USER MOD reduce.3.24.130724 H: found=0, std=0, add=854, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 858 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 33 SER OG : rot 180:sc= -0.117 USER MOD Set 1.2: B 35 LYS NZ :NH3+ 152:sc= -0.0387 (180deg=-0.584) USER MOD Set 2.1: A 27 THR OG1 : rot -147:sc= -0.408 USER MOD Set 2.2: B 5 GLN : amide:sc= -1.32 X(o=-1.7,f=-1.5!) USER MOD Set 3.1: A 5 GLN : amide:sc= 1.11 K(o=0.65,f=-1.6) USER MOD Set 3.2: B 27 THR OG1 : rot 180:sc= -0.461 USER MOD Single : A 3 ASN : amide:sc= -0.269 K(o=-0.27,f=-0.91) USER MOD Single : A 8 SER OG : rot 61:sc= 0.916 USER MOD Single : A 10 THR OG1 : rot 142:sc= -0.424 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 17 SER OG : rot -86:sc= 0.463 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 33 SER OG : rot 180:sc= -0.561 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 62 TYR OH : rot -46:sc= -0.601 USER MOD Single : B 3 ASN : amide:sc= -1.38 K(o=-1.4,f=-0.047) USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.0954 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 GLN : amide:sc= -0.465 K(o=-0.46,f=-1.3) USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 TYR OH : rot 30:sc= -0.508 USER MOD ----------------------------------------------------------------- ATOM 32 N ASN A 3 -10.810 8.466 -9.010 1.00 0.00 N ATOM 33 CA ASN A 3 -9.543 8.470 -8.204 1.00 0.00 C ATOM 34 C ASN A 3 -9.718 7.567 -6.984 1.00 0.00 C ATOM 35 O ASN A 3 -8.845 7.449 -6.143 1.00 0.00 O ATOM 36 CB ASN A 3 -9.221 9.900 -7.760 1.00 0.00 C ATOM 37 CG ASN A 3 -10.484 10.596 -7.265 1.00 0.00 C ATOM 38 OD1 ASN A 3 -11.337 10.969 -8.049 1.00 0.00 O ATOM 39 ND2 ASN A 3 -10.639 10.791 -5.988 1.00 0.00 N ATOM 0 HA ASN A 3 -8.719 8.096 -8.812 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -8.473 9.882 -6.968 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -8.792 10.459 -8.592 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -11.477 11.258 -5.641 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -9.922 10.477 -5.333 1.00 0.00 H new ATOM 46 N ARG A 4 -10.831 6.907 -6.894 1.00 0.00 N ATOM 47 CA ARG A 4 -11.061 5.990 -5.750 1.00 0.00 C ATOM 48 C ARG A 4 -10.348 4.690 -6.084 1.00 0.00 C ATOM 49 O ARG A 4 -10.355 4.252 -7.218 1.00 0.00 O ATOM 50 CB ARG A 4 -12.566 5.751 -5.577 1.00 0.00 C ATOM 51 CG ARG A 4 -13.297 7.108 -5.437 1.00 0.00 C ATOM 52 CD ARG A 4 -13.286 7.558 -3.975 1.00 0.00 C ATOM 53 NE ARG A 4 -14.300 6.766 -3.220 1.00 0.00 N ATOM 54 CZ ARG A 4 -15.540 7.173 -3.160 1.00 0.00 C ATOM 55 NH1 ARG A 4 -15.902 8.283 -3.744 1.00 0.00 N ATOM 56 NH2 ARG A 4 -16.421 6.461 -2.517 1.00 0.00 N ATOM 0 H ARG A 4 -11.596 6.962 -7.566 1.00 0.00 H new ATOM 0 HA ARG A 4 -10.682 6.408 -4.818 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -12.958 5.203 -6.434 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -12.747 5.137 -4.695 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -12.812 7.858 -6.061 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -14.324 7.016 -5.790 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -12.296 7.413 -3.543 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -13.511 8.622 -3.906 1.00 0.00 H new ATOM 0 HE ARG A 4 -14.024 5.904 -2.749 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -15.215 8.840 -4.252 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -16.872 8.594 -3.692 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -16.141 5.591 -2.064 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -17.391 6.773 -2.467 1.00 0.00 H new ATOM 70 N GLN A 5 -9.703 4.079 -5.133 1.00 0.00 N ATOM 71 CA GLN A 5 -8.959 2.820 -5.436 1.00 0.00 C ATOM 72 C GLN A 5 -9.136 1.815 -4.310 1.00 0.00 C ATOM 73 O GLN A 5 -9.557 2.142 -3.214 1.00 0.00 O ATOM 74 CB GLN A 5 -7.477 3.140 -5.618 1.00 0.00 C ATOM 75 CG GLN A 5 -7.281 3.918 -6.923 1.00 0.00 C ATOM 76 CD GLN A 5 -5.808 4.299 -7.074 1.00 0.00 C ATOM 77 OE1 GLN A 5 -5.303 5.125 -6.337 1.00 0.00 O ATOM 78 NE2 GLN A 5 -5.085 3.711 -7.989 1.00 0.00 N ATOM 0 H GLN A 5 -9.656 4.392 -4.163 1.00 0.00 H new ATOM 0 HA GLN A 5 -9.355 2.385 -6.354 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -7.114 3.727 -4.774 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -6.895 2.219 -5.640 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -7.600 3.312 -7.771 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -7.901 4.814 -6.921 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -5.509 3.019 -8.607 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -4.097 3.944 -8.086 1.00 0.00 H new ATOM 87 N PHE A 6 -8.827 0.578 -4.599 1.00 0.00 N ATOM 88 CA PHE A 6 -8.972 -0.508 -3.589 1.00 0.00 C ATOM 89 C PHE A 6 -7.595 -0.960 -3.137 1.00 0.00 C ATOM 90 O PHE A 6 -6.743 -1.290 -3.937 1.00 0.00 O ATOM 91 CB PHE A 6 -9.703 -1.679 -4.236 1.00 0.00 C ATOM 92 CG PHE A 6 -10.957 -1.158 -4.892 1.00 0.00 C ATOM 93 CD1 PHE A 6 -10.907 -0.660 -6.199 1.00 0.00 C ATOM 94 CD2 PHE A 6 -12.164 -1.159 -4.190 1.00 0.00 C ATOM 95 CE1 PHE A 6 -12.067 -0.162 -6.802 1.00 0.00 C ATOM 96 CE2 PHE A 6 -13.324 -0.661 -4.792 1.00 0.00 C ATOM 97 CZ PHE A 6 -13.277 -0.162 -6.098 1.00 0.00 C ATOM 0 H PHE A 6 -8.475 0.271 -5.506 1.00 0.00 H new ATOM 0 HA PHE A 6 -9.534 -0.147 -2.728 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -9.063 -2.164 -4.973 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -9.952 -2.431 -3.487 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -9.973 -0.660 -6.742 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -12.202 -1.544 -3.182 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -12.029 0.222 -7.811 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -14.257 -0.662 -4.248 1.00 0.00 H new ATOM 0 HZ PHE A 6 -14.173 0.223 -6.562 1.00 0.00 H new ATOM 107 N LEU A 7 -7.370 -0.971 -1.853 1.00 0.00 N ATOM 108 CA LEU A 7 -6.049 -1.399 -1.319 1.00 0.00 C ATOM 109 C LEU A 7 -6.282 -2.510 -0.303 1.00 0.00 C ATOM 110 O LEU A 7 -6.962 -2.327 0.689 1.00 0.00 O ATOM 111 CB LEU A 7 -5.373 -0.198 -0.646 1.00 0.00 C ATOM 112 CG LEU A 7 -3.869 -0.468 -0.459 1.00 0.00 C ATOM 113 CD1 LEU A 7 -3.148 0.853 -0.192 1.00 0.00 C ATOM 114 CD2 LEU A 7 -3.631 -1.439 0.711 1.00 0.00 C ATOM 0 H LEU A 7 -8.052 -0.699 -1.145 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.406 -1.765 -2.119 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -5.516 0.696 -1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.838 -0.005 0.321 1.00 0.00 H new ATOM 0 HG LEU A 7 -3.477 -0.925 -1.368 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.083 0.666 -0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.295 1.525 -1.037 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -3.551 1.312 0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.562 -1.616 0.825 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -4.027 -1.006 1.629 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.135 -2.384 0.508 1.00 0.00 H new ATOM 126 N SER A 8 -5.725 -3.668 -0.553 1.00 0.00 N ATOM 127 CA SER A 8 -5.910 -4.823 0.380 1.00 0.00 C ATOM 128 C SER A 8 -4.558 -5.429 0.730 1.00 0.00 C ATOM 129 O SER A 8 -3.616 -5.374 -0.040 1.00 0.00 O ATOM 130 CB SER A 8 -6.769 -5.889 -0.293 1.00 0.00 C ATOM 131 OG SER A 8 -7.000 -6.955 0.619 1.00 0.00 O ATOM 0 H SER A 8 -5.146 -3.865 -1.369 1.00 0.00 H new ATOM 0 HA SER A 8 -6.398 -4.470 1.288 1.00 0.00 H new ATOM 0 HB2 SER A 8 -7.718 -5.458 -0.614 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.270 -6.263 -1.187 1.00 0.00 H new ATOM 0 HG SER A 8 -7.473 -6.615 1.407 1.00 0.00 H new ATOM 137 N LEU A 9 -4.453 -6.012 1.894 1.00 0.00 N ATOM 138 CA LEU A 9 -3.163 -6.630 2.312 1.00 0.00 C ATOM 139 C LEU A 9 -3.441 -7.913 3.099 1.00 0.00 C ATOM 140 O LEU A 9 -4.502 -8.095 3.673 1.00 0.00 O ATOM 141 CB LEU A 9 -2.375 -5.640 3.186 1.00 0.00 C ATOM 142 CG LEU A 9 -0.876 -6.016 3.189 1.00 0.00 C ATOM 143 CD1 LEU A 9 -0.171 -5.390 1.973 1.00 0.00 C ATOM 144 CD2 LEU A 9 -0.214 -5.507 4.477 1.00 0.00 C ATOM 0 H LEU A 9 -5.208 -6.087 2.575 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.573 -6.873 1.428 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.503 -4.626 2.808 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -2.764 -5.652 4.204 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.787 -7.101 3.137 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.885 -5.661 1.985 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.630 -5.760 1.056 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.267 -4.305 2.015 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.843 -5.775 4.473 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.313 -4.423 4.533 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.701 -5.961 5.340 1.00 0.00 H new ATOM 156 N THR A 10 -2.491 -8.806 3.114 1.00 0.00 N ATOM 157 CA THR A 10 -2.671 -10.097 3.839 1.00 0.00 C ATOM 158 C THR A 10 -2.701 -9.871 5.352 1.00 0.00 C ATOM 159 O THR A 10 -2.430 -8.792 5.843 1.00 0.00 O ATOM 160 CB THR A 10 -1.513 -11.033 3.493 1.00 0.00 C ATOM 161 OG1 THR A 10 -0.291 -10.430 3.882 1.00 0.00 O ATOM 162 CG2 THR A 10 -1.497 -11.295 1.988 1.00 0.00 C ATOM 0 H THR A 10 -1.589 -8.696 2.651 1.00 0.00 H new ATOM 0 HA THR A 10 -3.619 -10.540 3.534 1.00 0.00 H new ATOM 0 HB THR A 10 -1.639 -11.978 4.021 1.00 0.00 H new ATOM 0 HG1 THR A 10 0.312 -11.114 4.241 1.00 0.00 H new ATOM 0 HG21 THR A 10 -0.671 -11.962 1.744 1.00 0.00 H new ATOM 0 HG22 THR A 10 -2.438 -11.758 1.689 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.371 -10.352 1.456 1.00 0.00 H new ATOM 170 N GLY A 11 -3.051 -10.899 6.088 1.00 0.00 N ATOM 171 CA GLY A 11 -3.129 -10.789 7.576 1.00 0.00 C ATOM 172 C GLY A 11 -1.966 -9.952 8.123 1.00 0.00 C ATOM 173 O GLY A 11 -0.807 -10.301 7.997 1.00 0.00 O ATOM 0 H GLY A 11 -3.288 -11.818 5.715 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -4.077 -10.333 7.862 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -3.107 -11.784 8.020 1.00 0.00 H new ATOM 177 N VAL A 12 -2.285 -8.845 8.730 1.00 0.00 N ATOM 178 CA VAL A 12 -1.232 -7.957 9.295 1.00 0.00 C ATOM 179 C VAL A 12 -0.814 -8.442 10.685 1.00 0.00 C ATOM 180 O VAL A 12 -1.476 -9.254 11.303 1.00 0.00 O ATOM 181 CB VAL A 12 -1.780 -6.532 9.389 1.00 0.00 C ATOM 182 CG1 VAL A 12 -3.008 -6.511 10.306 1.00 0.00 C ATOM 183 CG2 VAL A 12 -0.702 -5.600 9.953 1.00 0.00 C ATOM 0 H VAL A 12 -3.241 -8.514 8.860 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.358 -7.977 8.644 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.066 -6.191 