A 323 104.552 0.246 8.602 1.00 0.37 H new ATOM 0 HA ILE A 323 103.185 -0.555 11.175 1.00 0.41 H new ATOM 0 HB ILE A 323 105.035 1.839 10.780 1.00 0.44 H new ATOM 0 HG12 ILE A 323 106.333 -0.170 10.102 1.00 0.46 H new ATOM 0 HG13 ILE A 323 106.931 0.514 11.601 1.00 0.46 H new ATOM 0 HG21 ILE A 323 105.283 1.552 13.241 1.00 0.48 H new ATOM 0 HG22 ILE A 323 103.567 1.691 12.791 1.00 0.48 H new ATOM 0 HG23 ILE A 323 104.260 0.097 13.173 1.00 0.48 H new ATOM 0 HD11 ILE A 323 106.724 -1.951 11.783 1.00 0.52 H new ATOM 0 HD12 ILE A 323 105.601 -1.146 12.904 1.00 0.52 H new ATOM 0 HD13 ILE A 323 104.994 -1.841 11.382 1.00 0.52 H new ATOM 131 N PRO A 324 101.502 1.199 10.928 1.00 0.36 N ATOM 132 CA PRO A 324 100.351 2.093 10.641 1.00 0.40 C ATOM 133 C PRO A 324 100.722 3.560 10.852 1.00 0.64 C ATOM 134 O PRO A 324 101.545 3.891 11.682 1.00 1.44 O ATOM 135 CB PRO A 324 99.282 1.670 11.647 1.00 0.33 C ATOM 136 CG PRO A 324 99.754 0.382 12.240 1.00 0.30 C ATOM 137 CD PRO A 324 101.245 0.331 12.077 1.00 0.29 C ATOM 0 HA PRO A 324 100.019 2.008 9.606 1.00 0.40 H new ATOM 0 HB2 PRO A 324 99.151 2.429 12.418 1.00 0.33 H new ATOM 0 HB3 PRO A 324 98.316 1.543 11.158 1.00 0.33 H new ATOM 0 HG2 PRO A 324 99.481 0.322 13.294 1.00 0.30 H new ATOM 0 HG3 PRO A 324 99.284 -0.465 11.740 1.00 0.30 H new ATOM 0 HD2 PRO A 324 101.757 0.688 12.970 1.00 0.29 H new ATOM 0 HD3 PRO A 324 101.593 -0.686 11.895 1.00 0.29 H new ATOM 145 N ALA A 325 100.020 4.443 10.200 1.00 0.75 N ATOM 146 CA ALA A 325 100.216 5.894 10.460 1.00 0.98 C ATOM 147 C ALA A 325 99.570 6.268 11.793 1.00 0.81 C ATOM 148 O ALA A 325 99.244 5.418 12.598 1.00 1.11 O ATOM 149 CB ALA A 325 99.510 6.604 9.304 1.00 1.58 C ATOM 0 H ALA A 325 99.316 4.221 9.496 1.00 0.75 H new ATOM 0 HA ALA A 325 101.269 6.170 10.520 1.00 0.98 H new ATOM 0 HB1 ALA A 325 99.610 7.683 9.424 1.00 1.58 H new ATOM 0 HB2 ALA A 325 99.962 6.301 8.360 1.00 1.58 H new ATOM 0 HB3 ALA A 325 98.454 6.335 9.303 1.00 1.58 H new ATOM 155 N GLN A 326 99.418 7.534 12.050 1.00 0.91 N ATOM 156 CA GLN A 326 98.835 7.960 13.352 1.00 1.48 C ATOM 157 C GLN A 326 97.396 7.444 13.487 1.00 1.32 C ATOM 158 O GLN A 326 96.474 7.998 12.922 1.00 1.83 O ATOM 159 CB GLN A 326 98.854 9.488 13.305 1.00 2.25 C ATOM 160 CG GLN A 326 98.409 10.047 14.658 1.00 3.14 C ATOM 161 CD GLN A 326 98.311 11.571 14.576 1.00 3.55 C ATOM 162 OE1 GLN A 326 97.566 12.101 13.776 1.00 4.00 O ATOM 163 NE2 GLN A 326 99.036 12.304 15.375 1.00 3.92 N ATOM 0 H GLN A 326 99.671 8.293 11.417 1.00 0.91 H new ATOM 0 HA GLN A 326 99.391 7.567 14.203 1.00 1.48 H new ATOM 0 HB2 GLN A 326 99.857 9.842 13.065 1.00 2.25 H new ATOM 0 HB3 GLN A 326 98.192 9.846 12.516 1.00 2.25 H new ATOM 0 HG2 GLN A 326 97.444 9.625 14.938 1.00 3.14 H new ATOM 0 HG3 GLN A 326 99.119 9.759 15.433 1.00 3.14 H new ATOM 0 HE21 GLN A 326 99.662 11.860 16.047 1.00 3.92 H new ATOM 0 HE22 GLN A 326 98.977 13.321 15.328 1.00 3.92 H new ATOM 172 N GLY A 327 97.189 6.443 14.302 1.00 1.28 N ATOM 173 CA GLY A 327 95.799 5.961 14.554 1.00 1.48 C ATOM 174 C GLY A 327 95.432 4.851 13.562 1.00 1.24 C ATOM 175 O GLY A 327 94.273 4.543 13.367 1.00 1.52 O ATOM 0 H GLY A 327 97.921 5.939 14.803 1.00 1.28 H new ATOM 0 HA2 GLY A 327 95.716 5.588 15.575 1.00 1.48 H new ATOM 0 HA3 GLY A 327 95.097 6.789 14.459 1.00 1.48 H new ATOM 179 N VAL A 328 96.399 4.283 12.892 1.00 0.93 N ATOM 180 CA VAL A 328 96.085 3.242 11.871 1.00 1.03 C ATOM 181 C VAL A 328 96.402 1.842 12.410 1.00 1.06 C ATOM 182 O VAL A 328 97.276 1.667 13.235 1.00 1.71 O ATOM 183 CB VAL A 328 96.983 3.574 10.680 1.00 1.43 C ATOM 184 CG1 VAL A 328 96.730 2.569 9.555 1.00 1.73 C ATOM 185 CG2 VAL A 328 96.662 4.985 10.182 1.00 1.57 C ATOM 0 H VAL A 328 97.390 4.494 13.007 1.00 0.93 H new ATOM 0 HA VAL A 328 95.029 3.240 11.601 1.00 1.03 H new ATOM 0 HB VAL A 328 98.028 3.522 10.986 1.00 1.43 H new ATOM 0 HG11 VAL A 328 97.370 2.805 8.705 1.00 1.73 H new ATOM 0 HG12 VAL A 328 96.954 1.563 9.909 1.00 1.73 H new ATOM 0 HG13 VAL A 328 95.685 2.622 9.248 1.00 1.73 H new ATOM 0 HG21 VAL A 328 97.301 5.225 9.332 1.00 1.57 H new ATOM 0 HG22 VAL A 328 95.617 5.034 9.875 1.00 1.57 H new ATOM 0 HG23 VAL A 328 96.839 5.703 10.983 1.00 1.57 H new ATOM 195 N ASP A 329 95.718 0.839 11.926 1.00 1.16 N ATOM 196 CA ASP A 329 96.008 -0.554 12.378 1.00 1.20 C ATOM 197 C ASP A 329 97.013 -1.218 11.427 1.00 1.16 C ATOM 198 O ASP A 329 97.052 -0.925 10.249 1.00 1.39 O ATOM 199 CB ASP A 329 94.661 -1.278 12.326 1.00 1.44 C ATOM 200 CG ASP A 329 93.716 -0.672 13.365 1.00 1.37 C ATOM 201 OD1 ASP A 329 94.193 0.068 14.210 1.00 2.02 O ATOM 202 OD2 ASP A 329 92.533 -0.960 13.300 1.00 1.69 O ATOM 0 H ASP A 329 94.971 0.924 11.237 1.00 1.16 H new ATOM 0 HA ASP A 329 96.446 -0.582 13.376 1.00 1.20 H new ATOM 0 HB2 ASP A 329 94.227 -1.191 11.330 1.00 1.44 H new ATOM 0 HB3 ASP A 329 94.800 -2.341 12.521 1.00 1.44 H new ATOM 207 N GLU A 330 97.859 -2.073 11.939 1.00 1.13 N ATOM 208 CA GLU A 330 98.897 -2.709 11.071 1.00 1.11 C ATOM 209 C GLU A 330 98.253 -3.564 9.978 1.00 0.97 C ATOM 210 O GLU A 330 98.714 -3.598 8.858 1.00 0.91 O ATOM 211 CB GLU A 330 99.711 -3.597 12.009 1.00 1.28 C ATOM 212 CG GLU A 330 100.913 -2.815 12.527 1.00 1.68 C ATOM 213 CD GLU A 330 101.728 -3.695 13.476 1.00 2.07 C ATOM 214 OE1 GLU A 330 101.264 -4.777 13.795 1.00 2.70 O ATOM 215 OE2 GLU A 330 102.802 -3.272 13.869 1.00 2.49 O ATOM 0 H GLU A 330 97.877 -2.359 12.918 1.00 1.13 H new ATOM 0 HA GLU A 330 99.507 -1.959 10.567 1.00 1.11 H new ATOM 0 HB2 GLU A 330 99.092 -3.929 12.843 1.00 1.28 H new ATOM 0 HB3 GLU A 330 100.044 -4.492 11.483 1.00 1.28 H new ATOM 0 HG2 GLU A 330 101.535 -2.490 11.693 1.00 1.68 H new ATOM 0 HG3 GLU A 330 100.579 -1.916 13.045 1.00 1.68 H new ATOM 222 N LYS A 331 97.213 -4.282 10.299 1.00 0.98 N ATOM 223 CA LYS A 331 96.582 -5.164 9.276 1.00 0.92 C ATOM 224 C LYS A 331 96.032 -4.326 8.120 1.00 0.81 C ATOM 225 O LYS A 331 96.241 -4.632 6.964 1.00 0.80 O ATOM 226 CB LYS A 331 95.448 -5.879 10.008 1.00 1.02 C ATOM 227 CG LYS A 331 94.857 -6.955 9.098 1.00 1.49 C ATOM 228 CD LYS A 331 93.697 -7.650 9.813 1.00 2.27 C ATOM 229 CE LYS A 331 93.213 -8.834 8.973 1.00 2.60 C ATOM 230 NZ LYS A 331 92.370 -9.642 9.898 1.00 3.03 N ATOM 0 H LYS A 331 96.774 -4.297 11.220 1.00 0.98 H new ATOM 0 HA LYS A 331 97.294 -5.868 8.846 1.00 0.92 H new ATOM 0 HB2 LYS A 331 95.821 -6.329 10.928 1.00 1.02 H new ATOM 0 HB3 LYS A 331 94.676 -5.164 10.293 1.00 1.02 H new ATOM 0 HG2 LYS A 331 94.508 -6.507 8.167 1.00 1.49 H new ATOM 0 HG3 LYS A 331 95.624 -7.683 8.834 1.00 1.49 H new ATOM 0 HD2 LYS A 331 94.017 -7.995 10.796 1.00 2.27 H new ATOM 0 HD3 LYS A 331 92.880 -6.946 9.972 1.00 2.27 H new ATOM 0 HE2 LYS A 331 92.640 -8.497 8.109 1.00 2.60 H new ATOM 0 HE3 LYS A 331 94.052 -9.417 8.592 1.00 2.60 H new ATOM 0 HZ1 LYS A 331 92.001 -10.473 9.394 1.00 3.03 H new ATOM 0 HZ2 LYS A 331 92.944 -9.954 10.707 1.00 3.03 H new ATOM 0 HZ3 LYS A 331 91.576 -9.063 10.239 1.00 3.03 H new ATOM 244 N THR A 332 95.356 -3.255 8.420 1.00 0.78 N ATOM 245 CA THR A 332 94.821 -2.387 7.333 1.00 0.74 C ATOM 246 C THR A 332 95.967 -1.836 6.483 1.00 0.65 C ATOM 247 O THR A 332 95.921 -1.855 5.270 1.00 0.66 O ATOM 248 CB THR A 332 94.100 -1.250 8.054 1.00 0.77 C ATOM 249 OG1 THR A 332 93.099 -1.789 8.907 1.00 0.90 O ATOM 250 CG2 THR A 332 93.454 -0.320 7.026 1.00 0.82 C ATOM 0 H THR A 332 95.150 -2.942 9.369 1.00 0.78 H new ATOM 0 HA THR A 332 94.158 -2.931 6.660 1.00 0.74 H new ATOM 0 HB THR A 332 94.817 -0.685 8.650 1.00 0.77 H new ATOM 0 HG1 THR A 332 92.637 -1.060 9.371 1.00 0.90 H new ATOM 0 HG21 THR A 332 92.940 0.491 7.542 1.00 0.82 H new ATOM 0 HG22 THR A 332 94.224 0.094 6.375 1.00 0.82 H new ATOM 0 HG23 THR A 332 92.737 -0.882 6.427 1.00 0.82 H new ATOM 258 N LEU A 333 96.991 -1.330 7.111 1.00 0.59 N ATOM 259 CA LEU A 333 98.126 -0.759 6.334 1.00 0.57 C ATOM 260 C LEU A 333 98.756 -1.814 5.427 1.00 0.58 C ATOM 261 O LEU A 333 99.016 -1.575 4.266 1.00 0.54 O ATOM 262 CB LEU A 333 99.138 -0.305 7.379 1.00 0.68 C ATOM 263 CG LEU A 333 100.462 0.009 6.682 1.00 0.64 C ATOM 264 CD1 LEU A 333 100.283 1.213 5.756 1.00 0.93 C ATOM 265 CD2 LEU A 333 101.514 0.333 7.733 1.00 0.87 C ATOM 0 H LEU A 333 97.091 -1.287 8.125 1.00 0.59 H new ATOM 0 HA LEU A 333 97.796 0.056 5.690 1.00 0.57 H new ATOM 0 HB2 LEU A 333 98.769 0.577 7.903 1.00 0.68 H new ATOM 0 HB3 LEU A 333 99.282 -1.084 8.128 1.00 0.68 H new ATOM 0 HG LEU A 333 100.779 -0.853 6.095 1.00 0.64 H new ATOM 0 HD11 LEU A 333 101.228 1.435 5.261 1.00 0.93 H new ATOM 0 HD12 LEU A 333 99.525 0.986 5.006 1.00 0.93 H new ATOM 0 HD13 LEU A 333 99.968 2.078 6.340 1.00 0.93 H new ATOM 0 HD21 LEU A 333 102.461 0.558 7.243 1.00 0.87 H new ATOM 0 HD22 LEU A 333 101.193 1.197 8.315 1.00 0.87 H new ATOM 0 HD23 LEU A 333 101.643 -0.523 8.395 1.00 0.87 H new ATOM 277 N ALA A 334 99.036 -2.968 5.954 1.00 0.66 N ATOM 278 CA ALA A 334 99.688 -4.013 5.123 1.00 0.73 C ATOM 279 C ALA A 334 98.795 -4.366 3.935 1.00 0.68 C ATOM 280 O ALA A 334 99.256 -4.568 2.834 1.00 0.66 O ATOM 281 CB ALA A 334 99.855 -5.214 6.054 1.00 0.87 C ATOM 0 H ALA A 334 98.843 -3.233 6.920 1.00 0.66 H new ATOM 0 HA ALA A 334 100.644 -3.685 4.715 1.00 0.73 H new ATOM 0 HB1 ALA A 334 100.331 -6.031 5.512 1.00 0.87 H new ATOM 0 HB2 ALA A 334 100.476 -4.932 6.904 1.00 0.87 H new ATOM 0 HB3 ALA A 334 98.877 -5.537 6.410 1.00 0.87 H new ATOM 287 N ASP A 335 97.519 -4.440 4.146 1.00 0.67 N ATOM 288 CA ASP A 335 96.603 -4.790 3.025 1.00 0.65 C ATOM 289 C ASP A 335 96.664 -3.743 1.908 1.00 0.62 C ATOM 290 O ASP A 335 96.750 -4.074 0.742 1.00 0.69 O ATOM 291 CB ASP A 335 95.217 -4.809 3.650 1.00 0.67 C ATOM 292 CG ASP A 335 94.201 -5.327 2.630 1.00 1.19 C ATOM 293 OD1 ASP A 335 94.620 -5.736 1.561 1.00 1.61 O ATOM 294 OD2 ASP A 335 93.020 -5.303 2.936 1.00 1.96 O ATOM 0 H ASP A 335 97.065 -4.274 5.044 1.00 0.67 H new ATOM 0 HA ASP A 335 96.873 -5.742 2.568 1.00 0.65 H new ATOM 0 HB2 ASP A 335 95.215 -5.445 4.535 1.00 0.67 H new ATOM 0 HB3 ASP A 335 94.941 -3.807 3.977 1.00 0.67 H new ATOM 299 N ALA A 336 96.654 -2.482 2.248 1.00 0.60 N ATOM 300 CA ALA A 336 96.742 -1.431 1.191 1.00 0.62 C ATOM 301 C ALA A 336 98.075 -1.538 0.457 1.00 0.51 C ATOM 302 O ALA A 336 98.149 -1.349 -0.738 1.00 0.55 O ATOM 303 CB ALA A 336 96.636 -0.095 1.928 1.00 0.76 C ATOM 0 H ALA A 336 96.589 -2.135 3.205 1.00 0.60 H new ATOM 0 HA ALA A 336 95.956 -1.536 0.444 1.00 0.62 H new ATOM 0 HB1 ALA A 336 96.694 0.723 1.209 1.00 0.76 H new ATOM 0 HB2 ALA A 336 95.685 -0.046 2.458 1.00 0.76 H new ATOM 0 HB3 ALA A 336 97.454 -0.008 2.643 1.00 0.76 H new ATOM 309 N ALA A 337 99.124 -1.869 1.153 1.00 0.46 N ATOM 310 CA ALA A 337 100.442 -2.012 0.469 1.00 0.50 C ATOM 311 C ALA A 337 100.394 -3.154 -0.549 1.00 0.62 C ATOM 312 O ALA A 337 101.026 -3.097 -1.585 1.00 0.72 O ATOM 313 CB ALA A 337 101.446 -2.328 1.579 1.00 0.50 C ATOM 0 H ALA A 337 99.130 -2.046 2.158 1.00 0.46 H new ATOM 0 HA ALA A 337 100.714 -1.109 -0.078 1.00 0.50 H new ATOM 0 HB1 ALA A 337 102.440 -2.447 1.148 1.00 0.50 H new ATOM 0 HB2 ALA A 337 101.459 -1.512 2.301 1.00 0.50 H new ATOM 0 HB3 ALA A 337 101.156 -3.251 2.080 1.00 0.50 H new ATOM 319 N GLN A 338 99.678 -4.205 -0.254 1.00 0.71 N ATOM 320 CA GLN A 338 99.636 -5.355 -1.203 1.00 0.91 C ATOM 321 C GLN A 338 98.859 -4.987 -2.468 1.00 0.94 C ATOM 322 O GLN A 338 99.327 -5.187 -3.568 1.00 1.06 O ATOM 323 CB GLN A 338 98.919 -6.483 -0.460 1.00 1.03 C ATOM 324 CG GLN A 338 99.530 -6.735 0.932 1.00 1.03 C ATOM 325 CD GLN A 338 100.968 -6.187 1.049 1.00 0.94 C ATOM 326 OE1 GLN A 338 101.764 -6.322 0.147 1.00 1.72 O ATOM 327 NE2 GLN A 338 101.334 -5.570 2.139 1.00 0.69 N ATOM 0 H GLN A 338 99.125 -4.317 0.595 1.00 0.71 H new ATOM 0 HA GLN A 338 100.639 -5.645 -1.515 1.00 0.91 H new ATOM 0 HB2 GLN A 338 97.863 -6.233 -0.353 1.00 1.03 H new ATOM 0 HB3 GLN A 338 98.972 -7.398 -1.051 1.00 1.03 H new ATOM 0 HG2 GLN A 338 98.903 -6.268 1.691 1.00 1.03 H new ATOM 0 HG3 GLN A 338 99.534 -7.806 1.136 1.00 1.03 H new ATOM 0 HE21 GLN A 338 100.671 -5.451 2.905 1.00 0.69 H new ATOM 0 HE22 GLN A 338 102.283 -5.207 2.225 1.00 0.69 H new ATOM 336 N LEU A 339 97.643 -4.541 -2.333 1.00 0.86 N ATOM 337 CA LEU A 339 96.832 -4.280 -3.559 1.00 0.90 C ATOM 338 C LEU A 339 97.457 -3.141 -4.375 1.00 0.84 C ATOM 339 O LEU A 339 97.513 -3.199 -5.588 1.00 1.00 O ATOM 340 CB LEU A 339 95.422 -3.914 -3.083 1.00 0.80 C ATOM 341 CG LEU A 339 95.477 -2.959 -1.892 1.00 1.01 C ATOM 342 CD1 LEU A 339 94.827 -1.633 -2.282 1.00 1.34 C ATOM 343 CD2 LEU A 339 94.702 -3.578 -0.725 1.00 1.58 C ATOM 0 H LEU A 339 97.179 -4.348 -1.445 1.00 0.86 H new ATOM 0 HA LEU A 339 96.799 -5.154 -4.209 1.00 0.90 H new ATOM 0 HB2 LEU A 339 94.867 -3.451 -3.899 1.00 0.80 H new ATOM 0 HB3 LEU A 339 94.882 -4.819 -2.804 1.00 0.80 H new ATOM 0 HG LEU A 339 96.513 -2.786 -1.600 1.00 1.01 H new ATOM 0 HD11 LEU A 339 94.863 -0.947 -1.436 1.00 1.34 H new ATOM 0 HD12 LEU A 339 95.365 -1.198 -3.125 1.00 1.34 H new ATOM 0 HD13 LEU A 339 93.789 -1.806 -2.564 1.00 1.34 H new ATOM 0 HD21 LEU A 339 94.735 -2.904 0.131 1.00 1.58 H new ATOM 0 HD22 LEU A 339 93.665 -3.739 -1.021 1.00 1.58 H new ATOM 0 HD23 LEU A 339 95.154 -4.532 -0.454 1.00 1.58 H new ATOM 355 N ALA A 340 97.982 -2.139 -3.725 1.00 0.74 N ATOM 356 CA ALA A 340 98.666 -1.045 -4.473 1.00 0.93 C ATOM 357 C ALA A 340 99.945 -1.572 -5.128 1.00 1.36 C ATOM 358 O ALA A 340 100.483 -0.968 -6.034 1.00 2.24 O ATOM 359 CB ALA A 340 99.003 0.008 -3.419 1.00 0.82 C ATOM 0 H ALA A 340 97.967 -2.030 -2.711 1.00 0.74 H new ATOM 0 HA ALA A 340 98.042 -0.640 -5.270 1.00 0.93 H new ATOM 0 HB1 ALA A 340 99.510 0.848 -3.893 1.00 0.82 H new ATOM 0 HB2 ALA A 340 98.085 0.358 -2.947 1.00 0.82 H new ATOM 0 HB3 ALA A 340 99.655 -0.430 -2.663 1.00 0.82 H new ATOM 365 N SER A 341 100.406 -2.721 -4.713 1.00 1.07 N ATOM 366 CA SER A 341 101.615 -3.310 -5.360 1.00 1.44 C ATOM 367 C SER A 341 101.197 -4.290 -6.460 1.00 1.51 C ATOM 368 O SER A 341 101.957 -4.583 -7.362 1.00 2.65 O ATOM 369 CB SER A 341 102.372 -4.028 -4.239 1.00 2.84 C ATOM 370 OG SER A 341 101.626 -5.156 -3.816 1.00 3.56 O ATOM 0 H SER A 341 100.001 -3.275 -3.958 1.00 1.07 H new ATOM 0 HA SER A 341 102.239 -2.553 -5.834 1.00 1.44 H new ATOM 0 HB2 SER A 341 103.356 -4.340 -4.591 1.00 2.84 H new ATOM 0 HB3 SER A 341 102.533 -3.350 -3.401 1.00 2.84 H new ATOM 0 HG SER A 341 100.675 -5.006 -3.997 1.00 3.56 H new ATOM 376 N LEU A 342 99.972 -4.740 -6.438 1.00 1.19 