USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 822 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: A 270 SER OG : rot 75:sc= 1.41 USER MOD Set 1.2: B 68 HIS :FLIP no HE2:sc= -0.636 F(o=-1.1,f=0.77) USER MOD Single : A 255 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 LYS NZ :NH3+ 167:sc= -0.04 (180deg=-0.227) USER MOD Single : A 272 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 274 SER OG : rot 76:sc= 0.116 USER MOD Single : A 276 ASN : amide:sc= 0.0444 K(o=0.044,f=-3!) USER MOD Single : A 277 SER OG : rot 70:sc= 0.0377 USER MOD Single : B 1 MET CE :methyl -157:sc= -0.19 (180deg=-1.25) USER MOD Single : B 1 MET N :NH3+ 172:sc= 2.12 (180deg=1.65) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 180:sc= -0.614 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ 168:sc= -0.0389 (180deg=-0.214) USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.803 USER MOD Single : B 14 THR OG1 : rot -42:sc= 2.02 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 150:sc= 0.418 USER MOD Single : B 25 ASN : amide:sc= -0.502 K(o=-0.5,f=-4.7!) USER MOD Single : B 27 LYS NZ :NH3+ 166:sc= -0.0538 (180deg=-0.269) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 159:sc= -3.91! (180deg=-4.84!) USER MOD Single : B 31 GLN : amide:sc= -1.95 K(o=-1.9,f=-4.4!) USER MOD Single : B 33 LYS NZ :NH3+ -168:sc= -0.0339 (180deg=-0.258) USER MOD Single : B 40 GLN : amide:sc= -2.4 K(o=-2.4,f=-5.5!) USER MOD Single : B 41 GLN : amide:sc= -0.609 K(o=-0.61,f=-4.3!) USER MOD Single : B 48 LYS NZ :NH3+ -166:sc= -0.0427 (180deg=-0.268) USER MOD Single : B 49 GLN : amide:sc= -3.18! C(o=-3.2!,f=-9.3!) USER MOD Single : B 55 THR OG1 : rot 76:sc= -0.293 USER MOD Single : B 57 SER OG : rot -90:sc= -1.32 USER MOD Single : B 59 TYR OH : rot -140:sc=0.000484 USER MOD Single : B 60 ASN :FLIP amide:sc= 0.601 F(o=-1,f=0.6) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 143:sc= -0.0132 (180deg=-0.598) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 255 -25.086 -4.139 5.356 1.00 0.00 N ATOM 2 CA TYR A 255 -24.449 -3.998 4.021 1.00 0.00 C ATOM 3 C TYR A 255 -22.930 -4.143 4.123 1.00 0.00 C ATOM 4 O TYR A 255 -22.288 -3.456 4.918 1.00 0.00 O ATOM 5 CB TYR A 255 -24.812 -2.621 3.457 1.00 0.00 C ATOM 6 CG TYR A 255 -24.327 -2.388 2.042 1.00 0.00 C ATOM 7 CD1 TYR A 255 -24.680 -3.253 1.014 1.00 0.00 C ATOM 8 CD2 TYR A 255 -23.517 -1.302 1.736 1.00 0.00 C ATOM 9 CE1 TYR A 255 -24.239 -3.043 -0.279 1.00 0.00 C ATOM 10 CE2 TYR A 255 -23.072 -1.085 0.446 1.00 0.00 C ATOM 11 CZ TYR A 255 -23.436 -1.958 -0.557 1.00 0.00 C ATOM 12 OH TYR A 255 -22.995 -1.745 -1.843 1.00 0.00 O ATOM 0 HA TYR A 255 -24.812 -4.784 3.359 1.00 0.00 H new ATOM 0 HB2 TYR A 255 -25.895 -2.503 3.483 1.00 0.00 H new ATOM 0 HB3 TYR A 255 -24.392 -1.852 4.105 1.00 0.00 H new ATOM 0 HD1 TYR A 255 -25.310 -4.104 1.229 1.00 0.00 H new ATOM 0 HD2 TYR A 255 -23.230 -0.616 2.519 1.00 0.00 H new ATOM 0 HE1 TYR A 255 -24.522 -3.725 -1.067 1.00 0.00 H new ATOM 0 HE2 TYR A 255 -22.442 -0.236 0.225 1.00 0.00 H new ATOM 0 HH TYR A 255 -22.440 -0.937 -1.869 1.00 0.00 H new ATOM 24 N PRO A 256 -22.331 -5.043 3.321 1.00 0.00 N ATOM 25 CA PRO A 256 -20.881 -5.270 3.333 1.00 0.00 C ATOM 26 C PRO A 256 -20.096 -4.040 2.885 1.00 0.00 C ATOM 27 O PRO A 256 -20.438 -3.403 1.888 1.00 0.00 O ATOM 28 CB PRO A 256 -20.682 -6.420 2.340 1.00 0.00 C ATOM 29 CG PRO A 256 -21.893 -6.397 1.473 1.00 0.00 C ATOM 30 CD PRO A 256 -23.015 -5.911 2.345 1.00 0.00 C ATOM 0 HA PRO A 256 -20.518 -5.492 4.336 1.00 0.00 H new ATOM 0 HB2 PRO A 256 -19.774 -6.281 1.753 1.00 0.00 H new ATOM 0 HB3 PRO A 256 -20.585 -7.375 2.857 1.00 0.00 H new ATOM 0 HG2 PRO A 256 -21.749 -5.736 0.618 1.00 0.00 H new ATOM 0 HG3 PRO A 256 -22.108 -7.389 1.076 1.00 0.00 H new ATOM 0 HD2 PRO A 256 -23.762 -5.362 1.772 1.00 0.00 H new ATOM 0 HD3 PRO A 256 -23.532 -6.737 2.833 1.00 0.00 H new ATOM 38 N GLU A 257 -19.043 -3.714 3.629 1.00 0.00 N ATOM 39 CA GLU A 257 -18.205 -2.562 3.311 1.00 0.00 C ATOM 40 C GLU A 257 -17.492 -2.758 1.976 1.00 0.00 C ATOM 41 O GLU A 257 -16.904 -3.810 1.725 1.00 0.00 O ATOM 42 CB GLU A 257 -17.176 -2.336 4.421 1.00 0.00 C ATOM 43 CG GLU A 257 -16.259 -1.145 4.179 1.00 0.00 C ATOM 44 CD GLU A 257 -17.002 0.178 4.160 1.00 0.00 C ATOM 45 OE1 GLU A 257 -17.869 0.363 3.280 1.00 0.00 O ATOM 46 OE2 GLU A 257 -16.716 1.029 5.028 1.00 0.00 O ATOM 0 H GLU A 257 -18.749 -4.232 4.457 1.00 0.00 H new ATOM 0 HA GLU A 257 -18.849 -1.686 3.233 1.00 0.00 H new ATOM 0 HB2 GLU A 257 -17.701 -2.192 5.366 1.00 0.00 H new ATOM 0 HB3 GLU A 257 -16.568 -3.234 4.528 1.00 0.00 H new ATOM 0 HG2 GLU A 257 -15.496 -1.116 4.957 1.00 0.00 H new ATOM 0 HG3 GLU A 257 -15.741 -1.279 3.229 1.00 0.00 H new ATOM 53 N ASP A 258 -17.547 -1.737 1.126 1.00 0.00 N ATOM 54 CA ASP A 258 -16.904 -1.796 -0.182 1.00 0.00 C ATOM 55 C ASP A 258 -15.384 -1.724 -0.051 1.00 0.00 C ATOM 56 O ASP A 258 -14.657 -2.398 -0.780 1.00 0.00 O ATOM 57 CB ASP A 258 -17.416 -0.664 -1.081 1.00 0.00 C ATOM 58 CG ASP A 258 -17.199 0.710 -0.477 1.00 0.00 C ATOM 59 OD1 ASP A 258 -16.028 1.108 -0.302 1.00 0.00 O ATOM 60 OD2 ASP A 258 -18.203 1.391 -0.180 1.00 0.00 O ATOM 0 H ASP A 258 -18.030 -0.860 1.320 1.00 0.00 H new ATOM 0 HA ASP A 258 -17.159 -2.751 -0.640 1.00 0.00 H new ATOM 0 HB2 ASP A 258 -16.911 -0.716 -2.046 1.00 0.00 H new ATOM 0 HB3 ASP A 258 -18.480 -0.809 -1.270 1.00 0.00 H new ATOM 65 N GLU A 259 -14.912 -0.899 0.880 1.00 0.00 N ATOM 66 CA GLU A 259 -13.482 -0.731 1.106 1.00 0.00 C ATOM 67 C GLU A 259 -12.826 -2.051 1.495 1.00 0.00 C ATOM 68 O GLU A 259 -11.768 -2.406 0.975 1.00 0.00 O ATOM 69 CB GLU A 259 -13.244 0.306 2.202 1.00 0.00 C ATOM 70 CG GLU A 259 -11.775 0.558 2.488 1.00 0.00 C ATOM 71 CD GLU A 259 -11.562 1.537 3.625 1.00 0.00 C ATOM 72 OE1 GLU A 259 -12.566 1.987 4.216 1.00 0.00 O ATOM 73 OE2 GLU A 259 -10.391 1.851 3.926 1.00 0.00 O ATOM 0 H GLU A 259 -15.503 -0.335 1.491 1.00 0.00 H new ATOM 0 HA GLU A 259 -13.032 -0.387 0.175 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -13.716 1.245 1.912 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -13.733 -0.026 3.118 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -11.289 -0.387 2.731 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -11.294 0.942 1.588 1.00 0.00 H new ATOM 80 N GLU A 260 -13.459 -2.770 2.416 1.00 0.00 N ATOM 81 CA GLU A 260 -12.940 -4.050 2.882 1.00 0.00 C ATOM 82 C GLU A 260 -12.765 -5.026 1.723 1.00 0.00 C ATOM 83 O GLU A 260 -11.839 -5.836 1.719 1.00 0.00 O ATOM 84 CB GLU A 260 -13.875 -4.651 3.934 1.00 0.00 C ATOM 85 CG GLU A 260 -14.023 -3.789 5.177 1.00 0.00 C ATOM 86 CD GLU A 260 -14.952 -4.403 6.208 1.00 0.00 C ATOM 87 OE1 GLU A 260 -15.486 -5.502 5.948 1.00 0.00 O ATOM 88 OE2 GLU A 260 -15.145 -3.784 7.275 1.00 0.00 O ATOM 0 H GLU A 260 -14.335 -2.487 2.855 1.00 0.00 H new ATOM 0 HA GLU A 260 -11.963 -3.873 3.332 1.00 0.00 H new ATOM 0 HB2 GLU A 260 -14.858 -4.805 3.489 1.00 0.00 H new ATOM 0 HB3 GLU A 260 -13.499 -5.632 4.225 1.00 0.00 H new ATOM 0 HG2 GLU A 260 -13.042 -3.633 5.625 1.00 0.00 H new ATOM 0 HG3 GLU A 260 -14.402 -2.808 4.891 1.00 0.00 H new ATOM 95 N GLU A 261 -13.664 -4.947 0.747 1.00 0.00 N ATOM 96 CA GLU A 261 -13.614 -5.829 -0.415 1.00 0.00 C ATOM 97 C GLU A 261 -12.296 -5.679 -1.172 1.00 0.00 C ATOM 98 O GLU A 261 -11.599 -6.663 -1.415 1.00 0.00 O ATOM 99 CB GLU A 261 -14.789 -5.535 -1.351 1.00 0.00 C ATOM 100 CG GLU A 261 -14.837 -6.432 -2.579 1.00 0.00 C ATOM 101 CD GLU A 261 -15.075 -7.891 -2.235 1.00 0.00 C ATOM 102 OE1 GLU A 261 -14.234 -8.482 -1.525 1.00 0.00 O ATOM 103 OE2 GLU A 261 -16.104 -8.444 -2.679 1.00 0.00 O ATOM 0 H GLU A 261 -14.437 -4.281 0.737 1.00 0.00 H new ATOM 0 HA GLU A 261 -13.684 -6.856 -0.058 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -15.720 -5.646 -0.795 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -14.732 -4.496 -1.674 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -15.629 -6.087 -3.244 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -13.899 -6.341 -3.126 1.00 0.00 H new ATOM 110 N LEU A 262 -11.956 -4.448 -1.543 1.00 0.00 N ATOM 111 CA LEU A 262 -10.718 -4.188 -2.274 1.00 0.00 C ATOM 112 C LEU A 262 -9.498 -4.526 -1.424 1.00 0.00 C ATOM 113 O LEU A 262 -8.534 -5.116 -1.914 1.00 0.00 O ATOM 114 CB LEU A 262 -10.643 -2.726 -2.733 1.00 0.00 C ATOM 115 CG LEU A 262 -11.600 -2.329 -3.864 1.00 0.00 C ATOM 116 CD1 LEU A 262 -11.454 -3.267 -5.054 1.00 0.00 C ATOM 117 CD2 LEU A 262 -13.041 -2.304 -3.377 1.00 0.00 C ATOM 0 H LEU A 262 -12.517 -3.618 -1.351 1.00 0.00 H new ATOM 0 HA LEU A 262 -10.720 -4.830 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -10.841 -2.085 -1.874 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -9.623 -2.519 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 262 -11.333 -1.323 -4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -12.143 -2.964 -5.842 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -10.431 -3.223 -5.429 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -11.683 -4.287 -4.744 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -13.698 -2.020 -4.199 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -13.320 -3.294 -3.015 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -13.139 -1.581 -2.567 1.00 0.00 H new ATOM 129 N ILE A 263 -9.544 -4.146 -0.152 1.00 0.00 N ATOM 130 CA ILE A 263 -8.441 -4.405 0.766 1.00 0.00 C ATOM 131 C ILE A 263 -8.107 -5.896 0.837 1.00 0.00 C ATOM 132 O ILE A 263 -6.950 -6.284 0.671 1.00 0.00 O ATOM 133 CB ILE A 263 -8.761 -3.878 2.183 1.00 0.00 C ATOM 134 CG1 ILE A 263 -8.593 -2.359 2.243 1.00 0.00 C ATOM 135 CG2 ILE A 263 -7.887 -4.559 3.232 1.00 0.00 C ATOM 136 CD1 ILE A 263 -8.919 -1.760 3.595 1.00 0.00 C ATOM 0 H ILE A 263 -10.335 -3.657 0.267 1.00 0.00 H new ATOM 0 HA ILE A 263 -7.573 -3.873 0.377 1.00 0.00 H new ATOM 0 HB ILE A 263 -9.801 -4.118 2.405 1.00 0.00 H new ATOM 0 HG12 ILE A 263 -7.565 -2.106 1.982 1.00 0.00 H new ATOM 0 HG13 ILE A 263 -9.235 -1.902 1.490 1.00 0.00 H new ATOM 0 HG21 ILE A 263 -8.133 -4.169 4.220 1.00 0.00 H new ATOM 0 HG22 ILE A 263 -8.065 -5.634 3.212 1.00 0.00 H new ATOM 0 HG23 ILE A 263 -6.837 -4.361 3.015 1.00 0.00 H new ATOM 0 HD11 ILE A 263 -8.776 -0.680 3.558 1.00 0.00 H new ATOM 0 HD12 ILE A 263 -9.955 -1.981 3.850 1.00 0.00 H new ATOM 0 HD13 ILE A 263 -8.260 -2.188 4.351 1.00 0.00 H new ATOM 148 N ARG A 264 -9.116 -6.729 1.088 1.00 0.00 N ATOM 149 CA ARG A 264 -8.900 -8.170 1.185 1.00 0.00 C ATOM 150 C ARG A 264 -8.435 -8.755 -0.142 1.00 0.00 C ATOM 151 O ARG A 264 -7.540 -9.598 -0.167 1.00 0.00 O ATOM 152 CB ARG A 264 -10.155 -8.890 1.666 1.00 0.00 C ATOM 153 CG ARG A 264 -11.361 -8.703 0.762 1.00 0.00 C ATOM 154 CD ARG A 264 -12.572 -9.457 1.288 1.00 0.00 C ATOM 155 NE ARG A 264 -12.963 -9.005 2.621 1.00 0.00 N ATOM 156 CZ ARG A 264 -13.966 -9.534 3.316 1.00 0.00 C ATOM 157 NH1 ARG A 264 -14.674 -10.535 2.809 1.00 0.00 N ATOM 158 NH2 ARG A 264 -14.261 -9.065 4.521 1.00 0.00 N ATOM 0 H ARG A 264 -10.082 -6.434 1.227 1.00 0.00 H new ATOM 0 HA ARG A 264 -8.112 -8.324 1.922 1.00 0.00 H new ATOM 0 HB2 ARG A 264 -9.940 -9.955 1.751 1.00 0.00 H new ATOM 0 HB3 ARG A 264 -10.405 -8.534 2.666 1.00 0.00 H new ATOM 0 HG2 ARG A 264 -11.597 -7.642 0.683 1.00 0.00 H new ATOM 0 HG3 ARG A 264 -11.122 -9.052 -0.243 1.00 0.00 H new ATOM 0 HD2 ARG A 264 -13.408 -9.325 0.601 1.00 0.00 H new ATOM 0 HD3 ARG A 264 -12.350 -10.524 1.318 1.00 0.00 H new ATOM 0 HE ARG A 264 -12.437 -8.240 3.043 1.00 0.00 H new ATOM 0 HH11 ARG A 264 -14.450 -10.901 1.884 1.00 0.00 H new ATOM 0 HH12 ARG A 264 -15.443 -10.939 3.345 1.00 0.00 H new ATOM 0 HH21 ARG A 264 -13.718 -8.297 4.916 1.00 0.00 H new ATOM 0 HH22 ARG A 264 -15.031 -9.472 5.052 1.00 0.00 H new ATOM 172 N LYS A 265 -9.025 -8.302 -1.248 1.00 0.00 N ATOM 173 CA LYS A 265 -8.617 -8.794 -2.558 1.00 0.00 C ATOM 174 C LYS A 265 -7.120 -8.591 -2.708 1.00 0.00 C ATOM 175 O LYS A 265 -6.401 -9.462 -3.202 1.00 0.00 O ATOM 176 CB LYS A 265 -9.365 -8.069 -3.679 1.00 0.00 C ATOM 177 CG LYS A 265 -10.851 -8.389 -3.725 1.00 0.00 C ATOM 178 CD LYS A 265 -11.541 -7.697 -4.891 1.00 0.00 C ATOM 179 CE LYS A 265 -10.991 -8.164 -6.230 1.00 0.00 C ATOM 180 NZ LYS A 265 -11.161 -9.631 -6.420 1.00 0.00 N ATOM 0 H LYS A 265 -9.773 -7.608 -1.262 1.00 0.00 H new ATOM 0 HA LYS A 265 -8.861 -9.854 -2.634 1.00 0.00 H new ATOM 0 HB2 LYS A 265 -9.237 -6.994 -3.554 1.00 0.00 H new ATOM 0 HB3 LYS A 265 -8.915 -8.334 -4.636 1.00 0.00 H new ATOM 0 HG2 LYS A 265 -10.988 -9.467 -3.809 1.00 0.00 H new ATOM 0 HG3 LYS A 265 -11.319 -8.080 -2.790 1.00 0.00 H new ATOM 0 HD2 LYS A 265 -12.612 -7.895 -4.849 1.00 0.00 H new ATOM 0 HD3 LYS A 265 -11.412 -6.618 -4.801 1.00 0.00 H new ATOM 0 HE2 LYS A 265 -11.498 -7.633 -7.036 1.00 0.00 H new ATOM 0 HE3 LYS A 265 -9.933 -7.910 -6.