8.394 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -3.396 -5.495 10.371 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -3.777 -7.168 9.899 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.725 -6.856 11.301 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -1.096 -4.586 10.019 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -0.410 -5.941 10.946 1.00 0.00 H new ATOM 0 HG23 VAL A 12 0.168 -5.610 9.296 1.00 0.00 H new ATOM 193 N SER A 13 0.286 -7.942 11.181 1.00 0.00 N ATOM 194 CA SER A 13 0.759 -8.357 12.531 1.00 0.00 C ATOM 195 C SER A 13 -0.143 -7.728 13.600 1.00 0.00 C ATOM 196 O SER A 13 -0.571 -8.386 14.528 1.00 0.00 O ATOM 197 CB SER A 13 2.194 -7.866 12.719 1.00 0.00 C ATOM 198 OG SER A 13 3.037 -8.513 11.776 1.00 0.00 O ATOM 0 H SER A 13 0.879 -7.261 10.706 1.00 0.00 H new ATOM 0 HA SER A 13 0.723 -9.442 12.624 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.242 -6.785 12.586 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.533 -8.077 13.733 1.00 0.00 H new ATOM 0 HG SER A 13 3.958 -8.200 11.892 1.00 0.00 H new ATOM 204 N LYS A 14 -0.447 -6.466 13.473 1.00 0.00 N ATOM 205 CA LYS A 14 -1.337 -5.821 14.483 1.00 0.00 C ATOM 206 C LYS A 14 -1.706 -4.407 14.023 1.00 0.00 C ATOM 207 O LYS A 14 -0.915 -3.711 13.412 1.00 0.00 O ATOM 208 CB LYS A 14 -0.630 -5.756 15.845 1.00 0.00 C ATOM 209 CG LYS A 14 0.736 -5.034 15.718 1.00 0.00 C ATOM 210 CD LYS A 14 0.627 -3.583 16.221 1.00 0.00 C ATOM 211 CE LYS A 14 0.705 -3.552 17.752 1.00 0.00 C ATOM 212 NZ LYS A 14 0.714 -2.139 18.219 1.00 0.00 N ATOM 0 H LYS A 14 -0.122 -5.857 12.722 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.245 -6.415 14.583 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -1.260 -5.230 16.563 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.480 -6.764 16.231 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.492 -5.569 16.293 1.00 0.00 H new ATOM 0 HG3 LYS A 14 1.063 -5.041 14.678 1.00 0.00 H new ATOM 0 HD2 LYS A 14 1.429 -2.981 15.795 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.313 -3.143 15.887 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -0.145 -4.083 18.181 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.605 -4.064 18.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 0.767 -2.117 19.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.539 -1.647 17.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -0.157 -1.665 17.907 1.00 0.00 H new ATOM 226 N VAL A 15 -2.905 -3.973 14.316 1.00 0.00 N ATOM 227 CA VAL A 15 -3.334 -2.605 13.900 1.00 0.00 C ATOM 228 C VAL A 15 -2.981 -1.602 15.000 1.00 0.00 C ATOM 229 O VAL A 15 -3.309 -1.783 16.157 1.00 0.00 O ATOM 230 CB VAL A 15 -4.845 -2.595 13.659 1.00 0.00 C ATOM 231 CG1 VAL A 15 -5.307 -1.165 13.365 1.00 0.00 C ATOM 232 CG2 VAL A 15 -5.176 -3.492 12.464 1.00 0.00 C ATOM 0 H VAL A 15 -3.607 -4.509 14.827 1.00 0.00 H new ATOM 0 HA VAL A 15 -2.820 -2.327 12.980 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.356 -2.967 14.547 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.383 -1.158 13.193 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.071 -0.524 14.215 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.796 -0.793 12.477 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.252 -3.486 12.291 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.664 -3.120 11.577 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.848 -4.510 12.672 1.00 0.00 H new ATOM 242 N GLN A 16 -2.308 -0.545 14.641 1.00 0.00 N ATOM 243 CA GLN A 16 -1.918 0.482 15.647 1.00 0.00 C ATOM 244 C GLN A 16 -3.050 1.500 15.824 1.00 0.00 C ATOM 245 O GLN A 16 -3.148 2.165 16.838 1.00 0.00 O ATOM 246 CB GLN A 16 -0.658 1.196 15.153 1.00 0.00 C ATOM 247 CG GLN A 16 -0.181 2.184 16.217 1.00 0.00 C ATOM 248 CD GLN A 16 1.121 2.844 15.758 1.00 0.00 C ATOM 249 OE1 GLN A 16 1.162 3.494 14.731 1.00 0.00 O ATOM 250 NE2 GLN A 16 2.197 2.706 16.484 1.00 0.00 N ATOM 0 H GLN A 16 -2.009 -0.347 13.686 1.00 0.00 H new ATOM 0 HA GLN A 16 -1.726 0.002 16.607 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.125 0.468 14.940 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -0.867 1.722 14.221 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -0.944 2.943 16.391 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -0.024 1.667 17.164 1.00 0.00 H new ATOM 0 HE21 GLN A 16 2.164 2.161 17.346 1.00 0.00 H new ATOM 0 HE22 GLN A 16 3.070 3.143 16.190 1.00 0.00 H new ATOM 259 N SER A 17 -3.910 1.627 14.853 1.00 0.00 N ATOM 260 CA SER A 17 -5.029 2.606 14.981 1.00 0.00 C ATOM 261 C SER A 17 -6.001 2.437 13.816 1.00 0.00 C ATOM 262 O SER A 17 -5.653 1.932 12.767 1.00 0.00 O ATOM 263 CB SER A 17 -4.487 4.037 14.971 1.00 0.00 C ATOM 264 OG SER A 17 -5.569 4.945 15.148 1.00 0.00 O ATOM 0 H SER A 17 -3.889 1.099 13.980 1.00 0.00 H new ATOM 0 HA SER A 17 -5.544 2.420 15.924 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.753 4.167 15.766 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.976 4.239 14.030 1.00 0.00 H new ATOM 0 HG SER A 17 -5.975 5.143 14.279 1.00 0.00 H new ATOM 270 N PHE A 18 -7.225 2.859 13.990 1.00 0.00 N ATOM 271 CA PHE A 18 -8.227 2.723 12.893 1.00 0.00 C ATOM 272 C PHE A 18 -9.192 3.917 12.927 1.00 0.00 C ATOM 273 O PHE A 18 -10.079 3.999 13.753 1.00 0.00 O ATOM 274 CB PHE A 18 -8.990 1.394 13.083 1.00 0.00 C ATOM 275 CG PHE A 18 -10.353 1.437 12.414 1.00 0.00 C ATOM 276 CD1 PHE A 18 -10.526 2.102 11.194 1.00 0.00 C ATOM 277 CD2 PHE A 18 -11.445 0.815 13.031 1.00 0.00 C ATOM 278 CE1 PHE A 18 -11.786 2.145 10.593 1.00 0.00 C ATOM 279 CE2 PHE A 18 -12.708 0.861 12.429 1.00 0.00 C ATOM 280 CZ PHE A 18 -12.878 1.527 11.210 1.00 0.00 C ATOM 0 H PHE A 18 -7.574 3.292 14.845 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.730 2.714 11.923 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -8.405 0.574 12.667 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -9.111 1.191 14.147 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -9.684 2.582 10.717 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -11.313 0.300 13.971 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -11.917 2.656 9.651 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -13.551 0.383 12.905 1.00 0.00 H new ATOM 0 HZ PHE A 18 -13.853 1.564 10.746 1.00 0.00 H new ATOM 290 N ASP A 19 -9.028 4.831 12.003 1.00 0.00 N ATOM 291 CA ASP A 19 -9.932 6.020 11.922 1.00 0.00 C ATOM 292 C ASP A 19 -10.333 6.219 10.449 1.00 0.00 C ATOM 293 O ASP A 19 -9.552 5.942 9.562 1.00 0.00 O ATOM 294 CB ASP A 19 -9.197 7.267 12.425 1.00 0.00 C ATOM 295 CG ASP A 19 -8.584 6.979 13.797 1.00 0.00 C ATOM 296 OD1 ASP A 19 -7.557 6.324 13.839 1.00 0.00 O ATOM 297 OD2 ASP A 19 -9.156 7.419 14.781 1.00 0.00 O ATOM 0 H ASP A 19 -8.297 4.803 11.292 1.00 0.00 H new ATOM 0 HA ASP A 19 -10.816 5.861 12.539 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.417 7.552 11.719 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -9.888 8.107 12.493 1.00 0.00 H new ATOM 302 N PRO A 20 -11.523 6.704 10.179 1.00 0.00 N ATOM 303 CA PRO A 20 -11.990 6.948 8.778 1.00 0.00 C ATOM 304 C PRO A 20 -11.231 8.118 8.148 1.00 0.00 C ATOM 305 O PRO A 20 -11.261 8.335 6.952 1.00 0.00 O ATOM 306 CB PRO A 20 -13.483 7.279 8.938 1.00 0.00 C ATOM 307 CG PRO A 20 -13.615 7.796 10.338 1.00 0.00 C ATOM 308 CD PRO A 20 -12.547 7.076 11.166 1.00 0.00 C ATOM 0 HA PRO A 20 -11.820 6.095 8.122 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -13.803 8.024 8.210 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -14.102 6.396 8.783 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -13.468 8.876 10.369 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.612 7.598 10.733 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -12.138 7.725 11.941 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -12.955 6.199 11.668 1.00 0.00 H new ATOM 316 N LYS A 21 -10.543 8.868 8.960 1.00 0.00 N ATOM 317 CA LYS A 21 -9.759 10.027 8.451 1.00 0.00 C ATOM 318 C LYS A 21 -8.289 9.619 8.360 1.00 0.00 C ATOM 319 O LYS A 21 -7.447 10.362 7.894 1.00 0.00 O ATOM 320 CB LYS A 21 -9.916 11.192 9.432 1.00 0.00 C ATOM 321 CG LYS A 21 -9.506 12.503 8.759 1.00 0.00 C ATOM 322 CD LYS A 21 -9.826 13.683 9.683 1.00 0.00 C ATOM 323 CE LYS A 21 -8.898 13.665 10.904 1.00 0.00 C ATOM 324 NZ LYS A 21 -8.930 14.998 11.564 1.00 0.00 N ATOM 0 H LYS A 21 -10.489 8.726 9.969 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.114 10.331 7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.950 11.256 9.771 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.301 11.020 10.315 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.440 12.487 8.530 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.034 12.617 7.812 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -9.708 14.621 9.141 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.866 13.630 10.006 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.214 12.892 11.604 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.880 13.422 10.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.302 14.990 12.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.609 15.725 10.