USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=38 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+ -115:sc= -4.77! (180deg=-4.6!) USER MOD Set 1.2: B 81 ASN : amide:sc= -1.42 K(o=-5.4,f=-7.1!) USER MOD Set 1.3: B 84 THR OG1 : rot 81:sc= 0.779 USER MOD Set 2.1: B 78 HIS : no HD1:sc= -0.836 K(o=-0.65,f=-1.3) USER MOD Set 2.2: B 80 SER OG : rot -64:sc= 0.183 USER MOD Set 3.1: B 54 LYS NZ :NH3+ 142:sc= 1.02 (180deg=-1.04) USER MOD Set 3.2: B 66 GLN : amide:sc= -1.67! C(o=-3.2!,f=-18!) USER MOD Set 3.3: B 76 ASN : amide:sc= -2.59! C(o=-3.2!,f=-17!) USER MOD Set 4.1: B 56 SER OG : rot -39:sc= 1.1 USER MOD Set 4.2: B 62 LYS NZ :NH3+ 166:sc= -0.665 (180deg=-1.24!) USER MOD Set 4.3: B 64 GLN : amide:sc= -5.88! C(o=-5.4!,f=-9.8!) USER MOD Set 5.1: B 51 LYS NZ :NH3+ 172:sc= 2.26 (180deg=0.7) USER MOD Set 5.2: B 52 CYS SG : rot 4:sc= 1.17 USER MOD Set 6.1: B 45 HIS : no HE2:sc= -1.75 X(o=-1.7,f=-1.9) USER MOD Set 6.2: B 75 THR OG1 : rot 144:sc= 0.029 USER MOD Set 7.1: B 13 LYS NZ :NH3+ 179:sc= 0.969 (180deg=0.958) USER MOD Set 7.2: B 25 TYR OH : rot 180:sc= 0 USER MOD Set 8.1: B 17 GLN : amide:sc= -2.06! X(o=-1.7!,f=-1.4) USER MOD Set 8.2: B 20 GLN : amide:sc= 0.36 X(o=-1.7,f=-1.4) USER MOD Single : A 397 MET CE :methyl -126:sc= -0.0124 (180deg=-2.39!) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 TYR OH : rot 150:sc= -0.443 USER MOD Single : A 406 SER OG : rot -59:sc= 0.417 USER MOD Single : A 409 SER OG : rot 170:sc= -0.894 USER MOD Single : A 410 GLN : amide:sc= 0.816 K(o=0.82,f=-0.62) USER MOD Single : A 417 GLN : amide:sc= 1.08 K(o=1.1,f=-5.9!) USER MOD Single : A 418 MET CE :methyl -168:sc= -3.97! (180deg=-4.56!) USER MOD Single : A 419 THR OG1 : rot 163:sc= 0.768 USER MOD Single : A 423 LYS NZ :NH3+ 132:sc= -4.36! (180deg=-4.95!) USER MOD Single : A 426 TYR OH : rot 180:sc= -0.528 USER MOD Single : A 429 MET CE :methyl -159:sc= -4.88! (180deg=-7.51!) USER MOD Single : A 431 GLN : amide:sc= 1.06 K(o=1.1,f=-0.9) USER MOD Single : A 433 MET CE :methyl -150:sc= -1.94 (180deg=-2.73!) USER MOD Single : B 18 LYS NZ :NH3+ -146:sc= 0.853 (180deg=-1.29!) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 MET CE :methyl -130:sc= -2.53 (180deg=-7.86!) USER MOD Single : B 38 LYS NZ :NH3+ 149:sc= -1.12 (180deg=-3.01!) USER MOD Single : B 42 THR OG1 : rot 180:sc= -0.0188 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -164:sc= -0.0429 (180deg=-0.324) USER MOD Single : B 47 TYR OH : rot 124:sc= 0.893 USER MOD Single : B 53 GLN : amide:sc= -5.33! K(o=-5.3!,f=-1.1) USER MOD Single : B 60 LYS NZ :NH3+ 133:sc= 1.59 (180deg=-3.03!) USER MOD Single : B 70 HIS : no HE2:sc= -3.74 K(o=-3.7,f=-7.1!) USER MOD Single : B 74 THR OG1 : rot 35:sc= 0.413 USER MOD Single : B 83 SER OG : rot 180:sc= 0.128 USER MOD Single : B 87 LYS NZ :NH3+ 169:sc= 1.28 (180deg=1.15) USER MOD Single : B 93 LYS NZ :NH3+ 150:sc= 1.92 (180deg=-1.87!) USER MOD Single : B 97 GLN : amide:sc= -2.83! K(o=-2.8!,f=-0.56) USER MOD Single : B 98 GLN : amide:sc= -2.11! C(o=-2.1!,f=-5.1!) USER MOD Single : B 102 LYS NZ :NH3+ -171:sc= 1.05 (180deg=0.638) USER MOD Single : B 104 LYS NZ :NH3+ 179:sc= -0.0624! (180deg=-0.0819!) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 9.889 11.624 14.822 1.00 0.00 N ATOM 59 CA GLU A 382 9.084 10.549 14.245 1.00 0.00 C ATOM 60 C GLU A 382 8.226 11.087 13.110 1.00 0.00 C ATOM 61 O GLU A 382 7.948 12.285 13.031 1.00 0.00 O ATOM 62 CB GLU A 382 8.194 9.832 15.264 1.00 0.00 C ATOM 63 CG GLU A 382 8.357 8.317 15.214 1.00 0.00 C ATOM 64 CD GLU A 382 8.892 7.843 13.872 1.00 0.00 C ATOM 65 OE1 GLU A 382 8.075 7.588 12.962 1.00 0.00 O ATOM 66 OE2 GLU A 382 10.131 7.775 13.706 1.00 0.00 O ATOM 0 HA GLU A 382 9.792 9.810 13.871 1.00 0.00 H new ATOM 0 HB2 GLU A 382 8.434 10.188 16.266 1.00 0.00 H new ATOM 0 HB3 GLU A 382 7.152 10.089 15.076 1.00 0.00 H new ATOM 0 HG2 GLU A 382 9.035 7.999 16.006 1.00 0.00 H new ATOM 0 HG3 GLU A 382 7.395 7.843 15.408 1.00 0.00 H new ATOM 73 N GLU A 383 7.806 10.190 12.237 1.00 0.00 N ATOM 74 CA GLU A 383 6.993 10.557 11.098 1.00 0.00 C ATOM 75 C GLU A 383 5.540 10.143 11.319 1.00 0.00 C ATOM 76 O GLU A 383 4.625 10.839 10.891 1.00 0.00 O ATOM 77 CB GLU A 383 7.553 9.907 9.829 1.00 0.00 C ATOM 78 CG GLU A 383 9.025 10.215 9.578 1.00 0.00 C ATOM 79 CD GLU A 383 9.257 11.575 8.941 1.00 0.00 C ATOM 80 OE1 GLU A 383 8.829 12.596 9.526 1.00 0.00 O ATOM 81 OE2 GLU A 383 9.886 11.624 7.863 1.00 0.00 O ATOM 0 H GLU A 383 8.018 9.194 12.299 1.00 0.00 H new ATOM 0 HA GLU A 383 7.020 11.640 10.980 1.00 0.00 H new ATOM 0 HB2 GLU A 383 7.424 8.827 9.898 1.00 0.00 H new ATOM 0 HB3 GLU A 383 6.970 10.243 8.972 1.00 0.00 H new ATOM 0 HG2 GLU A 383 9.565 10.168 10.524 1.00 0.00 H new ATOM 0 HG3 GLU A 383 9.445 9.443 8.933 1.00 0.00 H new ATOM 88 N ASP A 384 5.338 9.021 12.009 1.00 0.00 N ATOM 89 CA ASP A 384 3.990 8.508 12.280 1.00 0.00 C ATOM 90 C ASP A 384 3.246 9.408 13.265 1.00 0.00 C ATOM 91 O ASP A 384 3.382 9.261 14.480 1.00 0.00 O ATOM 92 CB ASP A 384 4.066 7.081 12.832 1.00 0.00 C ATOM 93 CG ASP A 384 2.758 6.314 12.708 1.00 0.00 C ATOM 94 OD1 ASP A 384 1.754 6.876 12.215 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.732 5.123 13.080 1.00 0.00 O ATOM 0 H ASP A 384 6.090 8.447 12.392 1.00 0.00 H new ATOM 0 HA ASP A 384 3.439 8.500 11.340 1.00 0.00 H new ATOM 0 HB2 ASP A 384 4.849 6.537 12.304 1.00 0.00 H new ATOM 0 HB3 ASP A 384 4.357 7.121 13.882 1.00 0.00 H new ATOM 100 N ASP A 385 2.474 10.353 12.735 1.00 0.00 N ATOM 101 CA ASP A 385 1.723 11.283 13.573 1.00 0.00 C ATOM 102 C ASP A 385 0.274 11.443 13.112 1.00 0.00 C ATOM 103 O ASP A 385 -0.532 12.038 13.826 1.00 0.00 O ATOM 104 CB ASP A 385 2.416 12.655 13.594 1.00 0.00 C ATOM 105 CG ASP A 385 2.196 13.460 12.322 1.00 0.00 C ATOM 106 OD1 ASP A 385 2.532 12.961 11.224 1.00 0.00 O ATOM 107 OD2 ASP A 385 1.692 14.602 12.412 1.00 0.00 O ATOM 0 H ASP A 385 2.352 10.495 11.732 1.00 0.00 H new ATOM 0 HA ASP A 385 1.703 10.863 14.579 1.00 0.00 H new ATOM 0 HB2 ASP A 385 2.048 13.227 14.446 1.00 0.00 H new ATOM 0 HB3 ASP A 385 3.486 12.512 13.744 1.00 0.00 H new ATOM 112 N GLU A 386 -0.071 10.891 11.948 1.00 0.00 N ATOM 113 CA GLU A 386 -1.411 11.012 11.413 1.00 0.00 C ATOM 114 C GLU A 386 -1.456 10.246 10.113 1.00 0.00 C ATOM 115 O GLU A 386 -1.110 10.772 9.053 1.00 0.00 O ATOM 116 CB GLU A 386 -1.738 12.474 11.161 1.00 0.00 C ATOM 117 CG GLU A 386 -3.131 12.894 11.561 1.00 0.00 C ATOM 118 CD GLU A 386 -3.496 14.249 10.992 1.00 0.00 C ATOM 119 OE1 GLU A 386 -2.720 15.206 11.206 1.00 0.00 O ATOM 120 OE2 GLU A 386 -4.532 14.352 10.313 1.00 0.00 O ATOM 0 H GLU A 386 0.569 10.355 11.362 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.141 10.614 12.118 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.020 13.090 11.702 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -1.602 12.683 10.100 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -3.848 12.150 11.215 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -3.203 12.925 12.648 1.00 0.00 H new ATOM 127 N PHE A 387 -1.829 8.989 10.196 1.00 0.00 N ATOM 128 CA PHE A 387 -1.866 8.149 9.024 1.00 0.00 C ATOM 129 C PHE A 387 -3.134 7.325 8.986 1.00 0.00 C ATOM 130 O PHE A 387 -3.590 6.811 10.008 1.00 0.00 O ATOM 131 CB PHE A 387 -0.671 7.183 9.002 1.00 0.00 C ATOM 132 CG PHE A 387 0.685 7.803 8.790 1.00 0.00 C ATOM 133 CD1 PHE A 387 1.230 8.661 9.728 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.430 7.500 7.662 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.479 9.201 9.545 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.681 8.043 7.476 1.00 0.00 C ATOM 137 CZ PHE A 387 3.205 8.893 8.420 1.00 0.00 C ATOM 0 H PHE A 387 -2.110 8.528 11.061 1.00 0.00 H new ATOM 0 HA PHE A 387 -1.827 8.811 8.159 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.654 6.638 9.946 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -0.839 6.449 8.213 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.666 8.909 10.615 1.00 0.00 H new ATOM 0 HD2 PHE A 387 1.024 6.829 6.919 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.891 9.869 10.287 1.00 0.00 H new ATOM 0 HE2 PHE A 387 3.250 7.802 6.590 1.00 0.00 H new ATOM 0 HZ PHE A 387 4.187 9.319 8.278 1.00 0.00 H new ATOM 147 N GLU A 388 -3.649 7.168 7.790 1.00 0.00 N ATOM 148 CA GLU A 388 -4.838 6.387 7.552 1.00 0.00 C ATOM 149 C GLU A 388 -4.381 4.993 7.226 1.00 0.00 C ATOM 150 O GLU A 388 -3.647 4.816 6.254 1.00 0.00 O ATOM 151 CB GLU A 388 -5.636 6.941 6.366 1.00 0.00 C ATOM 152 CG GLU A 388 -6.099 8.372 6.541 1.00 0.00 C ATOM 153 CD GLU A 388 -7.024 8.540 7.731 1.00 0.00 C ATOM 154 OE1 GLU A 388 -8.251 8.395 7.556 1.00 0.00 O ATOM 155 OE2 GLU A 388 -6.517 8.807 8.838 1.00 0.00 O ATOM 0 H GLU A 388 -3.251 7.583 6.948 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.484 6.413 8.429 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.021 6.877 5.468 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.507 6.307 6.201 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.231 9.019 6.665 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.613 8.698 5.636 1.00 0.00 H new ATOM 162 N GLU A 389 -4.742 4.018 8.043 1.00 0.00 N ATOM 163 CA GLU A 389 -4.330 2.661 7.761 1.00 0.00 C ATOM 164 C GLU A 389 -4.944 2.256 6.434 1.00 0.00 C ATOM 165 O GLU A 389 -6.150 2.025 6.333 1.00 0.00 O ATOM 166 CB GLU A 389 -4.739 1.695 8.883 1.00 0.00 C ATOM 167 CG GLU A 389 -3.588 0.822 9.376 1.00 0.00 C ATOM 168 CD GLU A 389 -3.924 -0.660 9.443 1.00 0.00 C ATOM 169 OE1 GLU A 389 -4.590 -1.172 8.523 1.00 0.00 O ATOM 170 OE2 GLU A 389 -3.494 -1.330 10.409 1.00 0.00 O ATOM 0 H GLU A 389 -5.305 4.138 8.885 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.243 2.612 7.703 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -5.136 2.269 9.721 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -5.545 1.054 8.526 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -2.731 0.961 8.717 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -3.286 1.161 10.367 1.00 0.00 H new ATOM 177 N VAL A 390 -4.111 2.207 5.407 1.00 0.00 N ATOM 178 CA VAL A 390 -4.577 1.867 4.093 1.00 0.00 C ATOM 179 C VAL A 390 -4.795 0.374 4.007 1.00 0.00 C ATOM 180 O VAL A 390 -3.857 -0.410 4.173 1.00 0.00 O ATOM 181 CB VAL A 390 -3.608 2.249 2.960 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.310 2.158 1.617 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.035 3.629 3.154 1.00 0.00 C ATOM 0 H VAL A 390 -3.111 2.400 5.468 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.496 2.437 3.954 1.00 0.00 H new ATOM 0 HB VAL A 390 -2.779 1.541 2.983 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.614 2.431 0.824 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -4.660 1.138 1.458 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.160 2.840 1.604 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.356 3.860 2.333 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -3.844 4.359 3.173 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.490 3.667 4.097 1.00 0.00 H new ATOM 193 N ALA A 391 -6.011 -0.013 3.732 1.00 0.00 N ATOM 194 CA ALA A 391 -6.344 -1.401 3.618 1.00 0.00 C ATOM 195 C ALA A 391 -5.953 -1.893 2.244 1.00 0.00 C ATOM 196 O ALA A 391 -6.074 -1.163 1.260 1.00 0.00 O ATOM 197 CB ALA A 391 -7.829 -1.618 3.865 1.00 0.00 C ATOM 0 H ALA A 391 -6.793 0.624 3.582 1.00 0.00 H new ATOM 0 HA ALA A 391 -5.796 -1.967 4.372 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.062 -2.679 3.774 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.085 -1.275 4.868 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.406 -1.056 3.131 1.00 0.00 H new ATOM 203 N ASP A 392 -5.408 -3.086 2.207 1.00 0.00 N ATOM 204 CA ASP A 392 -5.015 -3.739 0.976 1.00 0.00 C ATOM 205 C ASP A 392 -6.257 -4.105 0.177 1.00 0.00 C ATOM 206 O ASP A 392 -6.653 -5.266 0.091 1.00 0.00 O ATOM 207 CB ASP A 392 -4.170 -4.981 1.279 1.00 0.00 C ATOM 208 CG ASP A 392 -4.634 -5.759 2.500 1.00 0.00 C ATOM 209 OD1 ASP A 392 -4.646 -5.183 3.616 1.00 0.00 O ATOM 210 OD2 ASP A 392 -4.942 -6.961 2.367 1.00 0.00 O ATOM 0 H ASP A 392 -5.221 -3.640 3.043 1.00 0.00 H new ATOM 0 HA ASP A 392 -4.406 -3.058 0.382 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.188 -5.641 0.412 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.134 -4.676 1.427 1.00 0.00 H new ATOM 215 N ASP A 393 -6.862 -3.080 -0.390 1.00 0.00 N ATOM 216 CA ASP A 393 -8.073 -3.211 -1.169 1.00 0.00 C ATOM 217 C ASP A 393 -7.756 -3.548 -2.615 1.00 0.00 C ATOM 218 O ASP A 393 -7.039 -2.815 -3.288 1.00 0.00 O ATOM 219 CB ASP A 393 -8.839 -1.899 -1.095 1.00 0.00 C ATOM 220 CG ASP A 393 -10.333 -2.078 -1.302 1.00 0.00 C ATOM 221 OD1 ASP A 393 -10.981 -2.742 -0.471 1.00 0.00 O ATOM 222 OD2 ASP A 393 -10.874 -1.538 -2.296 1.00 0.00 O ATOM 0 H ASP A 393 -6.520 -2.121 -0.321 1.00 0.00 H new ATOM 0 HA ASP A 393 -8.676 -4.023 -0.763 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -8.664 -1.436 -0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -8.452 -1.214 -1.849 1.00 0.00 H new ATOM 227 N PRO A 394 -8.275 -4.675 -3.110 1.00 0.00 N ATOM 228 CA PRO A 394 -8.048 -5.111 -4.475 1.00 0.00 C ATOM 229 C PRO A 394 -8.994 -4.457 -5.478 1.00 0.00 C ATOM 230 O PRO A 394 -9.881 -3.683 -5.119 1.00 0.00 O ATOM 231 CB PRO A 394 -8.303 -6.623 -4.423 1.00 0.00 C ATOM 232 CG PRO A 394 -8.822 -6.926 -3.055 1.00 0.00 C ATOM 233 CD PRO A 394 -9.114 -5.617 -2.376 1.00 0.00 C ATOM 0 HA PRO A 394 -7.048 -4.839 -4.812 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -9.024 -6.920 -5.185 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.385 -7.177 -4.620 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -9.724 -7.535 -3.115 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -8.089 -7.497 -2.486 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.170 -5.354 -2.442 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.858 -5.645 -1.317 1.00 0.00 H new ATOM 241 N ILE A 395 -8.809 -4.819 -6.736 1.00 0.00 N ATOM 242 CA ILE A 395 -9.617 -4.291 -7.826 1.00 0.00 C ATOM 243 C ILE A 395 -10.564 -5.370 -8.335 1.00 0.00 C ATOM 244 O ILE A 395 -10.134 -6.466 -8.697 1.00 0.00 O ATOM 245 CB ILE A 395 -8.727 -3.779 -8.993 1.00 0.00 C ATOM 246 CG1 ILE A 395 -8.142 -2.405 -8.661 1.00 0.00 C ATOM 247 CG2 ILE A 395 -9.500 -3.719 -10.308 1.00 0.00 C ATOM 248 CD1 ILE A 395 -9.184 -1.310 -8.544 1.00 0.00 C ATOM 0 H ILE A 395 -8.096 -5.486 -7.032 1.00 0.00 H new ATOM 0 HA ILE A 395 -10.192 -3.448 -7.444 1.00 0.00 H new ATOM 0 HB ILE A 395 -7.911 -4.491 -9.118 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -7.591 -2.472 -7.723 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -7.424 -2.130 -9.433 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -8.844 -3.356 -11.099 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -9.861 -4.715 -10.564 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -10.348 -3.042 -10.201 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -8.694 -0.365 -8.307 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -9.719 -1.214 -9.489 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -9.889 -1.562 -7.752 1.00 0.00 H new ATOM 260 N VAL A 396 -11.844 -5.056 -8.343 1.00 0.00 N ATOM 261 CA VAL A 396 -12.866 -5.976 -8.805 1.00 0.00 C ATOM 262 C VAL A 396 -13.709 -5.293 -9.875 1.00 0.00 C ATOM 263 O VAL A 396 -14.313 -4.247 -9.641 1.00 0.00 O ATOM 264 CB VAL A 396 -13.738 -6.495 -7.629 1.00 0.00 C ATOM 265 CG1 VAL A 396 -13.902 -5.436 -6.553 1.00 0.00 C ATOM 266 CG2 VAL A 396 -15.090 -7.000 -8.107 1.00 0.00 C ATOM 0 H VAL A 396 -12.206 -4.155 -8.029 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.386 -6.852 -9.242 1.00 0.00 H new ATOM 0 HB VAL A 396 -13.210 -7.342 -7.190 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.517 -5.831 -5.745 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -12.923 -5.160 -6.162 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.384 -4.556 -6.979 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.669 -7.354 -7.254 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.628 -6.190 -8.599 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.944 -7.819 -8.811 1.00 0.00 H new ATOM 276 N MET A 397 -13.728 -5.882 -11.058 1.00 0.00 N ATOM 277 CA MET A 397 -14.451 -5.317 -12.173 1.00 0.00 C ATOM 278 C MET A 397 -15.896 -5.759 -12.140 1.00 0.00 C ATOM 279 O MET A 397 -16.195 -6.908 -11.826 1.00 0.00 O ATOM 280 CB MET A 397 -13.801 -5.733 -13.494 1.00 0.00 C ATOM 281 CG MET A 397 -12.281 -5.734 -13.448 1.00 0.00 C ATOM 282 SD MET A 397 -11.528 -5.964 -15.069 1.00 0.00 S ATOM 283 CE MET A 397 -11.803 -4.352 -15.796 1.00 0.00 C ATOM 0 H MET A 397 -13.246 -6.757 -11.267 1.00 0.00 H new ATOM 0 HA MET A 397 -14.416 -4.230 -12.094 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.149 -6.730 -13.763 1.00 0.00 H new ATOM 0 HB3 MET A 397 -14.132 -5.056 -14.282 1.00 0.00 H new ATOM 0 HG2 MET A 397 -11.935 -4.792 -13.023 1.00 0.00 H new ATOM 0 HG3 MET A 397 -11.944 -6.527 -12.781 1.00 0.00 H new ATOM 0 HE1 MET A 397 -12.314 -4.466 -16.752 1.00 0.00 H new ATOM 0 HE2 MET A 397 -12.417 -3.751 -15.126 1.00 0.00 H new ATOM 0 HE3 MET A 397 -10.845 -3.856 -15.954 1.00 0.00 H new ATOM 293 N VAL A 398 -16.779 -4.824 -12.423 1.00 0.00 N ATOM 294 CA VAL A 398 -18.198 -5.095 -12.457 1.00 0.00 C ATOM 295 C VAL A 398 -18.769 -4.605 -13.775 1.00 0.00 C ATOM 296 O VAL A 398 -18.726 -3.404 -14.069 1.00 0.00 O ATOM 297 CB VAL A 398 -18.944 -4.424 -11.297 1.00 0.00 C ATOM 298 CG1 VAL A 398 -20.429 -4.690 -11.423 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.421 -4.921 -9.958 1.00 0.00 C ATOM 0 H VAL A 398 -16.532 -3.857 -12.635 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.334 -6.172 -12.356 1.00 0.00 H new ATOM 0 HB VAL A 398 -18.772 -3.349 -11.344 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -20.956 -4.212 -10.597 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -20.792 -4.286 -12.368 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -20.610 -5.765 -11.395 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -18.965 -4.431 -9.150 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.563 -6.000 -9.889 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.359 -4.689 -9.873 1.00 0.00 H new ATOM 309 N ALA A 399 -19.285 -5.538 -14.563 1.00 0.00 N ATOM 310 CA ALA A 399 -19.840 -5.249 -15.874 1.00 0.00 C ATOM 311 C ALA A 399 -18.741 -4.707 -16.780 1.00 0.00 C ATOM 312 O ALA A 399 -18.998 -3.933 -17.702 1.00 0.00 O ATOM 313 CB ALA A 399 -21.014 -4.281 -15.777 1.00 0.00 C ATOM 0 H ALA A 399 -19.330 -6.524 -14.306 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.228 -6.171 -16.307 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.407 -4.085 -16.775 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -21.797 -4.719 -15.158 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.678 -3.346 -15.329 1.00 0.00 H new ATOM 319 N GLY A 400 -17.501 -5.110 -16.490 1.00 0.00 N ATOM 320 CA GLY A 400 -16.369 -4.666 -17.279 1.00 0.00 C ATOM 321 C GLY A 400 -15.745 -3.398 -16.730 1.00 0.00 C ATOM 