N ATOM 377 CA LEU A 342 99.493 -5.631 -7.534 1.00 2.40 C ATOM 378 C LEU A 342 99.636 -4.922 -8.882 1.00 2.59 C ATOM 379 O LEU A 342 99.699 -5.547 -9.921 1.00 3.62 O ATOM 380 CB LEU A 342 98.013 -5.882 -7.241 1.00 3.39 C ATOM 381 CG LEU A 342 97.858 -6.642 -5.925 1.00 3.93 C ATOM 382 CD1 LEU A 342 96.391 -7.040 -5.746 1.00 4.36 C ATOM 383 CD2 LEU A 342 98.726 -7.901 -5.956 1.00 3.74 C ATOM 0 H LEU A 342 99.285 -4.531 -5.713 1.00 1.19 H new ATOM 0 HA LEU A 342 100.065 -6.558 -7.581 1.00 2.40 H new ATOM 0 HB2 LEU A 342 97.479 -4.933 -7.187 1.00 3.39 H new ATOM 0 HB3 LEU A 342 97.565 -6.453 -8.054 1.00 3.39 H new ATOM 0 HG LEU A 342 98.172 -6.007 -5.096 1.00 3.93 H new ATOM 0 HD11 LEU A 342 96.273 -7.583 -4.808 1.00 4.36 H new ATOM 0 HD12 LEU A 342 95.771 -6.144 -5.727 1.00 4.36 H new ATOM 0 HD13 LEU A 342 96.083 -7.677 -6.575 1.00 4.36 H new ATOM 0 HD21 LEU A 342 98.615 -8.443 -5.017 1.00 3.74 H new ATOM 0 HD22 LEU A 342 98.412 -8.539 -6.782 1.00 3.74 H new ATOM 0 HD23 LEU A 342 99.770 -7.620 -6.091 1.00 3.74 H new ATOM 395 N ALA A 343 99.573 -3.618 -8.876 1.00 2.04 N ATOM 396 CA ALA A 343 99.579 -2.863 -10.162 1.00 2.90 C ATOM 397 C ALA A 343 101.008 -2.489 -10.572 1.00 2.34 C ATOM 398 O ALA A 343 101.219 -1.851 -11.583 1.00 2.96 O ATOM 399 CB ALA A 343 98.753 -1.605 -9.887 1.00 3.81 C ATOM 0 H ALA A 343 99.518 -3.042 -8.036 1.00 2.04 H new ATOM 0 HA ALA A 343 99.169 -3.455 -10.980 1.00 2.90 H new ATOM 0 HB1 ALA A 343 98.710 -0.994 -10.789 1.00 3.81 H new ATOM 0 HB2 ALA A 343 97.743 -1.890 -9.593 1.00 3.81 H new ATOM 0 HB3 ALA A 343 99.217 -1.033 -9.083 1.00 3.81 H new ATOM 405 N ASP A 344 101.992 -2.909 -9.826 1.00 1.46 N ATOM 406 CA ASP A 344 103.397 -2.600 -10.222 1.00 1.77 C ATOM 407 C ASP A 344 104.045 -3.825 -10.875 1.00 1.92 C ATOM 408 O ASP A 344 103.734 -4.954 -10.547 1.00 1.99 O ATOM 409 CB ASP A 344 104.115 -2.225 -8.922 1.00 1.69 C ATOM 410 CG ASP A 344 104.215 -3.447 -8.003 1.00 2.00 C ATOM 411 OD1 ASP A 344 104.661 -4.482 -8.468 1.00 2.84 O ATOM 412 OD2 ASP A 344 103.850 -3.322 -6.847 1.00 1.89 O ATOM 0 H ASP A 344 101.887 -3.448 -8.967 1.00 1.46 H new ATOM 0 HA ASP A 344 103.450 -1.792 -10.952 1.00 1.77 H new ATOM 0 HB2 ASP A 344 105.112 -1.846 -9.145 1.00 1.69 H new ATOM 0 HB3 ASP A 344 103.575 -1.424 -8.417 1.00 1.69 H new ATOM 417 N GLU A 345 104.923 -3.612 -11.815 1.00 2.10 N ATOM 418 CA GLU A 345 105.570 -4.765 -12.506 1.00 2.37 C ATOM 419 C GLU A 345 106.944 -5.049 -11.892 1.00 2.30 C ATOM 420 O GLU A 345 107.694 -5.871 -12.378 1.00 2.51 O ATOM 421 CB GLU A 345 105.710 -4.329 -13.964 1.00 2.66 C ATOM 422 CG GLU A 345 104.323 -4.049 -14.548 1.00 2.29 C ATOM 423 CD GLU A 345 104.456 -3.685 -16.027 1.00 2.60 C ATOM 424 OE1 GLU A 345 105.576 -3.503 -16.474 1.00 2.87 O ATOM 425 OE2 GLU A 345 103.435 -3.595 -16.689 1.00 2.99 O ATOM 0 H GLU A 345 105.221 -2.691 -12.135 1.00 2.10 H new ATOM 0 HA GLU A 345 104.987 -5.681 -12.412 1.00 2.37 H new ATOM 0 HB2 GLU A 345 106.331 -3.436 -14.030 1.00 2.66 H new ATOM 0 HB3 GLU A 345 106.209 -5.107 -14.541 1.00 2.66 H new ATOM 0 HG2 GLU A 345 103.685 -4.926 -14.434 1.00 2.29 H new ATOM 0 HG3 GLU A 345 103.845 -3.234 -14.004 1.00 2.29 H new ATOM 432 N THR A 346 107.275 -4.371 -10.831 1.00 2.06 N ATOM 433 CA THR A 346 108.600 -4.597 -10.184 1.00 2.06 C ATOM 434 C THR A 346 108.517 -5.772 -9.206 1.00 1.91 C ATOM 435 O THR A 346 107.540 -5.924 -8.500 1.00 1.73 O ATOM 436 CB THR A 346 108.905 -3.297 -9.438 1.00 2.02 C ATOM 437 OG1 THR A 346 107.703 -2.781 -8.882 1.00 1.96 O ATOM 438 CG2 THR A 346 109.501 -2.277 -10.407 1.00 2.07 C ATOM 0 H THR A 346 106.687 -3.669 -10.382 1.00 2.06 H new ATOM 0 HA THR A 346 109.377 -4.842 -10.908 1.00 2.06 H new ATOM 0 HB THR A 346 109.621 -3.494 -8.640 1.00 2.02 H new ATOM 0 HG1 THR A 346 107.844 -2.572 -7.935 1.00 1.96 H new ATOM 0 HG21 THR A 346 109.718 -1.352 -9.873 1.00 2.07 H new ATOM 0 HG22 THR A 346 110.422 -2.675 -10.833 1.00 2.07 H new ATOM 0 HG23 THR A 346 108.789 -2.076 -11.207 1.00 2.07 H new ATOM 446 N PRO A 347 109.558 -6.558 -9.190 1.00 2.03 N ATOM 447 CA PRO A 347 109.614 -7.726 -8.278 1.00 1.99 C ATOM 448 C PRO A 347 109.437 -7.273 -6.826 1.00 1.79 C ATOM 449 O PRO A 347 108.900 -7.989 -6.004 1.00 1.68 O ATOM 450 CB PRO A 347 111.012 -8.305 -8.499 1.00 2.25 C ATOM 451 CG PRO A 347 111.481 -7.740 -9.803 1.00 2.38 C ATOM 452 CD PRO A 347 110.765 -6.433 -10.010 1.00 2.29 C ATOM 0 HA PRO A 347 108.827 -8.455 -8.473 1.00 1.99 H new ATOM 0 HB2 PRO A 347 111.684 -8.027 -7.687 1.00 2.25 H new ATOM 0 HB3 PRO A 347 110.984 -9.394 -8.531 1.00 2.25 H new ATOM 0 HG2 PRO A 347 112.560 -7.589 -9.790 1.00 2.38 H new ATOM 0 HG3 PRO A 347 111.266 -8.429 -10.620 1.00 2.38 H new ATOM 0 HD2 PRO A 347 111.377 -5.588 -9.694 1.00 2.29 H new ATOM 0 HD3 PRO A 347 110.520 -6.274 -11.060 1.00 2.29 H new ATOM 460 N GLU A 348 109.872 -6.084 -6.508 1.00 1.76 N ATOM 461 CA GLU A 348 109.713 -5.581 -5.113 1.00 1.64 C ATOM 462 C GLU A 348 108.228 -5.442 -4.769 1.00 1.41 C ATOM 463 O GLU A 348 107.798 -5.772 -3.683 1.00 1.31 O ATOM 464 CB GLU A 348 110.398 -4.215 -5.107 1.00 1.72 C ATOM 465 CG GLU A 348 111.894 -4.396 -5.377 1.00 2.14 C ATOM 466 CD GLU A 348 112.593 -3.036 -5.322 1.00 2.49 C ATOM 467 OE1 GLU A 348 111.897 -2.035 -5.286 1.00 3.25 O ATOM 468 OE2 GLU A 348 113.813 -3.019 -5.321 1.00 2.49 O ATOM 0 H GLU A 348 110.330 -5.440 -7.153 1.00 1.76 H new ATOM 0 HA GLU A 348 110.146 -6.257 -4.376 1.00 1.64 H new ATOM 0 HB2 GLU A 348 109.955 -3.570 -5.866 1.00 1.72 H new ATOM 0 HB3 GLU A 348 110.247 -3.724 -4.145 1.00 1.72 H new ATOM 0 HG2 GLU A 348 112.328 -5.070 -4.638 1.00 2.14 H new ATOM 0 HG3 GLU A 348 112.045 -4.855 -6.354 1.00 2.14 H new ATOM 475 N GLY A 349 107.430 -5.012 -5.705 1.00 1.42 N ATOM 476 CA GLY A 349 105.965 -4.919 -5.452 1.00 1.30 C ATOM 477 C GLY A 349 105.422 -6.301 -5.083 1.00 1.23 C ATOM 478 O GLY A 349 104.543 -6.433 -4.253 1.00 1.23 O ATOM 0 H GLY A 349 107.729 -4.720 -6.636 1.00 1.42 H new ATOM 0 HA2 GLY A 349 105.769 -4.212 -4.646 1.00 1.30 H new ATOM 0 HA3 GLY A 349 105.455 -4.541 -6.338 1.00 1.30 H new ATOM 482 N ARG A 350 106.043 -7.338 -5.574 1.00 1.19 N ATOM 483 CA ARG A 350 105.668 -8.708 -5.118 1.00 1.15 C ATOM 484 C ARG A 350 106.238 -8.952 -3.727 1.00 1.06 C ATOM 485 O ARG A 350 105.609 -9.558 -2.884 1.00 0.94 O ATOM 486 CB ARG A 350 106.303 -9.655 -6.132 1.00 1.18 C ATOM 487 CG ARG A 350 106.001 -9.152 -7.541 1.00 1.81 C ATOM 488 CD ARG A 350 106.512 -10.164 -8.569 1.00 2.33 C ATOM 489 NE ARG A 350 106.335 -9.493 -9.887 1.00 2.77 N ATOM 490 CZ ARG A 350 106.835 -10.029 -10.969 1.00 3.16 C ATOM 491 NH1 ARG A 350 107.495 -11.154 -10.903 1.00 3.46 N ATOM 492 NH2 ARG A 350 106.674 -9.437 -12.121 1.00 3.62 N ATOM 0 H ARG A 350 106.790 -7.298 -6.267 1.00 1.19 H new ATOM 0 HA ARG A 350 104.589 -8.850 -5.059 1.00 1.15 H new ATOM 0 HB2 ARG A 350 107.380 -9.708 -5.974 1.00 1.18 H new ATOM 0 HB3 ARG A 350 105.912 -10.664 -6.001 1.00 1.18 H new ATOM 0 HG2 ARG A 350 104.928 -9.005 -7.663 1.00 1.81 H new ATOM 0 HG3 ARG A 350 106.476 -8.184 -7.702 1.00 1.81 H new ATOM 0 HD2 ARG A 350 107.558 -10.415 -8.391 1.00 2.33 H new ATOM 0 HD3 ARG A 350 105.948 -11.095 -8.521 1.00 2.33 H new ATOM 0 HE ARG A 350 105.822 -8.613 -9.945 1.00 2.77 H new ATOM 0 HH11 ARG A 350 107.622 -11.619 -10.004 1.00 3.46 H new ATOM 0 HH12 ARG A 350 107.883 -11.568 -11.751 1.00 3.46 H new ATOM 0 HH21 ARG A 350 106.159 -8.558 -12.175 1.00 3.62 H new ATOM 0 HH22 ARG A 350 107.063 -9.853 -12.967 1.00 3.62 H new ATOM 506 N SER A 351 107.399 -8.435 -3.460 1.00 1.15 N ATOM 507 CA SER A 351 107.972 -8.591 -2.094 1.00 1.10 C ATOM 508 C SER A 351 106.970 -8.081 -1.055 1.00 0.97 C ATOM 509 O SER A 351 106.738 -8.707 -0.044 1.00 0.87 O ATOM 510 CB SER A 351 109.236 -7.733 -2.091 1.00 1.25 C ATOM 511 OG SER A 351 110.068 -8.118 -3.178 1.00 2.40 O ATOM 0 H SER A 351 107.975 -7.914 -4.121 1.00 1.15 H new ATOM 0 HA SER A 351 108.192 -9.630 -1.848 1.00 1.10 H new ATOM 0 HB2 SER A 351 108.974 -6.678 -2.175 1.00 1.25 H new ATOM 0 HB3 SER A 351 109.770 -7.855 -1.149 1.00 1.25 H new ATOM 0 HG SER A 351 110.953 -7.711 -3.073 1.00 2.40 H new ATOM 517 N ILE A 352 106.360 -6.955 -1.308 1.00 1.00 N ATOM 518 CA ILE A 352 105.359 -6.413 -0.348 1.00 0.93 C ATOM 519 C ILE A 352 104.096 -7.293 -0.300 1.00 0.80 C ATOM 520 O ILE A 352 103.638 -7.657 0.764 1.00 0.70 O ATOM 521 CB ILE A 352 105.074 -5.005 -0.871 1.00 1.08 C ATOM 522 CG1 ILE A 352 106.157 -4.071 -0.332 1.00 1.16 C ATOM 523 CG2 ILE A 352 103.696 -4.520 -0.411 1.00 1.16 C ATOM 524 CD1 ILE A 352 106.091 -2.726 -1.044 1.00 1.39 C ATOM 0 H ILE A 352 106.513 -6.386 -2.141 1.00 1.00 H new ATOM 0 HA ILE A 352 105.719 -6.398 0.681 1.00 0.93 H new ATOM 0 HB ILE A 352 105.079 -5.012 -1.961 1.00 1.08 H new ATOM 0 HG12 ILE A 352 106.025 -3.930 0.741 1.00 1.16 H new ATOM 0 HG13 ILE A 352 107.140 -4.520 -0.476 1.00 1.16 H new ATOM 0 HG21 ILE A 352 103.517 -3.516 -0.796 1.00 1.16 H new ATOM 0 HG22 ILE A 352 102.928 -5.196 -0.788 1.00 1.16 H new ATOM 0 HG23 ILE A 352 103.661 -4.503 0.678 1.00 1.16 H new ATOM 0 HD11 ILE A 352 106.867 -2.068 -0.652 1.00 1.39 H new ATOM 0 HD12 ILE A 352 106.245 -2.872 -2.113 1.00 1.39 H new ATOM 0 HD13 ILE A 352 105.114 -2.273 -0.877 1.00 1.39 H new ATOM 536 N VAL A 353 103.542 -7.668 -1.426 1.00 0.86 N ATOM 537 CA VAL A 353 102.334 -8.558 -1.387 1.00 0.82 C ATOM 538 C VAL A 353 102.620 -9.810 -0.546 1.00 0.77 C ATOM 539 O VAL A 353 101.796 -10.254 0.232 1.00 0.77 O ATOM 540 CB VAL A 353 102.058 -8.948 -2.841 1.00 0.97 C ATOM 541 CG1 VAL A 353 100.928 -9.978 -2.878 1.00 1.18 C ATOM 542 CG2 VAL A 353 101.634 -7.711 -3.634 1.00 1.10 C ATOM 0 H VAL A 353 103.864 -7.404 -2.357 1.00 0.86 H new ATOM 0 HA VAL A 353 101.479 -8.055 -0.936 1.00 0.82 H new ATOM 0 HB VAL A 353 102.961 -9.370 -3.281 1.00 0.97 H new ATOM 0 HG11 VAL A 353 100.726 -10.260 -3.911 1.00 1.18 H new ATOM 0 HG12 VAL A 353 101.222 -10.862 -2.312 1.00 1.18 H new ATOM 0 HG13 VAL A 353 100.029 -9.548 -2.437 1.00 1.18 H new ATOM 0 HG21 VAL A 353 101.438 -7.992 -4.669 1.00 1.10 H new ATOM 0 HG22 VAL A 353 100.730 -7.290 -3.195 1.00 1.10 H new ATOM 0 HG23 VAL A 353 102.432 -6.969 -3.604 1.00 1.10 H new ATOM 552 N ILE A 354 103.836 -10.274 -0.562 1.00 0.79 N ATOM 553 CA ILE A 354 104.226 -11.373 0.372 1.00 0.84 C ATOM 554 C ILE A 354 104.280 -10.863 1.814 1.00 0.72 C ATOM 555 O ILE A 354 103.788 -11.497 2.721 1.00 0.77 O ATOM 556 CB ILE A 354 105.612 -11.804 -0.092 1.00 0.97 C ATOM 557 CG1 ILE A 354 105.533 -12.282 -1.544 1.00 1.21 C ATOM 558 CG2 ILE A 354 106.120 -12.936 0.801 1.00 1.11 C ATOM 559 CD1 ILE A 354 106.933 -12.280 -2.162 1.00 1.36 C ATOM 0 H ILE A 354 104.578 -9.943 -1.179 1.00 0.79 H new ATOM 0 HA ILE A 354 103.511 -12.195 0.359 1.00 0.84 H new ATOM 0 HB ILE A 354 106.300 -10.961 -0.026 1.00 0.97 H new ATOM 0 HG12 ILE A 354 105.108 -13.285 -1.585 1.00 1.21 H new ATOM 0 HG13 ILE A 354 104.871 -11.632 -2.116 1.00 1.21 H new ATOM 0 HG21 ILE A 354 107.111 -13.244 0.469 1.00 1.11 H new ATOM 0 HG22 ILE A 354 106.174 -12.589 1.833 1.00 1.11 H new ATOM 0 HG23 ILE A 354 105.437 -13.783 0.739 1.00 1.11 H new ATOM 0 HD11 ILE A 354 106.875 -12.621 -3.196 1.00 1.36 H new ATOM 0 HD12 ILE A 354 107.341 -11.270 -2.135 1.00 1.36 H new ATOM 0 HD13 ILE A 354 107.582 -12.948 -1.596 1.00 1.36 H new ATOM 571 N LEU A 355 104.954 -9.777 2.045 1.00 0.63 N ATOM 572 CA LEU A 355 105.127 -9.295 3.448 1.00 0.62 C ATOM 573 C LEU A 355 103.784 -9.311 4.182 1.00 0.55 C ATOM 574 O LEU A 355 103.659 -9.852 5.263 1.00 0.61 O ATOM 575 CB LEU A 355 105.614 -7.858 3.299 1.00 0.64 C ATOM 576 CG LEU A 355 106.320 -7.400 4.582 1.00 0.73 C ATOM 577 CD1 LEU A 355 106.451 -5.876 4.574 1.00 1.14 C ATOM 578 CD2 LEU A 355 105.510 -7.828 5.809 1.00 1.15 C ATOM 0 H LEU A 355 105.394 -9.199 1.328 1.00 0.63 H new ATOM 0 HA LEU A 355 105.816 -9.918 4.018 1.00 0.62 H new ATOM 0 HB2 LEU A 355 106.298 -7.784 2.453 1.00 0.64 H new ATOM 0 HB3 LEU A 355 104.771 -7.201 3.085 1.00 0.64 H new ATOM 0 HG LEU A 355 107.308 -7.858 4.626 1.00 0.73 H new ATOM 0 HD11 LEU A 355 106.952 -5.549 5.485 1.00 1.14 H new ATOM 0 HD12 LEU A 355 107.034 -5.566 3.707 1.00 1.14 H new ATOM 0 HD13 LEU A 355 105.460 -5.426 4.524 1.00 1.14 H new ATOM 0 HD21 LEU A 355 106.019 -7.498 6.714 1.00 1.15 H new ATOM 0 HD22 LEU A 355 104.519 -7.377 5.766 1.00 1.15 H new ATOM 0 HD23 LEU A 355 105.415 -8.914 5.821 1.00 1.15 H new ATOM 590 N ALA A 356 102.760 -8.802 3.565 1.00 0.52 N ATOM 591 CA ALA A 356 101.414 -8.878 4.191 1.00 0.54 C ATOM 592 C ALA A 356 101.024 -10.344 4.370 1.00 0.53 C ATOM 593 O ALA A 356 100.408 -10.725 5.347 1.00 0.57 O ATOM 594 CB ALA A 356 100.480 -8.185 3.199 1.00 0.61 C ATOM 0 H ALA A 356 102.795 -8.338 2.657 1.00 0.52 H new ATOM 0 HA ALA A 356 101.374 -8.408 5.174 1.00 0.54 H new ATOM 0 HB1 ALA A 356 99.462 -8.198 3.588 1.00 0.61 H new ATOM 0 HB2 ALA A 356 100.801 -7.153 3.057 1.00 0.61 H new ATOM 0 HB3 ALA A 356 100.510 -8.709 2.244 1.00 0.61 H new ATOM 600 N LYS A 357 101.364 -11.172 3.426 1.00 0.57 N ATOM 601 CA LYS A 357 100.986 -12.610 3.547 1.00 0.68 C ATOM 602 C LYS A 357 101.624 -13.246 4.789 1.00 0.79 C ATOM 603 O LYS A 357 100.991 -13.983 5.513 1.00 0.93 O ATOM 604 CB LYS A 357 101.521 -13.281 2.289 1.00 0.88 C ATOM 605 CG LYS A 357 101.127 -14.755 2.327 1.00 0.97 C ATOM 606 CD LYS A 357 99.708 -14.919 1.782 1.00 1.16 C ATOM 607 CE LYS A 357 99.347 -16.406 1.738 1.00 0.90 C ATOM 608 NZ LYS A 357 99.680 -16.842 0.353 1.00 1.15 N ATOM 0 H LYS A 357 101.882 -10.922 2.583 1.00 0.57 H new ATOM 0 HA LYS A 357 99.907 -12.725 3.650 1.00 0.68 H new ATOM 0 HB2 LYS A 357 101.112 -12.802 1.400 1.00 0.88 H new ATOM 0 HB3 LYS A 357 102.605 -13.179 2.236 1.00 0.88 H new ATOM 0 HG2 LYS A 357 101.826 -15.344 1.734 1.00 0.97 H new ATOM 0 HG3 LYS A 357 101.181 -15.130 3.349 1.00 0.97 H new ATOM 0 HD2 LYS A 357 99.000 -14.381 2.412 1.00 1.16 H new ATOM 0 HD3 LYS A 357 99.638 -14.487 0.784 1.00 1.16 H new ATOM 0 HE2 LYS A 357 99.914 -16.972 2.477 1.00 0.90 H new ATOM 0 HE3 LYS A 357 98.291 -16.563 1.958 1.00 0.90 H new ATOM 0 HZ1 LYS A 357 99.460 -17.853 0.245 1.00 1.15 H new ATOM 0 HZ2 LYS A 357 99.120 -16.291 -0.329 1.00 1.15 H new ATOM 0 HZ3 LYS A 357 100.693 -16.687 0.174 1.00 1.15 H new ATOM 622 N GLN A 358 102.883 -13.018 5.019 1.00 0.80 N ATOM 623 CA GLN A 358 103.534 -13.672 6.188 1.00 1.01 C ATOM 624 C GLN A 358 102.913 -13.153 7.488 1.00 1.05 C ATOM 625 O GLN A 358 102.757 -13.885 8.445 1.00 1.25 O ATOM 626 CB GLN A 358 105.022 -13.310 6.102 1.00 