USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1226 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 14 LYS NZ :NH3+ -151:sc= -3.09! (180deg=-3.06!) USER MOD Set 1.2: B 81 ASN : amide:sc= -1.49! C(o=-2.2!,f=-4.3!) USER MOD Set 1.3: B 83 SER OG : rot -88:sc= 1.35 USER MOD Set 1.4: B 84 THR OG1 : rot 50:sc= 1.08 USER MOD Set 2.1: B 78 HIS : no HD1:sc= -2.27! C(o=-2.3!,f=-3.3!) USER MOD Set 2.2: B 80 SER OG : rot -150:sc= 0 USER MOD Set 3.1: B 54 LYS NZ :NH3+ 163:sc= 1.52 (180deg=0.0869) USER MOD Set 3.2: B 66 GLN : amide:sc= 0.48! C(o=-2!,f=-18!) USER MOD Set 3.3: B 76 ASN : amide:sc= -3.96! C(o=-2!,f=-15!) USER MOD Set 4.1: B 45 HIS : no HE2:sc= -0.858 K(o=-0.79,f=-1.4) USER MOD Set 4.2: B 75 THR OG1 : rot 147:sc= 0.0634 USER MOD Set 5.1: B 13 LYS NZ :NH3+ -115:sc= -0.334 (180deg=-1.59!) USER MOD Set 5.2: B 25 TYR OH : rot 180:sc= 0.828 USER MOD Single : A 397 MET CE :methyl -134:sc= -0.0227 (180deg=-2.43!) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 TYR OH : rot -35:sc= -0.767 USER MOD Single : A 406 SER OG : rot -106:sc= 0.576 USER MOD Single : A 409 SER OG : rot -95:sc= 0.813 USER MOD Single : A 410 GLN : amide:sc= 0.976 K(o=0.98,f=0) USER MOD Single : A 417 GLN : amide:sc= -0.163 X(o=-0.16,f=-0.18) USER MOD Single : A 418 MET CE :methyl -165:sc= -3.99! (180deg=-4.47!) USER MOD Single : A 419 THR OG1 : rot 152:sc= 0.606 USER MOD Single : A 423 LYS NZ :NH3+ 163:sc= -0.215 (180deg=-1.07!) USER MOD Single : A 426 TYR OH : rot 180:sc= -0.602 USER MOD Single : A 429 MET CE :methyl -160:sc= -5.14! (180deg=-5.54!) USER MOD Single : A 431 GLN : amide:sc= 0.0341 X(o=0.034,f=-0.46) USER MOD Single : A 433 MET CE :methyl -156:sc= -2.31! (180deg=-3.01!) USER MOD Single : B 17 GLN : amide:sc= -1.52 K(o=-1.5,f=-0.27) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ -150:sc= -0.131 (180deg=-1.25!) USER MOD Single : B 20 GLN : amide:sc= -0.808 K(o=-0.81,f=-0.044) USER MOD Single : B 27 MET CE :methyl -128:sc= -3.62! (180deg=-7.51!) USER MOD Single : B 38 LYS NZ :NH3+ -170:sc= 1.33 (180deg=0.781) USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -168:sc= -0.625 (180deg=-0.683) USER MOD Single : B 47 TYR OH : rot 110:sc= -0.818 USER MOD Single : B 51 LYS NZ :NH3+ -160:sc= 1.06 (180deg=0.709) USER MOD Single : B 52 CYS SG : rot 11:sc= -0.304 USER MOD Single : B 53 GLN : amide:sc= -7.57! C(o=-7.6!,f=-12!) USER MOD Single : B 56 SER OG : rot -81:sc= 1.64 USER MOD Single : B 60 LYS NZ :NH3+ 147:sc= 1.41 (180deg=-1.88) USER MOD Single : B 62 LYS NZ :NH3+ -150:sc= 1.29! (180deg=0.0661) USER MOD Single : B 64 GLN : amide:sc= -4.77! C(o=-4.8!,f=-4.8!) USER MOD Single : B 70 HIS : no HE2:sc= -5.4! C(o=-5.4!,f=-9.6!) USER MOD Single : B 74 THR OG1 : rot 30:sc= 0.38 USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 1.28 (180deg=1.28) USER MOD Single : B 93 LYS NZ :NH3+ 153:sc= 2.17 (180deg=-0.313) USER MOD Single : B 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 GLN : amide:sc= -2.03! X(o=-2!,f=-1.8) USER MOD Single : B 102 LYS NZ :NH3+ 151:sc= 0.719 (180deg=0.084) USER MOD Single : B 104 LYS NZ :NH3+ 163:sc= 0.0689! (180deg=-0.445) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 10.216 11.624 12.152 1.00 0.00 N ATOM 59 CA GLU A 382 9.168 12.412 12.794 1.00 0.00 C ATOM 60 C GLU A 382 7.874 12.345 11.998 1.00 0.00 C ATOM 61 O GLU A 382 7.483 13.304 11.330 1.00 0.00 O ATOM 62 CB GLU A 382 9.617 13.868 12.957 1.00 0.00 C ATOM 63 CG GLU A 382 10.873 14.217 12.170 1.00 0.00 C ATOM 64 CD GLU A 382 10.634 14.289 10.676 1.00 0.00 C ATOM 65 OE1 GLU A 382 9.999 15.258 10.211 1.00 0.00 O ATOM 66 OE2 GLU A 382 11.075 13.369 9.964 1.00 0.00 O ATOM 0 HA GLU A 382 8.984 11.990 13.782 1.00 0.00 H new ATOM 0 HB2 GLU A 382 8.807 14.525 12.641 1.00 0.00 H new ATOM 0 HB3 GLU A 382 9.795 14.067 14.014 1.00 0.00 H new ATOM 0 HG2 GLU A 382 11.258 15.176 12.517 1.00 0.00 H new ATOM 0 HG3 GLU A 382 11.642 13.472 12.374 1.00 0.00 H new ATOM 73 N GLU A 383 7.212 11.204 12.073 1.00 0.00 N ATOM 74 CA GLU A 383 5.971 11.001 11.353 1.00 0.00 C ATOM 75 C GLU A 383 4.893 10.443 12.278 1.00 0.00 C ATOM 76 O GLU A 383 5.002 10.536 13.499 1.00 0.00 O ATOM 77 CB GLU A 383 6.196 10.051 10.174 1.00 0.00 C ATOM 78 CG GLU A 383 7.521 10.264 9.459 1.00 0.00 C ATOM 79 CD GLU A 383 7.348 10.671 8.014 1.00 0.00 C ATOM 80 OE1 GLU A 383 6.858 9.843 7.222 1.00 0.00 O ATOM 81 OE2 GLU A 383 7.694 11.822 7.673 1.00 0.00 O ATOM 0 H GLU A 383 7.515 10.403 12.627 1.00 0.00 H new ATOM 0 HA GLU A 383 5.632 11.965 10.974 1.00 0.00 H new ATOM 0 HB2 GLU A 383 6.149 9.023 10.534 1.00 0.00 H new ATOM 0 HB3 GLU A 383 5.383 10.176 9.458 1.00 0.00 H new ATOM 0 HG2 GLU A 383 8.092 11.031 9.982 1.00 0.00 H new ATOM 0 HG3 GLU A 383 8.105 9.345 9.505 1.00 0.00 H new ATOM 88 N ASP A 384 3.864 9.862 11.668 1.00 0.00 N ATOM 89 CA ASP A 384 2.717 9.274 12.375 1.00 0.00 C ATOM 90 C ASP A 384 1.976 10.318 13.205 1.00 0.00 C ATOM 91 O ASP A 384 1.438 10.027 14.270 1.00 0.00 O ATOM 92 CB ASP A 384 3.130 8.087 13.245 1.00 0.00 C ATOM 93 CG ASP A 384 2.134 6.949 13.128 1.00 0.00 C ATOM 94 OD1 ASP A 384 0.947 7.213 12.834 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.534 5.780 13.294 1.00 0.00 O ATOM 0 H ASP A 384 3.797 9.782 10.653 1.00 0.00 H new ATOM 0 HA ASP A 384 2.034 8.902 11.611 1.00 0.00 H new ATOM 0 HB2 ASP A 384 4.119 7.740 12.946 1.00 0.00 H new ATOM 0 HB3 ASP A 384 3.204 8.404 14.285 1.00 0.00 H new ATOM 100 N ASP A 385 1.940 11.534 12.681 1.00 0.00 N ATOM 101 CA ASP A 385 1.264 12.646 13.342 1.00 0.00 C ATOM 102 C ASP A 385 -0.182 12.767 12.854 1.00 0.00 C ATOM 103 O ASP A 385 -1.029 13.362 13.512 1.00 0.00 O ATOM 104 CB ASP A 385 2.038 13.944 13.064 1.00 0.00 C ATOM 105 CG ASP A 385 1.309 15.197 13.516 1.00 0.00 C ATOM 106 OD1 ASP A 385 1.268 15.460 14.730 1.00 0.00 O ATOM 107 OD2 ASP A 385 0.801 15.932 12.639 1.00 0.00 O ATOM 0 H ASP A 385 2.375 11.779 11.792 1.00 0.00 H new ATOM 0 HA ASP A 385 1.239 12.463 14.416 1.00 0.00 H new ATOM 0 HB2 ASP A 385 3.004 13.895 13.566 1.00 0.00 H new ATOM 0 HB3 ASP A 385 2.238 14.016 11.995 1.00 0.00 H new ATOM 112 N GLU A 386 -0.466 12.147 11.711 1.00 0.00 N ATOM 113 CA GLU A 386 -1.783 12.190 11.105 1.00 0.00 C ATOM 114 C GLU A 386 -1.801 11.168 9.999 1.00 0.00 C ATOM 115 O GLU A 386 -1.442 11.476 8.862 1.00 0.00 O ATOM 116 CB GLU A 386 -2.056 13.567 10.512 1.00 0.00 C ATOM 117 CG GLU A 386 -3.253 14.283 11.106 1.00 0.00 C ATOM 118 CD GLU A 386 -3.619 15.526 10.324 1.00 0.00 C ATOM 119 OE1 GLU A 386 -2.701 16.311 9.998 1.00 0.00 O ATOM 120 OE2 GLU A 386 -4.813 15.716 10.028 1.00 0.00 O ATOM 0 H GLU A 386 0.215 11.602 11.183 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.546 11.982 11.856 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.172 14.189 10.650 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.208 13.462 9.438 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -4.106 13.605 11.128 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -3.036 14.556 12.139 1.00 0.00 H new ATOM 127 N PHE A 387 -2.147 9.943 10.327 1.00 0.00 N ATOM 128 CA PHE A 387 -2.149 8.902 9.328 1.00 0.00 C ATOM 129 C PHE A 387 -3.451 8.127 9.314 1.00 0.00 C ATOM 130 O PHE A 387 -3.937 7.681 10.352 1.00 0.00 O ATOM 131 CB PHE A 387 -0.983 7.926 9.550 1.00 0.00 C ATOM 132 CG PHE A 387 0.356 8.435 9.091 1.00 0.00 C ATOM 133 CD1 PHE A 387 0.914 9.559 9.662 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.059 7.790 8.083 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.129 10.031 9.245 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.282 8.262 7.666 1.00 0.00 C ATOM 137 CZ PHE A 387 2.814 9.384 8.249 1.00 0.00 C ATOM 0 H PHE A 387 -2.426 9.648 11.263 1.00 0.00 H new ATOM 0 HA PHE A 387 -2.034 9.397 8.364 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.922 7.689 10.612 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -1.202 6.995 9.028 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.385 10.074 10.450 1.00 0.00 H new ATOM 0 HD2 PHE A 387 0.641 6.908 7.621 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.549 10.915 9.701 1.00 0.00 H new ATOM 0 HE2 PHE A 387 2.821 7.751 6.882 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.773 9.758 7.923 1.00 0.00 H new ATOM 147 N GLU A 388 -3.977 7.949 8.117 1.00 0.00 N ATOM 148 CA GLU A 388 -5.195 7.200 7.909 1.00 0.00 C ATOM 149 C GLU A 388 -4.780 5.797 7.593 1.00 0.00 C ATOM 150 O GLU A 388 -4.040 5.595 6.628 1.00 0.00 O ATOM 151 CB GLU A 388 -5.998 7.744 6.721 1.00 0.00 C ATOM 152 CG GLU A 388 -6.720 9.047 6.985 1.00 0.00 C ATOM 153 CD GLU A 388 -7.771 8.929 8.069 1.00 0.00 C ATOM 154 OE1 GLU A 388 -7.403 8.972 9.260 1.00 0.00 O ATOM 155 OE2 GLU A 388 -8.964 8.792 7.726 1.00 0.00 O ATOM 0 H GLU A 388 -3.568 8.322 7.261 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.824 7.268 8.797 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.322 7.884 5.878 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.730 6.994 6.422 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.994 9.808 7.271 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.192 9.388 6.064 1.00 0.00 H new ATOM 162 N GLU A 389 -5.185 4.837 8.398 1.00 0.00 N ATOM 163 CA GLU A 389 -4.810 3.475 8.110 1.00 0.00 C ATOM 164 C GLU A 389 -5.456 3.090 6.790 1.00 0.00 C ATOM 165 O GLU A 389 -6.670 2.899 6.709 1.00 0.00 O ATOM 166 CB GLU A 389 -5.204 2.503 9.231 1.00 0.00 C ATOM 167 CG GLU A 389 -4.276 1.294 9.301 1.00 0.00 C ATOM 168 CD GLU A 389 -4.414 0.485 10.577 1.00 0.00 C ATOM 169 OE1 GLU A 389 -4.268 1.066 11.671 1.00 0.00 O ATOM 170 OE2 GLU A 389 -4.630 -0.748 10.485 1.00 0.00 O ATOM 0 H GLU A 389 -5.757 4.970 9.232 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.724 3.408 8.040 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -5.187 3.027 10.186 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -6.228 2.164 9.072 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -4.476 0.645 8.448 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -3.245 1.634 9.208 1.00 0.00 H new ATOM 177 N VAL A 390 -4.640 3.006 5.749 1.00 0.00 N ATOM 178 CA VAL A 390 -5.141 2.677 4.442 1.00 0.00 C ATOM 179 C VAL A 390 -5.436 1.194 4.407 1.00 0.00 C ATOM 180 O VAL A 390 -4.678 0.394 4.953 1.00 0.00 O ATOM 181 CB VAL A 390 -4.144 2.982 3.302 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.862 3.088 1.969 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.359 4.240 3.561 1.00 0.00 C ATOM 0 H VAL A 390 -3.633 3.162 5.794 1.00 0.00 H new ATOM 0 HA VAL A 390 -6.026 3.291 4.278 1.00 0.00 H new ATOM 0 HB VAL A 390 -3.442 2.149 3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -4.139 3.303 1.182 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -5.366 2.146 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.598 3.891 2.015 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.671 4.416 2.734 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -4.043 5.084 3.649 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.794 4.132 4.487 1.00 0.00 H new ATOM 193 N ALA A 391 -6.526 0.832 3.782 1.00 0.00 N ATOM 194 CA ALA A 391 -6.903 -0.553 3.682 1.00 0.00 C ATOM 195 C ALA A 391 -6.465 -1.107 2.344 1.00 0.00 C ATOM 196 O ALA A 391 -6.545 -0.421 1.331 1.00 0.00 O ATOM 197 CB ALA A 391 -8.405 -0.708 3.864 1.00 0.00 C ATOM 0 H ALA A 391 -7.171 1.482 3.332 1.00 0.00 H new ATOM 0 HA ALA A 391 -6.407 -1.116 4.473 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.674 -1.761 3.786 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.693 -0.332 4.846 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.925 -0.142 3.091 1.00 0.00 H new ATOM 203 N ASP A 392 -5.929 -2.309 2.374 1.00 0.00 N ATOM 204 CA ASP A 392 -5.502 -3.022 1.178 1.00 0.00 C ATOM 205 C ASP A 392 -6.721 -3.398 0.346 1.00 0.00 C ATOM 206 O ASP A 392 -7.110 -4.562 0.263 1.00 0.00 O ATOM 207 CB ASP A 392 -4.708 -4.280 1.563 1.00 0.00 C ATOM 208 CG ASP A 392 -5.309 -5.059 2.724 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.437 -4.493 3.834 1.00 0.00 O ATOM 210 OD2 ASP A 392 -5.611 -6.260 2.551 1.00 0.00 O ATOM 0 H ASP A 392 -5.774 -2.829 3.238 1.00 0.00 H new ATOM 0 HA ASP A 392 -4.854 -2.375 0.587 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.642 -4.935 0.695 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.690 -3.990 1.822 1.00 0.00 H new ATOM 215 N ASP A 393 -7.310 -2.394 -0.276 1.00 0.00 N ATOM 216 CA ASP A 393 -8.512 -2.578 -1.063 1.00 0.00 C ATOM 217 C ASP A 393 -8.230 -2.621 -2.558 1.00 0.00 C ATOM 218 O ASP A 393 -7.667 -1.683 -3.124 1.00 0.00 O ATOM 219 CB ASP A 393 -9.483 -1.451 -0.753 1.00 0.00 C ATOM 220 CG ASP A 393 -10.929 -1.851 -0.985 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.398 -1.776 -2.139 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.608 -2.238 -0.013 1.00 0.00 O ATOM 0 H ASP A 393 -6.970 -1.433 -0.250 1.00 0.00 H new ATOM 0 HA ASP A 393 -8.943 -3.542 -0.794 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.357 -1.142 0.285 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -9.244 -0.588 -1.374 1.00 0.00 H new ATOM 227 N PRO A 394 -8.622 -3.720 -3.213 1.00 0.00 N ATOM 228 CA PRO A 394 -8.430 -3.901 -4.646 1.00 0.00 C ATOM 229 C PRO A 394 -9.548 -3.274 -5.474 1.00 0.00 C ATOM 230 O PRO A 394 -10.595 -2.889 -4.950 1.00 0.00 O ATOM 231 CB PRO A 394 -8.463 -5.416 -4.795 1.00 0.00 C ATOM 232 CG PRO A 394 -9.415 -5.864 -3.740 1.00 0.00 C ATOM 233 CD PRO A 394 -9.272 -4.889 -2.597 1.00 0.00 C ATOM 0 HA PRO A 394 -7.515 -3.426 -5.000 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -8.801 -5.712 -5.788 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.475 -5.852 -4.651 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.437 -5.873 -4.118 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.186 -6.879 -3.416 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.240 -4.629 -2.169 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.668 -5.304 -1.790 1.00 0.00 H new ATOM 241 N ILE A 395 -9.327 -3.203 -6.772 1.00 0.00 N ATOM 242 CA ILE A 395 -10.303 -2.633 -7.682 1.00 0.00 C ATOM 243 C ILE A 395 -11.035 -3.741 -8.427 1.00 0.00 C ATOM 244 O ILE A 395 -10.436 -4.490 -9.201 1.00 0.00 O ATOM 245 CB ILE A 395 -9.635 -1.674 -8.699 1.00 0.00 C ATOM 246 CG1 ILE A 395 -9.283 -0.354 -8.021 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.531 -1.425 -9.909 1.00 0.00 C ATOM 248 CD1 ILE A 395 -10.478 0.361 -7.430 1.00 0.00 C ATOM 0 H ILE A 395 -8.475 -3.535 -7.223 1.00 0.00 H new ATOM 0 HA ILE A 395 -11.015 -2.060 -7.089 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.721 -2.149 -9.056 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.556 -0.543 -7.231 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.801 0.301 -8.747 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -10.029 -0.748 -10.600 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.735 -2.371 -10.411 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -11.470 -0.978 -9.581 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -10.152 1.291 -6.965 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -11.196 0.582 -8.219 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.948 -0.275 -6.680 1.00 0.00 H new ATOM 260 N VAL A 396 -12.322 -3.851 -8.172 1.00 0.00 N ATOM 261 CA VAL A 396 -13.144 -4.849 -8.823 1.00 0.00 C ATOM 262 C VAL A 396 -14.240 -4.152 -9.618 1.00 0.00 C ATOM 263 O VAL A 396 -15.074 -3.434 -9.065 1.00 0.00 O ATOM 264 CB VAL A 396 -13.723 -5.871 -7.806 1.00 0.00 C ATOM 265 CG1 VAL A 396 -14.045 -5.220 -6.471 1.00 0.00 C ATOM 266 CG2 VAL A 396 -14.933 -6.601 -8.365 1.00 0.00 C ATOM 0 H VAL A 396 -12.824 -3.256 -7.513 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.525 -5.426 -9.510 1.00 0.00 H new ATOM 0 HB VAL A 396 -12.944 -6.613 -7.630 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.447 -5.969 -5.789 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -13.137 -4.793 -6.046 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.782 -4.431 -6.619 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.307 -7.306 -7.623 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.714 -5.880 -8.606 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.647 -7.142 -9.267 1.00 0.00 H new ATOM 276 N MET A 397 -14.218 -4.352 -10.925 1.00 0.00 N ATOM 277 CA MET A 397 -15.175 -3.721 -11.801 1.00 0.00 C ATOM 278 C MET A 397 -16.458 -4.515 -11.820 1.00 0.00 C ATOM 279 O MET A 397 -16.443 -5.739 -11.731 1.00 0.00 O ATOM 280 CB MET A 397 -14.607 -3.598 -13.219 1.00 0.00 C ATOM 281 CG MET A 397 -13.141 -3.192 -13.251 1.00 0.00 C ATOM 282 SD MET A 397 -12.521 -2.912 -14.921 1.00 0.00 S ATOM 283 CE MET A 397 -13.184 -1.284 -15.259 1.00 0.00 C ATOM 0 H MET A 397 -13.542 -4.951 -11.399 1.00 0.00 H new ATOM 0 HA MET A 397 -15.383 -2.719 -11.426 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.723 -4.552 -13.733 1.00 0.00 H new ATOM 0 HB3 MET A 397 -15.192 -2.864 -13.774 1.00 0.00 H new ATOM 0 HG2 MET A 397 -13.009 -2.283 -12.664 1.00 0.00 H new ATOM 0 HG3 MET A 397 -12.544 -3.969 -12.774 1.00 0.00 H new ATOM 0 HE1 MET A 397 -13.630 -1.272 -16.254 1.00 0.00 H new ATOM 0 HE2 MET A 397 -13.944 -1.040 -14.517 1.00 0.00 H new ATOM 0 HE3 MET A 397 -12.382 -0.548 -15.212 1.00 0.00 H new ATOM 293 N VAL A 398 -17.559 -3.802 -11.878 1.00 0.00 N ATOM 294 CA VAL A 398 -18.865 -4.415 -11.933 1.00 0.00 C ATOM 295 C VAL A 398 -19.655 -3.817 -13.080 1.00 0.00 C ATOM 296 O VAL A 398 -19.939 -2.613 -13.089 1.00 0.00 O ATOM 297 CB VAL A 398 -19.650 -4.234 -10.628 1.00 0.00 C ATOM 298 CG1 VAL A 398 -21.040 -4.809 -10.789 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.930 -4.898 -9.466 1.00 0.00 C ATOM 0 H VAL A 398 -17.574 -2.782 -11.888 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.718 -5.484 -12.084 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.726 -3.169 -10.408 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.597 -4.680 -9.861 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -21.557 -4.291 -11.597 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -20.969 -5.871 -11.025 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.506 -4.756 -8.552 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.823 -5.964 -9.666 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.943 -4.451 -9.346 1.00 0.00 H new ATOM 309 N ALA A 399 -19.995 -4.660 -14.044 1.00 0.00 N ATOM 310 CA ALA A 399 -20.723 -4.252 -15.229 1.00 0.00 C ATOM 311 C ALA A 399 -19.883 -3.257 -16.023 1.00 0.00 C ATOM 312 O ALA A 399 -20.412 -2.372 -16.697 1.00 0.00 O ATOM 313 CB ALA A 399 -22.086 -3.671 -14.865 1.00 0.00 C ATOM 0 H ALA A 399 -19.770 -5.655 -14.022 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.909 -5.127 -15.852 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -22.609 -3.374 -15.774 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -22.673 -4.423 -14.338 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -21.951 -2.801 -14.223 1.00 0.00 H new ATOM 319 N GLY A 400 -18.560 -3.398 -15.914 1.00 0.00 N ATOM 320 CA GLY A 400 -17.658 -2.509 -16.623 1.00 0.00 C ATOM 321 C GLY A 400 -17.317 -1.270 -15.819 1.00 0.00 