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.901 15.212 11.868 1.00 0.00 H new ATOM 338 N GLU A 22 -7.980 8.436 8.808 1.00 0.00 N ATOM 339 CA GLU A 22 -6.569 7.957 8.758 1.00 0.00 C ATOM 340 C GLU A 22 -6.510 6.534 9.320 1.00 0.00 C ATOM 341 O GLU A 22 -7.210 6.193 10.251 1.00 0.00 O ATOM 342 CB GLU A 22 -5.671 8.893 9.591 1.00 0.00 C ATOM 343 CG GLU A 22 -4.322 8.211 9.935 1.00 0.00 C ATOM 344 CD GLU A 22 -4.408 7.532 11.309 1.00 0.00 C ATOM 345 OE1 GLU A 22 -4.934 6.436 11.379 1.00 0.00 O ATOM 346 OE2 GLU A 22 -3.952 8.129 12.270 1.00 0.00 O ATOM 0 H GLU A 22 -8.646 7.776 9.209 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.213 7.958 7.728 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.486 9.813 9.037 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.186 9.173 10.510 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.074 7.474 9.172 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.522 8.951 9.936 1.00 0.00 H new ATOM 353 N ILE A 23 -5.670 5.697 8.763 1.00 0.00 N ATOM 354 CA ILE A 23 -5.550 4.292 9.267 1.00 0.00 C ATOM 355 C ILE A 23 -4.073 3.923 9.395 1.00 0.00 C ATOM 356 O ILE A 23 -3.292 4.122 8.484 1.00 0.00 O ATOM 357 CB ILE A 23 -6.231 3.331 8.291 1.00 0.00 C ATOM 358 CG1 ILE A 23 -7.719 3.675 8.199 1.00 0.00 C ATOM 359 CG2 ILE A 23 -6.077 1.900 8.810 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.365 2.858 7.080 1.00 0.00 C ATOM 0 H ILE A 23 -5.060 5.926 7.978 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.033 4.217 10.241 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.773 3.419 7.306 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.211 3.463 9.148 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.845 4.740 8.005 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.560 1.209 8.120 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -5.018 1.654 8.889 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -6.543 1.817 9.792 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.425 3.104 7.015 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.880 3.092 6.132 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.251 1.795 7.293 1.00 0.00 H new ATOM 372 N LEU A 24 -3.689 3.372 10.520 1.00 0.00 N ATOM 373 CA LEU A 24 -2.260 2.970 10.728 1.00 0.00 C ATOM 374 C LEU A 24 -2.181 1.449 10.792 1.00 0.00 C ATOM 375 O LEU A 24 -2.894 0.811 11.541 1.00 0.00 O ATOM 376 CB LEU A 24 -1.748 3.550 12.047 1.00 0.00 C ATOM 377 CG LEU A 24 -1.942 5.071 12.053 1.00 0.00 C ATOM 378 CD1 LEU A 24 -1.383 5.651 13.353 1.00 0.00 C ATOM 379 CD2 LEU A 24 -1.221 5.697 10.850 1.00 0.00 C ATOM 0 H LEU A 24 -4.307 3.182 11.309 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.651 3.346 9.906 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.283 3.102 12.884 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.693 3.308 12.177 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.006 5.298 11.983 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.521 6.732 13.358 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.909 5.214 14.202 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.320 5.420 13.427 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.364 6.778 10.862 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.156 5.471 10.906 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.631 5.287 9.927 1.00 0.00 H new ATOM 391 N LEU A 25 -1.317 0.863 10.002 1.00 0.00 N ATOM 392 CA LEU A 25 -1.175 -0.626 9.990 1.00 0.00 C ATOM 393 C LEU A 25 0.274 -1.003 10.255 1.00 0.00 C ATOM 394 O LEU A 25 1.184 -0.524 9.606 1.00 0.00 O ATOM 395 CB LEU A 25 -1.602 -1.158 8.624 1.00 0.00 C ATOM 396 CG LEU A 25 -3.059 -0.760 8.364 1.00 0.00 C ATOM 397 CD1 LEU A 25 -3.460 -1.193 6.953 1.00 0.00 C ATOM 398 CD2 LEU A 25 -3.986 -1.432 9.396 1.00 0.00 C ATOM 0 H LEU A 25 -0.698 1.357 9.359 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.805 -1.061 10.766 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.957 -0.753 7.844 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.497 -2.243 8.593 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.155 0.322 8.456 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.496 -0.911 6.766 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.814 -0.703 6.225 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.356 -2.274 6.861 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.018 -1.142 9.201 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.893 -2.515 9.318 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.703 -1.115 10.400 1.00 0.00 H new ATOM 410 N GLU A 26 0.493 -1.869 11.209 1.00 0.00 N ATOM 411 CA GLU A 26 1.880 -2.306 11.536 1.00 0.00 C ATOM 412 C GLU A 26 2.108 -3.697 10.961 1.00 0.00 C ATOM 413 O GLU A 26 1.447 -4.655 11.336 1.00 0.00 O ATOM 414 CB GLU A 26 2.062 -2.330 13.050 1.00 0.00 C ATOM 415 CG GLU A 26 3.526 -2.641 13.381 1.00 0.00 C ATOM 416 CD GLU A 26 3.804 -2.305 14.848 1.00 0.00 C ATOM 417 OE1 GLU A 26 3.460 -1.207 15.256 1.00 0.00 O ATOM 418 OE2 GLU A 26 4.372 -3.141 15.531 1.00 0.00 O ATOM 0 H GLU A 26 -0.237 -2.295 11.780 1.00 0.00 H new ATOM 0 HA GLU A 26 2.601 -1.612 11.105 1.00 0.00 H new ATOM 0 HB2 GLU A 26 1.777 -1.368 13.477 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.409 -3.082 13.494 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.736 -3.694 13.193 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.186 -2.063 12.734 1.00 0.00 H new ATOM 425 N THR A 27 3.037 -3.807 10.040 1.00 0.00 N ATOM 426 CA THR A 27 3.328 -5.125 9.397 1.00 0.00 C ATOM 427 C THR A 27 4.803 -5.489 9.555 1.00 0.00 C ATOM 428 O THR A 27 5.675 -4.638 9.615 1.00 0.00 O ATOM 429 CB THR A 27 2.993 -5.051 7.907 1.00 0.00 C ATOM 430 OG1 THR A 27 3.344 -6.284 7.294 1.00 0.00 O ATOM 431 CG2 THR A 27 3.775 -3.908 7.250 1.00 0.00 C ATOM 0 H THR A 27 3.610 -3.032 9.705 1.00 0.00 H new ATOM 0 HA THR A 27 2.720 -5.888 9.883 1.00 0.00 H new ATOM 0 HB THR A 27 1.926 -4.865 7.782 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.637 -6.120 6.373 1.00 0.00 H new ATOM 0 HG21 THR A 27 3.530 -3.863 6.189 1.00 0.00 H new ATOM 0 HG22 THR A 27 3.507 -2.964 7.725 1.00 0.00 H new ATOM 0 HG23 THR A 27 4.844 -4.083 7.369 1.00 0.00 H new ATOM 439 N ILE A 28 5.071 -6.767 9.610 1.00 0.00 N ATOM 440 CA ILE A 28 6.471 -7.264 9.752 1.00 0.00 C ATOM 441 C ILE A 28 7.196 -6.503 10.865 1.00 0.00 C ATOM 442 O ILE A 28 7.282 -6.957 11.989 1.00 0.00 O ATOM 443 CB ILE A 28 7.211 -7.084 8.422 1.00 0.00 C ATOM 444 CG1 ILE A 28 6.422 -7.786 7.317 1.00 0.00 C ATOM 445 CG2 ILE A 28 8.609 -7.707 8.512 1.00 0.00 C ATOM 446 CD1 ILE A 28 7.092 -7.549 5.965 1.00 0.00 C ATOM 0 H ILE A 28 4.365 -7.501 9.562 1.00 0.00 H new ATOM 0 HA ILE A 28 6.451 -8.322 10.015 1.00 0.00 H new ATOM 0 HB ILE A 28 7.305 -6.021 8.202 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.366 -8.855 7.522 1.00 0.00 H new ATOM 0 HG13 ILE A 28 5.399 -7.412 7.296 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.128 -7.575 7.563 1.00 0.00 H new ATOM 0 HG22 ILE A 28 9.174 -7.219 9.306 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.520 -8.771 8.732 1.00 0.00 H new ATOM 0 HD11 ILE A 28 6.523 -8.053 5.184 1.00 0.00 H new ATOM 0 HD12 ILE A 28 7.125 -6.479 5.758 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.107 -7.945 5.988 1.00 0.00 H new ATOM 458 N GLN A 29 7.727 -5.353 10.561 1.00 0.00 N ATOM 459 CA GLN A 29 8.459 -4.559 11.592 1.00 0.00 C ATOM 460 C GLN A 29 8.216 -3.061 11.360 1.00 0.00 C ATOM 461 O GLN A 29 8.359 -2.250 12.257 1.00 0.00 O ATOM 462 CB GLN A 29 9.962 -4.853 11.468 1.00 0.00 C ATOM 463 CG GLN A 29 10.438 -4.506 10.050 1.00 0.00 C ATOM 464 CD GLN A 29 11.925 -4.839 9.906 1.00 0.00 C ATOM 465 OE1 GLN A 29 12.681 -4.721 10.852 1.00 0.00 O ATOM 466 NE2 GLN A 29 12.382 -5.252 8.754 1.00 0.00 N ATOM 0 H GLN A 29 7.686 -4.924 9.637 1.00 0.00 H new ATOM 0 HA GLN A 29 8.104 -4.831 12.586 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.519 -4.271 12.202 1.00 0.00 H new ATOM 0 HB3 GLN A 29 10.156 -5.904 11.681 1.00 0.00 H new ATOM 0 HG2 GLN A 29 9.858 -5.064 9.315 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.272 -3.448 9.850 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.749 -5.351 7.960 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.372 -5.475 8.648 1.00 0.00 H new ATOM 475 N GLY A 30 7.867 -2.679 10.157 1.00 0.00 N ATOM 476 CA GLY A 30 7.646 -1.226 9.866 1.00 0.00 C ATOM 477 C GLY A 30 6.177 -0.843 10.052 1.00 0.00 C ATOM 478 O GLY A 30 5.312 -1.680 10.216 1.00 0.00 O ATOM 0 H GLY A 30 7.726 -3.307 9.365 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.269 -0.621 10.525 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.956 -1.006 8.844 1.00 0.00 H new ATOM 482 N VAL A 31 5.900 0.441 10.020 1.00 0.00 N ATOM 483 CA VAL A 31 4.499 0.936 10.190 1.00 0.00 C ATOM 484 C VAL A 31 4.079 1.715 8.947 1.00 0.00 C ATOM 485 O VAL A 31 4.802 2.554 8.445 1.00 0.00 O ATOM 486 CB VAL A 31 4.423 1.845 11.418 1.00 0.00 C ATOM 487 CG1 VAL A 31 3.061 2.548 11.458 1.00 0.00 C ATOM 488 CG2 VAL A 31 4.594 0.997 12.680 1.00 0.00 C ATOM 0 H VAL A 31 6.596 1.174 9.881 1.00 0.00 H new ATOM 0 HA VAL A 31 3.828 0.088 10.328 1.00 0.00 H new ATOM 0 HB VAL A 31 5.213 2.595 11.366 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.011 3.194 12.334 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.935 3.148 10.557 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.268 1.802 11.512 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.541 1.639 13.559 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.801 0.251 12.727 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.562 0.497 12.654 1.00 0.00 H new ATOM 498 N LEU A 32 2.901 1.435 8.452 1.00 0.00 N ATOM 499 CA LEU A 32 2.391 2.140 7.238 1.00 0.00 C ATOM 500 C LEU A 32 1.242 3.067 7.633 1.00 0.00 C ATOM 501 O LEU A 32 0.268 2.647 8.229 1.00 0.00 O ATOM 502 CB LEU A 32 1.890 1.094 6.235 1.00 0.00 C ATOM 503 CG LEU A 32 1.431 1.777 4.939 1.00 0.00 C ATOM 504 CD1 LEU A 32 2.602 2.547 4.299 1.00 0.00 C ATOM 505 CD2 LEU A 32 0.918 0.708 3.966 1.00 0.00 C ATOM 0 H LEU A 32 2.264 0.740 8.842 1.00 0.00 H new ATOM 0 HA LEU A 32 3.188 2.732 6.787 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.684 0.380 6.016 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.065 0.530 6.669 1.00 0.00 H new ATOM 0 HG LEU A 32 0.633 2.484 5.165 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.263 3.027 3.381 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.961 3.306 4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.411 1.854 4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.590 1.184 3.042 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.719 0.002 3.746 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.080 0.177 4.418 1.00 0.00 H new ATOM 517 N SER A 33 1.355 4.335 7.308 1.00 0.00 N ATOM 518 CA SER A 33 0.279 5.312 7.664 1.00 0.00 C ATOM 519 C SER A 33 -0.437 5.775 6.397 1.00 0.00 C ATOM 520 O SER A 33 0.171 6.279 5.468 1.00 0.00 O ATOM 521 CB SER A 33 0.904 6.516 8.365 1.00 0.00 C ATOM 522 OG SER A 33 1.602 6.069 9.522 1.00 0.00 O ATOM 0 H SER A 33 2.150 4.735 6.810 1.00 0.00 H new ATOM 0 HA SER A 33 -0.441 4.833 8.328 1.00 0.00 H new ATOM 0 HB2 SER A 33 1.587 7.032 7.690 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.131 7.232 8.645 1.00 0.00 H new ATOM 0 HG SER A 33 2.008 6.837 9.976 1.00 0.00 H new ATOM 528 N ILE A 34 -1.737 5.606 6.362 1.00 0.00 N ATOM 529 CA ILE A 34 -2.537 6.024 5.171 1.00 0.00 C ATOM 530 C ILE A 34 -3.348 7.265 5.521 1.00 0.00 C ATOM 531 O ILE A 34 -4.008 7.322 6.540 1.00 0.00 O ATOM 532 CB ILE A 34 -3.492 4.898 4.770 1.00 0.00 C ATOM 533 CG1 ILE A 34 -2.679 3.663 4.379 1.00 0.00 C ATOM 534 CG2 ILE A 34 -4.344 5.346 3.578 1.00 0.00 C ATOM 535 CD1 ILE A 34 -3.617 2.468 4.198 1.00 0.00 C ATOM 0 H ILE A 34 -2.283 5.191 7.118 