1.03 C ATOM 627 CG GLN A 358 105.192 -11.799 5.941 1.00 0.99 C ATOM 628 CD GLN A 358 106.658 -11.424 6.169 1.00 1.21 C ATOM 629 OE1 GLN A 358 107.083 -11.243 7.292 1.00 1.62 O ATOM 630 NE2 GLN A 358 107.454 -11.299 5.143 1.00 1.90 N ATOM 0 H GLN A 358 103.485 -12.416 4.458 1.00 0.80 H new ATOM 0 HA GLN A 358 103.398 -14.753 6.180 1.00 1.01 H new ATOM 0 HB2 GLN A 358 105.538 -13.647 7.001 1.00 1.03 H new ATOM 0 HB3 GLN A 358 105.481 -13.826 5.259 1.00 1.03 H new ATOM 0 HG2 GLN A 358 104.877 -11.491 4.944 1.00 0.99 H new ATOM 0 HG3 GLN A 358 104.556 -11.273 6.653 1.00 0.99 H new ATOM 0 HE21 GLN A 358 107.098 -11.451 4.199 1.00 1.90 H new ATOM 0 HE22 GLN A 358 108.433 -11.049 5.284 1.00 1.90 H new ATOM 639 N ARG A 359 102.567 -11.893 7.537 1.00 0.93 N ATOM 640 CA ARG A 359 101.970 -11.339 8.786 1.00 1.10 C ATOM 641 C ARG A 359 100.483 -11.706 8.908 1.00 1.09 C ATOM 642 O ARG A 359 100.031 -12.129 9.954 1.00 1.55 O ATOM 643 CB ARG A 359 102.133 -9.822 8.667 1.00 1.08 C ATOM 644 CG ARG A 359 103.619 -9.462 8.705 1.00 1.26 C ATOM 645 CD ARG A 359 104.212 -9.882 10.051 1.00 1.27 C ATOM 646 NE ARG A 359 105.611 -9.373 10.029 1.00 1.47 N ATOM 647 CZ ARG A 359 106.506 -9.872 10.841 1.00 1.98 C ATOM 648 NH1 ARG A 359 106.179 -10.821 11.679 1.00 2.63 N ATOM 649 NH2 ARG A 359 107.730 -9.422 10.816 1.00 2.38 N ATOM 0 H ARG A 359 102.671 -11.228 6.771 1.00 0.93 H new ATOM 0 HA ARG A 359 102.459 -11.743 9.673 1.00 1.10 H new ATOM 0 HB2 ARG A 359 101.687 -9.470 7.737 1.00 1.08 H new ATOM 0 HB3 ARG A 359 101.607 -9.324 9.482 1.00 1.08 H new ATOM 0 HG2 ARG A 359 104.146 -9.961 7.892 1.00 1.26 H new ATOM 0 HG3 ARG A 359 103.748 -8.390 8.557 1.00 1.26 H new ATOM 0 HD2 ARG A 359 103.649 -9.455 10.881 1.00 1.27 H new ATOM 0 HD3 ARG A 359 104.187 -10.965 10.173 1.00 1.27 H new ATOM 0 HE ARG A 359 105.872 -8.632 9.378 1.00 1.47 H new ATOM 0 HH11 ARG A 359 105.223 -11.175 11.701 1.00 2.63 H new ATOM 0 HH12 ARG A 359 106.880 -11.208 12.311 1.00 2.63 H new ATOM 0 HH21 ARG A 359 107.988 -8.682 10.164 1.00 2.38 H new ATOM 0 HH22 ARG A 359 108.429 -9.810 11.449 1.00 2.38 H new ATOM 663 N PHE A 360 99.710 -11.531 7.865 1.00 0.70 N ATOM 664 CA PHE A 360 98.254 -11.856 7.966 1.00 0.74 C ATOM 665 C PHE A 360 97.894 -12.997 7.019 1.00 0.74 C ATOM 666 O PHE A 360 96.829 -13.576 7.098 1.00 1.09 O ATOM 667 CB PHE A 360 97.527 -10.573 7.561 1.00 0.85 C ATOM 668 CG PHE A 360 97.692 -9.535 8.646 1.00 1.28 C ATOM 669 CD1 PHE A 360 96.875 -9.578 9.784 1.00 1.78 C ATOM 670 CD2 PHE A 360 98.658 -8.527 8.514 1.00 2.03 C ATOM 671 CE1 PHE A 360 97.025 -8.614 10.792 1.00 2.74 C ATOM 672 CE2 PHE A 360 98.807 -7.563 9.522 1.00 3.03 C ATOM 673 CZ PHE A 360 97.990 -7.607 10.660 1.00 3.32 C ATOM 0 H PHE A 360 100.019 -11.181 6.958 1.00 0.70 H new ATOM 0 HA PHE A 360 97.978 -12.181 8.969 1.00 0.74 H new ATOM 0 HB2 PHE A 360 97.928 -10.197 6.620 1.00 0.85 H new ATOM 0 HB3 PHE A 360 96.469 -10.778 7.397 1.00 0.85 H new ATOM 0 HD1 PHE A 360 96.130 -10.353 9.885 1.00 1.78 H new ATOM 0 HD2 PHE A 360 99.287 -8.493 7.637 1.00 2.03 H new ATOM 0 HE1 PHE A 360 96.397 -8.648 11.670 1.00 2.74 H new ATOM 0 HE2 PHE A 360 99.551 -6.787 9.421 1.00 3.03 H new ATOM 0 HZ PHE A 360 98.104 -6.864 11.436 1.00 3.32 H new ATOM 683 N ASN A 361 98.759 -13.294 6.097 1.00 0.72 N ATOM 684 CA ASN A 361 98.458 -14.364 5.105 1.00 0.77 C ATOM 685 C ASN A 361 97.198 -14.012 4.321 1.00 0.91 C ATOM 686 O ASN A 361 96.459 -14.874 3.888 1.00 1.34 O ATOM 687 CB ASN A 361 98.250 -15.622 5.943 1.00 0.79 C ATOM 688 CG ASN A 361 98.389 -16.860 5.055 1.00 1.27 C ATOM 689 OD1 ASN A 361 99.440 -17.109 4.500 1.00 1.68 O ATOM 690 ND2 ASN A 361 97.363 -17.652 4.896 1.00 1.90 N ATOM 0 H ASN A 361 99.666 -12.842 5.984 1.00 0.72 H new ATOM 0 HA ASN A 361 99.254 -14.494 4.371 1.00 0.77 H new ATOM 0 HB2 ASN A 361 98.981 -15.658 6.751 1.00 0.79 H new ATOM 0 HB3 ASN A 361 97.264 -15.603 6.406 1.00 0.79 H new ATOM 0 HD21 ASN A 361 97.444 -18.480 4.306 1.00 1.90 H new ATOM 0 HD22 ASN A 361 96.480 -17.443 5.362 1.00 1.90 H new ATOM 697 N LEU A 362 97.039 -12.761 4.010 1.00 0.88 N ATOM 698 CA LEU A 362 95.931 -12.352 3.103 1.00 1.13 C ATOM 699 C LEU A 362 96.300 -12.693 1.656 1.00 1.12 C ATOM 700 O LEU A 362 97.374 -13.193 1.386 1.00 1.73 O ATOM 701 CB LEU A 362 95.820 -10.839 3.280 1.00 1.68 C ATOM 702 CG LEU A 362 97.190 -10.202 3.038 1.00 2.21 C ATOM 703 CD1 LEU A 362 97.108 -9.251 1.843 1.00 2.65 C ATOM 704 CD2 LEU A 362 97.614 -9.419 4.282 1.00 2.80 C ATOM 0 H LEU A 362 97.629 -11.999 4.344 1.00 0.88 H new ATOM 0 HA LEU A 362 94.993 -12.859 3.329 1.00 1.13 H new ATOM 0 HB2 LEU A 362 95.088 -10.432 2.582 1.00 1.68 H new ATOM 0 HB3 LEU A 362 95.468 -10.603 4.284 1.00 1.68 H new ATOM 0 HG LEU A 362 97.922 -10.983 2.831 1.00 2.21 H new ATOM 0 HD11 LEU A 362 98.084 -8.798 1.671 1.00 2.65 H new ATOM 0 HD12 LEU A 362 96.805 -9.807 0.956 1.00 2.65 H new ATOM 0 HD13 LEU A 362 96.376 -8.470 2.049 1.00 2.65 H new ATOM 0 HD21 LEU A 362 98.590 -8.965 4.111 1.00 2.80 H new ATOM 0 HD22 LEU A 362 96.881 -8.639 4.488 1.00 2.80 H new ATOM 0 HD23 LEU A 362 97.673 -10.095 5.135 1.00 2.80 H new ATOM 716 N ARG A 363 95.451 -12.377 0.716 1.00 1.10 N ATOM 717 CA ARG A 363 95.799 -12.630 -0.710 1.00 1.09 C ATOM 718 C ARG A 363 95.601 -11.371 -1.546 1.00 0.86 C ATOM 719 O ARG A 363 94.763 -10.541 -1.255 1.00 1.03 O ATOM 720 CB ARG A 363 94.848 -13.732 -1.166 1.00 1.21 C ATOM 721 CG ARG A 363 95.352 -15.072 -0.644 1.00 2.11 C ATOM 722 CD ARG A 363 94.381 -16.180 -1.055 1.00 2.74 C ATOM 723 NE ARG A 363 94.550 -16.311 -2.530 1.00 3.36 N ATOM 724 CZ ARG A 363 93.623 -16.885 -3.250 1.00 3.92 C ATOM 725 NH1 ARG A 363 92.540 -17.346 -2.683 1.00 4.21 N ATOM 726 NH2 ARG A 363 93.778 -16.997 -4.540 1.00 4.40 N ATOM 0 H ARG A 363 94.535 -11.956 0.873 1.00 1.10 H new ATOM 0 HA ARG A 363 96.843 -12.919 -0.826 1.00 1.09 H new ATOM 0 HB2 ARG A 363 93.842 -13.538 -0.795 1.00 1.21 H new ATOM 0 HB3 ARG A 363 94.788 -13.751 -2.254 1.00 1.21 H new ATOM 0 HG2 ARG A 363 96.345 -15.279 -1.042 1.00 2.11 H new ATOM 0 HG3 ARG A 363 95.444 -15.040 0.442 1.00 2.11 H new ATOM 0 HD2 ARG A 363 94.612 -17.116 -0.546 1.00 2.74 H new ATOM 0 HD3 ARG A 363 93.354 -15.921 -0.796 1.00 2.74 H new ATOM 0 HE ARG A 363 95.392 -15.951 -2.979 1.00 3.36 H new ATOM 0 HH11 ARG A 363 92.416 -17.259 -1.674 1.00 4.21 H new ATOM 0 HH12 ARG A 363 91.819 -17.793 -3.249 1.00 4.21 H new ATOM 0 HH21 ARG A 363 94.622 -16.637 -4.985 1.00 4.40 H new ATOM 0 HH22 ARG A 363 93.055 -17.445 -5.104 1.00 4.40 H new ATOM 740 N GLU A 364 96.311 -11.268 -2.633 1.00 0.74 N ATOM 741 CA GLU A 364 96.100 -10.112 -3.550 1.00 0.86 C ATOM 742 C GLU A 364 94.626 -10.036 -3.945 1.00 1.02 C ATOM 743 O GLU A 364 93.957 -11.045 -4.055 1.00 0.95 O ATOM 744 CB GLU A 364 96.970 -10.408 -4.771 1.00 0.96 C ATOM 745 CG GLU A 364 96.345 -11.548 -5.578 1.00 1.26 C ATOM 746 CD GLU A 364 97.281 -11.934 -6.725 1.00 1.69 C ATOM 747 OE1 GLU A 364 97.403 -11.151 -7.653 1.00 2.24 O ATOM 748 OE2 GLU A 364 97.861 -13.006 -6.656 1.00 2.21 O ATOM 0 H GLU A 364 97.027 -11.932 -2.927 1.00 0.74 H new ATOM 0 HA GLU A 364 96.363 -9.159 -3.091 1.00 0.86 H new ATOM 0 HB2 GLU A 364 97.061 -9.516 -5.391 1.00 0.96 H new ATOM 0 HB3 GLU A 364 97.977 -10.681 -4.456 1.00 0.96 H new ATOM 0 HG2 GLU A 364 96.168 -12.409 -4.934 1.00 1.26 H new ATOM 0 HG3 GLU A 364 95.377 -11.240 -5.973 1.00 1.26 H new ATOM 755 N ARG A 365 94.098 -8.858 -4.123 1.00 1.36 N ATOM 756 CA ARG A 365 92.653 -8.754 -4.469 1.00 1.73 C ATOM 757 C ARG A 365 92.484 -8.497 -5.966 1.00 1.59 C ATOM 758 O ARG A 365 93.205 -7.719 -6.559 1.00 1.56 O ATOM 759 CB ARG A 365 92.118 -7.585 -3.639 1.00 1.83 C ATOM 760 CG ARG A 365 92.530 -6.265 -4.280 1.00 2.15 C ATOM 761 CD ARG A 365 92.181 -5.113 -3.334 1.00 2.41 C ATOM 762 NE ARG A 365 92.225 -3.886 -4.179 1.00 3.18 N ATOM 763 CZ ARG A 365 91.985 -2.714 -3.646 1.00 3.60 C ATOM 764 NH1 ARG A 365 91.740 -2.611 -2.367 1.00 4.16 N ATOM 765 NH2 ARG A 365 91.993 -1.645 -4.393 1.00 3.72 N ATOM 0 H ARG A 365 94.597 -7.972 -4.045 1.00 1.36 H new ATOM 0 HA ARG A 365 92.109 -9.673 -4.251 1.00 1.73 H new ATOM 0 HB2 ARG A 365 91.032 -7.643 -3.570 1.00 1.83 H new ATOM 0 HB3 ARG A 365 92.505 -7.642 -2.622 1.00 1.83 H new ATOM 0 HG2 ARG A 365 93.600 -6.267 -4.490 1.00 2.15 H new ATOM 0 HG3 ARG A 365 92.019 -6.135 -5.234 1.00 2.15 H new ATOM 0 HD2 ARG A 365 91.194 -5.252 -2.892 1.00 2.41 H new ATOM 0 HD3 ARG A 365 92.893 -5.050 -2.511 1.00 2.41 H new ATOM 0 HE ARG A 365 92.442 -3.959 -5.173 1.00 3.18 H new ATOM 0 HH11 ARG A 365 91.735 -3.445 -1.780 1.00 4.16 H new ATOM 0 HH12 ARG A 365 91.554 -1.697 -1.955 1.00 4.16 H new ATOM 0 HH21 ARG A 365 92.186 -1.722 -5.392 1.00 3.72 H new ATOM 0 HH22 ARG A 365 91.806 -0.732 -3.979 1.00 3.72 H new ATOM 779 N ASP A 366 91.582 -9.200 -6.592 1.00 1.70 N ATOM 780 CA ASP A 366 91.419 -9.055 -8.065 1.00 1.93 C ATOM 781 C ASP A 366 90.834 -7.683 -8.399 1.00 2.04 C ATOM 782 O ASP A 366 89.732 -7.351 -8.006 1.00 2.65 O ATOM 783 CB ASP A 366 90.452 -10.169 -8.461 1.00 2.62 C ATOM 784 CG ASP A 366 91.148 -11.523 -8.325 1.00 2.50 C ATOM 785 OD1 ASP A 366 92.354 -11.530 -8.136 1.00 2.86 O ATOM 786 OD2 ASP A 366 90.465 -12.530 -8.410 1.00 2.50 O ATOM 0 H ASP A 366 90.952 -9.868 -6.148 1.00 1.70 H new ATOM 0 HA ASP A 366 92.366 -9.129 -8.599 1.00 1.93 H new ATOM 0 HB2 ASP A 366 89.566 -10.138 -7.826 1.00 2.62 H new ATOM 0 HB3 ASP A 366 90.114 -10.024 -9.487 1.00 2.62 H new ATOM 791 N VAL A 367 91.562 -6.889 -9.132 1.00 1.75 N ATOM 792 CA VAL A 367 91.054 -5.542 -9.513 1.00 2.31 C ATOM 793 C VAL A 367 89.880 -5.673 -10.493 1.00 2.53 C ATOM 794 O VAL A 367 88.872 -5.009 -10.360 1.00 3.04 O ATOM 795 CB VAL A 367 92.252 -4.860 -10.177 1.00 2.28 C ATOM 796 CG1 VAL A 367 91.811 -3.545 -10.815 1.00 2.89 C ATOM 797 CG2 VAL A 367 93.330 -4.575 -9.126 1.00 2.52 C ATOM 0 H VAL A 367 92.492 -7.116 -9.485 1.00 1.75 H new ATOM 0 HA VAL A 367 90.679 -4.974 -8.661 1.00 2.31 H new ATOM 0 HB VAL A 367 92.655 -5.519 -10.946 1.00 2.28 H new ATOM 0 HG11 VAL A 367 92.668 -3.064 -11.286 1.00 2.89 H new ATOM 0 HG12 VAL A 367 91.047 -3.744 -11.567 1.00 2.89 H new ATOM 0 HG13 VAL A 367 91.402 -2.887 -10.048 1.00 2.89 H new ATOM 0 HG21 VAL A 367 94.182 -4.089 -9.601 1.00 2.52 H new ATOM 0 HG22 VAL A 367 92.923 -3.921 -8.355 1.00 2.52 H new ATOM 0 HG23 VAL A 367 93.653 -5.512 -8.673 1.00 2.52 H new ATOM 807 N GLN A 368 90.008 -6.522 -11.478 1.00 2.20 N ATOM 808 CA GLN A 368 88.905 -6.695 -12.471 1.00 2.40 C ATOM 809 C GLN A 368 87.744 -7.496 -11.876 1.00 2.11 C ATOM 810 O GLN A 368 86.600 -7.264 -12.210 1.00 2.30 O ATOM 811 CB GLN A 368 89.530 -7.430 -13.652 1.00 2.46 C ATOM 812 CG GLN A 368 90.409 -6.451 -14.426 1.00 3.09 C ATOM 813 CD GLN A 368 91.043 -7.163 -15.622 1.00 3.29 C ATOM 814 OE1 GLN A 368 91.061 -8.377 -15.681 1.00 3.32 O ATOM 815 NE2 GLN A 368 91.569 -6.456 -16.585 1.00 3.69 N ATOM 0 H GLN A 368 90.830 -7.104 -11.639 1.00 2.20 H new ATOM 0 HA GLN A 368 88.485 -5.735 -12.772 1.00 2.40 H new ATOM 0 HB2 GLN A 368 90.123 -8.274 -13.301 1.00 2.46 H new ATOM 0 HB3 GLN A 368 88.752 -7.834 -14.300 1.00 2.46 H new ATOM 0 HG2 GLN A 368 89.813 -5.605 -14.768 1.00 3.09 H new ATOM 0 HG3 GLN A 368 91.186 -6.051 -13.774 1.00 3.09 H new ATOM 0 HE21 GLN A 368 91.554 -5.437 -16.536 1.00 3.69 H new ATOM 0 HE22 GLN A 368 91.995 -6.922 -17.386 1.00 3.69 H new ATOM 824 N SER A 369 87.990 -8.214 -10.817 1.00 1.80 N ATOM 825 CA SER A 369 86.840 -8.739 -10.027 1.00 1.87 C ATOM 826 C SER A 369 86.118 -7.566 -9.362 1.00 1.79 C ATOM 827 O SER A 369 84.905 -7.521 -9.303 1.00 2.27 O ATOM 828 CB SER A 369 87.446 -9.676 -8.989 1.00 2.47 C ATOM 829 OG SER A 369 86.405 -10.249 -8.210 1.00 3.05 O ATOM 0 H SER A 369 88.917 -8.457 -10.468 1.00 1.80 H new ATOM 0 HA SER A 369 86.110 -9.267 -10.641 1.00 1.87 H new ATOM 0 HB2 SER A 369 88.021 -10.460 -9.482 1.00 2.47 H new ATOM 0 HB3 SER A 369 88.137 -9.129 -8.348 1.00 2.47 H new ATOM 0 HG SER A 369 86.791 -10.854 -7.542 1.00 3.05 H new ATOM 835 N LEU A 370 86.852 -6.549 -9.004 1.00 1.38 N ATOM 836 CA LEU A 370 86.213 -5.297 -8.508 1.00 1.39 C ATOM 837 C LEU A 370 86.027 -4.311 -9.665 1.00 1.12 C ATOM 838 O LEU A 370 85.610 -3.187 -9.470 1.00 1.30 O ATOM 839 CB LEU A 370 87.202 -4.736 -7.489 1.00 1.54 C ATOM 840 CG LEU A 370 87.524 -5.807 -6.447 1.00 1.39 C ATOM 841 CD1 LEU A 370 88.748 -5.376 -5.638 1.00 1.80 C ATOM 842 CD2 LEU A 370 86.328 -5.976 -5.508 1.00 2.14 C ATOM 0 H LEU A 370 87.871 -6.531 -9.034 1.00 1.38 H new ATOM 0 HA LEU A 370 85.229 -5.474 -8.074 1.00 1.39 H new ATOM 0 HB2 LEU A 370 88.115 -4.416 -7.991 1.00 1.54 H new ATOM 0 HB3 LEU A 370 86.780 -3.856 -7.003 1.00 1.54 H new ATOM 0 HG LEU A 370 87.732 -6.753 -6.947 1.00 1.39 H new ATOM 0 HD11 LEU A 370 88.979 -6.138 -4.894 1.00 1.80 H new ATOM 0 HD12 LEU A 370 89.600 -5.250 -6.306 1.00 1.80 H new ATOM 0 HD13 LEU A 370 88.538 -4.431 -5.136 1.00 1.80 H new ATOM 0 HD21 LEU A 370 86.555 -6.739 -4.764 1.00 2.14 H new ATOM 0 HD22 LEU A 370 86.122 -5.030 -5.007 1.00 2.14 H new ATOM 0 HD23 LEU A 370 85.453 -6.279 -6.084 1.00 2.14 H new ATOM 854 N HIS A 371 86.473 -4.673 -10.840 1.00 1.29 N ATOM 855 CA HIS A 371 86.471 -3.699 -11.968 1.00 1.13 C ATOM 856 C HIS A 371 87.264 -2.465 -11.558 1.00 1.00 C ATOM 857 O HIS A 371 87.016 -1.364 -12.010 1.00 1.35 O ATOM 858 CB HIS A 371 85.009 -3.341 -12.182 1.00 1.54 C ATOM 859 CG HIS A 371 84.213 -4.591 -12.437 1.00 1.50 C ATOM 860 ND1 HIS A 371 83.589 -5.291 -11.416 1.00 1.97 N ATOM 861 CD2 HIS A 371 83.931 -5.280 -13.591 1.00 1.80 C ATOM 862 CE1 HIS A 371 82.969 -6.348 -11.970 1.00 2.10 C ATOM 863 NE2 HIS A 371 83.145 -6.390 -13.294 1.00 1.80 N ATOM 0 H HIS A 371 86.837 -5.599 -11.065 1.00 1.29 H new ATOM 0 HA HIS A 371 86.922 -4.101 -12.875 1.00 1.13 H new ATOM 0 HB2 HIS A 371 84.620 -2.823 -11.306 1.00 1.54 H new ATOM 0 HB3 HIS A 371 84.912 -2.658 -13.026 1.00 1.54 H new ATOM 0 HD2 HIS A 371 84.268 -5.003 -14.579 1.00 1.80 H new ATOM 0 HE1 HIS A 371 82.398 -7.075 -11.412 1.00 2.10 H new ATOM 0 HE2 HIS A 371 82.782 -7.085 -13.946 1.00 1.80 H new ATOM 871 N ALA A 372 88.257 -2.666 -10.752 1.00 0.75 N ATOM 872 CA ALA A 372 89.141 -1.543 -10.344 1.00 0.94 C ATOM 873 C ALA A 372 90.224 -1.313 -11.403 1.00 0.90 C ATOM 874 O ALA A 372 90.132 -1.788 -12.518 1.00 1.04 O ATOM 875 CB ALA A 372 89.763 -1.991 -9.022 1.00 1.12 C ATOM 0 H ALA A 372 88.501 -3.572 -10.351 1.00 0.75 H new ATOM 0 HA ALA A 372 88.598 -0.604 -10.239 1.00 0.94 H new ATOM 0 HB1 ALA A 372 90.432 -1.214 -8.653 1.00 1.12 H