322 O GLY A 400 -14.646 -3.015 -17.123 1.00 0.00 O ATOM 0 H GLY A 400 -17.265 -5.737 -15.721 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -15.617 -5.455 -17.308 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -16.690 -4.495 -18.306 1.00 0.00 H new ATOM 326 N ARG A 401 -16.449 -2.748 -15.813 1.00 0.00 N ATOM 327 CA ARG A 401 -15.964 -1.518 -15.204 1.00 0.00 C ATOM 328 C ARG A 401 -15.102 -1.845 -13.991 1.00 0.00 C ATOM 329 O ARG A 401 -15.575 -2.461 -13.038 1.00 0.00 O ATOM 330 CB ARG A 401 -17.136 -0.630 -14.787 1.00 0.00 C ATOM 331 CG ARG A 401 -18.124 -0.349 -15.908 1.00 0.00 C ATOM 332 CD ARG A 401 -19.497 0.010 -15.358 1.00 0.00 C ATOM 333 NE ARG A 401 -20.063 -1.073 -14.550 1.00 0.00 N ATOM 334 CZ ARG A 401 -21.278 -1.049 -14.001 1.00 0.00 C ATOM 335 NH1 ARG A 401 -22.067 0.008 -14.159 1.00 0.00 N ATOM 336 NH2 ARG A 401 -21.706 -2.084 -13.292 1.00 0.00 N ATOM 0 H ARG A 401 -17.361 -3.054 -15.474 1.00 0.00 H new ATOM 0 HA ARG A 401 -15.363 -0.979 -15.936 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -17.664 -1.106 -13.961 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -16.747 0.317 -14.413 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -17.753 0.468 -16.527 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -18.205 -1.225 -16.552 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -19.420 0.913 -14.752 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -20.171 0.237 -16.184 1.00 0.00 H new ATOM 0 HE ARG A 401 -19.489 -1.902 -14.397 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -21.745 0.808 -14.703 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -22.995 0.019 -13.736 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -21.106 -2.899 -13.166 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -22.635 -2.065 -12.872 1.00 0.00 H new ATOM 350 N PRO A 402 -13.826 -1.448 -14.015 1.00 0.00 N ATOM 351 CA PRO A 402 -12.898 -1.719 -12.919 1.00 0.00 C ATOM 352 C PRO A 402 -13.144 -0.852 -11.686 1.00 0.00 C ATOM 353 O PRO A 402 -12.873 0.348 -11.688 1.00 0.00 O ATOM 354 CB PRO A 402 -11.529 -1.409 -13.527 1.00 0.00 C ATOM 355 CG PRO A 402 -11.802 -0.412 -14.601 1.00 0.00 C ATOM 356 CD PRO A 402 -13.185 -0.707 -15.117 1.00 0.00 C ATOM 0 HA PRO A 402 -13.004 -2.741 -12.555 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -10.847 -1.006 -12.779 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -11.064 -2.308 -13.932 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -11.742 0.604 -14.211 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -11.065 -0.491 -15.400 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -13.728 0.209 -15.351 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -13.152 -1.300 -16.031 1.00 0.00 H new ATOM 364 N PHE A 403 -13.678 -1.470 -10.646 1.00 0.00 N ATOM 365 CA PHE A 403 -13.936 -0.781 -9.392 1.00 0.00 C ATOM 366 C PHE A 403 -13.059 -1.387 -8.310 1.00 0.00 C ATOM 367 O PHE A 403 -12.507 -2.468 -8.493 1.00 0.00 O ATOM 368 CB PHE A 403 -15.403 -0.930 -8.973 1.00 0.00 C ATOM 369 CG PHE A 403 -16.402 -0.372 -9.947 1.00 0.00 C ATOM 370 CD1 PHE A 403 -16.437 0.983 -10.231 1.00 0.00 C ATOM 371 CD2 PHE A 403 -17.318 -1.207 -10.564 1.00 0.00 C ATOM 372 CE1 PHE A 403 -17.371 1.493 -11.116 1.00 0.00 C ATOM 373 CE2 PHE A 403 -18.250 -0.705 -11.449 1.00 0.00 C ATOM 374 CZ PHE A 403 -18.276 0.647 -11.725 1.00 0.00 C ATOM 0 H PHE A 403 -13.943 -2.455 -10.646 1.00 0.00 H new ATOM 0 HA PHE A 403 -13.715 0.278 -9.526 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -15.617 -1.988 -8.823 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -15.542 -0.437 -8.011 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -15.729 1.648 -9.758 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -17.303 -2.265 -10.350 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -17.392 2.551 -11.330 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -18.957 -1.368 -11.924 1.00 0.00 H new ATOM 0 HZ PHE A 403 -19.004 1.043 -12.417 1.00 0.00 H new ATOM 384 N SER A 404 -12.907 -0.699 -7.201 1.00 0.00 N ATOM 385 CA SER A 404 -12.128 -1.232 -6.103 1.00 0.00 C ATOM 386 C SER A 404 -13.043 -2.100 -5.248 1.00 0.00 C ATOM 387 O SER A 404 -14.264 -2.018 -5.375 1.00 0.00 O ATOM 388 CB SER A 404 -11.527 -0.098 -5.278 1.00 0.00 C ATOM 389 OG SER A 404 -11.283 1.041 -6.090 1.00 0.00 O ATOM 0 H SER A 404 -13.308 0.224 -7.034 1.00 0.00 H new ATOM 0 HA SER A 404 -11.302 -1.833 -6.484 1.00 0.00 H new ATOM 0 HB2 SER A 404 -12.205 0.167 -4.467 1.00 0.00 H new ATOM 0 HB3 SER A 404 -10.595 -0.430 -4.819 1.00 0.00 H new ATOM 0 HG SER A 404 -10.899 1.757 -5.542 1.00 0.00 H new ATOM 395 N TYR A 405 -12.477 -2.924 -4.392 1.00 0.00 N ATOM 396 CA TYR A 405 -13.275 -3.797 -3.544 1.00 0.00 C ATOM 397 C TYR A 405 -14.156 -2.967 -2.626 1.00 0.00 C ATOM 398 O TYR A 405 -15.367 -3.179 -2.565 1.00 0.00 O ATOM 399 CB TYR A 405 -12.387 -4.735 -2.728 1.00 0.00 C ATOM 400 CG TYR A 405 -13.164 -5.744 -1.912 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.634 -5.431 -0.642 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.435 -7.008 -2.417 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.355 -6.349 0.099 1.00 0.00 C ATOM 404 CE2 TYR A 405 -14.152 -7.930 -1.682 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.610 -7.596 -0.425 1.00 0.00 C ATOM 406 OH TYR A 405 -15.329 -8.513 0.307 1.00 0.00 O ATOM 0 H TYR A 405 -11.469 -3.011 -4.262 1.00 0.00 H new ATOM 0 HA TYR A 405 -13.909 -4.411 -4.185 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -11.716 -5.265 -3.403 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -11.763 -4.142 -2.059 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.433 -4.454 -0.227 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -13.079 -7.274 -3.401 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.716 -6.089 1.083 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -14.354 -8.910 -2.090 1.00 0.00 H new ATOM 0 HH TYR A 405 -15.823 -9.102 -0.301 1.00 0.00 H new ATOM 416 N SER A 406 -13.545 -2.006 -1.945 1.00 0.00 N ATOM 417 CA SER A 406 -14.262 -1.119 -1.037 1.00 0.00 C ATOM 418 C SER A 406 -15.295 -0.292 -1.801 1.00 0.00 C ATOM 419 O SER A 406 -16.258 0.215 -1.228 1.00 0.00 O ATOM 420 CB SER A 406 -13.274 -0.197 -0.319 1.00 0.00 C ATOM 421 OG SER A 406 -12.375 0.398 -1.242 1.00 0.00 O ATOM 0 H SER A 406 -12.544 -1.820 -2.006 1.00 0.00 H new ATOM 0 HA SER A 406 -14.784 -1.725 -0.297 1.00 0.00 H new ATOM 0 HB2 SER A 406 -13.819 0.580 0.217 1.00 0.00 H new ATOM 0 HB3 SER A 406 -12.715 -0.765 0.425 1.00 0.00 H new ATOM 0 HG SER A 406 -11.877 -0.303 -1.712 1.00 0.00 H new ATOM 427 N GLU A 407 -15.091 -0.191 -3.105 1.00 0.00 N ATOM 428 CA GLU A 407 -15.976 0.554 -3.980 1.00 0.00 C ATOM 429 C GLU A 407 -17.179 -0.312 -4.331 1.00 0.00 C ATOM 430 O GLU A 407 -18.340 0.104 -4.216 1.00 0.00 O ATOM 431 CB GLU A 407 -15.209 0.948 -5.241 1.00 0.00 C ATOM 432 CG GLU A 407 -14.428 2.245 -5.108 1.00 0.00 C ATOM 433 CD GLU A 407 -15.323 3.462 -5.081 1.00 0.00 C ATOM 434 OE1 GLU A 407 -15.777 3.888 -6.161 1.00 0.00 O ATOM 435 OE2 GLU A 407 -15.598 3.982 -3.981 1.00 0.00 O ATOM 0 H GLU A 407 -14.304 -0.626 -3.586 1.00 0.00 H new ATOM 0 HA GLU A 407 -16.330 1.458 -3.484 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -14.519 0.145 -5.500 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -15.913 1.043 -6.068 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -13.834 2.215 -4.195 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -13.729 2.331 -5.940 1.00 0.00 H new ATOM 442 N VAL A 408 -16.880 -1.537 -4.734 1.00 0.00 N ATOM 443 CA VAL A 408 -17.894 -2.507 -5.096 1.00 0.00 C ATOM 444 C VAL A 408 -18.761 -2.848 -3.882 1.00 0.00 C ATOM 445 O VAL A 408 -19.968 -3.039 -4.004 1.00 0.00 O ATOM 446 CB VAL A 408 -17.244 -3.792 -5.660 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.279 -4.859 -5.925 1.00 0.00 C ATOM 448 CG2 VAL A 408 -16.476 -3.497 -6.935 1.00 0.00 C ATOM 0 H VAL A 408 -15.925 -1.884 -4.818 1.00 0.00 H new ATOM 0 HA VAL A 408 -18.525 -2.069 -5.869 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.549 -4.161 -4.906 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.791 -5.749 -6.321 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.791 -5.109 -4.995 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.004 -4.490 -6.650 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.029 -4.417 -7.311 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.156 -3.092 -7.684 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -15.691 -2.770 -6.727 1.00 0.00 H new ATOM 458 N SER A 409 -18.139 -2.894 -2.706 1.00 0.00 N ATOM 459 CA SER A 409 -18.858 -3.201 -1.473 1.00 0.00 C ATOM 460 C SER A 409 -19.737 -2.030 -1.047 1.00 0.00 C ATOM 461 O SER A 409 -20.704 -2.206 -0.306 1.00 0.00 O ATOM 462 CB SER A 409 -17.875 -3.550 -0.352 1.00 0.00 C ATOM 463 OG SER A 409 -16.875 -2.557 -0.218 1.00 0.00 O ATOM 0 H SER A 409 -17.141 -2.723 -2.582 1.00 0.00 H new ATOM 0 HA SER A 409 -19.498 -4.062 -1.665 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.415 -3.655 0.589 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.409 -4.513 -0.561 1.00 0.00 H new ATOM 0 HG SER A 409 -16.360 -2.719 0.600 1.00 0.00 H new ATOM 469 N GLN A 410 -19.389 -0.836 -1.511 1.00 0.00 N ATOM 470 CA GLN A 410 -20.148 0.361 -1.180 1.00 0.00 C ATOM 471 C GLN A 410 -21.472 0.388 -1.919 1.00 0.00 C ATOM 472 O GLN A 410 -22.480 0.841 -1.380 1.00 0.00 O ATOM 473 CB GLN A 410 -19.358 1.621 -1.529 1.00 0.00 C ATOM 474 CG GLN A 410 -18.488 2.143 -0.401 1.00 0.00 C ATOM 475 CD GLN A 410 -17.658 3.330 -0.839 1.00 0.00 C ATOM 476 OE1 GLN A 410 -18.111 4.473 -0.777 1.00 0.00 O ATOM 477 NE2 GLN A 410 -16.447 3.067 -1.297 1.00 0.00 N ATOM 0 H GLN A 410 -18.586 -0.672 -2.118 1.00 0.00 H new ATOM 0 HA GLN A 410 -20.336 0.338 -0.107 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -18.727 1.413 -2.393 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -20.056 2.403 -1.826 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -19.117 2.430 0.441 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -17.830 1.348 -0.051 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -16.112 2.104 -1.330 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -15.847 3.827 -1.617 1.00 0.00 H new ATOM 486 N ARG A 411 -21.469 -0.086 -3.156 1.00 0.00 N ATOM 487 CA ARG A 411 -22.689 -0.086 -3.951 1.00 0.00 C ATOM 488 C ARG A 411 -23.235 -1.491 -4.188 1.00 0.00 C ATOM 489 O ARG A 411 -22.723 -2.246 -5.030 1.00 0.00 O ATOM 490 CB ARG A 411 -22.462 0.608 -5.291 1.00 0.00 C ATOM 491 CG ARG A 411 -22.305 2.111 -5.173 1.00 0.00 C ATOM 492 CD ARG A 411 -20.951 2.552 -5.689 1.00 0.00 C ATOM 493 NE ARG A 411 -20.180 3.270 -4.677 1.00 0.00 N ATOM 494 CZ ARG A 411 -18.909 3.624 -4.841 1.00 0.00 C ATOM 495 NH1 ARG A 411 -18.301 3.383 -5.994 1.00 0.00 N ATOM 496 NH2 ARG A 411 -18.247 4.228 -3.862 1.00 0.00 N ATOM 0 H ARG A 411 -20.649 -0.470 -3.626 1.00 0.00 H new ATOM 0 HA ARG A 411 -23.432 0.465 -3.375 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -21.570 0.193 -5.760 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.301 0.389 -5.952 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -23.094 2.609 -5.737 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -22.418 2.412 -4.132 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -20.388 1.679 -6.020 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -21.087 3.192 -6.561 1.00 0.00 H new ATOM 0 HE ARG A 411 -20.640 3.512 -3.800 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -18.808 2.927 -6.752 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -17.326 3.653 -6.123 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -18.713 4.424 -2.976 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -17.272 4.496 -3.996 1.00 0.00 H new ATOM 510 N PRO A 412 -24.286 -1.862 -3.444 1.00 0.00 N ATOM 511 CA PRO A 412 -24.942 -3.156 -3.599 1.00 0.00 C ATOM 512 C PRO A 412 -25.470 -3.337 -5.021 1.00 0.00 C ATOM 513 O PRO A 412 -25.588 -4.462 -5.510 1.00 0.00 O ATOM 514 CB PRO A 412 -26.100 -3.104 -2.596 1.00 0.00 C ATOM 515 CG PRO A 412 -25.698 -2.069 -1.605 1.00 0.00 C ATOM 516 CD PRO A 412 -24.902 -1.057 -2.375 1.00 0.00 C ATOM 0 HA PRO A 412 -24.264 -3.991 -3.422 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.037 -2.839 -3.087 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.253 -4.071 -2.118 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -26.572 -1.610 -1.142 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -25.104 -2.506 -0.802 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -25.536 -0.268 -2.779 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -24.151 -0.574 -1.750 1.00 0.00 H new ATOM 524 N GLU A 413 -25.767 -2.217 -5.689 1.00 0.00 N ATOM 525 CA GLU A 413 -26.263 -2.254 -7.058 1.00 0.00 C ATOM 526 C GLU A 413 -25.150 -2.724 -7.973 1.00 0.00 C ATOM 527 O GLU A 413 -25.398 -3.392 -8.967 1.00 0.00 O ATOM 528 CB GLU A 413 -26.753 -0.883 -7.538 1.00 0.00 C ATOM 529 CG GLU A 413 -27.300 0.010 -6.445 1.00 0.00 C ATOM 530 CD GLU A 413 -26.218 0.869 -5.835 1.00 0.00 C ATOM 531 OE1 GLU A 413 -25.884 1.917 -6.420 1.00 0.00 O ATOM 532 OE2 GLU A 413 -25.680 0.473 -4.788 1.00 0.00 O ATOM 0 H GLU A 413 -25.671 -1.279 -5.300 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.111 -2.938 -7.084 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -25.927 -0.369 -8.030 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -27.529 -1.032 -8.289 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -28.084 0.647 -6.854 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -27.759 -0.603 -5.669 1.00 0.00 H new ATOM 539 N LEU A 414 -23.917 -2.367 -7.627 1.00 0.00 N ATOM 540 CA LEU A 414 -22.766 -2.778 -8.410 1.00 0.00 C ATOM 541 C LEU A 414 -22.644 -4.286 -8.351 1.00 0.00 C ATOM 542 O LEU A 414 -22.482 -4.943 -9.367 1.00 0.00 O ATOM 543 CB LEU A 414 -21.479 -2.126 -7.898 1.00 0.00 C ATOM 544 CG LEU A 414 -21.267 -0.673 -8.330 1.00 0.00 C ATOM 545 CD1 LEU A 414 -19.870 -0.207 -7.949 1.00 0.00 C ATOM 546 CD2 LEU A 414 -21.493 -0.519 -9.828 1.00 0.00 C ATOM 0 H LEU A 414 -23.694 -1.796 -6.812 1.00 0.00 H new ATOM 0 HA LEU A 414 -22.911 -2.454 -9.441 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.478 -2.168 -6.809 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -20.630 -2.718 -8.241 1.00 0.00 H new ATOM 0 HG LEU A 414 -21.994 -0.049 -7.811 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -19.734 0.828 -8.262 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -19.745 -0.278 -6.869 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.129 -0.836 -8.443 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -21.337 0.521 -10.114 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -20.791 -1.153 -10.369 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -22.513 -0.814 -10.074 1.00 0.00 H new ATOM 558 N VAL A 415 -22.776 -4.833 -7.155 1.00 0.00 N ATOM 559 CA VAL A 415 -22.697 -6.279 -6.969 1.00 0.00 C ATOM 560 C VAL A 415 -23.912 -6.943 -7.619 1.00 0.00 C ATOM 561 O VAL A 415 -23.877 -8.115 -8.004 1.00 0.00 O ATOM 562 CB VAL A 415 -22.612 -6.631 -5.462 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.744 -8.126 -5.219 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.304 -6.118 -4.881 1.00 0.00 C ATOM 0 H VAL A 415 -22.938 -4.303 -6.298 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.792 -6.654 -7.448 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.448 -6.144 -4.961 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -22.679 -8.328 -4.150 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.706 -8.472 -5.596 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.941 -8.651 -5.737 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.253 -6.370 -3.822 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.467 -6.580 -5.405 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.253 -5.036 -5.000 1.00 0.00 H new ATOM 574 N ALA A 416 -24.971 -6.162 -7.770 1.00 0.00 N ATOM 575 CA ALA A 416 -26.195 -6.628 -8.395 1.00 0.00 C ATOM 576 C ALA A 416 -26.072 -6.570 -9.915 1.00 0.00 C ATOM 577 O ALA A 416 -26.812 -7.235 -10.636 1.00 0.00 O ATOM 578 CB ALA A 416 -27.364 -5.785 -7.922 1.00 0.00 C ATOM 0 H ALA A 416 -25.004 -5.190 -7.463 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.369 -7.665 -8.108 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.281 -6.138 -8.393 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.458 -5.868 -6.839 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.194 -4.743 -8.193 1.00 0.00 H new ATOM 584 N GLN A 417 -25.115 -5.777 -10.388 1.00 0.00 N ATOM 585 CA GLN A 417 -24.867 -5.628 -11.814 1.00 0.00 C ATOM 586 C GLN A 417 -23.684 -6.490 -12.176 1.00 0.00 C ATOM 587 O GLN A 417 -23.355 -6.673 -13.346 1.00 0.00 O ATOM 588 CB GLN A 417 -24.555 -4.172 -12.180 1.00 0.00 C ATOM 589 CG GLN A 417 -25.706 -3.207 -11.960 1.00 0.00 C ATOM 590 CD GLN A 417 -25.247 -1.761 -11.898 1.00 0.00 C ATOM 591 OE1 GLN A 417 -24.264 -1.376 -12.536 1.00 0.00 O ATOM 592 NE2 GLN A 417 -25.949 -0.952 -11.121 1.00 0.00 N ATOM 0 H GLN A 417 -24.495 -5.224 -9.796 1.00 0.00 H new ATOM 0 HA GLN A 417 -25.760 -5.929 -12.362 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -23.700 -3.838 -11.592 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -24.257 -4.130 -13.228 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -26.431 -3.321 -12.766 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.218 -3.463 -11.032 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -26.756 -1.309 -10.610 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -25.683 0.029 -11.034 1.00 0.00 H new ATOM 601 N MET A 418 -23.043 -7.010 -11.142 1.00 0.00 N ATOM 602 CA MET A 418 -21.892 -7.843 -11.310 1.00 0.00 C ATOM 603 C MET A 418 -22.348 -9.246 -11.638 1.00 0.00 C ATOM 604 O MET A 418 -23.255 -9.804 -11.003 1.00 0.00 O ATOM 605 CB MET A 418 -21.008 -7.785 -10.060 1.00 0.00 C ATOM 606 CG MET A 418 -20.955 -9.061 -9.247 1.00 0.00 C ATOM 607 SD MET A 418 -20.305 -8.785 -7.590 1.00 0.00 S ATOM 608 CE MET A 418 -18.809 -7.879 -7.974 1.00 0.00 C ATOM 0 H MET A 418 -23.315 -6.860 -10.170 1.00 0.00 H new ATOM 0 HA MET A 418 -21.280 -7.486 -12.138 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.994 -7.524 -10.364 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.366 -6.979 -9.419 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.956 -9.487 -9.177 1.00 0.00 H new ATOM 0 HG3 MET A 418 -20.333 -9.793 -9.762 1.00 0.00 H new ATOM 0 HE1 MET A 418 -18.183 -7.816 -7.084 1.00 0.00 H new ATOM 0 HE2 MET A 418 -18.264 -8.395 -8.765 1.00 0.00 H new ATOM 0 HE3 MET A 418 -19.068 -6.874 -8.307 1.00 0.00 H new ATOM 618 N THR A 419 -21.718 -9.789 -12.638 1.00 0.00 N ATOM 619 CA THR A 419 -22.040 -11.120 -13.137 1.00 0.00 C ATOM 620 C THR A 419 -21.600 -12.185 -12.142 1.00 0.00 C ATOM 621 O THR A 419 -20.947 -11.863 -11.151 1.00 0.00 O ATOM 622 CB THR A 419 -21.360 -11.377 -14.499 1.00 0.00 C ATOM 623 OG1 THR A 419 -19.941 -11.467 -14.335 