C ATOM 322 O GLY A 400 -16.409 -0.520 -16.174 1.00 0.00 O ATOM 0 H GLY A 400 -18.101 -4.112 -15.348 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -16.741 -3.045 -16.866 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -18.113 -2.212 -17.568 1.00 0.00 H new ATOM 326 N ARG A 401 -18.043 -1.057 -14.732 1.00 0.00 N ATOM 327 CA ARG A 401 -17.817 0.095 -13.873 1.00 0.00 C ATOM 328 C ARG A 401 -16.789 -0.251 -12.806 1.00 0.00 C ATOM 329 O ARG A 401 -17.014 -1.144 -11.992 1.00 0.00 O ATOM 330 CB ARG A 401 -19.126 0.536 -13.217 1.00 0.00 C ATOM 331 CG ARG A 401 -20.251 0.791 -14.207 1.00 0.00 C ATOM 332 CD ARG A 401 -21.614 0.683 -13.542 1.00 0.00 C ATOM 333 NE ARG A 401 -21.853 -0.657 -12.999 1.00 0.00 N ATOM 334 CZ ARG A 401 -22.982 -1.035 -12.402 1.00 0.00 C ATOM 335 NH1 ARG A 401 -23.983 -0.172 -12.252 1.00 0.00 N ATOM 336 NH2 ARG A 401 -23.111 -2.281 -11.954 1.00 0.00 N ATOM 0 H ARG A 401 -18.797 -1.670 -14.423 1.00 0.00 H new ATOM 0 HA ARG A 401 -17.439 0.917 -14.480 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -19.443 -0.230 -12.509 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -18.946 1.445 -12.643 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -20.135 1.783 -14.643 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -20.186 0.074 -15.025 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -21.686 1.418 -12.740 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -22.392 0.925 -14.267 1.00 0.00 H new ATOM 0 HE ARG A 401 -21.105 -1.346 -13.084 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -23.888 0.784 -12.595 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -24.846 -0.466 -11.794 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -22.346 -2.946 -12.068 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -23.975 -2.572 -11.497 1.00 0.00 H new ATOM 350 N PRO A 402 -15.645 0.443 -12.797 1.00 0.00 N ATOM 351 CA PRO A 402 -14.576 0.181 -11.832 1.00 0.00 C ATOM 352 C PRO A 402 -14.920 0.630 -10.416 1.00 0.00 C ATOM 353 O PRO A 402 -15.000 1.823 -10.127 1.00 0.00 O ATOM 354 CB PRO A 402 -13.397 0.989 -12.379 1.00 0.00 C ATOM 355 CG PRO A 402 -14.028 2.101 -13.144 1.00 0.00 C ATOM 356 CD PRO A 402 -15.300 1.541 -13.719 1.00 0.00 C ATOM 0 HA PRO A 402 -14.378 -0.887 -11.738 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -12.768 1.368 -11.573 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -12.761 0.378 -13.019 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -14.235 2.952 -12.495 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -13.366 2.456 -13.934 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -16.087 2.294 -13.758 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -15.154 1.179 -14.737 1.00 0.00 H new ATOM 364 N PHE A 403 -15.136 -0.339 -9.546 1.00 0.00 N ATOM 365 CA PHE A 403 -15.443 -0.069 -8.155 1.00 0.00 C ATOM 366 C PHE A 403 -14.367 -0.691 -7.287 1.00 0.00 C ATOM 367 O PHE A 403 -13.539 -1.458 -7.774 1.00 0.00 O ATOM 368 CB PHE A 403 -16.801 -0.662 -7.763 1.00 0.00 C ATOM 369 CG PHE A 403 -17.978 -0.070 -8.483 1.00 0.00 C ATOM 370 CD1 PHE A 403 -18.262 1.282 -8.389 1.00 0.00 C ATOM 371 CD2 PHE A 403 -18.808 -0.875 -9.246 1.00 0.00 C ATOM 372 CE1 PHE A 403 -19.355 1.821 -9.041 1.00 0.00 C ATOM 373 CE2 PHE A 403 -19.900 -0.343 -9.902 1.00 0.00 C ATOM 374 CZ PHE A 403 -20.174 1.007 -9.800 1.00 0.00 C ATOM 0 H PHE A 403 -15.104 -1.331 -9.783 1.00 0.00 H new ATOM 0 HA PHE A 403 -15.482 1.011 -8.011 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.781 -1.736 -7.951 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -16.944 -0.528 -6.691 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -17.622 1.922 -7.800 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -18.598 -1.931 -9.329 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -19.569 2.876 -8.957 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -20.539 -0.981 -10.494 1.00 0.00 H new ATOM 0 HZ PHE A 403 -21.027 1.426 -10.313 1.00 0.00 H new ATOM 384 N SER A 404 -14.355 -0.353 -6.021 1.00 0.00 N ATOM 385 CA SER A 404 -13.398 -0.937 -5.109 1.00 0.00 C ATOM 386 C SER A 404 -14.043 -2.153 -4.456 1.00 0.00 C ATOM 387 O SER A 404 -15.245 -2.375 -4.609 1.00 0.00 O ATOM 388 CB SER A 404 -12.965 0.086 -4.064 1.00 0.00 C ATOM 389 OG SER A 404 -12.751 1.358 -4.657 1.00 0.00 O ATOM 0 H SER A 404 -14.994 0.321 -5.598 1.00 0.00 H new ATOM 0 HA SER A 404 -12.503 -1.246 -5.648 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.728 0.165 -3.289 1.00 0.00 H new ATOM 0 HB3 SER A 404 -12.050 -0.251 -3.577 1.00 0.00 H new ATOM 0 HG SER A 404 -12.476 1.998 -3.968 1.00 0.00 H new ATOM 395 N TYR A 405 -13.273 -2.932 -3.730 1.00 0.00 N ATOM 396 CA TYR A 405 -13.798 -4.121 -3.088 1.00 0.00 C ATOM 397 C TYR A 405 -14.787 -3.738 -2.001 1.00 0.00 C ATOM 398 O TYR A 405 -15.876 -4.306 -1.925 1.00 0.00 O ATOM 399 CB TYR A 405 -12.673 -4.974 -2.512 1.00 0.00 C ATOM 400 CG TYR A 405 -13.126 -6.344 -2.060 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.650 -6.545 -0.789 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.037 -7.434 -2.913 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.074 -7.794 -0.382 1.00 0.00 C ATOM 404 CE2 TYR A 405 -13.456 -8.687 -2.513 1.00 0.00 C ATOM 405 CZ TYR A 405 -13.974 -8.862 -1.248 1.00 0.00 C ATOM 406 OH TYR A 405 -14.398 -10.107 -0.849 1.00 0.00 O ATOM 0 H TYR A 405 -12.280 -2.765 -3.568 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.317 -4.714 -3.841 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -11.892 -5.088 -3.264 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.227 -4.450 -1.667 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.727 -5.710 -0.108 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -12.634 -7.300 -3.906 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.481 -7.934 0.608 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -13.378 -9.526 -3.188 1.00 0.00 H new ATOM 0 HH TYR A 405 -14.210 -10.226 0.105 1.00 0.00 H new ATOM 416 N SER A 406 -14.419 -2.763 -1.177 1.00 0.00 N ATOM 417 CA SER A 406 -15.294 -2.292 -0.109 1.00 0.00 C ATOM 418 C SER A 406 -16.532 -1.626 -0.701 1.00 0.00 C ATOM 419 O SER A 406 -17.544 -1.444 -0.029 1.00 0.00 O ATOM 420 CB SER A 406 -14.547 -1.314 0.797 1.00 0.00 C ATOM 421 OG SER A 406 -13.593 -0.574 0.059 1.00 0.00 O ATOM 0 H SER A 406 -13.520 -2.283 -1.228 1.00 0.00 H new ATOM 0 HA SER A 406 -15.608 -3.147 0.489 1.00 0.00 H new ATOM 0 HB2 SER A 406 -15.256 -0.634 1.268 1.00 0.00 H new ATOM 0 HB3 SER A 406 -14.049 -1.861 1.598 1.00 0.00 H new ATOM 0 HG SER A 406 -12.693 -0.897 0.272 1.00 0.00 H new ATOM 427 N GLU A 407 -16.441 -1.290 -1.975 1.00 0.00 N ATOM 428 CA GLU A 407 -17.528 -0.657 -2.695 1.00 0.00 C ATOM 429 C GLU A 407 -18.492 -1.731 -3.188 1.00 0.00 C ATOM 430 O GLU A 407 -19.701 -1.702 -2.915 1.00 0.00 O ATOM 431 CB GLU A 407 -16.951 0.132 -3.875 1.00 0.00 C ATOM 432 CG GLU A 407 -16.481 1.533 -3.514 1.00 0.00 C ATOM 433 CD GLU A 407 -17.618 2.434 -3.090 1.00 0.00 C ATOM 434 OE1 GLU A 407 -18.015 2.378 -1.911 1.00 0.00 O ATOM 435 OE2 GLU A 407 -18.145 3.177 -3.943 1.00 0.00 O ATOM 0 H GLU A 407 -15.607 -1.450 -2.540 1.00 0.00 H new ATOM 0 HA GLU A 407 -18.069 0.028 -2.042 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -16.113 -0.424 -4.295 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.709 0.204 -4.655 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -15.751 1.471 -2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -15.972 1.974 -4.371 1.00 0.00 H new ATOM 442 N VAL A 408 -17.920 -2.699 -3.892 1.00 0.00 N ATOM 443 CA VAL A 408 -18.665 -3.815 -4.446 1.00 0.00 C ATOM 444 C VAL A 408 -19.347 -4.629 -3.342 1.00 0.00 C ATOM 445 O VAL A 408 -20.475 -5.087 -3.505 1.00 0.00 O ATOM 446 CB VAL A 408 -17.731 -4.735 -5.265 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.469 -5.955 -5.767 1.00 0.00 C ATOM 448 CG2 VAL A 408 -17.113 -3.986 -6.432 1.00 0.00 C ATOM 0 H VAL A 408 -16.921 -2.729 -4.094 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.434 -3.406 -5.101 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.932 -5.063 -4.600 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.786 -6.583 -6.339 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.857 -6.520 -4.919 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.296 -5.643 -6.405 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.461 -4.657 -6.991 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.903 -3.618 -7.087 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.531 -3.144 -6.057 1.00 0.00 H new ATOM 458 N SER A 409 -18.662 -4.787 -2.214 1.00 0.00 N ATOM 459 CA SER A 409 -19.202 -5.554 -1.093 1.00 0.00 C ATOM 460 C SER A 409 -20.326 -4.799 -0.384 1.00 0.00 C ATOM 461 O SER A 409 -21.185 -5.410 0.249 1.00 0.00 O ATOM 462 CB SER A 409 -18.092 -5.898 -0.097 1.00 0.00 C ATOM 463 OG SER A 409 -17.311 -4.759 0.215 1.00 0.00 O ATOM 0 H SER A 409 -17.734 -4.396 -2.050 1.00 0.00 H new ATOM 0 HA SER A 409 -19.619 -6.476 -1.497 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.531 -6.302 0.815 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.454 -6.676 -0.515 1.00 0.00 H new ATOM 0 HG SER A 409 -16.522 -4.735 -0.365 1.00 0.00 H new ATOM 469 N GLN A 410 -20.313 -3.475 -0.491 1.00 0.00 N ATOM 470 CA GLN A 410 -21.332 -2.653 0.145 1.00 0.00 C ATOM 471 C GLN A 410 -22.667 -2.781 -0.568 1.00 0.00 C ATOM 472 O GLN A 410 -23.718 -2.757 0.067 1.00 0.00 O ATOM 473 CB GLN A 410 -20.916 -1.183 0.167 1.00 0.00 C ATOM 474 CG GLN A 410 -20.137 -0.778 1.405 1.00 0.00 C ATOM 475 CD GLN A 410 -19.777 0.693 1.394 1.00 0.00 C ATOM 476 OE1 GLN A 410 -20.514 1.529 1.913 1.00 0.00 O ATOM 477 NE2 GLN A 410 -18.649 1.018 0.789 1.00 0.00 N ATOM 0 H GLN A 410 -19.610 -2.950 -1.011 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.439 -3.012 1.168 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -20.310 -0.975 -0.715 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -21.809 -0.563 0.094 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -20.728 -1.000 2.294 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -19.226 -1.373 1.471 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -18.067 0.292 0.371 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -18.360 1.995 0.739 1.00 0.00 H new ATOM 486 N ARG A 411 -22.627 -2.902 -1.888 1.00 0.00 N ATOM 487 CA ARG A 411 -23.863 -3.012 -2.656 1.00 0.00 C ATOM 488 C ARG A 411 -24.105 -4.426 -3.169 1.00 0.00 C ATOM 489 O ARG A 411 -23.447 -4.888 -4.117 1.00 0.00 O ATOM 490 CB ARG A 411 -23.876 -2.048 -3.846 1.00 0.00 C ATOM 491 CG ARG A 411 -24.023 -0.584 -3.473 1.00 0.00 C ATOM 492 CD ARG A 411 -22.713 -0.027 -2.964 1.00 0.00 C ATOM 493 NE ARG A 411 -22.281 1.163 -3.690 1.00 0.00 N ATOM 494 CZ ARG A 411 -21.143 1.799 -3.427 1.00 0.00 C ATOM 495 NH1 ARG A 411 -20.399 1.417 -2.399 1.00 0.00 N ATOM 496 NH2 ARG A 411 -20.756 2.828 -4.172 1.00 0.00 N ATOM 0 H ARG A 411 -21.771 -2.926 -2.442 1.00 0.00 H new ATOM 0 HA ARG A 411 -24.663 -2.749 -1.964 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -22.951 -2.175 -4.409 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -24.695 -2.324 -4.511 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -24.353 -0.014 -4.341 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -24.792 -0.474 -2.708 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -22.814 0.216 -1.906 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -21.943 -0.794 -3.043 1.00 0.00 H new ATOM 0 HE ARG A 411 -22.879 1.523 -4.433 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -20.700 0.638 -1.813 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -19.525 1.902 -2.194 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -21.333 3.137 -4.954 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -19.881 3.309 -3.962 1.00 0.00 H new ATOM 510 N PRO A 412 -25.050 -5.144 -2.547 1.00 0.00 N ATOM 511 CA PRO A 412 -25.424 -6.482 -2.983 1.00 0.00 C ATOM 512 C PRO A 412 -25.932 -6.446 -4.421 1.00 0.00 C ATOM 513 O PRO A 412 -25.868 -7.442 -5.138 1.00 0.00 O ATOM 514 CB PRO A 412 -26.546 -6.886 -2.019 1.00 0.00 C ATOM 515 CG PRO A 412 -26.355 -6.013 -0.827 1.00 0.00 C ATOM 516 CD PRO A 412 -25.804 -4.720 -1.353 1.00 0.00 C ATOM 0 HA PRO A 412 -24.590 -7.183 -2.968 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.527 -6.734 -2.468 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.478 -7.941 -1.752 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.298 -5.853 -0.304 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -25.669 -6.469 -0.114 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -26.597 -4.016 -1.605 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -25.161 -4.228 -0.623 1.00 0.00 H new ATOM 524 N GLU A 413 -26.415 -5.271 -4.839 1.00 0.00 N ATOM 525 CA GLU A 413 -26.910 -5.081 -6.193 1.00 0.00 C ATOM 526 C GLU A 413 -25.734 -5.072 -7.147 1.00 0.00 C ATOM 527 O GLU A 413 -25.852 -5.491 -8.289 1.00 0.00 O ATOM 528 CB GLU A 413 -27.677 -3.764 -6.352 1.00 0.00 C ATOM 529 CG GLU A 413 -28.378 -3.285 -5.097 1.00 0.00 C ATOM 530 CD GLU A 413 -27.497 -2.369 -4.280 1.00 0.00 C ATOM 531 OE1 GLU A 413 -27.270 -1.221 -4.706 1.00 0.00 O ATOM 532 OE2 GLU A 413 -27.005 -2.816 -3.230 1.00 0.00 O ATOM 0 H GLU A 413 -26.471 -4.439 -4.252 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.596 -5.899 -6.413 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -26.982 -2.992 -6.681 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -28.418 -3.884 -7.143 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -29.294 -2.761 -5.369 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -28.670 -4.144 -4.493 1.00 0.00 H new ATOM 539 N LEU A 414 -24.593 -4.588 -6.667 1.00 0.00 N ATOM 540 CA LEU A 414 -23.393 -4.547 -7.484 1.00 0.00 C ATOM 541 C LEU A 414 -22.997 -5.962 -7.849 1.00 0.00 C ATOM 542 O LEU A 414 -22.821 -6.282 -9.015 1.00 0.00 O ATOM 543 CB LEU A 414 -22.236 -3.850 -6.763 1.00 0.00 C ATOM 544 CG LEU A 414 -22.360 -2.330 -6.632 1.00 0.00 C ATOM 545 CD1 LEU A 414 -21.026 -1.725 -6.239 1.00 0.00 C ATOM 546 CD2 LEU A 414 -22.866 -1.710 -7.922 1.00 0.00 C ATOM 0 H LEU A 414 -24.478 -4.222 -5.722 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.610 -3.971 -8.383 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -22.144 -4.277 -5.764 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -21.311 -4.077 -7.293 1.00 0.00 H new ATOM 0 HG LEU A 414 -23.087 -2.115 -5.849 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -21.129 -0.644 -6.150 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -20.706 -2.139 -5.283 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -20.283 -1.957 -7.002 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -22.944 -0.630 -7.800 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -22.171 -1.934 -8.731 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -23.847 -2.120 -8.163 1.00 0.00 H new ATOM 558 N VAL A 415 -22.920 -6.826 -6.848 1.00 0.00 N ATOM 559 CA VAL A 415 -22.553 -8.222 -7.088 1.00 0.00 C ATOM 560 C VAL A 415 -23.665 -8.917 -7.875 1.00 0.00 C ATOM 561 O VAL A 415 -23.439 -9.901 -8.578 1.00 0.00 O ATOM 562 CB VAL A 415 -22.276 -8.965 -5.755 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.012 -10.448 -5.978 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.099 -8.328 -5.032 1.00 0.00 C ATOM 0 H VAL A 415 -23.103 -6.594 -5.872 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.634 -8.246 -7.673 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.170 -8.876 -5.138 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -21.823 -10.932 -5.020 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -22.882 -10.905 -6.450 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.143 -10.570 -6.624 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -20.915 -8.859 -4.098 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.211 -8.384 -5.662 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.326 -7.284 -4.817 1.00 0.00 H new ATOM 574 N ALA A 416 -24.864 -8.361 -7.779 1.00 0.00 N ATOM 575 CA ALA A 416 -26.022 -8.889 -8.479 1.00 0.00 C ATOM 576 C ALA A 416 -26.099 -8.343 -9.902 1.00 0.00 C ATOM 577 O ALA A 416 -26.925 -8.779 -10.703 1.00 0.00 O ATOM 578 CB ALA A 416 -27.280 -8.536 -7.720 1.00 0.00 C ATOM 0 H ALA A 416 -25.059 -7.534 -7.215 1.00 0.00 H new ATOM 0 HA ALA A 416 -25.925 -9.973 -8.538 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.147 -8.933 -8.248 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.235 -8.967 -6.720 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.367 -7.452 -7.644 1.00 0.00 H new ATOM 584 N GLN A 417 -25.255 -7.365 -10.198 1.00 0.00 N ATOM 585 CA GLN A 417 -25.211 -6.769 -11.521 1.00 0.00 C ATOM 586 C GLN A 417 -23.849 -7.025 -12.111 1.00 0.00 C ATOM 587 O GLN A 417 -23.528 -6.569 -13.207 1.00 0.00 O ATOM 588 CB GLN A 417 -25.487 -5.262 -11.473 1.00 0.00 C ATOM 589 CG GLN A 417 -26.915 -4.918 -11.085 1.00 0.00 C ATOM 590 CD GLN A 417 -27.920 -5.306 -12.152 1.00 0.00 C ATOM 591 OE1 GLN A 417 -28.274 -4.498 -13.006 1.00 0.00 O ATOM 592 NE2 GLN A 417 -28.376 -6.549 -12.117 1.00 0.00 N ATOM 0 H GLN A 417 -24.590 -6.968 -9.535 1.00 0.00 H new ATOM 0 HA GLN A 417 -25.988 -7.220 -12.138 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.804 -4.798 -10.761 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -25.271 -4.830 -12.450 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -27.166 -5.425 -10.153 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.988 -3.847 -10.895 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -28.056 -7.189 -11.390 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -29.047 -6.866 -12.817 1.00 0.00 H new ATOM 601 N MET A 418 -23.042 -7.745 -11.350 1.00 0.00 N ATOM 602 CA MET A 418 -21.715 -8.085 -11.781 1.00 0.00 C ATOM 603 C MET A 418 -21.788 -9.354 -12.599 1.00 0.00 C ATOM 604 O MET A 418 -22.620 -10.232 -12.350 1.00 0.00 O ATOM 605 CB MET A 418 -20.761 -8.214 -10.584 1.00 0.00 C ATOM 606 CG MET A 418 -20.504 -9.631 -10.106 1.00 0.00 C ATOM 607 SD MET A 418 -19.792 -9.676 -8.448 1.00 0.00 S ATOM 608 CE MET A 418 -18.517 -8.426 -8.586 1.00 0.00 C ATOM 0 H MET A 418 -23.293 -8.102 -10.428 1.00 0.00 H new ATOM 0 HA MET A 418 -21.308 -7.289 -12.405 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.807 -7.760 -10.851 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.167 -7.637 -9.754 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.440 -10.190 -10.112 1.00 0.00 H new ATOM 0 HG3 MET A 418 -19.830 -10.130 -10.802 1.00 0.00 H new ATOM 0 HE1 MET A 418 -17.824 -8.519 -7.749 1.00 0.00 H new ATOM 0 HE2 MET A 418 -17.975 -8.561 -9.522 1.00 0.00 H new ATOM 0 HE3 MET A 418 -18.974 -7.437 -8.570 1.00 0.00 H new ATOM 618 N THR A 419 -20.932 -9.431 -13.577 1.00 0.00 N ATOM 619 CA THR A 419 -20.908 -10.573 -14.476 1.00 0.00 C ATOM 620 C THR A 419 -20.238 -11.762 -13.806 1.00 0.00 C ATOM 621 O THR A 419 -19.578 -11.595 -12.783 1.00 0.00 O ATOM 622 CB THR A 419 -20.174 -10.240 -15.793 1.00 0.00 C ATOM 623 OG1 THR A 419 -18.769 -10.088 -15.562 1.00 0.00 