new ATOM 0 HB2 ALA A 372 88.975 -2.169 -8.291 1.00 1.12 H new ATOM 0 HB3 ALA A 372 90.327 -2.911 -9.178 1.00 1.12 H new ATOM 881 N THR A 373 91.241 -0.579 -11.058 1.00 0.85 N ATOM 882 CA THR A 373 92.340 -0.292 -12.026 1.00 0.95 C ATOM 883 C THR A 373 93.703 -0.448 -11.349 1.00 0.93 C ATOM 884 O THR A 373 93.899 -0.026 -10.232 1.00 0.95 O ATOM 885 CB THR A 373 92.130 1.162 -12.437 1.00 1.32 C ATOM 886 OG1 THR A 373 90.931 1.278 -13.190 1.00 2.11 O ATOM 887 CG2 THR A 373 93.319 1.639 -13.273 1.00 1.90 C ATOM 0 H THR A 373 91.362 -0.159 -10.136 1.00 0.85 H new ATOM 0 HA THR A 373 92.323 -0.974 -12.876 1.00 0.95 H new ATOM 0 HB THR A 373 92.052 1.781 -11.544 1.00 1.32 H new ATOM 0 HG1 THR A 373 90.798 2.213 -13.451 1.00 2.11 H new ATOM 0 HG21 THR A 373 93.165 2.678 -13.565 1.00 1.90 H new ATOM 0 HG22 THR A 373 94.233 1.559 -12.685 1.00 1.90 H new ATOM 0 HG23 THR A 373 93.407 1.021 -14.166 1.00 1.90 H new ATOM 895 N PHE A 374 94.675 -0.941 -12.058 1.00 1.01 N ATOM 896 CA PHE A 374 96.057 -0.992 -11.494 1.00 1.25 C ATOM 897 C PHE A 374 96.808 0.299 -11.854 1.00 1.63 C ATOM 898 O PHE A 374 96.780 0.743 -12.984 1.00 1.61 O ATOM 899 CB PHE A 374 96.731 -2.184 -12.184 1.00 1.33 C ATOM 900 CG PHE A 374 96.092 -3.488 -11.755 1.00 1.63 C ATOM 901 CD1 PHE A 374 96.427 -4.070 -10.522 1.00 2.53 C ATOM 902 CD2 PHE A 374 95.180 -4.130 -12.606 1.00 1.41 C ATOM 903 CE1 PHE A 374 95.851 -5.290 -10.142 1.00 3.09 C ATOM 904 CE2 PHE A 374 94.602 -5.348 -12.223 1.00 1.89 C ATOM 905 CZ PHE A 374 94.940 -5.928 -10.992 1.00 2.72 C ATOM 0 H PHE A 374 94.577 -1.312 -13.003 1.00 1.01 H new ATOM 0 HA PHE A 374 96.054 -1.091 -10.409 1.00 1.25 H new ATOM 0 HB2 PHE A 374 96.653 -2.075 -13.266 1.00 1.33 H new ATOM 0 HB3 PHE A 374 97.793 -2.197 -11.940 1.00 1.33 H new ATOM 0 HD1 PHE A 374 97.129 -3.577 -9.866 1.00 2.53 H new ATOM 0 HD2 PHE A 374 94.923 -3.686 -13.556 1.00 1.41 H new ATOM 0 HE1 PHE A 374 96.110 -5.738 -9.194 1.00 3.09 H new ATOM 0 HE2 PHE A 374 93.896 -5.840 -12.876 1.00 1.89 H new ATOM 0 HZ PHE A 374 94.497 -6.868 -10.699 1.00 2.72 H new ATOM 915 N VAL A 375 97.555 0.851 -10.935 1.00 2.14 N ATOM 916 CA VAL A 375 98.390 2.043 -11.270 1.00 2.61 C ATOM 917 C VAL A 375 99.868 1.644 -11.342 1.00 2.22 C ATOM 918 O VAL A 375 100.447 1.250 -10.349 1.00 1.65 O ATOM 919 CB VAL A 375 98.163 3.028 -10.124 1.00 3.32 C ATOM 920 CG1 VAL A 375 98.815 4.367 -10.467 1.00 4.00 C ATOM 921 CG2 VAL A 375 96.661 3.231 -9.913 1.00 3.65 C ATOM 0 H VAL A 375 97.624 0.530 -9.969 1.00 2.14 H new ATOM 0 HA VAL A 375 98.123 2.474 -12.235 1.00 2.61 H new ATOM 0 HB VAL A 375 98.606 2.631 -9.211 1.00 3.32 H new ATOM 0 HG11 VAL A 375 98.653 5.070 -9.650 1.00 4.00 H new ATOM 0 HG12 VAL A 375 99.885 4.223 -10.616 1.00 4.00 H new ATOM 0 HG13 VAL A 375 98.372 4.764 -11.380 1.00 4.00 H new ATOM 0 HG21 VAL A 375 96.500 3.934 -9.095 1.00 3.65 H new ATOM 0 HG22 VAL A 375 96.216 3.628 -10.825 1.00 3.65 H new ATOM 0 HG23 VAL A 375 96.196 2.276 -9.668 1.00 3.65 H new ATOM 931 N PRO A 376 100.406 1.693 -12.532 1.00 2.87 N ATOM 932 CA PRO A 376 101.805 1.250 -12.762 1.00 2.67 C ATOM 933 C PRO A 376 102.780 1.989 -11.838 1.00 2.48 C ATOM 934 O PRO A 376 102.547 3.111 -11.434 1.00 3.24 O ATOM 935 CB PRO A 376 102.077 1.600 -14.228 1.00 3.84 C ATOM 936 CG PRO A 376 100.933 2.461 -14.668 1.00 4.63 C ATOM 937 CD PRO A 376 99.771 2.163 -13.762 1.00 4.03 C ATOM 0 HA PRO A 376 101.940 0.189 -12.552 1.00 2.67 H new ATOM 0 HB2 PRO A 376 103.025 2.128 -14.333 1.00 3.84 H new ATOM 0 HB3 PRO A 376 102.144 0.699 -14.838 1.00 3.84 H new ATOM 0 HG2 PRO A 376 101.203 3.516 -14.612 1.00 4.63 H new ATOM 0 HG3 PRO A 376 100.673 2.253 -15.706 1.00 4.63 H new ATOM 0 HD2 PRO A 376 99.162 3.050 -13.585 1.00 4.03 H new ATOM 0 HD3 PRO A 376 99.114 1.405 -14.189 1.00 4.03 H new ATOM 945 N PHE A 377 103.894 1.373 -11.543 1.00 2.13 N ATOM 946 CA PHE A 377 104.929 2.032 -10.689 1.00 3.07 C ATOM 947 C PHE A 377 105.973 2.718 -11.573 1.00 3.61 C ATOM 948 O PHE A 377 106.642 2.085 -12.366 1.00 4.10 O ATOM 949 CB PHE A 377 105.562 0.874 -9.906 1.00 3.15 C ATOM 950 CG PHE A 377 106.678 1.381 -9.013 1.00 3.91 C ATOM 951 CD1 PHE A 377 106.850 2.758 -8.801 1.00 4.01 C ATOM 952 CD2 PHE A 377 107.552 0.467 -8.406 1.00 4.73 C ATOM 953 CE1 PHE A 377 107.890 3.218 -7.984 1.00 4.92 C ATOM 954 CE2 PHE A 377 108.594 0.929 -7.590 1.00 5.70 C ATOM 955 CZ PHE A 377 108.762 2.305 -7.380 1.00 5.79 C ATOM 0 H PHE A 377 104.134 0.434 -11.859 1.00 2.13 H new ATOM 0 HA PHE A 377 104.516 2.799 -10.034 1.00 3.07 H new ATOM 0 HB2 PHE A 377 104.802 0.378 -9.302 1.00 3.15 H new ATOM 0 HB3 PHE A 377 105.953 0.130 -10.600 1.00 3.15 H new ATOM 0 HD1 PHE A 377 106.179 3.464 -9.269 1.00 4.01 H new ATOM 0 HD2 PHE A 377 107.422 -0.593 -8.567 1.00 4.73 H new ATOM 0 HE1 PHE A 377 108.019 4.278 -7.820 1.00 4.92 H new ATOM 0 HE2 PHE A 377 109.267 0.225 -7.123 1.00 5.70 H new ATOM 0 HZ PHE A 377 109.565 2.661 -6.752 1.00 5.79 H new ATOM 965 N THR A 378 106.159 3.997 -11.401 1.00 3.85 N ATOM 966 CA THR A 378 107.209 4.709 -12.183 1.00 4.47 C ATOM 967 C THR A 378 108.329 5.168 -11.250 1.00 4.28 C ATOM 968 O THR A 378 108.086 5.575 -10.131 1.00 3.71 O ATOM 969 CB THR A 378 106.497 5.912 -12.803 1.00 4.59 C ATOM 970 OG1 THR A 378 106.214 6.867 -11.789 1.00 4.26 O ATOM 971 CG2 THR A 378 105.191 5.455 -13.454 1.00 5.29 C ATOM 0 H THR A 378 105.630 4.580 -10.753 1.00 3.85 H new ATOM 0 HA THR A 378 107.664 4.074 -12.943 1.00 4.47 H new ATOM 0 HB THR A 378 107.139 6.364 -13.560 1.00 4.59 H new ATOM 0 HG1 THR A 378 105.759 7.640 -12.185 1.00 4.26 H new ATOM 0 HG21 THR A 378 104.685 6.313 -13.895 1.00 5.29 H new ATOM 0 HG22 THR A 378 105.409 4.723 -14.232 1.00 5.29 H new ATOM 0 HG23 THR A 378 104.547 5.003 -12.700 1.00 5.29 H new ATOM 979 N ALA A 379 109.553 5.068 -11.690 1.00 5.01 N ATOM 980 CA ALA A 379 110.697 5.457 -10.817 1.00 5.10 C ATOM 981 C ALA A 379 110.806 6.981 -10.724 1.00 5.05 C ATOM 982 O ALA A 379 111.291 7.517 -9.747 1.00 5.37 O ATOM 983 CB ALA A 379 111.933 4.874 -11.502 1.00 6.13 C ATOM 0 H ALA A 379 109.811 4.733 -12.618 1.00 5.01 H new ATOM 0 HA ALA A 379 110.579 5.087 -9.798 1.00 5.10 H new ATOM 0 HB1 ALA A 379 112.821 5.118 -10.919 1.00 6.13 H new ATOM 0 HB2 ALA A 379 111.832 3.791 -11.574 1.00 6.13 H new ATOM 0 HB3 ALA A 379 112.028 5.297 -12.502 1.00 6.13 H new ATOM 989 N GLN A 380 110.417 7.681 -11.755 1.00 4.87 N ATOM 990 CA GLN A 380 110.568 9.166 -11.738 1.00 4.93 C ATOM 991 C GLN A 380 109.808 9.755 -10.549 1.00 4.05 C ATOM 992 O GLN A 380 110.351 10.507 -9.765 1.00 3.84 O ATOM 993 CB GLN A 380 109.955 9.640 -13.056 1.00 5.65 C ATOM 994 CG GLN A 380 110.758 9.072 -14.228 1.00 6.07 C ATOM 995 CD GLN A 380 110.210 9.631 -15.541 1.00 7.03 C ATOM 996 OE1 GLN A 380 110.487 10.759 -15.897 1.00 7.74 O ATOM 997 NE2 GLN A 380 109.438 8.883 -16.283 1.00 7.22 N ATOM 0 H GLN A 380 110.004 7.293 -12.603 1.00 4.87 H new ATOM 0 HA GLN A 380 111.608 9.478 -11.638 1.00 4.93 H new ATOM 0 HB2 GLN A 380 108.916 9.317 -13.123 1.00 5.65 H new ATOM 0 HB3 GLN A 380 109.953 10.729 -13.097 1.00 5.65 H new ATOM 0 HG2 GLN A 380 111.811 9.332 -14.121 1.00 6.07 H new ATOM 0 HG3 GLN A 380 110.697 7.984 -14.230 1.00 6.07 H new ATOM 0 HE21 GLN A 380 109.205 7.936 -15.984 1.00 7.22 H new ATOM 0 HE22 GLN A 380 109.068 9.246 -17.161 1.00 7.22 H new ATOM 1006 N SER A 381 108.597 9.321 -10.341 1.00 3.64 N ATOM 1007 CA SER A 381 107.851 9.749 -9.124 1.00 3.06 C ATOM 1008 C SER A 381 108.095 8.750 -7.994 1.00 2.42 C ATOM 1009 O SER A 381 107.757 8.992 -6.853 1.00 3.00 O ATOM 1010 CB SER A 381 106.381 9.742 -9.539 1.00 3.49 C ATOM 1011 OG SER A 381 106.195 10.652 -10.616 1.00 3.82 O ATOM 0 H SER A 381 108.091 8.688 -10.961 1.00 3.64 H new ATOM 0 HA SER A 381 108.164 10.729 -8.763 1.00 3.06 H new ATOM 0 HB2 SER A 381 106.080 8.738 -9.839 1.00 3.49 H new ATOM 0 HB3 SER A 381 105.751 10.025 -8.695 1.00 3.49 H new ATOM 0 HG SER A 381 105.253 10.650 -10.887 1.00 3.82 H new ATOM 1017 N ARG A 382 108.659 7.616 -8.310 1.00 1.65 N ATOM 1018 CA ARG A 382 108.895 6.585 -7.262 1.00 1.74 C ATOM 1019 C ARG A 382 107.570 6.219 -6.593 1.00 1.57 C ATOM 1020 O ARG A 382 107.445 6.268 -5.385 1.00 2.08 O ATOM 1021 CB ARG A 382 109.832 7.251 -6.253 1.00 2.53 C ATOM 1022 CG ARG A 382 111.081 7.758 -6.973 1.00 2.69 C ATOM 1023 CD ARG A 382 112.096 8.262 -5.943 1.00 2.89 C ATOM 1024 NE ARG A 382 113.164 8.919 -6.747 1.00 3.36 N ATOM 1025 CZ ARG A 382 114.025 8.197 -7.412 1.00 3.67 C ATOM 1026 NH1 ARG A 382 113.956 6.893 -7.380 1.00 3.72 N ATOM 1027 NH2 ARG A 382 114.959 8.780 -8.113 1.00 4.25 N ATOM 0 H ARG A 382 108.966 7.360 -9.248 1.00 1.65 H new ATOM 0 HA ARG A 382 109.321 5.668 -7.668 1.00 1.74 H new ATOM 0 HB2 ARG A 382 109.323 8.079 -5.760 1.00 2.53 H new ATOM 0 HB3 ARG A 382 110.111 6.540 -5.476 1.00 2.53 H new ATOM 0 HG2 ARG A 382 111.519 6.958 -7.570 1.00 2.69 H new ATOM 0 HG3 ARG A 382 110.816 8.561 -7.661 1.00 2.69 H new ATOM 0 HD2 ARG A 382 111.637 8.964 -5.247 1.00 2.89 H new ATOM 0 HD3 ARG A 382 112.497 7.441 -5.349 1.00 2.89 H new ATOM 0 HE ARG A 382 113.223 9.937 -6.778 1.00 3.36 H new ATOM 0 HH11 ARG A 382 113.227 6.434 -6.834 1.00 3.72 H new ATOM 0 HH12 ARG A 382 114.631 6.334 -7.901 1.00 3.72 H new ATOM 0 HH21 ARG A 382 115.015 9.798 -8.141 1.00 4.25 H new ATOM 0 HH22 ARG A 382 115.632 8.218 -8.633 1.00 4.25 H new ATOM 1041 N MET A 383 106.574 5.865 -7.360 1.00 1.27 N ATOM 1042 CA MET A 383 105.268 5.521 -6.739 1.00 1.19 C ATOM 1043 C MET A 383 104.496 4.519 -7.591 1.00 1.07 C ATOM 1044 O MET A 383 104.479 4.588 -8.804 1.00 1.14 O ATOM 1045 CB MET A 383 104.494 6.835 -6.644 1.00 1.32 C ATOM 1046 CG MET A 383 105.135 7.734 -5.588 1.00 1.51 C ATOM 1047 SD MET A 383 103.997 9.076 -5.166 1.00 2.09 S ATOM 1048 CE MET A 383 103.659 9.625 -6.855 1.00 1.57 C ATOM 0 H MET A 383 106.609 5.800 -8.377 1.00 1.27 H new ATOM 0 HA MET A 383 105.411 5.057 -5.763 1.00 1.19 H new ATOM 0 HB2 MET A 383 104.492 7.338 -7.611 1.00 1.32 H new ATOM 0 HB3 MET A 383 103.454 6.638 -6.385 1.00 1.32 H new ATOM 0 HG2 MET A 383 105.375 7.153 -4.698 1.00 1.51 H new ATOM 0 HG3 MET A 383 106.073 8.143 -5.964 1.00 1.51 H new ATOM 0 HE1 MET A 383 102.588 9.789 -6.977 1.00 1.57 H new ATOM 0 HE2 MET A 383 104.193 10.555 -7.049 1.00 1.57 H new ATOM 0 HE3 MET A 383 103.992 8.862 -7.559 1.00 1.57 H new ATOM 1058 N SER A 384 103.718 3.714 -6.938 1.00 0.97 N ATOM 1059 CA SER A 384 102.760 2.827 -7.641 1.00 1.02 C ATOM 1060 C SER A 384 101.503 2.737 -6.786 1.00 0.93 C ATOM 1061 O SER A 384 101.500 3.160 -5.651 1.00 0.83 O ATOM 1062 CB SER A 384 103.461 1.474 -7.721 1.00 1.23 C ATOM 1063 OG SER A 384 103.344 0.809 -6.470 1.00 1.18 O ATOM 0 H SER A 384 103.705 3.631 -5.921 1.00 0.97 H new ATOM 0 HA SER A 384 102.477 3.178 -8.633 1.00 1.02 H new ATOM 0 HB2 SER A 384 103.017 0.868 -8.511 1.00 1.23 H new ATOM 0 HB3 SER A 384 104.512 1.611 -7.976 1.00 1.23 H new ATOM 0 HG SER A 384 104.214 0.438 -6.214 1.00 1.18 H new ATOM 1069 N GLY A 385 100.418 2.269 -7.316 1.00 1.02 N ATOM 1070 CA GLY A 385 99.173 2.264 -6.504 1.00 1.00 C ATOM 1071 C GLY A 385 98.073 1.521 -7.237 1.00 0.95 C ATOM 1072 O GLY A 385 98.301 0.809 -8.192 1.00 1.13 O ATOM 0 H GLY A 385 100.334 1.894 -8.261 1.00 1.02 H new ATOM 0 HA2 GLY A 385 99.361 1.792 -5.540 1.00 1.00 H new ATOM 0 HA3 GLY A 385 98.858 3.288 -6.302 1.00 1.00 H new ATOM 1076 N ILE A 386 96.879 1.678 -6.773 1.00 0.80 N ATOM 1077 CA ILE A 386 95.730 0.987 -7.397 1.00 0.78 C ATOM 1078 C ILE A 386 94.477 1.825 -7.190 1.00 0.77 C ATOM 1079 O ILE A 386 94.330 2.499 -6.193 1.00 0.80 O ATOM 1080 CB ILE A 386 95.636 -0.338 -6.652 1.00 0.81 C ATOM 1081 CG1 ILE A 386 94.309 -1.017 -6.961 1.00 0.86 C ATOM 1082 CG2 ILE A 386 95.727 -0.097 -5.146 1.00 0.84 C ATOM 1083 CD1 ILE A 386 94.275 -2.338 -6.207 1.00 1.26 C ATOM 0 H ILE A 386 96.643 2.266 -5.973 1.00 0.80 H new ATOM 0 HA ILE A 386 95.841 0.835 -8.471 1.00 0.78 H new ATOM 0 HB ILE A 386 96.459 -0.976 -6.974 1.00 0.81 H new ATOM 0 HG12 ILE A 386 93.476 -0.383 -6.658 1.00 0.86 H new ATOM 0 HG13 ILE A 386 94.207 -1.186 -8.033 1.00 0.86 H new ATOM 0 HG21 ILE A 386 95.659 -1.049 -4.620 1.00 0.84 H new ATOM 0 HG22 ILE A 386 96.678 0.380 -4.911 1.00 0.84 H new ATOM 0 HG23 ILE A 386 94.909 0.550 -4.831 1.00 0.84 H new ATOM 0 HD11 ILE A 386 93.333 -2.848 -6.410 1.00 1.26 H new ATOM 0 HD12 ILE A 386 95.105 -2.965 -6.533 1.00 1.26 H new ATOM 0 HD13 ILE A 386 94.362 -2.149 -5.137 1.00 1.26 H new ATOM 1095 N ASN A 387 93.554 1.753 -8.090 1.00 0.78 N ATOM 1096 CA ASN A 387 92.286 2.504 -7.910 1.00 0.83 C ATOM 1097 C ASN A 387 91.130 1.516 -7.918 1.00 0.92 C ATOM 1098 O ASN A 387 91.130 0.573 -8.674 1.00 0.86 O ATOM 1099 CB ASN A 387 92.188 3.442 -9.117 1.00 0.91 C ATOM 1100 CG ASN A 387 93.552 4.074 -9.395 1.00 1.31 C ATOM 1101 OD1 ASN A 387 93.891 4.340 -10.531 1.00 2.04 O ATOM 1102 ND2 ASN A 387 94.353 4.325 -8.401 1.00 1.81 N ATOM 0 H ASN A 387 93.618 1.206 -8.948 1.00 0.78 H new ATOM 0 HA ASN A 387 92.255 3.060 -6.973 1.00 0.83 H new ATOM 0 HB2 ASN A 387 91.848 2.888 -9.992 1.00 0.91 H new ATOM 0 HB3 ASN A 387 91.449 4.220 -8.925 1.00 0.91 H new ATOM 0 HD21 ASN A 387 95.266 4.745 -8.575 1.00 1.81 H new ATOM 0 HD22 ASN A 387 94.068 4.102 -7.447 1.00 1.81 H new ATOM 1109 N ILE A 388 90.120 1.740 -7.144 1.00 1.18 N ATOM 1110 CA ILE A 388 88.959 0.816 -7.205 1.00 1.31 C ATOM 1111 C ILE A 388 87.661 1.580 -6.975 1.00 1.70 C ATOM 1112 O ILE A 388 87.670 2.750 -6.650 1.00 1.89 O ATOM 1113 CB ILE A 388 89.202 -0.204 -6.101 1.00 1.24 C ATOM 1114 CG1 ILE A 388 88.048 -1.204 -6.067 1.00 1.66 C ATOM 1115 CG2 ILE A 388 89.291 0.521 -4.764 1.00 1.50 C ATOM 1116 CD1 ILE A 388 88.554 -2.537 -5.520 1.00 2.11 C ATOM 0 H ILE A 388 90.042 2.509 -6.479 1.00 1.18 H new ATOM 0 HA ILE A 388 88.864 0.335 -8.178 1.00 1.31 H new ATOM 0 HB ILE A 388 90.133 -0.738 -6.291 1.00 1.24 H new ATOM 0 HG12 ILE A 388 87.240 -0.824 -5.442 1.00 1.66 H new ATOM 0 HG13 ILE A 388 87.639 -1.340 -7.068 1.00 1.66 H new ATOM 0 HG21 ILE A 388 89.465 -0.203 -3.968 1.00 1.50 H new ATOM 0 HG22 ILE A 388 90.114 1.235 -4.791 1.00 1.50 H new ATOM 0 HG23 ILE A 388 88.357 1.051 -4.575 1.00 1.50 H new ATOM 0 HD11 ILE A 388 87.734 -3.254 -5.494 1.00 2.11 H new ATOM 0 HD12 ILE A 388 89.348 -2.917 -6.164 1.00 2.11 H new ATOM 0 HD13 ILE A 388 88.942 -2.393 -4.512 1.00 2.11 H new ATOM 1128 N ASP A 389 86.555 0.971 -7.294 1.00 1.97 N ATOM 1129 CA ASP A 389 85.257 1.706 -7.285 1.00 2.37 C ATOM 1130 C ASP A 389 84.844 2.211 -5.887 1.00 2.14 C ATOM 1131 O ASP A 