1.00 0.00 O ATOM 624 CG2 THR A 419 -21.690 -10.272 -15.492 1.00 0.00 C ATOM 0 H THR A 419 -20.960 -9.329 -13.142 1.00 0.00 H new ATOM 0 HA THR A 419 -23.121 -11.174 -13.266 1.00 0.00 H new ATOM 0 HB THR A 419 -21.740 -12.321 -14.891 1.00 0.00 H new ATOM 0 HG1 THR A 419 -19.547 -11.893 -15.125 1.00 0.00 H new ATOM 0 HG21 THR A 419 -21.198 -10.478 -16.443 1.00 0.00 H new ATOM 0 HG22 THR A 419 -22.769 -10.229 -15.643 1.00 0.00 H new ATOM 0 HG23 THR A 419 -21.340 -9.316 -15.102 1.00 0.00 H new ATOM 632 N PRO A 420 -21.994 -13.458 -12.342 1.00 0.00 N ATOM 633 CA PRO A 420 -21.571 -14.547 -11.460 1.00 0.00 C ATOM 634 C PRO A 420 -20.051 -14.575 -11.341 1.00 0.00 C ATOM 635 O PRO A 420 -19.501 -14.637 -10.244 1.00 0.00 O ATOM 636 CB PRO A 420 -22.089 -15.804 -12.161 1.00 0.00 C ATOM 637 CG PRO A 420 -23.241 -15.331 -12.977 1.00 0.00 C ATOM 638 CD PRO A 420 -22.893 -13.933 -13.412 1.00 0.00 C ATOM 0 HA PRO A 420 -21.953 -14.448 -10.444 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -21.319 -16.255 -12.787 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -22.398 -16.561 -11.440 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -23.402 -15.979 -13.838 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -24.162 -15.341 -12.394 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -22.400 -13.925 -14.384 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -23.781 -13.306 -13.499 1.00 0.00 H new ATOM 646 N GLU A 421 -19.381 -14.475 -12.485 1.00 0.00 N ATOM 647 CA GLU A 421 -17.924 -14.465 -12.525 1.00 0.00 C ATOM 648 C GLU A 421 -17.381 -13.335 -11.658 1.00 0.00 C ATOM 649 O GLU A 421 -16.468 -13.539 -10.861 1.00 0.00 O ATOM 650 CB GLU A 421 -17.407 -14.290 -13.960 1.00 0.00 C ATOM 651 CG GLU A 421 -18.166 -15.092 -15.007 1.00 0.00 C ATOM 652 CD GLU A 421 -19.433 -14.395 -15.454 1.00 0.00 C ATOM 653 OE1 GLU A 421 -19.335 -13.362 -16.145 1.00 0.00 O ATOM 654 OE2 GLU A 421 -20.526 -14.864 -15.085 1.00 0.00 O ATOM 0 H GLU A 421 -19.827 -14.400 -13.399 1.00 0.00 H new ATOM 0 HA GLU A 421 -17.577 -15.425 -12.142 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -17.456 -13.234 -14.224 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -16.356 -14.578 -13.992 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -17.522 -15.260 -15.870 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -18.417 -16.072 -14.600 1.00 0.00 H new ATOM 661 N GLU A 422 -17.958 -12.145 -11.813 1.00 0.00 N ATOM 662 CA GLU A 422 -17.542 -10.981 -11.054 1.00 0.00 C ATOM 663 C GLU A 422 -17.901 -11.142 -9.578 1.00 0.00 C ATOM 664 O GLU A 422 -17.117 -10.789 -8.698 1.00 0.00 O ATOM 665 CB GLU A 422 -18.193 -9.746 -11.668 1.00 0.00 C ATOM 666 CG GLU A 422 -17.727 -9.510 -13.096 1.00 0.00 C ATOM 667 CD GLU A 422 -18.380 -8.314 -13.740 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.547 -8.012 -13.402 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.729 -7.665 -14.587 1.00 0.00 O ATOM 0 H GLU A 422 -18.722 -11.967 -12.465 1.00 0.00 H new ATOM 0 HA GLU A 422 -16.459 -10.869 -11.100 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -19.277 -9.862 -11.654 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.958 -8.872 -11.060 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.646 -9.373 -13.101 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.939 -10.397 -13.692 1.00 0.00 H new ATOM 676 N LYS A 423 -19.093 -11.664 -9.320 1.00 0.00 N ATOM 677 CA LYS A 423 -19.565 -11.924 -7.962 1.00 0.00 C ATOM 678 C LYS A 423 -18.615 -12.847 -7.222 1.00 0.00 C ATOM 679 O LYS A 423 -18.116 -12.506 -6.151 1.00 0.00 O ATOM 680 CB LYS A 423 -20.947 -12.573 -8.011 1.00 0.00 C ATOM 681 CG LYS A 423 -21.603 -12.730 -6.649 1.00 0.00 C ATOM 682 CD LYS A 423 -22.374 -11.485 -6.246 1.00 0.00 C ATOM 683 CE LYS A 423 -23.721 -11.409 -6.947 1.00 0.00 C ATOM 684 NZ LYS A 423 -23.616 -10.823 -8.313 1.00 0.00 N ATOM 0 H LYS A 423 -19.762 -11.920 -10.046 1.00 0.00 H new ATOM 0 HA LYS A 423 -19.615 -10.972 -7.434 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -21.596 -11.974 -8.649 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -20.860 -13.555 -8.477 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -22.278 -13.585 -6.668 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -20.840 -12.943 -5.901 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -22.524 -11.483 -5.166 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -21.787 -10.599 -6.488 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -24.149 -12.409 -7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -24.406 -10.809 -6.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -24.132 -11.422 -8.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -24.027 -9.868 -8.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -22.616 -10.770 -8.592 1.00 0.00 H new ATOM 698 N GLU A 424 -18.353 -13.996 -7.818 1.00 0.00 N ATOM 699 CA GLU A 424 -17.480 -14.989 -7.215 1.00 0.00 C ATOM 700 C GLU A 424 -16.076 -14.429 -7.084 1.00 0.00 C ATOM 701 O GLU A 424 -15.351 -14.744 -6.142 1.00 0.00 O ATOM 702 CB GLU A 424 -17.486 -16.280 -8.035 1.00 0.00 C ATOM 703 CG GLU A 424 -18.611 -17.240 -7.654 1.00 0.00 C ATOM 704 CD GLU A 424 -20.000 -16.653 -7.851 1.00 0.00 C ATOM 705 OE1 GLU A 424 -20.466 -15.906 -6.962 1.00 0.00 O ATOM 706 OE2 GLU A 424 -20.628 -16.942 -8.891 1.00 0.00 O ATOM 0 H GLU A 424 -18.734 -14.266 -8.725 1.00 0.00 H new ATOM 0 HA GLU A 424 -17.850 -15.229 -6.218 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -17.576 -16.029 -9.092 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -16.529 -16.786 -7.908 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -18.521 -18.148 -8.250 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -18.492 -17.531 -6.610 1.00 0.00 H new ATOM 713 N ALA A 425 -15.708 -13.580 -8.033 1.00 0.00 N ATOM 714 CA ALA A 425 -14.413 -12.932 -8.017 1.00 0.00 C ATOM 715 C ALA A 425 -14.335 -11.990 -6.824 1.00 0.00 C ATOM 716 O ALA A 425 -13.364 -12.001 -6.072 1.00 0.00 O ATOM 717 CB ALA A 425 -14.197 -12.177 -9.315 1.00 0.00 C ATOM 0 H ALA A 425 -16.296 -13.325 -8.827 1.00 0.00 H new ATOM 0 HA ALA A 425 -13.628 -13.682 -7.924 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -13.221 -11.692 -9.296 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -14.240 -12.873 -10.152 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -14.975 -11.422 -9.431 1.00 0.00 H new ATOM 723 N TYR A 426 -15.382 -11.188 -6.653 1.00 0.00 N ATOM 724 CA TYR A 426 -15.473 -10.250 -5.548 1.00 0.00 C ATOM 725 C TYR A 426 -15.479 -11.008 -4.229 1.00 0.00 C ATOM 726 O TYR A 426 -14.757 -10.657 -3.295 1.00 0.00 O ATOM 727 CB TYR A 426 -16.749 -9.411 -5.697 1.00 0.00 C ATOM 728 CG TYR A 426 -17.168 -8.658 -4.452 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.640 -7.407 -4.164 1.00 0.00 C ATOM 730 CD2 TYR A 426 -18.096 -9.198 -3.571 1.00 0.00 C ATOM 731 CE1 TYR A 426 -17.025 -6.715 -3.031 1.00 0.00 C ATOM 732 CE2 TYR A 426 -18.485 -8.513 -2.438 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.946 -7.275 -2.171 1.00 0.00 C ATOM 734 OH TYR A 426 -18.332 -6.594 -1.043 1.00 0.00 O ATOM 0 H TYR A 426 -16.188 -11.173 -7.278 1.00 0.00 H new ATOM 0 HA TYR A 426 -14.611 -9.583 -5.558 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.602 -8.694 -6.505 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -17.565 -10.068 -5.998 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.917 -6.968 -4.835 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -18.520 -10.170 -3.776 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.607 -5.742 -2.821 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -19.209 -8.946 -1.764 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.987 -7.128 -0.547 1.00 0.00 H new ATOM 744 N ILE A 427 -16.289 -12.059 -4.172 1.00 0.00 N ATOM 745 CA ILE A 427 -16.395 -12.884 -2.980 1.00 0.00 C ATOM 746 C ILE A 427 -15.037 -13.492 -2.622 1.00 0.00 C ATOM 747 O ILE A 427 -14.586 -13.398 -1.481 1.00 0.00 O ATOM 748 CB ILE A 427 -17.446 -14.006 -3.159 1.00 0.00 C ATOM 749 CG1 ILE A 427 -18.850 -13.399 -3.255 1.00 0.00 C ATOM 750 CG2 ILE A 427 -17.376 -15.005 -2.010 1.00 0.00 C ATOM 751 CD1 ILE A 427 -19.912 -14.377 -3.714 1.00 0.00 C ATOM 0 H ILE A 427 -16.884 -12.359 -4.944 1.00 0.00 H new ATOM 0 HA ILE A 427 -16.722 -12.239 -2.164 1.00 0.00 H new ATOM 0 HB ILE A 427 -17.227 -14.540 -4.084 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -19.132 -13.004 -2.279 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -18.824 -12.556 -3.945 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -18.124 -15.784 -2.159 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -16.384 -15.456 -1.980 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -17.570 -14.491 -1.069 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -20.877 -13.872 -3.757 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -19.656 -14.754 -4.704 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -19.968 -15.209 -3.012 1.00 0.00 H new ATOM 763 N ALA A 428 -14.380 -14.092 -3.612 1.00 0.00 N ATOM 764 CA ALA A 428 -13.073 -14.709 -3.405 1.00 0.00 C ATOM 765 C ALA A 428 -12.035 -13.668 -2.995 1.00 0.00 C ATOM 766 O ALA A 428 -11.185 -13.925 -2.140 1.00 0.00 O ATOM 767 CB ALA A 428 -12.623 -15.437 -4.662 1.00 0.00 C ATOM 0 H ALA A 428 -14.732 -14.164 -4.567 1.00 0.00 H new ATOM 0 HA ALA A 428 -13.167 -15.433 -2.596 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -11.647 -15.891 -4.490 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -13.346 -16.214 -4.911 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -12.553 -14.729 -5.487 1.00 0.00 H new ATOM 773 N MET A 429 -12.113 -12.490 -3.605 1.00 0.00 N ATOM 774 CA MET A 429 -11.190 -11.403 -3.300 1.00 0.00 C ATOM 775 C MET A 429 -11.364 -10.951 -1.858 1.00 0.00 C ATOM 776 O MET A 429 -10.396 -10.592 -1.188 1.00 0.00 O ATOM 777 CB MET A 429 -11.413 -10.226 -4.248 1.00 0.00 C ATOM 778 CG MET A 429 -10.728 -10.386 -5.594 1.00 0.00 C ATOM 779 SD MET A 429 -10.086 -8.824 -6.220 1.00 0.00 S ATOM 780 CE MET A 429 -11.337 -7.694 -5.616 1.00 0.00 C ATOM 0 H MET A 429 -12.808 -12.263 -4.316 1.00 0.00 H new ATOM 0 HA MET A 429 -10.173 -11.770 -3.435 1.00 0.00 H new ATOM 0 HB2 MET A 429 -12.484 -10.098 -4.408 1.00 0.00 H new ATOM 0 HB3 MET A 429 -11.051 -9.315 -3.772 1.00 0.00 H new ATOM 0 HG2 MET A 429 -9.911 -11.102 -5.501 1.00 0.00 H new ATOM 0 HG3 MET A 429 -11.435 -10.801 -6.313 1.00 0.00 H new ATOM 0 HE1 MET A 429 -11.312 -6.776 -6.203 1.00 0.00 H new ATOM 0 HE2 MET A 429 -12.320 -8.156 -5.708 1.00 0.00 H new ATOM 0 HE3 MET A 429 -11.142 -7.461 -4.569 1.00 0.00 H new ATOM 790 N GLY A 430 -12.601 -10.990 -1.383 1.00 0.00 N ATOM 791 CA GLY A 430 -12.885 -10.598 -0.027 1.00 0.00 C ATOM 792 C GLY A 430 -12.469 -11.676 0.931 1.00 0.00 C ATOM 793 O GLY A 430 -11.936 -11.394 2.002 1.00 0.00 O ATOM 0 H GLY A 430 -13.415 -11.289 -1.921 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -12.359 -9.672 0.208 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.950 -10.396 0.084 1.00 0.00 H new ATOM 797 N GLN A 431 -12.685 -12.921 0.522 1.00 0.00 N ATOM 798 CA GLN A 431 -12.322 -14.067 1.331 1.00 0.00 C ATOM 799 C GLN A 431 -10.825 -14.062 1.606 1.00 0.00 C ATOM 800 O GLN A 431 -10.387 -14.482 2.664 1.00 0.00 O ATOM 801 CB GLN A 431 -12.728 -15.375 0.649 1.00 0.00 C ATOM 802 CG GLN A 431 -12.992 -16.503 1.634 1.00 0.00 C ATOM 803 CD GLN A 431 -14.239 -16.262 2.466 1.00 0.00 C ATOM 804 OE1 GLN A 431 -15.240 -15.749 1.968 1.00 0.00 O ATOM 805 NE2 GLN A 431 -14.182 -16.606 3.742 1.00 0.00 N ATOM 0 H GLN A 431 -13.113 -13.158 -0.373 1.00 0.00 H new ATOM 0 HA GLN A 431 -12.859 -13.997 2.277 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -13.624 -15.204 0.052 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -11.940 -15.679 -0.040 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -13.097 -17.441 1.089 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -12.133 -16.613 2.295 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -13.334 -17.029 4.119 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -14.986 -16.448 4.349 1.00 0.00 H new ATOM 814 N ARG A 432 -10.039 -13.562 0.658 1.00 0.00 N ATOM 815 CA ARG A 432 -8.594 -13.502 0.838 1.00 0.00 C ATOM 816 C ARG A 432 -8.236 -12.599 2.014 1.00 0.00 C ATOM 817 O ARG A 432 -7.286 -12.862 2.739 1.00 0.00 O ATOM 818 CB ARG A 432 -7.899 -13.016 -0.429 1.00 0.00 C ATOM 819 CG ARG A 432 -6.866 -14.002 -0.942 1.00 0.00 C ATOM 820 CD ARG A 432 -5.463 -13.407 -0.956 1.00 0.00 C ATOM 821 NE ARG A 432 -5.022 -12.959 0.371 1.00 0.00 N ATOM 822 CZ ARG A 432 -4.660 -13.773 1.375 1.00 0.00 C ATOM 823 NH1 ARG A 432 -4.690 -15.094 1.228 1.00 0.00 N ATOM 824 NH2 ARG A 432 -4.266 -13.253 2.535 1.00 0.00 N ATOM 0 H ARG A 432 -10.374 -13.196 -0.233 1.00 0.00 H new ATOM 0 HA ARG A 432 -8.244 -14.512 1.051 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -8.645 -12.841 -1.204 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -7.416 -12.060 -0.230 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -6.875 -14.894 -0.316 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -7.136 -14.317 -1.950 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -4.762 -14.150 -1.335 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -5.438 -12.564 -1.646 1.00 0.00 H new ATOM 0 HE ARG A 432 -4.988 -11.954 0.543 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -4.991 -15.502 0.343 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -4.412 -15.700 2.000 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -4.240 -12.241 2.658 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -3.990 -13.867 3.301 1.00 0.00 H new ATOM 838 N MET A 433 -9.006 -11.536 2.196 1.00 0.00 N ATOM 839 CA MET A 433 -8.775 -10.616 3.302 1.00 0.00 C ATOM 840 C MET A 433 -9.460 -11.148 4.553 1.00 0.00 C ATOM 841 O MET A 433 -9.071 -10.838 5.675 1.00 0.00 O ATOM 842 CB MET A 433 -9.311 -9.226 2.971 1.00 0.00 C ATOM 843 CG MET A 433 -8.548 -8.522 1.860 1.00 0.00 C ATOM 844 SD MET A 433 -9.370 -7.017 1.304 1.00 0.00 S ATOM 845 CE MET A 433 -10.766 -7.696 0.415 1.00 0.00 C ATOM 0 H MET A 433 -9.793 -11.289 1.596 1.00 0.00 H new ATOM 0 HA MET A 433 -7.702 -10.538 3.474 1.00 0.00 H new ATOM 0 HB2 MET A 433 -10.359 -9.310 2.683 1.00 0.00 H new ATOM 0 HB3 MET A 433 -9.276 -8.610 3.870 1.00 0.00 H new ATOM 0 HG2 MET A 433 -7.546 -8.276 2.211 1.00 0.00 H new ATOM 0 HG3 MET A 433 -8.432 -9.202 1.016 1.00 0.00 H new ATOM 0 HE1 MET A 433 -11.049 -7.018 -0.391 1.00 0.00 H new ATOM 0 HE2 MET A 433 -10.494 -8.665 -0.004 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.607 -7.819 1.097 1.00 0.00 H new ATOM 855 N PHE A 434 -10.492 -11.950 4.333 1.00 0.00 N ATOM 856 CA PHE A 434 -11.252 -12.553 5.413 1.00 0.00 C ATOM 857 C PHE A 434 -10.463 -13.687 6.064 1.00 0.00 C ATOM 858 O PHE A 434 -10.532 -13.884 7.276 1.00 0.00 O ATOM 859 CB PHE A 434 -12.597 -13.053 4.879 1.00 0.00 C ATOM 860 CG PHE A 434 -13.692 -12.026 4.957 1.00 0.00 C ATOM 861 CD1 PHE A 434 -13.878 -11.275 6.107 1.00 0.00 C ATOM 862 CD2 PHE A 434 -14.536 -11.814 3.879 1.00 0.00 C ATOM 863 CE1 PHE A 434 -14.884 -10.331 6.180 1.00 0.00 C ATOM 864 CE2 PHE A 434 -15.543 -10.870 3.946 1.00 0.00 C ATOM 865 CZ PHE A 434 -15.718 -10.128 5.097 1.00 0.00 C ATOM 0 H PHE A 434 -10.824 -12.199 3.401 1.00 0.00 H new ATOM 0 HA PHE A 434 -11.438 -11.801 6.180 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -12.474 -13.364 3.841 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -12.897 -13.936 5.443 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -13.229 -11.430 6.956 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -14.406 -12.393 2.977 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -15.018 -9.753 7.082 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -16.193 -10.713 3.098 1.00 0.00 H new ATOM 0 HZ PHE A 434 -16.505 -9.390 5.151 1.00 0.00 H new ATOM 875 N GLU A 435 -9.701 -14.416 5.257 1.00 0.00 N ATOM 876 CA GLU A 435 -8.874 -15.510 5.759 1.00 0.00 C ATOM 877 C GLU A 435 -7.506 -14.971 6.163 1.00 0.00 C ATOM 878 O GLU A 435 -6.483 -15.623 5.961 1.00 0.00 O ATOM 879 CB GLU A 435 -8.701 -16.603 4.697 1.00 0.00 C ATOM 880 CG GLU A 435 -10.000 -17.080 4.065 1.00 0.00 C ATOM 881 CD GLU A 435 -10.910 -17.807 5.033 1.00 0.00 C ATOM 882 OE1 GLU A 435 -10.470 -18.813 5.622 1.00 0.00 O ATOM 883 OE2 GLU A 435 -12.075 -17.383 5.179 1.00 0.00 O ATOM 0 H GLU A 435 -9.638 -14.270 4.250 1.00 0.00 H new ATOM 0 HA GLU A 435 -9.372 -15.948 6.624 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -8.046 -16.228 3.911 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -8.198 -17.457 5.151 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -10.531 -16.222 3.653 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -9.768 -17.741 3.230 1.00 0.00 H new ATOM 890 N ASP A 436 -7.507 -13.756 6.699 1.00 0.00 N ATOM 891 CA ASP A 436 -6.287 -13.091 7.142 1.00 0.00 C ATOM 892 C ASP A 436 -6.603 -12.236 8.364 1.00 0.00 C ATOM 893 O ASP A 436 -6.207 -11.071 8.452 1.00 0.00 O ATOM 894 CB ASP A 436 -5.734 -12.212 6.014 1.00 0.00 C ATOM 895 CG ASP A 436 -4.235 -12.006 6.100 1.00 0.00 C ATOM 896 OD1 ASP A 436 -3.767 -11.314 7.030 1.00 0.00 O ATOM 897 OD2 ASP A 436 -3.517 -12.512 5.215 1.00 0.00 O ATOM 0 H ASP A 436 -8.353 -13.204 6.839 1.00 0.00 H new ATOM 0 HA ASP A 436 -5.536 -13.836 7.404 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -5.977 -12.668 5.054 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -6.230 -11.242 6.041 1.00 0.00 H new ATOM 1036 N GLU B 7 9.812 -5.902 -12.947 1.00 0.00 N ATOM 1037 CA GLU B 7 9.203 -4.714 -13.539 1.00 0.00 C ATOM 1038 C GLU B 7 8.820 -3.713 -12.456 1.00 0.00 C ATOM 1039 O GLU B 7 8.561 -4.085 -11.313 1.00 0.00 O ATOM 1040 CB GLU B 7 7.957 -5.066 -14.368 1.00 0.00 C ATOM 1041 CG GLU B 7 7.508 -6.516 -14.262 1.00 0.00 C ATOM 1042 CD GLU B 7 8.416 -7.467 -15.019 1.00 0.00 C ATOM 1043 OE1 GLU B 7 8.382 -7.463 -16.262 1.00 0.00 O ATOM 1044 OE2 GLU B 7 9.173 -8.214 -14.359 1.00 0.00 O ATOM 0 HA GLU B 7 9.945 -4.270 -14.203 1.00 0.00 H new ATOM 0 HB2 GLU B 7 7.135 -4.422 -14.054 1.00 0.00 H new ATOM 0 HB3 GLU B 7 8.158 -4.838 -15.415 1.00 0.00 H new ATOM 0 HG2 GLU B 7 7.478 -6.807 -13.212 1.00 0.00 H new ATOM 0 HG3 GLU B 7 6.492 -6.607 -14.647 1.00 0.00 H new ATOM 1051 N VAL B 8 8.780 -2.442 -12.820 1.00 0.00 N ATOM 1052 CA VAL B 8 8.431 -1.398 -11.877 1.00 0.00 C ATOM 1053 C VAL B 8 7.136 -0.716 -12.277 1.00 0.00 C ATOM 1054 O VAL B 8 6.917 -0.394 -13.443 1.00 0.00 O ATOM 1055 CB VAL B 8 9.578 -0.393 -11.708 1.00 0.00 C ATOM 1056 CG1 VAL B 8 9.075 1.000 -11.352 1.00 0.00 C ATOM 1057 CG2 VAL B 8 10.481 -0.926 -10.624 1.00 0.00 C ATOM 0 H VAL B 8 8.985 -2.110 -13.762 1.00 0.00 H new ATOM 0 HA VAL B 8 8.268 -1.863 -10.905 1.00 0.00 H new ATOM 0 HB VAL B 8 10.114 -0.288 -12.651 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.923 1.676 -11.243 1.00 0.00 H new ATOM 0 HG12 VAL B 8 8.420 1.364 -12.144 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.521 0.958 -10.414 1.00 0.00 