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 -10.981 -9.875 -7.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 -10.489 -10.140 -5.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 -12.132 -9.904 -6.167 1.00 0.00 H new ATOM 194 N ALA A 266 -6.658 -7.440 -2.232 1.00 0.00 N ATOM 195 CA ALA A 266 -5.245 -7.113 -2.260 1.00 0.00 C ATOM 196 C ALA A 266 -4.491 -8.043 -1.320 1.00 0.00 C ATOM 197 O ALA A 266 -3.355 -8.430 -1.590 1.00 0.00 O ATOM 198 CB ALA A 266 -5.028 -5.660 -1.865 1.00 0.00 C ATOM 0 H ALA A 266 -7.249 -6.717 -1.821 1.00 0.00 H new ATOM 0 HA ALA A 266 -4.865 -7.247 -3.273 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -3.963 -5.431 -1.891 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -5.556 -5.010 -2.563 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -5.410 -5.496 -0.857 1.00 0.00 H new ATOM 204 N ILE A 267 -5.144 -8.404 -0.214 1.00 0.00 N ATOM 205 CA ILE A 267 -4.547 -9.299 0.768 1.00 0.00 C ATOM 206 C ILE A 267 -4.180 -10.636 0.130 1.00 0.00 C ATOM 207 O ILE A 267 -3.055 -11.117 0.273 1.00 0.00 O ATOM 208 CB ILE A 267 -5.496 -9.552 1.961 1.00 0.00 C ATOM 209 CG1 ILE A 267 -5.778 -8.246 2.709 1.00 0.00 C ATOM 210 CG2 ILE A 267 -4.904 -10.592 2.905 1.00 0.00 C ATOM 211 CD1 ILE A 267 -4.541 -7.593 3.290 1.00 0.00 C ATOM 0 H ILE A 267 -6.085 -8.089 0.020 1.00 0.00 H new ATOM 0 HA ILE A 267 -3.645 -8.810 1.136 1.00 0.00 H new ATOM 0 HB ILE A 267 -6.439 -9.937 1.574 1.00 0.00 H new ATOM 0 HG12 ILE A 267 -6.261 -7.545 2.028 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -6.484 -8.445 3.515 1.00 0.00 H new ATOM 0 HG21 ILE A 267 -5.586 -10.757 3.739 1.00 0.00 H new ATOM 0 HG22 ILE A 267 -4.755 -11.528 2.367 1.00 0.00 H new ATOM 0 HG23 ILE A 267 -3.947 -10.235 3.285 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -4.822 -6.674 3.804 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -4.068 -8.274 3.997 1.00 0.00 H new ATOM 0 HD13 ILE A 267 -3.841 -7.360 2.487 1.00 0.00 H new ATOM 223 N GLU A 268 -5.139 -11.227 -0.576 1.00 0.00 N ATOM 224 CA GLU A 268 -4.928 -12.509 -1.241 1.00 0.00 C ATOM 225 C GLU A 268 -3.859 -12.399 -2.323 1.00 0.00 C ATOM 226 O GLU A 268 -2.971 -13.246 -2.418 1.00 0.00 O ATOM 227 CB GLU A 268 -6.237 -13.009 -1.851 1.00 0.00 C ATOM 228 CG GLU A 268 -7.345 -13.211 -0.830 1.00 0.00 C ATOM 229 CD GLU A 268 -8.630 -13.714 -1.457 1.00 0.00 C ATOM 230 OE1 GLU A 268 -8.608 -14.807 -2.061 1.00 0.00 O ATOM 231 OE2 GLU A 268 -9.659 -13.015 -1.344 1.00 0.00 O ATOM 0 H GLU A 268 -6.073 -10.837 -0.703 1.00 0.00 H new ATOM 0 HA GLU A 268 -4.584 -13.223 -0.493 1.00 0.00 H new ATOM 0 HB2 GLU A 268 -6.573 -12.296 -2.604 1.00 0.00 H new ATOM 0 HB3 GLU A 268 -6.052 -13.952 -2.365 1.00 0.00 H new ATOM 0 HG2 GLU A 268 -7.012 -13.921 -0.073 1.00 0.00 H new ATOM 0 HG3 GLU A 268 -7.539 -12.268 -0.319 1.00 0.00 H new ATOM 238 N LEU A 269 -3.950 -11.351 -3.139 1.00 0.00 N ATOM 239 CA LEU A 269 -2.988 -11.136 -4.213 1.00 0.00 C ATOM 240 C LEU A 269 -1.569 -11.029 -3.661 1.00 0.00 C ATOM 241 O LEU A 269 -0.635 -11.609 -4.211 1.00 0.00 O ATOM 242 CB LEU A 269 -3.341 -9.872 -5.004 1.00 0.00 C ATOM 243 CG LEU A 269 -4.678 -9.922 -5.750 1.00 0.00 C ATOM 244 CD1 LEU A 269 -4.953 -8.597 -6.445 1.00 0.00 C ATOM 245 CD2 LEU A 269 -4.687 -11.063 -6.759 1.00 0.00 C ATOM 0 H LEU A 269 -4.679 -10.640 -3.076 1.00 0.00 H new ATOM 0 HA LEU A 269 -3.033 -11.995 -4.882 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -3.358 -9.026 -4.317 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -2.547 -9.681 -5.726 1.00 0.00 H new ATOM 0 HG LEU A 269 -5.469 -10.100 -5.021 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -5.907 -8.652 -6.969 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -4.992 -7.799 -5.704 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -4.157 -8.389 -7.160 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -5.645 -11.082 -7.278 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -3.885 -10.916 -7.482 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -4.537 -12.009 -6.239 1.00 0.00 H new ATOM 257 N SER A 270 -1.418 -10.284 -2.570 1.00 0.00 N ATOM 258 CA SER A 270 -0.113 -10.100 -1.943 1.00 0.00 C ATOM 259 C SER A 270 0.453 -11.427 -1.449 1.00 0.00 C ATOM 260 O SER A 270 1.627 -11.729 -1.665 1.00 0.00 O ATOM 261 CB SER A 270 -0.219 -9.118 -0.775 1.00 0.00 C ATOM 262 OG SER A 270 -0.697 -7.857 -1.208 1.00 0.00 O ATOM 0 H SER A 270 -2.183 -9.798 -2.102 1.00 0.00 H new ATOM 0 HA SER A 270 0.564 -9.695 -2.695 1.00 0.00 H new ATOM 0 HB2 SER A 270 -0.888 -9.523 -0.016 1.00 0.00 H new ATOM 0 HB3 SER A 270 0.758 -8.998 -0.307 1.00 0.00 H new ATOM 0 HG SER A 270 -1.659 -7.916 -1.387 1.00 0.00 H new ATOM 268 N LEU A 271 -0.386 -12.212 -0.779 1.00 0.00 N ATOM 269 CA LEU A 271 0.035 -13.505 -0.249 1.00 0.00 C ATOM 270 C LEU A 271 0.549 -14.416 -1.359 1.00 0.00 C ATOM 271 O LEU A 271 1.587 -15.063 -1.213 1.00 0.00 O ATOM 272 CB LEU A 271 -1.125 -14.182 0.486 1.00 0.00 C ATOM 273 CG LEU A 271 -1.673 -13.412 1.690 1.00 0.00 C ATOM 274 CD1 LEU A 271 -2.845 -14.156 2.309 1.00 0.00 C ATOM 275 CD2 LEU A 271 -0.580 -13.183 2.723 1.00 0.00 C ATOM 0 H LEU A 271 -1.360 -11.976 -0.590 1.00 0.00 H new ATOM 0 HA LEU A 271 0.850 -13.329 0.453 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -1.938 -14.343 -0.222 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -0.796 -15.165 0.823 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.025 -12.440 1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.222 -13.594 3.164 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -3.638 -14.266 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -2.517 -15.142 2.639 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -0.990 -12.634 3.571 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.195 -14.144 3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 271 0.229 -12.607 2.275 1.00 0.00 H new ATOM 287 N LYS A 272 -0.184 -14.466 -2.466 1.00 0.00 N ATOM 288 CA LYS A 272 0.197 -15.302 -3.600 1.00 0.00 C ATOM 289 C LYS A 272 1.526 -14.849 -4.200 1.00 0.00 C ATOM 290 O LYS A 272 2.389 -15.672 -4.508 1.00 0.00 O ATOM 291 CB LYS A 272 -0.896 -15.278 -4.669 1.00 0.00 C ATOM 292 CG LYS A 272 -0.568 -16.112 -5.898 1.00 0.00 C ATOM 293 CD LYS A 272 -0.337 -17.572 -5.542 1.00 0.00 C ATOM 294 CE LYS A 272 -0.020 -18.403 -6.775 1.00 0.00 C ATOM 295 NZ LYS A 272 0.213 -19.834 -6.436 1.00 0.00 N ATOM 0 H LYS A 272 -1.046 -13.938 -2.603 1.00 0.00 H new ATOM 0 HA LYS A 272 0.319 -16.322 -3.237 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -1.827 -15.641 -4.233 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -1.069 -14.247 -4.976 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -1.384 -16.037 -6.617 1.00 0.00 H new ATOM 0 HG3 LYS A 272 0.322 -15.711 -6.383 1.00 0.00 H new ATOM 0 HD2 LYS A 272 0.484 -17.648 -4.830 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -1.224 -17.972 -5.050 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -0.844 -18.328 -7.485 1.00 0.00 H new ATOM 0 HE3 LYS A 272 0.864 -17.998 -7.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 0.426 -20.366 -7.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 1.015 -19.909 -5.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -0.639 -20.228 -5.989 1.00 0.00 H new ATOM 309 N GLU A 273 1.683 -13.538 -4.365 1.00 0.00 N ATOM 310 CA GLU A 273 2.908 -12.982 -4.930 1.00 0.00 C ATOM 311 C GLU A 273 4.121 -13.386 -4.099 1.00 0.00 C ATOM 312 O GLU A 273 5.161 -13.757 -4.643 1.00 0.00 O ATOM 313 CB GLU A 273 2.816 -11.456 -5.015 1.00 0.00 C ATOM 314 CG GLU A 273 1.724 -10.963 -5.950 1.00 0.00 C ATOM 315 CD GLU A 273 1.627 -9.450 -5.993 1.00 0.00 C ATOM 316 OE1 GLU A 273 2.429 -8.783 -5.305 1.00 0.00 O ATOM 317 OE2 GLU A 273 0.750 -8.931 -6.716 1.00 0.00 O ATOM 0 H GLU A 273 0.979 -12.843 -4.116 1.00 0.00 H new ATOM 0 HA GLU A 273 3.028 -13.384 -5.936 1.00 0.00 H new ATOM 0 HB2 GLU A 273 2.637 -11.055 -4.017 1.00 0.00 H new ATOM 0 HB3 GLU A 273 3.775 -11.061 -5.350 1.00 0.00 H new ATOM 0 HG2 GLU A 273 1.915 -11.339 -6.955 1.00 0.00 H new ATOM 0 HG3 GLU A 273 0.766 -11.375 -5.632 1.00 0.00 H new ATOM 324 N SER A 274 3.979 -13.312 -2.778 1.00 0.00 N ATOM 325 CA SER A 274 5.064 -13.674 -1.873 1.00 0.00 C ATOM 326 C SER A 274 5.397 -15.157 -1.990 1.00 0.00 C ATOM 327 O SER A 274 4.514 -16.011 -1.908 1.00 0.00 O ATOM 328 CB SER A 274 4.689 -13.335 -0.429 1.00 0.00 C ATOM 329 OG SER A 274 4.468 -11.944 -0.271 1.00 0.00 O ATOM 0 H SER A 274 3.125 -13.005 -2.312 1.00 0.00 H new ATOM 0 HA SER A 274 5.946 -13.098 -2.155 1.00 0.00 H new ATOM 0 HB2 SER A 274 3.791 -13.883 -0.145 1.00 0.00 H new ATOM 0 HB3 SER A 274 5.485 -13.658 0.242 1.00 0.00 H new ATOM 0 HG SER A 274 3.596 -11.706 -0.649 1.00 0.00 H new ATOM 335 N ARG A 275 6.677 -15.453 -2.184 1.00 0.00 N ATOM 336 CA ARG A 275 7.135 -16.831 -2.316 1.00 0.00 C ATOM 337 C ARG A 275 7.228 -17.514 -0.953 1.00 0.00 C ATOM 338 O ARG A 275 6.889 -18.690 -0.815 1.00 0.00 O ATOM 339 CB ARG A 275 8.493 -16.871 -3.020 1.00 0.00 C ATOM 340 CG ARG A 275 9.579 -16.092 -2.295 1.00 0.00 C ATOM 341 CD ARG A 275 10.887 -16.106 -3.068 1.00 0.00 C ATOM 342 NE ARG A 275 11.391 -17.461 -3.275 1.00 0.00 N ATOM 343 CZ ARG A 275 12.512 -17.738 -3.933 1.00 0.00 C ATOM 344 NH1 ARG A 275 13.243 -16.757 -4.448 1.00 0.00 N ATOM 345 NH2 ARG A 275 12.905 -18.996 -4.078 1.00 0.00 N ATOM 0 H ARG A 275 7.418 -14.755 -2.254 1.00 0.00 H new ATOM 0 HA ARG A 275 6.406 -17.374 -2.917 1.00 0.00 H new ATOM 0 HB2 ARG A 275 8.809 -17.909 -3.122 1.00 0.00 H new ATOM 0 HB3 ARG A 275 8.382 -16.471 -4.028 1.00 0.00 H new ATOM 0 HG2 ARG A 275 9.253 -15.062 -2.149 1.00 0.00 H new ATOM 0 HG3 ARG A 275 9.736 -16.520 -1.305 1.00 0.00 H new ATOM 0 HD2 ARG A 275 10.741 -15.623 -4.034 1.00 0.00 H new ATOM 0 HD3 ARG A 275 11.632 -15.521 -2.528 1.00 0.00 H new ATOM 0 HE ARG A 275 10.852 -18.238 -2.893 1.00 0.00 H new ATOM 0 HH11 ARG A 275 12.945 -15.788 -4.339 1.00 0.00 H new ATOM 0 HH12 ARG A 275 14.103 -16.973 -4.952 1.00 0.00 H new ATOM 0 HH21 ARG A 275 12.347 -19.753 -3.684 1.00 0.00 H new ATOM 0 HH22 ARG A 275 13.766 -19.206 -4.583 1.00 0.00 H new ATOM 359 N ASN A 276 7.696 -16.771 0.048 1.00 0.00 N ATOM 360 CA ASN A 276 7.841 -17.308 1.398 1.00 0.00 C ATOM 361 C ASN A 276 6.523 -17.879 1.909 1.00 0.00 C ATOM 362 O ASN A 276 6.488 -18.993 2.434 1.00 0.00 O ATOM 363 CB ASN A 276 8.343 -16.223 2.354 1.00 0.00 C ATOM 364 CG ASN A 276 9.700 -15.677 1.952 1.00 0.00 C ATOM 365 OD1 ASN A 276 9.861 -15.124 0.864 1.00 0.00 O ATOM 366 ND2 ASN A 276 10.685 -15.831 2.830 1.00 0.00 N ATOM 0 H ASN A 276 7.981 -15.797 -0.051 1.00 0.00 H new ATOM 0 HA ASN A 276 8.572 -18.115 1.358 1.00 0.00 H new ATOM 0 HB2 ASN A 276 7.621 -15.407 2.384 1.00 0.00 H new ATOM 0 HB3 ASN A 276 8.404 -16.632 3.363 1.00 0.00 H new ATOM 0 HD21 ASN A 276 11.620 -15.484 2.614 1.00 0.00 H new ATOM 0 HD22 ASN A 276 10.507 -16.296 3.720 1.00 0.00 H new ATOM 373 N SER A 277 5.446 -17.107 1.748 1.00 0.00 N ATOM 374 CA SER A 277 4.109 -17.517 2.187 1.00 0.00 C ATOM 375 