O ATOM 624 CG2 THR A 419 -20.728 -8.968 -16.419 1.00 0.00 C ATOM 0 H THR A 419 -20.233 -8.717 -13.782 1.00 0.00 H new ATOM 0 HA THR A 419 -21.942 -10.825 -14.713 1.00 0.00 H new ATOM 0 HB THR A 419 -20.336 -11.069 -16.482 1.00 0.00 H new ATOM 0 HG1 THR A 419 -18.276 -10.321 -16.377 1.00 0.00 H new ATOM 0 HG21 THR A 419 -20.194 -8.756 -17.345 1.00 0.00 H new ATOM 0 HG22 THR A 419 -21.788 -9.100 -16.634 1.00 0.00 H new ATOM 0 HG23 THR A 419 -20.599 -8.136 -15.727 1.00 0.00 H new ATOM 632 N PRO A 420 -20.422 -12.985 -14.340 1.00 0.00 N ATOM 633 CA PRO A 420 -19.789 -14.183 -13.785 1.00 0.00 C ATOM 634 C PRO A 420 -18.287 -13.977 -13.621 1.00 0.00 C ATOM 635 O PRO A 420 -17.683 -14.422 -12.644 1.00 0.00 O ATOM 636 CB PRO A 420 -20.079 -15.260 -14.830 1.00 0.00 C ATOM 637 CG PRO A 420 -21.325 -14.802 -15.507 1.00 0.00 C ATOM 638 CD PRO A 420 -21.269 -13.298 -15.506 1.00 0.00 C ATOM 0 HA PRO A 420 -20.165 -14.441 -12.795 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -19.256 -15.357 -15.538 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -20.216 -16.236 -14.365 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -21.381 -15.190 -16.524 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -22.209 -15.160 -14.980 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -20.838 -12.912 -16.430 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -22.262 -12.860 -15.410 1.00 0.00 H new ATOM 646 N GLU A 421 -17.703 -13.272 -14.584 1.00 0.00 N ATOM 647 CA GLU A 421 -16.284 -12.960 -14.562 1.00 0.00 C ATOM 648 C GLU A 421 -15.969 -12.067 -13.371 1.00 0.00 C ATOM 649 O GLU A 421 -15.083 -12.372 -12.579 1.00 0.00 O ATOM 650 CB GLU A 421 -15.856 -12.252 -15.851 1.00 0.00 C ATOM 651 CG GLU A 421 -16.386 -12.894 -17.124 1.00 0.00 C ATOM 652 CD GLU A 421 -17.788 -12.430 -17.456 1.00 0.00 C ATOM 653 OE1 GLU A 421 -17.947 -11.262 -17.862 1.00 0.00 O ATOM 654 OE2 GLU A 421 -18.733 -13.220 -17.272 1.00 0.00 O ATOM 0 H GLU A 421 -18.199 -12.904 -15.396 1.00 0.00 H new ATOM 0 HA GLU A 421 -15.734 -13.897 -14.479 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -16.194 -11.217 -15.812 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -14.767 -12.230 -15.895 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -15.720 -12.656 -17.954 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -16.381 -13.978 -17.012 1.00 0.00 H new ATOM 661 N GLU A 422 -16.719 -10.971 -13.244 1.00 0.00 N ATOM 662 CA GLU A 422 -16.532 -10.024 -12.160 1.00 0.00 C ATOM 663 C GLU A 422 -16.814 -10.689 -10.815 1.00 0.00 C ATOM 664 O GLU A 422 -16.105 -10.468 -9.842 1.00 0.00 O ATOM 665 CB GLU A 422 -17.445 -8.826 -12.405 1.00 0.00 C ATOM 666 CG GLU A 422 -17.102 -8.095 -13.694 1.00 0.00 C ATOM 667 CD GLU A 422 -18.111 -7.031 -14.052 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.305 -7.201 -13.716 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.717 -6.011 -14.665 1.00 0.00 O ATOM 0 H GLU A 422 -17.468 -10.722 -13.890 1.00 0.00 H new ATOM 0 HA GLU A 422 -15.498 -9.680 -12.130 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -18.481 -9.163 -12.445 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.367 -8.135 -11.566 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.118 -7.637 -13.595 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.037 -8.816 -14.509 1.00 0.00 H new ATOM 676 N LYS A 423 -17.864 -11.492 -10.784 1.00 0.00 N ATOM 677 CA LYS A 423 -18.262 -12.258 -9.604 1.00 0.00 C ATOM 678 C LYS A 423 -17.123 -13.112 -9.080 1.00 0.00 C ATOM 679 O LYS A 423 -16.708 -12.976 -7.927 1.00 0.00 O ATOM 680 CB LYS A 423 -19.453 -13.135 -10.007 1.00 0.00 C ATOM 681 CG LYS A 423 -19.580 -14.459 -9.275 1.00 0.00 C ATOM 682 CD LYS A 423 -20.183 -14.313 -7.893 1.00 0.00 C ATOM 683 CE LYS A 423 -20.619 -15.667 -7.358 1.00 0.00 C ATOM 684 NZ LYS A 423 -19.759 -16.774 -7.871 1.00 0.00 N ATOM 0 H LYS A 423 -18.476 -11.636 -11.587 1.00 0.00 H new ATOM 0 HA LYS A 423 -18.536 -11.578 -8.798 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -20.369 -12.565 -9.849 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -19.385 -13.338 -11.076 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -20.197 -15.137 -9.865 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -18.595 -14.917 -9.189 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -19.454 -13.866 -7.217 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -21.038 -13.638 -7.932 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -20.583 -15.655 -6.269 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -21.655 -15.852 -7.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -19.892 -17.619 -7.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -20.024 -16.993 -8.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -18.761 -16.482 -7.838 1.00 0.00 H new ATOM 698 N GLU A 424 -16.615 -13.972 -9.934 1.00 0.00 N ATOM 699 CA GLU A 424 -15.530 -14.864 -9.553 1.00 0.00 C ATOM 700 C GLU A 424 -14.264 -14.068 -9.289 1.00 0.00 C ATOM 701 O GLU A 424 -13.456 -14.428 -8.436 1.00 0.00 O ATOM 702 CB GLU A 424 -15.302 -15.924 -10.628 1.00 0.00 C ATOM 703 CG GLU A 424 -15.922 -17.276 -10.292 1.00 0.00 C ATOM 704 CD GLU A 424 -17.231 -17.164 -9.522 1.00 0.00 C ATOM 705 OE1 GLU A 424 -17.190 -17.054 -8.275 1.00 0.00 O ATOM 706 OE2 GLU A 424 -18.312 -17.187 -10.151 1.00 0.00 O ATOM 0 H GLU A 424 -16.932 -14.077 -10.898 1.00 0.00 H new ATOM 0 HA GLU A 424 -15.806 -15.379 -8.633 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -15.716 -15.568 -11.571 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -14.230 -16.052 -10.779 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -16.098 -17.827 -11.216 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -15.212 -17.858 -9.705 1.00 0.00 H new ATOM 713 N ALA A 425 -14.109 -12.971 -10.015 1.00 0.00 N ATOM 714 CA ALA A 425 -12.963 -12.099 -9.845 1.00 0.00 C ATOM 715 C ALA A 425 -13.016 -11.432 -8.477 1.00 0.00 C ATOM 716 O ALA A 425 -12.013 -11.364 -7.770 1.00 0.00 O ATOM 717 CB ALA A 425 -12.933 -11.057 -10.948 1.00 0.00 C ATOM 0 H ALA A 425 -14.768 -12.665 -10.731 1.00 0.00 H new ATOM 0 HA ALA A 425 -12.050 -12.692 -9.907 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.069 -10.407 -10.811 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -12.864 -11.554 -11.916 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -13.845 -10.461 -10.910 1.00 0.00 H new ATOM 723 N TYR A 426 -14.202 -10.961 -8.107 1.00 0.00 N ATOM 724 CA TYR A 426 -14.418 -10.315 -6.826 1.00 0.00 C ATOM 725 C TYR A 426 -14.174 -11.316 -5.713 1.00 0.00 C ATOM 726 O TYR A 426 -13.501 -11.016 -4.726 1.00 0.00 O ATOM 727 CB TYR A 426 -15.852 -9.772 -6.755 1.00 0.00 C ATOM 728 CG TYR A 426 -16.359 -9.494 -5.356 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.123 -8.273 -4.741 1.00 0.00 C ATOM 730 CD2 TYR A 426 -17.076 -10.455 -4.653 1.00 0.00 C ATOM 731 CE1 TYR A 426 -16.586 -8.016 -3.465 1.00 0.00 C ATOM 732 CE2 TYR A 426 -17.541 -10.207 -3.378 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.293 -8.987 -2.788 1.00 0.00 C ATOM 734 OH TYR A 426 -17.754 -8.739 -1.516 1.00 0.00 O ATOM 0 H TYR A 426 -15.038 -11.018 -8.689 1.00 0.00 H new ATOM 0 HA TYR A 426 -13.725 -9.481 -6.712 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -15.905 -8.851 -7.335 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -16.520 -10.488 -7.232 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.568 -7.511 -5.268 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -17.272 -11.412 -5.113 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.395 -7.060 -3.000 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -18.096 -10.965 -2.845 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.233 -9.526 -1.182 1.00 0.00 H new ATOM 744 N ILE A 427 -14.710 -12.514 -5.895 1.00 0.00 N ATOM 745 CA ILE A 427 -14.560 -13.564 -4.912 1.00 0.00 C ATOM 746 C ILE A 427 -13.092 -13.960 -4.755 1.00 0.00 C ATOM 747 O ILE A 427 -12.577 -14.037 -3.640 1.00 0.00 O ATOM 748 CB ILE A 427 -15.405 -14.804 -5.267 1.00 0.00 C ATOM 749 CG1 ILE A 427 -16.886 -14.490 -5.062 1.00 0.00 C ATOM 750 CG2 ILE A 427 -14.991 -16.007 -4.425 1.00 0.00 C ATOM 751 CD1 ILE A 427 -17.799 -15.638 -5.411 1.00 0.00 C ATOM 0 H ILE A 427 -15.253 -12.778 -6.717 1.00 0.00 H new ATOM 0 HA ILE A 427 -14.923 -13.168 -3.964 1.00 0.00 H new ATOM 0 HB ILE A 427 -15.234 -15.057 -6.313 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -17.049 -14.210 -4.021 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -17.153 -13.626 -5.670 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -15.602 -16.868 -4.695 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -13.941 -16.236 -4.608 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -15.133 -15.778 -3.369 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -18.835 -15.344 -5.241 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -17.665 -15.904 -6.459 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -17.559 -16.497 -4.785 1.00 0.00 H new ATOM 763 N ALA A 428 -12.419 -14.185 -5.881 1.00 0.00 N ATOM 764 CA ALA A 428 -11.012 -14.567 -5.873 1.00 0.00 C ATOM 765 C ALA A 428 -10.157 -13.477 -5.235 1.00 0.00 C ATOM 766 O ALA A 428 -9.194 -13.763 -4.524 1.00 0.00 O ATOM 767 CB ALA A 428 -10.536 -14.862 -7.288 1.00 0.00 C ATOM 0 H ALA A 428 -12.828 -14.109 -6.812 1.00 0.00 H new ATOM 0 HA ALA A 428 -10.906 -15.472 -5.275 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -9.484 -15.146 -7.266 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -11.124 -15.679 -7.707 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -10.659 -13.973 -7.906 1.00 0.00 H new ATOM 773 N MET A 429 -10.524 -12.226 -5.486 1.00 0.00 N ATOM 774 CA MET A 429 -9.807 -11.091 -4.927 1.00 0.00 C ATOM 775 C MET A 429 -10.029 -11.019 -3.422 1.00 0.00 C ATOM 776 O MET A 429 -9.121 -10.681 -2.663 1.00 0.00 O ATOM 777 CB MET A 429 -10.261 -9.794 -5.599 1.00 0.00 C ATOM 778 CG MET A 429 -9.583 -9.540 -6.934 1.00 0.00 C ATOM 779 SD MET A 429 -9.308 -7.788 -7.245 1.00 0.00 S ATOM 780 CE MET A 429 -10.884 -7.118 -6.735 1.00 0.00 C ATOM 0 H MET A 429 -11.317 -11.973 -6.075 1.00 0.00 H new ATOM 0 HA MET A 429 -8.741 -11.222 -5.114 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.340 -9.829 -5.748 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.058 -8.957 -4.931 1.00 0.00 H new ATOM 0 HG2 MET A 429 -8.628 -10.064 -6.958 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.195 -9.956 -7.734 1.00 0.00 H new ATOM 0 HE1 MET A 429 -11.021 -6.132 -7.179 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.685 -7.779 -7.066 1.00 0.00 H new ATOM 0 HE3 MET A 429 -10.909 -7.034 -5.649 1.00 0.00 H new ATOM 790 N GLY A 430 -11.237 -11.363 -2.999 1.00 0.00 N ATOM 791 CA GLY A 430 -11.566 -11.346 -1.594 1.00 0.00 C ATOM 792 C GLY A 430 -10.937 -12.502 -0.861 1.00 0.00 C ATOM 793 O GLY A 430 -10.565 -12.373 0.301 1.00 0.00 O ATOM 0 H GLY A 430 -11.998 -11.655 -3.612 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -11.229 -10.408 -1.153 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -12.649 -11.384 -1.473 1.00 0.00 H new ATOM 797 N GLN A 431 -10.807 -13.628 -1.556 1.00 0.00 N ATOM 798 CA GLN A 431 -10.213 -14.837 -0.993 1.00 0.00 C ATOM 799 C GLN A 431 -8.846 -14.543 -0.382 1.00 0.00 C ATOM 800 O GLN A 431 -8.543 -15.004 0.709 1.00 0.00 O ATOM 801 CB GLN A 431 -10.085 -15.914 -2.078 1.00 0.00 C ATOM 802 CG GLN A 431 -9.214 -17.100 -1.678 1.00 0.00 C ATOM 803 CD GLN A 431 -9.768 -17.866 -0.492 1.00 0.00 C ATOM 804 OE1 GLN A 431 -10.980 -17.969 -0.312 1.00 0.00 O ATOM 805 NE2 GLN A 431 -8.879 -18.401 0.331 1.00 0.00 N ATOM 0 H GLN A 431 -11.110 -13.728 -2.525 1.00 0.00 H new ATOM 0 HA GLN A 431 -10.868 -15.201 -0.201 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -11.080 -16.278 -2.333 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -9.671 -15.460 -2.978 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -9.117 -17.776 -2.528 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -8.212 -16.744 -1.438 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -7.882 -18.292 0.145 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -9.191 -18.922 1.150 1.00 0.00 H new ATOM 814 N ARG A 432 -8.038 -13.755 -1.082 1.00 0.00 N ATOM 815 CA ARG A 432 -6.702 -13.411 -0.601 1.00 0.00 C ATOM 816 C ARG A 432 -6.770 -12.689 0.747 1.00 0.00 C ATOM 817 O ARG A 432 -6.008 -12.993 1.661 1.00 0.00 O ATOM 818 CB ARG A 432 -5.981 -12.538 -1.628 1.00 0.00 C ATOM 819 CG ARG A 432 -4.477 -12.439 -1.413 1.00 0.00 C ATOM 820 CD ARG A 432 -3.720 -13.489 -2.214 1.00 0.00 C ATOM 821 NE ARG A 432 -3.933 -14.838 -1.677 1.00 0.00 N ATOM 822 CZ ARG A 432 -2.991 -15.553 -1.056 1.00 0.00 C ATOM 823 NH1 ARG A 432 -1.734 -15.121 -1.020 1.00 0.00 N ATOM 824 NH2 ARG A 432 -3.300 -16.710 -0.480 1.00 0.00 N ATOM 0 H ARG A 432 -8.282 -13.342 -1.982 1.00 0.00 H new ATOM 0 HA ARG A 432 -6.143 -14.337 -0.463 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -6.169 -12.937 -2.625 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -6.408 -11.535 -1.600 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -4.134 -11.445 -1.701 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -4.253 -12.559 -0.353 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -4.043 -13.456 -3.254 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -2.655 -13.257 -2.204 1.00 0.00 H new ATOM 0 HE ARG A 432 -4.857 -15.255 -1.785 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -1.485 -14.239 -1.468 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -1.019 -15.671 -0.544 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -4.259 -17.055 -0.511 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -2.578 -17.253 -0.007 1.00 0.00 H new ATOM 838 N MET A 433 -7.700 -11.747 0.865 1.00 0.00 N ATOM 839 CA MET A 433 -7.866 -10.983 2.100 1.00 0.00 C ATOM 840 C MET A 433 -8.540 -11.832 3.173 1.00 0.00 C ATOM 841 O MET A 433 -8.134 -11.834 4.334 1.00 0.00 O ATOM 842 CB MET A 433 -8.702 -9.727 1.842 1.00 0.00 C ATOM 843 CG MET A 433 -7.978 -8.650 1.053 1.00 0.00 C ATOM 844 SD MET A 433 -9.083 -7.327 0.519 1.00 0.00 S ATOM 845 CE MET A 433 -9.931 -8.114 -0.846 1.00 0.00 C ATOM 0 H MET A 433 -8.351 -11.493 0.122 1.00 0.00 H new ATOM 0 HA MET A 433 -6.876 -10.690 2.451 1.00 0.00 H new ATOM 0 HB2 MET A 433 -9.607 -10.010 1.304 1.00 0.00 H new ATOM 0 HB3 MET A 433 -9.017 -9.311 2.799 1.00 0.00 H new ATOM 0 HG2 MET A 433 -7.181 -8.229 1.666 1.00 0.00 H new ATOM 0 HG3 MET A 433 -7.505 -9.099 0.180 1.00 0.00 H new ATOM 0 HE1 MET A 433 -10.308 -7.352 -1.528 1.00 0.00 H new ATOM 0 HE2 MET A 433 -9.238 -8.766 -1.377 1.00 0.00 H new ATOM 0 HE3 MET A 433 -10.765 -8.704 -0.465 1.00 0.00 H new ATOM 855 N PHE A 434 -9.568 -12.560 2.760 1.00 0.00 N ATOM 856 CA PHE A 434 -10.335 -13.423 3.651 1.00 0.00 C ATOM 857 C PHE A 434 -9.481 -14.557 4.206 1.00 0.00 C ATOM 858 O PHE A 434 -9.737 -15.072 5.293 1.00 0.00 O ATOM 859 CB PHE A 434 -11.534 -14.001 2.896 1.00 0.00 C ATOM 860 CG PHE A 434 -12.748 -13.116 2.918 1.00 0.00 C ATOM 861 CD1 PHE A 434 -13.115 -12.448 4.075 1.00 0.00 C ATOM 862 CD2 PHE A 434 -13.521 -12.953 1.780 1.00 0.00 C ATOM 863 CE1 PHE A 434 -14.230 -11.632 4.095 1.00 0.00 C ATOM 864 CE2 PHE A 434 -14.637 -12.140 1.794 1.00 0.00 C ATOM 865 CZ PHE A 434 -14.993 -11.480 2.954 1.00 0.00 C ATOM 0 H PHE A 434 -9.896 -12.570 1.794 1.00 0.00 H new ATOM 0 HA PHE A 434 -10.679 -12.821 4.492 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -11.246 -14.182 1.860 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -11.792 -14.967 3.329 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -12.523 -12.566 4.971 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -13.247 -13.468 0.871 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -14.504 -11.114 5.002 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -15.230 -12.020 0.900 1.00 0.00 H new ATOM 0 HZ PHE A 434 -15.867 -10.846 2.969 1.00 0.00 H new ATOM 875 N GLU A 435 -8.466 -14.935 3.452 1.00 0.00 N ATOM 876 CA GLU A 435 -7.567 -16.010 3.845 1.00 0.00 C ATOM 877 C GLU A 435 -6.638 -15.579 4.968 1.00 0.00 C ATOM 878 O GLU A 435 -5.945 -16.397 5.573 1.00 0.00 O ATOM 879 CB GLU A 435 -6.750 -16.464 2.636 1.00 0.00 C ATOM 880 CG GLU A 435 -6.386 -17.936 2.636 1.00 0.00 C ATOM 881 CD GLU A 435 -5.360 -18.262 1.570 1.00 0.00 C ATOM 882 OE1 GLU A 435 -5.641 -18.020 0.373 1.00 0.00 O ATOM 883 OE2 GLU A 435 -4.261 -18.738 1.930 1.00 0.00 O ATOM 0 H GLU A 435 -8.240 -14.509 2.553 1.00 0.00 H new ATOM 0 HA GLU A 435 -8.171 -16.839 4.214 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -7.313 -16.243 1.730 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -5.833 -15.877 2.593 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -5.994 -18.213 3.615 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -7.283 -18.532 2.471 1.00 0.00 H new ATOM 890 N ASP A 436 -6.661 -14.302 5.267 1.00 0.00 N ATOM 891 CA ASP A 436 -5.795 -13.756 6.302 1.00 0.00 C ATOM 892 C ASP A 436 -6.575 -12.994 7.365 1.00 0.00 C ATOM 893 O ASP A 436 -6.126 -11.961 7.854 1.00 0.00 O ATOM 894 CB ASP A 436 -4.725 -12.848 5.697 1.00 0.00 C ATOM 895 CG ASP A 436 -3.410 -12.964 6.441 1.00 0.00 C ATOM 896 OD1 ASP A 436 -2.697 -13.970 6.232 1.00 0.00 O ATOM 897 OD2 ASP A 436 -3.086 -12.063 7.240 1.00 0.00 O ATOM 0 H ASP A 436 -7.266 -13.617 4.813 1.00 0.00 H new ATOM 0 HA ASP A 436 -5.314 -14.606 6.785 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -4.575 -13.109 4.649 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -5.068 -11.814 5.722 1.00 0.00 H new ATOM 1036 N GLU B 7 6.864 -6.280 -12.434 1.00 0.00 N ATOM 1037 CA GLU B 7 5.798 -5.321 -12.668 1.00 0.00 C ATOM 1038 C GLU B 7 6.091 -4.029 -11.919 1.00 0.00 C ATOM 1039 O GLU B 7 5.496 -3.773 -10.878 1.00 0.00 O ATOM 1040 CB GLU B 7 4.436 -5.857 -12.193 1.00 0.00 C ATOM 1041 CG GLU B 7 4.167 -7.312 -12.532 1.00 0.00 C ATOM 1042 CD GLU B 7 2.965 -7.874 -11.781 1.00 0.00 C ATOM 1043 OE1 GLU B 7 1.817 -7.523 -12.126 1.00 0.00 O ATOM 1044 OE2 GLU B 7 3.159 -8.662 -10.829 1.00 0.00 O ATOM 0 HA GLU B 7 5.752 -5.143 -13.742 1.00 0.00 H new ATOM 0 HB2 GLU B 7 4.370 -5.733 -11.112 1.00 0.00 H new ATOM 0 HB3 GLU B 7 3.648 -5.245 -12.632 1.00 0.00 H new ATOM 0 HG2 GLU B 7 3.998 -7.406 -13.605 1.00 0.00 H new ATOM 0 HG3 GLU B 7 5.050 -7.906 -12.295 1.00 0.00 H new ATOM 1051 N VAL B 8 7.047 -3.241 -12.395 1.00 0.00 N ATOM 1052 CA VAL B 8 7.333 -1.979 -11.741 1.00 0.00 C ATOM 1053 C VAL B 8 6.150 -1.066 -11.940 1.00 0.00 C ATOM 1054 O VAL B 8 5.863 -0.599 -13.041 1.00 0.00 O ATOM 1055 CB VAL B 8 8.619 -1.314 -12.218 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.654 0.131 -11.746 1.00 0.00 C ATOM 1057 CG2 VAL B 8 9.794 -2.086 -11.661 1.00 0.00 C ATOM 0 H VAL B 8 7.622 -3.449 -13.211 1.00 0.00 H new ATOM 0 HA VAL B 8 7.496 -2.182 -10.683 1.00 0.00 H new ATOM 0 HB VAL B 8 8.667 -1.318 -13.307 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.575 0.603 -12.089 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.797 0.668 -12.153 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.615 