H new ATOM 0 HG21 VAL B 8 11.313 -0.238 -10.472 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.917 -1.024 -9.696 1.00 0.00 H new ATOM 0 HG23 VAL B 8 10.867 -1.902 -10.919 1.00 0.00 H new ATOM 1067 N LEU B 9 6.282 -0.525 -11.289 1.00 0.00 N ATOM 1068 CA LEU B 9 4.988 0.094 -11.488 1.00 0.00 C ATOM 1069 C LEU B 9 5.107 1.599 -11.392 1.00 0.00 C ATOM 1070 O LEU B 9 4.593 2.334 -12.233 1.00 0.00 O ATOM 1071 CB LEU B 9 4.012 -0.379 -10.411 1.00 0.00 C ATOM 1072 CG LEU B 9 4.266 -1.776 -9.860 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.726 -1.895 -8.451 1.00 0.00 C ATOM 1074 CD2 LEU B 9 3.636 -2.819 -10.751 1.00 0.00 C ATOM 0 H LEU B 9 6.468 -0.796 -10.323 1.00 0.00 H new ATOM 0 HA LEU B 9 4.624 -0.188 -12.476 1.00 0.00 H new ATOM 0 HB2 LEU B 9 4.041 0.329 -9.583 1.00 0.00 H new ATOM 0 HB3 LEU B 9 3.003 -0.348 -10.822 1.00 0.00 H new ATOM 0 HG LEU B 9 5.343 -1.945 -9.836 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.916 -2.899 -8.072 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.220 -1.166 -7.809 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.653 -1.706 -8.456 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.828 -3.811 -10.342 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.560 -2.650 -10.805 1.00 0.00 H new ATOM 0 HD23 LEU B 9 4.064 -2.750 -11.751 1.00 0.00 H new ATOM 1086 N LEU B 10 5.792 2.052 -10.356 1.00 0.00 N ATOM 1087 CA LEU B 10 5.940 3.473 -10.123 1.00 0.00 C ATOM 1088 C LEU B 10 7.310 3.819 -9.557 1.00 0.00 C ATOM 1089 O LEU B 10 7.868 3.080 -8.743 1.00 0.00 O ATOM 1090 CB LEU B 10 4.856 3.917 -9.157 1.00 0.00 C ATOM 1091 CG LEU B 10 4.468 5.389 -9.229 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.751 5.692 -10.536 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.597 5.751 -8.039 1.00 0.00 C ATOM 0 H LEU B 10 6.252 1.457 -9.667 1.00 0.00 H new ATOM 0 HA LEU B 10 5.846 3.993 -11.076 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.965 3.316 -9.339 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.187 3.697 -8.142 1.00 0.00 H new ATOM 0 HG LEU B 10 5.374 5.994 -9.197 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.483 6.748 -10.567 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.408 5.460 -11.374 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.848 5.086 -10.604 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.323 6.804 -8.096 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.694 5.140 -8.049 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.148 5.569 -7.116 1.00 0.00 H new ATOM 1105 N ILE B 11 7.837 4.946 -10.003 1.00 0.00 N ATOM 1106 CA ILE B 11 9.124 5.449 -9.552 1.00 0.00 C ATOM 1107 C ILE B 11 8.922 6.836 -8.968 1.00 0.00 C ATOM 1108 O ILE B 11 8.752 7.802 -9.710 1.00 0.00 O ATOM 1109 CB ILE B 11 10.141 5.534 -10.714 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.468 4.138 -11.244 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.409 6.252 -10.272 1.00 0.00 C ATOM 1112 CD1 ILE B 11 11.333 4.146 -12.485 1.00 0.00 C ATOM 0 H ILE B 11 7.381 5.543 -10.693 1.00 0.00 H new ATOM 0 HA ILE B 11 9.522 4.762 -8.805 1.00 0.00 H new ATOM 0 HB ILE B 11 9.689 6.111 -11.521 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.975 3.572 -10.462 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.537 3.615 -11.464 1.00 0.00 H new ATOM 0 HG21 ILE B 11 12.110 6.300 -11.106 1.00 0.00 H new ATOM 0 HG22 ILE B 11 11.161 7.263 -9.948 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.866 5.708 -9.445 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.523 3.121 -12.803 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.820 4.684 -13.283 1.00 0.00 H new ATOM 0 HD13 ILE B 11 12.280 4.639 -12.265 1.00 0.00 H new ATOM 1124 N VAL B 12 8.920 6.948 -7.651 1.00 0.00 N ATOM 1125 CA VAL B 12 8.706 8.233 -7.035 1.00 0.00 C ATOM 1126 C VAL B 12 9.995 8.777 -6.464 1.00 0.00 C ATOM 1127 O VAL B 12 10.721 8.079 -5.768 1.00 0.00 O ATOM 1128 CB VAL B 12 7.656 8.145 -5.919 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.088 9.518 -5.611 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.554 7.179 -6.306 1.00 0.00 C ATOM 0 H VAL B 12 9.062 6.174 -7.002 1.00 0.00 H new ATOM 0 HA VAL B 12 8.343 8.907 -7.811 1.00 0.00 H new ATOM 0 HB VAL B 12 8.139 7.769 -5.017 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.345 9.435 -4.817 1.00 0.00 H new ATOM 0 HG12 VAL B 12 7.891 10.180 -5.288 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.619 9.927 -6.506 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.817 7.128 -5.504 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.072 7.525 -7.220 1.00 0.00 H new ATOM 0 HG23 VAL B 12 6.979 6.189 -6.472 1.00 0.00 H new ATOM 1140 N LYS B 13 10.287 10.014 -6.785 1.00 0.00 N ATOM 1141 CA LYS B 13 11.475 10.666 -6.279 1.00 0.00 C ATOM 1142 C LYS B 13 11.065 11.645 -5.200 1.00 0.00 C ATOM 1143 O LYS B 13 9.872 11.877 -5.007 1.00 0.00 O ATOM 1144 CB LYS B 13 12.251 11.372 -7.387 1.00 0.00 C ATOM 1145 CG LYS B 13 12.716 10.443 -8.492 1.00 0.00 C ATOM 1146 CD LYS B 13 13.510 9.262 -7.951 1.00 0.00 C ATOM 1147 CE LYS B 13 14.599 8.820 -8.920 1.00 0.00 C ATOM 1148 NZ LYS B 13 15.476 7.765 -8.335 1.00 0.00 N ATOM 0 H LYS B 13 9.715 10.595 -7.398 1.00 0.00 H new ATOM 0 HA LYS B 13 12.143 9.912 -5.863 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.623 12.151 -7.819 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.119 11.868 -6.952 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.851 10.075 -9.044 1.00 0.00 H new ATOM 0 HG3 LYS B 13 13.332 11.000 -9.198 1.00 0.00 H new ATOM 0 HD2 LYS B 13 13.961 9.534 -6.997 1.00 0.00 H new ATOM 0 HD3 LYS B 13 12.835 8.428 -7.758 1.00 0.00 H new ATOM 0 HE2 LYS B 13 14.139 8.443 -9.834 1.00 0.00 H new ATOM 0 HE3 LYS B 13 15.206 9.681 -9.200 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 16.192 7.482 -9.034 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 15.949 8.137 -7.487 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 14.900 6.939 -8.076 1.00 0.00 H new ATOM 1162 N LYS B 14 12.044 12.192 -4.492 1.00 0.00 N ATOM 1163 CA LYS B 14 11.793 13.134 -3.407 1.00 0.00 C ATOM 1164 C LYS B 14 11.156 12.413 -2.224 1.00 0.00 C ATOM 1165 O LYS B 14 10.623 13.037 -1.307 1.00 0.00 O ATOM 1166 CB LYS B 14 10.884 14.240 -3.908 1.00 0.00 C ATOM 1167 CG LYS B 14 11.586 15.317 -4.714 1.00 0.00 C ATOM 1168 CD LYS B 14 10.716 15.824 -5.862 1.00 0.00 C ATOM 1169 CE LYS B 14 10.264 14.704 -6.802 1.00 0.00 C ATOM 1170 NZ LYS B 14 8.997 14.054 -6.353 1.00 0.00 N ATOM 0 H LYS B 14 13.032 11.997 -4.652 1.00 0.00 H new ATOM 0 HA LYS B 14 12.736 13.568 -3.074 1.00 0.00 H new ATOM 0 HB2 LYS B 14 10.100 13.798 -4.522 1.00 0.00 H new ATOM 0 HB3 LYS B 14 10.394 14.706 -3.053 1.00 0.00 H new ATOM 0 HG2 LYS B 14 11.846 16.149 -4.060 1.00 0.00 H new ATOM 0 HG3 LYS B 14 12.520 14.922 -5.113 1.00 0.00 H new ATOM 0 HD2 LYS B 14 9.839 16.325 -5.453 1.00 0.00 H new ATOM 0 HD3 LYS B 14 11.272 16.568 -6.432 1.00 0.00 H new ATOM 0 HE2 LYS B 14 10.125 15.110 -7.804 1.00 0.00 H new ATOM 0 HE3 LYS B 14 11.050 13.952 -6.869 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 9.185 13.062 -6.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 8.624 14.557 -5.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 8.297 14.090 -7.122 1.00 0.00 H new ATOM 1184 N VAL B 15 11.206 11.090 -2.271 1.00 0.00 N ATOM 1185 CA VAL B 15 10.647 10.258 -1.217 1.00 0.00 C ATOM 1186 C VAL B 15 11.672 10.108 -0.103 1.00 0.00 C ATOM 1187 O VAL B 15 12.636 9.365 -0.229 1.00 0.00 O ATOM 1188 CB VAL B 15 10.233 8.876 -1.768 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.468 8.070 -0.740 1.00 0.00 C ATOM 1190 CG2 VAL B 15 9.389 9.049 -3.012 1.00 0.00 C ATOM 0 H VAL B 15 11.632 10.566 -3.035 1.00 0.00 H new ATOM 0 HA VAL B 15 9.751 10.736 -0.821 1.00 0.00 H new ATOM 0 HB VAL B 15 11.144 8.330 -2.013 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.194 7.104 -1.165 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.093 7.915 0.140 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.565 8.609 -0.453 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.101 8.070 -3.395 1.00 0.00 H new ATOM 0 HG22 VAL B 15 8.494 9.621 -2.768 1.00 0.00 H new ATOM 0 HG23 VAL B 15 9.964 9.581 -3.771 1.00 0.00 H new ATOM 1200 N ARG B 16 11.462 10.833 0.976 1.00 0.00 N ATOM 1201 CA ARG B 16 12.382 10.838 2.102 1.00 0.00 C ATOM 1202 C ARG B 16 11.932 9.891 3.215 1.00 0.00 C ATOM 1203 O ARG B 16 10.975 10.171 3.920 1.00 0.00 O ATOM 1204 CB ARG B 16 12.491 12.269 2.648 1.00 0.00 C ATOM 1205 CG ARG B 16 12.478 13.333 1.556 1.00 0.00 C ATOM 1206 CD ARG B 16 12.658 14.733 2.118 1.00 0.00 C ATOM 1207 NE ARG B 16 14.057 15.025 2.436 1.00 0.00 N ATOM 1208 CZ ARG B 16 14.458 15.695 3.514 1.00 0.00 C ATOM 1209 NH1 ARG B 16 13.573 16.149 4.391 1.00 0.00 N ATOM 1210 NH2 ARG B 16 15.750 15.911 3.710 1.00 0.00 N ATOM 0 H ARG B 16 10.649 11.437 1.100 1.00 0.00 H new ATOM 0 HA ARG B 16 13.353 10.487 1.751 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.665 12.453 3.335 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.411 12.361 3.225 1.00 0.00 H new ATOM 0 HG2 ARG B 16 13.273 13.126 0.839 1.00 0.00 H new ATOM 0 HG3 ARG B 16 11.536 13.280 1.011 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.291 15.463 1.396 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.052 14.842 3.017 1.00 0.00 H new ATOM 0 HE ARG B 16 14.772 14.693 1.789 1.00 0.00 H new ATOM 0 HH11 ARG B 16 12.577 15.986 4.242 1.00 0.00 H new ATOM 0 HH12 ARG B 16 13.888 16.662 5.215 1.00 0.00 H new ATOM 0 HH21 ARG B 16 16.433 15.564 3.036 1.00 0.00 H new ATOM 0 HH22 ARG B 16 16.062 16.424 4.535 1.00 0.00 H new ATOM 1224 N GLN B 17 12.624 8.774 3.379 1.00 0.00 N ATOM 1225 CA GLN B 17 12.275 7.830 4.436 1.00 0.00 C ATOM 1226 C GLN B 17 12.883 8.315 5.741 1.00 0.00 C ATOM 1227 O GLN B 17 14.097 8.341 5.882 1.00 0.00 O ATOM 1228 CB GLN B 17 12.774 6.415 4.114 1.00 0.00 C ATOM 1229 CG GLN B 17 12.175 5.343 5.016 1.00 0.00 C ATOM 1230 CD GLN B 17 13.145 4.821 6.062 1.00 0.00 C ATOM 1231 OE1 GLN B 17 14.093 5.499 6.447 1.00 0.00 O ATOM 1232 NE2 GLN B 17 12.906 3.608 6.540 1.00 0.00 N ATOM 0 H GLN B 17 13.420 8.499 2.804 1.00 0.00 H new ATOM 0 HA GLN B 17 11.189 7.781 4.520 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.536 6.181 3.076 1.00 0.00 H new ATOM 0 HB3 GLN B 17 13.860 6.391 4.205 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.297 5.750 5.517 1.00 0.00 H new ATOM 0 HG3 GLN B 17 11.834 4.511 4.401 1.00 0.00 H new ATOM 0 HE21 GLN B 17 12.108 3.073 6.197 1.00 0.00 H new ATOM 0 HE22 GLN B 17 13.520 3.210 7.251 1.00 0.00 H new ATOM 1241 N LYS B 18 12.040 8.725 6.679 1.00 0.00 N ATOM 1242 CA LYS B 18 12.511 9.244 7.960 1.00 0.00 C ATOM 1243 C LYS B 18 13.398 10.468 7.717 1.00 0.00 C ATOM 1244 O LYS B 18 14.419 10.666 8.376 1.00 0.00 O ATOM 1245 CB LYS B 18 13.250 8.163 8.768 1.00 0.00 C ATOM 1246 CG LYS B 18 13.494 8.542 10.227 1.00 0.00 C ATOM 1247 CD LYS B 18 12.227 9.054 10.898 1.00 0.00 C ATOM 1248 CE LYS B 18 12.541 10.065 11.992 1.00 0.00 C ATOM 1249 NZ LYS B 18 12.264 9.519 13.353 1.00 0.00 N ATOM 0 H LYS B 18 11.025 8.709 6.579 1.00 0.00 H new ATOM 0 HA LYS B 18 11.650 9.546 8.557 1.00 0.00 H new ATOM 0 HB2 LYS B 18 12.672 7.239 8.734 1.00 0.00 H new ATOM 0 HB3 LYS B 18 14.208 7.958 8.291 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.868 7.674 10.770 1.00 0.00 H new ATOM 0 HG3 LYS B 18 14.268 9.308 10.279 1.00 0.00 H new ATOM 0 HD2 LYS B 18 11.580 9.514 10.151 1.00 0.00 H new ATOM 0 HD3 LYS B 18 11.676 8.216 11.324 1.00 0.00 H new ATOM 0 HE2 LYS B 18 13.589 10.358 11.925 1.00 0.00 H new ATOM 0 HE3 LYS B 18 11.947 10.966 11.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 11.928 10.284 13.972 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 11.535 8.780 13.289 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 13.136 9.112 13.748 1.00 0.00 H new ATOM 1263 N LYS B 19 12.987 11.258 6.724 1.00 0.00 N ATOM 1264 CA LYS B 19 13.650 12.506 6.341 1.00 0.00 C ATOM 1265 C LYS B 19 14.894 12.336 5.451 1.00 0.00 C ATOM 1266 O LYS B 19 15.590 13.315 5.201 1.00 0.00 O ATOM 1267 CB LYS B 19 13.972 13.355 7.573 1.00 0.00 C ATOM 1268 CG LYS B 19 12.742 14.019 8.168 1.00 0.00 C ATOM 1269 CD LYS B 19 13.033 14.666 9.509 1.00 0.00 C ATOM 1270 CE LYS B 19 11.785 15.318 10.078 1.00 0.00 C ATOM 1271 NZ LYS B 19 11.981 15.782 11.473 1.00 0.00 N ATOM 0 H LYS B 19 12.169 11.045 6.153 1.00 0.00 H new ATOM 0 HA LYS B 19 12.926 13.028 5.716 1.00 0.00 H new ATOM 0 HB2 LYS B 19 14.442 12.726 8.329 1.00 0.00 H new ATOM 0 HB3 LYS B 19 14.697 14.122 7.301 1.00 0.00 H new ATOM 0 HG2 LYS B 19 12.368 14.773 7.476 1.00 0.00 H new ATOM 0 HG3 LYS B 19 11.953 13.277 8.288 1.00 0.00 H new ATOM 0 HD2 LYS B 19 13.406 13.916 10.206 1.00 0.00 H new ATOM 0 HD3 LYS B 19 13.818 15.413 9.394 1.00 0.00 H new ATOM 0 HE2 LYS B 19 11.502 16.164 9.452 1.00 0.00 H new ATOM 0 HE3 LYS B 19 10.959 14.607 10.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 11.104 16.220 11.820 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 12.226 14.972 12.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 12.751 16.480 11.502 1.00 0.00 H new ATOM 1285 N GLN B 20 15.199 11.129 4.967 1.00 0.00 N ATOM 1286 CA GLN B 20 16.337 10.983 4.060 1.00 0.00 C ATOM 1287 C GLN B 20 15.802 10.925 2.631 1.00 0.00 C ATOM 1288 O GLN B 20 15.169 9.948 2.229 1.00 0.00 O ATOM 1289 CB GLN B 20 17.211 9.761 4.395 1.00 0.00 C ATOM 1290 CG GLN B 20 16.484 8.430 4.374 1.00 0.00 C ATOM 1291 CD GLN B 20 17.378 7.264 4.748 1.00 0.00 C ATOM 1292 OE1 GLN B 20 18.562 7.239 4.419 1.00 0.00 O ATOM 1293 NE2 GLN B 20 16.815 6.291 5.450 1.00 0.00 N ATOM 0 H GLN B 20 14.694 10.268 5.178 1.00 0.00 H new ATOM 0 HA GLN B 20 16.996 11.843 4.175 1.00 0.00 H new ATOM 0 HB2 GLN B 20 18.037 9.718 3.685 1.00 0.00 H new ATOM 0 HB3 GLN B 20 17.647 9.905 5.384 1.00 0.00 H new ATOM 0 HG2 GLN B 20 15.641 8.471 5.064 1.00 0.00 H new ATOM 0 HG3 GLN B 20 16.073 8.262 3.379 1.00 0.00 H new ATOM 0 HE21 GLN B 20 15.829 6.350 5.703 1.00 0.00 H new ATOM 0 HE22 GLN B 20 17.368 5.484 5.737 1.00 0.00 H new ATOM 1302 N ASP B 21 16.016 12.001 1.887 1.00 0.00 N ATOM 1303 CA ASP B 21 15.516 12.116 0.517 1.00 0.00 C ATOM 1304 C ASP B 21 16.063 11.049 -0.421 1.00 0.00 C ATOM 1305 O ASP B 21 17.263 10.952 -0.673 1.00 0.00 O ATOM 1306 CB ASP B 21 15.782 13.510 -0.058 1.00 0.00 C ATOM 1307 CG ASP B 21 17.021 14.166 0.516 1.00 0.00 C ATOM 1308 OD1 ASP B 21 16.954 14.627 1.679 1.00 0.00 O ATOM 1309 OD2 ASP B 21 18.043 14.230 -0.187 1.00 0.00 O ATOM 0 H ASP B 21 16.537 12.816 2.210 1.00 0.00 H new ATOM 0 HA ASP B 21 14.440 11.955 0.585 1.00 0.00 H new ATOM 0 HB2 ASP B 21 15.887 13.436 -1.140 1.00 0.00 H new ATOM 0 HB3 ASP B 21 14.919 14.147 0.136 1.00 0.00 H new ATOM 1314 N GLY B 22 15.147 10.243 -0.926 1.00 0.00 N ATOM 1315 CA GLY B 22 15.477 9.203 -1.849 1.00 0.00 C ATOM 1316 C GLY B 22 14.401 9.000 -2.892 1.00 0.00 C ATOM 1317 O GLY B 22 13.834 9.961 -3.423 1.00 0.00 O ATOM 0 H GLY B 22 14.154 10.301 -0.699 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.418 9.444 -2.343 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.632 8.272 -1.304 1.00 0.00 H new ATOM 1321 N ALA B 23 14.109 7.746 -3.165 1.00 0.00 N ATOM 1322 CA ALA B 23 13.126 7.377 -4.153 1.00 0.00 C ATOM 1323 C ALA B 23 12.371 6.134 -3.733 1.00 0.00 C ATOM 1324 O ALA B 23 12.964 5.172 -3.244 1.00 0.00 O ATOM 1325 CB ALA B 23 13.813 7.122 -5.473 1.00 0.00 C ATOM 0 H ALA B 23 14.551 6.951 -2.703 1.00 0.00 H new ATOM 0 HA ALA B 23 12.414 8.196 -4.252 1.00 0.00 H new ATOM 0 HB1 ALA B 23 13.071 6.843 -6.221 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.330 8.026 -5.795 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.534 6.313 -5.358 1.00 0.00 H new ATOM 1331 N LEU B 24 11.071 6.147 -3.947 1.00 0.00 N ATOM 1332 CA LEU B 24 10.239 5.021 -3.596 1.00 0.00 C ATOM 1333 C LEU B 24 9.864 4.288 -4.882 1.00 0.00 C ATOM 1334 O LEU B 24 9.158 4.829 -5.734 1.00 0.00 O ATOM 1335 CB LEU B 24 8.989 5.501 -2.859 1.00 0.00 C ATOM 1336 CG LEU B 24 8.449 4.539 -1.800 1.00 0.00 C ATOM 1337 CD1 LEU B 24 6.977 4.793 -1.539 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.682 3.099 -2.199 1.00 0.00 C ATOM 0 H LEU B 24 10.569 6.930 -4.365 1.00 0.00 H new ATOM 0 HA LEU B 24 10.776 4.344 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.212 6.455 -2.381 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.204 5.688 -3.592 1.00 0.00 H new ATOM 0 HG LEU B 24 8.996 4.723 -0.875 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.616 4.096 -0.782 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.841 5.815 -1.186 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.414 4.650 -2.461 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.287 2.439 -1.426 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.176 2.896 -3.143 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.751 2.922 -2.316 1.00 0.00 H new ATOM 1350 N TYR B 25 10.361 3.074 -5.028 1.00 0.00 N ATOM 1351 CA TYR B 25 10.106 2.281 -6.221 1.00 0.00 C ATOM 1352 C TYR B 25 9.113 1.154 -5.961 1.00 0.00 C ATOM 1353 O TYR B 25 9.359 0.286 -5.121 1.00 0.00 O ATOM 1354 CB TYR B 25 11.405 1.647 -6.720 1.00 0.00 C ATOM 1355 CG TYR B 25 12.263 2.544 -7.570 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.676 3.782 -7.110 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.670 2.138 -8.831 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.472 4.596 -7.884 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.466 2.944 -9.615 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.866 4.177 -9.137 1.00 0.00 C ATOM 1361 OH TYR B 25 14.663 4.994 -9.910 1.00 0.00 O ATOM 0 H TYR B 25 10.947 2.612 -4.333 1.00 0.00 H new ATOM 0 HA TYR B 25 9.689 2.962 -6.963 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.988 1.322 -5.858 1.00 0.00 H new ATOM 0 HB3 TYR B 25 11.159 0.754 -7.294 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.369 4.115 -6.129 1.00 0.00 H new ATOM 0 HD2 TYR B 25 12.358 1.174 -9.205 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.787 5.559 -7.511 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.775 2.614 -10.596 1.00 0.00 H new ATOM 0 HH TYR B 25 14.853 4.553 -10.764 1.00 0.00 H new ATOM 1371 N LEU B 26 7.998 1.156 -6.673 1.00 0.00 N ATOM 1372 CA LEU B 26 7.041 0.071 -6.536 1.00 0.00 C ATOM 1373 C LEU B 26 7.314 -0.922 -7.627 1.00 0.00 C ATOM 1374 O LEU B 26 7.122 -0.608 -8.803 1.00 0.00 O ATOM 1375 CB LEU B 26 5.582 0.495 -6.689 1.00 0.00 C ATOM 1376 CG LEU B 26 5.189 1.808 -6.068 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.770 2.156 -6.481 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.281 1.744 -4.561 1.00 0.00 C ATOM 0 H LEU B 26 7.736 1.882 -7.340 1.00 0.00 H new ATOM 0 HA LEU B 26 7.167 -0.325 -5.528 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.351 0.540 -7.753 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.954 -0.286 -6.259 1.00 0.00 H new ATOM 0 HG LEU B 26 5.876 2.578 -6.419 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.483 