C SER A 277 3.969 -17.443 3.708 1.00 0.00 C ATOM 376 O SER A 277 2.955 -16.968 4.220 1.00 0.00 O ATOM 377 CB SER A 277 3.786 -18.932 1.696 1.00 0.00 C ATOM 378 OG SER A 277 3.821 -19.001 0.281 1.00 0.00 O ATOM 0 H SER A 277 5.475 -16.185 1.312 1.00 0.00 H new ATOM 0 HA SER A 277 3.395 -16.820 1.748 1.00 0.00 H new ATOM 0 HB2 SER A 277 4.502 -19.638 2.116 1.00 0.00 H new ATOM 0 HB3 SER A 277 2.800 -19.228 2.053 1.00 0.00 H new ATOM 0 HG SER A 277 4.746 -18.904 -0.028 1.00 0.00 H new ATOM 384 N ALA A 278 4.989 -17.912 4.426 1.00 0.00 N ATOM 385 CA ALA A 278 4.977 -17.895 5.886 1.00 0.00 C ATOM 386 C ALA A 278 3.773 -18.651 6.438 1.00 0.00 C ATOM 387 O ALA A 278 2.769 -17.994 6.786 1.00 0.00 O ATOM 388 CB ALA A 278 4.991 -16.463 6.403 1.00 0.00 C ATOM 389 OXT ALA A 278 3.844 -19.896 6.522 1.00 0.00 O ATOM 0 H ALA A 278 5.835 -18.309 4.018 1.00 0.00 H new ATOM 0 HA ALA A 278 5.878 -18.400 6.234 1.00 0.00 H new ATOM 0 HB1 ALA A 278 4.982 -16.470 7.493 1.00 0.00 H new ATOM 0 HB2 ALA A 278 5.890 -15.958 6.051 1.00 0.00 H new ATOM 0 HB3 ALA A 278 4.111 -15.935 6.036 1.00 0.00 H new TER 395 ALA A 278 ATOM 396 N MET B 1 14.924 2.877 -2.409 1.00 0.00 N ATOM 397 CA MET B 1 14.531 1.998 -3.541 1.00 0.00 C ATOM 398 C MET B 1 13.167 2.391 -4.103 1.00 0.00 C ATOM 399 O MET B 1 12.248 2.728 -3.355 1.00 0.00 O ATOM 400 CB MET B 1 14.507 0.548 -3.052 1.00 0.00 C ATOM 401 CG MET B 1 13.549 0.308 -1.897 1.00 0.00 C ATOM 402 SD MET B 1 13.519 -1.417 -1.370 1.00 0.00 S ATOM 403 CE MET B 1 12.315 -1.345 -0.046 1.00 0.00 C ATOM 0 H1 MET B 1 15.786 2.504 -1.963 1.00 0.00 H new ATOM 0 H2 MET B 1 15.105 3.838 -2.763 1.00 0.00 H new ATOM 0 H3 MET B 1 14.156 2.905 -1.708 1.00 0.00 H new ATOM 0 HA MET B 1 15.258 2.109 -4.345 1.00 0.00 H new ATOM 0 HB2 MET B 1 14.231 -0.102 -3.883 1.00 0.00 H new ATOM 0 HB3 MET B 1 15.512 0.261 -2.744 1.00 0.00 H new ATOM 0 HG2 MET B 1 13.836 0.937 -1.054 1.00 0.00 H new ATOM 0 HG3 MET B 1 12.545 0.611 -2.193 1.00 0.00 H new ATOM 0 HE1 MET B 1 12.470 -2.183 0.633 1.00 0.00 H new ATOM 0 HE2 MET B 1 12.431 -0.409 0.500 1.00 0.00 H new ATOM 0 HE3 MET B 1 11.310 -1.399 -0.465 1.00 0.00 H new ATOM 415 N GLN B 2 13.049 2.347 -5.426 1.00 0.00 N ATOM 416 CA GLN B 2 11.802 2.695 -6.101 1.00 0.00 C ATOM 417 C GLN B 2 10.744 1.617 -5.890 1.00 0.00 C ATOM 418 O GLN B 2 11.061 0.430 -5.807 1.00 0.00 O ATOM 419 CB GLN B 2 12.044 2.892 -7.599 1.00 0.00 C ATOM 420 CG GLN B 2 13.043 3.992 -7.916 1.00 0.00 C ATOM 421 CD GLN B 2 13.260 4.169 -9.406 1.00 0.00 C ATOM 422 OE1 GLN B 2 13.668 3.239 -10.101 1.00 0.00 O ATOM 423 NE2 GLN B 2 12.988 5.369 -9.904 1.00 0.00 N ATOM 0 H GLN B 2 13.804 2.073 -6.055 1.00 0.00 H new ATOM 0 HA GLN B 2 11.438 3.627 -5.669 1.00 0.00 H new ATOM 0 HB2 GLN B 2 12.401 1.955 -8.027 1.00 0.00 H new ATOM 0 HB3 GLN B 2 11.096 3.124 -8.084 1.00 0.00 H new ATOM 0 HG2 GLN B 2 12.691 4.931 -7.489 1.00 0.00 H new ATOM 0 HG3 GLN B 2 13.995 3.762 -7.438 1.00 0.00 H new ATOM 0 HE21 GLN B 2 12.652 6.111 -9.291 1.00 0.00 H new ATOM 0 HE22 GLN B 2 13.115 5.549 -10.900 1.00 0.00 H new ATOM 432 N ILE B 3 9.486 2.040 -5.814 1.00 0.00 N ATOM 433 CA ILE B 3 8.369 1.120 -5.623 1.00 0.00 C ATOM 434 C ILE B 3 7.127 1.633 -6.343 1.00 0.00 C ATOM 435 O ILE B 3 6.874 2.839 -6.377 1.00 0.00 O ATOM 436 CB ILE B 3 8.027 0.920 -4.132 1.00 0.00 C ATOM 437 CG1 ILE B 3 7.614 2.250 -3.497 1.00 0.00 C ATOM 438 CG2 ILE B 3 9.209 0.312 -3.389 1.00 0.00 C ATOM 439 CD1 ILE B 3 7.067 2.107 -2.093 1.00 0.00 C ATOM 0 H ILE B 3 9.213 3.020 -5.882 1.00 0.00 H new ATOM 0 HA ILE B 3 8.679 0.162 -6.039 1.00 0.00 H new ATOM 0 HB ILE B 3 7.187 0.229 -4.059 1.00 0.00 H new ATOM 0 HG12 ILE B 3 8.476 2.916 -3.476 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.860 2.724 -4.125 1.00 0.00 H new ATOM 0 HG21 ILE B 3 8.949 0.178 -2.339 1.00 0.00 H new ATOM 0 HG22 ILE B 3 9.456 -0.655 -3.828 1.00 0.00 H new ATOM 0 HG23 ILE B 3 10.069 0.977 -3.468 1.00 0.00 H new ATOM 0 HD11 ILE B 3 6.795 3.089 -1.707 1.00 0.00 H new ATOM 0 HD12 ILE B 3 6.185 1.467 -2.110 1.00 0.00 H new ATOM 0 HD13 ILE B 3 7.826 1.662 -1.450 1.00 0.00 H new ATOM 451 N PHE B 4 6.356 0.719 -6.924 1.00 0.00 N ATOM 452 CA PHE B 4 5.145 1.100 -7.644 1.00 0.00 C ATOM 453 C PHE B 4 3.898 0.950 -6.785 1.00 0.00 C ATOM 454 O PHE B 4 3.659 -0.102 -6.194 1.00 0.00 O ATOM 455 CB PHE B 4 4.984 0.273 -8.920 1.00 0.00 C ATOM 456 CG PHE B 4 5.883 0.710 -10.037 1.00 0.00 C ATOM 457 CD1 PHE B 4 7.213 0.326 -10.074 1.00 0.00 C ATOM 458 CD2 PHE B 4 5.389 1.508 -11.055 1.00 0.00 C ATOM 459 CE1 PHE B 4 8.035 0.731 -11.109 1.00 0.00 C ATOM 460 CE2 PHE B 4 6.203 1.916 -12.091 1.00 0.00 C ATOM 461 CZ PHE B 4 7.529 1.527 -12.119 1.00 0.00 C ATOM 0 H PHE B 4 6.546 -0.283 -6.911 1.00 0.00 H new ATOM 0 HA PHE B 4 5.256 2.152 -7.905 1.00 0.00 H new ATOM 0 HB2 PHE B 4 5.185 -0.774 -8.692 1.00 0.00 H new ATOM 0 HB3 PHE B 4 3.948 0.334 -9.254 1.00 0.00 H new ATOM 0 HD1 PHE B 4 7.612 -0.296 -9.286 1.00 0.00 H new ATOM 0 HD2 PHE B 4 4.354 1.815 -11.038 1.00 0.00 H new ATOM 0 HE1 PHE B 4 9.071 0.426 -11.128 1.00 0.00 H new ATOM 0 HE2 PHE B 4 5.805 2.538 -12.879 1.00 0.00 H new ATOM 0 HZ PHE B 4 8.169 1.845 -12.929 1.00 0.00 H new ATOM 471 N VAL B 5 3.091 2.003 -6.747 1.00 0.00 N ATOM 472 CA VAL B 5 1.847 1.985 -5.993 1.00 0.00 C ATOM 473 C VAL B 5 0.681 1.727 -6.939 1.00 0.00 C ATOM 474 O VAL B 5 0.502 2.451 -7.920 1.00 0.00 O ATOM 475 CB VAL B 5 1.612 3.314 -5.248 1.00 0.00 C ATOM 476 CG1 VAL B 5 0.326 3.256 -4.438 1.00 0.00 C ATOM 477 CG2 VAL B 5 2.798 3.642 -4.354 1.00 0.00 C ATOM 0 H VAL B 5 3.278 2.881 -7.231 1.00 0.00 H new ATOM 0 HA VAL B 5 1.918 1.189 -5.252 1.00 0.00 H new ATOM 0 HB VAL B 5 1.511 4.109 -5.987 1.00 0.00 H new ATOM 0 HG11 VAL B 5 0.179 4.204 -3.920 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.516 3.073 -5.105 1.00 0.00 H new ATOM 0 HG13 VAL B 5 0.392 2.450 -3.707 1.00 0.00 H new ATOM 0 HG21 VAL B 5 2.614 4.583 -3.836 1.00 0.00 H new ATOM 0 HG22 VAL B 5 2.933 2.846 -3.622 1.00 0.00 H new ATOM 0 HG23 VAL B 5 3.698 3.732 -4.962 1.00 0.00 H new ATOM 487 N LYS B 6 -0.100 0.690 -6.653 1.00 0.00 N ATOM 488 CA LYS B 6 -1.235 0.342 -7.499 1.00 0.00 C ATOM 489 C LYS B 6 -2.543 0.372 -6.718 1.00 0.00 C ATOM 490 O LYS B 6 -2.672 -0.265 -5.672 1.00 0.00 O ATOM 491 CB LYS B 6 -1.036 -1.045 -8.112 1.00 0.00 C ATOM 492 CG LYS B 6 -2.131 -1.440 -9.090 1.00 0.00 C ATOM 493 CD LYS B 6 -1.997 -2.890 -9.525 1.00 0.00 C ATOM 494 CE LYS B 6 -3.053 -3.261 -10.554 1.00 0.00 C ATOM 495 NZ LYS B 6 -3.007 -4.708 -10.899 1.00 0.00 N ATOM 0 H LYS B 6 0.031 0.079 -5.847 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.293 1.086 -8.293 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.075 -1.072 -8.625 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -0.991 -1.784 -7.312 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -3.106 -1.287 -8.627 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -2.089 -0.792 -9.965 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.005 -3.055 -9.944 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.089 -3.542 -8.656 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -4.041 -3.011 -10.167 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.905 -2.668 -11.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.742 -4.921 -11.603 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.073 -4.942 -11.292 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -3.174 -5.274 -10.043 1.00 0.00 H new ATOM 509 N THR B 7 -3.514 1.105 -7.248 1.00 0.00 N ATOM 510 CA THR B 7 -4.825 1.216 -6.625 1.00 0.00 C ATOM 511 C THR B 7 -5.748 0.103 -7.112 1.00 0.00 C ATOM 512 O THR B 7 -5.605 -0.379 -8.235 1.00 0.00 O ATOM 513 CB THR B 7 -5.475 2.578 -6.926 1.00 0.00 C ATOM 514 OG1 THR B 7 -5.576 2.770 -8.341 1.00 0.00 O ATOM 515 CG2 THR B 7 -4.667 3.710 -6.312 1.00 0.00 C ATOM 0 H THR B 7 -3.416 1.635 -8.114 1.00 0.00 H new ATOM 0 HA THR B 7 -4.680 1.125 -5.548 1.00 0.00 H new ATOM 0 HB THR B 7 -6.473 2.585 -6.487 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.992 3.638 -8.524 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.146 4.663 -6.538 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.617 3.576 -5.231 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.659 3.703 -6.726 1.00 0.00 H new ATOM 523 N LEU B 8 -6.688 -0.302 -6.262 1.00 0.00 N ATOM 524 CA LEU B 8 -7.635 -1.358 -6.611 1.00 0.00 C ATOM 525 C LEU B 8 -8.705 -0.849 -7.577 1.00 0.00 C ATOM 526 O LEU B 8 -9.902 -0.995 -7.324 1.00 0.00 O ATOM 527 CB LEU B 8 -8.300 -1.933 -5.355 1.00 0.00 C ATOM 528 CG LEU B 8 -7.418 -2.845 -4.496 1.00 0.00 C ATOM 529 CD1 LEU B 8 -6.911 -4.025 -5.310 1.00 0.00 C ATOM 530 CD2 LEU B 8 -6.257 -2.069 -3.895 1.00 0.00 C ATOM 0 H LEU B 8 -6.815 0.085 -5.327 1.00 0.00 H new ATOM 0 HA LEU B 8 -7.071 -2.149 -7.106 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -8.645 -1.104 -4.737 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -9.184 -2.494 -5.658 1.00 0.00 H new ATOM 0 HG LEU B 8 -8.027 -3.230 -3.678 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -6.287 -4.660 -4.681 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -7.758 -4.602 -5.681 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -6.324 -3.660 -6.153 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -5.646 -2.739 -3.290 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -5.649 -1.647 -4.695 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -6.642 -1.264 -3.269 1.00 0.00 H new ATOM 542 N THR B 9 -8.269 -0.258 -8.685 1.00 0.00 N ATOM 543 CA THR B 9 -9.189 0.262 -9.687 1.00 0.00 C ATOM 544 C THR B 9 -8.556 0.256 -11.077 1.00 0.00 C ATOM 545 O THR B 9 -9.182 -0.174 -12.046 1.00 0.00 O ATOM 546 CB THR B 9 -9.663 1.690 -9.343 1.00 0.00 C ATOM 547 OG1 THR B 9 -10.492 2.198 -10.395 1.00 0.00 O ATOM 548 CG2 THR B 9 -8.484 2.625 -9.124 1.00 0.00 C ATOM 0 H THR B 9 -7.283 -0.128 -8.911 1.00 0.00 H new ATOM 0 HA THR B 9 -10.055 -0.399 -9.688 1.00 0.00 H new ATOM 0 HB THR B 9 -10.236 1.640 -8.417 1.00 0.00 H new ATOM 0 HG1 THR B 9 -10.790 3.104 -10.168 1.00 0.00 H new ATOM 0 HG21 THR B 9 -8.851 3.623 -8.883 1.00 0.00 H new ATOM 0 HG22 THR B 9 -7.874 2.254 -8.300 1.00 0.00 H new ATOM 0 HG23 THR B 9 -7.881 2.669 -10.031 1.00 0.00 H new ATOM 556 N GLY B 10 -7.313 0.726 -11.175 1.00 0.00 N ATOM 557 CA GLY B 10 -6.636 0.748 -12.461 1.00 0.00 C ATOM 558 C GLY B 10 -5.592 1.845 -12.569 1.00 0.00 C ATOM 559 O GLY B 10 -5.688 2.709 -13.441 1.00 0.00 O ATOM 0 H GLY B 10 -6.767 1.089 -10.393 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -6.158 -0.217 -12.629 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -7.375 0.880 -13.251 1.00 0.00 H new ATOM 563 N LYS B 11 -4.595 1.819 -11.688 1.00 0.00 N ATOM 564 CA LYS B 11 -3.544 2.830 -11.707 1.00 0.00 C ATOM 565 C LYS B 11 -2.291 2.355 -10.975 1.00 0.00 C ATOM 566 O LYS B 11 -2.375 1.698 -9.938 1.00 0.00 O ATOM 567 CB LYS B 11 -4.051 4.125 -11.075 1.00 0.00 C ATOM 568 CG LYS B 11 -3.077 5.285 -11.198 1.00 0.00 C ATOM 569 CD LYS B 11 -3.635 6.549 -10.569 1.00 0.00 C ATOM 570 CE LYS B 11 -2.651 7.704 -10.664 1.00 0.00 C ATOM 571 NZ LYS B 11 -2.331 8.046 -12.078 1.00 0.00 N ATOM 0 H LYS B 11 -4.494 1.114 -10.958 1.00 0.00 H new ATOM 0 HA LYS B 11 -3.277 3.010 -12.748 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -4.995 4.403 -11.544 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -4.260 3.947 -10.020 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -2.135 5.023 -10.716 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -2.857 5.467 -12.250 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -4.566 6.822 -11.065 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -3.875 6.360 -9.523 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -3.068 8.578 -10.164 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -1.733 7.443 -10.