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.864 6.242 4.342 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.144 4.658 5.609 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -2.132 3.852 3.455 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -1.939 3.444 5.148 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.024 4.542 3.294 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.921 6.228 3.854 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -3.694 5.586 2.736 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -3.036 1.589 3.919 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.144 2.274 5.132 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -4.340 2.689 3.413 1.00 0.00 H new ATOM 547 N LYS A 35 -3.300 8.265 4.677 1.00 0.00 N ATOM 548 CA LYS A 35 -4.064 9.523 4.941 1.00 0.00 C ATOM 549 C LYS A 35 -4.931 9.853 3.733 1.00 0.00 C ATOM 550 O LYS A 35 -4.522 9.710 2.593 1.00 0.00 O ATOM 551 CB LYS A 35 -3.079 10.662 5.185 1.00 0.00 C ATOM 552 CG LYS A 35 -2.339 10.410 6.498 1.00 0.00 C ATOM 553 CD LYS A 35 -1.354 11.549 6.763 1.00 0.00 C ATOM 554 CE LYS A 35 -0.621 11.286 8.076 1.00 0.00 C ATOM 555 NZ LYS A 35 0.341 12.391 8.343 1.00 0.00 N ATOM 0 H LYS A 35 -2.761 8.264 3.811 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.699 9.391 5.817 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.369 10.729 4.360 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.608 11.614 5.228 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.052 10.335 7.319 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.807 9.460 6.450 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -0.640 11.626 5.943 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.885 12.500 6.813 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.337 11.208 8.894 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.092 10.335 8.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 0.839 12.209 9.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 1.032 12.445 7.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.175 13.292 8.411 1.00 0.00 H new ATOM 569 N GLY A 36 -6.131 10.296 3.977 1.00 0.00 N ATOM 570 CA GLY A 36 -7.040 10.639 2.855 1.00 0.00 C ATOM 571 C GLY A 36 -8.447 10.888 3.397 1.00 0.00 C ATOM 572 O GLY A 36 -8.633 11.231 4.549 1.00 0.00 O ATOM 0 H GLY A 36 -6.521 10.435 4.909 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.676 11.526 2.336 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.058 9.829 2.126 1.00 0.00 H new ATOM 576 N GLU A 37 -9.439 10.719 2.564 1.00 0.00 N ATOM 577 CA GLU A 37 -10.851 10.948 2.994 1.00 0.00 C ATOM 578 C GLU A 37 -11.710 9.760 2.549 1.00 0.00 C ATOM 579 O GLU A 37 -11.448 9.134 1.540 1.00 0.00 O ATOM 580 CB GLU A 37 -11.376 12.234 2.340 1.00 0.00 C ATOM 581 CG GLU A 37 -10.318 13.342 2.450 1.00 0.00 C ATOM 582 CD GLU A 37 -10.039 13.650 3.923 1.00 0.00 C ATOM 583 OE1 GLU A 37 -10.904 13.381 4.739 1.00 0.00 O ATOM 584 OE2 GLU A 37 -8.958 14.138 4.210 1.00 0.00 O ATOM 0 H GLU A 37 -9.331 10.429 1.592 1.00 0.00 H new ATOM 0 HA GLU A 37 -10.897 11.046 4.079 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -11.615 12.049 1.293 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -12.299 12.550 2.826 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.399 13.030 1.954 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.666 14.241 1.941 1.00 0.00 H new ATOM 591 N LYS A 38 -12.725 9.445 3.307 1.00 0.00 N ATOM 592 CA LYS A 38 -13.614 8.296 2.958 1.00 0.00 C ATOM 593 C LYS A 38 -12.795 7.002 2.954 1.00 0.00 C ATOM 594 O LYS A 38 -12.773 6.257 1.992 1.00 0.00 O ATOM 595 CB LYS A 38 -14.252 8.519 1.579 1.00 0.00 C ATOM 596 CG LYS A 38 -14.835 9.939 1.484 1.00 0.00 C ATOM 597 CD LYS A 38 -16.023 10.088 2.444 1.00 0.00 C ATOM 598 CE LYS A 38 -16.686 11.448 2.232 1.00 0.00 C ATOM 599 NZ LYS A 38 -17.892 11.545 3.100 1.00 0.00 N ATOM 0 H LYS A 38 -12.980 9.939 4.162 1.00 0.00 H new ATOM 0 HA LYS A 38 -14.409 8.219 3.700 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.506 8.372 0.798 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -15.039 7.784 1.412 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.067 10.673 1.728 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.156 10.141 0.462 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.745 9.290 2.272 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.684 9.994 3.476 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -15.986 12.249 2.471 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -16.965 11.571 1.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.347 12.469 2.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.561 10.788 2.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.611 11.445 4.096 1.00 0.00 H new ATOM 613 N LEU A 39 -12.124 6.728 4.041 1.00 0.00 N ATOM 614 CA LEU A 39 -11.305 5.485 4.142 1.00 0.00 C ATOM 615 C LEU A 39 -12.155 4.384 4.777 1.00 0.00 C ATOM 616 O LEU A 39 -11.962 3.999 5.917 1.00 0.00 O ATOM 617 CB LEU A 39 -10.062 5.767 4.995 1.00 0.00 C ATOM 618 CG LEU A 39 -8.998 6.445 4.122 1.00 0.00 C ATOM 619 CD1 LEU A 39 -9.578 7.720 3.506 1.00 0.00 C ATOM 620 CD2 LEU A 39 -7.779 6.798 4.974 1.00 0.00 C ATOM 0 H LEU A 39 -12.108 7.319 4.872 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.983 5.160 3.153 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.322 6.408 5.838 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.672 4.838 5.410 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.696 5.762 3.328 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.822 8.201 2.886 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.443 7.467 2.893 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.883 8.401 4.300 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.026 7.279 4.350 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.077 7.478 5.772 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.363 5.889 5.408 1.00 0.00 H new ATOM 632 N GLY A 40 -13.106 3.883 4.037 1.00 0.00 N ATOM 633 CA GLY A 40 -13.991 2.812 4.573 1.00 0.00 C ATOM 634 C GLY A 40 -13.305 1.456 4.440 1.00 0.00 C ATOM 635 O GLY A 40 -12.915 1.042 3.364 1.00 0.00 O ATOM 0 H GLY A 40 -13.308 4.171 3.080 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -14.224 3.010 5.619 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -14.937 2.805 4.032 1.00 0.00 H new ATOM 697 N GLN A 50 -8.104 -11.824 4.715 1.00 0.00 N ATOM 698 CA GLN A 50 -7.513 -10.593 4.107 1.00 0.00 C ATOM 699 C GLN A 50 -8.363 -9.372 4.443 1.00 0.00 C ATOM 700 O GLN A 50 -9.513 -9.480 4.819 1.00 0.00 O ATOM 701 CB GLN A 50 -7.453 -10.759 2.592 1.00 0.00 C ATOM 702 CG GLN A 50 -6.451 -11.861 2.252 1.00 0.00 C ATOM 703 CD GLN A 50 -6.423 -12.076 0.740 1.00 0.00 C ATOM 704 OE1 GLN A 50 -7.442 -11.995 0.081 1.00 0.00 O ATOM 705 NE2 GLN A 50 -5.288 -12.344 0.157 1.00 0.00 N ATOM 0 HA GLN A 50 -6.510 -10.448 4.509 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.439 -11.013 2.202 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -7.156 -9.822 2.122 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.458 -11.587 2.609 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.727 -12.787 2.757 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -4.434 -12.412 0.710 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.254 -12.486 -0.853 1.00 0.00 H new ATOM 714 N VAL A 51 -7.788 -8.202 4.314 1.00 0.00 N ATOM 715 CA VAL A 51 -8.527 -6.942 4.625 1.00 0.00 C ATOM 716 C VAL A 51 -8.572 -6.061 3.379 1.00 0.00 C ATOM 717 O VAL A 51 -7.595 -5.912 2.673 1.00 0.00 O ATOM 718 CB VAL A 51 -7.801 -6.198 5.746 1.00 0.00 C ATOM 719 CG1 VAL A 51 -8.385 -4.788 5.900 1.00 0.00 C ATOM 720 CG2 VAL A 51 -7.977 -6.971 7.053 1.00 0.00 C ATOM 0 H VAL A 51 -6.826 -8.066 4.003 1.00 0.00 H new ATOM 0 HA VAL A 51 -9.543 -7.180 4.940 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.741 -6.118 5.503 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.863 -4.263 6.700 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.262 -4.239 4.966 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.445 -4.858 6.143 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.462 -6.447 7.858 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.038 -7.047 7.290 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -7.557 -7.971 6.944 1.00 0.00 H new ATOM 730 N GLU A 52 -9.712 -5.477 3.112 1.00 0.00 N ATOM 731 CA GLU A 52 -9.869 -4.592 1.918 1.00 0.00 C ATOM 732 C GLU A 52 -10.065 -3.155 2.388 1.00 0.00 C ATOM 733 O GLU A 52 -10.657 -2.901 3.420 1.00 0.00 O ATOM 734 CB GLU A 52 -11.106 -5.028 1.140 1.00 0.00 C ATOM 735 CG GLU A 52 -10.878 -6.424 0.556 1.00 0.00 C ATOM 736 CD GLU A 52 -12.220 -7.029 0.137 1.00 0.00 C ATOM 737 OE1 GLU A 52 -12.648 -6.767 -0.972 1.00 0.00 O ATOM 738 OE2 GLU A 52 -12.797 -7.745 0.941 1.00 0.00 O ATOM 0 H GLU A 52 -10.554 -5.578 3.680 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.984 -4.660 1.285 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -11.977 -5.035 1.795 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.314 -4.317 0.340 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -10.210 -6.365 -0.303 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -10.393 -7.064 1.294 1.00 0.00 H new ATOM 745 N VAL A 53 -9.576 -2.209 1.634 1.00 0.00 N ATOM 746 CA VAL A 53 -9.733 -0.773 2.018 1.00 0.00 C ATOM 747 C VAL A 53 -10.175 0.014 0.799 1.00 0.00 C ATOM 748 O VAL A 53 -9.658 -0.170 -0.287 1.00 0.00 O ATOM 749 CB VAL A 53 -8.408 -0.214 2.520 1.00 0.00 C ATOM 750 CG1 VAL A 53 -8.586 1.266 2.865 1.00 0.00 C ATOM 751 CG2 VAL A 53 -7.980 -0.981 3.770 1.00 0.00 C ATOM 0 H VAL A 53 -9.071 -2.368 0.762 1.00 0.00 H new ATOM 0 HA VAL A 53 -10.475 -0.692 2.812 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.645 -0.320 1.749 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.641 1.672 3.225 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.900 1.812 1.975 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.345 1.370 3.641 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.032 -0.585 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.740 -0.870 4.543 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.862 -2.037 3.526 1.00 0.00 H new ATOM 761 N GLU A 54 -11.132 0.891 0.965 1.00 0.00 N ATOM 762 CA GLU A 54 -11.626 1.702 -0.189 1.00 0.00 C ATOM 763 C GLU A 54 -11.534 3.183 0.153 1.00 0.00 C ATOM 764 O GLU A 54 -11.911 3.626 1.226 1.00 0.00 O ATOM 765 CB GLU A 54 -13.093 1.308 -0.492 1.00 