3.107 -6.032 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.716 2.236 -7.567 1.00 0.00 H new ATOM 0 HD13 LEU B 26 3.090 1.375 -6.141 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.992 2.706 -4.138 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.613 0.968 -4.188 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.305 1.512 -4.269 1.00 0.00 H new ATOM 1390 N MET B 27 7.782 -2.090 -7.264 1.00 0.00 N ATOM 1391 CA MET B 27 8.035 -3.109 -8.247 1.00 0.00 C ATOM 1392 C MET B 27 6.819 -3.984 -8.361 1.00 0.00 C ATOM 1393 O MET B 27 5.942 -3.944 -7.497 1.00 0.00 O ATOM 1394 CB MET B 27 9.267 -3.955 -7.918 1.00 0.00 C ATOM 1395 CG MET B 27 10.564 -3.433 -8.506 1.00 0.00 C ATOM 1396 SD MET B 27 11.899 -3.359 -7.300 1.00 0.00 S ATOM 1397 CE MET B 27 11.499 -1.824 -6.476 1.00 0.00 C ATOM 0 H MET B 27 7.994 -2.356 -6.302 1.00 0.00 H new ATOM 0 HA MET B 27 8.243 -2.616 -9.197 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.372 -4.015 -6.835 1.00 0.00 H new ATOM 0 HB3 MET B 27 9.102 -4.970 -8.279 1.00 0.00 H new ATOM 0 HG2 MET B 27 10.865 -4.073 -9.335 1.00 0.00 H new ATOM 0 HG3 MET B 27 10.396 -2.437 -8.917 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.387 -1.193 -6.431 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.715 -1.307 -7.030 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.151 -2.034 -5.465 1.00 0.00 H new ATOM 1407 N ALA B 28 6.804 -4.786 -9.407 1.00 0.00 N ATOM 1408 CA ALA B 28 5.688 -5.651 -9.719 1.00 0.00 C ATOM 1409 C ALA B 28 5.051 -6.313 -8.490 1.00 0.00 C ATOM 1410 O ALA B 28 3.837 -6.239 -8.301 1.00 0.00 O ATOM 1411 CB ALA B 28 6.105 -6.705 -10.724 1.00 0.00 C ATOM 0 H ALA B 28 7.576 -4.855 -10.070 1.00 0.00 H new ATOM 0 HA ALA B 28 4.920 -5.008 -10.148 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.255 -7.349 -10.950 1.00 0.00 H new ATOM 0 HB2 ALA B 28 6.446 -6.221 -11.639 1.00 0.00 H new ATOM 0 HB3 ALA B 28 6.914 -7.305 -10.308 1.00 0.00 H new ATOM 1417 N GLU B 29 5.867 -6.956 -7.662 1.00 0.00 N ATOM 1418 CA GLU B 29 5.364 -7.634 -6.471 1.00 0.00 C ATOM 1419 C GLU B 29 6.145 -7.241 -5.218 1.00 0.00 C ATOM 1420 O GLU B 29 5.988 -7.859 -4.158 1.00 0.00 O ATOM 1421 CB GLU B 29 5.433 -9.158 -6.657 1.00 0.00 C ATOM 1422 CG GLU B 29 6.498 -9.626 -7.647 1.00 0.00 C ATOM 1423 CD GLU B 29 7.914 -9.301 -7.202 1.00 0.00 C ATOM 1424 OE1 GLU B 29 8.270 -8.107 -7.174 1.00 0.00 O ATOM 1425 OE2 GLU B 29 8.678 -10.237 -6.892 1.00 0.00 O ATOM 0 H GLU B 29 6.876 -7.022 -7.792 1.00 0.00 H new ATOM 0 HA GLU B 29 4.328 -7.323 -6.337 1.00 0.00 H new ATOM 0 HB2 GLU B 29 5.625 -9.621 -5.689 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.460 -9.515 -6.994 1.00 0.00 H new ATOM 0 HG2 GLU B 29 6.406 -10.703 -7.787 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.313 -9.162 -8.616 1.00 0.00 H new ATOM 1432 N ARG B 30 6.954 -6.195 -5.313 1.00 0.00 N ATOM 1433 CA ARG B 30 7.756 -5.779 -4.173 1.00 0.00 C ATOM 1434 C ARG B 30 7.905 -4.272 -4.144 1.00 0.00 C ATOM 1435 O ARG B 30 7.746 -3.608 -5.155 1.00 0.00 O ATOM 1436 CB ARG B 30 9.136 -6.446 -4.220 1.00 0.00 C ATOM 1437 CG ARG B 30 10.086 -5.834 -5.239 1.00 0.00 C ATOM 1438 CD ARG B 30 11.256 -6.755 -5.548 1.00 0.00 C ATOM 1439 NE ARG B 30 10.847 -7.901 -6.354 1.00 0.00 N ATOM 1440 CZ ARG B 30 11.569 -8.427 -7.339 1.00 0.00 C ATOM 1441 NH1 ARG B 30 12.734 -7.890 -7.684 1.00 0.00 N ATOM 1442 NH2 ARG B 30 11.114 -9.486 -7.990 1.00 0.00 N ATOM 0 H ARG B 30 7.071 -5.628 -6.153 1.00 0.00 H new ATOM 0 HA ARG B 30 7.245 -6.093 -3.263 1.00 0.00 H new ATOM 0 HB2 ARG B 30 9.591 -6.385 -3.232 1.00 0.00 H new ATOM 0 HB3 ARG B 30 9.009 -7.504 -4.447 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.542 -5.617 -6.158 1.00 0.00 H new ATOM 0 HG3 ARG B 30 10.462 -4.884 -4.860 1.00 0.00 H new ATOM 0 HD2 ARG B 30 12.028 -6.196 -6.077 1.00 0.00 H new ATOM 0 HD3 ARG B 30 11.698 -7.106 -4.616 1.00 0.00 H new ATOM 0 HE ARG B 30 9.944 -8.328 -6.147 1.00 0.00 H new ATOM 0 HH11 ARG B 30 13.082 -7.067 -7.192 1.00 0.00 H new ATOM 0 HH12 ARG B 30 13.281 -8.301 -8.441 1.00 0.00 H new ATOM 0 HH21 ARG B 30 10.214 -9.894 -7.735 1.00 0.00 H new ATOM 0 HH22 ARG B 30 11.663 -9.894 -8.747 1.00 0.00 H new ATOM 1456 N ILE B 31 8.198 -3.734 -2.982 1.00 0.00 N ATOM 1457 CA ILE B 31 8.380 -2.307 -2.842 1.00 0.00 C ATOM 1458 C ILE B 31 9.755 -2.026 -2.259 1.00 0.00 C ATOM 1459 O ILE B 31 10.081 -2.462 -1.153 1.00 0.00 O ATOM 1460 CB ILE B 31 7.272 -1.665 -1.976 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.615 -0.211 -1.652 1.00 0.00 C ATOM 1462 CG2 ILE B 31 7.048 -2.466 -0.701 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.423 0.611 -1.219 1.00 0.00 C ATOM 0 H ILE B 31 8.316 -4.264 -2.119 1.00 0.00 H new ATOM 0 HA ILE B 31 8.307 -1.855 -3.831 1.00 0.00 H new ATOM 0 HB ILE B 31 6.344 -1.676 -2.548 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.366 -0.191 -0.862 1.00 0.00 H new ATOM 0 HG13 ILE B 31 8.065 0.252 -2.530 1.00 0.00 H new ATOM 0 HG21 ILE B 31 6.264 -1.995 -0.108 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.748 -3.482 -0.958 1.00 0.00 H new ATOM 0 HG23 ILE B 31 7.972 -2.496 -0.123 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.743 1.631 -1.006 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.680 0.623 -2.016 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.986 0.173 -0.322 1.00 0.00 H new ATOM 1475 N ALA B 32 10.573 -1.334 -3.024 1.00 0.00 N ATOM 1476 CA ALA B 32 11.919 -1.016 -2.581 1.00 0.00 C ATOM 1477 C ALA B 32 12.212 0.472 -2.704 1.00 0.00 C ATOM 1478 O ALA B 32 11.858 1.114 -3.687 1.00 0.00 O ATOM 1479 CB ALA B 32 12.938 -1.835 -3.353 1.00 0.00 C ATOM 0 H ALA B 32 10.334 -0.982 -3.951 1.00 0.00 H new ATOM 0 HA ALA B 32 11.994 -1.275 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA B 32 13.942 -1.585 -3.009 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.752 -2.896 -3.188 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.853 -1.613 -4.417 1.00 0.00 H new ATOM 1485 N TRP B 33 12.854 1.008 -1.685 1.00 0.00 N ATOM 1486 CA TRP B 33 13.206 2.412 -1.634 1.00 0.00 C ATOM 1487 C TRP B 33 14.719 2.579 -1.523 1.00 0.00 C ATOM 1488 O TRP B 33 15.396 1.767 -0.886 1.00 0.00 O ATOM 1489 CB TRP B 33 12.501 3.034 -0.420 1.00 0.00 C ATOM 1490 CG TRP B 33 12.827 4.479 -0.137 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.006 5.553 -0.312 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.053 5.006 0.391 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.649 6.705 0.069 1.00 0.00 N ATOM 1494 CE2 TRP B 33 13.902 6.394 0.503 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.264 4.436 0.774 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 14.912 7.218 0.984 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.268 5.246 1.242 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.088 6.632 1.347 1.00 0.00 C ATOM 0 H TRP B 33 13.148 0.478 -0.864 1.00 0.00 H new ATOM 0 HA TRP B 33 12.887 2.914 -2.548 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.424 2.946 -0.565 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.752 2.446 0.462 1.00 0.00 H new ATOM 0 HD1 TRP B 33 10.997 5.505 -0.694 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.252 7.644 0.033 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.412 3.368 0.704 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 14.770 8.285 1.067 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.211 4.809 1.534 1.00 0.00 H new ATOM 0 HH2 TRP B 33 16.894 7.246 1.722 1.00 0.00 H new ATOM 1509 N ALA B 34 15.238 3.632 -2.142 1.00 0.00 N ATOM 1510 CA ALA B 34 16.659 3.961 -2.088 1.00 0.00 C ATOM 1511 C ALA B 34 16.822 5.468 -2.233 1.00 0.00 C ATOM 1512 O ALA B 34 16.012 6.094 -2.898 1.00 0.00 O ATOM 1513 CB ALA B 34 17.426 3.240 -3.164 1.00 0.00 C ATOM 0 H ALA B 34 14.685 4.284 -2.697 1.00 0.00 H new ATOM 0 HA ALA B 34 17.063 3.638 -1.129 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.481 3.505 -3.098 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.313 2.164 -3.032 1.00 0.00 H new ATOM 0 HB3 ALA B 34 17.040 3.528 -4.142 1.00 0.00 H new ATOM 1519 N PRO B 35 17.856 6.074 -1.630 1.00 0.00 N ATOM 1520 CA PRO B 35 18.059 7.529 -1.695 1.00 0.00 C ATOM 1521 C PRO B 35 18.359 8.028 -3.114 1.00 0.00 C ATOM 1522 O PRO B 35 18.785 7.253 -3.976 1.00 0.00 O ATOM 1523 CB PRO B 35 19.265 7.779 -0.778 1.00 0.00 C ATOM 1524 CG PRO B 35 19.451 6.518 0.000 1.00 0.00 C ATOM 1525 CD PRO B 35 18.917 5.409 -0.860 1.00 0.00 C ATOM 0 HA PRO B 35 17.159 8.064 -1.392 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.156 8.015 -1.359 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.084 8.625 -0.115 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.503 6.357 0.233 1.00 0.00 H new ATOM 0 HG3 PRO B 35 18.918 6.565 0.950 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.688 4.994 -1.509 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.527 4.586 -0.262 1.00 0.00 H new ATOM 1533 N GLU B 36 18.142 9.340 -3.309 1.00 0.00 N ATOM 1534 CA GLU B 36 18.346 10.047 -4.587 1.00 0.00 C ATOM 1535 C GLU B 36 18.094 9.169 -5.821 1.00 0.00 C ATOM 1536 O GLU B 36 16.944 8.967 -6.237 1.00 0.00 O ATOM 1537 CB GLU B 36 19.743 10.691 -4.657 1.00 0.00 C ATOM 1538 CG GLU B 36 20.730 10.199 -3.606 1.00 0.00 C ATOM 1539 CD GLU B 36 21.596 9.060 -4.104 1.00 0.00 C ATOM 1540 OE1 GLU B 36 21.613 8.805 -5.328 1.00 0.00 O ATOM 1541 OE2 GLU B 36 22.271 8.408 -3.280 1.00 0.00 O ATOM 0 H GLU B 36 17.812 9.954 -2.565 1.00 0.00 H new ATOM 0 HA GLU B 36 17.593 10.835 -4.609 1.00 0.00 H new ATOM 0 HB2 GLU B 36 20.164 10.504 -5.645 1.00 0.00 H new ATOM 0 HB3 GLU B 36 19.635 11.771 -4.555 1.00 0.00 H new ATOM 0 HG2 GLU B 36 21.368 11.027 -3.297 1.00 0.00 H new ATOM 0 HG3 GLU B 36 20.181 9.873 -2.723 1.00 0.00 H new ATOM 1548 N GLY B 37 19.166 8.658 -6.407 1.00 0.00 N ATOM 1549 CA GLY B 37 19.051 7.820 -7.578 1.00 0.00 C ATOM 1550 C GLY B 37 19.975 6.628 -7.502 1.00 0.00 C ATOM 1551 O GLY B 37 20.579 6.235 -8.498 1.00 0.00 O ATOM 0 H GLY B 37 20.122 8.812 -6.087 1.00 0.00 H new ATOM 0 HA2 GLY B 37 18.022 7.477 -7.681 1.00 0.00 H new ATOM 0 HA3 GLY B 37 19.283 8.404 -8.468 1.00 0.00 H new ATOM 1555 N LYS B 38 20.094 6.064 -6.311 1.00 0.00 N ATOM 1556 CA LYS B 38 20.949 4.911 -6.098 1.00 0.00 C ATOM 1557 C LYS B 38 20.286 3.646 -6.629 1.00 0.00 C ATOM 1558 O LYS B 38 19.080 3.457 -6.476 1.00 0.00 O ATOM 1559 CB LYS B 38 21.266 4.758 -4.607 1.00 0.00 C ATOM 1560 CG LYS B 38 22.485 3.891 -4.323 1.00 0.00 C ATOM 1561 CD LYS B 38 23.744 4.441 -4.985 1.00 0.00 C ATOM 1562 CE LYS B 38 24.201 5.746 -4.346 1.00 0.00 C ATOM 1563 NZ LYS B 38 23.579 6.933 -4.991 1.00 0.00 N ATOM 0 H LYS B 38 19.607 6.388 -5.475 1.00 0.00 H new ATOM 0 HA LYS B 38 21.880 5.065 -6.643 1.00 0.00 H new ATOM 0 HB2 LYS B 38 21.426 5.746 -4.176 1.00 0.00 H new ATOM 0 HB3 LYS B 38 20.400 4.327 -4.104 1.00 0.00 H new ATOM 0 HG2 LYS B 38 22.641 3.826 -3.246 1.00 0.00 H new ATOM 0 HG3 LYS B 38 22.301 2.878 -4.680 1.00 0.00 H new ATOM 0 HD2 LYS B 38 24.543 3.703 -4.914 1.00 0.00 H new ATOM 0 HD3 LYS B 38 23.554 4.604 -6.046 1.00 0.00 H new ATOM 0 HE2 LYS B 38 23.950 5.737 -3.285 1.00 0.00 H new ATOM 0 HE3 LYS B 38 25.286 5.823 -4.416 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 23.464 7.690 -4.287 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 24.190 7.268 -5.763 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 22.648 6.672 -5.374 1.00 0.00 H new ATOM 1577 N ASP B 39 21.081 2.797 -7.266 1.00 0.00 N ATOM 1578 CA ASP B 39 20.587 1.542 -7.816 1.00 0.00 C ATOM 1579 C ASP B 39 20.378 0.534 -6.693 1.00 0.00 C ATOM 1580 O ASP B 39 19.462 -0.288 -6.733 1.00 0.00 O ATOM 1581 CB ASP B 39 21.564 0.995 -8.867 1.00 0.00 C ATOM 1582 CG ASP B 39 22.908 0.580 -8.286 1.00 0.00 C ATOM 1583 OD1 ASP B 39 23.385 1.230 -7.324 1.00 0.00 O ATOM 1584 OD2 ASP B 39 23.497 -0.395 -8.789 1.00 0.00 O ATOM 0 H ASP B 39 22.077 2.956 -7.415 1.00 0.00 H new ATOM 0 HA ASP B 39 19.630 1.720 -8.307 1.00 0.00 H new ATOM 0 HB2 ASP B 39 21.110 0.137 -9.362 1.00 0.00 H new ATOM 0 HB3 ASP B 39 21.726 1.755 -9.632 1.00 0.00 H new ATOM 1589 N ARG B 40 21.241 0.608 -5.689 1.00 0.00 N ATOM 1590 CA ARG B 40 21.143 -0.267 -4.536 1.00 0.00 C ATOM 1591 C ARG B 40 20.061 0.252 -3.602 1.00 0.00 C ATOM 1592 O ARG B 40 20.153 1.370 -3.093 1.00 0.00 O ATOM 1593 CB ARG B 40 22.482 -0.338 -3.798 1.00 0.00 C ATOM 1594 CG ARG B 40 23.370 -1.486 -4.250 1.00 0.00 C ATOM 1595 CD ARG B 40 24.742 -0.996 -4.682 1.00 0.00 C ATOM 1596 NE ARG B 40 24.856 -0.902 -6.135 1.00 0.00 N ATOM 1597 CZ ARG B 40 25.826 -1.469 -6.849 1.00 0.00 C ATOM 1598 NH1 ARG B 40 26.818 -2.115 -6.244 1.00 0.00 N ATOM 1599 NH2 ARG B 40 25.800 -1.385 -8.171 1.00 0.00 N ATOM 0 H ARG B 40 22.018 1.268 -5.653 1.00 0.00 H new ATOM 0 HA ARG B 40 20.885 -1.271 -4.873 1.00 0.00 H new ATOM 0 HB2 ARG B 40 23.016 0.601 -3.942 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.293 -0.436 -2.729 1.00 0.00 H new ATOM 0 HG2 ARG B 40 23.479 -2.204 -3.437 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.893 -2.011 -5.078 1.00 0.00 H new ATOM 0 HD2 ARG B 40 24.934 -0.019 -4.239 1.00 0.00 H new ATOM 0 HD3 ARG B 40 25.506 -1.674 -4.301 1.00 0.00 H new ATOM 0 HE ARG B 40 24.146 -0.367 -6.635 1.00 0.00 H new ATOM 0 HH11 ARG B 40 26.839 -2.179 -5.226 1.00 0.00 H new ATOM 0 HH12 ARG B 40 27.558 -2.547 -6.798 1.00 0.00 H new ATOM 0 HH21 ARG B 40 25.040 -0.888 -8.636 1.00 0.00 H new ATOM 0 HH22 ARG B 40 26.540 -1.817 -8.724 1.00 0.00 H new ATOM 1613 N PHE B 41 19.048 -0.564 -3.377 1.00 0.00 N ATOM 1614 CA PHE B 41 17.941 -0.186 -2.520 1.00 0.00 C ATOM 1615 C PHE B 41 18.308 -0.334 -1.053 1.00 0.00 C ATOM 1616 O PHE B 41 19.078 -1.215 -0.674 1.00 0.00 O ATOM 1617 CB PHE B 41 16.705 -1.020 -2.850 1.00 0.00 C ATOM 1618 CG PHE B 41 16.179 -0.782 -4.238 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.570 0.421 -4.563 1.00 0.00 C ATOM 1620 CD2 PHE B 41 16.295 -1.757 -5.216 1.00 0.00 C ATOM 1621 CE1 PHE B 41 15.086 0.644 -5.839 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.812 -1.539 -6.491 1.00 0.00 C ATOM 1623 CZ PHE B 41 15.206 -0.337 -6.804 1.00 0.00 C ATOM 0 H PHE B 41 18.970 -1.498 -3.779 1.00 0.00 H new ATOM 0 HA PHE B 41 17.714 0.864 -2.704 1.00 0.00 H new ATOM 0 HB2 PHE B 41 16.948 -2.077 -2.737 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.920 -0.795 -2.128 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.473 1.191 -3.812 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.769 -2.698 -4.978 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.614 1.585 -6.081 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.908 -2.308 -7.244 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.827 -0.165 -7.801 1.00 0.00 H new ATOM 1633 N THR B 42 17.747 0.541 -0.242 1.00 0.00 N ATOM 1634 CA THR B 42 17.991 0.546 1.187 1.00 0.00 C ATOM 1635 C THR B 42 16.873 -0.187 1.920 1.00 0.00 C ATOM 1636 O THR B 42 17.112 -0.963 2.844 1.00 0.00 O ATOM 1637 CB THR B 42 18.075 1.997 1.697 1.00 0.00 C ATOM 1638 OG1 THR B 42 19.244 2.630 1.163 1.00 0.00 O ATOM 1639 CG2 THR B 42 18.095 2.059 3.218 1.00 0.00 C ATOM 0 H THR B 42 17.107 1.271 -0.556 1.00 0.00 H new ATOM 0 HA THR B 42 18.935 0.036 1.381 1.00 0.00 H new ATOM 0 HB THR B 42 17.184 2.525 1.357 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.293 3.553 1.488 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.155 3.099 3.539 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.184 1.609 3.612 1.00 0.00 H new ATOM 0 HG23 THR B 42 18.961 1.513 3.593 1.00 0.00 H new ATOM 1647 N ILE B 43 15.653 0.058 1.482 1.00 0.00 N ATOM 1648 CA ILE B 43 14.484 -0.548 2.087 1.00 0.00 C ATOM 1649 C ILE B 43 13.791 -1.468 1.091 1.00 0.00 C ATOM 1650 O ILE B 43 13.420 -1.043 0.001 1.00 0.00 O ATOM 1651 CB ILE B 43 13.509 0.548 2.571 1.00 0.00 C ATOM 1652 CG1 ILE B 43 13.969 1.116 3.910 1.00 0.00 C ATOM 1653 CG2 ILE B 43 12.084 0.029 2.674 1.00 0.00 C ATOM 1654 CD1 ILE B 43 14.515 2.518 3.798 1.00 0.00 C ATOM 0 H ILE B 43 15.445 0.680 0.701 1.00 0.00 H new ATOM 0 HA ILE B 43 14.800 -1.141 2.945 1.00 0.00 H new ATOM 0 HB ILE B 43 13.515 1.346 1.828 1.00 0.00 H new ATOM 0 HG12 ILE B 43 13.131 1.113 4.607 1.00 0.00 H new ATOM 0 HG13 ILE B 43 14.736 0.466 4.330 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.429 0.830 3.018 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.751 -0.317 1.695 1.00 0.00 H new ATOM 0 HG23 ILE B 43 12.048 -0.798 3.383 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.826 2.867 4.783 1.00 0.00 H new ATOM 0 HD12 ILE B 43 15.372 2.522 3.125 1.00 0.00 H new ATOM 0 HD13 ILE B 43 13.742 3.179 3.406 1.00 0.00 H new ATOM 1666 N SER B 44 13.662 -2.734 1.451 1.00 0.00 N ATOM 1667 CA SER B 44 13.008 -3.708 0.592 1.00 0.00 C ATOM 1668 C SER B 44 11.917 -4.451 1.351 1.00 0.00 C ATOM 1669 O SER B 44 12.174 -5.059 2.389 1.00 0.00 O ATOM 1670 CB SER B 44 14.036 -4.691 0.031 1.00 0.00 C ATOM 1671 OG SER B 44 15.106 -3.999 -0.591 1.00 0.00 O ATOM 0 H SER B 44 14.002 -3.113 2.335 1.00 0.00 H new ATOM 0 HA SER B 44 12.542 -3.178 -0.238 1.00 0.00 H new ATOM 0 HB2 SER B 44 14.421 -5.319 0.834 1.00 0.00 H new ATOM 0 HB3 SER B 44 13.557 -5.353 -0.690 1.00 0.00 H new ATOM 0 HG SER B 44 15.754 -4.645 -0.942 1.00 0.00 H new ATOM 1677 N HIS B 45 10.702 -4.383 0.831 1.00 0.00 N ATOM 1678 CA HIS B 45 9.565 -5.046 1.432 1.00 0.00 C ATOM 1679 C HIS B 45 8.797 -5.772 0.354 1.00 0.00 C ATOM 1680 O HIS B 45 8.684 -5.293 -0.776 1.00 0.00 O ATOM 1681 CB HIS B 45 8.636 -4.050 2.139 1.00 0.00 C ATOM 1682 CG HIS B 45 9.276 -3.286 3.258 1.00 0.00 C ATOM 1683 ND1 HIS B 45 9.847 -3.870 4.366 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.424 -1.950 3.422 1.00 0.00 C ATOM 1685 CE1 HIS B 45 10.315 -2.891 5.152 1.00 0.00 C ATOM 1686 NE2 HIS B 45 10.083 -1.706 4.623 1.00 0.00 N ATOM 0 H HIS B 45 10.480 -3.866 -0.020 1.00 0.00 H new ATOM 0 HA HIS B 45 9.933 -5.747 2.181 1.00 0.00 H new ATOM 0 HB2 HIS B 45 8.257 -3.341 1.403 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.776 -4.592 2.532 1.00 0.00 H new ATOM 0 HD1 HIS B 45 9.904 -4.871 4.555 1.00 0.00 H new ATOM 0 HD2 HIS B 45 9.084 -1.194 2.730 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.816 -3.052 6.095 1.00 0.00 H new ATOM 1694 N MET B 46 8.293 -6.927 0.692 1.00 0.00 N ATOM 1695 CA MET B 46 7.531 -7.721 -0.241 1.00 0.00 C ATOM 1696 C MET B 46 6.054 -7.519 0.042 1.00 0.00 C ATOM 1697 O MET B 46 5.644 -7.530 1.197 1.00 0.00 O ATOM 1698 CB MET B 46 7.908 -9.192 -0.098 1.00 0.00 C ATOM 1699 CG MET B 46 9.218 -9.565 -0.772 1.00 0.00 C ATOM 1700 SD MET B 46 9.191 -9.309 -2.556 1.00 0.00 S ATOM 1701 CE MET B 46 7.981 -10.526 -3.070 1.00 0.00 C ATOM 0 H MET B 46 8.396 -7.346 1.616 1.00 0.00 H new ATOM 0 HA MET B 46 7.749 -7.411 -1.263 1.00 0.00 H new ATOM 0 HB2 MET B 46 7.974 -9.438 0.962 1.00 0.00 H new ATOM 0 HB3 MET B 46 7.109 -9.803 -0.518 1.00 0.00 H new ATOM 0 HG2 MET B 46 10.025 -8.974 -0.338 1.00 0.00 H new ATOM 0 HG3 MET B 46 9.442 -10.611 -0.564 1.00 0.00 H new ATOM 0 HE1 MET B 46 8.061 -10.687 -4.145 1.00 0.00 H new ATOM 0 HE2 MET B 46 8.165 -11.465 -2.548 1.00 0.00 H new ATOM 0 HE3 MET B 46 6.980 -10.168 -2.830 1.00 0.00 H new ATOM 1711 N TYR B 47 5.252 -7.342 -1.003 1.00 0.00 N ATOM 1712 CA TYR B 47 3.806 -7.133 -0.827 1.00 0.00 C ATOM 1713 C TYR B 47 3.177 -8.296 -0.055 1.00 0.00 C ATOM 1714 O TYR B 47 2.050 -8.207 0.416 1.00 0.00 O ATOM 1715 CB TYR B 47 3.088 -6.990 -2.176 1.00 0.00 C ATOM 1716 CG TYR B 47 3.516 -5.804 -3.017 1.00 0.00 C ATOM 1717 CD1 TYR B 47 4.307 -4.790 -2.495 1.00 0.00 C ATOM 1718 CD2 TYR B 47 3.123 -5.708 -4.347 1.00 0.00 C ATOM 1719 CE1 TYR B 47 4.697 -3.718 -3.274 1.00 0.00 C ATOM 1720 CE2 TYR B 47 3.507 -4.639 -5.130 1.00 0.00 C ATOM 1721 CZ TYR B 47 4.294 -3.647 -4.590 1.00 0.00 C ATOM 1722 OH TYR B 47 4.688 -2.587 -5.371 1.00 0.00 O ATOM 0 H TYR B 47 5.567 -7.338 -1.973 1.00 0.00 H new ATOM 0 HA TYR B 47 3.687 -6.209 -0.262 1.00 0.00 H new ATOM 0 HB2 TYR B 47 3.250 -7.900 -2.753 1.00 0.00 H new ATOM 0 HB3 TYR B 47 2.016 -6.916 -1.992 1.00 0.00 H new ATOM 0 HD1 TYR B 47 4.623 -4.840 -1.463 1.00 0.00 H new ATOM 0 HD2 TYR B 47 2.506 -6.484 -4.775 1.00 0.00 H new ATOM 0 HE1 TYR B 47 5.315 -2.939 -2.853 1.00 0.00 H new ATOM 0 HE2 TYR B 47 3.192 -4.581 -6.161 1.00 0.00 H new ATOM 0 HH TYR B 47 5.151 -2.922 -6.167 1.00 0.00 H new ATOM 1732 N ALA B 48 3.929 -9.384 0.052 1.00 0.00 N ATOM 1733 CA ALA B 48 3.490 -10.586 0.740 1.00 0.00 C ATOM 1734 C ALA B 48 3.555 -10.450 2.260 1.00 0.00 C ATOM 1735 O ALA B 48 2.734 -11.031 2.970 1.00 0.00 O ATOM 1736 CB ALA B 48 4.331 -11.772 0.291 1.00 0.00 C ATOM 0 H ALA B 48 4.868 -9.455 -0.340 1.00 0.00 H new ATOM 0 HA ALA B 48 2.445 -10.746 0.476 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.998 -12.671 0.810 1.00 0.00 H new ATOM 0 HB2 ALA B 48 4.219 -11.911 -0.784 1.00 0.00 H new ATOM 0 HB3 ALA B 48 5.379 -11.585 0.526 1.00 0.00 H new ATOM 1742 N ASP B 49 4.524 -9.691 2.760 1.00 0.00 N ATOM 1743 CA ASP B 49 4.679 -9.522 4.202 1.00 0.00 C ATOM 1744 C ASP B 49 4.040 -8.232 4.679 1.00 0.00 C ATOM 1745 O ASP B 49 3.773 -8.073 5.870 1.00 0.00 O ATOM 1746 CB ASP B 49 6.160 -9.575 4.607 1.00 0.00 C ATOM 1747 CG ASP B 49 6.946 -8.333 4.212 1.00 0.00 C ATOM 1748 OD1 ASP B 49 6.949 -7.357 4.989 1.00 0.00 O ATOM 1749 OD2 ASP B 49 7.573 -8.341 3.127 1.00 0.00 O ATOM 0 H ASP B 49 5.208 -9.187 2.196 1.00 0.00 H new ATOM 0 HA ASP B 49 4.163 -10.351 4.686 1.00 0.00 H new ATOM 0 HB2 ASP B 49 6.228 -9.709 5.687 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.622 -10.449 4.147 1.00 0.00 H new ATOM 1754 N ILE B 50 3.784 -7.316 3.762 1.00 0.00 N ATOM 1755 CA ILE B 50 3.157 -6.062 4.130 1.00 0.00 C ATOM 1756 C ILE B 50 1.687 -6.293 4.440 1.00 0.00 C ATOM 1757 O ILE B 50 0.910 -6.687 3.572 1.00 0.00 O ATOM 1758 CB ILE B 50 3.280 -4.991 3.035 1.00 0.00 C ATOM 1759 CG1 ILE B 50 4.674 -5.009 2.423 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.988 -3.620 3.618 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.811 -4.095 1.232 1.00 0.00 C ATOM 0 H ILE B 50 3.998 -7.415 2.770 1.00 0.00 H new ATOM 0 HA ILE B 50 3.682 -5.692 5.011 1.00 0.00 H new ATOM 0 HB ILE B 50 2.555 -5.210 2.252 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.401 -4.718 3.182 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.918 -6.028 2.121 1.00 0.00 H new ATOM 0 HG21 ILE B 50 3.077 -2.866 2.836 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.976 -3.605 4.023 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.701 -3.404 4.414 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.827 -4.154 0.843 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.107 -4.399 0.457 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.597 -3.070 1.534 1.00 0.00 H new ATOM 1773 N LYS B 51 1.323 -6.054 5.686 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.040 -6.235 6.138 1.00 0.00 C ATOM 1775 C LYS B 51 -0.954 -5.206 5.503 1.00 0.00 C ATOM 1776 O LYS B 51 -1.899 -5.548 4.795 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.112 -6.102 7.659 1.00 0.00 C ATOM 1778 CG LYS B 51 -1.527 -6.161 8.198 1.00 0.00 C ATOM 1779 CD LYS B 51 -1.737 -5.184 9.337 1.00 0.00 C ATOM 1780 CE LYS B 51 -3.212 -5.094 9.698 1.00 0.00 C ATOM 1781 NZ LYS B 51 -3.796 -3.753 9.393 1.00 0.00 N ATOM 0 H LYS B 51 1.964 -5.730 6.410 1.00 0.00 H new ATOM 0 HA LYS B 51 -0.366 -7.232 5.843 1.00 0.00 H new ATOM 0 HB2 LYS B 51 0.477 -6.898 8.115 1.00 0.00 H new ATOM 0 HB3 LYS B 51 0.344 -5.158 7.956 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.231 -5.940 7.396 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -1.743 -7.172 8.542 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.163 -5.502 10.207 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.366 -4.200 9.052 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.764 -5.859 9.152 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -3.336 -5.308 10.760 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.827 -3.784 9.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -3.384 -3.042 10.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.584 -3.498 8.407 1.00 0.00 H new ATOM 1795 N CYS B 52 -0.650 -3.946 5.769 1.00 0.00 N ATOM 1796 CA CYS B 52 -1.433 -2.830 5.262 1.00 0.00 C ATOM 1797 C CYS B 52 -0.532 -1.614 5.141 1.00 0.00 C ATOM 1798 O CYS B 52 0.686 -1.717 5.285 1.00 0.00 O ATOM 1799 CB CYS B 52 -2.609 -2.532 6.201 1.00 0.00 C ATOM 1800 SG CYS B 52 -3.842 -3.857 6.300 1.00 0.00 S ATOM 0 H CYS B 52 0.146 -3.668 6.342 1.00 0.00 H new ATOM 0 HA CYS B 52 -1.839 -3.083 4.283 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.220 -2.339 7.201 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.101 -1.618 5.868 1.00 0.00 H new ATOM 0 HG CYS B 52 -3.441 -4.876 5.600 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.119 -0.471 4.878 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.360 0.755 4.751 1.00 0.00 C ATOM 1808 C GLN B 53 -0.936 1.793 5.690 1.00 0.00 C ATOM 1809 O GLN B 53 -1.866 1.510 6.429 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.397 1.282 3.314 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.248 0.211 2.249 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.320 0.315 1.186 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.184 1.070 0.228 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -2.401 -0.439 1.348 1.00 0.00 N ATOM 0 H GLN B 53 -2.125 -0.362 4.747 1.00 0.00 H new ATOM 0 HA GLN B 53 0.679 0.550 5.009 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.340 1.805 3.156 1.00 0.00 H new ATOM 0 HB3 GLN B 53 0.400 2.015 3.188 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.734 0.297 1.783 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.294 -0.773 2.716 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -2.477 -1.054 2.158 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.155 -0.403 0.662 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.340 2.964 5.701 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.802 4.077 6.504 1.00 0.00 C ATOM 1825 C LYS B 54 -0.357 5.340 5.801 1.00 0.00 C ATOM 1826 O LYS B 54 0.758 5.403 5.306 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.273 3.991 7.938 1.00 0.00 C ATOM 1828 CG LYS B 54 -1.186 3.180 8.844 1.00 0.00 C ATOM 1829 CD LYS B 54 -0.626 3.022 10.242 1.00 0.00 C ATOM 1830 CE LYS B 54 -0.764 4.301 11.040 1.00 0.00 C ATOM 1831 NZ LYS B 54 0.396 4.505 11.951 1.00 0.00 N ATOM 0 H LYS B 54 0.490 3.174 5.146 1.00 0.00 H new ATOM 0 HA LYS B 54 -1.888 4.065 6.598 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.720 3.541 7.930 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.164 4.997 8.343 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -2.161 3.665 8.899 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -1.344 2.194 8.406 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -1.147 2.213 10.755 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.425 2.739 10.185 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -0.847 5.148 10.359 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -1.684 4.270 11.623 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 0.642 5.515 11.979 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.147 4.182 12.908 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 1.211 3.960 11.603 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.213 6.334 5.710 1.00 0.00 N ATOM 1846 CA ILE B 55 -0.849 7.536 4.974 1.00 0.00 C ATOM 1847 C ILE B 55 -1.218 8.827 5.659 1.00 0.00 C ATOM 1848 O ILE B 55 -2.236 8.911 6.326 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.570 7.567 3.621 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.083 7.490 3.836 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.106 6.432 2.746 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -3.887 7.805 2.604 1.00 0.00 C ATOM 0 H ILE B 55 -2.145 6.341 6.124 1.00 0.00 H new ATOM 0 HA ILE B 55 0.236 7.479 4.887 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.331 8.504 3.118 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.341 6.489 4.181 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.364 8.183 4.629 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -1.629 6.472 1.791 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.033 6.519 2.576 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.320 5.483 3.238 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -4.950 7.730 2.834 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.659 8.817 2.269 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.636 7.097 1.815 1.00 0.00 H new ATOM 1864 N SER B 56 -0.372 9.824 5.487 1.00 0.00 N ATOM 1865 CA SER B 56 -0.665 11.149 5.974 1.00 0.00 C ATOM 1866 C SER B 56 -1.551 11.772 4.910 1.00 0.00 C ATOM 1867 O SER B 56 -1.077 12.123 3.827 1.00 0.00 O ATOM 1868 CB SER B 56 0.615 11.953 6.182 1.00 0.00 C ATOM 1869 OG SER B 56 1.369 11.415 7.253 1.00 0.00 O ATOM 0 H SER B 56 0.526 9.736 5.011 1.00 0.00 H new ATOM 0 HA SER B 56 -1.159 11.129 6.946 1.00 0.00 H new ATOM 0 HB2 SER B 56 1.210 11.943 5.269 1.00 0.00 H new ATOM 0 HB3 SER B 56 0.368 12.994 6.390 1.00 0.00 H new ATOM 0 HG SER B 56 0.764 11.133 7.970 1.00 0.00 H new ATOM 1875 N PRO B 57 -2.852 11.872 5.194 1.00 0.00 N ATOM 1876 CA PRO B 57 -3.848 12.357 4.238 1.00 0.00 C ATOM 1877 C PRO B 57 -3.664 13.831 3.849 1.00 0.00 C ATOM 1878 O PRO B 57 -2.673 14.467 4.219 1.00 0.00 O ATOM 1879 CB PRO B 57 -5.178 12.101 4.956 1.00 0.00 C ATOM 1880 CG PRO B 57 -4.840 11.170 6.060 1.00 0.00 C ATOM 1881 CD PRO B 57 -3.467 11.555 6.484 1.00 0.00 C ATOM 0 HA PRO B 57 -3.774 11.847 3.278 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.606 13.028 5.337 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -5.914 11.664 4.281 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.548 11.262 6.884 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -4.873 10.133 5.726 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -3.469 12.410 7.160 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -2.952 10.743 6.998 1.00 0.00 H new ATOM 1889 N GLU B 58 -4.634 14.370 3.116 1.00 0.00 N ATOM 1890 CA GLU B 58 -4.582 15.750 2.620 1.00 0.00 C ATOM 1891 C GLU B 58 -4.576 16.790 3.742 1.00 0.00 C ATOM 1892 O GLU B 58 -4.246 17.952 3.510 1.00 0.00 O ATOM 1893 CB GLU B 58 -5.766 16.036 1.686 1.00 0.00 C ATOM 1894 CG GLU B 58 -6.224 14.839 0.867 1.00 0.00 C ATOM 1895 CD GLU B 58 -7.264 14.007 1.592 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -6.868 13.164 2.426 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -8.467 14.210 1.344 1.00 0.00 O ATOM 0 H GLU B 58 -5.479 13.867 2.847 1.00 0.00 H new ATOM 0 HA GLU B 58 -3.641 15.837 2.077 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -6.605 16.395 2.282 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -5.490 16.842 1.006 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -6.636 15.187 -0.080 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -5.363 14.214 0.630 1.00 0.00 H new ATOM 1904 N GLY B 59 -4.931 16.380 4.949 1.00 0.00 N ATOM 1905 CA GLY B 59 -4.961 17.312 6.064 1.00 0.00 C ATOM 1906 C GLY B 59 -3.619 17.448 6.759 1.00 0.00 C ATOM 1907 O GLY B 59 -3.546 17.917 7.893 1.00 0.00 O ATOM 0 H GLY B 59 -5.199 15.423 5.180 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -5.278 18.291 5.704 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -5.707 16.981 6.787 1.00 0.00 H new ATOM 1911 N LYS B 60 -2.550 17.058 6.079 1.00 0.00 N ATOM 1912 CA LYS B 60 -1.219 17.130 6.658 1.00 0.00 C ATOM 1913 C LYS B 60 -0.249 17.861 5.748 1.00 0.00 C ATOM 1914 O LYS B 60 -0.412 17.878 4.532 1.00 0.00 O ATOM 1915 CB LYS B 60 -0.692 15.731 6.941 1.00 0.00 C ATOM 1916 CG LYS B 60 -1.479 15.005 8.004 1.00 0.00 C ATOM 1917 CD LYS B 60 -0.658 13.901 8.620 1.00 0.00 C ATOM 1918 CE LYS B 60 0.395 14.446 9.571 1.00 0.00 C ATOM 1919 NZ LYS B 60 -0.194 15.231 10.691 1.00 0.00 N ATOM 0 H LYS B 60 -2.580 16.690 5.128 1.00 0.00 H new ATOM 0 HA LYS B 60 -1.299 17.689 7.590 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -0.713 15.148 6.020 1.00 0.00 H new ATOM 0 HB3 LYS B 60 0.351 15.798 7.252 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -1.789 15.708 8.777 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -2.388 14.589 7.569 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -1.314 13.216 9.157 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -0.173 13.325 7.832 1.00 0.00 H new ATOM 0 HE2 LYS B 60 0.974 13.618 9.979 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.089 15.077 9.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 0.234 14.929 11.589 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -0.008 16.243 10.541 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -1.221 15.069 10.726 1.00 0.00 H new ATOM 1933 N ALA B 61 0.766 18.459 6.359 1.00 0.00 N ATOM 1934 CA ALA B 61 1.781 19.190 5.621 1.00 0.00 C ATOM 1935 C ALA B 61 2.807 18.239 5.022 1.00 0.00 C ATOM 1936 O ALA B 61 3.175 18.368 3.858 1.00 0.00 O ATOM 1937 CB ALA B 61 2.461 20.198 6.524 1.00 0.00 C ATOM 0 H ALA B 61 0.906 18.450 7.369 1.00 0.00 H new ATOM 0 HA ALA B 61 1.293 19.722 4.804 1.00 0.00 H new ATOM 0 HB1 ALA B 61 3.220 20.739 5.959 1.00 0.00 H new ATOM 0 HB2 ALA B 61 1.721 20.902 6.905 1.00 0.00 H new ATOM 0 HB3 ALA B 61 2.932 19.679 7.359 1.00 0.00 H new ATOM 1943 N LYS B 62 3.278 17.286 5.822 1.00 0.00 N ATOM 1944 CA LYS B 62 4.248 16.323 5.332 1.00 0.00 C ATOM 1945 C LYS B 62 3.521 15.082 4.827 1.00 0.00 C ATOM 1946 O LYS B 62 2.776 14.432 5.563 1.00 0.00 O ATOM 1947 CB LYS B 62 5.316 15.984 6.392 1.00 0.00 C ATOM 1948 CG LYS B 62 4.791 15.523 7.747 1.00 0.00 C ATOM 1949 CD LYS B 62 5.940 15.347 8.740 1.00 0.00 C ATOM 1950 CE LYS B 62 5.613 14.317 9.814 1.00 0.00 C ATOM 1951 NZ LYS B 62 6.818 13.901 10.590 1.00 0.00 N ATOM 0 H LYS B 62 3.006 17.164 6.797 1.00 0.00 H new ATOM 0 HA LYS B 62 4.792 16.768 4.499 1.00 0.00 H new ATOM 0 HB2 LYS B 62 5.963 15.204 5.991 1.00 0.00 H new ATOM 0 HB3 LYS B 62 5.938 16.865 6.547 1.00 0.00 H new ATOM 0 HG2 LYS B 62 4.078 16.251 8.133 1.00 0.00 H new ATOM 0 HG3 LYS B 62 4.254 14.581 7.633 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.838 15.040 8.204 1.00 0.00 H new ATOM 0 HD3 LYS B 62 6.162 16.304 9.211 1.00 0.00 H new ATOM 0 HE2 LYS B 62 4.870 14.731 10.496 1.00 0.00 H new ATOM 0 HE3 LYS B 62 5.164 13.440 9.348 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 6.520 13.393 11.447 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.409 13.277 10.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 7.365 14.743 10.860 1.00 0.00 H new ATOM 1965 N ILE B 63 3.726 14.791 3.553 1.00 0.00 N ATOM 1966 CA ILE B 63 3.088 13.668 2.884 1.00 0.00 C ATOM 1967 C ILE B 63 3.862 12.389 3.174 1.00 0.00 C ATOM 1968 O ILE B 63 4.952 12.203 2.666 1.00 0.00 O ATOM 1969 CB ILE B 63 3.033 13.938 1.368 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.001 15.029 1.078 1.00 0.00 C ATOM 1971 CG2 ILE B 63 2.703 12.673 0.583 1.00 0.00 C ATOM 1972 CD1 ILE B 63 2.439 16.440 1.422 1.00 0.00 C ATOM 0 H ILE B 63 4.345 15.332 2.949 1.00 0.00 H new ATOM 0 HA ILE B 63 2.071 13.548 3.256 1.00 0.00 H new ATOM 0 HB ILE B 63 4.019 14.274 1.046 1.00 0.00 H new ATOM 0 HG12 ILE B 63 1.746 14.993 0.019 1.00 0.00 H new ATOM 0 HG13 ILE B 63 1.091 14.803 1.633 1.00 0.00 H new ATOM 0 HG21 ILE B 63 2.673 12.903 -0.482 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.468 11.919 0.770 1.00 0.00 H new ATOM 0 HG23 ILE B 63 1.732 12.291 0.899 1.00 0.00 H new ATOM 0 HD11 ILE B 63 1.638 17.139 1.180 1.00 0.00 H new ATOM 0 HD12 ILE B 63 2.664 16.502 2.487 1.00 0.00 H new ATOM 0 HD13 ILE B 63 3.329 16.695 0.847 1.00 0.00 H new ATOM 1984 N GLN B 64 3.315 11.504 3.992 1.00 0.00 N ATOM 1985 CA GLN B 64 4.042 10.286 4.339 1.00 0.00 C ATOM 1986 C GLN B 64 3.213 9.020 4.165 1.00 0.00 C ATOM 1987 O GLN B 64 2.002 9.012 4.384 1.00 0.00 O ATOM 1988 CB GLN B 64 4.538 10.373 5.778 1.00 0.00 C ATOM 1989 CG GLN B 64 4.605 11.792 6.299 1.00 0.00 C ATOM 1990 CD GLN B 64 4.837 11.858 7.782 1.00 0.00 C ATOM 1991 OE1 GLN B 64 5.971 11.845 8.240 1.00 0.00 O ATOM 1992 NE2 GLN B 64 3.760 11.949 8.542 1.00 0.00 N ATOM 0 H GLN B 64 2.394 11.598 4.420 1.00 0.00 H new ATOM 0 HA GLN B 64 4.881 10.216 3.646 1.00 0.00 H new ATOM 0 HB2 GLN B 64 3.879 9.788 6.419 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.528 9.922 5.842 1.00 0.00 H new ATOM 0 HG2 GLN B 64 5.406 12.325 5.787 1.00 0.00 H new ATOM 0 HG3 GLN B 64 3.675 12.307 6.058 1.00 0.00 H new ATOM 0 HE21 GLN B 64 2.834 11.956 8.115 1.00 0.00 H new ATOM 0 HE22 GLN B 64 3.855 12.012 9.556 1.00 0.00 H new ATOM 2001 N LEU B 65 3.896 7.959 3.765 1.00 0.00 N ATOM 2002 CA LEU B 65 3.296 6.653 3.556 1.00 0.00 C ATOM 2003 C LEU B 65 3.998 5.620 4.436 1.00 0.00 C ATOM 2004 O LEU B 65 5.176 5.340 4.242 1.00 0.00 O ATOM 2005 CB LEU B 65 3.457 6.235 2.098 1.00 0.00 C ATOM 2006 CG LEU B 65 2.714 4.963 1.697 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.323 5.278 1.161 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.535 4.180 0.694 1.00 0.00 C ATOM 0 H LEU B 65 4.898 7.983 3.574 1.00 0.00 H new ATOM 0 HA LEU B 65 2.238 6.708 3.811 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.114 7.052 1.463 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.518 6.096 1.892 1.00 0.00 H new ATOM 0 HG LEU B 65 2.577 4.345 2.585 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.821 4.351 0.885 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.744 5.789 1.930 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.408 5.920 0.284 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.998 3.274 0.413 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.705 4.791 -0.193 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.493 3.911 1.139 1.00 0.00 H new ATOM 2020 N GLN B 66 3.288 5.062 5.394 1.00 0.00 N ATOM 2021 CA GLN B 66 3.859 4.068 6.285 1.00 0.00 C ATOM 2022 C GLN B 66 3.456 2.662 5.862 1.00 0.00 C ATOM 2023 O GLN B 66 2.276 2.359 5.715 1.00 0.00 O ATOM 2024 CB GLN B 66 3.431 4.321 7.723 1.00 0.00 C ATOM 2025 CG GLN B 66 3.839 3.216 8.687 1.00 0.00 C ATOM 2026 CD GLN B 66 3.366 3.466 10.104 1.00 0.00 C