0.159 -10.657 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.724 -1.623 -11.993 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.752 -2.076 -10.572 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.754 -3.116 -12.016 1.00 0.00 H new ATOM 1067 N LEU B 9 5.464 -0.856 -10.853 1.00 0.00 N ATOM 1068 CA LEU B 9 4.258 -0.073 -10.831 1.00 0.00 C ATOM 1069 C LEU B 9 4.543 1.410 -10.799 1.00 0.00 C ATOM 1070 O LEU B 9 4.067 2.161 -11.647 1.00 0.00 O ATOM 1071 CB LEU B 9 3.441 -0.502 -9.614 1.00 0.00 C ATOM 1072 CG LEU B 9 3.597 -1.986 -9.282 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.404 -2.270 -7.812 1.00 0.00 C ATOM 1074 CD2 LEU B 9 2.634 -2.807 -10.102 1.00 0.00 C ATOM 0 H LEU B 9 5.730 -1.229 -9.942 1.00 0.00 H new ATOM 0 HA LEU B 9 3.696 -0.252 -11.748 1.00 0.00 H new ATOM 0 HB2 LEU B 9 3.745 0.091 -8.752 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.388 -0.285 -9.795 1.00 0.00 H new ATOM 0 HG LEU B 9 4.620 -2.267 -9.533 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.525 -3.338 -7.629 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.144 -1.716 -7.234 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.403 -1.961 -7.510 1.00 0.00 H new ATOM 0 HD21 LEU B 9 2.755 -3.862 -9.857 1.00 0.00 H new ATOM 0 HD22 LEU B 9 1.612 -2.498 -9.881 1.00 0.00 H new ATOM 0 HD23 LEU B 9 2.838 -2.655 -11.162 1.00 0.00 H new ATOM 1086 N LEU B 10 5.312 1.836 -9.824 1.00 0.00 N ATOM 1087 CA LEU B 10 5.618 3.243 -9.706 1.00 0.00 C ATOM 1088 C LEU B 10 7.030 3.501 -9.213 1.00 0.00 C ATOM 1089 O LEU B 10 7.486 2.913 -8.232 1.00 0.00 O ATOM 1090 CB LEU B 10 4.620 3.889 -8.767 1.00 0.00 C ATOM 1091 CG LEU B 10 4.412 5.386 -8.955 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.684 5.668 -10.261 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.643 5.957 -7.776 1.00 0.00 C ATOM 0 H LEU B 10 5.732 1.239 -9.111 1.00 0.00 H new ATOM 0 HA LEU B 10 5.549 3.679 -10.703 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.659 3.389 -8.887 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.945 3.712 -7.742 1.00 0.00 H new ATOM 0 HG LEU B 10 5.387 5.871 -9.002 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.546 6.743 -10.376 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.273 5.287 -11.095 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.711 5.176 -10.249 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.499 7.028 -7.920 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.672 5.467 -7.703 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.205 5.786 -6.858 1.00 0.00 H new ATOM 1105 N ILE B 11 7.712 4.375 -9.928 1.00 0.00 N ATOM 1106 CA ILE B 11 9.060 4.788 -9.594 1.00 0.00 C ATOM 1107 C ILE B 11 9.021 6.225 -9.093 1.00 0.00 C ATOM 1108 O ILE B 11 8.949 7.161 -9.888 1.00 0.00 O ATOM 1109 CB ILE B 11 9.986 4.696 -10.828 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.197 3.233 -11.221 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.317 5.381 -10.566 1.00 0.00 C ATOM 1112 CD1 ILE B 11 11.027 3.056 -12.473 1.00 0.00 C ATOM 0 H ILE B 11 7.341 4.823 -10.766 1.00 0.00 H new ATOM 0 HA ILE B 11 9.454 4.127 -8.822 1.00 0.00 H new ATOM 0 HB ILE B 11 9.504 5.214 -11.657 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.682 2.710 -10.397 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.225 2.762 -11.370 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.948 5.301 -11.451 1.00 0.00 H new ATOM 0 HG22 ILE B 11 11.146 6.433 -10.337 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.813 4.902 -9.722 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.135 1.993 -12.691 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.533 3.549 -13.310 1.00 0.00 H new ATOM 0 HD13 ILE B 11 12.012 3.497 -12.322 1.00 0.00 H new ATOM 1124 N VAL B 12 9.043 6.412 -7.781 1.00 0.00 N ATOM 1125 CA VAL B 12 8.986 7.744 -7.235 1.00 0.00 C ATOM 1126 C VAL B 12 10.347 8.170 -6.734 1.00 0.00 C ATOM 1127 O VAL B 12 11.089 7.368 -6.188 1.00 0.00 O ATOM 1128 CB VAL B 12 7.976 7.831 -6.077 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.549 9.266 -5.849 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.771 6.949 -6.345 1.00 0.00 C ATOM 0 H VAL B 12 9.099 5.664 -7.090 1.00 0.00 H new ATOM 0 HA VAL B 12 8.664 8.410 -8.036 1.00 0.00 H new ATOM 0 HB VAL B 12 8.464 7.471 -5.172 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.835 9.307 -5.026 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.422 9.870 -5.602 1.00 0.00 H new ATOM 0 HG13 VAL B 12 7.082 9.655 -6.754 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.071 7.027 -5.513 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.281 7.272 -7.263 1.00 0.00 H new ATOM 0 HG23 VAL B 12 7.094 5.914 -6.451 1.00 0.00 H new ATOM 1140 N LYS B 13 10.678 9.421 -6.955 1.00 0.00 N ATOM 1141 CA LYS B 13 11.935 9.976 -6.491 1.00 0.00 C ATOM 1142 C LYS B 13 11.628 11.108 -5.528 1.00 0.00 C ATOM 1143 O LYS B 13 10.470 11.505 -5.400 1.00 0.00 O ATOM 1144 CB LYS B 13 12.820 10.461 -7.640 1.00 0.00 C ATOM 1145 CG LYS B 13 13.769 9.402 -8.191 1.00 0.00 C ATOM 1146 CD LYS B 13 13.063 8.401 -9.087 1.00 0.00 C ATOM 1147 CE LYS B 13 14.057 7.470 -9.770 1.00 0.00 C ATOM 1148 NZ LYS B 13 14.811 6.634 -8.792 1.00 0.00 N ATOM 0 H LYS B 13 10.088 10.083 -7.459 1.00 0.00 H new ATOM 0 HA LYS B 13 12.500 9.192 -5.988 1.00 0.00 H new ATOM 0 HB2 LYS B 13 12.182 10.817 -8.449 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.406 11.314 -7.297 1.00 0.00 H new ATOM 0 HG2 LYS B 13 14.566 9.889 -8.753 1.00 0.00 H new ATOM 0 HG3 LYS B 13 14.240 8.874 -7.362 1.00 0.00 H new ATOM 0 HD2 LYS B 13 12.359 7.815 -8.496 1.00 0.00 H new ATOM 0 HD3 LYS B 13 12.482 8.932 -9.841 1.00 0.00 H new ATOM 0 HE2 LYS B 13 13.525 6.821 -10.466 1.00 0.00 H new ATOM 0 HE3 LYS B 13 14.760 8.060 -10.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 15.819 6.889 -8.822 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 14.440 6.800 -7.835 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 14.701 5.629 -9.037 1.00 0.00 H new ATOM 1162 N LYS B 14 12.657 11.608 -4.852 1.00 0.00 N ATOM 1163 CA LYS B 14 12.510 12.671 -3.861 1.00 0.00 C ATOM 1164 C LYS B 14 11.793 12.126 -2.627 1.00 0.00 C ATOM 1165 O LYS B 14 11.252 12.873 -1.810 1.00 0.00 O ATOM 1166 CB LYS B 14 11.728 13.820 -4.471 1.00 0.00 C ATOM 1167 CG LYS B 14 12.540 14.732 -5.372 1.00 0.00 C ATOM 1168 CD LYS B 14 11.702 15.282 -6.525 1.00 0.00 C ATOM 1169 CE LYS B 14 10.949 14.186 -7.279 1.00 0.00 C ATOM 1170 NZ LYS B 14 9.588 13.946 -6.718 1.00 0.00 N ATOM 0 H LYS B 14 13.618 11.288 -4.975 1.00 0.00 H new ATOM 0 HA LYS B 14 13.492 13.035 -3.558 1.00 0.00 H new ATOM 0 HB2 LYS B 14 10.896 13.411 -5.045 1.00 0.00 H new ATOM 0 HB3 LYS B 14 11.297 14.416 -3.666 1.00 0.00 H new ATOM 0 HG2 LYS B 14 12.940 15.560 -4.786 1.00 0.00 H new ATOM 0 HG3 LYS B 14 13.393 14.183 -5.772 1.00 0.00 H new ATOM 0 HD2 LYS B 14 10.987 16.007 -6.136 1.00 0.00 H new ATOM 0 HD3 LYS B 14 12.351 15.815 -7.219 1.00 0.00 H new ATOM 0 HE2 LYS B 14 10.863 14.464 -8.329 1.00 0.00 H new ATOM 0 HE3 LYS B 14 11.524 13.261 -7.240 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 9.315 12.956 -6.881 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 9.595 14.139 -5.696 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 8.904 14.575 -7.185 1.00 0.00 H new ATOM 1184 N VAL B 15 11.804 10.805 -2.520 1.00 0.00 N ATOM 1185 CA VAL B 15 11.171 10.094 -1.421 1.00 0.00 C ATOM 1186 C VAL B 15 12.172 9.944 -0.283 1.00 0.00 C ATOM 1187 O VAL B 15 13.146 9.212 -0.405 1.00 0.00 O ATOM 1188 CB VAL B 15 10.681 8.704 -1.900 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.703 8.085 -0.925 1.00 0.00 C ATOM 1190 CG2 VAL B 15 10.031 8.820 -3.264 1.00 0.00 C ATOM 0 H VAL B 15 12.256 10.193 -3.199 1.00 0.00 H new ATOM 0 HA VAL B 15 10.307 10.657 -1.068 1.00 0.00 H new ATOM 0 HB VAL B 15 11.554 8.055 -1.961 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.384 7.112 -1.298 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.185 7.962 0.045 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.835 8.735 -0.819 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.691 7.837 -3.590 1.00 0.00 H new ATOM 0 HG22 VAL B 15 9.179 9.497 -3.205 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.755 9.209 -3.980 1.00 0.00 H new ATOM 1200 N ARG B 16 11.944 10.647 0.813 1.00 0.00 N ATOM 1201 CA ARG B 16 12.853 10.617 1.940 1.00 0.00 C ATOM 1202 C ARG B 16 12.482 9.551 2.960 1.00 0.00 C ATOM 1203 O ARG B 16 11.313 9.364 3.294 1.00 0.00 O ATOM 1204 CB ARG B 16 12.891 11.984 2.632 1.00 0.00 C ATOM 1205 CG ARG B 16 13.171 13.145 1.691 1.00 0.00 C ATOM 1206 CD ARG B 16 13.555 14.403 2.456 1.00 0.00 C ATOM 1207 NE ARG B 16 14.881 14.285 3.068 1.00 0.00 N ATOM 1208 CZ ARG B 16 16.001 14.718 2.488 1.00 0.00 C ATOM 1209 NH1 ARG B 16 15.938 15.408 1.356 1.00 0.00 N ATOM 1210 NH2 ARG B 16 17.184 14.489 3.049 1.00 0.00 N ATOM 0 H ARG B 16 11.131 11.249 0.944 1.00 0.00 H new ATOM 0 HA ARG B 16 13.837 10.371 1.541 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.936 12.155 3.129 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.656 11.966 3.408 1.00 0.00 H new ATOM 0 HG2 ARG B 16 13.975 12.874 1.007 1.00 0.00 H new ATOM 0 HG3 ARG B 16 12.288 13.343 1.083 1.00 0.00 H new ATOM 0 HD2 ARG B 16 13.542 15.258 1.780 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.813 14.598 3.231 1.00 0.00 H new ATOM 0 HE ARG B 16 14.951 13.848 3.987 1.00 0.00 H new ATOM 0 HH11 ARG B 16 15.033 15.607 0.930 1.00 0.00 H new ATOM 0 HH12 ARG B 16 16.795 15.739 0.912 1.00 0.00 H new ATOM 0 HH21 ARG B 16 17.240 13.978 3.930 1.00 0.00 H new ATOM 0 HH22 ARG B 16 18.036 14.824 2.598 1.00 0.00 H new ATOM 1224 N GLN B 17 13.497 8.844 3.415 1.00 0.00 N ATOM 1225 CA GLN B 17 13.359 7.827 4.441 1.00 0.00 C ATOM 1226 C GLN B 17 14.588 7.925 5.322 1.00 0.00 C ATOM 1227 O GLN B 17 15.711 7.887 4.814 1.00 0.00 O ATOM 1228 CB GLN B 17 13.233 6.425 3.840 1.00 0.00 C ATOM 1229 CG GLN B 17 12.221 5.543 4.562 1.00 0.00 C ATOM 1230 CD GLN B 17 12.668 5.126 5.953 1.00 0.00 C ATOM 1231 OE1 GLN B 17 11.853 4.967 6.858 1.00 0.00 O ATOM 1232 NE2 GLN B 17 13.965 4.931 6.131 1.00 0.00 N ATOM 0 H GLN B 17 14.453 8.960 3.079 1.00 0.00 H new ATOM 0 HA GLN B 17 12.447 7.994 5.015 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.945 6.512 2.792 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.208 5.939 3.863 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.274 6.077 4.638 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.037 4.650 3.965 1.00 0.00 H new ATOM 0 HE21 GLN B 17 14.613 5.073 5.356 1.00 0.00 H new ATOM 0 HE22 GLN B 17 14.316 4.639 7.043 1.00 0.00 H new ATOM 1241 N LYS B 18 14.376 8.089 6.620 1.00 0.00 N ATOM 1242 CA LYS B 18 15.469 8.248 7.570 1.00 0.00 C ATOM 1243 C LYS B 18 16.162 9.573 7.266 1.00 0.00 C ATOM 1244 O LYS B 18 17.389 9.676 7.264 1.00 0.00 O ATOM 1245 CB LYS B 18 16.453 7.067 7.509 1.00 0.00 C ATOM 1246 CG LYS B 18 17.111 6.747 8.844 1.00 0.00 C ATOM 1247 CD LYS B 18 18.431 7.484 9.012 1.00 0.00 C ATOM 1248 CE LYS B 18 18.833 7.578 10.472 1.00 0.00 C ATOM 1249 NZ LYS B 18 20.072 8.379 10.659 1.00 0.00 N ATOM 0 H LYS B 18 13.448 8.116 7.043 1.00 0.00 H new ATOM 0 HA LYS B 18 15.077 8.258 8.587 1.00 0.00 H new ATOM 0 HB2 LYS B 18 15.924 6.183 7.154 1.00 0.00 H new ATOM 0 HB3 LYS B 18 17.229 7.290 6.776 1.00 0.00 H new ATOM 0 HG2 LYS B 18 16.437 7.018 9.656 1.00 0.00 H new ATOM 0 HG3 LYS B 18 17.282 5.673 8.917 1.00 0.00 H new ATOM 0 HD2 LYS B 18 19.211 6.969 8.451 1.00 0.00 H new ATOM 0 HD3 LYS B 18 18.346 8.486 8.592 1.00 0.00 H new ATOM 0 HE2 LYS B 18 18.021 8.028 11.043 1.00 0.00 H new ATOM 0 HE3 LYS B 18 18.986 6.575 10.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 20.311 8.418 11.670 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 20.854 7.936 10.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 19.919 9.344 10.302 1.00 0.00 H new ATOM 1263 N LYS B 19 15.331 10.577 6.974 1.00 0.00 N ATOM 1264 CA LYS B 19 15.782 11.929 6.648 1.00 0.00 C ATOM 1265 C LYS B 19 16.706 11.947 5.429 1.00 0.00 C ATOM 1266 O LYS B 19 17.477 12.888 5.245 1.00 0.00 O ATOM 1267 CB LYS B 19 16.485 12.561 7.854 1.00 0.00 C ATOM 1268 CG LYS B 19 15.699 13.695 8.498 1.00 0.00 C ATOM 1269 CD LYS B 19 14.381 13.215 9.092 1.00 0.00 C ATOM 1270 CE LYS B 19 14.542 12.749 10.533 1.00 0.00 C ATOM 1271 NZ LYS B 19 15.077 11.366 10.621 1.00 0.00 N ATOM 0 H LYS B 19 14.317 10.471 6.958 1.00 0.00 H new ATOM 0 HA LYS B 19 14.898 12.516 6.398 1.00 0.00 H new ATOM 0 HB2 LYS B 19 16.669 11.789 8.601 1.00 0.00 H new ATOM 0 HB3 LYS B 19 17.458 12.939 7.539 1.00 0.00 H new ATOM 0 HG2 LYS B 19 16.303 14.155 9.281 1.00 0.00 H new ATOM 0 HG3 LYS B 19 15.501 14.466 7.754 1.00 0.00 H new ATOM 0 HD2 LYS B 19 13.650 14.022 9.051 1.00 0.00 H new ATOM 0 HD3 LYS B 19 13.987 12.397 8.488 1.00 0.00 H new ATOM 0 HE2 LYS B 19 15.211 13.429 11.060 1.00 0.00 H new ATOM 0 HE3 LYS B 19 13.577 12.796 11.038 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 14.717 10.909 11.483 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 14.773 10.823 9.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 16.116 11.397 10.654 1.00 0.00 H new ATOM 1285 N GLN B 20 16.586 10.946 4.563 1.00 0.00 N ATOM 1286 CA GLN B 20 17.439 10.855 3.385 1.00 0.00 C ATOM 1287 C GLN B 20 16.592 10.795 2.126 1.00 0.00 C ATOM 1288 O GLN B 20 15.684 9.971 2.027 1.00 0.00 O ATOM 1289 CB GLN B 20 18.335 9.618 3.475 1.00 0.00 C ATOM 1290 CG GLN B 20 19.820 9.928 3.376 1.00 0.00 C ATOM 1291 CD GLN B 20 20.336 10.752 4.543 1.00 0.00 C ATOM 1292 OE1 GLN B 20 21.260 11.547 4.392 1.00 0.00 O ATOM 1293 NE2 GLN B 20 19.750 10.567 5.718 1.00 0.00 N ATOM 0 H GLN B 20 15.909 10.189 4.655 1.00 0.00 H new ATOM 0 HA GLN B 20 18.069 11.743 3.342 1.00 0.00 H new ATOM 0 HB2 GLN B 20 18.142 9.109 4.419 1.00 0.00 H new ATOM 0 HB3 GLN B 20 18.064 8.926 2.678 1.00 0.00 H new ATOM 0 HG2 GLN B 20 20.378 8.993 3.325 1.00 0.00 H new ATOM 0 HG3 GLN B 20 20.012 10.465 2.447 1.00 0.00 H new ATOM 0 HE21 GLN B 20 18.985 9.898 5.807 1.00 0.00 H new ATOM 0 HE22 GLN B 20 20.064 11.094 6.533 1.00 0.00 H new ATOM 1302 N ASP B 21 16.882 11.669 1.174 1.00 0.00 N ATOM 1303 CA ASP B 21 16.128 11.716 -0.070 1.00 0.00 C ATOM 1304 C ASP B 21 16.559 10.620 -1.026 1.00 0.00 C ATOM 1305 O ASP B 21 17.704 10.559 -1.469 1.00 0.00 O ATOM 1306 CB ASP B 21 16.251 13.084 -0.752 1.00 0.00 C ATOM 1307 CG ASP B 21 17.660 13.652 -0.733 1.00 0.00 C ATOM 1308 OD1 ASP B 21 18.157 13.974 0.374 1.00 0.00 O ATOM 1309 OD2 ASP B 21 18.251 13.808 -1.814 1.00 0.00 O ATOM 0 H ASP B 21 17.634 12.355 1.239 1.00 0.00 H new ATOM 0 HA ASP B 21 15.082 11.553 0.191 1.00 0.00 H new ATOM 0 HB2 ASP B 21 15.918 12.996 -1.786 1.00 0.00 H new ATOM 0 HB3 ASP B 21 15.579 13.787 -0.260 1.00 0.00 H new ATOM 1314 N GLY B 22 15.633 9.729 -1.309 1.00 0.00 N ATOM 1315 CA GLY B 22 15.891 8.656 -2.214 1.00 0.00 C ATOM 1316 C GLY B 22 14.780 8.475 -3.219 1.00 0.00 C ATOM 1317 O GLY B 22 14.337 9.430 -3.864 1.00 0.00 O ATOM 0 H GLY B 22 14.692 9.737 -0.916 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.827 8.844 -2.740 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.023 7.732 -1.651 1.00 0.00 H new ATOM 1321 N ALA B 23 14.313 7.252 -3.324 1.00 0.00 N ATOM 1322 CA ALA B 23 13.281 6.900 -4.261 1.00 0.00 C ATOM 1323 C ALA B 23 12.447 5.754 -3.732 1.00 0.00 C ATOM 1324 O ALA B 23 12.975 4.817 -3.136 1.00 0.00 O ATOM 1325 CB ALA B 23 13.916 6.512 -5.576 1.00 0.00 C ATOM 0 H ALA B 23 14.643 6.472 -2.756 1.00 0.00 H new ATOM 0 HA ALA B 23 12.626 7.759 -4.407 1.00 0.00 H new ATOM 0 HB1 ALA B 23 13.138 6.244 -6.291 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.491 7.352 -5.964 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.577 5.659 -5.423 1.00 0.00 H new ATOM 1331 N LEU B 24 11.156 5.824 -3.974 1.00 0.00 N ATOM 1332 CA LEU B 24 10.245 4.800 -3.523 1.00 0.00 C ATOM 1333 C LEU B 24 9.765 4.029 -4.748 1.00 0.00 C ATOM 1334 O LEU B 24 9.111 4.587 -5.629 1.00 0.00 O ATOM 1335 CB LEU B 24 9.074 5.441 -2.788 1.00 0.00 C ATOM 1336 CG LEU B 24 8.484 4.616 -1.646 1.00 0.00 C ATOM 1337 CD1 LEU B 24 7.041 5.008 -1.396 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.611 3.130 -1.914 1.00 0.00 C ATOM 0 H LEU B 24 10.713 6.587 -4.485 1.00 0.00 H new ATOM 0 HA LEU B 24 10.738 4.118 -2.831 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.400 6.401 -2.389 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.284 5.648 -3.510 1.00 0.00 H new ATOM 0 HG LEU B 24 9.056 4.832 -0.744 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.638 4.410 -0.579 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.992 6.064 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.455 4.832 -2.298 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.181 2.572 -1.082 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.079 2.879 -2.832 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.664 2.868 -2.021 1.00 0.00 H new ATOM 1350 N TYR B 25 10.113 2.762 -4.811 1.00 0.00 N ATOM 1351 CA TYR B 25 9.753 1.925 -5.945 1.00 0.00 C ATOM 1352 C TYR B 25 8.695 0.888 -5.602 1.00 0.00 C ATOM 1353 O TYR B 25 8.895 0.051 -4.721 1.00 0.00 O ATOM 1354 CB TYR B 25 10.984 1.177 -6.450 1.00 0.00 C ATOM 1355 CG TYR B 25 11.862 1.956 -7.389 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.270 3.244 -7.088 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.298 1.388 -8.575 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.087 3.947 -7.942 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.115 2.082 -9.440 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.510 3.365 -9.119 1.00 0.00 C ATOM 1361 OH TYR B 25 14.332 4.070 -9.974 1.00 0.00 O ATOM 0 H TYR B 25 10.648 2.282 -4.087 1.00 0.00 H new ATOM 0 HA TYR B 25 9.350 2.596 -6.703 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.580 0.869 -5.591 1.00 0.00 H new ATOM 0 HB3 TYR B 25 10.656 0.268 -6.954 1.00 0.00 H new ATOM 0 HD1 TYR B 25 11.941 3.704 -6.168 1.00 0.00 H new ATOM 0 HD2 TYR B 25 11.992 0.383 -8.826 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.396 4.951 -7.692 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.444 1.626 -10.362 1.00 0.00 H new ATOM 0 HH TYR B 25 14.540 3.518 -10.757 1.00 0.00 H new ATOM 1371 N LEU B 26 7.574 0.937 -6.300 1.00 0.00 N ATOM 1372 CA LEU B 26 6.536 -0.060 -6.111 1.00 0.00 C ATOM 1373 C LEU B 26 6.734 -1.108 -7.175 1.00 0.00 C ATOM 1374 O LEU B 26 6.548 -0.823 -8.360 1.00 0.00 O ATOM 1375 CB LEU B 26 5.122 0.505 -6.261 1.00 0.00 C ATOM 1376 CG LEU B 26 4.894 1.889 -5.692 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.538 2.417 -6.123 1.00 0.00 C ATOM 1378 CD2 LEU B 26 4.972 1.871 -4.184 1.00 0.00 C ATOM 0 H LEU B 26 7.360 1.650 -6.997 1.00 0.00 H new ATOM 0 HA LEU B 26 6.620 -0.451 -5.097 1.00 0.00 H new ATOM 0 HB2 LEU B 26 4.871 0.524 -7.322 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.425 -0.182 -5.781 1.00 0.00 H new ATOM 0 HG LEU B 26 5.677 2.544 -6.075 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.386 3.413 -5.707 