0.00 C ATOM 766 CG GLU A 54 -13.326 1.131 -2.000 1.00 0.00 C ATOM 767 CD GLU A 54 -13.516 2.496 -2.663 1.00 0.00 C ATOM 768 OE1 GLU A 54 -12.760 3.394 -2.344 1.00 0.00 O ATOM 769 OE2 GLU A 54 -14.417 2.616 -3.478 1.00 0.00 O ATOM 0 H GLU A 54 -11.595 1.081 1.854 1.00 0.00 H new ATOM 0 HA GLU A 54 -11.014 1.509 -1.070 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -13.337 0.381 0.027 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -13.764 2.075 -0.106 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -12.478 0.614 -2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -14.205 0.509 -2.170 1.00 0.00 H new ATOM 776 N GLY A 55 -11.037 3.948 -0.772 1.00 0.00 N ATOM 777 CA GLY A 55 -10.917 5.412 -0.545 1.00 0.00 C ATOM 778 C GLY A 55 -9.810 5.984 -1.430 1.00 0.00 C ATOM 779 O GLY A 55 -9.104 5.270 -2.115 1.00 0.00 O ATOM 0 H GLY A 55 -10.707 3.622 -1.680 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.864 5.903 -0.769 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.695 5.610 0.504 1.00 0.00 H new ATOM 783 N LEU A 56 -9.666 7.282 -1.420 1.00 0.00 N ATOM 784 CA LEU A 56 -8.621 7.940 -2.254 1.00 0.00 C ATOM 785 C LEU A 56 -7.366 8.177 -1.413 1.00 0.00 C ATOM 786 O LEU A 56 -7.437 8.562 -0.262 1.00 0.00 O ATOM 787 CB LEU A 56 -9.156 9.289 -2.770 1.00 0.00 C ATOM 788 CG LEU A 56 -9.991 9.999 -1.670 1.00 0.00 C ATOM 789 CD1 LEU A 56 -9.817 11.520 -1.789 1.00 0.00 C ATOM 790 CD2 LEU A 56 -11.482 9.659 -1.827 1.00 0.00 C ATOM 0 H LEU A 56 -10.234 7.920 -0.863 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.372 7.297 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.324 9.926 -3.071 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.771 9.128 -3.655 1.00 0.00 H new ATOM 0 HG LEU A 56 -9.641 9.657 -0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.404 12.015 -1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.765 11.777 -1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.158 11.850 -2.770 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.054 10.164 -1.049 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.830 9.990 -2.806 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -11.621 8.582 -1.738 1.00 0.00 H new ATOM 802 N ILE A 57 -6.213 7.958 -1.984 1.00 0.00 N ATOM 803 CA ILE A 57 -4.946 8.179 -1.229 1.00 0.00 C ATOM 804 C ILE A 57 -4.451 9.602 -1.503 1.00 0.00 C ATOM 805 O ILE A 57 -4.044 9.939 -2.599 1.00 0.00 O ATOM 806 CB ILE A 57 -3.908 7.139 -1.690 1.00 0.00 C ATOM 807 CG1 ILE A 57 -4.156 5.816 -0.950 1.00 0.00 C ATOM 808 CG2 ILE A 57 -2.480 7.627 -1.391 1.00 0.00 C ATOM 809 CD1 ILE A 57 -5.619 5.395 -1.118 1.00 0.00 C ATOM 0 H ILE A 57 -6.093 7.635 -2.944 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.107 8.064 -0.157 1.00 0.00 H new ATOM 0 HB ILE A 57 -4.010 6.994 -2.766 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -3.497 5.041 -1.341 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -3.920 5.930 0.108 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.762 6.878 -1.724 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.298 8.564 -1.918 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.367 7.786 -0.319 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.790 4.456 -0.591 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.269 6.166 -0.705 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.840 5.263 -2.177 1.00 0.00 H new ATOM 821 N ASP A 58 -4.487 10.436 -0.502 1.00 0.00 N ATOM 822 CA ASP A 58 -4.025 11.844 -0.659 1.00 0.00 C ATOM 823 C ASP A 58 -2.593 11.971 -0.133 1.00 0.00 C ATOM 824 O ASP A 58 -1.861 12.866 -0.508 1.00 0.00 O ATOM 825 CB ASP A 58 -4.952 12.759 0.140 1.00 0.00 C ATOM 826 CG ASP A 58 -6.389 12.588 -0.366 1.00 0.00 C ATOM 827 OD1 ASP A 58 -6.552 12.340 -1.548 1.00 0.00 O ATOM 828 OD2 ASP A 58 -7.299 12.703 0.438 1.00 0.00 O ATOM 0 H ASP A 58 -4.822 10.199 0.432 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.045 12.129 -1.711 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.896 12.516 1.201 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -4.638 13.797 0.034 1.00 0.00 H new ATOM 833 N ALA A 59 -2.177 11.083 0.734 1.00 0.00 N ATOM 834 CA ALA A 59 -0.781 11.184 1.258 1.00 0.00 C ATOM 835 C ALA A 59 -0.352 9.869 1.911 1.00 0.00 C ATOM 836 O ALA A 59 -1.152 9.136 2.463 1.00 0.00 O ATOM 837 CB ALA A 59 -0.685 12.321 2.287 1.00 0.00 C ATOM 0 H ALA A 59 -2.731 10.307 1.096 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.117 11.394 0.420 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.336 12.386 2.663 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.959 13.264 1.814 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.364 12.120 3.115 1.00 0.00 H new ATOM 843 N LEU A 60 0.923 9.577 1.852 1.00 0.00 N ATOM 844 CA LEU A 60 1.452 8.321 2.465 1.00 0.00 C ATOM 845 C LEU A 60 2.694 8.649 3.276 1.00 0.00 C ATOM 846 O LEU A 60 3.562 9.377 2.836 1.00 0.00 O ATOM 847 CB LEU A 60 1.828 7.329 1.357 1.00 0.00 C ATOM 848 CG LEU A 60 0.562 6.729 0.724 1.00 0.00 C ATOM 849 CD1 LEU A 60 0.952 5.863 -0.477 1.00 0.00 C ATOM 850 CD2 LEU A 60 -0.206 5.879 1.756 1.00 0.00 C ATOM 0 H LEU A 60 1.627 10.161 1.401 1.00 0.00 H new ATOM 0 HA LEU A 60 0.690 7.881 3.108 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.420 7.834 0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.449 6.533 1.768 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.086 7.540 0.393 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.054 5.438 -0.926 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.471 6.476 -1.214 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.609 5.058 -0.147 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.099 5.462 1.291 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.433 5.068 2.107 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.495 6.505 2.600 1.00 0.00 H new ATOM 862 N VAL A 61 2.792 8.107 4.460 1.00 0.00 N ATOM 863 CA VAL A 61 3.991 8.368 5.307 1.00 0.00 C ATOM 864 C VAL A 61 4.465 7.058 5.927 1.00 0.00 C ATOM 865 O VAL A 61 3.732 6.374 6.618 1.00 0.00 O ATOM 866 CB VAL A 61 3.639 9.370 6.412 1.00 0.00 C ATOM 867 CG1 VAL A 61 4.768 9.425 7.449 1.00 0.00 C ATOM 868 CG2 VAL A 61 3.460 10.757 5.791 1.00 0.00 C ATOM 0 H VAL A 61 2.092 7.494 4.878 1.00 0.00 H new ATOM 0 HA VAL A 61 4.787 8.787 4.691 1.00 0.00 H new ATOM 0 HB VAL A 61 2.717 9.057 6.902 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.510 10.139 8.231 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.905 8.438 7.891 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.693 9.737 6.964 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.209 11.475 6.571 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.387 11.060 5.303 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.656 10.725 5.055 1.00 0.00 H new ATOM 878 N TYR A 62 5.696 6.715 5.690 1.00 0.00 N ATOM 879 CA TYR A 62 6.272 5.471 6.259 1.00 0.00 C ATOM 880 C TYR A 62 7.680 5.829 6.752 1.00 0.00 C ATOM 881 O TYR A 62 8.344 6.620 6.124 1.00 0.00 O ATOM 882 CB TYR A 62 6.351 4.414 5.155 1.00 0.00 C ATOM 883 CG TYR A 62 7.082 3.196 5.663 1.00 0.00 C ATOM 884 CD1 TYR A 62 8.478 3.186 5.689 1.00 0.00 C ATOM 885 CD2 TYR A 62 6.365 2.080 6.107 1.00 0.00 C ATOM 886 CE1 TYR A 62 9.160 2.059 6.156 1.00 0.00 C ATOM 887 CE2 TYR A 62 7.045 0.951 6.575 1.00 0.00 C ATOM 888 CZ TYR A 62 8.446 0.942 6.599 1.00 0.00 C ATOM 889 OH TYR A 62 9.122 -0.170 7.053 1.00 0.00 O ATOM 0 H TYR A 62 6.340 7.256 5.114 1.00 0.00 H new ATOM 0 HA TYR A 62 5.667 5.075 7.074 1.00 0.00 H new ATOM 0 HB2 TYR A 62 5.348 4.138 4.831 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.866 4.822 4.285 1.00 0.00 H new ATOM 0 HD1 TYR A 62 9.031 4.049 5.348 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.285 2.090 6.088 1.00 0.00 H new ATOM 0 HE1 TYR A 62 10.240 2.051 6.175 1.00 0.00 H new ATOM 0 HE2 TYR A 62 6.492 0.089 6.917 1.00 0.00 H new ATOM 0 HH TYR A 62 9.851 -0.385 6.434 1.00 0.00 H new ATOM 899 N PRO A 63 8.138 5.299 7.863 1.00 0.00 N ATOM 900 CA PRO A 63 9.497 5.631 8.390 1.00 0.00 C ATOM 901 C PRO A 63 10.610 4.860 7.667 1.00 0.00 C ATOM 902 O PRO A 63 10.740 3.658 7.805 1.00 0.00 O ATOM 903 CB PRO A 63 9.416 5.203 9.857 1.00 0.00 C ATOM 904 CG PRO A 63 8.450 4.063 9.863 1.00 0.00 C ATOM 905 CD PRO A 63 7.436 4.349 8.747 1.00 0.00 C ATOM 0 HA PRO A 63 9.745 6.683 8.248 1.00 0.00 H new ATOM 0 HB2 PRO A 63 10.392 4.898 10.236 1.00 0.00 H new ATOM 0 HB3 PRO A 63 9.069 6.020 10.490 1.00 0.00 H new ATOM 0 HG2 PRO A 63 8.964 3.118 9.688 1.00 0.00 H new ATOM 0 HG3 PRO A 63 7.952 3.981 10.829 1.00 0.00 H new ATOM 0 HD2 PRO A 63 7.160 3.438 8.215 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.516 4.778 9.144 1.00 0.00 H new ATOM 913 N LEU A 64 11.419 5.553 6.912 1.00 0.00 N ATOM 914 CA LEU A 64 12.544 4.891 6.182 1.00 0.00 C ATOM 915 C LEU A 64 13.853 5.196 6.919 1.00 0.00 C ATOM 916 O LEU A 64 14.866 4.558 6.703 1.00 0.00 O ATOM 917 CB LEU A 64 12.623 5.419 4.725 1.00 0.00 C ATOM 918 CG LEU A 64 12.145 6.889 4.613 1.00 0.00 C ATOM 919 CD1 LEU A 64 10.620 7.004 4.836 1.00 0.00 C ATOM 920 CD2 LEU A 64 12.907 7.779 5.608 1.00 0.00 C ATOM 0 H LEU A 64 11.349 6.560 6.767 1.00 0.00 H new ATOM 0 HA LEU A 64 12.377 3.814 6.149 1.00 0.00 H new ATOM 0 HB2 LEU A 64 13.650 5.344 4.367 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.013 4.789 4.078 1.00 0.00 H new ATOM 0 HG LEU A 64 12.359 7.235 3.602 1.00 0.00 H new ATOM 0 HD11 LEU A 64 10.318 8.048 4.751 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.097 6.412 4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.369 6.633 5.830 1.00 0.00 H new ATOM 0 HD21 LEU A 64 12.559 8.808 5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 64 12.729 7.425 6.623 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.974 7.736 5.391 1.00 0.00 H new ATOM 1082 N ASN B 3 6.522 -13.225 6.650 1.00 0.00 N ATOM 1083 CA ASN B 3 6.659 -11.749 6.518 1.00 0.00 C ATOM 1084 C ASN B 3 6.313 -11.328 5.082 1.00 0.00 C ATOM 1085 O ASN B 3 6.284 -10.156 4.752 1.00 0.00 O ATOM 1086 CB ASN B 3 8.104 -11.358 6.862 1.00 0.00 C ATOM 1087 CG ASN B 3 9.087 -12.139 5.989 1.00 0.00 C ATOM 1088 OD1 ASN B 3 9.553 -13.197 6.371 1.00 0.00 O ATOM 1089 ND2 ASN B 3 9.430 -11.658 4.831 1.00 0.00 N ATOM 0 HA ASN B 3 5.976 -11.242 7.200 1.00 0.00 H new ATOM 0 HB2 ASN B 3 8.244 -10.288 6.711 1.00 0.00 H new ATOM 0 HB3 ASN B 3 8.302 -11.560 7.915 1.00 0.00 H new ATOM 0 HD21 ASN B 3 10.090 -12.167 4.242 1.00 0.00 H new ATOM 0 HD22 ASN B 3 9.040 -10.772 4.511 