389 83.786 2.788 -5.735 1.00 2.92 O ATOM 1132 CB ASP A 389 84.256 0.664 -7.771 1.00 2.65 C ATOM 1133 CG ASP A 389 84.468 0.406 -9.264 1.00 3.31 C ATOM 1134 OD1 ASP A 389 85.226 1.145 -9.870 1.00 3.85 O ATOM 1135 OD2 ASP A 389 83.868 -0.525 -9.775 1.00 3.63 O ATOM 0 H ASP A 389 86.492 -0.011 -7.563 1.00 1.97 H new ATOM 0 HA ASP A 389 85.314 2.604 -7.900 1.00 2.37 H new ATOM 0 HB2 ASP A 389 84.379 -0.263 -7.210 1.00 2.65 H new ATOM 0 HB3 ASP A 389 83.238 1.012 -7.593 1.00 2.65 H new ATOM 1140 N ASN A 390 85.685 2.111 -4.891 1.00 1.20 N ATOM 1141 CA ASN A 390 85.330 2.713 -3.573 1.00 1.12 C ATOM 1142 C ASN A 390 86.573 3.254 -2.848 1.00 0.97 C ATOM 1143 O ASN A 390 86.506 3.613 -1.689 1.00 1.15 O ATOM 1144 CB ASN A 390 84.707 1.566 -2.774 1.00 1.13 C ATOM 1145 CG ASN A 390 83.952 2.134 -1.571 1.00 1.53 C ATOM 1146 OD1 ASN A 390 83.927 3.331 -1.364 1.00 2.33 O ATOM 1147 ND2 ASN A 390 83.330 1.320 -0.763 1.00 1.89 N ATOM 0 H ASN A 390 86.591 1.645 -4.932 1.00 1.20 H new ATOM 0 HA ASN A 390 84.654 3.560 -3.690 1.00 1.12 H new ATOM 0 HB2 ASN A 390 84.028 0.995 -3.407 1.00 1.13 H new ATOM 0 HB3 ASN A 390 85.483 0.879 -2.438 1.00 1.13 H new ATOM 0 HD21 ASN A 390 82.823 1.689 0.042 1.00 1.89 H new ATOM 0 HD22 ASN A 390 83.351 0.315 -0.936 1.00 1.89 H new ATOM 1154 N ARG A 391 87.729 3.202 -3.462 1.00 0.83 N ATOM 1155 CA ARG A 391 88.969 3.584 -2.727 1.00 0.73 C ATOM 1156 C ARG A 391 90.080 3.990 -3.698 1.00 0.74 C ATOM 1157 O ARG A 391 90.172 3.472 -4.790 1.00 1.10 O ATOM 1158 CB ARG A 391 89.383 2.327 -1.958 1.00 0.94 C ATOM 1159 CG ARG A 391 88.356 2.026 -0.862 1.00 1.05 C ATOM 1160 CD ARG A 391 88.876 0.897 0.032 1.00 1.30 C ATOM 1161 NE ARG A 391 89.066 -0.264 -0.883 1.00 1.92 N ATOM 1162 CZ ARG A 391 89.339 -1.446 -0.395 1.00 2.13 C ATOM 1163 NH1 ARG A 391 89.451 -1.617 0.896 1.00 2.15 N ATOM 1164 NH2 ARG A 391 89.500 -2.459 -1.201 1.00 2.69 N ATOM 0 H ARG A 391 87.865 2.914 -4.431 1.00 0.83 H new ATOM 0 HA ARG A 391 88.796 4.437 -2.071 1.00 0.73 H new ATOM 0 HB2 ARG A 391 89.458 1.481 -2.641 1.00 0.94 H new ATOM 0 HB3 ARG A 391 90.369 2.469 -1.516 1.00 0.94 H new ATOM 0 HG2 ARG A 391 88.172 2.920 -0.266 1.00 1.05 H new ATOM 0 HG3 ARG A 391 87.404 1.740 -1.310 1.00 1.05 H new ATOM 0 HD2 ARG A 391 89.812 1.176 0.515 1.00 1.30 H new ATOM 0 HD3 ARG A 391 88.166 0.662 0.825 1.00 1.30 H new ATOM 0 HE ARG A 391 88.983 -0.136 -1.892 1.00 1.92 H new ATOM 0 HH11 ARG A 391 89.325 -0.826 1.528 1.00 2.15 H new ATOM 0 HH12 ARG A 391 89.664 -2.541 1.271 1.00 2.15 H new ATOM 0 HH21 ARG A 391 89.413 -2.328 -2.209 1.00 2.69 H new ATOM 0 HH22 ARG A 391 89.713 -3.382 -0.823 1.00 2.69 H new ATOM 1178 N MET A 392 91.051 4.713 -3.214 1.00 0.48 N ATOM 1179 CA MET A 392 92.297 4.906 -4.010 1.00 0.51 C ATOM 1180 C MET A 392 93.511 4.590 -3.129 1.00 0.48 C ATOM 1181 O MET A 392 93.539 4.931 -1.963 1.00 0.52 O ATOM 1182 CB MET A 392 92.289 6.380 -4.420 1.00 0.59 C ATOM 1183 CG MET A 392 91.079 6.654 -5.316 1.00 1.14 C ATOM 1184 SD MET A 392 91.142 8.364 -5.905 1.00 1.31 S ATOM 1185 CE MET A 392 89.550 8.366 -6.764 1.00 2.02 C ATOM 0 H MET A 392 91.037 5.177 -2.306 1.00 0.48 H new ATOM 0 HA MET A 392 92.348 4.254 -4.882 1.00 0.51 H new ATOM 0 HB2 MET A 392 92.250 7.015 -3.535 1.00 0.59 H new ATOM 0 HB3 MET A 392 93.210 6.626 -4.949 1.00 0.59 H new ATOM 0 HG2 MET A 392 91.076 5.966 -6.162 1.00 1.14 H new ATOM 0 HG3 MET A 392 90.156 6.482 -4.762 1.00 1.14 H new ATOM 0 HE1 MET A 392 89.380 9.345 -7.212 1.00 2.02 H new ATOM 0 HE2 MET A 392 89.557 7.605 -7.545 1.00 2.02 H new ATOM 0 HE3 MET A 392 88.753 8.149 -6.053 1.00 2.02 H new ATOM 1195 N ILE A 393 94.516 3.951 -3.664 1.00 0.45 N ATOM 1196 CA ILE A 393 95.714 3.637 -2.833 1.00 0.45 C ATOM 1197 C ILE A 393 96.987 4.076 -3.556 1.00 0.50 C ATOM 1198 O ILE A 393 97.141 3.857 -4.739 1.00 0.60 O ATOM 1199 CB ILE A 393 95.689 2.118 -2.655 1.00 0.43 C ATOM 1200 CG1 ILE A 393 94.327 1.692 -2.101 1.00 1.21 C ATOM 1201 CG2 ILE A 393 96.794 1.704 -1.682 1.00 0.98 C ATOM 1202 CD1 ILE A 393 94.138 2.269 -0.696 1.00 1.68 C ATOM 0 H ILE A 393 94.560 3.635 -4.633 1.00 0.45 H new ATOM 0 HA ILE A 393 95.700 4.156 -1.875 1.00 0.45 H new ATOM 0 HB ILE A 393 95.854 1.633 -3.617 1.00 0.43 H new ATOM 0 HG12 ILE A 393 93.531 2.042 -2.758 1.00 1.21 H new ATOM 0 HG13 ILE A 393 94.260 0.604 -2.070 1.00 1.21 H new ATOM 0 HG21 ILE A 393 96.779 0.622 -1.553 1.00 0.98 H new ATOM 0 HG22 ILE A 393 97.762 2.008 -2.080 1.00 0.98 H new ATOM 0 HG23 ILE A 393 96.630 2.186 -0.718 1.00 0.98 H new ATOM 0 HD11 ILE A 393 93.167 1.964 -0.305 1.00 1.68 H new ATOM 0 HD12 ILE A 393 94.926 1.898 -0.041 1.00 1.68 H new ATOM 0 HD13 ILE A 393 94.185 3.357 -0.740 1.00 1.68 H new ATOM 1214 N ARG A 394 97.933 4.621 -2.840 1.00 0.63 N ATOM 1215 CA ARG A 394 99.231 4.987 -3.479 1.00 0.72 C ATOM 1216 C ARG A 394 100.397 4.699 -2.527 1.00 0.60 C ATOM 1217 O ARG A 394 100.295 4.879 -1.333 1.00 0.54 O ATOM 1218 CB ARG A 394 99.126 6.484 -3.768 1.00 0.78 C ATOM 1219 CG ARG A 394 98.029 6.728 -4.806 1.00 1.27 C ATOM 1220 CD ARG A 394 98.471 6.163 -6.158 1.00 1.04 C ATOM 1221 NE ARG A 394 99.626 7.009 -6.567 1.00 1.47 N ATOM 1222 CZ ARG A 394 99.996 7.057 -7.820 1.00 1.92 C ATOM 1223 NH1 ARG A 394 99.354 6.366 -8.723 1.00 2.78 N ATOM 1224 NH2 ARG A 394 101.009 7.800 -8.171 1.00 2.09 N ATOM 0 H ARG A 394 97.864 4.828 -1.844 1.00 0.63 H new ATOM 0 HA ARG A 394 99.418 4.411 -4.385 1.00 0.72 H new ATOM 0 HB2 ARG A 394 98.900 7.027 -2.850 1.00 0.78 H new ATOM 0 HB3 ARG A 394 100.080 6.862 -4.136 1.00 0.78 H new ATOM 0 HG2 ARG A 394 97.100 6.254 -4.488 1.00 1.27 H new ATOM 0 HG3 ARG A 394 97.828 7.796 -4.894 1.00 1.27 H new ATOM 0 HD2 ARG A 394 98.759 5.115 -6.073 1.00 1.04 H new ATOM 0 HD3 ARG A 394 97.665 6.214 -6.890 1.00 1.04 H new ATOM 0 HE ARG A 394 100.130 7.553 -5.867 1.00 1.47 H new ATOM 0 HH11 ARG A 394 98.560 5.786 -8.452 1.00 2.78 H new ATOM 0 HH12 ARG A 394 99.646 6.407 -9.699 1.00 2.78 H new ATOM 0 HH21 ARG A 394 101.511 8.342 -7.468 1.00 2.09 H new ATOM 0 HH22 ARG A 394 101.299 7.838 -9.148 1.00 2.09 H new ATOM 1238 N LYS A 395 101.501 4.255 -3.056 1.00 0.63 N ATOM 1239 CA LYS A 395 102.686 3.951 -2.201 1.00 0.58 C ATOM 1240 C LYS A 395 103.969 4.280 -2.967 1.00 0.60 C ATOM 1241 O LYS A 395 104.049 4.081 -4.159 1.00 0.68 O ATOM 1242 CB LYS A 395 102.602 2.449 -1.938 1.00 0.72 C ATOM 1243 CG LYS A 395 103.570 2.063 -0.821 1.00 0.80 C ATOM 1244 CD LYS A 395 104.908 1.661 -1.435 1.00 1.11 C ATOM 1245 CE LYS A 395 104.698 0.458 -2.355 1.00 1.15 C ATOM 1246 NZ LYS A 395 106.010 -0.240 -2.365 1.00 1.57 N ATOM 0 H LYS A 395 101.637 4.087 -4.053 1.00 0.63 H new ATOM 0 HA LYS A 395 102.697 4.530 -1.277 1.00 0.58 H new ATOM 0 HB2 LYS A 395 101.584 2.176 -1.660 1.00 0.72 H new ATOM 0 HB3 LYS A 395 102.843 1.898 -2.847 1.00 0.72 H new ATOM 0 HG2 LYS A 395 103.707 2.900 -0.136 1.00 0.80 H new ATOM 0 HG3 LYS A 395 103.161 1.238 -0.238 1.00 0.80 H new ATOM 0 HD2 LYS A 395 105.329 2.495 -1.997 1.00 1.11 H new ATOM 0 HD3 LYS A 395 105.622 1.413 -0.650 1.00 1.11 H new ATOM 0 HE2 LYS A 395 103.906 -0.192 -1.983 1.00 1.15 H new ATOM 0 HE3 LYS A 395 104.408 0.772 -3.358 1.00 1.15 H new ATOM 0 HZ1 LYS A 395 105.942 -1.099 -2.948 1.00 1.57 H new ATOM 0 HZ2 LYS A 395 106.736 0.391 -2.761 1.00 1.57 H new ATOM 0 HZ3 LYS A 395 106.272 -0.501 -1.393 1.00 1.57 H new ATOM 1260 N GLY A 396 104.986 4.742 -2.298 1.00 0.56 N ATOM 1261 CA GLY A 396 106.265 5.027 -3.017 1.00 0.60 C ATOM 1262 C GLY A 396 107.261 5.714 -2.084 1.00 0.55 C ATOM 1263 O GLY A 396 107.329 5.419 -0.909 1.00 0.82 O ATOM 0 H GLY A 396 104.992 4.934 -1.296 1.00 0.56 H new ATOM 0 HA2 GLY A 396 106.692 4.098 -3.394 1.00 0.60 H new ATOM 0 HA3 GLY A 396 106.070 5.662 -3.881 1.00 0.60 H new ATOM 1267 N SER A 397 108.091 6.572 -2.622 1.00 0.50 N ATOM 1268 CA SER A 397 109.153 7.205 -1.790 1.00 0.60 C ATOM 1269 C SER A 397 108.552 8.225 -0.820 1.00 0.48 C ATOM 1270 O SER A 397 107.449 8.700 -1.001 1.00 0.61 O ATOM 1271 CB SER A 397 110.110 7.876 -2.779 1.00 0.91 C ATOM 1272 OG SER A 397 110.793 6.875 -3.520 1.00 1.17 O ATOM 0 H SER A 397 108.077 6.860 -3.600 1.00 0.50 H new ATOM 0 HA SER A 397 109.672 6.471 -1.174 1.00 0.60 H new ATOM 0 HB2 SER A 397 109.556 8.530 -3.453 1.00 0.91 H new ATOM 0 HB3 SER A 397 110.825 8.501 -2.244 1.00 0.91 H new ATOM 0 HG SER A 397 111.758 6.960 -3.372 1.00 1.17 H new ATOM 1278 N VAL A 398 109.239 8.495 0.257 1.00 0.53 N ATOM 1279 CA VAL A 398 108.675 9.403 1.294 1.00 0.47 C ATOM 1280 C VAL A 398 108.423 10.788 0.702 1.00 0.51 C ATOM 1281 O VAL A 398 107.321 11.291 0.735 1.00 0.51 O ATOM 1282 CB VAL A 398 109.744 9.475 2.380 1.00 0.46 C ATOM 1283 CG1 VAL A 398 109.278 10.415 3.492 1.00 0.50 C ATOM 1284 CG2 VAL A 398 109.974 8.078 2.955 1.00 0.51 C ATOM 0 H VAL A 398 110.167 8.125 0.463 1.00 0.53 H new ATOM 0 HA VAL A 398 107.722 9.044 1.682 1.00 0.47 H new ATOM 0 HB VAL A 398 110.674 9.852 1.954 1.00 0.46 H new ATOM 0 HG11 VAL A 398 110.041 10.467 4.268 1.00 0.50 H new ATOM 0 HG12 VAL A 398 109.111 11.410 3.081 1.00 0.50 H new ATOM 0 HG13 VAL A 398 108.349 10.039 3.921 1.00 0.50 H new ATOM 0 HG21 VAL A 398 110.737 8.125 3.732 1.00 0.51 H new ATOM 0 HG22 VAL A 398 109.044 7.703 3.383 1.00 0.51 H new ATOM 0 HG23 VAL A 398 110.305 7.408 2.161 1.00 0.51 H new ATOM 1294 N ASP A 399 109.394 11.343 0.036 1.00 0.55 N ATOM 1295 CA ASP A 399 109.146 12.615 -0.691 1.00 0.62 C ATOM 1296 C ASP A 399 108.056 12.383 -1.736 1.00 0.64 C ATOM 1297 O ASP A 399 107.229 13.233 -1.996 1.00 0.64 O ATOM 1298 CB ASP A 399 110.474 12.957 -1.364 1.00 0.71 C ATOM 1299 CG ASP A 399 111.518 13.288 -0.296 1.00 1.10 C ATOM 1300 OD1 ASP A 399 111.129 13.471 0.847 1.00 1.59 O ATOM 1301 OD2 ASP A 399 112.688 13.352 -0.637 1.00 1.46 O ATOM 0 H ASP A 399 110.342 10.974 -0.036 1.00 0.55 H new ATOM 0 HA ASP A 399 108.814 13.422 -0.037 1.00 0.62 H new ATOM 0 HB2 ASP A 399 110.813 12.117 -1.971 1.00 0.71 H new ATOM 0 HB3 ASP A 399 110.345 13.805 -2.037 1.00 0.71 H new ATOM 1306 N ALA A 400 108.056 11.225 -2.332 1.00 0.70 N ATOM 1307 CA ALA A 400 107.034 10.911 -3.364 1.00 0.76 C ATOM 1308 C ALA A 400 105.626 10.898 -2.755 1.00 0.72 C ATOM 1309 O ALA A 400 104.707 11.475 -3.293 1.00 0.75 O ATOM 1310 CB ALA A 400 107.420 9.520 -3.870 1.00 0.85 C ATOM 0 H ALA A 400 108.725 10.478 -2.146 1.00 0.70 H new ATOM 0 HA ALA A 400 107.011 11.653 -4.162 1.00 0.76 H new ATOM 0 HB1 ALA A 400 106.716 9.205 -4.640 1.00 0.85 H new ATOM 0 HB2 ALA A 400 108.426 9.551 -4.289 1.00 0.85 H new ATOM 0 HB3 ALA A 400 107.394 8.811 -3.042 1.00 0.85 H new ATOM 1316 N ILE A 401 105.431 10.244 -1.645 1.00 0.67 N ATOM 1317 CA ILE A 401 104.062 10.218 -1.053 1.00 0.66 C ATOM 1318 C ILE A 401 103.674 11.602 -0.525 1.00 0.59 C ATOM 1319 O ILE A 401 102.534 12.009 -0.613 1.00 0.64 O ATOM 1320 CB ILE A 401 104.133 9.201 0.084 1.00 0.64 C ATOM 1321 CG1 ILE A 401 104.510 7.829 -0.482 1.00 0.81 C ATOM 1322 CG2 ILE A 401 102.773 9.112 0.776 1.00 0.68 C ATOM 1323 CD1 ILE A 401 103.644 7.521 -1.705 1.00 0.62 C ATOM 0 H ILE A 401 106.146 9.733 -1.128 1.00 0.67 H new ATOM 0 HA ILE A 401 103.306 9.946 -1.790 1.00 0.66 H new ATOM 0 HB ILE A 401 104.886 9.516 0.806 1.00 0.64 H new ATOM 0 HG12 ILE A 401 105.564 7.816 -0.758 1.00 0.81 H new ATOM 0 HG13 ILE A 401 104.370 7.060 0.278 1.00 0.81 H new ATOM 0 HG21 ILE A 401 102.824 8.386 1.587 1.00 0.68 H new ATOM 0 HG22 ILE A 401 102.505 10.089 1.179 1.00 0.68 H new ATOM 0 HG23 ILE A 401 102.018 8.798 0.055 1.00 0.68 H new ATOM 0 HD11 ILE A 401 103.915 6.544 -2.106 1.00 0.62 H new ATOM 0 HD12 ILE A 401 102.593 7.516 -1.415 1.00 0.62 H new ATOM 0 HD13 ILE A 401 103.806 8.283 -2.467 1.00 0.62 H new ATOM 1335 N ARG A 402 104.608 12.336 0.002 1.00 0.50 N ATOM 1336 CA ARG A 402 104.280 13.698 0.510 1.00 0.47 C ATOM 1337 C ARG A 402 103.769 14.570 -0.636 1.00 0.54 C ATOM 1338 O ARG A 402 102.811 15.301 -0.494 1.00 0.62 O ATOM 1339 CB ARG A 402 105.596 14.246 1.060 1.00 0.44 C ATOM 1340 CG ARG A 402 105.346 15.603 1.721 1.00 1.17 C ATOM 1341 CD ARG A 402 106.666 16.161 2.257 1.00 1.24 C ATOM 1342 NE ARG A 402 106.292 17.411 2.974 1.00 1.71 N ATOM 1343 CZ ARG A 402 107.189 18.071 3.658 1.00 2.17 C ATOM 1344 NH1 ARG A 402 108.421 17.640 3.716 1.00 2.62 N ATOM 1345 NH2 ARG A 402 106.854 19.165 4.285 1.00 2.61 N ATOM 0 H ARG A 402 105.583 12.055 0.104 1.00 0.50 H new ATOM 0 HA ARG A 402 103.501 13.682 1.272 1.00 0.47 H new ATOM 0 HB2 ARG A 402 106.018 13.549 1.784 1.00 0.44 H new ATOM 0 HB3 ARG A 402 106.324 14.350 0.255 1.00 0.44 H new ATOM 0 HG2 ARG A 402 104.912 16.296 1.000 1.00 1.17 H new ATOM 0 HG3 ARG A 402 104.627 15.497 2.534 1.00 1.17 H new ATOM 0 HD2 ARG A 402 107.151 15.452 2.927 1.00 1.24 H new ATOM 0 HD3 ARG A 402 107.366 16.365 1.447 1.00 1.24 H new ATOM 0 HE ARG A 402 105.332 17.754 2.931 1.00 1.71 H new ATOM 0 HH11 ARG A 402 108.686 16.785 3.226 1.00 2.62 H new ATOM 0 HH12 ARG A 402 109.118 18.158 4.251 1.00 2.62 H new ATOM 0 HH21 ARG A 402 105.893 19.504 4.241 1.00 2.61 H new ATOM 0 HH22 ARG A 402 107.553 19.681 4.819 1.00 2.61 H new ATOM 1359 N ARG A 403 104.404 14.500 -1.774 1.00 0.54 N ATOM 1360 CA ARG A 403 103.955 15.329 -2.925 1.00 0.62 C ATOM 1361 C ARG A 403 102.593 14.838 -3.439 1.00 0.72 C ATOM 1362 O ARG A 403 101.762 15.622 -3.854 1.00 0.82 O ATOM 1363 CB ARG A 403 105.062 15.185 -3.982 1.00 0.63 C ATOM 1364 CG ARG A 403 104.866 13.912 -4.805 1.00 0.83 C ATOM 1365 CD ARG A 403 104.218 14.262 -6.147 1.00 0.96 C ATOM 1366 NE ARG A 403 105.322 14.169 -7.143 1.00 1.38 N ATOM 1367 CZ ARG A 403 105.106 14.471 -8.395 1.00 2.01 C ATOM 1368 NH1 ARG A 403 103.919 14.854 -8.785 1.00 2.48 N ATOM 1369 NH2 ARG A 403 106.079 14.388 -9.262 1.00 2.46 N ATOM 0 H ARG A 403 105.213 13.905 -1.955 1.00 0.54 H new ATOM 0 HA ARG A 403 103.809 16.375 -2.657 1.00 0.62 H new ATOM 0 HB2 ARG A 403 105.057 16.053 -4.641 1.00 0.63 H new ATOM 0 HB3 ARG A 403 106.036 15.161 -3.494 1.00 0.63 H new ATOM 0 HG2 ARG A 403 105.826 13.422 -4.970 1.00 0.83 H new ATOM 0 HG3 ARG A 403 104.238 13.207 -4.259 1.00 0.83 H new ATOM 0 HD2 ARG A 403 103.410 13.571 -6.387 1.00 0.96 H new ATOM 0 HD3 ARG A 403 103.787 15.263 -6.128 1.00 0.96 H new ATOM 0 HE ARG A 403 106.250 13.868 -6.846 1.00 1.38 H new ATOM 0 HH11 ARG A 403 103.157 14.918 -8.110 1.00 2.48 H new ATOM 0 HH12 ARG A 403 103.755 15.089 -9.764 1.00 2.48 H new ATOM 0 HH21 ARG A 403 107.006 14.088 -8.961 1.00 2.46 H new ATOM 0 HH22 ARG A 403 105.912 14.624 -10.240 1.00 2.46 H new ATOM 1383 N HIS A 404 102.318 13.563 -3.339 1.00 0.74 N ATOM 1384 