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -1.826 8.954 -12.110 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.731 7.302 -12.488 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -3.212 8.121 -12.625 1.00 0.00 H new ATOM 585 N THR B 12 -1.132 2.705 -11.526 1.00 0.00 N ATOM 586 CA THR B 12 0.153 2.335 -10.941 1.00 0.00 C ATOM 587 C THR B 12 1.201 3.397 -11.259 1.00 0.00 C ATOM 588 O THR B 12 1.347 3.802 -12.412 1.00 0.00 O ATOM 589 CB THR B 12 0.640 0.970 -11.465 1.00 0.00 C ATOM 590 OG1 THR B 12 -0.346 -0.035 -11.205 1.00 0.00 O ATOM 591 CG2 THR B 12 1.955 0.575 -10.811 1.00 0.00 C ATOM 0 H THR B 12 -1.057 3.250 -12.385 1.00 0.00 H new ATOM 0 HA THR B 12 0.014 2.262 -9.862 1.00 0.00 H new ATOM 0 HB THR B 12 0.798 1.056 -12.540 1.00 0.00 H new ATOM 0 HG1 THR B 12 -0.029 -0.899 -11.542 1.00 0.00 H new ATOM 0 HG21 THR B 12 2.278 -0.392 -11.197 1.00 0.00 H new ATOM 0 HG22 THR B 12 2.713 1.326 -11.034 1.00 0.00 H new ATOM 0 HG23 THR B 12 1.819 0.507 -9.732 1.00 0.00 H new ATOM 599 N ILE B 13 1.915 3.863 -10.234 1.00 0.00 N ATOM 600 CA ILE B 13 2.927 4.902 -10.428 1.00 0.00 C ATOM 601 C ILE B 13 4.193 4.651 -9.609 1.00 0.00 C ATOM 602 O ILE B 13 4.133 4.175 -8.476 1.00 0.00 O ATOM 603 CB ILE B 13 2.373 6.288 -10.043 1.00 0.00 C ATOM 604 CG1 ILE B 13 1.141 6.631 -10.884 1.00 0.00 C ATOM 605 CG2 ILE B 13 3.452 7.350 -10.202 1.00 0.00 C ATOM 606 CD1 ILE B 13 1.428 6.778 -12.364 1.00 0.00 C ATOM 0 H ILE B 13 1.814 3.542 -9.271 1.00 0.00 H new ATOM 0 HA ILE B 13 3.184 4.873 -11.487 1.00 0.00 H new ATOM 0 HB ILE B 13 2.068 6.262 -8.997 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.391 5.853 -10.745 1.00 0.00 H new ATOM 0 HG13 ILE B 13 0.708 7.560 -10.514 1.00 0.00 H new ATOM 0 HG21 ILE B 13 3.047 8.324 -9.927 1.00 0.00 H new ATOM 0 HG22 ILE B 13 4.296 7.111 -9.554 1.00 0.00 H new ATOM 0 HG23 ILE B 13 3.787 7.376 -11.239 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.505 7.021 -12.891 1.00 0.00 H new ATOM 0 HD12 ILE B 13 2.154 7.577 -12.516 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.831 5.842 -12.751 1.00 0.00 H new ATOM 618 N THR B 14 5.337 5.007 -10.194 1.00 0.00 N ATOM 619 CA THR B 14 6.629 4.859 -9.533 1.00 0.00 C ATOM 620 C THR B 14 6.729 5.806 -8.341 1.00 0.00 C ATOM 621 O THR B 14 6.192 6.913 -8.377 1.00 0.00 O ATOM 622 CB THR B 14 7.791 5.174 -10.496 1.00 0.00 C ATOM 623 OG1 THR B 14 7.646 4.429 -11.707 1.00 0.00 O ATOM 624 CG2 THR B 14 9.131 4.847 -9.855 1.00 0.00 C ATOM 0 H THR B 14 5.392 5.403 -11.132 1.00 0.00 H new ATOM 0 HA THR B 14 6.703 3.823 -9.202 1.00 0.00 H new ATOM 0 HB THR B 14 7.762 6.240 -10.721 1.00 0.00 H new ATOM 0 HG1 THR B 14 7.357 3.516 -11.497 1.00 0.00 H new ATOM 0 HG21 THR B 14 9.935 5.078 -10.554 1.00 0.00 H new ATOM 0 HG22 THR B 14 9.256 5.441 -8.950 1.00 0.00 H new ATOM 0 HG23 THR B 14 9.164 3.787 -9.601 1.00 0.00 H new ATOM 632 N LEU B 15 7.422 5.378 -7.292 1.00 0.00 N ATOM 633 CA LEU B 15 7.586 6.213 -6.108 1.00 0.00 C ATOM 634 C LEU B 15 8.824 5.790 -5.321 1.00 0.00 C ATOM 635 O LEU B 15 8.906 4.668 -4.822 1.00 0.00 O ATOM 636 CB LEU B 15 6.329 6.127 -5.230 1.00 0.00 C ATOM 637 CG LEU B 15 6.123 7.278 -4.233 1.00 0.00 C ATOM 638 CD1 LEU B 15 7.237 7.320 -3.199 1.00 0.00 C ATOM 639 CD2 LEU B 15 6.025 8.608 -4.968 1.00 0.00 C ATOM 0 H LEU B 15 7.876 4.466 -7.237 1.00 0.00 H new ATOM 0 HA LEU B 15 7.723 7.248 -6.422 1.00 0.00 H new ATOM 0 HB2 LEU B 15 5.457 6.078 -5.882 1.00 0.00 H new ATOM 0 HB3 LEU B 15 6.363 5.191 -4.672 1.00 0.00 H new ATOM 0 HG LEU B 15 5.186 7.100 -3.706 1.00 0.00 H new ATOM 0 HD11 LEU B 15 7.062 8.145 -2.509 1.00 0.00 H new ATOM 0 HD12 LEU B 15 7.255 6.381 -2.645 1.00 0.00 H new ATOM 0 HD13 LEU B 15 8.194 7.464 -3.701 1.00 0.00 H new ATOM 0 HD21 LEU B 15 5.879 9.412 -4.247 1.00 0.00 H new ATOM 0 HD22 LEU B 15 6.944 8.784 -5.527 1.00 0.00 H new ATOM 0 HD23 LEU B 15 5.181 8.581 -5.657 1.00 0.00 H new ATOM 651 N GLU B 16 9.785 6.704 -5.220 1.00 0.00 N ATOM 652 CA GLU B 16 11.027 6.445 -4.501 1.00 0.00 C ATOM 653 C GLU B 16 10.793 6.445 -2.994 1.00 0.00 C ATOM 654 O GLU B 16 10.150 7.348 -2.459 1.00 0.00 O ATOM 655 CB GLU B 16 12.074 7.502 -4.865 1.00 0.00 C ATOM 656 CG GLU B 16 13.412 7.307 -4.172 1.00 0.00 C ATOM 657 CD GLU B 16 14.098 6.019 -4.580 1.00 0.00 C ATOM 658 OE1 GLU B 16 14.387 5.856 -5.784 1.00 0.00 O ATOM 659 OE2 GLU B 16 14.348 5.174 -3.696 1.00 0.00 O ATOM 0 H GLU B 16 9.726 7.636 -5.630 1.00 0.00 H new ATOM 0 HA GLU B 16 11.392 5.460 -4.793 1.00 0.00 H new ATOM 0 HB2 GLU B 16 12.229 7.489 -5.944 1.00 0.00 H new ATOM 0 HB3 GLU B 16 11.684 8.488 -4.611 1.00 0.00 H new ATOM 0 HG2 GLU B 16 14.063 8.150 -4.404 1.00 0.00 H new ATOM 0 HG3 GLU B 16 13.261 7.308 -3.092 1.00 0.00 H new ATOM 666 N VAL B 17 11.322 5.433 -2.311 1.00 0.00 N ATOM 667 CA VAL B 17 11.166 5.330 -0.863 1.00 0.00 C ATOM 668 C VAL B 17 12.422 4.773 -0.200 1.00 0.00 C ATOM 669 O VAL B 17 12.961 3.750 -0.621 1.00 0.00 O ATOM 670 CB VAL B 17 9.965 4.440 -0.483 1.00 0.00 C ATOM 671 CG1 VAL B 17 8.664 5.058 -0.969 1.00 0.00 C ATOM 672 CG2 VAL B 17 10.138 3.037 -1.045 1.00 0.00 C ATOM 0 H VAL B 17 11.860 4.677 -2.734 1.00 0.00 H new ATOM 0 HA VAL B 17 10.990 6.343 -0.502 1.00 0.00 H new ATOM 0 HB VAL B 17 9.923 4.369 0.604 1.00 0.00 H new ATOM 0 HG11 VAL B 17 7.829 4.415 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL B 17 8.534 6.039 -0.512 1.00 0.00 H new ATOM 0 HG13 VAL B 17 8.694 5.164 -2.053 1.00 0.00 H new ATOM 0 HG21 VAL B 17 9.280 2.425 -0.766 1.00 0.00 H new ATOM 0 HG22 VAL B 17 10.210 3.087 -2.131 1.00 0.00 H new ATOM 0 HG23 VAL B 17 11.048 2.593 -0.641 1.00 0.00 H new ATOM 682 N GLU B 18 12.879 5.456 0.845 1.00 0.00 N ATOM 683 CA GLU B 18 14.066 5.033 1.578 1.00 0.00 C ATOM 684 C GLU B 18 13.693 4.063 2.694 1.00 0.00 C ATOM 685 O GLU B 18 12.695 4.258 3.390 1.00 0.00 O ATOM 686 CB GLU B 18 14.793 6.246 2.161 1.00 0.00 C ATOM 687 CG GLU B 18 15.247 7.254 1.115 1.00 0.00 C ATOM 688 CD GLU B 18 16.270 6.683 0.149 1.00 0.00 C ATOM 689 OE1 GLU B 18 15.924 5.746 -0.601 1.00 0.00 O ATOM 690 OE2 GLU B 18 17.419 7.173 0.146 1.00 0.00 O ATOM 0 H GLU B 18 12.444 6.306 1.203 1.00 0.00 H new ATOM 0 HA GLU B 18 14.732 4.523 0.882 1.00 0.00 H new ATOM 0 HB2 GLU B 18 14.134 6.746 2.871 1.00 0.00 H new ATOM 0 HB3 GLU B 18 15.662 5.902 2.721 1.00 0.00 H new ATOM 0 HG2 GLU B 18 14.380 7.603 0.554 1.00 0.00 H new ATOM 0 HG3 GLU B 18 15.673 8.123 1.616 1.00 0.00 H new ATOM 697 N SER B 19 14.498 3.018 2.859 1.00 0.00 N ATOM 698 CA SER B 19 14.253 2.016 3.891 1.00 0.00 C ATOM 699 C SER B 19 14.181 2.661 5.272 1.00 0.00 C ATOM 700 O SER B 19 13.348 2.289 6.099 1.00 0.00 O ATOM 701 CB SER B 19 15.352 0.953 3.868 1.00 0.00 C ATOM 702 OG SER B 19 16.624 1.531 4.104 1.00 0.00 O ATOM 0 H SER B 19 15.327 2.843 2.291 1.00 0.00 H new ATOM 0 HA SER B 19 13.294 1.543 3.682 1.00 0.00 H new ATOM 0 HB2 SER B 19 15.147 0.196 4.625 1.00 0.00 H new ATOM 0 HB3 SER B 19 15.352 0.446 2.903 1.00 0.00 H new ATOM 0 HG SER B 19 17.310 0.831 4.086 1.00 0.00 H new ATOM 708 N SER B 20 15.062 3.625 5.515 1.00 0.00 N ATOM 709 CA SER B 20 15.105 4.322 6.796 1.00 0.00 C ATOM 710 C SER B 20 13.799 5.066 7.066 1.00 0.00 C ATOM 711 O SER B 20 13.247 4.989 8.164 1.00 0.00 O ATOM 712 CB SER B 20 16.278 5.302 6.825 1.00 0.00 C ATOM 713 OG SER B 20 17.511 4.627 6.636 1.00 0.00 O ATOM 0 H SER B 20 15.758 3.942 4.840 1.00 0.00 H new ATOM 0 HA SER B 20 15.240 3.576 7.579 1.00 0.00 H new ATOM 0 HB2 SER B 20 16.148 6.053 6.046 1.00 0.00 H new ATOM 0 HB3 SER B 20 16.291 5.830 7.778 1.00 0.00 H new ATOM 0 HG SER B 20 18.245 5.275 6.657 1.00 0.00 H new ATOM 719 N ASP B 21 13.312 5.788 6.060 1.00 0.00 N ATOM 720 CA ASP B 21 12.072 6.549 6.193 1.00 0.00 C ATOM 721 C ASP B 21 10.892 5.629 6.493 1.00 0.00 C ATOM 722 O ASP B 21 10.722 4.591 5.854 1.00 0.00 O ATOM 723 CB ASP B 21 11.801 7.351 4.919 1.00 0.00 C ATOM 724 CG ASP B 21 12.867 8.397 4.659 1.00 0.00 C ATOM 725 OD1 ASP B 21 14.051 8.021 4.538 1.00 0.00 O ATOM 726 OD2 ASP B 21 12.517 9.593 4.578 1.00 0.00 O ATOM 0 H ASP B 21 13.756 5.862 5.145 1.00 0.00 H new ATOM 0 HA ASP B 21 12.189 7.238 7.029 1.00 0.00 H new ATOM 0 HB2 ASP B 21 11.748 6.671 4.069 1.00 0.00 H new ATOM 0 HB3 ASP B 21 10.829 7.838 4.999 1.00 0.00 H new ATOM 731 N THR B 22 10.082 6.020 7.474 1.00 0.00 N ATOM 732 CA THR B 22 8.918 5.234 7.868 1.00 0.00 C ATOM 733 C THR B 22 7.840 5.250 6.787 1.00 0.00 C ATOM 734 O THR B 22 8.053 5.767 5.690 1.00 0.00 O ATOM 735 CB THR B 22 8.315 5.754 9.187 1.00 0.00 C ATOM 736 OG1 THR B 22 7.935 7.127 9.043 1.00 0.00 O ATOM 737 CG2 THR B 22 9.311 5.616 10.329 1.00 0.00 C ATOM 0 H THR B 22 10.212 6.878 8.011 1.00 0.00 H new ATOM 0 HA THR B 22 9.264 4.210 8.009 1.00 0.00 H new ATOM 0 HB THR B 22 7.434 5.155 9.420 1.00 0.00 H new ATOM 0 HG1 THR B 22 7.167 7.316 9.622 1.00 0.00 H new ATOM 0 HG21 THR B 22 8.863 5.990 11.250 1.00 0.00 H new ATOM 0 HG22 THR B 22 9.577 4.567 10.455 1.00 0.00 H new ATOM 0 HG23 THR B 22 10.207 6.193 10.102 1.00 0.00 H new ATOM 745 N ILE B 23 6.684 4.674 7.106 1.00 0.00 N ATOM 746 CA ILE B 23 5.568 4.613 6.167 1.00 0.00 C ATOM 747 C ILE B 23 4.918 5.981 5.980 1.00 0.00 C ATOM 748 O ILE B 23 4.605 6.377 4.857 1.00 0.00 O ATOM 749 CB ILE B 23 4.496 3.608 6.635 1.00 0.00 C ATOM 750 CG1 ILE B 23 5.096 2.203 6.766 1.00 0.00 C ATOM 751 CG2 ILE B 23 3.314 3.601 5.674 1.00 0.00 C ATOM 752 CD1 ILE B 23 5.601 1.626 5.461 1.00 0.00 C ATOM 0 H ILE B 23 6.496 4.242 8.010 1.00 0.00 H new ATOM 0 HA ILE B 23 5.980 4.282 5.214 1.00 0.00 H new ATOM 0 HB ILE B 23 4.137 3.919 7.616 1.00 0.00 H new ATOM 0 HG12 ILE B 23 5.919 2.236 7.480 1.00 0.00 H new ATOM 0 HG13 ILE B 23 4.342 1.534 7.180 1.00 0.00 H new ATOM 0 HG21 ILE B 23 2.568 2.886 6.020 1.00 0.00 H new ATOM 0 HG22 ILE B 23 2.872 4.596 5.634 1.00 0.00 H new ATOM 0 HG23 ILE B 23 3.656 3.316 4.679 1.00 0.00 H new ATOM 0 HD11 ILE B 23 6.010 0.631 5.637 1.00 0.00 H new ATOM 0 HD12 ILE B 23 4.778 1.559 4.750 1.00 0.00 H new ATOM 0 HD13 ILE B 23 6.380 2.272 5.055 1.00 0.00 H new ATOM 764 N ASP B 24 4.708 6.695 7.084 1.00 0.00 N ATOM 765 CA ASP B 24 4.087 8.016 7.030 1.00 0.00 C ATOM 766 C ASP B 24 4.815 8.921 6.040 1.00 0.00 C ATOM 767 O ASP B 24 4.184 9.661 5.283 1.00 0.00 O ATOM 768 CB ASP B 24 4.054 8.655 8.421 1.00 0.00 C ATOM 769 CG ASP B 24 5.427 8.760 9.057 1.00 0.00 C ATOM 770 OD1 ASP B 24 6.281 9.493 8.517 1.00 0.00 O ATOM 771 OD2 ASP B 24 5.648 8.108 10.099 1.00 0.00 O ATOM 0 H ASP B 24 4.957 6.383 8.022 1.00 0.00 H new ATOM 0 HA ASP B 24 3.061 7.892 6.684 1.00 0.00 H new ATOM 0 HB2 ASP B 24 3.617 9.651 8.347 1.00 0.00 H new ATOM 0 HB3 ASP B 24 3.403 8.068 9.069 1.00 0.00 H new ATOM 776 N ASN B 25 6.143 8.846 6.038 1.00 0.00 N ATOM 777 CA ASN B 25 6.945 9.649 5.124 1.00 0.00 C ATOM 778 C ASN B 25 6.558 9.329 3.687 1.00 0.00 C ATOM 779 O ASN B 25 6.419 10.223 2.850 1.00 0.00 O ATOM 780 CB ASN B 25 8.436 9.382 5.342 1.00 0.00 C ATOM 781 CG ASN B 25 9.319 10.249 4.463 1.00 0.00 C ATOM 782 OD1 ASN B 25 9.249 10.186 3.236 1.00 0.00 O ATOM 783 ND2 ASN B 25 10.157 11.067 5.091 1.00 0.00 N ATOM 0 H ASN B 25 6.683 8.240 6.656 1.00 0.00 H new ATOM 0 HA ASN B 25 6.754 10.704 5.321 1.00 0.00 H new ATOM 0 HB2 ASN B 25 8.684 9.561 6.388 1.00 0.00 H new ATOM 0 HB3 ASN B 25 8.647 8.332 5.139 1.00 0.00 H new ATOM 0 HD21 ASN B 25 10.775 11.675 4.554 1.00 0.00 H new ATOM 0 HD22 ASN B 25 10.182 11.087 6.110 1.00 0.00 H new ATOM 790 N VAL B 26 6.370 8.040 3.416 1.00 0.00 N ATOM 791 CA VAL B 26 5.980 7.585 2.091 1.00 0.00 C ATOM 792 C VAL B 26 4.633 8.179 1.703 1.00 0.00 C ATOM 793 O VAL B 26 4.425 8.574 0.557 1.00 0.00 O ATOM 794 CB VAL B 26 5.895 6.047 2.022 1.00 0.00 C ATOM 795 CG1 VAL B 26 5.507 5.593 0.623 1.00 0.00 C ATOM 796 CG2 VAL B 26 7.214 5.419 2.447 1.00 0.00 C ATOM 0 H VAL B 26 6.483 7.293 4.101 1.00 0.00 H new ATOM 0 HA VAL B 26 6.747 7.921 1.393 1.00 0.00 H new ATOM 0 HB VAL B 26 5.121 5.715 2.713 1.00 0.00 H new ATOM 0 HG11 VAL B 26 5.453 4.505 0.596 1.00 0.00 H new ATOM 0 HG12 VAL B 26 4.535 6.012 0.361 1.00 0.00 H new ATOM 0 HG13 VAL B 26 6.255 5.937 -0.092 1.00 0.00 H new ATOM 0 HG21 VAL B 26 7.135 4.333 2.392 1.00 0.00 H new ATOM 0 HG22 VAL B 26 8.009 5.759 1.784 1.00 0.00 H new ATOM 0 HG23 VAL B 26 7.444 5.714 3.471 1.00 0.00 H new ATOM 806 N LYS B 27 3.723 8.245 2.671 1.00 0.00 N ATOM 807 CA LYS B 27 2.395 8.800 2.437 1.00 0.00 C ATOM 808 C LYS B 27 2.485 10.262 2.022 1.00 0.00 C ATOM 809 O LYS B 27 1.774 10.703 1.122 1.00 0.00 O ATOM 810 CB LYS B 27 1.524 8.660 3.688 1.00 0.00 C ATOM 811 CG LYS B 27 1.193 7.219 4.042 1.00 0.00 C ATOM 812 CD LYS B 27 0.371 6.552 2.949 1.00 0.00 C ATOM 813 CE LYS B 27 0.023 5.118 3.312 1.00 0.00 C ATOM 814 NZ LYS B 27 -0.772 5.038 4.568 1.00 0.00 N ATOM 0 H LYS B 27 3.882 7.921 3.625 1.00 0.00 H new ATOM 0 HA LYS B 27 1.933 8.238 1.625 1.00 0.00 H new ATOM 0 HB2 LYS B 27 2.036 9.124 4.531 1.00 0.00 H new ATOM 0 HB3 LYS B 27 0.595 9.211 3.537 1.00 0.00 H new ATOM 0 HG2 LYS B 27 2.116 6.660 4.197 1.00 0.00 H new ATOM 0 HG3 LYS B 27 0.642 7.191 4.982 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.545 7.119 2.783 1.00 0.00 H new ATOM 0 HD3 LYS B 27 0.929 6.567 2.013 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -0.540 4.664 2.497 1.00 0.00 H new ATOM 0 HE3 LYS B 27 0.940 4.540 3.426 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -1.187 4.089 4.