1.00 0.00 H new ATOM 1096 N ARG B 4 6.041 -12.275 4.227 1.00 0.00 N ATOM 1097 CA ARG B 4 5.691 -11.940 2.817 1.00 0.00 C ATOM 1098 C ARG B 4 4.250 -11.454 2.743 1.00 0.00 C ATOM 1099 O ARG B 4 3.369 -11.982 3.392 1.00 0.00 O ATOM 1100 CB ARG B 4 5.850 -13.186 1.945 1.00 0.00 C ATOM 1101 CG ARG B 4 7.337 -13.569 1.841 1.00 0.00 C ATOM 1102 CD ARG B 4 8.009 -12.777 0.718 1.00 0.00 C ATOM 1103 NE ARG B 4 7.290 -13.007 -0.570 1.00 0.00 N ATOM 1104 CZ ARG B 4 7.319 -14.176 -1.147 1.00 0.00 C ATOM 1105 NH1 ARG B 4 7.982 -15.163 -0.610 1.00 0.00 N ATOM 1106 NH2 ARG B 4 6.684 -14.356 -2.270 1.00 0.00 N ATOM 0 H ARG B 4 6.046 -13.271 4.445 1.00 0.00 H new ATOM 0 HA ARG B 4 6.355 -11.153 2.460 1.00 0.00 H new ATOM 0 HB2 ARG B 4 5.282 -14.013 2.371 1.00 0.00 H new ATOM 0 HB3 ARG B 4 5.444 -12.999 0.951 1.00 0.00 H new ATOM 0 HG2 ARG B 4 7.839 -13.369 2.788 1.00 0.00 H new ATOM 0 HG3 ARG B 4 7.432 -14.638 1.650 1.00 0.00 H new ATOM 0 HD2 ARG B 4 8.007 -11.714 0.960 1.00 0.00 H new ATOM 0 HD3 ARG B 4 9.051 -13.080 0.621 1.00 0.00 H new ATOM 0 HE ARG B 4 6.771 -12.243 -1.003 1.00 0.00 H new ATOM 0 HH11 ARG B 4 8.483 -15.023 0.268 1.00 0.00 H new ATOM 0 HH12 ARG B 4 8.000 -16.074 -1.068 1.00 0.00 H new ATOM 0 HH21 ARG B 4 6.168 -13.585 -2.693 1.00 0.00 H new ATOM 0 HH22 ARG B 4 6.703 -15.268 -2.726 1.00 0.00 H new ATOM 1120 N GLN B 5 4.002 -10.446 1.949 1.00 0.00 N ATOM 1121 CA GLN B 5 2.616 -9.909 1.826 1.00 0.00 C ATOM 1122 C GLN B 5 2.326 -9.581 0.366 1.00 0.00 C ATOM 1123 O GLN B 5 3.220 -9.352 -0.428 1.00 0.00 O ATOM 1124 CB GLN B 5 2.495 -8.636 2.659 1.00 0.00 C ATOM 1125 CG GLN B 5 2.651 -8.988 4.138 1.00 0.00 C ATOM 1126 CD GLN B 5 2.590 -7.713 4.978 1.00 0.00 C ATOM 1127 OE1 GLN B 5 3.424 -6.839 4.839 1.00 0.00 O ATOM 1128 NE2 GLN B 5 1.633 -7.572 5.850 1.00 0.00 N ATOM 0 H GLN B 5 4.702 -9.971 1.379 1.00 0.00 H new ATOM 0 HA GLN B 5 1.904 -10.653 2.182 1.00 0.00 H new ATOM 0 HB2 GLN B 5 3.259 -7.918 2.361 1.00 0.00 H new ATOM 0 HB3 GLN B 5 1.528 -8.164 2.485 1.00 0.00 H new ATOM 0 HG2 GLN B 5 1.862 -9.675 4.444 1.00 0.00 H new ATOM 0 HG3 GLN B 5 3.600 -9.499 4.302 1.00 0.00 H new ATOM 0 HE21 GLN B 5 0.935 -8.307 5.964 1.00 0.00 H new ATOM 0 HE22 GLN B 5 1.582 -6.727 6.419 1.00 0.00 H new ATOM 1137 N PHE B 6 1.066 -9.557 0.012 1.00 0.00 N ATOM 1138 CA PHE B 6 0.666 -9.246 -1.395 1.00 0.00 C ATOM 1139 C PHE B 6 -0.046 -7.899 -1.407 1.00 0.00 C ATOM 1140 O PHE B 6 -0.901 -7.638 -0.583 1.00 0.00 O ATOM 1141 CB PHE B 6 -0.291 -10.332 -1.903 1.00 0.00 C ATOM 1142 CG PHE B 6 0.131 -11.673 -1.349 1.00 0.00 C ATOM 1143 CD1 PHE B 6 1.476 -12.056 -1.382 1.00 0.00 C ATOM 1144 CD2 PHE B 6 -0.828 -12.536 -0.803 1.00 0.00 C ATOM 1145 CE1 PHE B 6 1.864 -13.299 -0.869 1.00 0.00 C ATOM 1146 CE2 PHE B 6 -0.442 -13.779 -0.290 1.00 0.00 C ATOM 1147 CZ PHE B 6 0.905 -14.162 -0.323 1.00 0.00 C ATOM 0 H PHE B 6 0.288 -9.742 0.645 1.00 0.00 H new ATOM 0 HA PHE B 6 1.546 -9.212 -2.038 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -1.312 -10.105 -1.596 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -0.284 -10.358 -2.993 1.00 0.00 H new ATOM 0 HD1 PHE B 6 2.216 -11.392 -1.804 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -1.867 -12.241 -0.778 1.00 0.00 H new ATOM 0 HE1 PHE B 6 2.903 -13.593 -0.894 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -1.182 -14.443 0.131 1.00 0.00 H new ATOM 0 HZ PHE B 6 1.204 -15.122 0.072 1.00 0.00 H new ATOM 1157 N LEU B 7 0.298 -7.039 -2.327 1.00 0.00 N ATOM 1158 CA LEU B 7 -0.363 -5.699 -2.388 1.00 0.00 C ATOM 1159 C LEU B 7 -1.086 -5.569 -3.726 1.00 0.00 C ATOM 1160 O LEU B 7 -0.503 -5.738 -4.779 1.00 0.00 O ATOM 1161 CB LEU B 7 0.704 -4.607 -2.260 1.00 0.00 C ATOM 1162 CG LEU B 7 0.045 -3.244 -1.942 1.00 0.00 C ATOM 1163 CD1 LEU B 7 1.073 -2.319 -1.287 1.00 0.00 C ATOM 1164 CD2 LEU B 7 -0.499 -2.583 -3.225 1.00 0.00 C ATOM 0 H LEU B 7 1.008 -7.204 -3.040 1.00 0.00 H new ATOM 0 HA LEU B 7 -1.081 -5.593 -1.575 1.00 0.00 H new ATOM 0 HB2 LEU B 7 1.410 -4.870 -1.472 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.273 -4.536 -3.187 1.00 0.00 H new ATOM 0 HG LEU B 7 -0.788 -3.414 -1.260 1.00 0.00 H new ATOM 0 HD11 LEU B 7 0.608 -1.359 -1.063 1.00 0.00 H new ATOM 0 HD12 LEU B 7 1.433 -2.772 -0.363 1.00 0.00 H new ATOM 0 HD13 LEU B 7 1.911 -2.167 -1.967 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -0.957 -1.626 -2.975 1.00 0.00 H new ATOM 0 HD22 LEU B 7 0.320 -2.421 -3.926 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -1.244 -3.234 -3.682 1.00 0.00 H new ATOM 1176 N SER B 8 -2.363 -5.275 -3.682 1.00 0.00 N ATOM 1177 CA SER B 8 -3.159 -5.139 -4.942 1.00 0.00 C ATOM 1178 C SER B 8 -3.593 -3.691 -5.130 1.00 0.00 C ATOM 1179 O SER B 8 -3.873 -2.977 -4.185 1.00 0.00 O ATOM 1180 CB SER B 8 -4.398 -6.030 -4.852 1.00 0.00 C ATOM 1181 OG SER B 8 -5.265 -5.542 -3.835 1.00 0.00 O ATOM 0 H SER B 8 -2.891 -5.123 -2.823 1.00 0.00 H new ATOM 0 HA SER B 8 -2.544 -5.441 -5.790 1.00 0.00 H new ATOM 0 HB2 SER B 8 -4.918 -6.045 -5.810 1.00 0.00 H new ATOM 0 HB3 SER B 8 -4.105 -7.057 -4.632 1.00 0.00 H new ATOM 0 HG SER B 8 -6.059 -6.114 -3.780 1.00 0.00 H new ATOM 1187 N LEU B 9 -3.649 -3.251 -6.358 1.00 0.00 N ATOM 1188 CA LEU B 9 -4.065 -1.846 -6.627 1.00 0.00 C ATOM 1189 C LEU B 9 -4.600 -1.740 -8.059 1.00 0.00 C ATOM 1190 O LEU B 9 -4.274 -2.542 -8.921 1.00 0.00 O ATOM 1191 CB LEU B 9 -2.857 -0.915 -6.452 1.00 0.00 C ATOM 1192 CG LEU B 9 -3.325 0.540 -6.268 1.00 0.00 C ATOM 1193 CD1 LEU B 9 -3.808 0.778 -4.824 1.00 0.00 C ATOM 1194 CD2 LEU B 9 -2.159 1.491 -6.571 1.00 0.00 C ATOM 0 H LEU B 9 -3.425 -3.804 -7.185 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.848 -1.554 -5.928 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -2.271 -1.227 -5.588 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -2.205 -0.987 -7.322 1.00 0.00 H new ATOM 0 HG LEU B 9 -4.153 0.729 -6.952 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.134 1.812 -4.715 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -4.641 0.110 -4.604 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -2.991 0.580 -4.130 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -2.487 2.522 -6.442 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -1.334 1.284 -5.889 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -1.826 1.343 -7.598 1.00 0.00 H new ATOM 1206 N THR B 10 -5.425 -0.755 -8.317 1.00 0.00 N ATOM 1207 CA THR B 10 -5.993 -0.585 -9.689 1.00 0.00 C ATOM 1208 C THR B 10 -6.279 0.896 -9.962 1.00 0.00 C ATOM 1209 O THR B 10 -6.426 1.692 -9.055 1.00 0.00 O ATOM 1210 CB THR B 10 -7.292 -1.382 -9.811 1.00 0.00 C ATOM 1211 OG1 THR B 10 -7.921 -1.071 -11.046 1.00 0.00 O ATOM 1212 CG2 THR B 10 -8.232 -1.041 -8.653 1.00 0.00 C ATOM 0 H THR B 10 -5.730 -0.061 -7.635 1.00 0.00 H new ATOM 0 HA THR B 10 -5.269 -0.950 -10.417 1.00 0.00 H new ATOM 0 HB THR B 10 -7.062 -2.447 -9.775 1.00 0.00 H new ATOM 0 HG1 THR B 10 -8.753 -1.582 -11.127 1.00 0.00 H new ATOM 0 HG21 THR B 10 -9.153 -1.615 -8.751 1.00 0.00 H new ATOM 0 HG22 THR B 10 -7.749 -1.289 -7.708 1.00 0.00 H new ATOM 0 HG23 THR B 10 -8.464 0.024 -8.674 1.00 0.00 H new ATOM 1220 N GLY B 11 -6.360 1.263 -11.217 1.00 0.00 N ATOM 1221 CA GLY B 11 -6.635 2.687 -11.576 1.00 0.00 C ATOM 1222 C GLY B 11 -5.330 3.488 -11.533 1.00 0.00 C ATOM 1223 O GLY B 11 -5.332 4.704 -11.511 1.00 0.00 O ATOM 0 H GLY B 11 -6.247 0.634 -12.012 1.00 0.00 H new ATOM 0 HA2 GLY B 11 -7.076 2.743 -12.571 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -7.359 3.114 -10.882 1.00 0.00 H new ATOM 1227 N VAL B 12 -4.215 2.815 -11.513 1.00 0.00 N ATOM 1228 CA VAL B 12 -2.914 3.540 -11.462 1.00 0.00 C ATOM 1229 C VAL B 12 -2.821 4.542 -12.613 1.00 0.00 C ATOM 1230 O VAL B 12 -3.372 4.346 -13.681 1.00 0.00 O ATOM 1231 CB VAL B 12 -1.755 2.543 -11.555 1.00 0.00 C ATOM 1232 CG1 VAL B 12 -1.764 1.844 -12.917 1.00 0.00 C ATOM 1233 CG2 VAL B 12 -0.432 3.293 -11.380 1.00 0.00 C ATOM 0 H VAL B 12 -4.147 1.797 -11.530 1.00 0.00 H new ATOM 0 HA VAL B 12 -2.852 4.078 -10.516 1.00 0.00 H new ATOM 0 HB VAL B 12 -1.866 1.793 -10.772 1.00 0.00 H new ATOM 0 HG11 VAL B 12 -0.935 1.138 -12.969 1.00 0.00 H new ATOM 0 HG12 VAL B 12 -2.705 1.309 -13.045 1.00 0.00 H new ATOM 0 HG13 VAL B 12 -1.659 2.587 -13.708 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.397 2.588 -11.445 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.333 4.044 -12.164 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -0.417 3.782 -10.406 1.00 0.00 H new ATOM 1243 N SER B 13 -2.119 5.618 -12.397 1.00 0.00 N ATOM 1244 CA SER B 13 -1.969 6.646 -13.460 1.00 0.00 C ATOM 1245 C SER B 13 -1.023 6.109 -14.539 1.00 0.00 C ATOM 1246 O SER B 13 -1.277 6.230 -15.722 1.00 0.00 O ATOM 1247 CB SER B 13 -1.387 7.916 -12.835 1.00 0.00 C ATOM 1248 OG SER B 13 -1.717 9.037 -13.643 1.00 0.00 O ATOM 0 H SER B 13 -1.639 5.830 -11.522 1.00 0.00 H new ATOM 0 HA SER B 13 -2.934 6.875 -13.911 1.00 0.00 H new ATOM 0 HB2 SER B 13 -1.781 8.052 -11.828 1.00 0.00 H new ATOM 0 HB3 SER B 13 -0.305 7.826 -12.744 1.00 0.00 H new ATOM 0 HG SER B 13 -1.346 9.850 -13.242 1.00 0.00 H new ATOM 1254 N LYS B 14 0.064 5.504 -14.140 1.00 0.00 N ATOM 1255 CA LYS B 14 1.014 4.953 -15.154 1.00 0.00 C ATOM 1256 C LYS B 14 2.112 4.131 -14.466 1.00 0.00 C ATOM 1257 O LYS B 14 2.306 4.200 -13.266 1.00 0.00 O ATOM 1258 CB LYS B 14 1.648 6.104 -15.968 1.00 0.00 C ATOM 1259 CG LYS B 14 2.946 6.589 -15.303 1.00 0.00 C ATOM 1260 CD LYS B 14 3.327 7.965 -15.834 1.00 0.00 C ATOM 1261 CE LYS B 14 3.776 7.848 -17.292 1.00 0.00 C ATOM 1262 NZ LYS B 14 4.351 9.145 -17.740 1.00 0.00 N ATOM 0 H LYS B 14 0.335 5.368 -13.166 1.00 0.00 H new ATOM 0 HA LYS B 14 0.461 4.302 -15.831 1.00 0.00 H new ATOM 0 HB2 LYS B 14 1.858 5.766 -16.983 1.00 0.00 H new ATOM 0 HB3 LYS B 14 0.943 6.931 -16.047 1.00 0.00 H new ATOM 0 HG2 LYS B 14 2.815 6.632 -14.222 1.00 0.00 H new ATOM 0 HG3 LYS B 14 3.750 5.880 -15.499 1.00 0.00 H new ATOM 0 HD2 LYS B 14 2.477 8.643 -15.758 1.00 0.00 H new ATOM 0 HD3 LYS B 14 4.128 8.390 -15.229 1.00 0.00 H new ATOM 0 HE2 LYS B 14 4.517 7.055 -17.393 1.00 0.00 H new ATOM 0 HE3 LYS B 14 2.930 7.576 -17.923 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 4.656 9.066 -18.