CA HIS A 404 100.973 13.062 -3.742 1.00 0.86 C ATOM 1385 C HIS A 404 99.894 13.620 -2.810 1.00 0.84 C ATOM 1386 O HIS A 404 98.843 14.051 -3.243 1.00 0.94 O ATOM 1387 CB HIS A 404 101.064 11.543 -3.612 1.00 0.92 C ATOM 1388 CG HIS A 404 99.764 10.926 -4.050 1.00 1.32 C ATOM 1389 ND1 HIS A 404 99.333 10.968 -5.366 1.00 1.39 N ATOM 1390 CD2 HIS A 404 98.790 10.251 -3.357 1.00 2.29 C ATOM 1391 CE1 HIS A 404 98.146 10.337 -5.423 1.00 1.88 C ATOM 1392 NE2 HIS A 404 97.768 9.880 -4.226 1.00 2.43 N ATOM 0 H HIS A 404 102.964 12.851 -2.997 1.00 0.74 H new ATOM 0 HA HIS A 404 100.704 13.370 -4.752 1.00 0.86 H new ATOM 0 HB2 HIS A 404 101.883 11.163 -4.222 1.00 0.92 H new ATOM 0 HB3 HIS A 404 101.281 11.267 -2.580 1.00 0.92 H new ATOM 0 HD1 HIS A 404 99.825 11.399 -6.149 1.00 1.39 H new ATOM 0 HD2 HIS A 404 98.813 10.040 -2.298 1.00 2.29 H new ATOM 0 HE1 HIS A 404 97.568 10.215 -6.327 1.00 1.88 H new ATOM 1400 N VAL A 405 100.162 13.657 -1.536 1.00 0.76 N ATOM 1401 CA VAL A 405 99.168 14.228 -0.584 1.00 0.79 C ATOM 1402 C VAL A 405 98.961 15.719 -0.859 1.00 0.85 C ATOM 1403 O VAL A 405 97.851 16.207 -0.857 1.00 0.94 O ATOM 1404 CB VAL A 405 99.778 14.013 0.802 1.00 0.76 C ATOM 1405 CG1 VAL A 405 98.858 14.613 1.864 1.00 0.80 C ATOM 1406 CG2 VAL A 405 99.945 12.514 1.060 1.00 0.76 C ATOM 0 H VAL A 405 101.025 13.317 -1.112 1.00 0.76 H new ATOM 0 HA VAL A 405 98.190 13.755 -0.676 1.00 0.79 H new ATOM 0 HB VAL A 405 100.752 14.500 0.848 1.00 0.76 H new ATOM 0 HG11 VAL A 405 99.293 14.459 2.851 1.00 0.80 H new ATOM 0 HG12 VAL A 405 98.740 15.681 1.682 1.00 0.80 H new ATOM 0 HG13 VAL A 405 97.883 14.127 1.818 1.00 0.80 H new ATOM 0 HG21 VAL A 405 100.380 12.361 2.048 1.00 0.76 H new ATOM 0 HG22 VAL A 405 98.972 12.026 1.012 1.00 0.76 H new ATOM 0 HG23 VAL A 405 100.603 12.086 0.304 1.00 0.76 H new ATOM 1416 N GLU A 406 100.015 16.458 -1.059 1.00 0.84 N ATOM 1417 CA GLU A 406 99.858 17.924 -1.283 1.00 0.95 C ATOM 1418 C GLU A 406 99.047 18.196 -2.556 1.00 1.05 C ATOM 1419 O GLU A 406 98.269 19.129 -2.614 1.00 1.19 O ATOM 1420 CB GLU A 406 101.285 18.457 -1.432 1.00 0.91 C ATOM 1421 CG GLU A 406 102.041 18.263 -0.116 1.00 0.88 C ATOM 1422 CD GLU A 406 103.446 18.854 -0.243 1.00 1.43 C ATOM 1423 OE1 GLU A 406 103.817 19.217 -1.347 1.00 1.86 O ATOM 1424 OE2 GLU A 406 104.127 18.936 0.766 1.00 2.16 O ATOM 0 H GLU A 406 100.975 16.114 -1.077 1.00 0.84 H new ATOM 0 HA GLU A 406 99.322 18.406 -0.465 1.00 0.95 H new ATOM 0 HB2 GLU A 406 101.798 17.934 -2.239 1.00 0.91 H new ATOM 0 HB3 GLU A 406 101.264 19.513 -1.700 1.00 0.91 H new ATOM 0 HG2 GLU A 406 101.504 18.747 0.699 1.00 0.88 H new ATOM 0 HG3 GLU A 406 102.102 17.202 0.128 1.00 0.88 H new ATOM 1431 N ALA A 407 99.213 17.393 -3.571 1.00 1.02 N ATOM 1432 CA ALA A 407 98.439 17.617 -4.828 1.00 1.17 C ATOM 1433 C ALA A 407 96.952 17.382 -4.566 1.00 1.32 C ATOM 1434 O ALA A 407 96.113 18.191 -4.911 1.00 1.53 O ATOM 1435 CB ALA A 407 98.981 16.586 -5.818 1.00 1.12 C ATOM 0 H ALA A 407 99.848 16.595 -3.586 1.00 1.02 H new ATOM 0 HA ALA A 407 98.543 18.633 -5.208 1.00 1.17 H new ATOM 0 HB1 ALA A 407 98.460 16.687 -6.770 1.00 1.12 H new ATOM 0 HB2 ALA A 407 100.048 16.752 -5.969 1.00 1.12 H new ATOM 0 HB3 ALA A 407 98.822 15.583 -5.422 1.00 1.12 H new ATOM 1441 N ASN A 408 96.641 16.361 -3.820 1.00 1.23 N ATOM 1442 CA ASN A 408 95.240 16.160 -3.370 1.00 1.37 C ATOM 1443 C ASN A 408 94.855 17.281 -2.409 1.00 1.44 C ATOM 1444 O ASN A 408 93.695 17.578 -2.209 1.00 1.60 O ATOM 1445 CB ASN A 408 95.259 14.814 -2.652 1.00 1.27 C ATOM 1446 CG ASN A 408 95.426 13.690 -3.675 1.00 1.88 C ATOM 1447 OD1 ASN A 408 96.210 12.783 -3.477 1.00 2.75 O ATOM 1448 ND2 ASN A 408 94.717 13.711 -4.771 1.00 2.02 N ATOM 0 H ASN A 408 97.303 15.653 -3.501 1.00 1.23 H new ATOM 0 HA ASN A 408 94.519 16.173 -4.187 1.00 1.37 H new ATOM 0 HB2 ASN A 408 96.075 14.787 -1.930 1.00 1.27 H new ATOM 0 HB3 ASN A 408 94.334 14.676 -2.092 1.00 1.27 H new ATOM 0 HD21 ASN A 408 94.821 12.966 -5.460 1.00 2.02 H new ATOM 0 HD22 ASN A 408 94.059 14.472 -4.938 1.00 2.02 H new ATOM 1455 N GLY A 409 95.828 17.835 -1.746 1.00 1.37 N ATOM 1456 CA GLY A 409 95.546 18.859 -0.713 1.00 1.51 C ATOM 1457 C GLY A 409 95.510 18.192 0.663 1.00 1.69 C ATOM 1458 O GLY A 409 94.922 18.696 1.598 1.00 2.28 O ATOM 0 H GLY A 409 96.816 17.618 -1.879 1.00 1.37 H new ATOM 0 HA2 GLY A 409 96.312 19.634 -0.734 1.00 1.51 H new ATOM 0 HA3 GLY A 409 94.593 19.347 -0.919 1.00 1.51 H new ATOM 1462 N GLY A 410 96.166 17.070 0.796 1.00 1.39 N ATOM 1463 CA GLY A 410 96.205 16.376 2.116 1.00 1.72 C ATOM 1464 C GLY A 410 97.449 16.822 2.887 1.00 1.26 C ATOM 1465 O GLY A 410 98.151 17.726 2.482 1.00 1.69 O ATOM 0 H GLY A 410 96.677 16.604 0.047 1.00 1.39 H new ATOM 0 HA2 GLY A 410 95.306 16.608 2.688 1.00 1.72 H new ATOM 0 HA3 GLY A 410 96.221 15.296 1.971 1.00 1.72 H new ATOM 1469 N HIS A 411 97.750 16.170 3.979 1.00 0.88 N ATOM 1470 CA HIS A 411 98.976 16.534 4.747 1.00 1.32 C ATOM 1471 C HIS A 411 99.682 15.273 5.256 1.00 1.27 C ATOM 1472 O HIS A 411 99.052 14.284 5.577 1.00 1.52 O ATOM 1473 CB HIS A 411 98.474 17.379 5.917 1.00 1.83 C ATOM 1474 CG HIS A 411 97.868 18.652 5.393 1.00 2.66 C ATOM 1475 ND1 HIS A 411 96.517 18.764 5.105 1.00 3.39 N ATOM 1476 CD2 HIS A 411 98.417 19.875 5.097 1.00 3.34 C ATOM 1477 CE1 HIS A 411 96.299 20.015 4.659 1.00 4.16 C ATOM 1478 NE2 HIS A 411 97.424 20.735 4.635 1.00 4.13 N ATOM 0 H HIS A 411 97.202 15.404 4.371 1.00 0.88 H new ATOM 0 HA HIS A 411 99.699 17.073 4.135 1.00 1.32 H new ATOM 0 HB2 HIS A 411 97.734 16.821 6.491 1.00 1.83 H new ATOM 0 HB3 HIS A 411 99.297 17.607 6.594 1.00 1.83 H new ATOM 0 HD2 HIS A 411 99.461 20.131 5.206 1.00 3.34 H new ATOM 0 HE1 HIS A 411 95.333 20.391 4.357 1.00 4.16 H new ATOM 0 HE2 HIS A 411 97.532 21.706 4.341 1.00 4.13 H new ATOM 1486 N PHE A 412 100.982 15.315 5.369 1.00 1.04 N ATOM 1487 CA PHE A 412 101.725 14.137 5.902 1.00 1.06 C ATOM 1488 C PHE A 412 101.853 14.244 7.427 1.00 1.03 C ATOM 1489 O PHE A 412 102.517 15.128 7.932 1.00 1.05 O ATOM 1490 CB PHE A 412 103.102 14.210 5.238 1.00 1.03 C ATOM 1491 CG PHE A 412 103.659 12.816 5.073 1.00 1.36 C ATOM 1492 CD1 PHE A 412 104.266 12.169 6.158 1.00 1.73 C ATOM 1493 CD2 PHE A 412 103.571 12.171 3.832 1.00 1.90 C ATOM 1494 CE1 PHE A 412 104.784 10.876 6.002 1.00 2.70 C ATOM 1495 CE2 PHE A 412 104.089 10.878 3.675 1.00 2.91 C ATOM 1496 CZ PHE A 412 104.696 10.230 4.761 1.00 3.31 C ATOM 0 H PHE A 412 101.562 16.115 5.115 1.00 1.04 H new ATOM 0 HA PHE A 412 101.221 13.194 5.691 1.00 1.06 H new ATOM 0 HB2 PHE A 412 103.023 14.698 4.267 1.00 1.03 H new ATOM 0 HB3 PHE A 412 103.778 14.813 5.844 1.00 1.03 H new ATOM 0 HD1 PHE A 412 104.335 12.667 7.114 1.00 1.73 H new ATOM 0 HD2 PHE A 412 103.104 12.670 2.996 1.00 1.90 H new ATOM 0 HE1 PHE A 412 105.251 10.377 6.838 1.00 2.70 H new ATOM 0 HE2 PHE A 412 104.021 10.381 2.719 1.00 2.91 H new ATOM 0 HZ PHE A 412 105.095 9.234 4.641 1.00 3.31 H new ATOM 1506 N PRO A 413 101.159 13.373 8.111 1.00 1.03 N ATOM 1507 CA PRO A 413 101.136 13.410 9.597 1.00 1.06 C ATOM 1508 C PRO A 413 102.551 13.262 10.165 1.00 0.96 C ATOM 1509 O PRO A 413 103.357 12.506 9.663 1.00 0.88 O ATOM 1510 CB PRO A 413 100.270 12.211 9.987 1.00 1.16 C ATOM 1511 CG PRO A 413 99.518 11.835 8.749 1.00 1.23 C ATOM 1512 CD PRO A 413 100.341 12.285 7.573 1.00 1.05 C ATOM 0 HA PRO A 413 100.748 14.352 9.986 1.00 1.06 H new ATOM 0 HB2 PRO A 413 100.884 11.382 10.339 1.00 1.16 H new ATOM 0 HB3 PRO A 413 99.587 12.468 10.797 1.00 1.16 H new ATOM 0 HG2 PRO A 413 99.352 10.758 8.712 1.00 1.23 H new ATOM 0 HG3 PRO A 413 98.537 12.310 8.736 1.00 1.23 H new ATOM 0 HD2 PRO A 413 100.959 11.475 7.185 1.00 1.05 H new ATOM 0 HD3 PRO A 413 99.711 12.627 6.752 1.00 1.05 H new ATOM 1520 N THR A 414 102.855 13.981 11.213 1.00 1.01 N ATOM 1521 CA THR A 414 104.215 13.884 11.819 1.00 0.97 C ATOM 1522 C THR A 414 104.498 12.450 12.267 1.00 0.92 C ATOM 1523 O THR A 414 105.580 11.939 12.081 1.00 0.84 O ATOM 1524 CB THR A 414 104.180 14.832 13.023 1.00 1.09 C ATOM 1525 OG1 THR A 414 105.510 15.128 13.427 1.00 1.63 O ATOM 1526 CG2 THR A 414 103.430 14.173 14.185 1.00 1.75 C ATOM 0 H THR A 414 102.220 14.631 11.676 1.00 1.01 H new ATOM 0 HA THR A 414 105.001 14.151 11.113 1.00 0.97 H new ATOM 0 HB THR A 414 103.667 15.751 12.742 1.00 1.09 H new ATOM 0 HG1 THR A 414 105.491 15.735 14.196 1.00 1.63 H new ATOM 0 HG21 THR A 414 103.409 14.853 15.037 1.00 1.75 H new ATOM 0 HG22 THR A 414 102.409 13.946 13.877 1.00 1.75 H new ATOM 0 HG23 THR A 414 103.937 13.251 14.469 1.00 1.75 H new ATOM 1534 N ASP A 415 103.552 11.812 12.893 1.00 0.99 N ATOM 1535 CA ASP A 415 103.805 10.431 13.391 1.00 0.97 C ATOM 1536 C ASP A 415 104.243 9.528 12.237 1.00 0.83 C ATOM 1537 O ASP A 415 105.159 8.745 12.365 1.00 0.84 O ATOM 1538 CB ASP A 415 102.466 9.966 13.961 1.00 1.08 C ATOM 1539 CG ASP A 415 102.132 10.783 15.211 1.00 1.27 C ATOM 1540 OD1 ASP A 415 103.011 11.481 15.690 1.00 1.80 O ATOM 1541 OD2 ASP A 415 101.005 10.696 15.668 1.00 1.87 O ATOM 0 H ASP A 415 102.620 12.182 13.081 1.00 0.99 H new ATOM 0 HA ASP A 415 104.598 10.397 14.138 1.00 0.97 H new ATOM 0 HB2 ASP A 415 101.680 10.085 13.215 1.00 1.08 H new ATOM 0 HB3 ASP A 415 102.513 8.905 14.208 1.00 1.08 H new ATOM 1546 N VAL A 416 103.616 9.648 11.100 1.00 0.71 N ATOM 1547 CA VAL A 416 104.023 8.810 9.936 1.00 0.60 C ATOM 1548 C VAL A 416 105.416 9.209 9.442 1.00 0.51 C ATOM 1549 O VAL A 416 106.244 8.369 9.156 1.00 0.46 O ATOM 1550 CB VAL A 416 102.971 9.093 8.865 1.00 0.58 C ATOM 1551 CG1 VAL A 416 103.429 8.508 7.526 1.00 0.51 C ATOM 1552 CG2 VAL A 416 101.648 8.446 9.274 1.00 0.71 C ATOM 0 H VAL A 416 102.841 10.288 10.926 1.00 0.71 H new ATOM 0 HA VAL A 416 104.077 7.752 10.191 1.00 0.60 H new ATOM 0 HB VAL A 416 102.838 10.170 8.763 1.00 0.58 H new ATOM 0 HG11 VAL A 416 102.677 8.711 6.764 1.00 0.51 H new ATOM 0 HG12 VAL A 416 104.374 8.965 7.234 1.00 0.51 H new ATOM 0 HG13 VAL A 416 103.562 7.431 7.626 1.00 0.51 H new ATOM 0 HG21 VAL A 416 100.894 8.646 8.512 1.00 0.71 H new ATOM 0 HG22 VAL A 416 101.785 7.369 9.375 1.00 0.71 H new ATOM 0 HG23 VAL A 416 101.319 8.861 10.227 1.00 0.71 H new ATOM 1562 N ASP A 417 105.706 10.477 9.401 1.00 0.53 N ATOM 1563 CA ASP A 417 107.073 10.910 8.995 1.00 0.53 C ATOM 1564 C ASP A 417 108.108 10.378 9.989 1.00 0.58 C ATOM 1565 O ASP A 417 109.162 9.906 9.614 1.00 0.60 O ATOM 1566 CB ASP A 417 107.026 12.438 9.021 1.00 0.61 C ATOM 1567 CG ASP A 417 108.315 13.000 8.419 1.00 1.03 C ATOM 1568 OD1 ASP A 417 109.106 12.215 7.924 1.00 1.81 O ATOM 1569 OD2 ASP A 417 108.489 14.206 8.464 1.00 1.15 O ATOM 0 H ASP A 417 105.059 11.232 9.630 1.00 0.53 H new ATOM 0 HA ASP A 417 107.357 10.532 8.013 1.00 0.53 H new ATOM 0 HB2 ASP A 417 106.164 12.795 8.458 1.00 0.61 H new ATOM 0 HB3 ASP A 417 106.907 12.791 10.045 1.00 0.61 H new ATOM 1574 N GLN A 418 107.773 10.366 11.246 1.00 0.62 N ATOM 1575 CA GLN A 418 108.685 9.773 12.261 1.00 0.68 C ATOM 1576 C GLN A 418 108.854 8.268 12.026 1.00 0.69 C ATOM 1577 O GLN A 418 109.944 7.745 12.108 1.00 0.81 O ATOM 1578 CB GLN A 418 107.997 10.051 13.599 1.00 0.73 C ATOM 1579 CG GLN A 418 108.041 11.552 13.894 1.00 1.31 C ATOM 1580 CD GLN A 418 107.331 11.832 15.220 1.00 1.86 C ATOM 1581 OE1 GLN A 418 106.605 10.997 15.720 1.00 1.96 O ATOM 1582 NE2 GLN A 418 107.512 12.980 15.812 1.00 2.60 N ATOM 0 H GLN A 418 106.901 10.744 11.617 1.00 0.62 H new ATOM 0 HA GLN A 418 109.689 10.196 12.220 1.00 0.68 H new ATOM 0 HB2 GLN A 418 106.963 9.706 13.567 1.00 0.73 H new ATOM 0 HB3 GLN A 418 108.493 9.498 14.397 1.00 0.73 H new ATOM 0 HG2 GLN A 418 109.075 11.894 13.944 1.00 1.31 H new ATOM 0 HG3 GLN A 418 107.560 12.106 13.088 1.00 1.31 H new ATOM 0 HE21 GLN A 418 108.122 13.680 15.391 1.00 2.60 H new ATOM 0 HE22 GLN A 418 107.043 13.177 16.696 1.00 2.60 H new ATOM 1591 N LYS A 419 107.800 7.566 11.716 1.00 0.61 N ATOM 1592 CA LYS A 419 107.939 6.102 11.464 1.00 0.63 C ATOM 1593 C LYS A 419 108.832 5.843 10.246 1.00 0.62 C ATOM 1594 O LYS A 419 109.631 4.933 10.235 1.00 0.71 O ATOM 1595 CB LYS A 419 106.517 5.605 11.203 1.00 0.57 C ATOM 1596 CG LYS A 419 105.696 5.703 12.490 1.00 0.81 C ATOM 1597 CD LYS A 419 104.303 5.117 12.253 1.00 0.93 C ATOM 1598 CE LYS A 419 103.442 5.326 13.502 1.00 1.33 C ATOM 1599 NZ LYS A 419 104.240 4.748 14.619 1.00 2.49 N ATOM 0 H LYS A 419 106.854 7.938 11.626 1.00 0.61 H new ATOM 0 HA LYS A 419 108.404 5.588 12.305 1.00 0.63 H new ATOM 0 HB2 LYS A 419 106.052 6.199 10.417 1.00 0.57 H new ATOM 0 HB3 LYS A 419 106.540 4.573 10.852 1.00 0.57 H new ATOM 0 HG2 LYS A 419 106.196 5.165 13.295 1.00 0.81 H new ATOM 0 HG3 LYS A 419 105.616 6.744 12.804 1.00 0.81 H new ATOM 0 HD2 LYS A 419 103.837 5.597 11.392 1.00 0.93 H new ATOM 0 HD3 LYS A 419 104.378 4.054 12.024 1.00 0.93 H new ATOM 0 HE2 LYS A 419 103.238 6.384 13.668 1.00 1.33 H new ATOM 0 HE3 LYS A 419 102.478 4.826 13.405 1.00 1.33 H new ATOM 0 HZ1 LYS A 419 103.599 4.416 15.368 1.00 2.49 H new ATOM 0 HZ2 LYS A 419 104.803 3.948 14.266 1.00 2.49 H new ATOM 0 HZ3 LYS A 419 104.875 5.476 15.004 1.00 2.49 H new ATOM 1613 N VAL A 420 108.712 6.644 9.224 1.00 0.56 N ATOM 1614 CA VAL A 420 109.552 6.447 8.004 1.00 0.62 C ATOM 1615 C VAL A 420 111.023 6.711 8.322 1.00 0.71 C ATOM 1616 O VAL A 420 111.910 6.028 7.852 1.00 0.79 O ATOM 1617 CB VAL A 420 109.030 7.480 7.008 1.00 0.60 C ATOM 1618 CG1 VAL A 420 109.892 7.458 5.748 1.00 0.70 C ATOM 1619 CG2 VAL A 420 107.581 7.152 6.639 1.00 0.59 C ATOM 0 H VAL A 420 108.065 7.432 9.179 1.00 0.56 H new ATOM 0 HA VAL A 420 109.491 5.429 7.618 1.00 0.62 H new ATOM 0 HB VAL A 420 109.074 8.470 7.461 1.00 0.60 H new ATOM 0 HG11 VAL A 420 109.518 8.196 5.038 1.00 0.70 H new ATOM 0 HG12 VAL A 420 110.923 7.695 6.009 1.00 0.70 H new ATOM 0 HG13 VAL A 420 109.851 6.467 5.296 1.00 0.70 H new ATOM 0 HG21 VAL A 420 107.210 7.891 5.928 1.00 0.59 H new ATOM 0 HG22 VAL A 420 107.536 6.160 6.189 1.00 0.59 H new ATOM 0 HG23 VAL A 420 106.964 7.171 7.537 1.00 0.59 H new ATOM 1629 N ASP A 421 111.281 7.710 9.109 1.00 0.72 N ATOM 1630 CA ASP A 421 112.686 8.050 9.465 1.00 0.84 C ATOM 1631 C ASP A 421 113.296 6.966 10.356 1.00 0.91 C ATOM 1632 O ASP A 421 114.407 6.524 10.140 1.00 1.00 O ATOM 1633 CB ASP A 421 112.571 9.367 10.225 1.00 0.88 C ATOM 1634 CG ASP A 421 112.249 10.496 9.245 1.00 1.14 C ATOM 1635 OD1 ASP A 421 112.293 10.250 8.052 1.00 2.05 O ATOM 1636 OD2 ASP A 421 111.961 11.589 9.705 1.00 1.25 O