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.496 2.468 -7.211 1.00 0.00 H new ATOM 0 HD13 LEU B 26 2.756 1.750 -5.761 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.805 2.877 -3.799 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.210 1.200 -3.788 1.00 0.00 H new ATOM 0 HD23 LEU B 26 5.958 1.523 -3.875 1.00 0.00 H new ATOM 1390 N MET B 27 7.139 -2.295 -6.790 1.00 0.00 N ATOM 1391 CA MET B 27 7.346 -3.333 -7.768 1.00 0.00 C ATOM 1392 C MET B 27 6.263 -4.372 -7.700 1.00 0.00 C ATOM 1393 O MET B 27 5.428 -4.354 -6.799 1.00 0.00 O ATOM 1394 CB MET B 27 8.717 -3.991 -7.629 1.00 0.00 C ATOM 1395 CG MET B 27 9.800 -3.334 -8.459 1.00 0.00 C ATOM 1396 SD MET B 27 11.412 -3.410 -7.669 1.00 0.00 S ATOM 1397 CE MET B 27 11.203 -2.132 -6.442 1.00 0.00 C ATOM 0 H MET B 27 7.329 -2.562 -5.824 1.00 0.00 H new ATOM 0 HA MET B 27 7.306 -2.851 -8.745 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.014 -3.971 -6.580 1.00 0.00 H new ATOM 0 HB3 MET B 27 8.637 -5.039 -7.918 1.00 0.00 H new ATOM 0 HG2 MET B 27 9.853 -3.821 -9.433 1.00 0.00 H new ATOM 0 HG3 MET B 27 9.535 -2.292 -8.637 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.031 -1.426 -6.507 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.264 -1.607 -6.619 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.186 -2.581 -5.449 1.00 0.00 H new ATOM 1407 N ALA B 28 6.367 -5.319 -8.614 1.00 0.00 N ATOM 1408 CA ALA B 28 5.381 -6.361 -8.802 1.00 0.00 C ATOM 1409 C ALA B 28 4.771 -6.895 -7.509 1.00 0.00 C ATOM 1410 O ALA B 28 3.554 -6.859 -7.334 1.00 0.00 O ATOM 1411 CB ALA B 28 6.002 -7.504 -9.568 1.00 0.00 C ATOM 0 H ALA B 28 7.155 -5.384 -9.258 1.00 0.00 H new ATOM 0 HA ALA B 28 4.562 -5.904 -9.357 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.261 -8.291 -9.711 1.00 0.00 H new ATOM 0 HB2 ALA B 28 6.345 -7.147 -10.539 1.00 0.00 H new ATOM 0 HB3 ALA B 28 6.849 -7.900 -9.007 1.00 0.00 H new ATOM 1417 N GLU B 29 5.611 -7.371 -6.598 1.00 0.00 N ATOM 1418 CA GLU B 29 5.121 -7.910 -5.336 1.00 0.00 C ATOM 1419 C GLU B 29 5.912 -7.359 -4.165 1.00 0.00 C ATOM 1420 O GLU B 29 5.852 -7.898 -3.056 1.00 0.00 O ATOM 1421 CB GLU B 29 5.204 -9.445 -5.309 1.00 0.00 C ATOM 1422 CG GLU B 29 5.454 -10.097 -6.660 1.00 0.00 C ATOM 1423 CD GLU B 29 6.917 -10.382 -6.902 1.00 0.00 C ATOM 1424 OE1 GLU B 29 7.610 -10.808 -5.959 1.00 0.00 O ATOM 1425 OE2 GLU B 29 7.390 -10.155 -8.032 1.00 0.00 O ATOM 0 H GLU B 29 6.625 -7.395 -6.708 1.00 0.00 H new ATOM 0 HA GLU B 29 4.078 -7.607 -5.249 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.002 -9.739 -4.627 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.273 -9.837 -4.899 1.00 0.00 H new ATOM 0 HG2 GLU B 29 4.891 -11.028 -6.720 1.00 0.00 H new ATOM 0 HG3 GLU B 29 5.078 -9.446 -7.449 1.00 0.00 H new ATOM 1432 N ARG B 30 6.626 -6.270 -4.379 1.00 0.00 N ATOM 1433 CA ARG B 30 7.432 -5.717 -3.309 1.00 0.00 C ATOM 1434 C ARG B 30 7.639 -4.224 -3.475 1.00 0.00 C ATOM 1435 O ARG B 30 7.826 -3.725 -4.580 1.00 0.00 O ATOM 1436 CB ARG B 30 8.788 -6.441 -3.231 1.00 0.00 C ATOM 1437 CG ARG B 30 9.931 -5.731 -3.951 1.00 0.00 C ATOM 1438 CD ARG B 30 10.897 -6.717 -4.590 1.00 0.00 C ATOM 1439 NE ARG B 30 10.467 -7.108 -5.933 1.00 0.00 N ATOM 1440 CZ ARG B 30 9.697 -8.163 -6.197 1.00 0.00 C ATOM 1441 NH1 ARG B 30 9.318 -8.981 -5.221 1.00 0.00 N ATOM 1442 NH2 ARG B 30 9.324 -8.414 -7.439 1.00 0.00 N ATOM 0 H ARG B 30 6.665 -5.761 -5.262 1.00 0.00 H new ATOM 0 HA ARG B 30 6.892 -5.872 -2.375 1.00 0.00 H new ATOM 0 HB2 ARG B 30 9.059 -6.565 -2.182 1.00 0.00 H new ATOM 0 HB3 ARG B 30 8.676 -7.440 -3.652 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.524 -5.073 -4.718 1.00 0.00 H new ATOM 0 HG3 ARG B 30 10.470 -5.101 -3.244 1.00 0.00 H new ATOM 0 HD2 ARG B 30 11.890 -6.271 -4.642 1.00 0.00 H new ATOM 0 HD3 ARG B 30 10.979 -7.604 -3.962 1.00 0.00 H new ATOM 0 HE ARG B 30 10.777 -6.536 -6.718 1.00 0.00 H new ATOM 0 HH11 ARG B 30 9.616 -8.803 -4.262 1.00 0.00 H new ATOM 0 HH12 ARG B 30 8.729 -9.787 -5.431 1.00 0.00 H new ATOM 0 HH21 ARG B 30 9.625 -7.800 -8.196 1.00 0.00 H new ATOM 0 HH22 ARG B 30 8.735 -9.222 -7.641 1.00 0.00 H new ATOM 1456 N ILE B 31 7.577 -3.522 -2.367 1.00 0.00 N ATOM 1457 CA ILE B 31 7.805 -2.098 -2.350 1.00 0.00 C ATOM 1458 C ILE B 31 9.208 -1.869 -1.813 1.00 0.00 C ATOM 1459 O ILE B 31 9.517 -2.239 -0.677 1.00 0.00 O ATOM 1460 CB ILE B 31 6.747 -1.354 -1.500 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.186 0.085 -1.228 1.00 0.00 C ATOM 1462 CG2 ILE B 31 6.480 -2.096 -0.199 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.048 1.002 -0.838 1.00 0.00 C ATOM 0 H ILE B 31 7.367 -3.923 -1.453 1.00 0.00 H new ATOM 0 HA ILE B 31 7.713 -1.695 -3.359 1.00 0.00 H new ATOM 0 HB ILE B 31 5.816 -1.322 -2.066 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.930 0.085 -0.432 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.673 0.482 -2.119 1.00 0.00 H new ATOM 0 HG21 ILE B 31 5.733 -1.555 0.382 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.111 -3.098 -0.420 1.00 0.00 H new ATOM 0 HG23 ILE B 31 7.404 -2.168 0.375 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.434 2.006 -0.660 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.313 1.033 -1.643 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.575 0.629 0.071 1.00 0.00 H new ATOM 1475 N ALA B 32 10.071 -1.311 -2.637 1.00 0.00 N ATOM 1476 CA ALA B 32 11.447 -1.096 -2.234 1.00 0.00 C ATOM 1477 C ALA B 32 11.875 0.351 -2.410 1.00 0.00 C ATOM 1478 O ALA B 32 11.574 0.988 -3.412 1.00 0.00 O ATOM 1479 CB ALA B 32 12.367 -2.025 -3.006 1.00 0.00 C ATOM 0 H ALA B 32 9.848 -1.000 -3.582 1.00 0.00 H new ATOM 0 HA ALA B 32 11.519 -1.323 -1.170 1.00 0.00 H new ATOM 0 HB1 ALA B 32 13.398 -1.856 -2.696 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.092 -3.060 -2.803 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.272 -1.827 -4.074 1.00 0.00 H new ATOM 1485 N TRP B 33 12.577 0.854 -1.418 1.00 0.00 N ATOM 1486 CA TRP B 33 13.069 2.214 -1.422 1.00 0.00 C ATOM 1487 C TRP B 33 14.596 2.223 -1.399 1.00 0.00 C ATOM 1488 O TRP B 33 15.221 1.357 -0.780 1.00 0.00 O ATOM 1489 CB TRP B 33 12.496 2.940 -0.193 1.00 0.00 C ATOM 1490 CG TRP B 33 12.983 4.353 0.015 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.267 5.500 -0.161 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.286 4.764 0.449 1.00 0.00 C ATOM 1493 NE1 TRP B 33 13.049 6.592 0.128 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.291 6.165 0.503 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.447 4.079 0.790 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.416 6.892 0.888 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.561 4.788 1.158 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.543 6.188 1.208 1.00 0.00 C ATOM 0 H TRP B 33 12.824 0.327 -0.580 1.00 0.00 H new ATOM 0 HA TRP B 33 12.750 2.728 -2.329 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.409 2.958 -0.278 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.737 2.357 0.696 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.236 5.544 -0.481 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.750 7.566 0.072 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.471 3.000 0.765 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.398 7.971 0.932 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.467 4.259 1.414 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.435 6.720 1.504 1.00 0.00 H new ATOM 1509 N ALA B 34 15.183 3.205 -2.071 1.00 0.00 N ATOM 1510 CA ALA B 34 16.633 3.384 -2.109 1.00 0.00 C ATOM 1511 C ALA B 34 16.945 4.863 -2.286 1.00 0.00 C ATOM 1512 O ALA B 34 16.171 5.566 -2.913 1.00 0.00 O ATOM 1513 CB ALA B 34 17.253 2.580 -3.222 1.00 0.00 C ATOM 0 H ALA B 34 14.668 3.903 -2.607 1.00 0.00 H new ATOM 0 HA ALA B 34 17.058 3.027 -1.171 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.332 2.734 -3.225 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.038 1.522 -3.070 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.838 2.901 -4.178 1.00 0.00 H new ATOM 1519 N PRO B 35 18.069 5.361 -1.751 1.00 0.00 N ATOM 1520 CA PRO B 35 18.423 6.783 -1.853 1.00 0.00 C ATOM 1521 C PRO B 35 18.790 7.191 -3.282 1.00 0.00 C ATOM 1522 O PRO B 35 19.216 6.351 -4.083 1.00 0.00 O ATOM 1523 CB PRO B 35 19.637 6.934 -0.924 1.00 0.00 C ATOM 1524 CG PRO B 35 19.757 5.640 -0.183 1.00 0.00 C ATOM 1525 CD PRO B 35 19.097 4.596 -1.037 1.00 0.00 C ATOM 0 HA PRO B 35 17.585 7.424 -1.578 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.542 7.141 -1.496 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.499 7.767 -0.234 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.803 5.391 -0.005 1.00 0.00 H new ATOM 0 HG3 PRO B 35 19.274 5.705 0.792 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.803 4.129 -1.724 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.662 3.798 -0.436 1.00 0.00 H new ATOM 1533 N GLU B 36 18.631 8.490 -3.570 1.00 0.00 N ATOM 1534 CA GLU B 36 18.915 9.074 -4.889 1.00 0.00 C ATOM 1535 C GLU B 36 18.323 8.231 -6.022 1.00 0.00 C ATOM 1536 O GLU B 36 17.129 8.315 -6.332 1.00 0.00 O ATOM 1537 CB GLU B 36 20.427 9.252 -5.111 1.00 0.00 C ATOM 1538 CG GLU B 36 21.233 9.453 -3.838 1.00 0.00 C ATOM 1539 CD GLU B 36 22.126 8.267 -3.536 1.00 0.00 C ATOM 1540 OE1 GLU B 36 22.726 7.708 -4.482 1.00 0.00 O ATOM 1541 OE2 GLU B 36 22.240 7.878 -2.353 1.00 0.00 O ATOM 0 H GLU B 36 18.299 9.172 -2.888 1.00 0.00 H new ATOM 0 HA GLU B 36 18.440 10.055 -4.904 1.00 0.00 H new ATOM 0 HB2 GLU B 36 20.810 8.376 -5.634 1.00 0.00 H new ATOM 0 HB3 GLU B 36 20.587 10.109 -5.766 1.00 0.00 H new ATOM 0 HG2 GLU B 36 21.844 10.351 -3.934 1.00 0.00 H new ATOM 0 HG3 GLU B 36 20.554 9.617 -3.001 1.00 0.00 H new ATOM 1548 N GLY B 37 19.173 7.421 -6.634 1.00 0.00 N ATOM 1549 CA GLY B 37 18.755 6.562 -7.717 1.00 0.00 C ATOM 1550 C GLY B 37 19.597 5.310 -7.764 1.00 0.00 C ATOM 1551 O GLY B 37 19.933 4.818 -8.839 1.00 0.00 O ATOM 0 H GLY B 37 20.161 7.345 -6.393 1.00 0.00 H new ATOM 0 HA2 GLY B 37 17.706 6.295 -7.591 1.00 0.00 H new ATOM 0 HA3 GLY B 37 18.837 7.096 -8.663 1.00 0.00 H new ATOM 1555 N LYS B 38 19.947 4.813 -6.585 1.00 0.00 N ATOM 1556 CA LYS B 38 20.765 3.615 -6.464 1.00 0.00 C ATOM 1557 C LYS B 38 20.031 2.386 -6.986 1.00 0.00 C ATOM 1558 O LYS B 38 18.807 2.290 -6.887 1.00 0.00 O ATOM 1559 CB LYS B 38 21.172 3.395 -5.004 1.00 0.00 C ATOM 1560 CG LYS B 38 22.312 4.288 -4.544 1.00 0.00 C ATOM 1561 CD LYS B 38 22.608 4.093 -3.065 1.00 0.00 C ATOM 1562 CE LYS B 38 23.975 4.645 -2.688 1.00 0.00 C ATOM 1563 NZ LYS B 38 24.060 6.115 -2.887 1.00 0.00 N ATOM 0 H LYS B 38 19.674 5.225 -5.693 1.00 0.00 H new ATOM 0 HA LYS B 38 21.659 3.761 -7.070 1.00 0.00 H new ATOM 0 HB2 LYS B 38 20.306 3.569 -4.365 1.00 0.00 H new ATOM 0 HB3 LYS B 38 21.463 2.353 -4.871 1.00 0.00 H new ATOM 0 HG2 LYS B 38 23.206 4.069 -5.127 1.00 0.00 H new ATOM 0 HG3 LYS B 38 22.057 5.331 -4.731 1.00 0.00 H new ATOM 0 HD2 LYS B 38 21.839 4.588 -2.472 1.00 0.00 H new ATOM 0 HD3 LYS B 38 22.564 3.031 -2.822 1.00 0.00 H new ATOM 0 HE2 LYS B 38 24.186 4.408 -1.645 1.00 0.00 H new ATOM 0 HE3 LYS B 38 24.741 4.154 -3.287 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 25.048 6.423 -2.782 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 23.721 6.356 -3.840 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 23.470 6.596 -2.178 1.00 0.00 H new ATOM 1577 N ASP B 39 20.796 1.455 -7.539 1.00 0.00 N ATOM 1578 CA ASP B 39 20.249 0.216 -8.079 1.00 0.00 C ATOM 1579 C ASP B 39 19.882 -0.731 -6.943 1.00 0.00 C ATOM 1580 O ASP B 39 18.886 -1.453 -7.010 1.00 0.00 O ATOM 1581 CB ASP B 39 21.262 -0.450 -9.025 1.00 0.00 C ATOM 1582 CG ASP B 39 22.553 -0.866 -8.331 1.00 0.00 C ATOM 1583 OD1 ASP B 39 22.995 -0.157 -7.395 1.00 0.00 O ATOM 1584 OD2 ASP B 39 23.131 -1.904 -8.711 1.00 0.00 O ATOM 0 H ASP B 39 21.809 1.536 -7.626 1.00 0.00 H new ATOM 0 HA ASP B 39 19.349 0.449 -8.647 1.00 0.00 H new ATOM 0 HB2 ASP B 39 20.802 -1.328 -9.478 1.00 0.00 H new ATOM 0 HB3 ASP B 39 21.499 0.239 -9.835 1.00 0.00 H new ATOM 1589 N ARG B 40 20.694 -0.717 -5.897 1.00 0.00 N ATOM 1590 CA ARG B 40 20.457 -1.554 -4.737 1.00 0.00 C ATOM 1591 C ARG B 40 19.572 -0.821 -3.738 1.00 0.00 C ATOM 1592 O ARG B 40 19.926 0.251 -3.241 1.00 0.00 O ATOM 1593 CB ARG B 40 21.783 -1.970 -4.088 1.00 0.00 C ATOM 1594 CG ARG B 40 22.786 -0.834 -3.946 1.00 0.00 C ATOM 1595 CD ARG B 40 24.194 -1.295 -4.286 1.00 0.00 C ATOM 1596 NE ARG B 40 24.306 -1.713 -5.682 1.00 0.00 N ATOM 1597 CZ ARG B 40 25.099 -2.688 -6.117 1.00 0.00 C ATOM 1598 NH1 ARG B 40 25.906 -3.325 -5.272 1.00 0.00 N ATOM 1599 NH2 ARG B 40 25.086 -3.020 -7.400 1.00 0.00 N ATOM 0 H ARG B 40 21.526 -0.131 -5.830 1.00 0.00 H new ATOM 0 HA ARG B 40 19.943 -2.460 -5.058 1.00 0.00 H new ATOM 0 HB2 ARG B 40 21.578 -2.386 -3.101 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.233 -2.766 -4.682 1.00 0.00 H new ATOM 0 HG2 ARG B 40 22.502 -0.011 -4.602 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.763 -0.451 -2.926 1.00 0.00 H new ATOM 0 HD2 ARG B 40 24.898 -0.486 -4.091 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.472 -2.124 -3.635 1.00 0.00 H new ATOM 0 HE ARG B 40 23.736 -1.222 -6.371 1.00 0.00 H new ATOM 0 HH11 ARG B 40 25.918 -3.066 -4.285 1.00 0.00 H new ATOM 0 HH12 ARG B 40 26.512 -4.072 -5.611 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.470 -2.529 -8.048 1.00 0.00 H new ATOM 0 HH22 ARG B 40 25.692 -3.767 -7.740 1.00 0.00 H new ATOM 1613 N PHE B 41 18.420 -1.404 -3.457 1.00 0.00 N ATOM 1614 CA PHE B 41 17.466 -0.817 -2.534 1.00 0.00 C ATOM 1615 C PHE B 41 17.893 -1.038 -1.091 1.00 0.00 C ATOM 1616 O PHE B 41 18.613 -1.984 -0.779 1.00 0.00 O ATOM 1617 CB PHE B 41 16.075 -1.402 -2.774 1.00 0.00 C ATOM 1618 CG PHE B 41 15.598 -1.238 -4.189 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.155 -0.007 -4.646 1.00 0.00 C ATOM 1620 CD2 PHE B 41 15.594 -2.313 -5.063 1.00 0.00 C ATOM 1621 CE1 PHE B 41 14.718 0.148 -5.948 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.161 -2.164 -6.366 1.00 0.00 C ATOM 1623 CZ PHE B 41 14.721 -0.932 -6.809 1.00 0.00 C ATOM 0 H PHE B 41 18.121 -2.292 -3.860 1.00 0.00 H new ATOM 0 HA PHE B 41 17.434 0.258 -2.713 1.00 0.00 H new ATOM 0 HB2 PHE B 41 16.086 -2.462 -2.522 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.365 -0.922 -2.101 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.151 0.841 -3.977 1.00 0.00 H new ATOM 0 HD2 PHE B 41 15.934 -3.280 -4.721 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.375 1.113 -6.292 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.166 -3.010 -7.038 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.380 -0.813 -7.827 1.00 0.00 H new ATOM 1633 N THR B 42 17.442 -0.155 -0.221 1.00 0.00 N ATOM 1634 CA THR B 42 17.765 -0.224 1.192 1.00 0.00 C ATOM 1635 C THR B 42 16.622 -0.860 1.980 1.00 0.00 C ATOM 1636 O THR B 42 16.839 -1.689 2.861 1.00 0.00 O ATOM 1637 CB THR B 42 18.047 1.187 1.739 1.00 0.00 C ATOM 1638 OG1 THR B 42 19.186 1.743 1.070 1.00 0.00 O ATOM 1639 CG2 THR B 42 18.284 1.166 3.242 1.00 0.00 C ATOM 0 H THR B 42 16.842 0.630 -0.473 1.00 0.00 H new ATOM 0 HA THR B 42 18.655 -0.843 1.308 1.00 0.00 H new ATOM 0 HB THR B 42 17.170 1.807 1.550 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.363 2.642 1.418 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.480 2.179 3.594 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.400 0.772 3.744 1.00 0.00 H new ATOM 0 HG23 THR B 42 19.142 0.532 3.466 1.00 0.00 H new ATOM 1647 N ILE B 43 15.405 -0.475 1.642 1.00 0.00 N ATOM 1648 CA ILE B 43 14.229 -0.985 2.322 1.00 0.00 C ATOM 1649 C ILE B 43 13.331 -1.730 1.343 1.00 0.00 C ATOM 1650 O ILE B 43 12.901 -1.169 0.341 1.00 0.00 O ATOM 1651 CB ILE B 43 13.459 0.176 2.996 1.00 0.00 C ATOM 1652 CG1 ILE B 43 14.034 0.446 4.386 1.00 0.00 C ATOM 1653 CG2 ILE B 43 11.964 -0.111 3.082 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.635 1.789 4.949 1.00 0.00 C ATOM 0 H ILE B 43 15.205 0.192 0.897 1.00 0.00 H new ATOM 0 HA ILE B 43 14.545 -1.685 3.095 1.00 0.00 H new ATOM 0 HB ILE B 43 13.584 1.065 2.377 1.00 0.00 H new ATOM 0 HG12 ILE B 43 13.703 -0.338 5.067 1.00 0.00 H new ATOM 0 HG13 ILE B 43 15.121 0.389 4.339 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.459 0.728 3.561 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.562 -0.251 2.079 1.00 0.00 H new ATOM 0 HG23 ILE B 43 11.800 -1.016 3.668 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.077 1.915 5.937 1.00 0.00 H new ATOM 0 HD12 ILE B 43 13.990 2.580 4.289 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.549 1.842 5.028 1.00 0.00 H new ATOM 1666 N SER B 44 13.094 -3.005 1.612 1.00 0.00 N ATOM 1667 CA SER B 44 12.246 -3.821 0.758 1.00 0.00 C ATOM 1668 C SER B 44 11.159 -4.513 1.575 1.00 0.00 C ATOM 1669 O SER B 44 11.454 -5.257 2.511 1.00 0.00 O ATOM 1670 CB SER B 44 13.091 -4.855 0.014 1.00 0.00 C ATOM 1671 OG SER B 44 14.189 -4.239 -0.638 1.00 0.00 O ATOM 0 H SER B 44 13.479 -3.498 2.418 1.00 0.00 H new ATOM 0 HA SER B 44 11.761 -3.170 0.030 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.455 -5.606 0.716 1.00 0.00 H new ATOM 0 HB3 SER B 44 12.474 -5.375 -0.718 1.00 0.00 H new ATOM 0 HG SER B 44 14.716 -4.920 -1.106 1.00 0.00 H new ATOM 1677 N HIS B 45 9.907 -4.264 1.222 1.00 0.00 N ATOM 1678 CA HIS B 45 8.778 -4.868 1.904 1.00 0.00 C ATOM 1679 C HIS B 45 7.928 -5.596 0.888 1.00 0.00 C ATOM 1680 O HIS B 45 7.585 -5.049 -0.157 1.00 0.00 O ATOM 1681 CB HIS B 45 7.921 -3.820 2.625 1.00 0.00 C ATOM 1682 CG HIS B 45 8.645 -3.036 3.677 1.00 0.00 C ATOM 1683 ND1 HIS B 45 9.224 -3.592 4.798 1.00 0.00 N ATOM 1684 CD2 HIS B 45 8.871 -1.703 3.763 1.00 0.00 C ATOM 1685 CE1 HIS B 45 9.771 -2.599 5.513 1.00 0.00 C ATOM 1686 NE2 HIS B 45 9.583 -1.433 4.926 1.00 0.00 N ATOM 0 H HIS B 45 9.648 -3.640 0.458 1.00 0.00 H new ATOM 0 HA HIS B 45 9.161 -5.559 2.655 1.00 0.00 H new ATOM 0 HB2 HIS B 45 7.521 -3.127 1.885 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.070 -4.321 3.086 1.00 0.00 H new ATOM 0 HD1 HIS B 45 9.234 -4.583 5.040 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.549 -0.966 3.042 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.296 -2.736 6.447 1.00 0.00 H new ATOM 1694 N MET B 46 7.612 -6.834 1.174 1.00 0.00 N ATOM 1695 CA MET B 46 6.801 -7.621 0.274 1.00 0.00 C ATOM 1696 C MET B 46 5.334 -7.341 0.540 1.00 0.00 C ATOM 1697 O MET B 46 4.910 -7.324 1.692 1.00 0.00 O ATOM 1698 CB MET B 46 7.118 -9.097 0.454 1.00 0.00 C ATOM 1699 CG MET B 46 8.322 -9.556 -0.351 1.00 0.00 C ATOM 1700 SD MET B 46 8.100 -11.196 -1.063 1.00 0.00 S ATOM 1701 CE MET B 46 6.974 -10.827 -2.406 1.00 0.00 C ATOM 0 H MET B 46 7.903 -7.320 2.022 1.00 0.00 H new ATOM 0 HA MET B 46 7.023 -7.349 -0.758 1.00 0.00 H new ATOM 0 HB2 MET B 46 7.299 -9.296 1.510 1.00 0.00 H new ATOM 0 HB3 MET B 46 6.249 -9.686 0.162 1.00 0.00 H new ATOM 0 HG2 MET B 46 8.513 -8.840 -1.151 1.00 0.00 H new ATOM 0 HG3 MET B 46 9.203 -9.560 0.291 1.00 0.00 H new ATOM 0 HE1 MET B 46 6.573 -11.756 -2.810 1.00 0.00 H new ATOM 0 HE2 MET B 46 6.156 -10.209 -2.036 1.00 0.00 H new ATOM 0 HE3 