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 3.631 9.891 -17.658 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 5.169 9.387 -17.144 1.00 0.00 H new ATOM 1276 N VAL B 15 2.848 3.373 -15.235 1.00 0.00 N ATOM 1277 CA VAL B 15 3.958 2.561 -14.662 1.00 0.00 C ATOM 1278 C VAL B 15 5.276 3.322 -14.831 1.00 0.00 C ATOM 1279 O VAL B 15 5.879 3.324 -15.888 1.00 0.00 O ATOM 1280 CB VAL B 15 4.031 1.224 -15.398 1.00 0.00 C ATOM 1281 CG1 VAL B 15 5.208 0.412 -14.866 1.00 0.00 C ATOM 1282 CG2 VAL B 15 2.730 0.452 -15.157 1.00 0.00 C ATOM 0 H VAL B 15 2.726 3.282 -16.244 1.00 0.00 H new ATOM 0 HA VAL B 15 3.781 2.380 -13.602 1.00 0.00 H new ATOM 0 HB VAL B 15 4.167 1.398 -16.465 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.259 -0.542 -15.392 1.00 0.00 H new ATOM 0 HG12 VAL B 15 6.134 0.965 -15.026 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.073 0.232 -13.800 1.00 0.00 H new ATOM 0 HG21 VAL B 15 2.772 -0.504 -15.679 1.00 0.00 H new ATOM 0 HG22 VAL B 15 2.603 0.277 -14.089 1.00 0.00 H new ATOM 0 HG23 VAL B 15 1.887 1.033 -15.532 1.00 0.00 H new ATOM 1292 N GLN B 16 5.728 3.972 -13.793 1.00 0.00 N ATOM 1293 CA GLN B 16 7.004 4.737 -13.882 1.00 0.00 C ATOM 1294 C GLN B 16 8.167 3.767 -14.112 1.00 0.00 C ATOM 1295 O GLN B 16 8.995 3.962 -14.980 1.00 0.00 O ATOM 1296 CB GLN B 16 7.222 5.489 -12.567 1.00 0.00 C ATOM 1297 CG GLN B 16 8.440 6.413 -12.677 1.00 0.00 C ATOM 1298 CD GLN B 16 8.143 7.536 -13.675 1.00 0.00 C ATOM 1299 OE1 GLN B 16 8.282 7.357 -14.869 1.00 0.00 O ATOM 1300 NE2 GLN B 16 7.739 8.693 -13.233 1.00 0.00 N ATOM 0 H GLN B 16 5.266 4.006 -12.884 1.00 0.00 H new ATOM 0 HA GLN B 16 6.955 5.443 -14.711 1.00 0.00 H new ATOM 0 HB2 GLN B 16 6.335 6.073 -12.323 1.00 0.00 H new ATOM 0 HB3 GLN B 16 7.369 4.778 -11.754 1.00 0.00 H new ATOM 0 HG2 GLN B 16 8.679 6.834 -11.701 1.00 0.00 H new ATOM 0 HG3 GLN B 16 9.312 5.845 -13.002 1.00 0.00 H new ATOM 0 HE21 GLN B 16 7.622 8.844 -12.231 1.00 0.00 H new ATOM 0 HE22 GLN B 16 7.539 9.448 -13.889 1.00 0.00 H new ATOM 1309 N SER B 17 8.237 2.721 -13.340 1.00 0.00 N ATOM 1310 CA SER B 17 9.344 1.742 -13.520 1.00 0.00 C ATOM 1311 C SER B 17 9.051 0.488 -12.699 1.00 0.00 C ATOM 1312 O SER B 17 8.752 0.560 -11.521 1.00 0.00 O ATOM 1313 CB SER B 17 10.670 2.350 -13.057 1.00 0.00 C ATOM 1314 OG SER B 17 11.725 1.435 -13.335 1.00 0.00 O ATOM 0 H SER B 17 7.578 2.501 -12.594 1.00 0.00 H new ATOM 0 HA SER B 17 9.420 1.485 -14.577 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.849 3.296 -13.568 1.00 0.00 H new ATOM 0 HB3 SER B 17 10.632 2.567 -11.989 1.00 0.00 H new ATOM 0 HG SER B 17 12.577 1.820 -13.042 1.00 0.00 H new ATOM 1320 N PHE B 18 9.134 -0.665 -13.315 1.00 0.00 N ATOM 1321 CA PHE B 18 8.863 -1.941 -12.586 1.00 0.00 C ATOM 1322 C PHE B 18 10.160 -2.739 -12.467 1.00 0.00 C ATOM 1323 O PHE B 18 10.740 -3.159 -13.451 1.00 0.00 O ATOM 1324 CB PHE B 18 7.831 -2.765 -13.363 1.00 0.00 C ATOM 1325 CG PHE B 18 7.738 -4.147 -12.757 1.00 0.00 C ATOM 1326 CD1 PHE B 18 6.862 -4.388 -11.694 1.00 0.00 C ATOM 1327 CD2 PHE B 18 8.545 -5.178 -13.250 1.00 0.00 C ATOM 1328 CE1 PHE B 18 6.790 -5.664 -11.124 1.00 0.00 C ATOM 1329 CE2 PHE B 18 8.476 -6.452 -12.678 1.00 0.00 C ATOM 1330 CZ PHE B 18 7.598 -6.697 -11.614 1.00 0.00 C ATOM 0 H PHE B 18 9.380 -0.777 -14.299 1.00 0.00 H new ATOM 0 HA PHE B 18 8.476 -1.717 -11.592 1.00 0.00 H new ATOM 0 HB2 PHE B 18 6.858 -2.275 -13.331 1.00 0.00 H new ATOM 0 HB3 PHE B 18 8.119 -2.834 -14.412 1.00 0.00 H new ATOM 0 HD1 PHE B 18 6.242 -3.590 -11.313 1.00 0.00 H new ATOM 0 HD2 PHE B 18 9.220 -4.990 -14.071 1.00 0.00 H new ATOM 0 HE1 PHE B 18 6.111 -5.852 -10.306 1.00 0.00 H new ATOM 0 HE2 PHE B 18 9.100 -7.248 -13.057 1.00 0.00 H new ATOM 0 HZ PHE B 18 7.545 -7.681 -11.173 1.00 0.00 H new ATOM 1340 N ASP B 19 10.604 -2.961 -11.260 1.00 0.00 N ATOM 1341 CA ASP B 19 11.855 -3.746 -11.030 1.00 0.00 C ATOM 1342 C ASP B 19 11.571 -4.780 -9.925 1.00 0.00 C ATOM 1343 O ASP B 19 10.741 -4.550 -9.070 1.00 0.00 O ATOM 1344 CB ASP B 19 12.993 -2.796 -10.595 1.00 0.00 C ATOM 1345 CG ASP B 19 12.750 -1.401 -11.180 1.00 0.00 C ATOM 1346 OD1 ASP B 19 13.026 -1.214 -12.354 1.00 0.00 O ATOM 1347 OD2 ASP B 19 12.291 -0.545 -10.443 1.00 0.00 O ATOM 0 H ASP B 19 10.148 -2.628 -10.411 1.00 0.00 H new ATOM 0 HA ASP B 19 12.163 -4.253 -11.944 1.00 0.00 H new ATOM 0 HB2 ASP B 19 13.040 -2.742 -9.507 1.00 0.00 H new ATOM 0 HB3 ASP B 19 13.953 -3.182 -10.936 1.00 0.00 H new ATOM 1352 N PRO B 20 12.245 -5.902 -9.936 1.00 0.00 N ATOM 1353 CA PRO B 20 12.045 -6.964 -8.904 1.00 0.00 C ATOM 1354 C PRO B 20 12.615 -6.545 -7.545 1.00 0.00 C ATOM 1355 O PRO B 20 12.346 -7.157 -6.528 1.00 0.00 O ATOM 1356 CB PRO B 20 12.810 -8.169 -9.470 1.00 0.00 C ATOM 1357 CG PRO B 20 13.868 -7.571 -10.344 1.00 0.00 C ATOM 1358 CD PRO B 20 13.271 -6.284 -10.919 1.00 0.00 C ATOM 0 HA PRO B 20 10.991 -7.173 -8.723 1.00 0.00 H new ATOM 0 HB2 PRO B 20 13.248 -8.770 -8.673 1.00 0.00 H new ATOM 0 HB3 PRO B 20 12.151 -8.825 -10.039 1.00 0.00 H new ATOM 0 HG2 PRO B 20 14.771 -7.359 -9.772 1.00 0.00 H new ATOM 0 HG3 PRO B 20 14.149 -8.259 -11.141 1.00 0.00 H new ATOM 0 HD2 PRO B 20 14.027 -5.507 -11.030 1.00 0.00 H new ATOM 0 HD3 PRO B 20 12.838 -6.450 -11.905 1.00 0.00 H new ATOM 1366 N LYS B 21 13.406 -5.501 -7.525 1.00 0.00 N ATOM 1367 CA LYS B 21 14.011 -5.014 -6.246 1.00 0.00 C ATOM 1368 C LYS B 21 13.471 -3.616 -5.934 1.00 0.00 C ATOM 1369 O LYS B 21 13.809 -3.013 -4.934 1.00 0.00 O ATOM 1370 CB LYS B 21 15.531 -4.962 -6.404 1.00 0.00 C ATOM 1371 CG LYS B 21 16.066 -6.383 -6.611 1.00 0.00 C ATOM 1372 CD LYS B 21 17.599 -6.373 -6.571 1.00 0.00 C ATOM 1373 CE LYS B 21 18.158 -5.666 -7.810 1.00 0.00 C ATOM 1374 NZ LYS B 21 19.604 -5.992 -7.958 1.00 0.00 N ATOM 0 H LYS B 21 13.661 -4.959 -8.350 1.00 0.00 H new ATOM 0 HA LYS B 21 13.754 -5.688 -5.429 1.00 0.00 H new ATOM 0 HB2 LYS B 21 15.799 -4.333 -7.253 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.985 -4.515 -5.520 1.00 0.00 H new ATOM 0 HG2 LYS B 21 15.677 -7.044 -5.836 1.00 0.00 H new ATOM 0 HG3 LYS B 21 15.721 -6.775 -7.567 1.00 0.00 H new ATOM 0 HD2 LYS B 21 17.943 -5.867 -5.669 1.00 0.00 H new ATOM 0 HD3 LYS B 21 17.975 -7.395 -6.526 1.00 0.00 H new ATOM 0 HE2 LYS B 21 17.611 -5.980 -8.699 1.00 0.00 H new ATOM 0 HE3 LYS B 21 18.025 -4.588 -7.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 19.984 -5.512 -8.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 20.120 -5.672 -7.114 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 19.719 -7.020 -8.065 1.00 0.00 H new ATOM 1388 N GLU B 22 12.628 -3.098 -6.782 1.00 0.00 N ATOM 1389 CA GLU B 22 12.060 -1.742 -6.530 1.00 0.00 C ATOM 1390 C GLU B 22 10.926 -1.483 -7.522 1.00 0.00 C ATOM 1391 O GLU B 22 11.019 -1.823 -8.686 1.00 0.00 O ATOM 1392 CB GLU B 22 13.153 -0.673 -6.700 1.00 0.00 C ATOM 1393 CG GLU B 22 12.523 0.743 -6.762 1.00 0.00 C ATOM 1394 CD GLU B 22 12.297 1.160 -8.222 1.00 0.00 C ATOM 1395 OE1 GLU B 22 13.235 1.655 -8.826 1.00 0.00 O ATOM 1396 OE2 GLU B 22 11.196 0.974 -8.709 1.00 0.00 O ATOM 0 H GLU B 22 12.307 -3.552 -7.637 1.00 0.00 H new ATOM 0 HA GLU B 22 11.676 -1.693 -5.511 1.00 0.00 H new ATOM 0 HB2 GLU B 22 13.856 -0.728 -5.869 1.00 0.00 H new ATOM 0 HB3 GLU B 22 13.720 -0.866 -7.611 1.00 0.00 H new ATOM 0 HG2 GLU B 22 11.576 0.751 -6.223 1.00 0.00 H new ATOM 0 HG3 GLU B 22 13.177 1.462 -6.268 1.00 0.00 H new ATOM 1403 N ILE B 23 9.848 -0.890 -7.069 1.00 0.00 N ATOM 1404 CA ILE B 23 8.691 -0.612 -7.983 1.00 0.00 C ATOM 1405 C ILE B 23 8.229 0.837 -7.828 1.00 0.00 C ATOM 1406 O ILE B 23 8.018 1.323 -6.734 1.00 0.00 O ATOM 1407 CB ILE B 23 7.540 -1.557 -7.646 1.00 0.00 C ATOM 1408 CG1 ILE B 23 7.967 -2.991 -7.967 1.00 0.00 C ATOM 1409 CG2 ILE B 23 6.310 -1.186 -8.479 1.00 0.00 C ATOM 1410 CD1 ILE B 23 6.945 -3.979 -7.398 1.00 0.00 C ATOM 0 H ILE B 23 9.717 -0.585 -6.104 1.00 0.00 H new ATOM 0 HA ILE B 23 9.006 -0.771 -9.014 1.00 0.00 H new ATOM 0 HB ILE B 23 7.291 -1.475 -6.588 1.00 0.00 H new ATOM 0 HG12 ILE B 23 8.051 -3.122 -9.046 1.00 0.00 H new ATOM 0 HG13 ILE B 23 8.952 -3.190 -7.545 1.00 0.00 H new ATOM 0 HG21 ILE B 23 5.490 -1.862 -8.237 1.00 0.00 H new ATOM 0 HG22 ILE B 23 6.014 -0.161 -8.255 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.549 -1.271 -9.539 1.00 0.00 H new ATOM 0 HD11 ILE B 23 7.255 -4.998 -7.630 1.00 0.00 H new ATOM 0 HD12 ILE B 23 6.883 -3.856 -6.317 1.00 0.00 H new ATOM 0 HD13 ILE B 23 5.968 -3.787 -7.841 1.00 0.00 H new ATOM 1422 N LEU B 24 8.068 1.528 -8.932 1.00 0.00 N ATOM 1423 CA LEU B 24 7.613 2.954 -8.889 1.00 0.00 C ATOM 1424 C LEU B 24 6.335 3.105 -9.697 1.00 0.00 C ATOM 1425 O LEU B 24 6.282 2.781 -10.868 1.00 0.00 O ATOM 1426 CB LEU B 24 8.704 3.847 -9.485 1.00 0.00 C ATOM 1427 CG LEU B 24 9.920 3.880 -8.537 1.00 0.00 C ATOM 1428 CD1 LEU B 24 11.186 4.216 -9.327 1.00 0.00 C ATOM 1429 CD2 LEU B 24 9.707 4.951 -7.459 1.00 0.00 C ATOM 0 H LEU B 24 8.234 1.161 -9.869 1.00 0.00 H new ATOM 0 HA LEU B 24 7.422 3.247 -7.857 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.003 3.470 -10.463 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.320 4.856 -9.636 1.00 0.00 H new ATOM 0 HG LEU B 24 10.029 2.902 -8.069 1.00 0.00 H new ATOM 0 HD11 LEU B 24 12.041 4.238 -8.652 1.00 0.00 H new ATOM 0 HD12 LEU B 24 11.348 3.458 -10.094 1.00 0.00 H new ATOM 0 HD13 LEU B 24 11.072 5.192 -9.799 1.00 0.00 H new ATOM 0 HD21 LEU B 24 10.568 4.971 -6.791 1.00 0.00 H new ATOM 0 HD22 LEU B 24 9.592 5.926 -7.933 1.00 0.00 H new ATOM 0 HD23 LEU B 24 8.809 4.718 -6.887 1.00 0.00 H new ATOM 1441 N LEU B 25 5.297 3.596 -9.073 1.00 0.00 N ATOM 1442 CA LEU B 25 3.998 3.776 -9.786 1.00 0.00 C ATOM 1443 C LEU B 25 3.439 5.165 -9.513 1.00 0.00 C ATOM 1444 O LEU B 25 3.372 5.610 -8.383 1.00 0.00 O ATOM 1445 CB LEU B 25 3.001 2.731 -9.285 1.00 0.00 C ATOM 1446 CG LEU B 25 3.508 1.326 -9.631 1.00 0.00 C ATOM 1447 CD1 LEU B 25 2.599 0.287 -8.974 1.00 0.00 C ATOM 1448 CD2 LEU B 25 3.514 1.121 -11.159 1.00 0.00 C ATOM 0 H LEU B 25 5.293 3.882 -8.094 1.00 0.00 H new ATOM 0 HA LEU B 25 4.160 3.658 -10.857 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.871 2.826 -8.207 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.025 2.898 -9.740 1.00 0.00 H new ATOM 0 HG LEU B 25 4.526 1.211 -9.260 1.00 0.00 H new ATOM 0 HD11 LEU B 25 2.955 -0.714 -9.217 1.00 0.00 H new ATOM 0 HD12 LEU B 25 2.612 0.424 -7.893 1.00 0.00 H new ATOM 0 HD13 LEU B 25 1.581 0.409 -9.343 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.876 0.119 -11.390 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.502 1.239 -11.546 1.00 0.00 H new ATOM 0 HD23 LEU B 25 4.168 1.859 -11.623 1.00 0.00 H new ATOM 1460 N GLU B 26 3.014 5.849 -10.540 1.00 0.00 N ATOM 1461 CA GLU B 26 2.431 7.201 -10.343 1.00 0.00 C ATOM 1462 C GLU B 26 0.935 7.029 -10.106 1.00 