ATOM 0 H ASP A 421 110.573 8.314 9.527 1.00 0.72 H new ATOM 0 HA ASP A 421 113.331 8.126 8.590 1.00 0.84 H new ATOM 0 HB2 ASP A 421 111.790 9.295 10.982 1.00 0.88 H new ATOM 0 HB3 ASP A 421 113.503 9.580 10.748 1.00 0.88 H new ATOM 1641 N GLN A 422 112.557 6.497 11.319 1.00 0.89 N ATOM 1642 CA GLN A 422 113.066 5.398 12.185 1.00 0.98 C ATOM 1643 C GLN A 422 113.253 4.129 11.354 1.00 0.98 C ATOM 1644 O GLN A 422 114.195 3.388 11.541 1.00 1.07 O ATOM 1645 CB GLN A 422 111.987 5.201 13.249 1.00 0.99 C ATOM 1646 CG GLN A 422 111.822 6.492 14.057 1.00 1.32 C ATOM 1647 CD GLN A 422 110.731 6.299 15.109 1.00 1.77 C ATOM 1648 OE1 GLN A 422 109.948 5.373 15.027 1.00 2.33 O ATOM 1649 NE2 GLN A 422 110.644 7.139 16.104 1.00 2.33 N ATOM 0 H GLN A 422 111.619 6.828 11.545 1.00 0.89 H new ATOM 0 HA GLN A 422 114.032 5.629 12.633 1.00 0.98 H new ATOM 0 HB2 GLN A 422 111.042 4.931 12.778 1.00 0.99 H new ATOM 0 HB3 GLN A 422 112.260 4.378 13.910 1.00 0.99 H new ATOM 0 HG2 GLN A 422 112.764 6.755 14.539 1.00 1.32 H new ATOM 0 HG3 GLN A 422 111.561 7.317 13.395 1.00 1.32 H new ATOM 0 HE21 GLN A 422 111.301 7.916 16.174 1.00 2.33 H new ATOM 0 HE22 GLN A 422 109.920 7.018 16.812 1.00 2.33 H new ATOM 1658 N VAL A 423 112.445 3.951 10.349 1.00 0.91 N ATOM 1659 CA VAL A 423 112.667 2.823 9.410 1.00 0.94 C ATOM 1660 C VAL A 423 114.031 2.976 8.732 1.00 0.96 C ATOM 1661 O VAL A 423 114.791 2.034 8.621 1.00 1.00 O ATOM 1662 CB VAL A 423 111.542 2.963 8.393 1.00 0.92 C ATOM 1663 CG1 VAL A 423 111.731 1.949 7.267 1.00 0.95 C ATOM 1664 CG2 VAL A 423 110.198 2.721 9.078 1.00 0.99 C ATOM 0 H VAL A 423 111.639 4.540 10.138 1.00 0.91 H new ATOM 0 HA VAL A 423 112.664 1.849 9.899 1.00 0.94 H new ATOM 0 HB VAL A 423 111.561 3.970 7.976 1.00 0.92 H new ATOM 0 HG11 VAL A 423 110.923 2.054 6.543 1.00 0.95 H new ATOM 0 HG12 VAL A 423 112.686 2.127 6.773 1.00 0.95 H new ATOM 0 HG13 VAL A 423 111.719 0.940 7.680 1.00 0.95 H new ATOM 0 HG21 VAL A 423 109.394 2.822 8.348 1.00 0.99 H new ATOM 0 HG22 VAL A 423 110.181 1.716 9.501 1.00 0.99 H new ATOM 0 HG23 VAL A 423 110.059 3.452 9.874 1.00 0.99 H new ATOM 1674 N ALA A 424 114.360 4.166 8.309 1.00 0.98 N ATOM 1675 CA ALA A 424 115.690 4.394 7.675 1.00 1.07 C ATOM 1676 C ALA A 424 116.800 4.303 8.724 1.00 1.17 C ATOM 1677 O ALA A 424 117.778 3.604 8.550 1.00 1.24 O ATOM 1678 CB ALA A 424 115.616 5.809 7.112 1.00 1.09 C ATOM 0 H ALA A 424 113.764 4.991 8.375 1.00 0.98 H new ATOM 0 HA ALA A 424 115.913 3.653 6.907 1.00 1.07 H new ATOM 0 HB1 ALA A 424 116.560 6.057 6.626 1.00 1.09 H new ATOM 0 HB2 ALA A 424 114.806 5.869 6.385 1.00 1.09 H new ATOM 0 HB3 ALA A 424 115.429 6.514 7.922 1.00 1.09 H new ATOM 1684 N ARG A 425 116.653 5.006 9.814 1.00 1.23 N ATOM 1685 CA ARG A 425 117.697 4.960 10.876 1.00 1.39 C ATOM 1686 C ARG A 425 117.952 3.511 11.293 1.00 1.38 C ATOM 1687 O ARG A 425 119.000 3.178 11.810 1.00 1.53 O ATOM 1688 CB ARG A 425 117.116 5.762 12.041 1.00 1.57 C ATOM 1689 CG ARG A 425 116.952 7.225 11.623 1.00 2.17 C ATOM 1690 CD ARG A 425 116.436 8.041 12.809 1.00 2.43 C ATOM 1691 NE ARG A 425 117.580 8.105 13.759 1.00 2.68 N ATOM 1692 CZ ARG A 425 117.380 8.423 15.011 1.00 3.44 C ATOM 1693 NH1 ARG A 425 116.173 8.686 15.438 1.00 4.11 N ATOM 1694 NH2 ARG A 425 118.387 8.478 15.838 1.00 3.73 N ATOM 0 H ARG A 425 115.856 5.610 10.015 1.00 1.23 H new ATOM 0 HA ARG A 425 118.650 5.369 10.540 1.00 1.39 H new ATOM 0 HB2 ARG A 425 116.152 5.347 12.337 1.00 1.57 H new ATOM 0 HB3 ARG A 425 117.773 5.692 12.908 1.00 1.57 H new ATOM 0 HG2 ARG A 425 117.906 7.625 11.280 1.00 2.17 H new ATOM 0 HG3 ARG A 425 116.257 7.299 10.787 1.00 2.17 H new ATOM 0 HD2 ARG A 425 116.126 9.038 12.497 1.00 2.43 H new ATOM 0 HD3 ARG A 425 115.568 7.566 13.267 1.00 2.43 H new ATOM 0 HE ARG A 425 118.524 7.900 13.432 1.00 2.68 H new ATOM 0 HH11 ARG A 425 115.383 8.643 14.794 1.00 4.11 H new ATOM 0 HH12 ARG A 425 116.021 8.934 16.416 1.00 4.11 H new ATOM 0 HH21 ARG A 425 119.330 8.273 15.508 1.00 3.73 H new ATOM 0 HH22 ARG A 425 118.232 8.726 16.815 1.00 3.73 H new ATOM 1708 N GLN A 426 117.007 2.644 11.054 1.00 1.26 N ATOM 1709 CA GLN A 426 117.205 1.208 11.422 1.00 1.33 C ATOM 1710 C GLN A 426 117.809 0.428 10.251 1.00 1.26 C ATOM 1711 O GLN A 426 118.048 -0.760 10.344 1.00 1.33 O ATOM 1712 CB GLN A 426 115.811 0.687 11.761 1.00 1.34 C ATOM 1713 CG GLN A 426 115.328 1.352 13.049 1.00 1.95 C ATOM 1714 CD GLN A 426 113.873 0.961 13.313 1.00 2.42 C ATOM 1715 OE1 GLN A 426 113.185 0.499 12.425 1.00 2.68 O ATOM 1716 NE2 GLN A 426 113.371 1.125 14.507 1.00 2.92 N ATOM 0 H GLN A 426 116.109 2.863 10.622 1.00 1.26 H new ATOM 0 HA GLN A 426 117.895 1.092 12.258 1.00 1.33 H new ATOM 0 HB2 GLN A 426 115.121 0.902 10.945 1.00 1.34 H new ATOM 0 HB3 GLN A 426 115.834 -0.396 11.883 1.00 1.34 H new ATOM 0 HG2 GLN A 426 115.955 1.045 13.886 1.00 1.95 H new ATOM 0 HG3 GLN A 426 115.415 2.435 12.966 1.00 1.95 H new ATOM 0 HE21 GLN A 426 113.947 1.513 15.254 1.00 2.92 H new ATOM 0 HE22 GLN A 426 112.402 0.865 14.693 1.00 2.92 H new ATOM 1725 N GLY A 427 118.138 1.100 9.185 1.00 1.16 N ATOM 1726 CA GLY A 427 118.819 0.409 8.051 1.00 1.14 C ATOM 1727 C GLY A 427 117.777 -0.145 7.078 1.00 1.07 C ATOM 1728 O GLY A 427 118.097 -0.858 6.148 1.00 1.11 O ATOM 0 H GLY A 427 117.966 2.096 9.048 1.00 1.16 H new ATOM 0 HA2 GLY A 427 119.479 1.105 7.533 1.00 1.14 H new ATOM 0 HA3 GLY A 427 119.443 -0.401 8.429 1.00 1.14 H new ATOM 1732 N ALA A 428 116.538 0.217 7.256 1.00 1.07 N ATOM 1733 CA ALA A 428 115.478 -0.241 6.311 1.00 1.00 C ATOM 1734 C ALA A 428 115.106 0.894 5.360 1.00 0.94 C ATOM 1735 O ALA A 428 115.193 2.055 5.706 1.00 0.97 O ATOM 1736 CB ALA A 428 114.290 -0.607 7.200 1.00 1.04 C ATOM 0 H ALA A 428 116.211 0.812 8.017 1.00 1.07 H new ATOM 0 HA ALA A 428 115.800 -1.082 5.697 1.00 1.00 H new ATOM 0 HB1 ALA A 428 113.464 -0.955 6.579 1.00 1.04 H new ATOM 0 HB2 ALA A 428 114.583 -1.398 7.891 1.00 1.04 H new ATOM 0 HB3 ALA A 428 113.974 0.270 7.765 1.00 1.04 H new ATOM 1742 N THR A 429 114.585 0.568 4.211 1.00 0.92 N ATOM 1743 CA THR A 429 114.083 1.635 3.300 1.00 0.88 C ATOM 1744 C THR A 429 112.596 1.846 3.554 1.00 0.65 C ATOM 1745 O THR A 429 111.792 0.983 3.264 1.00 0.62 O ATOM 1746 CB THR A 429 114.305 1.106 1.880 1.00 1.00 C ATOM 1747 OG1 THR A 429 115.680 1.228 1.542 1.00 1.21 O ATOM 1748 CG2 THR A 429 113.458 1.918 0.888 1.00 1.00 C ATOM 0 H THR A 429 114.485 -0.386 3.864 1.00 0.92 H new ATOM 0 HA THR A 429 114.593 2.586 3.454 1.00 0.88 H new ATOM 0 HB THR A 429 114.009 0.058 1.832 1.00 1.00 H new ATOM 0 HG1 THR A 429 115.825 0.888 0.634 1.00 1.21 H new ATOM 0 HG21 THR A 429 113.618 1.540 -0.122 1.00 1.00 H new ATOM 0 HG22 THR A 429 112.404 1.824 1.148 1.00 1.00 H new ATOM 0 HG23 THR A 429 113.751 2.967 0.933 1.00 1.00 H new ATOM 1756 N PRO A 430 112.283 2.964 4.141 1.00 0.70 N ATOM 1757 CA PRO A 430 110.884 3.262 4.493 1.00 0.55 C ATOM 1758 C PRO A 430 110.110 3.696 3.251 1.00 0.54 C ATOM 1759 O PRO A 430 110.184 4.836 2.837 1.00 0.68 O ATOM 1760 CB PRO A 430 110.986 4.419 5.494 1.00 0.81 C ATOM 1761 CG PRO A 430 112.454 4.689 5.681 1.00 1.20 C ATOM 1762 CD PRO A 430 113.182 4.041 4.537 1.00 1.04 C ATOM 0 HA PRO A 430 110.359 2.400 4.905 1.00 0.55 H new ATOM 0 HB2 PRO A 430 110.473 5.304 5.118 1.00 0.81 H new ATOM 0 HB3 PRO A 430 110.516 4.156 6.441 1.00 0.81 H new ATOM 0 HG2 PRO A 430 112.647 5.762 5.700 1.00 1.20 H new ATOM 0 HG3 PRO A 430 112.800 4.286 6.633 1.00 1.20 H new ATOM 0 HD2 PRO A 430 113.355 4.742 3.721 1.00 1.04 H new ATOM 0 HD3 PRO A 430 114.157 3.661 4.843 1.00 1.04 H new ATOM 1770 N LEU A 431 109.169 2.898 2.841 1.00 0.47 N ATOM 1771 CA LEU A 431 108.177 3.395 1.857 1.00 0.56 C ATOM 1772 C LEU A 431 107.009 4.001 2.624 1.00 0.54 C ATOM 1773 O LEU A 431 106.770 3.657 3.760 1.00 0.59 O ATOM 1774 CB LEU A 431 107.702 2.169 1.076 1.00 0.59 C ATOM 1775 CG LEU A 431 108.855 1.563 0.281 1.00 0.59 C ATOM 1776 CD1 LEU A 431 108.325 0.388 -0.541 1.00 1.14 C ATOM 1777 CD2 LEU A 431 109.436 2.619 -0.662 1.00 1.40 C ATOM 0 H LEU A 431 109.045 1.931 3.142 1.00 0.47 H new ATOM 0 HA LEU A 431 108.593 4.148 1.188 1.00 0.56 H new ATOM 0 HB2 LEU A 431 107.297 1.427 1.764 1.00 0.59 H new ATOM 0 HB3 LEU A 431 106.895 2.451 0.400 1.00 0.59 H new ATOM 0 HG LEU A 431 109.633 1.220 0.963 1.00 0.59 H new ATOM 0 HD11 LEU A 431 109.141 -0.053 -1.114 1.00 1.14 H new ATOM 0 HD12 LEU A 431 107.903 -0.363 0.127 1.00 1.14 H new ATOM 0 HD13 LEU A 431 107.552 0.741 -1.224 1.00 1.14 H new ATOM 0 HD21 LEU A 431 110.260 2.186 -1.230 1.00 1.40 H new ATOM 0 HD22 LEU A 431 108.661 2.959 -1.349 1.00 1.40 H new ATOM 0 HD23 LEU A 431 109.802 3.465 -0.080 1.00 1.40 H new ATOM 1789 N VAL A 432 106.218 4.811 1.998 1.00 0.49 N ATOM 1790 CA VAL A 432 105.008 5.313 2.699 1.00 0.48 C ATOM 1791 C VAL A 432 103.758 5.002 1.877 1.00 0.48 C ATOM 1792 O VAL A 432 103.755 5.103 0.666 1.00 0.52 O ATOM 1793 CB VAL A 432 105.216 6.818 2.841 1.00 0.43 C ATOM 1794 CG1 VAL A 432 104.033 7.430 3.592 1.00 0.45 C ATOM 1795 CG2 VAL A 432 106.506 7.080 3.623 1.00 0.51 C ATOM 0 H VAL A 432 106.349 5.147 1.044 1.00 0.49 H new ATOM 0 HA VAL A 432 104.867 4.841 3.671 1.00 0.48 H new ATOM 0 HB VAL A 432 105.289 7.270 1.852 1.00 0.43 H new ATOM 0 HG11 VAL A 432 104.183 8.505 3.693 1.00 0.45 H new ATOM 0 HG12 VAL A 432 103.114 7.242 3.038 1.00 0.45 H new ATOM 0 HG13 VAL A 432 103.958 6.980 4.582 1.00 0.45 H new ATOM 0 HG21 VAL A 432 106.657 8.155 3.726 1.00 0.51 H new ATOM 0 HG22 VAL A 432 106.430 6.628 4.612 1.00 0.51 H new ATOM 0 HG23 VAL A 432 107.350 6.644 3.089 1.00 0.51 H new ATOM 1805 N VAL A 433 102.706 4.601 2.533 1.00 0.44 N ATOM 1806 CA VAL A 433 101.450 4.259 1.811 1.00 0.45 C ATOM 1807 C VAL A 433 100.332 5.188 2.273 1.00 0.37 C ATOM 1808 O VAL A 433 100.127 5.380 3.458 1.00 0.37 O ATOM 1809 CB VAL A 433 101.141 2.817 2.213 1.00 0.56 C ATOM 1810 CG1 VAL A 433 99.989 2.284 1.361 1.00 0.59 C ATOM 1811 CG2 VAL A 433 102.381 1.947 1.998 1.00 1.08 C ATOM 0 H VAL A 433 102.662 4.495 3.547 1.00 0.44 H new ATOM 0 HA VAL A 433 101.544 4.367 0.730 1.00 0.45 H new ATOM 0 HB VAL A 433 100.857 2.788 3.265 1.00 0.56 H new ATOM 0 HG11 VAL A 433 99.769 1.256 1.648 1.00 0.59 H new ATOM 0 HG12 VAL A 433 99.105 2.901 1.518 1.00 0.59 H new ATOM 0 HG13 VAL A 433 100.271 2.314 0.308 1.00 0.59 H new ATOM 0 HG21 VAL A 433 102.159 0.919 2.285 1.00 1.08 H new ATOM 0 HG22 VAL A 433 102.668 1.976 0.947 1.00 1.08 H new ATOM 0 HG23 VAL A 433 103.201 2.325 2.609 1.00 1.08 H new ATOM 1821 N VAL A 434 99.567 5.712 1.359 1.00 0.43 N ATOM 1822 CA VAL A 434 98.421 6.567 1.764 1.00 0.43 C ATOM 1823 C VAL A 434 97.150 6.146 1.038 1.00 0.48 C ATOM 1824 O VAL A 434 97.180 5.688 -0.086 1.00 0.90 O ATOM 1825 CB VAL A 434 98.804 7.999 1.374 1.00 0.53 C ATOM 1826 CG1 VAL A 434 100.263 8.261 1.743 1.00 0.70 C ATOM 1827 CG2 VAL A 434 98.614 8.201 -0.133 1.00 0.49 C ATOM 0 H VAL A 434 99.685 5.586 0.354 1.00 0.43 H new ATOM 0 HA VAL A 434 98.222 6.479 2.832 1.00 0.43 H new ATOM 0 HB VAL A 434 98.162 8.696 1.913 1.00 0.53 H new ATOM 0 HG11 VAL A 434 100.531 9.280 1.464 1.00 0.70 H new ATOM 0 HG12 VAL A 434 100.395 8.132 2.817 1.00 0.70 H new ATOM 0 HG13 VAL A 434 100.905 7.558 1.211 1.00 0.70 H new ATOM 0 HG21 VAL A 434 98.889 9.221 -0.401 1.00 0.49 H new ATOM 0 HG22 VAL A 434 99.247 7.500 -0.677 1.00 0.49 H new ATOM 0 HG23 VAL A 434 97.571 8.025 -0.395 1.00 0.49 H new ATOM 1837 N GLU A 435 96.034 6.427 1.630 1.00 0.61 N ATOM 1838 CA GLU A 435 94.741 6.192 0.936 1.00 0.60 C ATOM 1839 C GLU A 435 94.225 7.516 0.389 1.00 0.62 C ATOM 1840 O GLU A 435 94.145 8.496 1.104 1.00 0.67 O ATOM 1841 CB GLU A 435 93.801 5.656 2.013 1.00 0.70 C ATOM 1842 CG GLU A 435 93.607 4.155 1.803 1.00 0.76 C ATOM 1843 CD GLU A 435 92.554 3.632 2.782 1.00 1.13 C ATOM 1844 OE1 GLU A 435 92.119 4.403 3.621 1.00 1.34 O ATOM 1845 OE2 GLU A 435 92.201 2.469 2.675 1.00 1.79 O ATOM 0 H GLU A 435 95.957 6.812 2.571 1.00 0.61 H new ATOM 0 HA GLU A 435 94.828 5.497 0.101 1.00 0.60 H new ATOM 0 HB2 GLU A 435 94.215 5.847 3.003 1.00 0.70 H new ATOM 0 HB3 GLU A 435 92.841 6.170 1.964 1.00 0.70 H new ATOM 0 HG2 GLU A 435 93.294 3.958 0.777 1.00 0.76 H new ATOM 0 HG3 GLU A 435 94.551 3.631 1.954 1.00 0.76 H new ATOM 1852 N GLY A 436 94.013 7.605 -0.887 1.00 0.61 N ATOM 1853 CA GLY A 436 93.671 8.930 -1.462 1.00 0.64 C ATOM 1854 C GLY A 436 94.799 9.913 -1.133 1.00 0.68 C ATOM 1855 O GLY A 436 95.877 9.844 -1.689 1.00 1.42 O ATOM 0 H GLY A 436 94.060 6.832 -1.550 1.00 0.61 H new ATOM 0 HA2 GLY A 436 93.541 8.851 -2.541 1.00 0.64 H new ATOM 0 HA3 GLY A 436 92.726 9.288 -1.052 1.00 0.64 H new ATOM 1859 N SER A 437 94.544 10.854 -0.264 1.00 0.84 N ATOM 1860 CA SER A 437 95.584 11.874 0.062 1.00 0.81 C ATOM 1861 C SER A 437 96.034 11.760 1.528 1.00 0.83 C ATOM 1862 O SER A 437 96.653 12.661 2.058 1.00 1.35 O ATOM 1863 CB SER A 437 94.897 13.216 -0.177 1.00 0.80 C ATOM 1864 OG SER A 437 94.110 13.550 0.959 1.00 1.42 O ATOM 0 H SER A 437 93.661 10.961 0.235 1.00 0.84 H new ATOM 0 HA SER A 437 96.480 11.746 -0.545 1.00 0.81 H new ATOM 0 HB2 SER A 437 95.641 13.991 -0.359 1.00 0.80 H new ATOM 0 HB3 SER A 437 94.269 13.163 -1.066 1.00 0.80 H new ATOM 0 HG SER A 437 93.669 14.412 0.809 1.00 1.42 H new ATOM 1870 N ARG A 438 95.699 10.691 2.203 1.00 0.53 N ATOM 1871 CA ARG A 438 96.083 10.581 3.643 1.00 0.62 C ATOM 1872 C ARG A 438 96.905 9.307 3.876 1.00 0.65 C ATOM 1873 O ARG A 438 96.677 8.289 3.256 1.00 0.69 O ATOM 1874 CB ARG A 438 94.756 10.518 4.398 1.00 0.78 C ATOM 1875 CG ARG A 438 94.157 9.120 4.263 1.00 1.34 C ATOM 1876 CD ARG A 438 92.685 9.156 4.667 1.00 1.53 C ATOM 1877 NE ARG A 438 92.249 7.732 4.674 1.00 2.25 N ATOM 1878 CZ ARG A 438 92.568 6.953 5.674 1.00 2.95 C ATOM 1879 NH1 ARG A 438 93.271 7.416 6.672 1.00 3.49 N ATOM 1880 NH2 ARG A 438 92.181 5.706 5.674 1.00 3.52 N ATOM 0 H ARG A 438 95.182 9.897 1.825 1.00 0.53 H new ATOM 0 HA ARG A 438 96.700 11.416 3.975 1.00 0.62 H new ATOM 0 HB2 ARG A 438 94.912 10.758 5.450 1.00 0.78 H new ATOM 0 HB3 ARG A 438 94.064 11.261 4.001 1.00 0.78 H new ATOM 0 HG2 ARG A 438 94.255 8.768 3.236 1.00 1.34 H new ATOM 0 HG3 ARG A 438 94.701 8.417 4.894 1.00 1.34 H new ATOM 0 HD2 ARG A 438 92.557 9.612 5.649 1.00 1.53 H new ATOM 0 HD3 ARG A 438 92.097 9.745 3.963 1.00 1.53 H new ATOM 0 HE ARG A 438 91.700 7.364 3.897 1.00 2.25 H new ATOM 0 HH11 ARG A 438 93.574 8.390 6.674 1.00 3.49 H new ATOM 0 HH12 ARG A 438 93.517 6.804 7.450 1.00 3.49 H new ATOM 0 HH21 ARG A 438 91.632 5.343 4.895 