MET B 46 7.507 -10.290 -3.191 1.00 0.00 H new ATOM 1711 N TYR B 47 4.563 -7.137 -0.526 1.00 0.00 N ATOM 1712 CA TYR B 47 3.131 -6.826 -0.410 1.00 0.00 C ATOM 1713 C TYR B 47 2.367 -7.911 0.353 1.00 0.00 C ATOM 1714 O TYR B 47 1.211 -7.726 0.718 1.00 0.00 O ATOM 1715 CB TYR B 47 2.494 -6.656 -1.795 1.00 0.00 C ATOM 1716 CG TYR B 47 2.992 -5.457 -2.572 1.00 0.00 C ATOM 1717 CD1 TYR B 47 3.706 -4.445 -1.947 1.00 0.00 C ATOM 1718 CD2 TYR B 47 2.745 -5.340 -3.934 1.00 0.00 C ATOM 1719 CE1 TYR B 47 4.160 -3.353 -2.654 1.00 0.00 C ATOM 1720 CE2 TYR B 47 3.199 -4.249 -4.647 1.00 0.00 C ATOM 1721 CZ TYR B 47 3.906 -3.259 -4.001 1.00 0.00 C ATOM 1722 OH TYR B 47 4.360 -2.170 -4.703 1.00 0.00 O ATOM 0 H TYR B 47 4.904 -7.181 -1.486 1.00 0.00 H new ATOM 0 HA TYR B 47 3.062 -5.892 0.148 1.00 0.00 H new ATOM 0 HB2 TYR B 47 2.682 -7.556 -2.380 1.00 0.00 H new ATOM 0 HB3 TYR B 47 1.414 -6.573 -1.676 1.00 0.00 H new ATOM 0 HD1 TYR B 47 3.909 -4.514 -0.889 1.00 0.00 H new ATOM 0 HD2 TYR B 47 2.190 -6.114 -4.442 1.00 0.00 H new ATOM 0 HE1 TYR B 47 4.714 -2.574 -2.151 1.00 0.00 H new ATOM 0 HE2 TYR B 47 3.001 -4.172 -5.706 1.00 0.00 H new ATOM 0 HH TYR B 47 5.084 -2.446 -5.303 1.00 0.00 H new ATOM 1732 N ALA B 48 3.016 -9.045 0.571 1.00 0.00 N ATOM 1733 CA ALA B 48 2.404 -10.154 1.279 1.00 0.00 C ATOM 1734 C ALA B 48 2.438 -9.937 2.788 1.00 0.00 C ATOM 1735 O ALA B 48 1.483 -10.262 3.490 1.00 0.00 O ATOM 1736 CB ALA B 48 3.100 -11.458 0.913 1.00 0.00 C ATOM 0 H ALA B 48 3.973 -9.220 0.264 1.00 0.00 H new ATOM 0 HA ALA B 48 1.359 -10.212 0.976 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.632 -12.283 1.450 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.013 -11.628 -0.160 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.153 -11.397 1.187 1.00 0.00 H new ATOM 1742 N ASP B 49 3.531 -9.363 3.278 1.00 0.00 N ATOM 1743 CA ASP B 49 3.689 -9.126 4.708 1.00 0.00 C ATOM 1744 C ASP B 49 3.034 -7.818 5.122 1.00 0.00 C ATOM 1745 O ASP B 49 2.608 -7.673 6.261 1.00 0.00 O ATOM 1746 CB ASP B 49 5.179 -9.143 5.089 1.00 0.00 C ATOM 1747 CG ASP B 49 5.582 -8.017 6.029 1.00 0.00 C ATOM 1748 OD1 ASP B 49 5.307 -8.120 7.248 1.00 0.00 O ATOM 1749 OD2 ASP B 49 6.178 -7.032 5.546 1.00 0.00 O ATOM 0 H ASP B 49 4.319 -9.054 2.708 1.00 0.00 H new ATOM 0 HA ASP B 49 3.187 -9.929 5.247 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.414 -10.098 5.559 1.00 0.00 H new ATOM 0 HB3 ASP B 49 5.778 -9.078 4.181 1.00 0.00 H new ATOM 1754 N ILE B 50 2.932 -6.874 4.201 1.00 0.00 N ATOM 1755 CA ILE B 50 2.320 -5.596 4.521 1.00 0.00 C ATOM 1756 C ILE B 50 0.848 -5.779 4.873 1.00 0.00 C ATOM 1757 O ILE B 50 0.031 -6.151 4.031 1.00 0.00 O ATOM 1758 CB ILE B 50 2.454 -4.573 3.380 1.00 0.00 C ATOM 1759 CG1 ILE B 50 3.824 -4.684 2.717 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.252 -3.169 3.925 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.008 -3.737 1.556 1.00 0.00 C ATOM 0 H ILE B 50 3.260 -6.966 3.239 1.00 0.00 H new ATOM 0 HA ILE B 50 2.859 -5.201 5.383 1.00 0.00 H new ATOM 0 HB ILE B 50 1.691 -4.783 2.630 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.596 -4.489 3.461 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.969 -5.707 2.368 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.348 -2.447 3.114 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.259 -3.090 4.367 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.005 -2.962 4.686 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.003 -3.870 1.132 1.00 0.00 H new ATOM 0 HD12 ILE B 50 3.258 -3.947 0.793 1.00 0.00 H new ATOM 0 HD13 ILE B 50 3.895 -2.710 1.903 1.00 0.00 H new ATOM 1773 N LYS B 51 0.531 -5.522 6.133 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.820 -5.656 6.642 1.00 0.00 C ATOM 1775 C LYS B 51 -1.726 -4.592 6.059 1.00 0.00 C ATOM 1776 O LYS B 51 -2.701 -4.893 5.371 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.814 -5.529 8.167 1.00 0.00 C ATOM 1778 CG LYS B 51 -2.199 -5.572 8.781 1.00 0.00 C ATOM 1779 CD LYS B 51 -2.376 -4.510 9.848 1.00 0.00 C ATOM 1780 CE LYS B 51 -3.838 -4.386 10.235 1.00 0.00 C ATOM 1781 NZ LYS B 51 -4.103 -3.204 11.102 1.00 0.00 N ATOM 0 H LYS B 51 1.208 -5.214 6.831 1.00 0.00 H new ATOM 0 HA LYS B 51 -1.197 -6.637 6.351 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -0.213 -6.334 8.589 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -0.331 -4.592 8.444 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.947 -5.431 8.001 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.373 -6.556 9.216 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.782 -4.765 10.725 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -2.008 -3.552 9.481 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.444 -4.313 9.332 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -4.150 -5.291 10.756 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -5.002 -3.339 11.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -3.331 -3.098 11.791 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -4.162 -2.348 10.514 1.00 0.00 H new ATOM 1795 N CYS B 52 -1.384 -3.350 6.348 1.00 0.00 N ATOM 1796 CA CYS B 52 -2.150 -2.207 5.893 1.00 0.00 C ATOM 1797 C CYS B 52 -1.217 -1.029 5.695 1.00 0.00 C ATOM 1798 O CYS B 52 0.001 -1.161 5.810 1.00 0.00 O ATOM 1799 CB CYS B 52 -3.249 -1.861 6.905 1.00 0.00 C ATOM 1800 SG CYS B 52 -4.607 -3.058 6.953 1.00 0.00 S ATOM 0 H CYS B 52 -0.566 -3.106 6.906 1.00 0.00 H new ATOM 0 HA CYS B 52 -2.631 -2.448 4.945 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.805 -1.790 7.898 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.653 -0.877 6.665 1.00 0.00 H new ATOM 0 HG CYS B 52 -4.274 -4.119 6.280 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.780 0.114 5.395 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.997 1.302 5.167 1.00 0.00 C ATOM 1808 C GLN B 53 -1.495 2.410 6.076 1.00 0.00 C ATOM 1809 O GLN B 53 -2.424 2.206 6.839 1.00 0.00 O ATOM 1810 CB GLN B 53 -1.093 1.739 3.696 1.00 0.00 C ATOM 1811 CG GLN B 53 -1.099 0.591 2.689 1.00 0.00 C ATOM 1812 CD GLN B 53 -2.479 -0.028 2.488 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -2.869 -0.950 3.191 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -3.220 0.459 1.514 1.00 0.00 N ATOM 0 H GLN B 53 -2.787 0.247 5.302 1.00 0.00 H new ATOM 0 HA GLN B 53 0.048 1.089 5.390 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -2.002 2.325 3.564 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -0.254 2.397 3.471 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -0.729 0.955 1.731 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.407 -0.182 3.025 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -2.870 1.228 0.943 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.144 0.067 1.331 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.850 3.556 6.019 1.00 0.00 N ATOM 1824 CA LYS B 54 -1.241 4.726 6.786 1.00 0.00 C ATOM 1825 C LYS B 54 -0.739 5.943 6.034 1.00 0.00 C ATOM 1826 O LYS B 54 0.371 5.934 5.519 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.704 4.664 8.220 1.00 0.00 C ATOM 1828 CG LYS B 54 -1.618 3.877 9.151 1.00 0.00 C ATOM 1829 CD LYS B 54 -0.973 3.589 10.488 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.055 4.787 11.407 1.00 0.00 C ATOM 1831 NZ LYS B 54 0.053 4.793 12.399 1.00 0.00 N ATOM 0 H LYS B 54 -0.029 3.706 5.432 1.00 0.00 H new ATOM 0 HA LYS B 54 -2.325 4.775 6.887 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.285 4.206 8.215 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.585 5.677 8.604 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -2.540 4.437 9.309 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -1.894 2.936 8.674 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -1.464 2.735 10.955 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.071 3.313 10.339 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -1.020 5.702 10.816 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -2.012 4.781 11.929 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 0.143 5.743 12.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -0.151 4.104 13.151 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 0.943 4.536 11.927 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.548 6.981 5.933 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.153 8.148 5.148 1.00 0.00 C ATOM 1847 C ILE B 55 -1.495 9.471 5.786 1.00 0.00 C ATOM 1848 O ILE B 55 -2.355 9.548 6.645 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.890 8.135 3.809 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.399 8.102 4.057 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.458 6.947 2.988 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.220 8.443 2.844 1.00 0.00 C ATOM 0 H ILE B 55 -2.466 7.046 6.373 1.00 0.00 H new ATOM 0 HA ILE B 55 -0.070 8.071 5.055 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.644 9.039 3.252 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.679 7.108 4.406 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.642 8.801 4.857 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -1.990 6.949 2.037 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.385 7.003 2.804 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.686 6.029 3.529 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.279 8.399 3.097 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.969 9.449 2.506 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -4.007 7.729 2.048 1.00 0.00 H new ATOM 1864 N SER B 56 -0.822 10.509 5.317 1.00 0.00 N ATOM 1865 CA SER B 56 -1.086 11.863 5.755 1.00 0.00 C ATOM 1866 C SER B 56 -2.195 12.423 4.874 1.00 0.00 C ATOM 1867 O SER B 56 -1.966 12.770 3.715 1.00 0.00 O ATOM 1868 CB SER B 56 0.177 12.705 5.626 1.00 0.00 C ATOM 1869 OG SER B 56 0.975 12.241 4.553 1.00 0.00 O ATOM 0 H SER B 56 -0.079 10.433 4.623 1.00 0.00 H new ATOM 0 HA SER B 56 -1.393 11.879 6.801 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.090 13.749 5.463 1.00 0.00 H new ATOM 0 HB3 SER B 56 0.746 12.663 6.555 1.00 0.00 H new ATOM 0 HG SER B 56 1.503 11.470 4.848 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.418 12.472 5.391 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.581 12.937 4.641 1.00 0.00 C ATOM 1877 C PRO B 57 -4.576 14.450 4.457 1.00 0.00 C ATOM 1878 O PRO B 57 -4.046 15.182 5.295 1.00 0.00 O ATOM 1879 CB PRO B 57 -5.761 12.476 5.499 1.00 0.00 C ATOM 1880 CG PRO B 57 -5.163 11.581 6.519 1.00 0.00 C ATOM 1881 CD PRO B 57 -3.792 12.104 6.750 1.00 0.00 C ATOM 0 HA PRO B 57 -4.612 12.540 3.626 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -6.266 13.323 5.964 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.504 11.951 4.899 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.747 11.590 7.439 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.136 10.549 6.168 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -3.782 12.957 7.428 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -3.127 11.352 7.174 1.00 0.00 H new ATOM 1889 N GLU B 58 -5.149 14.902 3.343 1.00 0.00 N ATOM 1890 CA GLU B 58 -5.224 16.326 3.005 1.00 0.00 C ATOM 1891 C GLU B 58 -3.834 16.965 2.943 1.00 0.00 C ATOM 1892 O GLU B 58 -3.686 18.183 3.073 1.00 0.00 O ATOM 1893 CB GLU B 58 -6.119 17.072 4.004 1.00 0.00 C ATOM 1894 CG GLU B 58 -7.494 16.440 4.182 1.00 0.00 C ATOM 1895 CD GLU B 58 -8.053 15.873 2.889 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -8.638 16.646 2.105 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -7.895 14.653 2.658 1.00 0.00 O ATOM 0 H GLU B 58 -5.576 14.291 2.646 1.00 0.00 H new ATOM 0 HA GLU B 58 -5.668 16.407 2.013 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -5.617 17.109 4.971 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -6.242 18.102 3.670 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -7.430 15.644 4.924 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -8.184 17.187 4.574 1.00 0.00 H new ATOM 1904 N GLY B 59 -2.816 16.136 2.742 1.00 0.00 N ATOM 1905 CA GLY B 59 -1.456 16.630 2.655 1.00 0.00 C ATOM 1906 C GLY B 59 -0.804 16.798 4.012 1.00 0.00 C ATOM 1907 O GLY B 59 0.266 16.248 4.255 1.00 0.00 O ATOM 0 H GLY B 59 -2.910 15.126 2.637 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -0.862 15.941 2.054 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -1.455 17.588 2.135 1.00 0.00 H new ATOM 1911 N LYS B 60 -1.455 17.574 4.883 1.00 0.00 N ATOM 1912 CA LYS B 60 -0.972 17.855 6.242 1.00 0.00 C ATOM 1913 C LYS B 60 0.460 18.430 6.235 1.00 0.00 C ATOM 1914 O LYS B 60 1.192 18.337 7.228 1.00 0.00 O ATOM 1915 CB LYS B 60 -1.094 16.597 7.137 1.00 0.00 C ATOM 1916 CG LYS B 60 0.141 15.713 7.194 1.00 0.00 C ATOM 1917 CD LYS B 60 0.125 14.823 8.422 1.00 0.00 C ATOM 1918 CE LYS B 60 0.751 15.500 9.636 1.00 0.00 C ATOM 1919 NZ LYS B 60 -0.160 16.478 10.294 1.00 0.00 N ATOM 0 H LYS B 60 -2.341 18.030 4.665 1.00 0.00 H new ATOM 0 HA LYS B 60 -1.609 18.627 6.672 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -1.339 16.916 8.150 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -1.932 15.998 6.780 1.00 0.00 H new ATOM 0 HG2 LYS B 60 0.192 15.097 6.296 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.036 16.335 7.205 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -0.903 14.546 8.654 1.00 0.00 H new ATOM 0 HD3 LYS B 60 0.663 13.900 8.206 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.041 14.738 10.360 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.663 16.012 9.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 0.019 16.485 11.318 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 0.012 17.428 9.906 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -1.148 16.205 10.117 1.00 0.00 H new ATOM 1933 N ALA B 61 0.819 19.062 5.108 1.00 0.00 N ATOM 1934 CA ALA B 61 2.139 19.681 4.893 1.00 0.00 C ATOM 1935 C ALA B 61 3.217 18.634 4.635 1.00 0.00 C ATOM 1936 O ALA B 61 3.892 18.674 3.610 1.00 0.00 O ATOM 1937 CB ALA B 61 2.537 20.589 6.048 1.00 0.00 C ATOM 0 H ALA B 61 0.193 19.160 4.308 1.00 0.00 H new ATOM 0 HA ALA B 61 2.051 20.300 4.000 1.00 0.00 H new ATOM 0 HB1 ALA B 61 3.516 21.024 5.848 1.00 0.00 H new ATOM 0 HB2 ALA B 61 1.801 21.386 6.155 1.00 0.00 H new ATOM 0 HB3 ALA B 61 2.579 20.008 6.969 1.00 0.00 H new ATOM 1943 N LYS B 62 3.389 17.712 5.569 1.00 0.00 N ATOM 1944 CA LYS B 62 4.371 16.649 5.418 1.00 0.00 C ATOM 1945 C LYS B 62 3.734 15.492 4.669 1.00 0.00 C ATOM 1946 O LYS B 62 2.835 14.835 5.194 1.00 0.00 O ATOM 1947 CB LYS B 62 4.871 16.167 6.786 1.00 0.00 C ATOM 1948 CG LYS B 62 5.937 17.058 7.411 1.00 0.00 C ATOM 1949 CD LYS B 62 7.270 16.330 7.553 1.00 0.00 C ATOM 1950 CE LYS B 62 7.150 15.091 8.431 1.00 0.00 C ATOM 1951 NZ LYS B 62 8.364 14.233 8.362 1.00 0.00 N ATOM 0 H LYS B 62 2.861 17.678 6.441 1.00 0.00 H new ATOM 0 HA LYS B 62 5.225 17.033 4.860 1.00 0.00 H new ATOM 0 HB2 LYS B 62 4.023 16.101 7.468 1.00 0.00 H new ATOM 0 HB3 LYS B 62 5.273 15.159 6.679 1.00 0.00 H new ATOM 0 HG2 LYS B 62 6.072 17.948 6.797 1.00 0.00 H new ATOM 0 HG3 LYS B 62 5.600 17.395 8.391 1.00 0.00 H new ATOM 0 HD2 LYS B 62 7.633 16.042 6.566 1.00 0.00 H new ATOM 0 HD3 LYS B 62 8.010 17.007 7.980 1.00 0.00 H new ATOM 0 HE2 LYS B 62 6.980 15.395 9.464 1.00 0.00 H new ATOM 0 HE3 LYS B 62 6.280 14.512 8.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 8.096 13.240 8.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 8.806 14.332 7.426 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 9.039 14.527 9.097 1.00 0.00 H new ATOM 1965 N ILE B 63 4.186 15.237 3.447 1.00 0.00 N ATOM 1966 CA ILE B 63 3.623 14.159 2.663 1.00 0.00 C ATOM 1967 C ILE B 63 4.276 12.848 3.090 1.00 0.00 C ATOM 1968 O ILE B 63 5.256 12.395 2.505 1.00 0.00 O ATOM 1969 CB ILE B 63 3.795 14.411 1.154 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.985 15.641 0.738 1.00 0.00 C ATOM 1971 CG2 ILE B 63 3.332 13.201 0.357 1.00 0.00 C ATOM 1972 CD1 ILE B 63 3.635 16.975 1.031 1.00 0.00 C ATOM 0 H ILE B 63 4.932 15.758 2.987 1.00 0.00 H new ATOM 0 HA ILE B 63 2.550 14.102 2.846 1.00 0.00 H new ATOM 0 HB ILE B 63 4.851 14.585 0.948 1.00 0.00 H new ATOM 0 HG12 ILE B 63 2.787 15.580 -0.332 1.00 0.00 H new ATOM 0 HG13 ILE B 63 2.020 15.607 1.243 1.00 0.00 H new ATOM 0 HG21 ILE B 63 3.460 13.396 -0.708 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.924 12.331 0.641 1.00 0.00 H new ATOM 0 HG23 ILE B 63 2.280 13.008 0.566 1.00 0.00 H new ATOM 0 HD11 ILE B 63 2.980 17.780 0.698 1.00 0.00 H new ATOM 0 HD12 ILE B 63 3.808 17.068 2.103 1.00 0.00 H new ATOM 0 HD13 ILE B 63 4.587 17.040 0.503 1.00 0.00 H new ATOM 1984 N GLN B 64 3.717 12.257 4.127 1.00 0.00 N ATOM 1985 CA GLN B 64 4.250 11.034 4.710 1.00 0.00 C ATOM 1986 C GLN B 64 3.327 9.827 4.495 1.00 0.00 C ATOM 1987 O GLN B 64 2.113 9.901 4.714 1.00 0.00 O ATOM 1988 CB GLN B 64 4.484 11.277 6.202 1.00 0.00 C ATOM 1989 CG GLN B 64 3.478 12.238 6.827 1.00 0.00 C ATOM 1990 CD GLN B 64 3.876 12.718 8.211 1.00 0.00 C ATOM 1991 OE1 GLN B 64 5.047 12.870 8.520 1.00 0.00 O ATOM 1992 NE2 GLN B 64 2.890 12.956 9.063 1.00 0.00 N ATOM 0 H GLN B 64 2.880 12.608 4.592 1.00 0.00 H new ATOM 0 HA GLN B 64 5.187 10.790 4.210 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.439 10.324 6.729 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.490 11.673 6.344 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.358 13.101 6.173 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.507 11.746 6.887 1.00 0.00 H new ATOM 0 HE21 GLN B 64 1.922 12.819 8.773 1.00 0.00 H new ATOM 0 HE22 GLN B 64 3.099 13.276 10.009 1.00 0.00 H new ATOM 2001 N LEU B 65 3.919 8.722 4.061 1.00 0.00 N ATOM 2002 CA LEU B 65 3.197 7.477 3.809 1.00 0.00 C ATOM 2003 C LEU B 65 3.767 6.350 4.668 1.00 0.00 C ATOM 2004 O LEU B 65 4.922 5.986 4.516 1.00 0.00 O ATOM 2005 CB LEU B 65 3.341 7.086 2.343 1.00 0.00 C ATOM 2006 CG LEU B 65 2.526 5.869 1.910 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.156 6.280 1.385 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.295 5.060 0.884 1.00 0.00 C ATOM 0 H LEU B 65 4.920 8.662 3.872 1.00 0.00 H new ATOM 0 HA LEU B 65 2.147 7.632 4.057 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.049 7.936 1.727 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.393 6.890 2.138 1.00 0.00 H new ATOM 0 HG LEU B 65 2.358 5.238 2.783 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.600 5.392 1.085 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.608 6.803 2.169 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.278 6.939 0.526 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.703 4.196 0.584 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.500 5.680 0.011 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.236 4.722 1.318 1.00 0.00 H new ATOM 2020 N GLN B 66 2.960 5.775 5.537 1.00 0.00 N ATOM 2021 CA GLN B 66 3.426 4.705 6.407 1.00 0.00 C ATOM 2022 C GLN B 66 2.924 3.341 5.950 1.00 0.00 C ATOM 2023 O GLN B 66 1.771 3.188 5.552 1.00 0.00 O ATOM 2024 CB GLN B 66 2.981 4.961 7.838 1.00 0.00 C ATOM 2025 CG GLN B 66 3.507 3.949 8.843 1.00 0.00 C ATOM 2026 CD GLN B 66 3.018 