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -0.153 5.222 5.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -1.532 5.748 4.544 1.00 0.00 H new ATOM 828 N SER B 28 3.366 11.010 2.680 1.00 0.00 N ATOM 829 CA SER B 28 3.548 12.422 2.365 1.00 0.00 C ATOM 830 C SER B 28 4.094 12.590 0.949 1.00 0.00 C ATOM 831 O SER B 28 3.679 13.486 0.213 1.00 0.00 O ATOM 832 CB SER B 28 4.494 13.077 3.373 1.00 0.00 C ATOM 833 OG SER B 28 4.699 14.445 3.066 1.00 0.00 O ATOM 0 H SER B 28 3.962 10.663 3.431 1.00 0.00 H new ATOM 0 HA SER B 28 2.577 12.913 2.425 1.00 0.00 H new ATOM 0 HB2 SER B 28 4.081 12.984 4.377 1.00 0.00 H new ATOM 0 HB3 SER B 28 5.450 12.554 3.372 1.00 0.00 H new ATOM 0 HG SER B 28 5.306 14.841 3.726 1.00 0.00 H new ATOM 839 N LYS B 29 5.025 11.719 0.572 1.00 0.00 N ATOM 840 CA LYS B 29 5.621 11.770 -0.758 1.00 0.00 C ATOM 841 C LYS B 29 4.594 11.400 -1.826 1.00 0.00 C ATOM 842 O LYS B 29 4.504 12.052 -2.868 1.00 0.00 O ATOM 843 CB LYS B 29 6.825 10.828 -0.834 1.00 0.00 C ATOM 844 CG LYS B 29 7.915 11.164 0.173 1.00 0.00 C ATOM 845 CD LYS B 29 9.086 10.194 0.091 1.00 0.00 C ATOM 846 CE LYS B 29 8.657 8.767 0.387 1.00 0.00 C ATOM 847 NZ LYS B 29 9.818 7.838 0.446 1.00 0.00 N ATOM 0 H LYS B 29 5.382 10.971 1.167 1.00 0.00 H new ATOM 0 HA LYS B 29 5.958 12.790 -0.944 1.00 0.00 H new ATOM 0 HB2 LYS B 29 6.488 9.805 -0.667 1.00 0.00 H new ATOM 0 HB3 LYS B 29 7.244 10.866 -1.839 1.00 0.00 H new ATOM 0 HG2 LYS B 29 8.272 12.179 -0.004 1.00 0.00 H new ATOM 0 HG3 LYS B 29 7.497 11.144 1.180 1.00 0.00 H new ATOM 0 HD2 LYS B 29 9.529 10.242 -0.904 1.00 0.00 H new ATOM 0 HD3 LYS B 29 9.858 10.496 0.798 1.00 0.00 H new ATOM 0 HE2 LYS B 29 8.121 8.739 1.336 1.00 0.00 H new ATOM 0 HE3 LYS B 29 7.962 8.430 -0.382 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 9.554 6.986 0.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 10.096 7.568 -0.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 10.616 8.310 0.917 1.00 0.00 H new ATOM 861 N ILE B 30 3.821 10.352 -1.556 1.00 0.00 N ATOM 862 CA ILE B 30 2.796 9.892 -2.486 1.00 0.00 C ATOM 863 C ILE B 30 1.679 10.921 -2.632 1.00 0.00 C ATOM 864 O ILE B 30 1.230 11.210 -3.741 1.00 0.00 O ATOM 865 CB ILE B 30 2.188 8.544 -2.036 1.00 0.00 C ATOM 866 CG1 ILE B 30 3.255 7.446 -2.063 1.00 0.00 C ATOM 867 CG2 ILE B 30 1.008 8.170 -2.922 1.00 0.00 C ATOM 868 CD1 ILE B 30 2.751 6.097 -1.593 1.00 0.00 C ATOM 0 H ILE B 30 3.886 9.804 -0.698 1.00 0.00 H new ATOM 0 HA ILE B 30 3.285 9.756 -3.450 1.00 0.00 H new ATOM 0 HB ILE B 30 1.826 8.648 -1.013 1.00 0.00 H new ATOM 0 HG12 ILE B 30 3.637 7.348 -3.079 1.00 0.00 H new ATOM 0 HG13 ILE B 30 4.093 7.750 -1.435 1.00 0.00 H new ATOM 0 HG21 ILE B 30 0.592 7.218 -2.591 1.00 0.00 H new ATOM 0 HG22 ILE B 30 0.243 8.944 -2.855 1.00 0.00 H new ATOM 0 HG23 ILE B 30 1.343 8.080 -3.955 1.00 0.00 H new ATOM 0 HD11 ILE B 30 3.561 5.369 -1.640 1.00 0.00 H new ATOM 0 HD12 ILE B 30 2.396 6.179 -0.566 1.00 0.00 H new ATOM 0 HD13 ILE B 30 1.933 5.770 -2.235 1.00 0.00 H new ATOM 880 N GLN B 31 1.231 11.468 -1.506 1.00 0.00 N ATOM 881 CA GLN B 31 0.166 12.458 -1.510 1.00 0.00 C ATOM 882 C GLN B 31 0.594 13.709 -2.271 1.00 0.00 C ATOM 883 O GLN B 31 -0.200 14.309 -2.993 1.00 0.00 O ATOM 884 CB GLN B 31 -0.227 12.820 -0.076 1.00 0.00 C ATOM 885 CG GLN B 31 0.822 13.630 0.658 1.00 0.00 C ATOM 886 CD GLN B 31 0.387 14.033 2.053 1.00 0.00 C ATOM 887 OE1 GLN B 31 0.127 13.184 2.903 1.00 0.00 O ATOM 888 NE2 GLN B 31 0.306 15.337 2.294 1.00 0.00 N ATOM 0 H GLN B 31 1.591 11.240 -0.579 1.00 0.00 H new ATOM 0 HA GLN B 31 -0.699 12.028 -2.015 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -1.160 13.383 -0.096 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -0.420 11.903 0.481 1.00 0.00 H new ATOM 0 HG2 GLN B 31 1.742 13.049 0.723 1.00 0.00 H new ATOM 0 HG3 GLN B 31 1.051 14.526 0.081 1.00 0.00 H new ATOM 0 HE21 GLN B 31 0.531 16.007 1.558 1.00 0.00 H new ATOM 0 HE22 GLN B 31 0.018 15.669 3.215 1.00 0.00 H new ATOM 897 N ASP B 32 1.852 14.098 -2.101 1.00 0.00 N ATOM 898 CA ASP B 32 2.384 15.280 -2.767 1.00 0.00 C ATOM 899 C ASP B 32 2.447 15.087 -4.281 1.00 0.00 C ATOM 900 O ASP B 32 2.072 15.978 -5.044 1.00 0.00 O ATOM 901 CB ASP B 32 3.776 15.609 -2.225 1.00 0.00 C ATOM 902 CG ASP B 32 4.377 16.838 -2.878 1.00 0.00 C ATOM 903 OD1 ASP B 32 3.763 17.922 -2.781 1.00 0.00 O ATOM 904 OD2 ASP B 32 5.462 16.717 -3.485 1.00 0.00 O ATOM 0 H ASP B 32 2.523 13.611 -1.507 1.00 0.00 H new ATOM 0 HA ASP B 32 1.710 16.111 -2.560 1.00 0.00 H new ATOM 0 HB2 ASP B 32 3.715 15.767 -1.148 1.00 0.00 H new ATOM 0 HB3 ASP B 32 4.436 14.757 -2.386 1.00 0.00 H new ATOM 909 N LYS B 33 2.938 13.927 -4.712 1.00 0.00 N ATOM 910 CA LYS B 33 3.066 13.634 -6.138 1.00 0.00 C ATOM 911 C LYS B 33 1.715 13.327 -6.784 1.00 0.00 C ATOM 912 O LYS B 33 1.269 14.041 -7.682 1.00 0.00 O ATOM 913 CB LYS B 33 4.013 12.449 -6.350 1.00 0.00 C ATOM 914 CG LYS B 33 4.319 12.171 -7.813 1.00 0.00 C ATOM 915 CD LYS B 33 5.240 10.971 -7.979 1.00 0.00 C ATOM 916 CE LYS B 33 6.593 11.203 -7.321 1.00 0.00 C ATOM 917 NZ LYS B 33 7.289 12.392 -7.886 1.00 0.00 N ATOM 0 H LYS B 33 3.253 13.177 -4.097 1.00 0.00 H new ATOM 0 HA LYS B 33 3.473 14.525 -6.616 1.00 0.00 H new ATOM 0 HB2 LYS B 33 4.947 12.642 -5.822 1.00 0.00 H new ATOM 0 HB3 LYS B 33 3.572 11.558 -5.903 1.00 0.00 H new ATOM 0 HG2 LYS B 33 3.388 11.992 -8.352 1.00 0.00 H new ATOM 0 HG3 LYS B 33 4.783 13.050 -8.261 1.00 0.00 H new ATOM 0 HD2 LYS B 33 4.770 10.089 -7.544 1.00 0.00 H new ATOM 0 HD3 LYS B 33 5.382 10.766 -9.040 1.00 0.00 H new ATOM 0 HE2 LYS B 33 6.456 11.338 -6.248 1.00 0.00 H new ATOM 0 HE3 LYS B 33 7.218 10.320 -7.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 8.278 12.400 -7.565 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 7.262 12.349 -8.925 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 6.813 13.259 -7.563 1.00 0.00 H new ATOM 931 N GLU B 34 1.081 12.247 -6.336 1.00 0.00 N ATOM 932 CA GLU B 34 -0.206 11.823 -6.884 1.00 0.00 C ATOM 933 C GLU B 34 -1.333 12.793 -6.537 1.00 0.00 C ATOM 934 O GLU B 34 -2.227 13.028 -7.350 1.00 0.00 O ATOM 935 CB GLU B 34 -0.556 10.417 -6.392 1.00 0.00 C ATOM 936 CG GLU B 34 0.384 9.342 -6.916 1.00 0.00 C ATOM 937 CD GLU B 34 -0.024 7.947 -6.483 1.00 0.00 C ATOM 938 OE1 GLU B 34 -1.160 7.536 -6.800 1.00 0.00 O ATOM 939 OE2 GLU B 34 0.794 7.264 -5.832 1.00 0.00 O ATOM 0 H GLU B 34 1.438 11.647 -5.592 1.00 0.00 H new ATOM 0 HA GLU B 34 -0.105 11.815 -7.969 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -0.537 10.406 -5.302 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -1.575 10.177 -6.695 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.410 9.387 -8.005 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.395 9.546 -6.564 1.00 0.00 H new ATOM 946 N GLY B 35 -1.301 13.344 -5.329 1.00 0.00 N ATOM 947 CA GLY B 35 -2.344 14.266 -4.915 1.00 0.00 C ATOM 948 C GLY B 35 -3.535 13.546 -4.313 1.00 0.00 C ATOM 949 O GLY B 35 -4.678 13.772 -4.713 1.00 0.00 O ATOM 0 H GLY B 35 -0.577 13.171 -4.632 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -1.939 14.968 -4.186 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -2.671 14.852 -5.774 1.00 0.00 H new ATOM 953 N ILE B 36 -3.261 12.674 -3.349 1.00 0.00 N ATOM 954 CA ILE B 36 -4.304 11.906 -2.680 1.00 0.00 C ATOM 955 C ILE B 36 -4.054 11.859 -1.173 1.00 0.00 C ATOM 956 O ILE B 36 -2.934 11.600 -0.735 1.00 0.00 O ATOM 957 CB ILE B 36 -4.370 10.463 -3.228 1.00 0.00 C ATOM 958 CG1 ILE B 36 -4.758 10.476 -4.709 1.00 0.00 C ATOM 959 CG2 ILE B 36 -5.352 9.621 -2.422 1.00 0.00 C ATOM 960 CD1 ILE B 36 -4.779 9.102 -5.346 1.00 0.00 C ATOM 0 H ILE B 36 -2.318 12.481 -3.012 1.00 0.00 H new ATOM 0 HA ILE B 36 -5.254 12.403 -2.876 1.00 0.00 H new ATOM 0 HB ILE B 36 -3.382 10.012 -3.131 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -5.744 10.930 -4.813 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -4.057 11.108 -5.253 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -5.381 8.609 -2.827 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -5.032 9.586 -1.381 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -6.346 10.064 -2.482 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -5.062 9.191 -6.395 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -3.788 8.653 -5.275 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -5.501 8.472 -4.828 1.00 0.00 H new ATOM 972 N PRO B 37 -5.095 12.111 -0.357 1.00 0.00 N ATOM 973 CA PRO B 37 -4.975 12.096 1.104 1.00 0.00 C ATOM 974 C PRO B 37 -4.346 10.802 1.618 1.00 0.00 C ATOM 975 O PRO B 37 -4.718 9.711 1.189 1.00 0.00 O ATOM 976 CB PRO B 37 -6.426 12.223 1.597 1.00 0.00 C ATOM 977 CG PRO B 37 -7.280 11.989 0.395 1.00 0.00 C ATOM 978 CD PRO B 37 -6.465 12.432 -0.782 1.00 0.00 C ATOM 0 HA PRO B 37 -4.325 12.894 1.463 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -6.640 11.493 2.378 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -6.610 13.209 2.023 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -7.552 10.937 0.308 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -8.210 12.554 0.461 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -6.743 11.900 -1.692 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -6.589 13.496 -0.984 1.00 0.00 H new ATOM 986 N PRO B 38 -3.376 10.910 2.546 1.00 0.00 N ATOM 987 CA PRO B 38 -2.690 9.743 3.114 1.00 0.00 C ATOM 988 C PRO B 38 -3.620 8.858 3.936 1.00 0.00 C ATOM 989 O PRO B 38 -3.559 7.632 3.850 1.00 0.00 O ATOM 990 CB PRO B 38 -1.611 10.358 4.011 1.00 0.00 C ATOM 991 CG PRO B 38 -2.113 11.723 4.329 1.00 0.00 C ATOM 992 CD PRO B 38 -2.869 12.174 3.112 1.00 0.00 C ATOM 0 HA PRO B 38 -2.296 9.092 2.334 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -1.466 9.769 4.917 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -0.649 10.399 3.501 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -2.759 11.708 5.207 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -1.289 12.401 4.551 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -3.681 12.854 3.371 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -2.224 12.701 2.409 1.00 0.00 H new ATOM 1000 N ASP B 39 -4.474 9.487 4.737 1.00 0.00 N ATOM 1001 CA ASP B 39 -5.412 8.753 5.581 1.00 0.00 C ATOM 1002 C ASP B 39 -6.310 7.847 4.745 1.00 0.00 C ATOM 1003 O ASP B 39 -6.520 6.683 5.084 1.00 0.00 O ATOM 1004 CB ASP B 39 -6.267 9.726 6.394 1.00 0.00 C ATOM 1005 CG ASP B 39 -5.434 10.622 7.288 1.00 0.00 C ATOM 1006 OD1 ASP B 39 -4.710 10.089 8.155 1.00 0.00 O ATOM 1007 OD2 ASP B 39 -5.504 11.858 7.121 1.00 0.00 O ATOM 0 H ASP B 39 -4.536 10.502 4.820 1.00 0.00 H new ATOM 