ATOM 2027 OE1 GLN B 66 2.276 3.056 10.488 1.00 0.00 O ATOM 2028 NE2 GLN B 66 4.182 4.138 10.891 1.00 0.00 N ATOM 0 H GLN B 66 2.309 5.280 5.578 1.00 0.00 H new ATOM 0 HA GLN B 66 4.944 4.152 6.223 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.863 5.263 8.061 1.00 0.00 H new ATOM 0 HB3 GLN B 66 2.348 4.437 7.755 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.434 2.267 8.336 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.925 3.120 8.683 1.00 0.00 H new ATOM 0 HE21 GLN B 66 5.081 4.463 10.535 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.914 4.333 11.856 1.00 0.00 H new ATOM 2037 N LEU B 67 4.445 1.816 5.647 1.00 0.00 N ATOM 2038 CA LEU B 67 4.205 0.437 5.269 1.00 0.00 C ATOM 2039 C LEU B 67 4.109 -0.420 6.517 1.00 0.00 C ATOM 2040 O LEU B 67 5.113 -0.672 7.176 1.00 0.00 O ATOM 2041 CB LEU B 67 5.332 -0.088 4.383 1.00 0.00 C ATOM 2042 CG LEU B 67 5.348 0.438 2.951 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.461 -0.236 2.171 1.00 0.00 C ATOM 2044 CD2 LEU B 67 4.003 0.206 2.278 1.00 0.00 C ATOM 0 H LEU B 67 5.431 2.063 5.729 1.00 0.00 H new ATOM 0 HA LEU B 67 3.271 0.390 4.710 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.284 0.160 4.852 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.267 -1.176 4.350 1.00 0.00 H new ATOM 0 HG LEU B 67 5.531 1.512 2.971 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.469 0.142 1.149 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.419 -0.022 2.645 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.295 -1.313 2.158 1.00 0.00 H new ATOM 0 HD21 LEU B 67 4.036 0.588 1.258 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.785 -0.862 2.258 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.223 0.725 2.835 1.00 0.00 H new ATOM 2056 N VAL B 68 2.905 -0.848 6.849 1.00 0.00 N ATOM 2057 CA VAL B 68 2.698 -1.674 8.023 1.00 0.00 C ATOM 2058 C VAL B 68 2.802 -3.137 7.649 1.00 0.00 C ATOM 2059 O VAL B 68 1.888 -3.703 7.055 1.00 0.00 O ATOM 2060 CB VAL B 68 1.334 -1.412 8.677 1.00 0.00 C ATOM 2061 CG1 VAL B 68 1.259 -2.119 10.018 1.00 0.00 C ATOM 2062 CG2 VAL B 68 1.101 0.079 8.838 1.00 0.00 C ATOM 0 H VAL B 68 2.057 -0.637 6.323 1.00 0.00 H new ATOM 0 HA VAL B 68 3.473 -1.415 8.745 1.00 0.00 H new ATOM 0 HB VAL B 68 0.550 -1.808 8.032 1.00 0.00 H new ATOM 0 HG11 VAL B 68 0.288 -1.928 10.476 1.00 0.00 H new ATOM 0 HG12 VAL B 68 1.387 -3.192 9.872 1.00 0.00 H new ATOM 0 HG13 VAL B 68 2.048 -1.745 10.671 1.00 0.00 H new ATOM 0 HG21 VAL B 68 0.130 0.247 9.303 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.883 0.504 9.467 1.00 0.00 H new ATOM 0 HG23 VAL B 68 1.123 0.558 7.859 1.00 0.00 H new ATOM 2072 N LEU B 69 3.915 -3.746 8.001 1.00 0.00 N ATOM 2073 CA LEU B 69 4.148 -5.137 7.668 1.00 0.00 C ATOM 2074 C LEU B 69 3.605 -6.061 8.751 1.00 0.00 C ATOM 2075 O LEU B 69 3.455 -5.659 9.905 1.00 0.00 O ATOM 2076 CB LEU B 69 5.638 -5.379 7.475 1.00 0.00 C ATOM 2077 CG LEU B 69 6.424 -4.170 6.970 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.906 -4.428 7.071 1.00 0.00 C ATOM 2079 CD2 LEU B 69 6.052 -3.826 5.544 1.00 0.00 C ATOM 0 H LEU B 69 4.673 -3.300 8.518 1.00 0.00 H new ATOM 0 HA LEU B 69 3.621 -5.359 6.740 1.00 0.00 H new ATOM 0 HB2 LEU B 69 6.065 -5.701 8.425 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.770 -6.200 6.771 1.00 0.00 H new ATOM 0 HG LEU B 69 6.166 -3.319 7.601 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.452 -3.558 6.708 1.00 0.00 H new ATOM 0 HD12 LEU B 69 8.173 -4.615 8.111 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.166 -5.298 6.467 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.629 -2.962 5.216 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.270 -4.675 4.896 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.988 -3.593 5.491 1.00 0.00 H new ATOM 2091 N HIS B 70 3.322 -7.304 8.369 1.00 0.00 N ATOM 2092 CA HIS B 70 2.796 -8.305 9.300 1.00 0.00 C ATOM 2093 C HIS B 70 3.821 -8.642 10.375 1.00 0.00 C ATOM 2094 O HIS B 70 3.469 -9.082 11.465 1.00 0.00 O ATOM 2095 CB HIS B 70 2.429 -9.599 8.561 1.00 0.00 C ATOM 2096 CG HIS B 70 1.112 -9.559 7.860 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -0.100 -9.440 8.506 1.00 0.00 N ATOM 2098 CD2 HIS B 70 0.831 -9.607 6.535 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -1.063 -9.411 7.577 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -0.550 -9.512 6.360 1.00 0.00 N ATOM 0 H HIS B 70 3.448 -7.646 7.416 1.00 0.00 H new ATOM 0 HA HIS B 70 1.906 -7.877 9.762 1.00 0.00 H new ATOM 0 HB2 HIS B 70 3.208 -9.819 7.831 1.00 0.00 H new ATOM 0 HB3 HIS B 70 2.421 -10.421 9.276 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -0.239 -9.384 9.515 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.559 -9.703 5.743 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -2.117 -9.318 7.791 1.00 0.00 H new ATOM 2108 N ALA B 71 5.090 -8.434 10.047 1.00 0.00 N ATOM 2109 CA ALA B 71 6.184 -8.734 10.960 1.00 0.00 C ATOM 2110 C ALA B 71 6.169 -7.847 12.201 1.00 0.00 C ATOM 2111 O ALA B 71 6.690 -8.233 13.245 1.00 0.00 O ATOM 2112 CB ALA B 71 7.518 -8.602 10.238 1.00 0.00 C ATOM 0 H ALA B 71 5.388 -8.056 9.148 1.00 0.00 H new ATOM 0 HA ALA B 71 6.049 -9.761 11.298 1.00 0.00 H new ATOM 0 HB1 ALA B 71 8.330 -8.828 10.929 1.00 0.00 H new ATOM 0 HB2 ALA B 71 7.549 -9.299 9.401 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.631 -7.584 9.866 1.00 0.00 H new ATOM 2118 N GLY B 72 5.580 -6.664 12.091 1.00 0.00 N ATOM 2119 CA GLY B 72 5.548 -5.767 13.222 1.00 0.00 C ATOM 2120 C GLY B 72 6.526 -4.650 13.002 1.00 0.00 C ATOM 2121 O GLY B 72 7.114 -4.109 13.936 1.00 0.00 O ATOM 0 H GLY B 72 5.128 -6.314 11.246 1.00 0.00 H new ATOM 0 HA2 GLY B 72 4.543 -5.365 13.352 1.00 0.00 H new ATOM 0 HA3 GLY B 72 5.796 -6.307 14.136 1.00 0.00 H new ATOM 2125 N ASP B 73 6.677 -4.313 11.736 1.00 0.00 N ATOM 2126 CA ASP B 73 7.577 -3.281 11.300 1.00 0.00 C ATOM 2127 C ASP B 73 6.788 -2.356 10.426 1.00 0.00 C ATOM 2128 O ASP B 73 5.982 -2.805 9.610 1.00 0.00 O ATOM 2129 CB ASP B 73 8.746 -3.859 10.499 1.00 0.00 C ATOM 2130 CG ASP B 73 9.761 -2.799 10.105 1.00 0.00 C ATOM 2131 OD1 ASP B 73 9.512 -2.068 9.119 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.804 -2.697 10.781 1.00 0.00 O ATOM 0 H ASP B 73 6.166 -4.760 10.975 1.00 0.00 H new ATOM 0 HA ASP B 73 7.996 -2.767 12.165 1.00 0.00 H new ATOM 0 HB2 ASP B 73 9.241 -4.630 11.089 1.00 0.00 H new ATOM 0 HB3 ASP B 73 8.363 -4.343 9.600 1.00 0.00 H new ATOM 2137 N THR B 74 6.961 -1.087 10.623 1.00 0.00 N ATOM 2138 CA THR B 74 6.254 -0.131 9.828 1.00 0.00 C ATOM 2139 C THR B 74 7.234 0.947 9.347 1.00 0.00 C ATOM 2140 O THR B 74 7.825 1.656 10.163 1.00 0.00 O ATOM 2141 CB THR B 74 5.121 0.501 10.648 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.635 1.036 11.873 1.00 0.00 O ATOM 2143 CG2 THR B 74 4.036 -0.520 10.956 1.00 0.00 C ATOM 0 H THR B 74 7.584 -0.689 11.326 1.00 0.00 H new ATOM 0 HA THR B 74 5.814 -0.628 8.963 1.00 0.00 H new ATOM 0 HB THR B 74 4.686 1.305 10.055 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.532 1.401 11.720 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.245 -0.046 11.538 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.621 -0.902 10.023 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.463 -1.344 11.528 1.00 0.00 H new ATOM 2151 N THR B 75 7.398 1.081 8.039 1.00 0.00 N ATOM 2152 CA THR B 75 8.329 2.062 7.486 1.00 0.00 C ATOM 2153 C THR B 75 7.591 3.266 6.898 1.00 0.00 C ATOM 2154 O THR B 75 6.705 3.111 6.065 1.00 0.00 O ATOM 2155 CB THR B 75 9.228 1.407 6.413 1.00 0.00 C ATOM 2156 OG1 THR B 75 10.249 0.629 7.049 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.874 2.448 5.512 1.00 0.00 C ATOM 0 H THR B 75 6.902 0.527 7.341 1.00 0.00 H new ATOM 0 HA THR B 75 8.956 2.421 8.302 1.00 0.00 H new ATOM 0 HB THR B 75 8.599 0.767 5.795 1.00 0.00 H new ATOM 0 HG1 THR B 75 10.421 -0.179 6.521 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.499 1.950 4.770 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.098 3.023 5.006 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.489 3.118 6.113 1.00 0.00 H new ATOM 2165 N ASN B 76 7.974 4.469 7.325 1.00 0.00 N ATOM 2166 CA ASN B 76 7.324 5.693 6.855 1.00 0.00 C ATOM 2167 C ASN B 76 8.123 6.371 5.743 1.00 0.00 C ATOM 2168 O ASN B 76 9.309 6.663 5.904 1.00 0.00 O ATOM 2169 CB ASN B 76 7.136 6.702 8.001 1.00 0.00 C ATOM 2170 CG ASN B 76 6.963 6.058 9.365 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.304 5.034 9.506 1.00 0.00 O ATOM 2172 ND2 ASN B 76 7.569 6.657 10.376 1.00 0.00 N ATOM 0 H ASN B 76 8.729 4.623 7.994 1.00 0.00 H new ATOM 0 HA ASN B 76 6.352 5.390 6.466 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.999 7.368 8.031 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.264 7.320 7.789 1.00 0.00 H new ATOM 0 HD21 ASN B 76 7.498 6.268 11.316 1.00 0.00 H new ATOM 0 HD22 ASN B 76 8.108 7.508 10.216 1.00 0.00 H new ATOM 2179 N PHE B 77 7.465 6.605 4.618 1.00 0.00 N ATOM 2180 CA PHE B 77 8.074 7.281 3.478 1.00 0.00 C ATOM 2181 C PHE B 77 7.499 8.687 3.365 1.00 0.00 C ATOM 2182 O PHE B 77 6.314 8.853 3.102 1.00 0.00 O ATOM 2183 CB PHE B 77 7.811 6.501 2.188 1.00 0.00 C ATOM 2184 CG PHE B 77 8.489 5.165 2.149 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.857 5.067 2.325 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.760 4.006 1.935 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.489 3.841 2.289 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.388 2.776 1.897 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.755 2.694 2.074 1.00 0.00 C ATOM 0 H PHE B 77 6.494 6.332 4.467 1.00 0.00 H new ATOM 0 HA PHE B 77 9.152 7.337 3.629 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.737 6.358 2.072 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.147 7.095 1.338 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.438 5.962 2.493 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.691 4.065 1.797 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.558 3.780 2.429 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.810 1.879 1.729 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.248 1.734 2.044 1.00 0.00 H new ATOM 2199 N HIS B 78 8.340 9.688 3.549 1.00 0.00 N ATOM 2200 CA HIS B 78 7.907 11.080 3.513 1.00 0.00 C ATOM 2201 C HIS B 78 8.168 11.705 2.138 1.00 0.00 C ATOM 2202 O HIS B 78 9.301 12.016 1.784 1.00 0.00 O ATOM 2203 CB HIS B 78 8.629 11.854 4.627 1.00 0.00 C ATOM 2204 CG HIS B 78 8.445 13.343 4.606 1.00 0.00 C ATOM 2205 ND1 HIS B 78 9.325 14.217 5.201 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.480 14.112 4.037 1.00 0.00 C ATOM 2207 CE1 HIS B 78 8.886 15.460 4.977 1.00 0.00 C ATOM 2208 NE2 HIS B 78 7.768 15.452 4.275 1.00 0.00 N ATOM 0 H HIS B 78 9.337 9.565 3.727 1.00 0.00 H new ATOM 0 HA HIS B 78 6.831 11.130 3.682 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.284 11.477 5.590 1.00 0.00 H new ATOM 0 HB3 HIS B 78 9.695 11.637 4.564 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.627 13.742 3.488 1.00 0.00 H new ATOM 0 HE1 HIS B 78 9.382 16.354 5.325 1.00 0.00 H new ATOM 0 HE2 HIS B 78 7.227 16.261 3.970 1.00 0.00 H new ATOM 2216 N PHE B 79 7.105 11.881 1.377 1.00 0.00 N ATOM 2217 CA PHE B 79 7.178 12.480 0.053 1.00 0.00 C ATOM 2218 C PHE B 79 7.219 13.994 0.199 1.00 0.00 C ATOM 2219 O PHE B 79 6.334 14.588 0.817 1.00 0.00 O ATOM 2220 CB PHE B 79 5.966 12.072 -0.791 1.00 0.00 C ATOM 2221 CG PHE B 79 5.820 10.588 -0.986 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.487 9.761 0.076 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.008 10.022 -2.233 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.347 8.399 -0.105 1.00 0.00 C ATOM 2225 CE2 PHE B 79 5.870 8.660 -2.420 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.539 7.849 -1.354 1.00 0.00 C ATOM 0 H PHE B 79 6.162 11.613 1.658 1.00 0.00 H new ATOM 0 HA PHE B 79 8.079 12.129 -0.450 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.062 12.455 -0.317 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.041 12.550 -1.768 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.335 10.187 1.057 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.266 10.652 -3.071 1.00 0.00 H new ATOM 0 HE1 PHE B 79 5.088 7.766 0.731 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.021 8.231 -3.399 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.430 6.784 -1.498 1.00 0.00 H new ATOM 2236 N SER B 80 8.233 14.613 -0.370 1.00 0.00 N ATOM 2237 CA SER B 80 8.395 16.053 -0.265 1.00 0.00 C ATOM 2238 C SER B 80 8.472 16.718 -1.634 1.00 0.00 C ATOM 2239 O SER B 80 9.528 17.188 -2.054 1.00 0.00 O ATOM 2240 CB SER B 80 9.641 16.381 0.557 1.00 0.00 C ATOM 2241 OG SER B 80 9.706 15.573 1.723 1.00 0.00 O ATOM 0 H SER B 80 8.959 14.143 -0.911 1.00 0.00 H new ATOM 0 HA SER B 80 7.515 16.450 0.240 1.00 0.00 H new ATOM 0 HB2 SER B 80 10.533 16.224 -0.049 1.00 0.00 H new ATOM 0 HB3 SER B 80 9.629 17.434 0.839 1.00 0.00 H new ATOM 0 HG SER B 80 8.945 15.777 2.305 1.00 0.00 H new ATOM 2247 N ASN B 81 7.368 16.683 -2.357 1.00 0.00 N ATOM 2248 CA ASN B 81 7.284 17.334 -3.648 1.00 0.00 C ATOM 2249 C ASN B 81 6.078 18.260 -3.638 1.00 0.00 C ATOM 2250 O ASN B 81 5.430 18.486 -4.661 1.00 0.00 O ATOM 2251 CB ASN B 81 7.176 16.299 -4.753 1.00 0.00 C ATOM 2252 CG ASN B 81 7.529 16.856 -6.116 1.00 0.00 C ATOM 2253 OD1 ASN B 81 8.227 17.858 -6.239 1.00 0.00 O ATOM 2254 ND2 ASN B 81 7.076 16.179 -7.147 1.00 0.00 N ATOM 0 H ASN B 81 6.513 16.207 -2.068 1.00 0.00 H new ATOM 0 HA ASN B 81 8.185 17.918 -3.838 1.00 0.00 H new ATOM 0 HB2 ASN B 81 7.836 15.462 -4.526 1.00 0.00 H new ATOM 0 HB3 ASN B 81 6.160 15.906 -4.778 1.00 0.00 H new ATOM 0 HD21 ASN B 81 7.302 16.481 -8.095 1.00 0.00 H new ATOM 0 HD22 ASN B 81 6.499 15.351 -7.000 1.00 0.00 H new ATOM 2261 N GLU B 82 5.806 18.758 -2.429 1.00 0.00 N ATOM 2262 CA GLU B 82 4.710 19.676 -2.100 1.00 0.00 C ATOM 2263 C GLU B 82 3.491 19.547 -3.009 1.00 0.00 C ATOM 2264 O GLU B 82 2.560 18.793 -2.712 1.00 0.00 O ATOM 2265 CB GLU B 82 5.222 21.120 -2.094 1.00 0.00 C ATOM 2266 CG GLU B 82 5.979 21.494 -0.824 1.00 0.00 C ATOM 2267 CD GLU B 82 7.254 20.691 -0.632 1.00 0.00 C ATOM 2268 OE1 GLU B 82 7.160 19.508 -0.226 1.00 0.00 O ATOM 2269 OE2 GLU B 82 8.342 21.237 -0.895 1.00 0.00 O ATOM 0 H GLU B 82 6.371 18.521 -1.613 1.00 0.00 H new ATOM 0 HA GLU B 82 4.366 19.393 -1.105 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.876 21.269 -2.954 1.00 0.00 H new ATOM 0 HB3 GLU B 82 4.376 21.797 -2.216 1.00 0.00 H new ATOM 0 HG2 GLU B 82 6.226 22.555 -0.855 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.328 21.343 0.037 1.00 0.00 H new ATOM 2276 N SER B 83 3.521 20.279 -4.114 1.00 0.00 N ATOM 2277 CA SER B 83 2.438 20.309 -5.085 1.00 0.00 C ATOM 2278 C SER B 83 1.905 18.914 -5.440 1.00 0.00 C ATOM 2279 O SER B 83 0.691 18.728 -5.602 1.00 0.00 O ATOM 2280 CB SER B 83 2.928 21.017 -6.345 1.00 0.00 C ATOM 2281 OG SER B 83 4.108 21.758 -6.072 1.00 0.00 O ATOM 0 H SER B 83 4.309 20.876 -4.364 1.00 0.00 H new ATOM 0 HA SER B 83 1.605 20.849 -4.634 1.00 0.00 H new ATOM 0 HB2 SER B 83 3.125 20.284 -7.128 1.00 0.00 H new ATOM 0 HB3 SER B 83 2.151 21.684 -6.720 1.00 0.00 H new ATOM 0 HG SER B 83 4.410 22.205 -6.890 1.00 0.00 H new ATOM 2287 N THR B 84 2.789 17.934 -5.556 1.00 0.00 N ATOM 2288 CA THR B 84 2.357 16.592 -5.909 1.00 0.00 C ATOM 2289 C THR B 84 2.732 15.564 -4.861 1.00 0.00 C ATOM 2290 O THR B 84 2.462 14.385 -5.052 1.00 0.00 O ATOM 2291 CB THR B 84 2.952 16.138 -7.243 1.00 0.00 C ATOM 2292 OG1 THR B 84 4.363 15.976 -7.116 1.00 0.00 O ATOM 2293 CG2 THR B 84 2.673 17.149 -8.330 1.00 0.00 C ATOM 0 H THR B 84 3.793 18.040 -5.413 1.00 0.00 H new ATOM 0 HA THR B 84 1.271 16.652 -5.982 1.00 0.00 H new ATOM 0 HB THR B 84 2.489 15.189 -7.512 1.00 0.00 H new ATOM 0 HG1 THR B 84 4.557 15.108 -6.705 1.00 0.00 H new ATOM 0 HG21 THR B 84 3.106 16.803 -9.268 1.00 0.00 H new ATOM 0 HG22 THR B 84 1.596 17.267 -8.449 1.00 0.00 H new ATOM 0 HG23 THR B 84 3.115 18.107 -8.058 1.00 0.00 H new ATOM 2301 N ALA B 85 3.338 16.005 -3.765 1.00 0.00 N ATOM 2302 CA ALA B 85 3.750 15.089 -2.704 1.00 0.00 C ATOM 2303 C ALA B 85 2.615 14.136 -2.347 1.00 0.00 C ATOM 2304 O ALA B 85 2.775 12.916 -2.409 1.00 0.00 O ATOM 2305 CB ALA B 85 4.212 15.865 -1.485 1.00 0.00 C ATOM 0 H ALA B 85 3.555 16.986 -3.586 1.00 0.00 H new ATOM 0 HA ALA B 85 4.588 14.493 -3.066 1.00 0.00 H new ATOM 0 HB1 ALA B 85 4.516 15.168 -0.704 1.00 0.00 H new ATOM 0 HB2 ALA B 85 5.057 16.498 -1.755 1.00 0.00 H new ATOM 0 HB3 ALA B 85 3.395 16.487 -1.119 1.00 0.00 H new ATOM 2311 N VAL B 86 1.466 14.707 -1.991 1.00 0.00 N ATOM 2312 CA VAL B 86 0.276 13.928 -1.650 1.00 0.00 C ATOM 2313 C VAL B 86 -0.089 12.940 -2.755 1.00 0.00 C ATOM 2314 O VAL B 86 -0.277 11.757 -2.493 1.00 0.00 O ATOM 2315 CB VAL B 86 -0.924 14.866 -1.349 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -2.245 14.241 -1.771 1.00 0.00 C ATOM 2317 CG2 VAL B 86 -0.991 15.204 0.131 1.00 0.00 C ATOM 0 H VAL B 86 1.333 15.717 -1.931 1.00 0.00 H new ATOM 0 HA VAL B 86 0.509 13.353 -0.754 1.00 0.00 H new ATOM 0 HB VAL B 86 -0.764 15.776 -1.926 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -3.061 14.927 -1.544 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -2.227 14.040 -2.842 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -2.395 13.307 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -1.840 15.862 0.316 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -1.110 14.287 0.709 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -0.071 15.705 0.432 1.00 0.00 H new ATOM 2327 N LYS B 87 -0.135 13.426 -3.989 1.00 0.00 N ATOM 2328 CA LYS B 87 -0.500 12.596 -5.132 1.00 0.00 C ATOM 2329 C LYS B 87 0.512 11.478 -5.351 1.00 0.00 C ATOM 2330 O LYS B 87 0.134 10.361 -5.668 1.00 0.00 O ATOM 2331 CB LYS B 87 -0.609 13.460 -6.393 1.00 0.00 C ATOM 2332 CG LYS B 87 -1.459 14.711 -6.209 1.00 0.00 C ATOM 2333 CD LYS B 87 -1.219 15.714 -7.327 1.00 0.00 C ATOM 2334 CE LYS B 87 -2.121 16.934 -7.196 1.00 0.00 C ATOM 2335 NZ LYS B 87 -1.816 17.736 -5.978 1.00 0.00 N ATOM 0 H LYS B 87 0.077 14.395 -4.225 1.00 0.00 H new ATOM 0 HA LYS B 87 -1.467 12.138 -4.922 1.00 0.00 H new ATOM 0 HB2 LYS B 87 0.392 13.755 -6.708 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -1.032 12.860 -7.198 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -2.513 14.436 -6.185 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -1.228 15.172 -5.249 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -0.176 16.030 -7.314 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -1.394 15.234 -8.290 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -2.009 17.562 -8.079 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -3.162 16.612 -7.165 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -2.319 18.645 -6.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -2.124 17.214 -5.