4.225 10.250 1.00 0.00 C ATOM 2027 OE1 GLN B 66 1.992 3.704 10.676 1.00 0.00 O ATOM 2028 NE2 GLN B 66 3.747 5.049 10.979 1.00 0.00 N ATOM 0 H GLN B 66 1.980 6.027 5.662 1.00 0.00 H new ATOM 0 HA GLN B 66 4.515 4.696 6.357 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.309 5.957 8.136 1.00 0.00 H new ATOM 0 HB3 GLN B 66 1.892 4.960 7.874 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.197 2.948 8.543 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.597 3.962 8.831 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.594 5.462 10.589 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.463 5.273 11.933 1.00 0.00 H new ATOM 2037 N LEU B 67 3.812 2.364 5.988 1.00 0.00 N ATOM 2038 CA LEU B 67 3.483 0.998 5.631 1.00 0.00 C ATOM 2039 C LEU B 67 3.421 0.154 6.887 1.00 0.00 C ATOM 2040 O LEU B 67 4.434 -0.044 7.553 1.00 0.00 O ATOM 2041 CB LEU B 67 4.531 0.409 4.693 1.00 0.00 C ATOM 2042 CG LEU B 67 4.579 1.017 3.301 1.00 0.00 C ATOM 2043 CD1 LEU B 67 5.606 0.285 2.458 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.207 0.963 2.647 1.00 0.00 C ATOM 0 H LEU B 67 4.784 2.497 6.268 1.00 0.00 H new ATOM 0 HA LEU B 67 2.519 0.999 5.123 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.512 0.524 5.155 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.347 -0.661 4.597 1.00 0.00 H new ATOM 0 HG LEU B 67 4.872 2.064 3.381 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.638 0.724 1.461 1.00 0.00 H new ATOM 0 HD12 LEU B 67 6.588 0.372 2.924 1.00 0.00 H new ATOM 0 HD13 LEU B 67 5.332 -0.767 2.383 1.00 0.00 H new ATOM 0 HD21 LEU B 67 3.261 1.403 1.651 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.882 -0.074 2.568 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.493 1.522 3.252 1.00 0.00 H new ATOM 2056 N VAL B 68 2.242 -0.330 7.215 1.00 0.00 N ATOM 2057 CA VAL B 68 2.071 -1.146 8.398 1.00 0.00 C ATOM 2058 C VAL B 68 2.116 -2.616 8.029 1.00 0.00 C ATOM 2059 O VAL B 68 1.166 -3.154 7.469 1.00 0.00 O ATOM 2060 CB VAL B 68 0.749 -0.832 9.112 1.00 0.00 C ATOM 2061 CG1 VAL B 68 0.681 -1.578 10.428 1.00 0.00 C ATOM 2062 CG2 VAL B 68 0.612 0.664 9.333 1.00 0.00 C ATOM 0 H VAL B 68 1.388 -0.173 6.679 1.00 0.00 H new ATOM 0 HA VAL B 68 2.889 -0.915 9.081 1.00 0.00 H new ATOM 0 HB VAL B 68 -0.080 -1.161 8.485 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -0.260 -1.349 10.928 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.742 -2.650 10.242 1.00 0.00 H new ATOM 0 HG13 VAL B 68 1.513 -1.272 11.063 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -0.330 0.872 9.840 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.440 1.019 9.946 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.627 1.177 8.371 1.00 0.00 H new ATOM 2072 N LEU B 69 3.218 -3.262 8.350 1.00 0.00 N ATOM 2073 CA LEU B 69 3.396 -4.664 8.020 1.00 0.00 C ATOM 2074 C LEU B 69 2.814 -5.574 9.099 1.00 0.00 C ATOM 2075 O LEU B 69 2.665 -5.163 10.252 1.00 0.00 O ATOM 2076 CB LEU B 69 4.874 -4.962 7.821 1.00 0.00 C ATOM 2077 CG LEU B 69 5.702 -3.786 7.300 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.175 -4.108 7.369 1.00 0.00 C ATOM 2079 CD2 LEU B 69 5.314 -3.430 5.880 1.00 0.00 C ATOM 0 H LEU B 69 4.006 -2.839 8.840 1.00 0.00 H new ATOM 0 HA LEU B 69 2.857 -4.865 7.094 1.00 0.00 H new ATOM 0 HB2 LEU B 69 5.295 -5.291 8.771 1.00 0.00 H new ATOM 0 HB3 LEU B 69 4.972 -5.794 7.124 1.00 0.00 H new ATOM 0 HG LEU B 69 5.496 -2.925 7.936 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.750 -3.261 6.995 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.456 -4.309 8.403 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.384 -4.987 6.759 1.00 0.00 H new ATOM 0 HD21 LEU B 69 5.919 -2.591 5.537 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.483 -4.289 5.230 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.260 -3.154 5.849 1.00 0.00 H new ATOM 2091 N HIS B 70 2.492 -6.807 8.714 1.00 0.00 N ATOM 2092 CA HIS B 70 1.931 -7.794 9.637 1.00 0.00 C ATOM 2093 C HIS B 70 2.968 -8.185 10.678 1.00 0.00 C ATOM 2094 O HIS B 70 2.626 -8.573 11.792 1.00 0.00 O ATOM 2095 CB HIS B 70 1.488 -9.068 8.896 1.00 0.00 C ATOM 2096 CG HIS B 70 0.182 -8.961 8.169 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -1.037 -8.785 8.786 1.00 0.00 N ATOM 2098 CD2 HIS B 70 -0.079 -9.018 6.837 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -1.979 -8.738 7.837 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -1.450 -8.876 6.635 1.00 0.00 N ATOM 0 H HIS B 70 2.611 -7.150 7.761 1.00 0.00 H new ATOM 0 HA HIS B 70 1.064 -7.336 10.114 1.00 0.00 H new ATOM 0 HB2 HIS B 70 2.263 -9.341 8.180 1.00 0.00 H new ATOM 0 HB3 HIS B 70 1.419 -9.883 9.617 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -1.194 -8.705 9.791 1.00 0.00 H new ATOM 0 HD2 HIS B 70 0.658 -9.152 6.059 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -3.033 -8.605 8.029 1.00 0.00 H new ATOM 2108 N ALA B 71 4.237 -8.085 10.291 1.00 0.00 N ATOM 2109 CA ALA B 71 5.344 -8.433 11.171 1.00 0.00 C ATOM 2110 C ALA B 71 5.378 -7.567 12.427 1.00 0.00 C ATOM 2111 O ALA B 71 5.876 -7.996 13.466 1.00 0.00 O ATOM 2112 CB ALA B 71 6.664 -8.321 10.423 1.00 0.00 C ATOM 0 H ALA B 71 4.523 -7.763 9.366 1.00 0.00 H new ATOM 0 HA ALA B 71 5.192 -9.464 11.491 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.484 -8.584 11.091 1.00 0.00 H new ATOM 0 HB2 ALA B 71 6.658 -9.001 9.571 1.00 0.00 H new ATOM 0 HB3 ALA B 71 6.797 -7.298 10.070 1.00 0.00 H new ATOM 2118 N GLY B 72 4.856 -6.351 12.334 1.00 0.00 N ATOM 2119 CA GLY B 72 4.864 -5.470 13.478 1.00 0.00 C ATOM 2120 C GLY B 72 5.877 -4.384 13.271 1.00 0.00 C ATOM 2121 O GLY B 72 6.491 -3.883 14.210 1.00 0.00 O ATOM 0 H GLY B 72 4.431 -5.964 11.492 1.00 0.00 H new ATOM 0 HA2 GLY B 72 3.875 -5.036 13.622 1.00 0.00 H new ATOM 0 HA3 GLY B 72 5.099 -6.033 14.381 1.00 0.00 H new ATOM 2125 N ASP B 73 6.028 -4.024 12.012 1.00 0.00 N ATOM 2126 CA ASP B 73 6.961 -3.016 11.597 1.00 0.00 C ATOM 2127 C ASP B 73 6.207 -2.042 10.747 1.00 0.00 C ATOM 2128 O ASP B 73 5.369 -2.437 9.935 1.00 0.00 O ATOM 2129 CB ASP B 73 8.107 -3.619 10.781 1.00 0.00 C ATOM 2130 CG ASP B 73 9.161 -2.589 10.414 1.00 0.00 C ATOM 2131 OD1 ASP B 73 8.959 -1.856 9.421 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.185 -2.511 11.121 1.00 0.00 O ATOM 0 H ASP B 73 5.495 -4.434 11.245 1.00 0.00 H new ATOM 0 HA ASP B 73 7.398 -2.536 12.472 1.00 0.00 H new ATOM 0 HB2 ASP B 73 8.572 -4.423 11.352 1.00 0.00 H new ATOM 0 HB3 ASP B 73 7.706 -4.065 9.871 1.00 0.00 H new ATOM 2137 N THR B 74 6.441 -0.787 10.961 1.00 0.00 N ATOM 2138 CA THR B 74 5.773 0.211 10.185 1.00 0.00 C ATOM 2139 C THR B 74 6.801 1.231 9.685 1.00 0.00 C ATOM 2140 O THR B 74 7.453 1.901 10.490 1.00 0.00 O ATOM 2141 CB THR B 74 4.693 0.906 11.026 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.259 1.408 12.244 1.00 0.00 O ATOM 2143 CG2 THR B 74 3.555 -0.049 11.347 1.00 0.00 C ATOM 0 H THR B 74 7.087 -0.428 11.664 1.00 0.00 H new ATOM 0 HA THR B 74 5.287 -0.259 9.330 1.00 0.00 H new ATOM 0 HB THR B 74 4.296 1.737 10.443 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.198 1.646 12.095 1.00 0.00 H new ATOM 0 HG21 THR B 74 2.803 0.468 11.944 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.103 -0.401 10.420 1.00 0.00 H new ATOM 0 HG23 THR B 74 3.941 -0.900 11.908 1.00 0.00 H new ATOM 2151 N THR B 75 6.939 1.357 8.375 1.00 0.00 N ATOM 2152 CA THR B 75 7.907 2.282 7.790 1.00 0.00 C ATOM 2153 C THR B 75 7.204 3.490 7.176 1.00 0.00 C ATOM 2154 O THR B 75 6.203 3.338 6.483 1.00 0.00 O ATOM 2155 CB THR B 75 8.767 1.559 6.726 1.00 0.00 C ATOM 2156 OG1 THR B 75 9.787 0.786 7.372 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.409 2.538 5.749 1.00 0.00 C ATOM 0 H THR B 75 6.394 0.831 7.692 1.00 0.00 H new ATOM 0 HA THR B 75 8.561 2.639 8.585 1.00 0.00 H new ATOM 0 HB THR B 75 8.106 0.906 6.156 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.972 -0.019 6.844 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.003 1.987 5.020 1.00 0.00 H new ATOM 0 HG22 THR B 75 8.631 3.100 5.233 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.053 3.228 6.295 1.00 0.00 H new ATOM 2165 N ASN B 76 7.724 4.689 7.429 1.00 0.00 N ATOM 2166 CA ASN B 76 7.112 5.898 6.900 1.00 0.00 C ATOM 2167 C ASN B 76 7.981 6.479 5.782 1.00 0.00 C ATOM 2168 O ASN B 76 9.192 6.626 5.940 1.00 0.00 O ATOM 2169 CB ASN B 76 6.936 6.972 7.987 1.00 0.00 C ATOM 2170 CG ASN B 76 6.769 6.431 9.396 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.083 5.443 9.630 1.00 0.00 O ATOM 2172 ND2 ASN B 76 7.412 7.093 10.352 1.00 0.00 N ATOM 0 H ASN B 76 8.560 4.845 7.992 1.00 0.00 H new ATOM 0 HA ASN B 76 6.130 5.621 6.518 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.802 7.634 7.967 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.065 7.579 7.740 1.00 0.00 H new ATOM 0 HD21 ASN B 76 7.344 6.783 11.321 1.00 0.00 H new ATOM 0 HD22 ASN B 76 7.973 7.911 10.117 1.00 0.00 H new ATOM 2179 N PHE B 77 7.359 6.775 4.657 1.00 0.00 N ATOM 2180 CA PHE B 77 8.041 7.364 3.514 1.00 0.00 C ATOM 2181 C PHE B 77 7.616 8.819 3.380 1.00 0.00 C ATOM 2182 O PHE B 77 6.437 9.108 3.169 1.00 0.00 O ATOM 2183 CB PHE B 77 7.706 6.602 2.232 1.00 0.00 C ATOM 2184 CG PHE B 77 8.315 5.232 2.168 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.689 5.072 2.188 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.515 4.105 2.084 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.255 3.816 2.126 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.077 2.845 2.020 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.448 2.700 2.041 1.00 0.00 C ATOM 0 H PHE B 77 6.363 6.614 4.507 1.00 0.00 H new ATOM 0 HA PHE B 77 9.118 7.305 3.672 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.623 6.513 2.145 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.048 7.182 1.375 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.326 5.942 2.253 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.440 4.212 2.068 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.329 3.706 2.144 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.443 1.973 1.954 1.00 0.00 H new ATOM 0 HZ PHE B 77 9.889 1.715 1.991 1.00 0.00 H new ATOM 2199 N HIS B 78 8.569 9.726 3.474 1.00 0.00 N ATOM 2200 CA HIS B 78 8.269 11.146 3.414 1.00 0.00 C ATOM 2201 C HIS B 78 8.622 11.753 2.057 1.00 0.00 C ATOM 2202 O HIS B 78 9.790 11.904 1.707 1.00 0.00 O ATOM 2203 CB HIS B 78 9.014 11.875 4.538 1.00 0.00 C ATOM 2204 CG HIS B 78 8.809 13.362 4.550 1.00 0.00 C ATOM 2205 ND1 HIS B 78 9.822 14.269 4.763 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.684 14.097 4.355 1.00 0.00 C ATOM 2207 CE1 HIS B 78 9.298 15.498 4.690 1.00 0.00 C ATOM 2208 NE2 HIS B 78 8.003 15.449 4.443 1.00 0.00 N ATOM 0 H HIS B 78 9.558 9.506 3.592 1.00 0.00 H new ATOM 0 HA HIS B 78 7.194 11.268 3.546 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.691 11.468 5.496 1.00 0.00 H new ATOM 0 HB3 HIS B 78 10.080 11.667 4.446 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.700 13.697 4.162 1.00 0.00 H new ATOM 0 HE1 HIS B 78 9.861 16.411 4.817 1.00 0.00 H new ATOM 0 HE2 HIS B 78 7.367 16.239 4.338 1.00 0.00 H new ATOM 2216 N PHE B 79 7.596 12.109 1.306 1.00 0.00 N ATOM 2217 CA PHE B 79 7.769 12.739 0.010 1.00 0.00 C ATOM 2218 C PHE B 79 7.922 14.238 0.255 1.00 0.00 C ATOM 2219 O PHE B 79 7.130 14.829 0.986 1.00 0.00 O ATOM 2220 CB PHE B 79 6.570 12.451 -0.896 1.00 0.00 C ATOM 2221 CG PHE B 79 6.330 10.982 -1.130 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.800 10.181 -0.129 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.636 10.405 -2.349 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.582 8.834 -0.343 1.00 0.00 C ATOM 2225 CE2 PHE B 79 6.418 9.059 -2.568 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.891 8.272 -1.564 1.00 0.00 C ATOM 0 H PHE B 79 6.622 11.970 1.576 1.00 0.00 H new ATOM 0 HA PHE B 79 8.650 12.344 -0.496 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.676 12.891 -0.453 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.724 12.943 -1.856 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.555 10.616 0.829 1.00 0.00 H new ATOM 0 HD2 PHE B 79 7.050 11.014 -3.139 1.00 0.00 H new ATOM 0 HE1 PHE B 79 5.170 8.221 0.445 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.660 8.622 -3.525 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.721 7.219 -1.734 1.00 0.00 H new ATOM 2236 N SER B 80 8.919 14.858 -0.346 1.00 0.00 N ATOM 2237 CA SER B 80 9.176 16.270 -0.096 1.00 0.00 C ATOM 2238 C SER B 80 9.171 17.117 -1.361 1.00 0.00 C ATOM 2239 O SER B 80 9.670 18.238 -1.352 1.00 0.00 O ATOM 2240 CB SER B 80 10.517 16.420 0.625 1.00 0.00 C ATOM 2241 OG SER B 80 10.654 15.440 1.642 1.00 0.00 O ATOM 0 H SER B 80 9.560 14.416 -1.004 1.00 0.00 H new ATOM 0 HA SER B 80 8.360 16.639 0.526 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.333 16.324 -0.091 1.00 0.00 H new ATOM 0 HB3 SER B 80 10.591 17.416 1.061 1.00 0.00 H new ATOM 0 HG SER B 80 11.212 15.795 2.365 1.00 0.00 H new ATOM 2247 N ASN B 81 8.614 16.604 -2.446 1.00 0.00 N ATOM 2248 CA ASN B 81 8.566 17.372 -3.671 1.00 0.00 C ATOM 2249 C ASN B 81 7.374 18.310 -3.603 1.00 0.00 C ATOM 2250 O ASN B 81 6.252 17.902 -3.853 1.00 0.00 O ATOM 2251 CB ASN B 81 8.453 16.445 -4.873 1.00 0.00 C ATOM 2252 CG ASN B 81 8.859 17.131 -6.154 1.00 0.00 C ATOM 2253 OD1 ASN B 81 9.834 17.867 -6.196 1.00 0.00 O ATOM 2254 ND2 ASN B 81 8.122 16.875 -7.212 1.00 0.00 N ATOM 0 H ASN B 81 8.196 15.675 -2.501 1.00 0.00 H new ATOM 0 HA ASN B 81 9.482 17.951 -3.784 1.00 0.00 H new ATOM 0 HB2 ASN B 81 9.082 15.569 -4.716 1.00 0.00 H new ATOM 0 HB3 ASN B 81 7.427 16.089 -4.962 1.00 0.00 H new ATOM 0 HD21 ASN B 81 8.356 17.297 -8.111 1.00 0.00 H new ATOM 0 HD22 ASN B 81 7.316 16.255 -7.134 1.00 0.00 H new ATOM 2261 N GLU B 82 7.629 19.560 -3.265 1.00 0.00 N ATOM 2262 CA GLU B 82 6.575 20.570 -3.096 1.00 0.00 C ATOM 2263 C GLU B 82 5.507 20.545 -4.203 1.00 0.00 C ATOM 2264 O GLU B 82 4.333 20.822 -3.948 1.00 0.00 O ATOM 2265 CB GLU B 82 7.198 21.974 -2.990 1.00 0.00 C ATOM 2266 CG GLU B 82 7.751 22.531 -4.301 1.00 0.00 C ATOM 2267 CD GLU B 82 8.752 21.607 -4.966 1.00 0.00 C ATOM 2268 OE1 GLU B 82 9.800 21.327 -4.352 1.00 0.00 O ATOM 2269 OE2 GLU B 82 8.467 21.132 -6.087 1.00 0.00 O ATOM 0 H GLU B 82 8.571 19.914 -3.097 1.00 0.00 H new ATOM 0 HA GLU B 82 6.058 20.318 -2.170 1.00 0.00 H new ATOM 0 HB2 GLU B 82 6.444 22.663 -2.608 1.00 0.00 H new ATOM 0 HB3 GLU B 82 8.003 21.944 -2.256 1.00 0.00 H new ATOM 0 HG2 GLU B 82 6.925 22.716 -4.987 1.00 0.00 H new ATOM 0 HG3 GLU B 82 8.226 23.493 -4.108 1.00 0.00 H new ATOM 2276 N SER B 83 5.904 20.193 -5.414 1.00 0.00 N ATOM 2277 CA SER B 83 4.984 20.164 -6.535 1.00 0.00 C ATOM 2278 C SER B 83 4.155 18.872 -6.621 1.00 0.00 C ATOM 2279 O SER B 83 2.961 18.919 -6.946 1.00 0.00 O ATOM 2280 CB SER B 83 5.774 20.363 -7.829 1.00 0.00 C ATOM 2281 OG SER B 83 7.029 19.707 -7.759 1.00 0.00 O ATOM 0 H SER B 83 6.860 19.923 -5.645 1.00 0.00 H new ATOM 0 HA SER B 83 4.268 20.972 -6.384 1.00 0.00 H new ATOM 0 HB2 SER B 83 5.203 19.975 -8.672 1.00 0.00 H new ATOM 0 HB3 SER B 83 5.925 21.428 -8.008 1.00 0.00 H new ATOM 0 HG SER B 83 7.692 20.311 -7.363 1.00 0.00 H new ATOM 2287 N THR B 84 4.749 17.719 -6.320 1.00 0.00 N ATOM 2288 CA THR B 84 4.017 16.458 -6.465 1.00 0.00 C ATOM 2289 C THR B 84 4.001 15.557 -5.236 1.00 0.00 C ATOM 2290 O THR B 84 3.314 14.544 -5.263 1.00 0.00 O ATOM 2291 CB THR B 84 4.611 15.629 -7.604 1.00 0.00 C ATOM 2292 OG1 THR B 84 5.975 15.312 -7.305 1.00 0.00 O ATOM 2293 CG2 THR B 84 4.560 16.383 -8.912 1.00 0.00 C ATOM 0 H THR B 84 5.708 17.628 -5.983 1.00 0.00 H new ATOM 0 HA THR B 84 2.992 16.777 -6.652 1.00 0.00 H new ATOM 0 HB THR B 84 4.021 14.717 -7.702 1.00 0.00 H new ATOM 0 HG1 THR B 84 6.033 14.935 -6.402 1.00 0.00 H new ATOM 0 HG21 THR B 84 4.989 15.768 -9.703 1.00 0.00 H new ATOM 0 HG22 THR B 84 3.524 16.618 -9.157 1.00 0.00 H new ATOM 0 HG23 THR B 84 5.130 17.308 -8.821 1.00 0.00 H new ATOM 2301 N ALA B 85 4.732 15.918 -4.189 1.00 0.00 N ATOM 2302 CA ALA B 85 4.839 15.108 -2.966 1.00 0.00 C ATOM 2303 C ALA B 85 3.541 14.380 -2.631 1.00 0.00 C ATOM 2304 O ALA B 85 3.491 13.151 -2.645 1.00 0.00 O ATOM 2305 CB ALA B 85 5.277 15.982 -1.803 1.00 0.00 C ATOM 0 H ALA B 85 5.272 16.783 -4.157 1.00 0.00 H new ATOM 0 HA ALA B 85 5.591 14.340 -3.148 1.00 0.00 H new ATOM 0 HB1 ALA B 85 5.354 15.375 -0.901 1.00 0.00 H new ATOM 0 HB2 ALA B 85 6.247 16.425 -2.026 1.00 0.00 H new ATOM 0 HB3 ALA B 85 4.544 16.773 -1.646 1.00 0.00 H new ATOM 2311 N VAL B 86 2.501 15.149 -2.338 1.00 0.00 N ATOM 2312 CA VAL B 86 1.185 14.601 -2.017 1.00 0.00 C ATOM 2313 C VAL B 86 0.712 13.579 -3.051 1.00 0.00 C ATOM 2314 O VAL B 86 0.381 12.451 -2.700 1.00 0.00 O ATOM 2315 CB VAL B 86 0.155 15.746 -1.876 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.230 15.315 -2.332 1.00 0.00 C ATOM 2317 CG2 VAL B 86 0.078 16.226 -0.440 1.00 0.00 C ATOM 0 H VAL B 86 2.543 16.168 -2.315 1.00 0.00 H new ATOM 0 HA VAL B 86 1.273 14.074 -1.067 1.00 0.00 H new ATOM 0 HB VAL B 86 0.495 16.560 -2.516 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -1.926 16.146 -2.218 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.191 15.015 -3.379 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -1.567 14.474 -1.726 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -0.653 17.031 -0.364 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.224 15.400 0.204 1.00 0.00 H new ATOM 0 HG23 VAL B 86 1.055 16.592 -0.126 1.00 0.00 H new ATOM 2327 N LYS B 87 0.729 13.965 -4.317 1.00 0.00 N ATOM 2328 CA LYS B 87 0.280 13.090 -5.394 1.00 0.00 C ATOM 2329 C LYS B 87 1.148 11.840 -5.474 1.00 0.00 C ATOM 2330 O LYS B 87 0.647 10.760 -5.746 1.00 0.00 O ATOM 2331 CB LYS B 87 0.314 13.837 -6.732 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.177 15.278 -6.650 1.00 0.00 C ATOM 2333 CD LYS B 87 0.237 16.077 -7.879 1.00 0.00 C ATOM 2334 CE LYS B 87 -0.367 17.476 -7.880 1.00 0.00 C ATOM 2335 NZ LYS B 87 0.297 18.382 -6.899 1.00 0.00 N ATOM 0 H LYS B 87 1.050 14.882 -4.627 1.00 0.00 H new ATOM 0 HA LYS B 87 -0.745 12.786 -5.181 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.335 13.833 -7.113 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.298 13.296 -7.454 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.263 15.289 -6.556 1.00 0.00 H new ATOM 0 HG3 LYS B 87 0.226 15.751 -5.754 1.00 0.00 H new ATOM 0 HD2 LYS B 87 1.324 16.151 -7.914 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -0.075 15.547 -8.779 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -0.285 17.904 -8.879 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -1.430 17.410 -7.648 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -0.148 19.321 -6.937 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 0.197 17.990 -5.941 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 1.306 18.468 -7.134 1.00 0.00 H new ATOM 2349 N GLU B 88 2.444 11.992 -5.231 1.00 0.00 N ATOM 2350 CA GLU B 88 3.367 10.865 -5.270 1.00 0.00 C ATOM 2351 C GLU B 88 3.026 9.867 -4.164 1.00 0.00 C ATOM 