0 HA ASP B 39 -4.833 8.129 6.262 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -6.856 10.342 5.715 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -6.972 9.162 7.005 1.00 0.00 H new ATOM 1012 N GLN B 40 -6.843 8.390 3.654 1.00 0.00 N ATOM 1013 CA GLN B 40 -7.724 7.628 2.775 1.00 0.00 C ATOM 1014 C GLN B 40 -6.992 6.457 2.129 1.00 0.00 C ATOM 1015 O GLN B 40 -7.406 5.306 2.268 1.00 0.00 O ATOM 1016 CB GLN B 40 -8.316 8.534 1.693 1.00 0.00 C ATOM 1017 CG GLN B 40 -9.472 9.403 2.171 1.00 0.00 C ATOM 1018 CD GLN B 40 -9.096 10.337 3.307 1.00 0.00 C ATOM 1019 OE1 GLN B 40 -8.780 9.899 4.413 1.00 0.00 O ATOM 1020 NE2 GLN B 40 -9.131 11.637 3.038 1.00 0.00 N ATOM 0 H GLN B 40 -6.681 9.353 3.358 1.00 0.00 H new ATOM 0 HA GLN B 40 -8.532 7.227 3.387 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -7.528 9.179 1.304 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -8.660 7.915 0.864 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -9.843 9.993 1.333 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -10.290 8.760 2.495 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -9.398 11.958 2.108 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -8.890 12.314 3.762 1.00 0.00 H new ATOM 1029 N GLN B 41 -5.905 6.751 1.422 1.00 0.00 N ATOM 1030 CA GLN B 41 -5.129 5.710 0.758 1.00 0.00 C ATOM 1031 C GLN B 41 -4.483 4.782 1.783 1.00 0.00 C ATOM 1032 O GLN B 41 -3.832 5.238 2.723 1.00 0.00 O ATOM 1033 CB GLN B 41 -4.057 6.330 -0.142 1.00 0.00 C ATOM 1034 CG GLN B 41 -3.047 7.186 0.604 1.00 0.00 C ATOM 1035 CD GLN B 41 -1.991 7.771 -0.313 1.00 0.00 C ATOM 1036 OE1 GLN B 41 -1.257 7.041 -0.979 1.00 0.00 O ATOM 1037 NE2 GLN B 41 -1.906 9.096 -0.348 1.00 0.00 N ATOM 0 H GLN B 41 -5.543 7.696 1.295 1.00 0.00 H new ATOM 0 HA GLN B 41 -5.808 5.124 0.139 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -3.528 5.532 -0.663 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -4.544 6.940 -0.903 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -3.569 7.995 1.115 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -2.563 6.584 1.373 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -2.535 9.663 0.221 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -1.212 9.547 -0.944 1.00 0.00 H new ATOM 1046 N ARG B 42 -4.666 3.479 1.598 1.00 0.00 N ATOM 1047 CA ARG B 42 -4.096 2.498 2.514 1.00 0.00 C ATOM 1048 C ARG B 42 -3.190 1.519 1.775 1.00 0.00 C ATOM 1049 O ARG B 42 -3.620 0.838 0.845 1.00 0.00 O ATOM 1050 CB ARG B 42 -5.210 1.737 3.235 1.00 0.00 C ATOM 1051 CG ARG B 42 -6.129 2.633 4.049 1.00 0.00 C ATOM 1052 CD ARG B 42 -7.204 1.828 4.761 1.00 0.00 C ATOM 1053 NE ARG B 42 -6.638 0.837 5.675 1.00 0.00 N ATOM 1054 CZ ARG B 42 -5.911 1.146 6.746 1.00 0.00 C ATOM 1055 NH1 ARG B 42 -5.676 2.415 7.054 1.00 0.00 N ATOM 1056 NH2 ARG B 42 -5.422 0.183 7.516 1.00 0.00 N ATOM 0 H ARG B 42 -5.201 3.080 0.827 1.00 0.00 H new ATOM 0 HA ARG B 42 -3.494 3.033 3.249 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -5.803 1.194 2.499 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -4.763 0.994 3.895 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -5.543 3.187 4.782 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -6.597 3.367 3.394 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -7.853 2.504 5.318 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -7.827 1.324 4.022 1.00 0.00 H new ATOM 0 HE ARG B 42 -6.811 -0.149 5.480 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -6.053 3.160 6.469 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -5.118 2.645 7.876 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -5.603 -0.794 7.287 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -4.865 0.420 8.337 1.00 0.00 H new ATOM 1070 N LEU B 43 -1.932 1.454 2.201 1.00 0.00 N ATOM 1071 CA LEU B 43 -0.958 0.559 1.586 1.00 0.00 C ATOM 1072 C LEU B 43 -1.131 -0.870 2.089 1.00 0.00 C ATOM 1073 O LEU B 43 -1.375 -1.098 3.275 1.00 0.00 O ATOM 1074 CB LEU B 43 0.465 1.046 1.867 1.00 0.00 C ATOM 1075 CG LEU B 43 0.807 2.423 1.293 1.00 0.00 C ATOM 1076 CD1 LEU B 43 2.220 2.828 1.682 1.00 0.00 C ATOM 1077 CD2 LEU B 43 0.649 2.426 -0.221 1.00 0.00 C ATOM 0 H LEU B 43 -1.563 2.012 2.971 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.129 0.565 0.510 1.00 0.00 H new ATOM 0 HB2 LEU B 43 0.617 1.072 2.946 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.168 0.317 1.464 1.00 0.00 H new ATOM 0 HG LEU B 43 0.113 3.151 1.712 1.00 0.00 H new ATOM 0 HD11 LEU B 43 2.445 3.810 1.265 1.00 0.00 H new ATOM 0 HD12 LEU B 43 2.301 2.868 2.768 1.00 0.00 H new ATOM 0 HD13 LEU B 43 2.928 2.097 1.292 1.00 0.00 H new ATOM 0 HD21 LEU B 43 0.897 3.413 -0.611 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.318 1.685 -0.658 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -0.381 2.182 -0.480 1.00 0.00 H new ATOM 1089 N ILE B 44 -1.001 -1.828 1.177 1.00 0.00 N ATOM 1090 CA ILE B 44 -1.141 -3.238 1.518 1.00 0.00 C ATOM 1091 C ILE B 44 -0.034 -4.065 0.873 1.00 0.00 C ATOM 1092 O ILE B 44 0.325 -3.845 -0.285 1.00 0.00 O ATOM 1093 CB ILE B 44 -2.511 -3.792 1.073 1.00 0.00 C ATOM 1094 CG1 ILE B 44 -3.643 -3.009 1.743 1.00 0.00 C ATOM 1095 CG2 ILE B 44 -2.618 -5.277 1.396 1.00 0.00 C ATOM 1096 CD1 ILE B 44 -5.028 -3.455 1.321 1.00 0.00 C ATOM 0 H ILE B 44 -0.798 -1.652 0.193 1.00 0.00 H new ATOM 0 HA ILE B 44 -1.066 -3.314 2.603 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.601 -3.672 -0.007 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.552 -3.111 2.824 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -3.526 -1.950 1.512 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -3.591 -5.650 1.075 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -1.831 -5.821 0.874 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -2.509 -5.424 2.471 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -5.777 -2.854 1.837 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -5.139 -3.327 0.244 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -5.166 -4.505 1.577 1.00 0.00 H new ATOM 1108 N PHE B 45 0.504 -5.013 1.634 1.00 0.00 N ATOM 1109 CA PHE B 45 1.574 -5.874 1.147 1.00 0.00 C ATOM 1110 C PHE B 45 1.693 -7.123 2.014 1.00 0.00 C ATOM 1111 O PHE B 45 1.585 -7.051 3.240 1.00 0.00 O ATOM 1112 CB PHE B 45 2.904 -5.115 1.140 1.00 0.00 C ATOM 1113 CG PHE B 45 4.048 -5.899 0.558 1.00 0.00 C ATOM 1114 CD1 PHE B 45 3.942 -6.481 -0.696 1.00 0.00 C ATOM 1115 CD2 PHE B 45 5.229 -6.051 1.266 1.00 0.00 C ATOM 1116 CE1 PHE B 45 4.994 -7.201 -1.232 1.00 0.00 C ATOM 1117 CE2 PHE B 45 6.283 -6.770 0.736 1.00 0.00 C ATOM 1118 CZ PHE B 45 6.166 -7.346 -0.515 1.00 0.00 C ATOM 0 H PHE B 45 0.215 -5.204 2.593 1.00 0.00 H new ATOM 0 HA PHE B 45 1.333 -6.177 0.128 1.00 0.00 H new ATOM 0 HB2 PHE B 45 2.782 -4.193 0.572 1.00 0.00 H new ATOM 0 HB3 PHE B 45 3.154 -4.830 2.162 1.00 0.00 H new ATOM 0 HD1 PHE B 45 3.028 -6.371 -1.260 1.00 0.00 H new ATOM 0 HD2 PHE B 45 5.327 -5.602 2.243 1.00 0.00 H new ATOM 0 HE1 PHE B 45 4.900 -7.649 -2.210 1.00 0.00 H new ATOM 0 HE2 PHE B 45 7.198 -6.882 1.299 1.00 0.00 H new ATOM 0 HZ PHE B 45 6.989 -7.908 -0.931 1.00 0.00 H new ATOM 1128 N ALA B 46 1.908 -8.266 1.369 1.00 0.00 N ATOM 1129 CA ALA B 46 2.035 -9.536 2.076 1.00 0.00 C ATOM 1130 C ALA B 46 0.843 -9.767 2.997 1.00 0.00 C ATOM 1131 O ALA B 46 0.992 -10.269 4.111 1.00 0.00 O ATOM 1132 CB ALA B 46 3.335 -9.573 2.866 1.00 0.00 C ATOM 0 H ALA B 46 1.998 -8.338 0.356 1.00 0.00 H new ATOM 0 HA ALA B 46 2.052 -10.338 1.338 1.00 0.00 H new ATOM 0 HB1 ALA B 46 3.416 -10.526 3.388 1.00 0.00 H new ATOM 0 HB2 ALA B 46 4.178 -9.460 2.185 1.00 0.00 H new ATOM 0 HB3 ALA B 46 3.343 -8.760 3.592 1.00 0.00 H new ATOM 1138 N GLY B 47 -0.340 -9.392 2.521 1.00 0.00 N ATOM 1139 CA GLY B 47 -1.547 -9.558 3.306 1.00 0.00 C ATOM 1140 C GLY B 47 -1.493 -8.801 4.619 1.00 0.00 C ATOM 1141 O GLY B 47 -2.016 -9.267 5.631 1.00 0.00 O ATOM 0 H GLY B 47 -0.483 -8.974 1.601 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.404 -9.214 2.727 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -1.703 -10.618 3.507 1.00 0.00 H new ATOM 1145 N LYS B 48 -0.864 -7.627 4.600 1.00 0.00 N ATOM 1146 CA LYS B 48 -0.745 -6.798 5.797 1.00 0.00 C ATOM 1147 C LYS B 48 -0.644 -5.321 5.427 1.00 0.00 C ATOM 1148 O LYS B 48 0.210 -4.928 4.634 1.00 0.00 O ATOM 1149 CB LYS B 48 0.489 -7.200 6.614 1.00 0.00 C ATOM 1150 CG LYS B 48 0.431 -8.614 7.169 1.00 0.00 C ATOM 1151 CD LYS B 48 1.681 -8.952 7.965 1.00 0.00 C ATOM 1152 CE LYS B 48 1.622 -10.365 8.523 1.00 0.00 C ATOM 1153 NZ LYS B 48 0.454 -10.557 9.427 1.00 0.00 N ATOM 0 H LYS B 48 -0.429 -7.229 3.768 1.00 0.00 H new ATOM 0 HA LYS B 48 -1.641 -6.955 6.398 1.00 0.00 H new ATOM 0 HB2 LYS B 48 1.375 -7.104 5.986 1.00 0.00 H new ATOM 0 HB3 LYS B 48 0.607 -6.501 7.442 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -0.447 -8.720 7.806 1.00 0.00 H new ATOM 0 HG3 LYS B 48 0.318 -9.323 6.349 1.00 0.00 H new ATOM 0 HD2 LYS B 48 2.559 -8.848 7.327 1.00 0.00 H new ATOM 0 HD3 LYS B 48 1.796 -8.241 8.783 1.00 0.00 H new ATOM 0 HE2 LYS B 48 1.565 -11.078 7.700 1.00 0.00 H new ATOM 0 HE3 LYS B 48 2.542 -10.579 9.068 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 0.574 -11.438 9.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 0.388 -9.754 10.085 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -0.417 -10.614 8.862 1.00 0.00 H new ATOM 1167 N GLN B 49 -1.516 -4.509 6.017 1.00 0.00 N ATOM 1168 CA GLN B 49 -1.518 -3.074 5.760 1.00 0.00 C ATOM 1169 C GLN B 49 -0.322 -2.412 6.435 1.00 0.00 C ATOM 1170 O GLN B 49 -0.043 -2.668 7.607 1.00 0.00 O ATOM 1171 CB GLN B 49 -2.819 -2.439 6.263 1.00 0.00 C ATOM 1172 CG GLN B 49 -4.046 -2.770 5.421 1.00 0.00 C ATOM 1173 CD GLN B 49 -4.330 -4.259 5.328 1.00 0.00 C ATOM 1174 OE1 GLN B 49 -3.598 -5.006 4.678 1.00 0.00 O ATOM 1175 NE2 GLN B 49 -5.397 -4.698 5.984 1.00 0.00 N ATOM 0 H GLN B 49 -2.230 -4.821 6.676 1.00 0.00 H new ATOM 0 HA GLN B 49 -1.446 -2.920 4.683 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -2.997 -2.766 7.287 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -2.694 -1.357 6.292 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -4.915 -2.268 5.846 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -3.907 -2.371 4.416 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -5.977 -4.044 6.511 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -5.637 -5.689 5.962 1.00 0.00 H new ATOM 1184 N LEU B 50 0.386 -1.565 5.693 1.00 0.00 N ATOM 1185 CA LEU B 50 1.553 -0.879 6.237 1.00 0.00 C ATOM 1186 C LEU B 50 1.149 0.083 7.351 1.00 0.00 C ATOM 1187 O LEU B 50 0.304 0.957 7.153 1.00 0.00 O ATOM 1188 CB LEU B 50 2.294 -0.119 5.132 1.00 0.00 C ATOM 1189 CG LEU B 50 2.764 -0.972 3.949 1.00 0.00 C ATOM 1190 CD1 LEU B 50 3.517 -0.118 2.941 1.00 0.00 C ATOM 1191 CD2 LEU B 50 3.638 -2.124 4.426 1.00 0.00 C ATOM 0 H LEU B 50 0.174 -1.339 4.721 1.00 0.00 H new ATOM 0 HA LEU B 50 2.220 -1.633 6.655 1.00 0.00 H new ATOM 0 HB2 LEU B 50 1.640 0.667 4.754 1.00 0.00 H new ATOM 0 HB3 LEU B 50 3.162 0.372 5.572 1.00 0.00 H new ATOM 0 HG LEU B 50 1.883 -1.390 3.461 1.00 0.00 H new ATOM 0 HD11 LEU B 50 3.843 -0.741 2.108 1.00 0.00 H new ATOM 0 HD12 LEU B 50 2.862 0.670 2.570 1.00 0.00 H new ATOM 0 HD13 LEU B 50 4.387 0.330 3.421 1.00 0.00 H new ATOM 0 HD21 LEU B 50 3.960 -2.716 3.569 1.00 0.00 H new ATOM 0 HD22 LEU B 50 4.512 -1.728 4.942 1.00 0.00 H new ATOM 0 HD23 LEU B 50 3.068 -2.754 5.109 1.00 0.00 H new ATOM 1203 N GLU B 51 1.762 -0.082 8.520 1.00 0.00 N ATOM 1204 CA GLU B 51 1.472 0.771 9.669 1.00 0.00 C ATOM 1205 C GLU B 51 2.122 2.142 9.505 1.00 0.00 C ATOM 1206 O GLU B 51 3.249 2.247 9.027 1.00 0.00 O ATOM 1207 CB GLU B 51 1.962 0.111 10.959 1.00 0.00 C ATOM 1208 CG GLU B 51 1.313 -1.235 11.238 1.00 0.00 C ATOM 1209 CD GLU B 51 1.814 -1.868 12.521 1.00 0.00 C ATOM 1210 OE1 GLU B 51 3.032 -2.128 12.618 1.00 0.00 O ATOM 1211 OE2 GLU B 51 0.989 -2.104 13.428 