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -0.792 17.910 -5.924 1.00 0.00 H new ATOM 2349 N GLU B 88 1.794 11.779 -5.181 1.00 0.00 N ATOM 2350 CA GLU B 88 2.837 10.777 -5.356 1.00 0.00 C ATOM 2351 C GLU B 88 2.692 9.678 -4.303 1.00 0.00 C ATOM 2352 O GLU B 88 2.804 8.489 -4.611 1.00 0.00 O ATOM 2353 CB GLU B 88 4.222 11.430 -5.305 1.00 0.00 C ATOM 2354 CG GLU B 88 4.626 12.074 -6.627 1.00 0.00 C ATOM 2355 CD GLU B 88 5.881 12.919 -6.522 1.00 0.00 C ATOM 2356 OE1 GLU B 88 5.789 14.053 -6.019 1.00 0.00 O ATOM 2357 OE2 GLU B 88 6.962 12.467 -6.961 1.00 0.00 O ATOM 0 H GLU B 88 2.135 12.705 -4.923 1.00 0.00 H new ATOM 0 HA GLU B 88 2.728 10.316 -6.338 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.232 12.187 -4.520 1.00 0.00 H new ATOM 0 HB3 GLU B 88 4.962 10.678 -5.032 1.00 0.00 H new ATOM 0 HG2 GLU B 88 4.783 11.293 -7.371 1.00 0.00 H new ATOM 0 HG3 GLU B 88 3.806 12.696 -6.986 1.00 0.00 H new ATOM 2364 N ARG B 89 2.420 10.078 -3.062 1.00 0.00 N ATOM 2365 CA ARG B 89 2.214 9.117 -1.982 1.00 0.00 C ATOM 2366 C ARG B 89 0.946 8.332 -2.249 1.00 0.00 C ATOM 2367 O ARG B 89 0.923 7.107 -2.158 1.00 0.00 O ATOM 2368 CB ARG B 89 2.089 9.818 -0.630 1.00 0.00 C ATOM 2369 CG ARG B 89 1.485 8.934 0.454 1.00 0.00 C ATOM 2370 CD ARG B 89 1.023 9.730 1.668 1.00 0.00 C ATOM 2371 NE ARG B 89 0.057 10.784 1.342 1.00 0.00 N ATOM 2372 CZ ARG B 89 -1.132 10.577 0.769 1.00 0.00 C ATOM 2373 NH1 ARG B 89 -1.546 9.345 0.503 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -1.923 11.606 0.497 1.00 0.00 N ATOM 0 H ARG B 89 2.338 11.055 -2.781 1.00 0.00 H new ATOM 0 HA ARG B 89 3.077 8.452 -1.948 1.00 0.00 H new ATOM 0 HB2 ARG B 89 3.076 10.152 -0.309 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.473 10.710 -0.747 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.639 8.385 0.041 1.00 0.00 H new ATOM 0 HG3 ARG B 89 2.222 8.195 0.768 1.00 0.00 H new ATOM 0 HD2 ARG B 89 0.575 9.048 2.391 1.00 0.00 H new ATOM 0 HD3 ARG B 89 1.891 10.180 2.150 1.00 0.00 H new ATOM 0 HE ARG B 89 0.311 11.745 1.569 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -0.955 8.547 0.736 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -2.455 9.196 0.065 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -1.623 12.554 0.725 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -2.831 11.450 0.060 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.109 9.065 -2.574 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.403 8.480 -2.878 1.00 0.00 C ATOM 2390 C ASP B 90 -1.309 7.524 -4.038 1.00 0.00 C ATOM 2391 O ASP B 90 -1.981 6.503 -4.058 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.431 9.575 -3.181 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.188 9.991 -1.945 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.580 9.090 -1.168 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -3.366 11.200 -1.722 1.00 0.00 O ATOM 0 H ASP B 90 -0.090 10.083 -2.634 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.730 7.922 -2.001 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.924 10.442 -3.606 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.133 9.216 -3.933 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.439 7.839 -4.968 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.251 7.008 -6.156 1.00 0.00 C ATOM 2402 C ALA B 91 0.380 5.689 -5.779 1.00 0.00 C ATOM 2403 O ALA B 91 -0.084 4.616 -6.168 1.00 0.00 O ATOM 2404 CB ALA B 91 0.633 7.717 -7.160 1.00 0.00 C ATOM 0 H ALA B 91 0.157 8.666 -4.934 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.228 6.825 -6.603 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.764 7.086 -8.039 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.167 8.657 -7.454 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.605 7.919 -6.710 1.00 0.00 H new ATOM 2410 N VAL B 92 1.450 5.796 -5.025 1.00 0.00 N ATOM 2411 CA VAL B 92 2.173 4.645 -4.544 1.00 0.00 C ATOM 2412 C VAL B 92 1.234 3.788 -3.716 1.00 0.00 C ATOM 2413 O VAL B 92 1.129 2.581 -3.906 1.00 0.00 O ATOM 2414 CB VAL B 92 3.361 5.125 -3.696 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.731 4.131 -2.621 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.555 5.411 -4.573 1.00 0.00 C ATOM 0 H VAL B 92 1.844 6.689 -4.728 1.00 0.00 H new ATOM 0 HA VAL B 92 2.551 4.051 -5.376 1.00 0.00 H new ATOM 0 HB VAL B 92 3.051 6.045 -3.200 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.575 4.513 -2.047 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.880 3.980 -1.957 1.00 0.00 H new ATOM 0 HG13 VAL B 92 4.005 3.182 -3.082 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.387 5.750 -3.956 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.843 4.503 -5.103 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.299 6.187 -5.294 1.00 0.00 H new ATOM 2426 N LYS B 93 0.524 4.467 -2.834 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.451 3.864 -1.947 1.00 0.00 C ATOM 2428 C LYS B 93 -1.542 3.185 -2.737 1.00 0.00 C ATOM 2429 O LYS B 93 -1.989 2.099 -2.388 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.060 4.974 -1.106 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.319 4.587 -0.370 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.038 5.822 0.113 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.275 6.120 -0.708 1.00 0.00 C ATOM 2434 NZ LYS B 93 -3.962 6.563 -2.096 1.00 0.00 N ATOM 0 H LYS B 93 0.612 5.476 -2.712 1.00 0.00 H new ATOM 0 HA LYS B 93 0.034 3.115 -1.321 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.319 5.310 -0.380 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.280 5.823 -1.753 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -2.971 4.011 -1.027 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.072 3.946 0.476 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.320 5.691 1.158 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.361 6.675 0.070 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -4.900 5.228 -0.750 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -4.858 6.894 -0.209 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.731 6.274 -2.734 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.865 7.598 -2.117 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -3.071 6.126 -2.407 1.00 0.00 H new ATOM 2448 N ASP B 94 -1.981 3.847 -3.790 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.023 3.309 -4.628 1.00 0.00 C ATOM 2450 C ASP B 94 -2.607 1.956 -5.168 1.00 0.00 C ATOM 2451 O ASP B 94 -3.257 0.946 -4.909 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.350 4.249 -5.777 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.464 5.212 -5.411 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -4.844 5.257 -4.211 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -4.960 5.918 -6.304 1.00 0.00 O ATOM 0 H ASP B 94 -1.629 4.759 -4.082 1.00 0.00 H new ATOM 0 HA ASP B 94 -3.920 3.196 -4.019 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.458 4.811 -6.053 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.643 3.668 -6.651 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.489 1.952 -5.888 1.00 0.00 N ATOM 2461 CA LEU B 95 -0.937 0.737 -6.472 1.00 0.00 C ATOM 2462 C LEU B 95 -0.683 -0.304 -5.391 1.00 0.00 C ATOM 2463 O LEU B 95 -1.050 -1.471 -5.536 1.00 0.00 O ATOM 2464 CB LEU B 95 0.358 1.067 -7.218 1.00 0.00 C ATOM 2465 CG LEU B 95 0.349 0.772 -8.725 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.041 0.976 -9.311 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.355 1.662 -9.439 1.00 0.00 C ATOM 0 H LEU B 95 -0.942 2.791 -6.082 1.00 0.00 H new ATOM 0 HA LEU B 95 -1.656 0.322 -7.179 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.580 2.125 -7.074 1.00 0.00 H new ATOM 0 HB3 LEU B 95 1.173 0.506 -6.761 1.00 0.00 H new ATOM 0 HG LEU B 95 0.631 -0.271 -8.870 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.021 0.761 -10.379 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -1.745 0.305 -8.819 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.354 2.008 -9.155 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.340 1.444 -10.507 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.094 2.708 -9.278 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.353 1.473 -9.044 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.074 0.147 -4.304 1.00 0.00 N ATOM 2480 CA LEU B 96 0.234 -0.701 -3.162 1.00 0.00 C ATOM 2481 C LEU B 96 -1.018 -1.409 -2.660 1.00 0.00 C ATOM 2482 O LEU B 96 -1.105 -2.634 -2.701 1.00 0.00 O ATOM 2483 CB LEU B 96 0.835 0.160 -2.054 1.00 0.00 C ATOM 2484 CG LEU B 96 2.337 0.386 -2.166 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.791 1.404 -1.140 1.00 0.00 C ATOM 2486 CD2 LEU B 96 3.093 -0.920 -2.002 1.00 0.00 C ATOM 0 H LEU B 96 0.222 1.116 -4.189 1.00 0.00 H new ATOM 0 HA LEU B 96 0.950 -1.465 -3.465 1.00 0.00 H new ATOM 0 HB2 LEU B 96 0.335 1.128 -2.054 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.623 -0.309 -1.093 1.00 0.00 H new ATOM 0 HG LEU B 96 2.555 0.776 -3.160 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.866 1.557 -1.230 1.00 0.00 H new ATOM 0 HD12 LEU B 96 2.275 2.349 -1.311 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.559 1.040 -0.139 1.00 0.00 H new ATOM 0 HD21 LEU B 96 4.164 -0.734 -2.086 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.874 -1.346 -1.023 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.785 -1.619 -2.779 1.00 0.00 H new ATOM 2498 N GLN B 97 -1.981 -0.615 -2.209 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.254 -1.114 -1.702 1.00 0.00 C ATOM 2500 C GLN B 97 -3.913 -2.119 -2.663 1.00 0.00 C ATOM 2501 O GLN B 97 -4.402 -3.157 -2.231 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.164 0.081 -1.408 1.00 0.00 C ATOM 2503 CG GLN B 97 -5.646 -0.153 -1.614 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.373 1.126 -1.993 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -7.530 1.328 -1.638 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -5.692 2.002 -2.723 1.00 0.00 N ATOM 0 H GLN B 97 -1.900 0.402 -2.184 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.077 -1.669 -0.781 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.004 0.390 -0.375 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -3.855 0.913 -2.041 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -5.791 -0.898 -2.396 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.080 -0.560 -0.701 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -4.731 1.798 -2.999 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -6.130 2.878 -3.008 1.00 0.00 H new ATOM 2515 N GLN B 98 -3.872 -1.827 -3.963 1.00 0.00 N ATOM 2516 CA GLN B 98 -4.494 -2.696 -4.974 1.00 0.00 C ATOM 2517 C GLN B 98 -3.792 -4.043 -5.120 1.00 0.00 C ATOM 2518 O GLN B 98 -4.435 -5.097 -5.148 1.00 0.00 O ATOM 2519 CB GLN B 98 -4.487 -2.032 -6.358 1.00 0.00 C ATOM 2520 CG GLN B 98 -5.163 -0.674 -6.419 1.00 0.00 C ATOM 2521 CD GLN B 98 -6.534 -0.659 -5.783 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -7.272 -1.637 -5.842 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -6.875 0.457 -5.170 1.00 0.00 N ATOM 0 H GLN B 98 -3.417 -0.998 -4.345 1.00 0.00 H new ATOM 0 HA GLN B 98 -5.512 -2.857 -4.618 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -3.454 -1.922 -6.687 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -4.978 -2.698 -7.067 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -4.531 0.061 -5.921 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -5.250 -0.366 -7.461 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -6.227 1.245 -5.147 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -7.787 0.533 -4.719 1.00 0.00 H new ATOM 2532 N LEU B 99 -2.478 -4.002 -5.233 1.00 0.00 N ATOM 2533 CA LEU B 99 -1.683 -5.205 -5.447 1.00 0.00 C ATOM 2534 C LEU B 99 -1.499 -6.029 -4.182 1.00 0.00 C ATOM 2535 O LEU B 99 -1.467 -7.259 -4.243 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.324 -4.815 -6.015 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.371 -4.163 -7.396 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.779 -3.184 -7.563 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.325 -5.228 -8.479 1.00 0.00 C ATOM 0 H LEU B 99 -1.931 -3.143 -5.180 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.227 -5.833 -6.152 1.00 0.00 H new ATOM 0 HB2 LEU B 99 0.161 -4.129 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU B 99 0.301 -5.707 -6.070 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.306 -3.611 -7.489 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.729 -2.729 -8.552 1.00 0.00 H new ATOM 0 HD12 LEU B 99 0.708 -2.406 -6.802 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.726 -3.713 -7.454 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.359 -4.752 -9.459 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.597 -5.802 -8.386 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.180 -5.895 -8.370 1.00 0.00 H new ATOM 2551 N LEU B 100 -1.406 -5.343 -3.054 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.193 -5.970 -1.748 1.00 0.00 C ATOM 2553 C LEU B 100 -1.928 -7.293 -1.519 1.00 0.00 C ATOM 2554 O LEU B 100 -1.275 -8.317 -1.372 1.00 0.00 O ATOM 2555 CB LEU B 100 -1.571 -5.012 -0.631 1.00 0.00 C ATOM 2556 CG LEU B 100 -0.452 -4.137 -0.111 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.004 -3.210 0.959 1.00 0.00 C ATOM 2558 CD2 LEU B 100 0.676 -5.012 0.424 1.00 0.00 C ATOM 0 H LEU B 100 -1.476 -4.326 -3.013 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.129 -6.207 -1.739 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -2.376 -4.368 -0.986 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -1.970 -5.592 0.201 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.042 -3.525 -0.914 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.203 -2.576 1.339 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -1.789 -2.586 0.531 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -1.417 -3.802 1.776 1.00 0.00 H new ATOM 0 HD21 LEU B 100 1.481 -4.379 0.798 1.00 0.00 H new ATOM 0 HD22 LEU B 100 0.299 -5.637 1.234 1.00 0.00 H new ATOM 0 HD23 LEU B 100 1.055 -5.646 -0.377 1.00 0.00 H new ATOM 2570 N PRO B 101 -3.278 -7.322 -1.546 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.051 -8.540 -1.234 1.00 0.00 C ATOM 2572 C PRO B 101 -3.789 -9.722 -2.167 1.00 0.00 C ATOM 2573 O PRO B 101 -4.364 -10.792 -1.987 1.00 0.00 O ATOM 2574 CB PRO B 101 -5.506 -8.082 -1.366 1.00 0.00 C ATOM 2575 CG PRO B 101 -5.441 -6.913 -2.281 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.168 -6.210 -1.927 1.00 0.00 C ATOM 0 HA PRO B 101 -3.775 -8.920 -0.251 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.136 -8.872 -1.774 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -5.926 -7.807 -0.398 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -5.440 -7.229 -3.324 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.303 -6.259 -2.147 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -3.771 -5.644 -2.769 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.309 -5.505 -1.107 1.00 0.00 H new ATOM 2584 N LYS B 102 -2.947 -9.537 -3.170 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.639 -10.621 -4.085 1.00 0.00 C ATOM 2586 C LYS B 102 -1.345 -11.307 -3.681 1.00 0.00 C ATOM 2587 O LYS B 102 -1.068 -12.428 -4.098 1.00 0.00 O ATOM 2588 CB LYS B 102 -2.561 -10.115 -5.520 1.00 0.00 C ATOM 2589 CG LYS B 102 -3.892 -10.215 -6.243 1.00 0.00 C ATOM 2590 CD LYS B 102 -3.930 -9.332 -7.480 1.00 0.00 C ATOM 2591 CE LYS B 102 -3.878 -7.857 -7.110 1.00 0.00 C ATOM 2592 NZ LYS B 102 -4.995 -7.474 -6.204 1.00 0.00 N ATOM 0 H LYS B 102 -2.470 -8.658 -3.369 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.445 -11.353 -4.032 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -2.229 -9.077 -5.519 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -1.811 -10.689 -6.064 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -4.073 -11.251 -6.530 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -4.696 -9.927 -5.566 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -3.089 -9.576 -8.129 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -4.839 -9.535 -8.046 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -2.926 -7.637 -6.626 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -3.922 -7.253 -8.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -5.016 -6.440 -6.097 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -5.897 -7.799 -6.608 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -4.854 -7.916 -5.273 1.00 0.00 H new ATOM 2606 N PHE B 103 -0.563 -10.624 -2.857 1.00 0.00 N ATOM 2607 CA PHE B 103 0.697 -11.158 -2.377 1.00 0.00 C ATOM 2608 C PHE B 103 0.667 -11.263 -0.862 1.00 0.00 C ATOM 2609 O PHE B 103 1.254 -12.176 -0.278 1.00 0.00 O ATOM 2610 CB PHE B 103 1.856 -10.273 -2.839 1.00 0.00 C ATOM 2611 CG PHE B 103 1.853 -10.023 -4.320 1.00 0.00 C ATOM 2612 CD1 PHE B 103 2.259 -11.012 -5.203 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.434 -8.806 -4.831 1.00 0.00 C ATOM 2614 CE1 PHE B 103 2.245 -10.789 -6.567 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.420 -8.577 -6.193 1.00 0.00 C ATOM 2616 CZ PHE B 103 1.825 -9.571 -7.062 1.00 0.00 C ATOM 0 H PHE B 103 -0.784 -9.692 -2.507 1.00 0.00 H new ATOM 0 HA PHE B 103 0.846 -12.155 -2.791 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.807 -9.318 -2.315 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.798 -10.743 -2.558 1.00 0.00 H new ATOM 0 HD1 PHE B 103 2.590 -11.967 -4.821 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.114 -8.026 -4.156 1.00 0.00 H new ATOM 0 HE1 PHE B 103 2.563 -11.567 -7.245 1.00 0.00 H new ATOM 0 HE2 PHE B 103 1.093 -7.622 -6.578 1.00 0.00 H new ATOM 0 HZ PHE B 103 1.813 -9.395 -8.128 1.00 0.00 H new ATOM 2626 N LYS B 104 -0.051 -10.328 -0.250 1.00 0.00 N ATOM 2627 CA LYS B 104 -0.213 -10.246 1.194 1.00 0.00 C ATOM 2628 C LYS B 104 -0.665 -11.582 1.764 1.00 0.00 C ATOM 2629 O LYS B 104 -1.811 -11.990 1.562 1.00 0.00 O ATOM 2630 CB LYS B 104 -1.236 -9.145 1.508 1.00 0.00 C ATOM 2631 CG LYS B 104 -1.585 -8.985 2.975 1.00 0.00 C ATOM 2632 CD LYS B 104 -2.923 -9.627 3.304 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.456 -9.142 4.639 1.00 0.00 C ATOM 2634 NZ LYS B 104 -3.775 -7.692 4.613 1.00 0.00 N ATOM 0 H LYS B 104 -0.546 -9.592 -0.755 1.00 0.00 H new ATOM 0 HA LYS B 104 0.743 -10.002 1.657 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -0.849 -8.196 1.138 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -2.151 -9.354 0.954 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -0.804 -9.436 3.587 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -1.617 -7.925 3.229 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -3.642 -9.396 2.518 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -2.812 -10.711 3.327 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -4.352 -9.706 4.899 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -2.718 -9.338 5.417 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.152 -7.403 5.538 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -2.912 -7.150 4.406 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -4.485 -7.506 3.876 1.00 0.00 H new