1.00 3.52 H new ATOM 0 HH22 ARG A 438 92.428 5.095 6.453 1.00 3.52 H new ATOM 1894 N VAL A 439 97.909 9.389 4.702 1.00 0.67 N ATOM 1895 CA VAL A 439 98.822 8.224 4.890 1.00 0.74 C ATOM 1896 C VAL A 439 98.228 7.211 5.871 1.00 0.93 C ATOM 1897 O VAL A 439 97.898 7.539 6.994 1.00 1.41 O ATOM 1898 CB VAL A 439 100.107 8.822 5.461 1.00 0.89 C ATOM 1899 CG1 VAL A 439 101.162 7.724 5.601 1.00 0.99 C ATOM 1900 CG2 VAL A 439 100.626 9.908 4.516 1.00 0.86 C ATOM 0 H VAL A 439 98.139 10.213 5.257 1.00 0.67 H new ATOM 0 HA VAL A 439 98.989 7.688 3.956 1.00 0.74 H new ATOM 0 HB VAL A 439 99.902 9.257 6.439 1.00 0.89 H new ATOM 0 HG11 VAL A 439 102.079 8.150 6.008 1.00 0.99 H new ATOM 0 HG12 VAL A 439 100.793 6.948 6.272 1.00 0.99 H new ATOM 0 HG13 VAL A 439 101.367 7.290 4.623 1.00 0.99 H new ATOM 0 HG21 VAL A 439 101.543 10.336 4.922 1.00 0.86 H new ATOM 0 HG22 VAL A 439 100.831 9.472 3.538 1.00 0.86 H new ATOM 0 HG23 VAL A 439 99.875 10.691 4.414 1.00 0.86 H new ATOM 1910 N LEU A 440 98.136 5.969 5.472 1.00 0.79 N ATOM 1911 CA LEU A 440 97.617 4.930 6.407 1.00 1.07 C ATOM 1912 C LEU A 440 98.764 4.306 7.209 1.00 0.74 C ATOM 1913 O LEU A 440 98.575 3.875 8.329 1.00 0.88 O ATOM 1914 CB LEU A 440 96.923 3.876 5.533 1.00 1.60 C ATOM 1915 CG LEU A 440 97.808 3.495 4.345 1.00 1.48 C ATOM 1916 CD1 LEU A 440 97.688 1.994 4.084 1.00 1.79 C ATOM 1917 CD2 LEU A 440 97.343 4.258 3.105 1.00 1.57 C ATOM 0 H LEU A 440 98.396 5.632 4.545 1.00 0.79 H new ATOM 0 HA LEU A 440 96.923 5.357 7.131 1.00 1.07 H new ATOM 0 HB2 LEU A 440 96.703 2.990 6.128 1.00 1.60 H new ATOM 0 HB3 LEU A 440 95.970 4.264 5.174 1.00 1.60 H new ATOM 0 HG LEU A 440 98.845 3.747 4.567 1.00 1.48 H new ATOM 0 HD11 LEU A 440 98.318 1.720 3.238 1.00 1.79 H new ATOM 0 HD12 LEU A 440 98.010 1.444 4.968 1.00 1.79 H new ATOM 0 HD13 LEU A 440 96.651 1.746 3.859 1.00 1.79 H new ATOM 0 HD21 LEU A 440 97.971 3.989 2.256 1.00 1.57 H new ATOM 0 HD22 LEU A 440 96.307 4.000 2.886 1.00 1.57 H new ATOM 0 HD23 LEU A 440 97.419 5.330 3.288 1.00 1.57 H new ATOM 1929 N GLY A 441 99.958 4.271 6.670 1.00 0.64 N ATOM 1930 CA GLY A 441 101.093 3.691 7.454 1.00 1.02 C ATOM 1931 C GLY A 441 102.400 3.750 6.657 1.00 0.82 C ATOM 1932 O GLY A 441 102.446 4.234 5.545 1.00 0.96 O ATOM 0 H GLY A 441 100.194 4.612 5.738 1.00 0.64 H new ATOM 0 HA2 GLY A 441 101.209 4.237 8.390 1.00 1.02 H new ATOM 0 HA3 GLY A 441 100.868 2.657 7.714 1.00 1.02 H new ATOM 1936 N VAL A 442 103.469 3.263 7.237 1.00 0.56 N ATOM 1937 CA VAL A 442 104.795 3.289 6.546 1.00 0.44 C ATOM 1938 C VAL A 442 105.362 1.865 6.460 1.00 0.41 C ATOM 1939 O VAL A 442 104.986 0.995 7.220 1.00 0.41 O ATOM 1940 CB VAL A 442 105.679 4.156 7.435 1.00 0.42 C ATOM 1941 CG1 VAL A 442 107.064 4.280 6.804 1.00 0.44 C ATOM 1942 CG2 VAL A 442 105.056 5.547 7.576 1.00 0.57 C ATOM 0 H VAL A 442 103.480 2.845 8.167 1.00 0.56 H new ATOM 0 HA VAL A 442 104.731 3.676 5.529 1.00 0.44 H new ATOM 0 HB VAL A 442 105.766 3.697 8.420 1.00 0.42 H new ATOM 0 HG11 VAL A 442 107.698 4.900 7.438 1.00 0.44 H new ATOM 0 HG12 VAL A 442 107.508 3.290 6.704 1.00 0.44 H new ATOM 0 HG13 VAL A 442 106.975 4.739 5.819 1.00 0.44 H new ATOM 0 HG21 VAL A 442 105.689 6.166 8.212 1.00 0.57 H new ATOM 0 HG22 VAL A 442 104.968 6.008 6.592 1.00 0.57 H new ATOM 0 HG23 VAL A 442 104.067 5.459 8.025 1.00 0.57 H new ATOM 1952 N ILE A 443 106.229 1.603 5.517 1.00 0.42 N ATOM 1953 CA ILE A 443 106.768 0.214 5.369 1.00 0.43 C ATOM 1954 C ILE A 443 108.296 0.206 5.430 1.00 0.44 C ATOM 1955 O ILE A 443 108.962 0.871 4.669 1.00 0.51 O ATOM 1956 CB ILE A 443 106.299 -0.261 3.994 1.00 0.47 C ATOM 1957 CG1 ILE A 443 104.819 0.084 3.800 1.00 0.51 C ATOM 1958 CG2 ILE A 443 106.482 -1.775 3.895 1.00 0.56 C ATOM 1959 CD1 ILE A 443 104.020 -0.363 5.024 1.00 1.05 C ATOM 0 H ILE A 443 106.586 2.283 4.846 1.00 0.42 H new ATOM 0 HA ILE A 443 106.417 -0.433 6.173 1.00 0.43 H new ATOM 0 HB ILE A 443 106.887 0.235 3.222 1.00 0.47 H new ATOM 0 HG12 ILE A 443 104.703 1.157 3.650 1.00 0.51 H new ATOM 0 HG13 ILE A 443 104.436 -0.406 2.905 1.00 0.51 H new ATOM 0 HG21 ILE A 443 106.149 -2.119 2.916 1.00 0.56 H new ATOM 0 HG22 ILE A 443 107.535 -2.024 4.028 1.00 0.56 H new ATOM 0 HG23 ILE A 443 105.893 -2.264 4.671 1.00 0.56 H new ATOM 0 HD11 ILE A 443 102.968 -0.116 4.882 1.00 1.05 H new ATOM 0 HD12 ILE A 443 104.125 -1.440 5.154 1.00 1.05 H new ATOM 0 HD13 ILE A 443 104.396 0.148 5.910 1.00 1.05 H new ATOM 1971 N ALA A 444 108.850 -0.607 6.280 1.00 0.40 N ATOM 1972 CA ALA A 444 110.335 -0.739 6.342 1.00 0.44 C ATOM 1973 C ALA A 444 110.788 -1.958 5.535 1.00 0.43 C ATOM 1974 O ALA A 444 110.343 -3.063 5.770 1.00 0.45 O ATOM 1975 CB ALA A 444 110.647 -0.942 7.825 1.00 0.46 C ATOM 0 H ALA A 444 108.338 -1.191 6.941 1.00 0.40 H new ATOM 0 HA ALA A 444 110.847 0.130 5.928 1.00 0.44 H new ATOM 0 HB1 ALA A 444 111.723 -1.048 7.959 1.00 0.46 H new ATOM 0 HB2 ALA A 444 110.294 -0.081 8.392 1.00 0.46 H new ATOM 0 HB3 ALA A 444 110.146 -1.842 8.182 1.00 0.46 H new ATOM 1981 N LEU A 445 111.632 -1.767 4.560 1.00 0.57 N ATOM 1982 CA LEU A 445 112.067 -2.919 3.718 1.00 0.63 C ATOM 1983 C LEU A 445 113.463 -3.384 4.129 1.00 0.75 C ATOM 1984 O LEU A 445 114.363 -2.584 4.294 1.00 0.92 O ATOM 1985 CB LEU A 445 112.096 -2.379 2.290 1.00 0.81 C ATOM 1986 CG LEU A 445 110.715 -2.511 1.647 1.00 1.23 C ATOM 1987 CD1 LEU A 445 109.638 -2.036 2.625 1.00 2.11 C ATOM 1988 CD2 LEU A 445 110.664 -1.654 0.382 1.00 1.91 C ATOM 0 H LEU A 445 112.039 -0.866 4.309 1.00 0.57 H new ATOM 0 HA LEU A 445 111.400 -3.774 3.824 1.00 0.63 H new ATOM 0 HB2 LEU A 445 112.404 -1.334 2.295 1.00 0.81 H new ATOM 0 HB3 LEU A 445 112.833 -2.926 1.702 1.00 0.81 H new ATOM 0 HG LEU A 445 110.534 -3.556 1.394 1.00 1.23 H new ATOM 0 HD11 LEU A 445 108.657 -2.133 2.161 1.00 2.11 H new ATOM 0 HD12 LEU A 445 109.673 -2.644 3.529 1.00 2.11 H new ATOM 0 HD13 LEU A 445 109.816 -0.992 2.883 1.00 2.11 H new ATOM 0 HD21 LEU A 445 109.681 -1.745 -0.080 1.00 1.91 H new ATOM 0 HD22 LEU A 445 110.848 -0.611 0.641 1.00 1.91 H new ATOM 0 HD23 LEU A 445 111.427 -1.994 -0.319 1.00 1.91 H new ATOM 2000 N LYS A 446 113.686 -4.668 4.137 1.00 0.89 N ATOM 2001 CA LYS A 446 115.061 -5.187 4.355 1.00 1.15 C ATOM 2002 C LYS A 446 115.817 -5.215 3.029 1.00 1.27 C ATOM 2003 O LYS A 446 115.259 -5.520 1.994 1.00 1.87 O ATOM 2004 CB LYS A 446 114.860 -6.604 4.878 1.00 1.92 C ATOM 2005 CG LYS A 446 116.188 -7.159 5.389 1.00 2.25 C ATOM 2006 CD LYS A 446 115.977 -8.599 5.852 1.00 2.85 C ATOM 2007 CE LYS A 446 117.253 -9.114 6.523 1.00 3.64 C ATOM 2008 NZ LYS A 446 117.137 -10.599 6.476 1.00 4.48 N ATOM 0 H LYS A 446 112.971 -5.382 4.001 1.00 0.89 H new ATOM 0 HA LYS A 446 115.638 -4.572 5.045 1.00 1.15 H new ATOM 0 HB2 LYS A 446 114.122 -6.604 5.680 1.00 1.92 H new ATOM 0 HB3 LYS A 446 114.469 -7.242 4.085 1.00 1.92 H new ATOM 0 HG2 LYS A 446 116.940 -7.123 4.601 1.00 2.25 H new ATOM 0 HG3 LYS A 446 116.560 -6.549 6.212 1.00 2.25 H new ATOM 0 HD2 LYS A 446 115.141 -8.649 6.550 1.00 2.85 H new ATOM 0 HD3 LYS A 446 115.720 -9.231 5.002 1.00 2.85 H new ATOM 0 HE2 LYS A 446 118.143 -8.770 5.996 1.00 3.64 H new ATOM 0 HE3 LYS A 446 117.332 -8.756 7.549 1.00 3.64 H new ATOM 0 HZ1 LYS A 446 117.976 -11.027 6.918 1.00 4.48 H new ATOM 0 HZ2 LYS A 446 116.284 -10.897 6.991 1.00 4.48 H new ATOM 0 HZ3 LYS A 446 117.070 -10.911 5.486 1.00 4.48 H new ATOM 2022 N ASP A 447 117.081 -4.914 3.050 1.00 1.33 N ATOM 2023 CA ASP A 447 117.871 -4.942 1.786 1.00 2.04 C ATOM 2024 C ASP A 447 118.597 -6.281 1.641 1.00 1.83 C ATOM 2025 O ASP A 447 119.481 -6.608 2.407 1.00 2.21 O ATOM 2026 CB ASP A 447 118.872 -3.794 1.913 1.00 2.93 C ATOM 2027 CG ASP A 447 119.644 -3.925 3.227 1.00 3.02 C ATOM 2028 OD1 ASP A 447 119.383 -4.869 3.955 1.00 3.91 O ATOM 2029 OD2 ASP A 447 120.484 -3.078 3.485 1.00 2.75 O ATOM 0 H ASP A 447 117.604 -4.650 3.885 1.00 1.33 H new ATOM 0 HA ASP A 447 117.239 -4.831 0.905 1.00 2.04 H new ATOM 0 HB2 ASP A 447 119.564 -3.807 1.071 1.00 2.93 H new ATOM 0 HB3 ASP A 447 118.349 -2.838 1.881 1.00 2.93 H new ATOM 2034 N ILE A 448 118.275 -7.030 0.623 1.00 2.00 N ATOM 2035 CA ILE A 448 118.999 -8.312 0.385 1.00 2.26 C ATOM 2036 C ILE A 448 120.503 -8.043 0.340 1.00 2.39 C ATOM 2037 O ILE A 448 121.293 -8.738 0.946 1.00 2.75 O ATOM 2038 CB ILE A 448 118.497 -8.807 -0.977 1.00 2.53 C ATOM 2039 CG1 ILE A 448 117.116 -9.463 -0.833 1.00 3.34 C ATOM 2040 CG2 ILE A 448 119.478 -9.838 -1.544 1.00 2.71 C ATOM 2041 CD1 ILE A 448 116.230 -8.654 0.119 1.00 3.61 C ATOM 0 H ILE A 448 117.544 -6.811 -0.054 1.00 2.00 H new ATOM 0 HA ILE A 448 118.822 -9.049 1.168 1.00 2.26 H new ATOM 0 HB ILE A 448 118.422 -7.952 -1.649 1.00 2.53 H new ATOM 0 HG12 ILE A 448 116.638 -9.535 -1.810 1.00 3.34 H new ATOM 0 HG13 ILE A 448 117.228 -10.480 -0.458 1.00 3.34 H new ATOM 0 HG21 ILE A 448 119.119 -10.188 -2.512 1.00 2.71 H new ATOM 0 HG22 ILE A 448 120.459 -9.378 -1.666 1.00 2.71 H new ATOM 0 HG23 ILE A 448 119.555 -10.682 -0.859 1.00 2.71 H new ATOM 0 HD11 ILE A 448 115.256 -9.136 0.207 1.00 3.61 H new ATOM 0 HD12 ILE A 448 116.701 -8.605 1.101 1.00 3.61 H new ATOM 0 HD13 ILE A 448 116.102 -7.645 -0.273 1.00 3.61 H new ATOM 2053 N VAL A 449 120.899 -7.040 -0.391 1.00 2.65 N ATOM 2054 CA VAL A 449 122.350 -6.717 -0.503 1.00 3.38 C ATOM 2055 C VAL A 449 122.698 -5.527 0.397 1.00 3.99 C ATOM 2056 O VAL A 449 122.013 -4.524 0.407 1.00 4.70 O ATOM 2057 CB VAL A 449 122.557 -6.351 -1.970 1.00 4.18 C ATOM 2058 CG1 VAL A 449 124.040 -6.073 -2.225 1.00 5.09 C ATOM 2059 CG2 VAL A 449 122.097 -7.511 -2.855 1.00 4.27 C ATOM 0 H VAL A 449 120.278 -6.426 -0.919 1.00 2.65 H new ATOM 0 HA VAL A 449 122.984 -7.548 -0.193 1.00 3.38 H new ATOM 0 HB VAL A 449 121.975 -5.460 -2.206 1.00 4.18 H new ATOM 0 HG11 VAL A 449 124.186 -5.812 -3.273 1.00 5.09 H new ATOM 0 HG12 VAL A 449 124.369 -5.246 -1.596 1.00 5.09 H new ATOM 0 HG13 VAL A 449 124.623 -6.963 -1.988 1.00 5.09 H new ATOM 0 HG21 VAL A 449 122.245 -7.250 -3.903 1.00 4.27 H new ATOM 0 HG22 VAL A 449 122.678 -8.402 -2.618 1.00 4.27 H new ATOM 0 HG23 VAL A 449 121.040 -7.708 -2.676 1.00 4.27 H new ATOM 2069 N LYS A 450 123.773 -5.620 1.131 1.00 4.08 N ATOM 2070 CA LYS A 450 124.181 -4.480 2.001 1.00 5.12 C ATOM 2071 C LYS A 450 125.126 -3.546 1.241 1.00 5.65 C ATOM 2072 O LYS A 450 126.059 -3.982 0.595 1.00 6.68 O ATOM 2073 CB LYS A 450 124.901 -5.124 3.188 1.00 5.87 C ATOM 2074 CG LYS A 450 125.195 -4.058 4.245 1.00 5.93 C ATOM 2075 CD LYS A 450 123.900 -3.686 4.969 1.00 6.39 C ATOM 2076 CE LYS A 450 124.201 -2.653 6.058 1.00 6.77 C ATOM 2077 NZ LYS A 450 123.448 -1.435 5.650 1.00 7.50 N ATOM 0 H LYS A 450 124.386 -6.435 1.166 1.00 4.08 H new ATOM 0 HA LYS A 450 123.330 -3.878 2.319 1.00 5.12 H new ATOM 0 HB2 LYS A 450 124.285 -5.915 3.615 1.00 5.87 H new ATOM 0 HB3 LYS A 450 125.830 -5.588 2.856 1.00 5.87 H new ATOM 0 HG2 LYS A 450 125.929 -4.432 4.959 1.00 5.93 H new ATOM 0 HG3 LYS A 450 125.628 -3.175 3.775 1.00 5.93 H new ATOM 0 HD2 LYS A 450 123.178 -3.282 4.260 1.00 6.39 H new ATOM 0 HD3 LYS A 450 123.450 -4.575 5.411 1.00 6.39 H new ATOM 0 HE2 LYS A 450 123.879 -3.007 7.038 1.00 6.77 H new ATOM 0 HE3 LYS A 450 125.270 -2.452 6.127 1.00 6.77 H new ATOM 0 HZ1 LYS A 450 123.604 -0.680 6.348 1.00 7.50 H new ATOM 0 HZ2 LYS A 450 123.780 -1.118 4.717 1.00 7.50 H new ATOM 0 HZ3 LYS A 450 122.433 -1.655 5.599 1.00 7.50 H new ATOM 2091 N GLY A 451 124.891 -2.264 1.310 1.00 5.14 N ATOM 2092 CA GLY A 451 125.775 -1.304 0.591 1.00 5.92 C ATOM 2093 C GLY A 451 126.413 -0.343 1.596 1.00 6.73 C ATOM 2094 O GLY A 451 125.740 0.021 2.546 1.00 7.01 O ATOM 2095 OXT GLY A 451 127.563 0.012 1.398 1.00 7.30 O ATOM 0 H GLY A 451 124.125 -1.840 1.833 1.00 5.14 H new ATOM 0 HA2 GLY A 451 126.550 -1.845 0.047 1.00 5.92 H new ATOM 0 HA3 GLY A 451 125.199 -0.745 -0.146 1.00 5.92 H new TER 2099 GLY A 451 HETATM 2100 PG ANP A1001 116.455 3.060 -7.931 1.00 0.00 P HETATM 2101 O1G ANP A1001 117.488 4.017 -8.469 1.00 0.00 O HETATM 2102 O2G ANP A1001 115.982 3.485 -6.564 1.00 0.00 O HETATM 2103 O3G ANP A1001 116.982 1.649 -7.907 1.00 0.00 O HETATM 2104 PB ANP A1001 114.840 1.693 -9.657 1.00 0.00 P HETATM 2105 O1B ANP A1001 115.610 1.636 -10.946 1.00 0.00 O HETATM 2106 O2B ANP A1001 115.213 0.574 -8.726 1.00 0.00 O HETATM 2107 N3B ANP A1001 115.186 3.092 -8.925 1.00 0.00 N HETATM 2108 PA ANP A1001 112.166 1.507 -8.722 1.00 0.00 P HETATM 2109 O1A ANP A1001 111.163 2.598 -8.701 1.00 0.00 O HETATM 2110 O2A ANP A1001 111.632 0.133 -8.884 1.00 0.00 O HETATM 2111 O3A ANP A1001 113.248 1.798 -9.890 1.00 0.00 O HETATM 2112 O5' ANP A1001 113.059 1.577 -7.374 1.00 0.00 O HETATM 2113 C5' ANP A1001 112.692 0.895 -6.152 1.00 0.00 C HETATM 2114 C4' ANP A1001 112.345 1.913 -5.077 1.00 0.00 C HETATM 2115 O4' ANP A1001 110.974 2.371 -5.320 1.00 0.00 O HETATM 2116 C3' ANP A1001 112.354 1.082 -3.797 1.00 0.00 C HETATM 2117 O3' ANP A1001 113.579 1.210 -3.089 1.00 0.00 O HETATM 2118 C2' ANP A1001 111.218 1.676 -3.017 1.00 0.00 C HETATM 2119 O2' ANP A1001 111.625 2.819 -2.274 1.00 0.00 O HETATM 2120 C1' ANP A1001 110.241 2.056 -4.105 1.00 0.00 C HETATM 2121 N9 ANP A1001 109.339 0.899 -4.419 1.00 0.00 N HETATM 2122 C8 ANP A1001 109.727 -0.380 -4.469 1.00 0.00 C HETATM 2123 N7 ANP A1001 108.690 -1.173 -4.753 1.00 0.00 N HETATM 2124 C5 ANP A1001 107.622 -0.402 -4.894 1.00 0.00 C HETATM 2125 C6 ANP A1001 106.242 -0.615 -5.173 1.00 0.00 C HETATM 2126 N6 ANP A1001 105.773 -1.846 -5.351 1.00 0.00 N HETATM 2127 N1 ANP A1001 105.384 0.459 -5.246 1.00 0.00 N HETATM 2128 C2 ANP A1001 105.791 1.751 -5.054 1.00 0.00 C HETATM 2129 N3 ANP A1001 107.113 1.974 -4.789 1.00 0.00 N HETATM 2130 C4 ANP A1001 108.033 0.938 -4.689 1.00 0.00 C HETATM 0 HO3' ANP A1001 113.545 0.665 -2.275 1.00 0.00 H new HETATM 0 HO2' ANP A1001 112.603 2.837 -2.210 1.00 0.00 H new HETATM 0 HNB1 ANP A1001 114.638 3.938 -9.081 1.00 0.00 H new HETATM 0 HN62 ANP A1001 104.783 -1.991 -5.551 1.00 0.00 H new HETATM 0 HN61 ANP A1001 106.403 -2.646 -5.288 1.00 0.00 H new HETATM 0 H5'2 ANP A1001 111.840 0.239 -6.333 1.00 0.00 H new HETATM 0 H5'1 ANP A1001 113.515 0.264 -5.816 1.00 0.00 H new HETATM 0 H8 ANP A1001 110.747 -0.727 -4.301 1.00 0.00 H new HETATM 0 H4' ANP A1001 113.014 2.773 -5.045 1.00 0.00 H new HETATM 0 H3' ANP A1001 112.251 0.013 -3.983 1.00 0.00 H new HETATM 0 H2' ANP A1001 110.807 0.993 -2.273 1.00 0.00 H new HETATM 0 H2 ANP A1001 105.082 2.577 -5.111 1.00 0.00 H new HETATM 0 H1' ANP A1001 109.658 2.910 -3.760 1.00 0.00 H new