1.00 0.00 O ATOM 0 H GLU B 51 2.464 -0.800 8.697 1.00 0.00 H new ATOM 0 HA GLU B 51 0.392 0.905 9.727 1.00 0.00 H new ATOM 0 HB2 GLU B 51 3.043 -0.021 10.902 1.00 0.00 H new ATOM 0 HB3 GLU B 51 1.766 0.780 11.797 1.00 0.00 H new ATOM 0 HG2 GLU B 51 0.232 -1.108 11.298 1.00 0.00 H new ATOM 0 HG3 GLU B 51 1.509 -1.909 10.404 1.00 0.00 H new ATOM 1218 N ASP B 52 1.400 3.189 9.896 1.00 0.00 N ATOM 1219 CA ASP B 52 1.904 4.556 9.785 1.00 0.00 C ATOM 1220 C ASP B 52 2.927 4.872 10.878 1.00 0.00 C ATOM 1221 O ASP B 52 2.830 5.900 11.550 1.00 0.00 O ATOM 1222 CB ASP B 52 0.743 5.553 9.849 1.00 0.00 C ATOM 1223 CG ASP B 52 -0.055 5.443 11.136 1.00 0.00 C ATOM 1224 OD1 ASP B 52 0.282 4.582 11.976 1.00 0.00 O ATOM 1225 OD2 ASP B 52 -1.020 6.218 11.301 1.00 0.00 O ATOM 0 H ASP B 52 0.463 3.117 10.293 1.00 0.00 H new ATOM 0 HA ASP B 52 2.407 4.646 8.822 1.00 0.00 H new ATOM 0 HB2 ASP B 52 1.134 6.566 9.755 1.00 0.00 H new ATOM 0 HB3 ASP B 52 0.080 5.387 9.000 1.00 0.00 H new ATOM 1230 N GLY B 53 3.908 3.990 11.050 1.00 0.00 N ATOM 1231 CA GLY B 53 4.927 4.208 12.061 1.00 0.00 C ATOM 1232 C GLY B 53 5.924 3.067 12.146 1.00 0.00 C ATOM 1233 O GLY B 53 6.235 2.593 13.239 1.00 0.00 O ATOM 0 H GLY B 53 4.015 3.132 10.509 1.00 0.00 H new ATOM 0 HA2 GLY B 53 5.459 5.134 11.841 1.00 0.00 H new ATOM 0 HA3 GLY B 53 4.448 4.339 13.031 1.00 0.00 H new ATOM 1237 N ARG B 54 6.427 2.627 10.994 1.00 0.00 N ATOM 1238 CA ARG B 54 7.392 1.534 10.945 1.00 0.00 C ATOM 1239 C ARG B 54 8.311 1.662 9.732 1.00 0.00 C ATOM 1240 O ARG B 54 7.867 1.996 8.634 1.00 0.00 O ATOM 1241 CB ARG B 54 6.670 0.188 10.900 1.00 0.00 C ATOM 1242 CG ARG B 54 5.964 -0.181 12.196 1.00 0.00 C ATOM 1243 CD ARG B 54 6.953 -0.375 13.336 1.00 0.00 C ATOM 1244 NE ARG B 54 6.291 -0.734 14.588 1.00 0.00 N ATOM 1245 CZ ARG B 54 5.594 -1.854 14.765 1.00 0.00 C ATOM 1246 NH1 ARG B 54 5.474 -2.730 13.776 1.00 0.00 N ATOM 1247 NH2 ARG B 54 5.019 -2.100 15.935 1.00 0.00 N ATOM 0 H ARG B 54 6.181 3.012 10.082 1.00 0.00 H new ATOM 0 HA ARG B 54 8.000 1.589 11.848 1.00 0.00 H new ATOM 0 HB2 ARG B 54 5.938 0.207 10.093 1.00 0.00 H new ATOM 0 HB3 ARG B 54 7.392 -0.592 10.657 1.00 0.00 H new ATOM 0 HG2 ARG B 54 5.253 0.602 12.460 1.00 0.00 H new ATOM 0 HG3 ARG B 54 5.391 -1.097 12.051 1.00 0.00 H new ATOM 0 HD2 ARG B 54 7.665 -1.155 13.067 1.00 0.00 H new ATOM 0 HD3 ARG B 54 7.524 0.542 13.479 1.00 0.00 H new ATOM 0 HE ARG B 54 6.368 -0.088 15.373 1.00 0.00 H new ATOM 0 HH11 ARG B 54 5.917 -2.546 12.876 1.00 0.00 H new ATOM 0 HH12 ARG B 54 4.939 -3.587 13.916 1.00 0.00 H new ATOM 0 HH21 ARG B 54 5.111 -1.431 16.699 1.00 0.00 H new ATOM 0 HH22 ARG B 54 4.485 -2.958 16.070 1.00 0.00 H new ATOM 1261 N THR B 55 9.595 1.391 9.945 1.00 0.00 N ATOM 1262 CA THR B 55 10.588 1.470 8.879 1.00 0.00 C ATOM 1263 C THR B 55 10.417 0.337 7.871 1.00 0.00 C ATOM 1264 O THR B 55 10.050 -0.781 8.231 1.00 0.00 O ATOM 1265 CB THR B 55 12.021 1.430 9.441 1.00 0.00 C ATOM 1266 OG1 THR B 55 12.225 0.220 10.179 1.00 0.00 O ATOM 1267 CG2 THR B 55 12.281 2.628 10.341 1.00 0.00 C ATOM 0 H THR B 55 9.973 1.113 10.851 1.00 0.00 H new ATOM 0 HA THR B 55 10.428 2.423 8.375 1.00 0.00 H new ATOM 0 HB THR B 55 12.718 1.465 8.603 1.00 0.00 H new ATOM 0 HG1 THR B 55 12.343 -0.527 9.556 1.00 0.00 H new ATOM 0 HG21 THR B 55 13.299 2.579 10.727 1.00 0.00 H new ATOM 0 HG22 THR B 55 12.153 3.547 9.769 1.00 0.00 H new ATOM 0 HG23 THR B 55 11.577 2.618 11.173 1.00 0.00 H new ATOM 1275 N LEU B 56 10.683 0.643 6.605 1.00 0.00 N ATOM 1276 CA LEU B 56 10.560 -0.335 5.527 1.00 0.00 C ATOM 1277 C LEU B 56 11.538 -1.496 5.704 1.00 0.00 C ATOM 1278 O LEU B 56 11.249 -2.624 5.304 1.00 0.00 O ATOM 1279 CB LEU B 56 10.801 0.341 4.176 1.00 0.00 C ATOM 1280 CG LEU B 56 9.825 1.466 3.825 1.00 0.00 C ATOM 1281 CD1 LEU B 56 10.209 2.112 2.504 1.00 0.00 C ATOM 1282 CD2 LEU B 56 8.402 0.935 3.762 1.00 0.00 C ATOM 0 H LEU B 56 10.987 1.567 6.298 1.00 0.00 H new ATOM 0 HA LEU B 56 9.548 -0.739 5.561 1.00 0.00 H new ATOM 0 HB2 LEU B 56 11.814 0.744 4.165 1.00 0.00 H new ATOM 0 HB3 LEU B 56 10.752 -0.417 3.395 1.00 0.00 H new ATOM 0 HG LEU B 56 9.877 2.223 4.607 1.00 0.00 H new ATOM 0 HD11 LEU B 56 9.504 2.910 2.271 1.00 0.00 H new ATOM 0 HD12 LEU B 56 11.214 2.527 2.580 1.00 0.00 H new ATOM 0 HD13 LEU B 56 10.185 1.363 1.712 1.00 0.00 H new ATOM 0 HD21 LEU B 56 7.721 1.748 3.511 1.00 0.00 H new ATOM 0 HD22 LEU B 56 8.337 0.159 2.999 1.00 0.00 H new ATOM 0 HD23 LEU B 56 8.127 0.517 4.730 1.00 0.00 H new ATOM 1294 N SER B 57 12.701 -1.209 6.285 1.00 0.00 N ATOM 1295 CA SER B 57 13.730 -2.227 6.492 1.00 0.00 C ATOM 1296 C SER B 57 13.168 -3.462 7.192 1.00 0.00 C ATOM 1297 O SER B 57 13.417 -4.590 6.765 1.00 0.00 O ATOM 1298 CB SER B 57 14.891 -1.652 7.305 1.00 0.00 C ATOM 1299 OG SER B 57 15.474 -0.541 6.647 1.00 0.00 O ATOM 0 H SER B 57 12.955 -0.280 6.621 1.00 0.00 H new ATOM 0 HA SER B 57 14.092 -2.532 5.510 1.00 0.00 H new ATOM 0 HB2 SER B 57 14.535 -1.349 8.290 1.00 0.00 H new ATOM 0 HB3 SER B 57 15.646 -2.423 7.462 1.00 0.00 H new ATOM 0 HG SER B 57 16.195 -0.850 6.060 1.00 0.00 H new ATOM 1305 N ASP B 58 12.413 -3.248 8.266 1.00 0.00 N ATOM 1306 CA ASP B 58 11.823 -4.355 9.014 1.00 0.00 C ATOM 1307 C ASP B 58 10.959 -5.227 8.109 1.00 0.00 C ATOM 1308 O ASP B 58 11.040 -6.455 8.154 1.00 0.00 O ATOM 1309 CB ASP B 58 10.992 -3.828 10.185 1.00 0.00 C ATOM 1310 CG ASP B 58 11.848 -3.176 11.253 1.00 0.00 C ATOM 1311 OD1 ASP B 58 12.576 -2.217 10.926 1.00 0.00 O ATOM 1312 OD2 ASP B 58 11.789 -3.625 12.417 1.00 0.00 O ATOM 0 H ASP B 58 12.196 -2.323 8.637 1.00 0.00 H new ATOM 0 HA ASP B 58 12.636 -4.966 9.406 1.00 0.00 H new ATOM 0 HB2 ASP B 58 10.265 -3.106 9.815 1.00 0.00 H new ATOM 0 HB3 ASP B 58 10.429 -4.650 10.626 1.00 0.00 H new ATOM 1317 N TYR B 59 10.137 -4.585 7.285 1.00 0.00 N ATOM 1318 CA TYR B 59 9.263 -5.305 6.364 1.00 0.00 C ATOM 1319 C TYR B 59 10.074 -6.070 5.326 1.00 0.00 C ATOM 1320 O TYR B 59 9.651 -7.124 4.849 1.00 0.00 O ATOM 1321 CB TYR B 59 8.304 -4.343 5.658 1.00 0.00 C ATOM 1322 CG TYR B 59 7.307 -3.679 6.581 1.00 0.00 C ATOM 1323 CD1 TYR B 59 7.722 -2.794 7.567 1.00 0.00 C ATOM 1324 CD2 TYR B 59 5.948 -3.942 6.466 1.00 0.00 C ATOM 1325 CE1 TYR B 59 6.812 -2.188 8.410 1.00 0.00 C ATOM 1326 CE2 TYR B 59 5.031 -3.340 7.306 1.00 0.00 C ATOM 1327 CZ TYR B 59 5.468 -2.464 8.276 1.00 0.00 C ATOM 1328 OH TYR B 59 4.559 -1.861 9.114 1.00 0.00 O ATOM 0 H TYR B 59 10.057 -3.569 7.236 1.00 0.00 H new ATOM 0 HA TYR B 59 8.683 -6.017 6.952 1.00 0.00 H new ATOM 0 HB2 TYR B 59 8.886 -3.572 5.153 1.00 0.00 H new ATOM 0 HB3 TYR B 59 7.761 -4.889 4.886 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.774 -2.576 7.676 1.00 0.00 H new ATOM 0 HD2 TYR B 59 5.602 -4.629 5.707 1.00 0.00 H new ATOM 0 HE1 TYR B 59 7.151 -1.501 9.171 1.00 0.00 H new ATOM 0 HE2 TYR B 59 3.978 -3.555 7.203 1.00 0.00 H new ATOM 0 HH TYR B 59 3.869 -2.509 9.369 1.00 0.00 H new ATOM 1338 N ASN B 60 11.235 -5.524 4.968 1.00 0.00 N ATOM 1339 CA ASN B 60 12.103 -6.146 3.974 1.00 0.00 C ATOM 1340 C ASN B 60 11.391 -6.193 2.623 1.00 0.00 C ATOM 1341 O ASN B 60 11.321 -7.236 1.974 1.00 0.00 O ATOM 1342 CB ASN B 60 12.507 -7.556 4.421 1.00 0.00 C ATOM 1343 CG ASN B 60 13.640 -8.134 3.593 1.00 0.00 C ATOM 1344 OD1 ASN B 60 14.759 -8.425 4.246 1.00 0.00 O flip ATOM 1345 ND2 ASN B 60 13.514 -8.319 2.383 1.00 0.00 N flip ATOM 0 H ASN B 60 11.595 -4.651 5.353 1.00 0.00 H new ATOM 0 HA ASN B 60 13.010 -5.550 3.873 1.00 0.00 H new ATOM 0 HB2 ASN B 60 12.806 -7.528 5.469 1.00 0.00 H new ATOM 0 HB3 ASN B 60 11.641 -8.215 4.354 1.00 0.00 H new ATOM 0 HD21 ASN B 60 12.637 -8.082 1.919 1.00 0.00 H new ATOM 0 HD22 ASN B 60 14.287 -8.710 1.844 1.00 0.00 H new ATOM 1352 N ILE B 61 10.851 -5.048 2.216 1.00 0.00 N ATOM 1353 CA ILE B 61 10.129 -4.944 0.952 1.00 0.00 C ATOM 1354 C ILE B 61 11.069 -5.099 -0.241 1.00 0.00 C ATOM 1355 O ILE B 61 12.140 -4.494 -0.284 1.00 0.00 O ATOM 1356 CB ILE B 61 9.390 -3.595 0.843 1.00 0.00 C ATOM 1357 CG1 ILE B 61 8.455 -3.406 2.042 1.00 0.00 C ATOM 1358 CG2 ILE B 61 8.608 -3.522 -0.462 1.00 0.00 C ATOM 1359 CD1 ILE B 61 7.738 -2.072 2.050 1.00 0.00 C ATOM 0 H ILE B 61 10.900 -4.177 2.745 1.00 0.00 H new ATOM 0 HA ILE B 61 9.400 -5.754 0.936 1.00 0.00 H new ATOM 0 HB ILE B 61 10.126 -2.791 0.847 1.00 0.00 H new ATOM 0 HG12 ILE B 61 7.715 -4.206 2.044 1.00 0.00 H new ATOM 0 HG13 ILE B 61 9.033 -3.504 2.961 1.00 0.00 H new ATOM 0 HG21 ILE B 61 8.092 -2.564 -0.524 1.00 0.00 H new ATOM 0 HG22 ILE B 61 9.294 -3.620 -1.303 1.00 0.00 H new ATOM 0 HG23 ILE B 61 7.877 -4.330 -0.494 1.00 0.00 H new ATOM 0 HD11 ILE B 61 7.094 -2.010 2.928 1.00 0.00 H new ATOM 0 HD12 ILE B 61 8.471 -1.265 2.080 1.00 0.00 H new ATOM 0 HD13 ILE B 61 7.132 -1.979 1.149 1.00 0.00 H new ATOM 1371 N GLN B 62 10.656 -5.914 -1.207 1.00 0.00 N ATOM 1372 CA GLN B 62 11.454 -6.153 -2.407 1.00 0.00 C ATOM 1373 C GLN B 62 11.508 -4.909 -3.290 1.00 0.00 C ATOM 1374 O GLN B 62 10.573 -4.109 -3.312 1.00 0.00 O ATOM 1375 CB GLN B 62 10.883 -7.330 -3.202 1.00 0.00 C ATOM 1376 CG GLN B 62 9.462 -7.103 -3.692 1.00 0.00 C ATOM 1377 CD GLN B 62 8.935 -8.264 -4.513 1.00 0.00 C ATOM 1378 OE1 GLN B 62 8.837 -9.390 -4.027 1.00 0.00 O ATOM 1379 NE2 GLN B 62 8.594 -7.994 -5.768 1.00 0.00 N ATOM 0 H GLN B 62 9.772 -6.421 -1.183 1.00 0.00 H new ATOM 0 HA GLN B 62 12.469 -6.394 -2.090 1.00 0.00 H new ATOM 0 HB2 GLN B 62 11.527 -7.525 -4.060 1.00 0.00 H new ATOM 0 HB3 GLN B 62 10.905 -8.223 -2.578 1.00 0.00 H new ATOM 0 HG2 GLN B 62 8.808 -6.942 -2.835 1.00 0.00 H new ATOM 0 HG3 GLN B 62 9.430 -6.194 -4.293 1.00 0.00 H new ATOM 0 HE21 GLN B 62 8.692 -7.045 -6.130 1.00 0.00 H new ATOM 0 HE22 GLN B 62 8.234 -8.735 -6.370 1.00 0.00 H new ATOM 1388 N LYS B 63 12.611 -4.754 -4.017 1.00 0.00 N ATOM 1389 CA LYS B 63 12.797 -3.618 -4.905 1.00 0.00 C ATOM 1390 C LYS B 63 11.665 -3.529 -5.927 1.00 0.00 C ATOM 1391 O LYS B 63 11.109 -4.549 -6.336 1.00 0.00 O ATOM 1392 CB LYS B 63 14.145 -3.736 -5.617 1.00 0.00 C ATOM 1393 CG LYS B 63 14.423 -2.591 -6.570 1.00 0.00 C ATOM 1394 CD LYS B 63 15.782 -2.730 -7.241 1.00 0.00 C ATOM 1395 CE LYS B 63 15.863 -3.986 -8.094 1.00 0.00 C ATOM 1396 NZ LYS B 63 14.841 -3.990 -9.177 1.00 0.00 N ATOM 0 H LYS B 63 13.393 -5.408 -4.006 1.00 0.00 H new ATOM 0 HA LYS B 63 12.783 -2.706 -4.308 1.00 0.00 H new ATOM 0 HB2 LYS B 63 14.939 -3.780 -4.871 1.00 0.00 H new ATOM 0 HB3 LYS B 63 14.175 -4.675 -6.170 1.00 0.00 H new ATOM 0 HG2 LYS B 63 13.644 -2.555 -7.331 1.00 0.00 H new ATOM 0 HG3 LYS B 63 14.381 -1.647 -6.026 1.00 0.00 H new ATOM 0 HD2 LYS B 63 15.972 -1.855 -7.863 1.00 0.00 H new ATOM 0 HD3 LYS B 63 16.562 -2.756 -6.480 1.00 0.00 H new ATOM 0 HE2 LYS B 63 16.858 -4.063 -8.533 1.00 0.00 H new ATOM 0 HE3 LYS B 63 15.725 -4.863 -7.462 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 15.245 -4.418 -10.034 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 14.014 -4.542 -8.872 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 14.549 -3.013 -9.382 1.00 0.00 H new ATOM 1410 N GLU B 64 11.330 -2.298 -6.322 1.00 0.00 N ATOM 1411 CA GLU B 64 10.262 -2.038 -7.293 1.00 0.00 C ATOM 1412 C GLU B 64 9.024 -2.884 -7.005 1.00 0.00 C ATOM 1413 O GLU B 64 8.402 -3.430 -7.917 1.00 0.00 O ATOM 1414 CB GLU B 64 10.751 -2.262 -8.732 1.00 0.00 C ATOM 1415 CG GLU B 64 11.192 -3.684 -9.033 1.00 0.00 C ATOM 1416 CD GLU B 64 11.682 -3.857 -10.458 1.00 0.00 C ATOM 1417 OE1 GLU B 64 11.683 -2.860 -11.212 1.00 0.00 O ATOM 1418 OE2 GLU B 64 12.065 -4.989 -10.821 1.00 0.00 O ATOM 0 H GLU B 64 11.790 -1.455 -5.979 1.00 0.00 H new ATOM 0 HA GLU B 64 9.980 -0.990 -7.190 1.00 0.00 H new ATOM 0 HB2 GLU B 64 9.951 -1.990 -9.421 1.00 0.00 H new ATOM 0 HB3 GLU B 64 11.584 -1.587 -8.928 1.00 0.00 H new ATOM 0 HG2 GLU B 64 11.987 -3.967 -8.343 1.00 0.00 H new ATOM 0 HG3 GLU B 64 10.359 -4.364 -8.855 1.00 0.00 H new ATOM 1425 N SER B 65 8.671 -2.981 -5.727 1.00 0.00 N ATOM 1426 CA SER B 65 