2352 O GLU B 88 2.938 8.662 -4.407 1.00 0.00 O ATOM 2353 CB GLU B 88 4.813 11.357 -5.146 1.00 0.00 C ATOM 2354 CG GLU B 88 5.318 12.056 -6.401 1.00 0.00 C ATOM 2355 CD GLU B 88 6.696 12.674 -6.236 1.00 0.00 C ATOM 2356 OE1 GLU B 88 6.834 13.631 -5.443 1.00 0.00 O ATOM 2357 OE2 GLU B 88 7.642 12.238 -6.927 1.00 0.00 O ATOM 0 H GLU B 88 2.880 12.886 -5.005 1.00 0.00 H new ATOM 0 HA GLU B 88 3.267 10.356 -6.229 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.886 12.043 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.461 10.509 -4.925 1.00 0.00 H new ATOM 0 HG2 GLU B 88 5.346 11.338 -7.221 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.610 12.835 -6.683 1.00 0.00 H new ATOM 2364 N ARG B 89 2.812 10.377 -2.954 1.00 0.00 N ATOM 2365 CA ARG B 89 2.446 9.532 -1.818 1.00 0.00 C ATOM 2366 C ARG B 89 1.092 8.897 -2.067 1.00 0.00 C ATOM 2367 O ARG B 89 0.914 7.693 -1.895 1.00 0.00 O ATOM 2368 CB ARG B 89 2.394 10.359 -0.535 1.00 0.00 C ATOM 2369 CG ARG B 89 1.661 9.689 0.619 1.00 0.00 C ATOM 2370 CD ARG B 89 1.268 10.701 1.690 1.00 0.00 C ATOM 2371 NE ARG B 89 -0.185 10.809 1.845 1.00 0.00 N ATOM 2372 CZ ARG B 89 -0.991 11.383 0.951 1.00 0.00 C ATOM 2373 NH1 ARG B 89 -0.487 11.986 -0.112 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -2.304 11.392 1.138 1.00 0.00 N ATOM 0 H ARG B 89 2.885 11.370 -2.734 1.00 0.00 H new ATOM 0 HA ARG B 89 3.199 8.752 -1.706 1.00 0.00 H new ATOM 0 HB2 ARG B 89 3.413 10.583 -0.220 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.911 11.312 -0.751 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.768 9.189 0.244 1.00 0.00 H new ATOM 0 HG3 ARG B 89 2.296 8.920 1.058 1.00 0.00 H new ATOM 0 HD2 ARG B 89 1.712 10.411 2.642 1.00 0.00 H new ATOM 0 HD3 ARG B 89 1.677 11.678 1.432 1.00 0.00 H new ATOM 0 HE ARG B 89 -0.606 10.421 2.689 1.00 0.00 H new ATOM 0 HH11 ARG B 89 0.523 12.014 -0.252 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -1.108 12.423 -0.793 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -2.704 10.958 1.970 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -2.914 11.833 0.450 1.00 0.00 H new ATOM 2388 N ASP B 90 0.145 9.728 -2.477 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.205 9.283 -2.777 1.00 0.00 C ATOM 2390 C ASP B 90 -1.213 8.246 -3.876 1.00 0.00 C ATOM 2391 O ASP B 90 -1.984 7.298 -3.836 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.085 10.476 -3.163 1.00 0.00 C ATOM 2393 CG ASP B 90 -2.813 11.050 -1.970 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.578 10.294 -1.327 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -2.602 12.239 -1.648 1.00 0.00 O ATOM 0 H ASP B 90 0.292 10.728 -2.611 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.611 8.819 -1.878 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.467 11.250 -3.618 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -2.810 10.164 -3.915 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.307 8.408 -4.813 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.198 7.496 -5.953 1.00 0.00 C ATOM 2402 C ALA B 91 0.312 6.155 -5.502 1.00 0.00 C ATOM 2403 O ALA B 91 -0.254 5.108 -5.818 1.00 0.00 O ATOM 2404 CB ALA B 91 0.757 8.057 -6.985 1.00 0.00 C ATOM 0 H ALA B 91 0.375 9.166 -4.817 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.189 7.383 -6.392 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.828 7.368 -7.827 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.389 9.021 -7.335 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.742 8.186 -6.537 1.00 0.00 H new ATOM 2410 N VAL B 92 1.406 6.212 -4.774 1.00 0.00 N ATOM 2411 CA VAL B 92 2.032 5.036 -4.233 1.00 0.00 C ATOM 2412 C VAL B 92 1.019 4.294 -3.383 1.00 0.00 C ATOM 2413 O VAL B 92 0.842 3.094 -3.513 1.00 0.00 O ATOM 2414 CB VAL B 92 3.245 5.460 -3.397 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.623 4.411 -2.378 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.422 5.771 -4.294 1.00 0.00 C ATOM 0 H VAL B 92 1.885 7.082 -4.542 1.00 0.00 H new ATOM 0 HA VAL B 92 2.373 4.375 -5.030 1.00 0.00 H new ATOM 0 HB VAL B 92 2.966 6.361 -2.851 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.487 4.752 -1.808 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.785 4.242 -1.701 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.870 3.480 -2.889 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.275 6.070 -3.685 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.683 4.885 -4.873 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.158 6.582 -4.972 1.00 0.00 H new ATOM 2426 N LYS B 93 0.330 5.059 -2.555 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.706 4.560 -1.671 1.00 0.00 C ATOM 2428 C LYS B 93 -1.824 3.926 -2.465 1.00 0.00 C ATOM 2429 O LYS B 93 -2.312 2.854 -2.113 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.260 5.744 -0.894 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.535 5.458 -0.139 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.191 6.753 0.281 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.384 7.101 -0.581 1.00 0.00 C ATOM 2434 NZ LYS B 93 -4.006 7.634 -1.922 1.00 0.00 N ATOM 0 H LYS B 93 0.479 6.065 -2.478 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.288 3.807 -1.003 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.503 6.084 -0.187 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.440 6.565 -1.588 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.217 4.882 -0.765 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.318 4.850 0.739 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.508 6.676 1.321 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.461 7.561 0.229 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -5.001 6.212 -0.712 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -4.995 7.840 -0.063 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.765 7.429 -2.603 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.865 8.662 -1.860 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -3.125 7.182 -2.239 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.230 4.610 -3.521 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.295 4.128 -4.374 1.00 0.00 C ATOM 2450 C ASP B 94 -2.938 2.755 -4.911 1.00 0.00 C ATOM 2451 O ASP B 94 -3.670 1.779 -4.721 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.539 5.087 -5.533 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.585 6.135 -5.198 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -4.903 6.302 -3.993 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -5.084 6.795 -6.127 1.00 0.00 O ATOM 0 H ASP B 94 -1.834 5.505 -3.807 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.208 4.064 -3.783 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.604 5.581 -5.797 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.860 4.522 -6.408 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.783 2.692 -5.563 1.00 0.00 N ATOM 2461 CA LEU B 95 -1.278 1.454 -6.131 1.00 0.00 C ATOM 2462 C LEU B 95 -1.088 0.415 -5.038 1.00 0.00 C ATOM 2463 O LEU B 95 -1.517 -0.724 -5.174 1.00 0.00 O ATOM 2464 CB LEU B 95 0.040 1.709 -6.863 1.00 0.00 C ATOM 2465 CG LEU B 95 0.030 1.378 -8.359 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.305 1.750 -8.987 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.163 2.102 -9.068 1.00 0.00 C ATOM 0 H LEU B 95 -1.174 3.497 -5.711 1.00 0.00 H new ATOM 0 HA LEU B 95 -2.005 1.073 -6.849 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.308 2.759 -6.741 1.00 0.00 H new ATOM 0 HB3 LEU B 95 0.823 1.123 -6.383 1.00 0.00 H new ATOM 0 HG LEU B 95 0.174 0.303 -8.470 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.288 1.506 -10.049 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -2.105 1.192 -8.499 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.480 2.819 -8.863 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.143 1.857 -10.130 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.043 3.178 -8.941 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.117 1.791 -8.642 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.469 0.840 -3.950 1.00 0.00 N ATOM 2480 CA LEU B 96 -0.206 -0.018 -2.806 1.00 0.00 C ATOM 2481 C LEU B 96 -1.480 -0.683 -2.310 1.00 0.00 C ATOM 2482 O LEU B 96 -1.580 -1.905 -2.283 1.00 0.00 O ATOM 2483 CB LEU B 96 0.425 0.813 -1.692 1.00 0.00 C ATOM 2484 CG LEU B 96 1.941 0.919 -1.780 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.473 1.831 -0.691 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.572 -0.461 -1.705 1.00 0.00 C ATOM 0 H LEU B 96 -0.132 1.796 -3.834 1.00 0.00 H new ATOM 0 HA LEU B 96 0.480 -0.808 -3.111 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -0.001 1.816 -1.716 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.157 0.375 -0.730 1.00 0.00 H new ATOM 0 HG LEU B 96 2.209 1.358 -2.741 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.558 1.896 -0.768 1.00 0.00 H new ATOM 0 HD12 LEU B 96 2.041 2.825 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.202 1.429 0.285 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.656 -0.369 -1.769 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.303 -0.933 -0.760 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.210 -1.072 -2.532 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.451 0.138 -1.950 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.734 -0.335 -1.455 1.00 0.00 C ATOM 2500 C GLN B 97 -4.415 -1.305 -2.427 1.00 0.00 C ATOM 2501 O GLN B 97 -4.868 -2.372 -2.026 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.621 0.873 -1.151 1.00 0.00 C ATOM 2503 CG GLN B 97 -6.101 0.659 -1.366 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.867 1.960 -1.301 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -7.357 2.362 -0.248 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -6.948 2.645 -2.427 1.00 0.00 N ATOM 0 H GLN B 97 -2.373 1.154 -1.992 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.566 -0.904 -0.540 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.460 1.169 -0.114 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.297 1.707 -1.774 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.264 0.188 -2.336 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.483 -0.027 -0.610 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -6.528 2.276 -3.280 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.431 3.543 -2.444 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.437 -0.949 -3.704 1.00 0.00 N ATOM 2516 CA GLN B 98 -5.093 -1.770 -4.727 1.00 0.00 C ATOM 2517 C GLN B 98 -4.332 -3.055 -5.057 1.00 0.00 C ATOM 2518 O GLN B 98 -4.940 -4.077 -5.376 1.00 0.00 O ATOM 2519 CB GLN B 98 -5.272 -0.958 -6.011 1.00 0.00 C ATOM 2520 CG GLN B 98 -6.384 0.076 -5.939 1.00 0.00 C ATOM 2521 CD GLN B 98 -6.207 1.199 -6.948 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -7.176 1.768 -7.439 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -4.965 1.532 -7.261 1.00 0.00 N ATOM 0 H GLN B 98 -4.008 -0.096 -4.063 1.00 0.00 H new ATOM 0 HA GLN B 98 -6.057 -2.062 -4.311 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -4.334 -0.453 -6.243 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.478 -1.641 -6.835 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -7.342 -0.414 -6.112 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -6.418 0.498 -4.934 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -4.181 1.038 -6.834 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -4.791 2.283 -7.929 1.00 0.00 H new ATOM 2532 N LEU B 99 -3.014 -3.006 -4.985 1.00 0.00 N ATOM 2533 CA LEU B 99 -2.181 -4.156 -5.330 1.00 0.00 C ATOM 2534 C LEU B 99 -1.917 -5.080 -4.151 1.00 0.00 C ATOM 2535 O LEU B 99 -1.521 -6.230 -4.337 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.853 -3.662 -5.876 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.880 -3.205 -7.326 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.143 -2.107 -7.536 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.599 -4.381 -8.248 1.00 0.00 C ATOM 0 H LEU B 99 -2.491 -2.181 -4.690 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.728 -4.733 -6.075 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.509 -2.833 -5.257 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -0.118 -4.461 -5.777 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.869 -2.811 -7.561 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.120 -1.783 -8.576 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -0.091 -1.263 -6.887 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.137 -2.485 -7.295 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.620 -4.044 -9.284 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.384 -4.795 -8.021 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.359 -5.149 -8.100 1.00 0.00 H new ATOM 2551 N LEU B 100 -2.121 -4.576 -2.950 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.882 -5.355 -1.743 1.00 0.00 C ATOM 2553 C LEU B 100 -2.629 -6.685 -1.715 1.00 0.00 C ATOM 2554 O LEU B 100 -1.993 -7.722 -1.578 1.00 0.00 O ATOM 2555 CB LEU B 100 -2.239 -4.550 -0.510 1.00 0.00 C ATOM 2556 CG LEU B 100 -1.106 -3.735 0.072 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.665 -2.779 1.103 1.00 0.00 C ATOM 2558 CD2 LEU B 100 -0.055 -4.665 0.667 1.00 0.00 C ATOM 0 H LEU B 100 -2.453 -3.627 -2.780 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.817 -5.588 -1.747 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -3.060 -3.877 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.607 -5.232 0.257 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.619 -3.148 -0.707 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.854 -2.187 1.528 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.389 -2.116 0.629 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.155 -3.344 1.895 1.00 0.00 H new ATOM 0 HD21 LEU B 100 0.759 -4.073 1.085 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.507 -5.268 1.454 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.335 -5.319 -0.113 1.00 0.00 H new ATOM 2570 N PRO B 101 -3.974 -6.692 -1.869 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.781 -7.928 -1.823 1.00 0.00 C ATOM 2572 C PRO B 101 -4.409 -8.957 -2.891 1.00 0.00 C ATOM 2573 O PRO B 101 -5.087 -9.966 -3.054 1.00 0.00 O ATOM 2574 CB PRO B 101 -6.214 -7.437 -2.037 1.00 0.00 C ATOM 2575 CG PRO B 101 -6.064 -6.108 -2.679 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.826 -5.513 -2.094 1.00 0.00 C ATOM 0 HA PRO B 101 -4.622 -8.453 -0.881 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.777 -8.122 -2.671 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.752 -7.362 -1.092 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -5.978 -6.204 -3.761 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.932 -5.478 -2.482 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -4.359 -4.800 -2.774 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -5.033 -4.980 -1.166 1.00 0.00 H new ATOM 2584 N LYS B 102 -3.355 -8.684 -3.633 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.874 -9.601 -4.641 1.00 0.00 C ATOM 2586 C LYS B 102 -1.845 -10.529 -3.998 1.00 0.00 C ATOM 2587 O LYS B 102 -1.710 -11.691 -4.375 1.00 0.00 O ATOM 2588 CB LYS B 102 -2.259 -8.814 -5.805 1.00 0.00 C ATOM 2589 CG LYS B 102 -1.678 -9.667 -6.922 1.00 0.00 C ATOM 2590 CD LYS B 102 -1.160 -8.781 -8.060 1.00 0.00 C ATOM 2591 CE LYS B 102 -0.215 -9.518 -9.003 1.00 0.00 C ATOM 2592 NZ LYS B 102 0.716 -8.582 -9.706 1.00 0.00 N ATOM 0 H LYS B 102 -2.812 -7.824 -3.554 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.694 -10.198 -5.039 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -3.024 -8.162 -6.227 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -1.472 -8.170 -5.413 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -0.866 -10.282 -6.533 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -2.440 -10.348 -7.301 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -2.007 -8.397 -8.629 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -0.644 -7.919 -7.637 1.00 0.00 H new ATOM 0 HE2 LYS B 102 0.364 -10.249 -8.438 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -0.797 -10.072 -9.740 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 1.605 -9.076 -9.925 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 0.276 -8.252 -10.589 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 0.916 -7.766 -9.093 1.00 0.00 H new ATOM 2606 N PHE B 103 -1.122 -9.992 -3.013 1.00 0.00 N ATOM 2607 CA PHE B 103 -0.100 -10.753 -2.299 1.00 0.00 C ATOM 2608 C PHE B 103 -0.355 -10.785 -0.799 1.00 0.00 C ATOM 2609 O PHE B 103 0.201 -11.623 -0.097 1.00 0.00 O ATOM 2610 CB PHE B 103 1.282 -10.173 -2.589 1.00 0.00 C ATOM 2611 CG PHE B 103 1.581 -10.115 -4.054 1.00 0.00 C ATOM 2612 CD1 PHE B 103 1.895 -11.268 -4.754 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.528 -8.912 -4.736 1.00 0.00 C ATOM 2614 CE1 PHE B 103 2.150 -11.222 -6.108 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.784 -8.861 -6.088 1.00 0.00 C ATOM 2616 CZ PHE B 103 2.096 -10.017 -6.776 1.00 0.00 C ATOM 0 H PHE B 103 -1.228 -9.029 -2.692 1.00 0.00 H new ATOM 0 HA PHE B 103 -0.144 -11.781 -2.658 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.348 -9.170 -2.168 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.039 -10.778 -2.090 1.00 0.00 H new ATOM 0 HD1 PHE B 103 1.941 -12.213 -4.234 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.284 -8.005 -4.203 1.00 0.00 H new ATOM 0 HE1 PHE B 103 2.392 -12.128 -6.644 1.00 0.00 H new ATOM 0 HE2 PHE B 103 1.741 -7.917 -6.610 1.00 0.00 H new ATOM 0 HZ PHE B 103 2.298 -9.977 -7.836 1.00 0.00 H new ATOM 2626 N LYS B 104 -1.214 -9.887 -0.333 1.00 0.00 N ATOM 2627 CA LYS B 104 -1.543 -9.761 1.087 1.00 0.00 C ATOM 2628 C LYS B 104 -1.939 -11.099 1.701 1.00 0.00 C ATOM 2629 O LYS B 104 -3.032 -11.606 1.445 1.00 0.00 O ATOM 2630 CB LYS B 104 -2.680 -8.749 1.251 1.00 0.00 C ATOM 2631 CG LYS B 104 -2.868 -8.245 2.669 1.00 0.00 C ATOM 2632 CD LYS B 104 -3.928 -9.043 3.410 1.00 0.00 C ATOM 2633 CE LYS B 104 -4.158 -8.500 4.811 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.449 -7.040 4.803 1.00 0.00 N ATOM 0 H LYS B 104 -1.706 -9.221 -0.929 1.00 0.00 H new ATOM 0 HA LYS B 104 -0.654 -9.415 1.614 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -2.490 -7.898 0.598 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -3.610 -9.207 0.915 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -1.922 -8.308 3.207 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -3.153 -7.193 2.647 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -4.863 -9.015 2.850 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -3.623 -10.088 3.469 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -4.989 -9.033 5.274 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -3.276 -8.690 5.423 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.876 -6.766 5.711 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -3.565 -6.511 4.662 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -5.110 -6.822 4.030 1.00 0.00 H new