7.507 -3.751 -5.305 1.00 0.00 C ATOM 1427 C SER B 65 6.217 -2.983 -5.572 1.00 0.00 C ATOM 1428 O SER B 65 6.169 -1.760 -5.425 1.00 0.00 O ATOM 1429 CB SER B 65 7.607 -4.092 -3.818 1.00 0.00 C ATOM 1430 OG SER B 65 6.485 -4.845 -3.389 1.00 0.00 O ATOM 0 H SER B 65 9.177 -2.534 -4.963 1.00 0.00 H new ATOM 0 HA SER B 65 7.487 -4.674 -5.885 1.00 0.00 H new ATOM 0 HB2 SER B 65 8.520 -4.657 -3.632 1.00 0.00 H new ATOM 0 HB3 SER B 65 7.676 -3.173 -3.235 1.00 0.00 H new ATOM 0 HG SER B 65 6.575 -5.051 -2.435 1.00 0.00 H new ATOM 1436 N THR B 66 5.170 -3.707 -5.957 1.00 0.00 N ATOM 1437 CA THR B 66 3.878 -3.091 -6.231 1.00 0.00 C ATOM 1438 C THR B 66 2.989 -3.126 -4.990 1.00 0.00 C ATOM 1439 O THR B 66 2.340 -4.135 -4.710 1.00 0.00 O ATOM 1440 CB THR B 66 3.148 -3.792 -7.395 1.00 0.00 C ATOM 1441 OG1 THR B 66 3.962 -3.761 -8.574 1.00 0.00 O ATOM 1442 CG2 THR B 66 1.812 -3.121 -7.680 1.00 0.00 C ATOM 0 H THR B 66 5.192 -4.719 -6.086 1.00 0.00 H new ATOM 0 HA THR B 66 4.072 -2.056 -6.514 1.00 0.00 H new ATOM 0 HB THR B 66 2.964 -4.827 -7.107 1.00 0.00 H new ATOM 0 HG1 THR B 66 3.492 -4.210 -9.308 1.00 0.00 H new ATOM 0 HG21 THR B 66 1.316 -3.633 -8.505 1.00 0.00 H new ATOM 0 HG22 THR B 66 1.183 -3.171 -6.791 1.00 0.00 H new ATOM 0 HG23 THR B 66 1.979 -2.078 -7.949 1.00 0.00 H new ATOM 1450 N LEU B 67 2.962 -2.020 -4.249 1.00 0.00 N ATOM 1451 CA LEU B 67 2.150 -1.932 -3.040 1.00 0.00 C ATOM 1452 C LEU B 67 0.706 -1.582 -3.383 1.00 0.00 C ATOM 1453 O LEU B 67 0.447 -0.628 -4.115 1.00 0.00 O ATOM 1454 CB LEU B 67 2.721 -0.881 -2.083 1.00 0.00 C ATOM 1455 CG LEU B 67 4.163 -1.117 -1.627 1.00 0.00 C ATOM 1456 CD1 LEU B 67 4.618 0.010 -0.712 1.00 0.00 C ATOM 1457 CD2 LEU B 67 4.292 -2.458 -0.919 1.00 0.00 C ATOM 0 H LEU B 67 3.492 -1.175 -4.465 1.00 0.00 H new ATOM 0 HA LEU B 67 2.170 -2.906 -2.552 1.00 0.00 H new ATOM 0 HB2 LEU B 67 2.667 0.094 -2.568 1.00 0.00 H new ATOM 0 HB3 LEU B 67 2.083 -0.834 -1.201 1.00 0.00 H new ATOM 0 HG LEU B 67 4.803 -1.133 -2.509 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.645 -0.171 -0.395 1.00 0.00 H new ATOM 0 HD12 LEU B 67 4.565 0.958 -1.248 1.00 0.00 H new ATOM 0 HD13 LEU B 67 3.970 0.052 0.164 1.00 0.00 H new ATOM 0 HD21 LEU B 67 5.325 -2.605 -0.604 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.640 -2.472 -0.045 1.00 0.00 H new ATOM 0 HD23 LEU B 67 4.003 -3.258 -1.600 1.00 0.00 H new ATOM 1469 N HIS B 68 -0.232 -2.355 -2.846 1.00 0.00 N ATOM 1470 CA HIS B 68 -1.650 -2.119 -3.095 1.00 0.00 C ATOM 1471 C HIS B 68 -2.139 -0.890 -2.336 1.00 0.00 C ATOM 1472 O HIS B 68 -1.643 -0.580 -1.254 1.00 0.00 O ATOM 1473 CB HIS B 68 -2.475 -3.344 -2.701 1.00 0.00 C ATOM 1474 CG HIS B 68 -2.150 -4.563 -3.504 1.00 0.00 C ATOM 1475 ND1 HIS B 68 -1.672 -5.771 -3.126 1.00 0.00 N flip ATOM 1476 CD2 HIS B 68 -2.309 -4.627 -4.872 1.00 0.00 C flip ATOM 1477 CE1 HIS B 68 -1.554 -6.536 -4.260 1.00 0.00 C flip ATOM 1478 NE2 HIS B 68 -1.944 -5.823 -5.299 1.00 0.00 N flip ATOM 0 H HIS B 68 -0.037 -3.149 -2.236 1.00 0.00 H new ATOM 0 HA HIS B 68 -1.779 -1.938 -4.162 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -2.311 -3.559 -1.645 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -3.534 -3.113 -2.818 1.00 0.00 H new ATOM 0 HD1 HIS B 68 -1.442 -6.060 -2.175 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -2.675 -3.825 -5.497 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -1.200 -7.556 -4.296 1.00 0.00 H new ATOM 1487 N LEU B 69 -3.112 -0.192 -2.911 1.00 0.00 N ATOM 1488 CA LEU B 69 -3.664 1.004 -2.287 1.00 0.00 C ATOM 1489 C LEU B 69 -5.189 0.970 -2.327 1.00 0.00 C ATOM 1490 O LEU B 69 -5.788 0.828 -3.393 1.00 0.00 O ATOM 1491 CB LEU B 69 -3.137 2.258 -3.002 1.00 0.00 C ATOM 1492 CG LEU B 69 -3.435 3.598 -2.317 1.00 0.00 C ATOM 1493 CD1 LEU B 69 -2.581 4.700 -2.924 1.00 0.00 C ATOM 1494 CD2 LEU B 69 -4.910 3.958 -2.437 1.00 0.00 C ATOM 0 H LEU B 69 -3.534 -0.434 -3.807 1.00 0.00 H new ATOM 0 HA LEU B 69 -3.349 1.034 -1.244 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -2.057 2.162 -3.113 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -3.560 2.284 -4.006 1.00 0.00 H new ATOM 0 HG LEU B 69 -3.192 3.498 -1.259 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -2.802 5.646 -2.429 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -1.527 4.458 -2.791 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -2.802 4.787 -3.988 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -5.093 4.912 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -5.181 4.037 -3.490 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -5.513 3.183 -1.964 1.00 0.00 H new ATOM 1506 N VAL B 70 -5.811 1.113 -1.160 1.00 0.00 N ATOM 1507 CA VAL B 70 -7.264 1.109 -1.062 1.00 0.00 C ATOM 1508 C VAL B 70 -7.759 2.448 -0.532 1.00 0.00 C ATOM 1509 O VAL B 70 -7.285 2.927 0.500 1.00 0.00 O ATOM 1510 CB VAL B 70 -7.766 -0.018 -0.135 1.00 0.00 C ATOM 1511 CG1 VAL B 70 -9.287 -0.045 -0.092 1.00 0.00 C ATOM 1512 CG2 VAL B 70 -7.220 -1.367 -0.577 1.00 0.00 C ATOM 0 H VAL B 70 -5.329 1.233 -0.269 1.00 0.00 H new ATOM 0 HA VAL B 70 -7.659 0.937 -2.063 1.00 0.00 H new ATOM 0 HB VAL B 70 -7.399 0.185 0.871 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -9.618 -0.847 0.567 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -9.657 0.909 0.283 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -9.676 -0.216 -1.096 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -7.588 -2.145 0.092 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -7.550 -1.577 -1.594 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -6.131 -1.347 -0.546 1.00 0.00 H new ATOM 1522 N LEU B 71 -8.704 3.052 -1.241 1.00 0.00 N ATOM 1523 CA LEU B 71 -9.249 4.340 -0.832 1.00 0.00 C ATOM 1524 C LEU B 71 -10.276 4.172 0.282 1.00 0.00 C ATOM 1525 O LEU B 71 -11.247 3.428 0.140 1.00 0.00 O ATOM 1526 CB LEU B 71 -9.886 5.067 -2.022 1.00 0.00 C ATOM 1527 CG LEU B 71 -8.922 5.474 -3.142 1.00 0.00 C ATOM 1528 CD1 LEU B 71 -8.412 4.252 -3.891 1.00 0.00 C ATOM 1529 CD2 LEU B 71 -9.602 6.443 -4.098 1.00 0.00 C ATOM 0 H LEU B 71 -9.107 2.673 -2.098 1.00 0.00 H new ATOM 0 HA LEU B 71 -8.422 4.941 -0.455 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -10.658 4.425 -2.447 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -10.385 5.963 -1.653 1.00 0.00 H new ATOM 0 HG LEU B 71 -8.065 5.974 -2.691 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -7.730 4.568 -4.680 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -7.886 3.594 -3.199 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -9.254 3.717 -4.331 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -8.906 6.723 -4.888 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -10.477 5.966 -4.538 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -9.911 7.335 -3.553 1.00 0.00 H new ATOM 1541 N ARG B 72 -10.056 4.878 1.386 1.00 0.00 N ATOM 1542 CA ARG B 72 -10.964 4.826 2.529 1.00 0.00 C ATOM 1543 C ARG B 72 -12.376 5.223 2.108 1.00 0.00 C ATOM 1544 O ARG B 72 -12.553 6.092 1.254 1.00 0.00 O ATOM 1545 CB ARG B 72 -10.466 5.757 3.639 1.00 0.00 C ATOM 1546 CG ARG B 72 -11.387 5.828 4.848 1.00 0.00 C ATOM 1547 CD ARG B 72 -11.472 4.493 5.572 1.00 0.00 C ATOM 1548 NE ARG B 72 -10.171 4.059 6.077 1.00 0.00 N ATOM 1549 CZ ARG B 72 -9.487 4.709 7.015 1.00 0.00 C ATOM 1550 NH1 ARG B 72 -9.989 5.805 7.568 1.00 0.00 N ATOM 1551 NH2 ARG B 72 -8.303 4.259 7.406 1.00 0.00 N ATOM 0 H ARG B 72 -9.254 5.495 1.515 1.00 0.00 H new ATOM 0 HA ARG B 72 -10.988 3.804 2.907 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -9.481 5.422 3.965 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -10.343 6.760 3.230 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -11.026 6.592 5.536 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -12.384 6.132 4.528 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -12.174 4.575 6.402 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -11.868 3.737 4.893 1.00 0.00 H new ATOM 0 HE ARG B 72 -9.764 3.209 5.688 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -10.902 6.152 7.274 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -9.462 6.301 8.287 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -7.915 3.413 6.988 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -7.780 4.758 8.125 1.00 0.00 H new ATOM 1565 N LEU B 73 -13.375 4.579 2.708 1.00 0.00 N ATOM 1566 CA LEU B 73 -14.772 4.863 2.393 1.00 0.00 C ATOM 1567 C LEU B 73 -15.041 6.364 2.409 1.00 0.00 C ATOM 1568 O LEU B 73 -14.574 7.079 3.296 1.00 0.00 O ATOM 1569 CB LEU B 73 -15.695 4.160 3.391 1.00 0.00 C ATOM 1570 CG LEU B 73 -17.193 4.367 3.149 1.00 0.00 C ATOM 1571 CD1 LEU B 73 -17.609 3.773 1.812 1.00 0.00 C ATOM 1572 CD2 LEU B 73 -18.003 3.755 4.281 1.00 0.00 C ATOM 0 H LEU B 73 -13.242 3.856 3.416 1.00 0.00 H new ATOM 0 HA LEU B 73 -14.974 4.486 1.391 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -15.483 3.091 3.367 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -15.453 4.510 4.394 1.00 0.00 H new ATOM 0 HG LEU B 73 -17.391 5.438 3.122 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -18.677 3.931 1.660 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -17.053 4.258 1.010 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -17.396 2.704 1.807 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -19.065 3.911 4.094 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -17.798 2.686 4.339 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -17.727 4.229 5.223 1.00 0.00 H new ATOM 1584 N ARG B 74 -15.794 6.835 1.418 1.00 0.00 N ATOM 1585 CA ARG B 74 -16.123 8.253 1.312 1.00 0.00 C ATOM 1586 C ARG B 74 -16.772 8.760 2.596 1.00 0.00 C ATOM 1587 O ARG B 74 -16.389 9.805 3.123 1.00 0.00 O ATOM 1588 CB ARG B 74 -17.062 8.495 0.127 1.00 0.00 C ATOM 1589 CG ARG B 74 -16.474 8.087 -1.214 1.00 0.00 C ATOM 1590 CD ARG B 74 -17.432 8.392 -2.356 1.00 0.00 C ATOM 1591 NE ARG B 74 -16.885 8.008 -3.655 1.00 0.00 N ATOM 1592 CZ ARG B 74 -15.798 8.556 -4.195 1.00 0.00 C ATOM 1593 NH1 ARG B 74 -15.147 9.520 -3.556 1.00 0.00 N ATOM 1594 NH2 ARG B 74 -15.364 8.143 -5.378 1.00 0.00 N ATOM 0 H ARG B 74 -16.188 6.255 0.677 1.00 0.00 H new ATOM 0 HA ARG B 74 -15.195 8.802 1.152 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -17.988 7.943 0.290 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -17.323 9.553 0.092 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -15.533 8.613 -1.376 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -16.245 7.021 -1.204 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -18.372 7.865 -2.190 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -17.661 9.458 -2.361 1.00 0.00 H new ATOM 0 HE ARG B 74 -17.364 7.276 -4.180 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -15.479 9.844 -2.648 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -14.315 9.937 -3.973 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -15.863 7.405 -5.875 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -14.531 8.563 -5.791 1.00 0.00 H new ATOM 1608 N GLY B 75 -17.752 8.012 3.094 1.00 0.00 N ATOM 1609 CA GLY B 75 -18.440 8.400 4.313 1.00 0.00 C ATOM 1610 C GLY B 75 -19.273 9.656 4.140 1.00 0.00 C ATOM 1611 O GLY B 75 -18.816 10.637 3.553 1.00 0.00 O ATOM 0 H GLY B 75 -18.083 7.143 2.675 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -19.085 7.583 4.637 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -17.707 8.561 5.104 1.00 0.00 H new ATOM 1615 N GLY B 76 -20.500 9.627 4.653 1.00 0.00 N ATOM 1616 CA GLY B 76 -21.378 10.777 4.543 1.00 0.00 C ATOM 1617 C GLY B 76 -22.728 10.543 5.191 1.00 0.00 C ATOM 1618 O GLY B 76 -23.753 10.666 4.488 1.00 0.00 O ATOM 1619 OXT GLY B 76 -22.761 10.236 6.401 1.00 0.00 O ATOM 0 H GLY B 76 -20.901 8.827 5.143 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -20.901 11.640 5.008 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -21.522 11.021 3.490 1.00 0.00 H new TER 1623 GLY B 76