0.00 C ATOM 1463 O GLU B 26 0.234 6.461 -10.928 1.00 0.00 O ATOM 1464 CB GLU B 26 2.649 8.039 -11.599 1.00 0.00 C ATOM 1465 CG GLU B 26 2.318 9.497 -11.298 1.00 0.00 C ATOM 1466 CD GLU B 26 2.602 10.357 -12.532 1.00 0.00 C ATOM 1467 OE1 GLU B 26 2.197 9.960 -13.615 1.00 0.00 O ATOM 1468 OE2 GLU B 26 3.217 11.397 -12.376 1.00 0.00 O ATOM 0 H GLU B 26 3.047 5.527 -11.507 1.00 0.00 H new ATOM 0 HA GLU B 26 2.902 7.702 -9.497 1.00 0.00 H new ATOM 0 HB2 GLU B 26 3.683 7.951 -11.934 1.00 0.00 H new ATOM 0 HB3 GLU B 26 2.019 7.671 -12.409 1.00 0.00 H new ATOM 0 HG2 GLU B 26 1.271 9.590 -11.011 1.00 0.00 H new ATOM 0 HG3 GLU B 26 2.912 9.848 -10.454 1.00 0.00 H new ATOM 1475 N THR B 27 0.444 7.495 -8.983 1.00 0.00 N ATOM 1476 CA THR B 27 -1.012 7.348 -8.669 1.00 0.00 C ATOM 1477 C THR B 27 -1.626 8.712 -8.367 1.00 0.00 C ATOM 1478 O THR B 27 -0.952 9.633 -7.953 1.00 0.00 O ATOM 1479 CB THR B 27 -1.188 6.425 -7.458 1.00 0.00 C ATOM 1480 OG1 THR B 27 -2.570 6.324 -7.143 1.00 0.00 O ATOM 1481 CG2 THR B 27 -0.432 6.985 -6.253 1.00 0.00 C ATOM 0 H THR B 27 0.992 7.973 -8.267 1.00 0.00 H new ATOM 0 HA THR B 27 -1.518 6.915 -9.532 1.00 0.00 H new ATOM 0 HB THR B 27 -0.789 5.440 -7.699 1.00 0.00 H new ATOM 0 HG1 THR B 27 -2.687 5.733 -6.370 1.00 0.00 H new ATOM 0 HG21 THR B 27 -0.565 6.320 -5.399 1.00 0.00 H new ATOM 0 HG22 THR B 27 0.629 7.061 -6.492 1.00 0.00 H new ATOM 0 HG23 THR B 27 -0.820 7.973 -6.007 1.00 0.00 H new ATOM 1489 N ILE B 28 -2.916 8.817 -8.578 1.00 0.00 N ATOM 1490 CA ILE B 28 -3.673 10.086 -8.329 1.00 0.00 C ATOM 1491 C ILE B 28 -2.791 11.325 -8.558 1.00 0.00 C ATOM 1492 O ILE B 28 -2.802 11.917 -9.618 1.00 0.00 O ATOM 1493 CB ILE B 28 -4.213 10.090 -6.895 1.00 0.00 C ATOM 1494 CG1 ILE B 28 -4.908 8.754 -6.608 1.00 0.00 C ATOM 1495 CG2 ILE B 28 -5.216 11.233 -6.729 1.00 0.00 C ATOM 1496 CD1 ILE B 28 -5.975 8.459 -7.675 1.00 0.00 C ATOM 0 H ILE B 28 -3.494 8.051 -8.924 1.00 0.00 H new ATOM 0 HA ILE B 28 -4.501 10.130 -9.037 1.00 0.00 H new ATOM 0 HB ILE B 28 -3.388 10.228 -6.197 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -4.171 7.951 -6.591 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -5.371 8.783 -5.622 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.600 11.235 -5.709 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -4.722 12.183 -6.933 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -6.042 11.096 -7.427 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -6.457 7.507 -7.454 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -6.722 9.253 -7.672 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -5.504 8.408 -8.656 1.00 0.00 H new ATOM 1508 N GLN B 29 -2.033 11.727 -7.574 1.00 0.00 N ATOM 1509 CA GLN B 29 -1.163 12.925 -7.742 1.00 0.00 C ATOM 1510 C GLN B 29 0.118 12.736 -6.923 1.00 0.00 C ATOM 1511 O GLN B 29 0.537 13.608 -6.187 1.00 0.00 O ATOM 1512 CB GLN B 29 -1.924 14.176 -7.274 1.00 0.00 C ATOM 1513 CG GLN B 29 -2.402 13.991 -5.830 1.00 0.00 C ATOM 1514 CD GLN B 29 -3.238 15.204 -5.413 1.00 0.00 C ATOM 1515 OE1 GLN B 29 -3.010 16.304 -5.879 1.00 0.00 O ATOM 1516 NE2 GLN B 29 -4.203 15.052 -4.546 1.00 0.00 N ATOM 0 H GLN B 29 -1.979 11.277 -6.660 1.00 0.00 H new ATOM 0 HA GLN B 29 -0.895 13.050 -8.791 1.00 0.00 H new ATOM 0 HB2 GLN B 29 -1.278 15.051 -7.342 1.00 0.00 H new ATOM 0 HB3 GLN B 29 -2.777 14.358 -7.927 1.00 0.00 H new ATOM 0 HG2 GLN B 29 -2.995 13.080 -5.745 1.00 0.00 H new ATOM 0 HG3 GLN B 29 -1.547 13.878 -5.164 1.00 0.00 H new ATOM 0 HE21 GLN B 29 -4.396 14.130 -4.154 1.00 0.00 H new ATOM 0 HE22 GLN B 29 -4.764 15.855 -4.261 1.00 0.00 H new ATOM 1525 N GLY B 30 0.750 11.600 -7.057 1.00 0.00 N ATOM 1526 CA GLY B 30 2.008 11.348 -6.294 1.00 0.00 C ATOM 1527 C GLY B 30 2.600 10.006 -6.727 1.00 0.00 C ATOM 1528 O GLY B 30 1.956 9.227 -7.403 1.00 0.00 O ATOM 0 H GLY B 30 0.450 10.836 -7.662 1.00 0.00 H new ATOM 0 HA2 GLY B 30 2.724 12.150 -6.475 1.00 0.00 H new ATOM 0 HA3 GLY B 30 1.803 11.340 -5.224 1.00 0.00 H new ATOM 1532 N VAL B 31 3.831 9.734 -6.355 1.00 0.00 N ATOM 1533 CA VAL B 31 4.483 8.443 -6.755 1.00 0.00 C ATOM 1534 C VAL B 31 4.810 7.616 -5.520 1.00 0.00 C ATOM 1535 O VAL B 31 5.342 8.103 -4.541 1.00 0.00 O ATOM 1536 CB VAL B 31 5.779 8.720 -7.528 1.00 0.00 C ATOM 1537 CG1 VAL B 31 6.555 7.406 -7.719 1.00 0.00 C ATOM 1538 CG2 VAL B 31 5.435 9.312 -8.896 1.00 0.00 C ATOM 0 H VAL B 31 4.413 10.352 -5.790 1.00 0.00 H new ATOM 0 HA VAL B 31 3.790 7.892 -7.391 1.00 0.00 H new ATOM 0 HB VAL B 31 6.394 9.425 -6.968 1.00 0.00 H new ATOM 0 HG11 VAL B 31 7.476 7.604 -8.268 1.00 0.00 H new ATOM 0 HG12 VAL B 31 6.798 6.982 -6.745 1.00 0.00 H new ATOM 0 HG13 VAL B 31 5.942 6.700 -8.280 1.00 0.00 H new ATOM 0 HG21 VAL B 31 6.354 9.510 -9.448 1.00 0.00 H new ATOM 0 HG22 VAL B 31 4.821 8.605 -9.454 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.885 10.243 -8.762 1.00 0.00 H new ATOM 1548 N LEU B 32 4.500 6.351 -5.579 1.00 0.00 N ATOM 1549 CA LEU B 32 4.785 5.437 -4.439 1.00 0.00 C ATOM 1550 C LEU B 32 5.971 4.551 -4.809 1.00 0.00 C ATOM 1551 O LEU B 32 5.973 3.892 -5.833 1.00 0.00 O ATOM 1552 CB LEU B 32 3.551 4.570 -4.175 1.00 0.00 C ATOM 1553 CG LEU B 32 3.849 3.538 -3.076 1.00 0.00 C ATOM 1554 CD1 LEU B 32 4.312 4.251 -1.795 1.00 0.00 C ATOM 1555 CD2 LEU B 32 2.578 2.732 -2.789 1.00 0.00 C ATOM 0 H LEU B 32 4.055 5.906 -6.381 1.00 0.00 H new ATOM 0 HA LEU B 32 5.021 6.009 -3.542 1.00 0.00 H new ATOM 0 HB2 LEU B 32 2.713 5.200 -3.875 1.00 0.00 H new ATOM 0 HB3 LEU B 32 3.254 4.060 -5.091 1.00 0.00 H new ATOM 0 HG LEU B 32 4.642 2.869 -3.411 1.00 0.00 H new ATOM 0 HD11 LEU B 32 4.521 3.511 -1.022 1.00 0.00 H new ATOM 0 HD12 LEU B 32 5.216 4.823 -2.003 1.00 0.00 H new ATOM 0 HD13 LEU B 32 3.528 4.925 -1.450 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.781 1.997 -2.010 1.00 0.00 H new ATOM 0 HD22 LEU B 32 1.788 3.405 -2.456 1.00 0.00 H new ATOM 0 HD23 LEU B 32 2.259 2.220 -3.697 1.00 0.00 H new ATOM 1567 N SER B 33 6.985 4.537 -3.977 1.00 0.00 N ATOM 1568 CA SER B 33 8.192 3.701 -4.258 1.00 0.00 C ATOM 1569 C SER B 33 8.267 2.567 -3.243 1.00 0.00 C ATOM 1570 O SER B 33 8.213 2.779 -2.044 1.00 0.00 O ATOM 1571 CB SER B 33 9.442 4.567 -4.151 1.00 0.00 C ATOM 1572 OG SER B 33 10.563 3.830 -4.621 1.00 0.00 O ATOM 0 H SER B 33 7.027 5.073 -3.110 1.00 0.00 H new ATOM 0 HA SER B 33 8.125 3.284 -5.263 1.00 0.00 H new ATOM 0 HB2 SER B 33 9.319 5.478 -4.737 1.00 0.00 H new ATOM 0 HB3 SER B 33 9.600 4.872 -3.117 1.00 0.00 H new ATOM 0 HG SER B 33 11.369 4.384 -4.556 1.00 0.00 H new ATOM 1578 N ILE B 34 8.390 1.356 -3.723 1.00 0.00 N ATOM 1579 CA ILE B 34 8.461 0.175 -2.814 1.00 0.00 C ATOM 1580 C ILE B 34 9.890 -0.358 -2.787 1.00 0.00 C ATOM 1581 O ILE B 34 10.512 -0.557 -3.815 1.00 0.00 O ATOM 1582 CB ILE B 34 7.530 -0.919 -3.328 1.00 0.00 C ATOM 1583 CG1 ILE B 34 6.104 -0.367 -3.395 1.00 0.00 C ATOM 1584 CG2 ILE B 34 7.574 -2.107 -2.368 1.00 0.00 C ATOM 1585 CD1 ILE B 34 5.186 -1.384 -4.076 1.00 0.00 C ATOM 0 H ILE B 34 8.445 1.134 -4.717 1.00 0.00 H new ATOM 0 HA ILE B 34 8.159 0.472 -1.810 1.00 0.00 H new ATOM 0 HB ILE B 34 7.845 -1.242 -4.320 1.00 0.00 H new ATOM 0 HG12 ILE B 34 5.740 -0.151 -2.390 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.094 0.573 -3.947 1.00 0.00 H new ATOM 0 HG21 ILE B 34 6.910 -2.892 -2.730 1.00 0.00 H new ATOM 0 HG22 ILE B 34 8.593 -2.491 -2.310 1.00 0.00 H new ATOM 0 HG23 ILE B 34 7.250 -1.787 -1.378 1.00 0.00 H new ATOM 0 HD11 ILE B 34 4.172 -0.986 -4.121 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.545 -1.578 -5.087 1.00 0.00 H new ATOM 0 HD13 ILE B 34 5.186 -2.313 -3.506 1.00 0.00 H new ATOM 1597 N LYS B 35 10.410 -0.585 -1.604 1.00 0.00 N ATOM 1598 CA LYS B 35 11.806 -1.104 -1.461 1.00 0.00 C ATOM 1599 C LYS B 35 11.787 -2.398 -0.653 1.00 0.00 C ATOM 1600 O LYS B 35 11.036 -2.547 0.294 1.00 0.00 O ATOM 1601 CB LYS B 35 12.653 -0.069 -0.721 1.00 0.00 C ATOM 1602 CG LYS B 35 12.826 1.171 -1.600 1.00 0.00 C ATOM 1603 CD LYS B 35 13.686 2.201 -0.863 1.00 0.00 C ATOM 1604 CE LYS B 35 13.911 3.417 -1.761 1.00 0.00 C ATOM 1605 NZ LYS B 35 12.604 4.071 -2.053 1.00 0.00 N ATOM 0 H LYS B 35 9.920 -0.431 -0.723 1.00 0.00 H new ATOM 0 HA LYS B 35 12.227 -1.293 -2.449 1.00 0.00 H new ATOM 0 HB2 LYS B 35 12.174 0.203 0.220 1.00 0.00 H new ATOM 0 HB3 LYS B 35 13.627 -0.491 -0.473 1.00 0.00 H new ATOM 0 HG2 LYS B 35 13.296 0.898 -2.545 1.00 0.00 H new ATOM 0 HG3 LYS B 35 11.853 1.599 -1.840 1.00 0.00 H new ATOM 0 HD2 LYS B 35 13.195 2.505 0.062 1.00 0.00 H new ATOM 0 HD3 LYS B 35 14.643 1.759 -0.586 1.00 0.00 H new ATOM 0 HE2 LYS B 35 14.582 4.124 -1.272 1.00 0.00 H new ATOM 0 HE3 LYS B 35 14.392 3.112 -2.690 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 12.755 5.085 -2.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 12.177 3.634 -2.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 11.967 3.951 -1.240 1.00 0.00 H new ATOM 1619 N GLY B 36 12.613 -3.336 -1.021 1.00 0.00 N ATOM 1620 CA GLY B 36 12.658 -4.629 -0.281 1.00 0.00 C ATOM 1621 C GLY B 36 13.240 -5.711 -1.190 1.00 0.00 C ATOM 1622 O GLY B 36 14.073 -5.446 -2.034 1.00 0.00 O ATOM 0 H GLY B 36 13.262 -3.264 -1.805 1.00 0.00 H new ATOM 0 HA2 GLY B 36 13.267 -4.526 0.617 1.00 0.00 H new ATOM 0 HA3 GLY B 36 11.656 -4.911 0.044 1.00 0.00 H new ATOM 1626 N GLU B 37 12.808 -6.938 -1.015 1.00 0.00 N ATOM 1627 CA GLU B 37 13.334 -8.060 -1.858 1.00 0.00 C ATOM 1628 C GLU B 37 12.172 -8.879 -2.426 1.00 0.00 C ATOM 1629 O GLU B 37 11.128 -9.015 -1.819 1.00 0.00 O ATOM 1630 CB GLU B 37 14.215 -8.970 -0.996 1.00 0.00 C ATOM 1631 CG GLU B 37 15.434 -8.191 -0.490 1.00 0.00 C ATOM 1632 CD GLU B 37 16.284 -7.726 -1.676 1.00 0.00 C ATOM 1633 OE1 GLU B 37 16.555 -8.542 -2.542 1.00 0.00 O ATOM 1634 OE2 GLU B 37 16.640 -6.559 -1.702 1.00 0.00 O ATOM 0 H GLU B 37 12.111 -7.212 -0.322 1.00 0.00 H new ATOM 0 HA GLU B 37 13.917 -7.645 -2.680 1.00 0.00 H new ATOM 0 HB2 GLU B 37 13.641 -9.352 -0.152 1.00 0.00 H new ATOM 0 HB3 GLU B 37 14.540 -9.833 -1.578 1.00 0.00 H new ATOM 0 HG2 GLU B 37 15.109 -7.331 0.096 1.00 0.00 H new ATOM 0 HG3 GLU B 37 16.030 -8.820 0.171 1.00 0.00 H new ATOM 1641 N LYS B 38 12.367 -9.417 -3.602 1.00 0.00 N ATOM 1642 CA LYS B 38 11.310 -10.235 -4.270 1.00 0.00 C ATOM 1643 C LYS B 38 10.069 -9.372 -4.505 1.00 0.00 C ATOM 1644 O LYS B 38 8.963 -9.731 -4.152 1.00 0.00 O ATOM 1645 CB LYS B 38 10.953 -11.449 -3.404 1.00 0.00 C ATOM 1646 CG LYS B 38 12.231 -12.200 -3.010 1.00 0.00 C ATOM 1647 CD LYS B 38 12.898 -12.802 -4.254 1.00 0.00 C ATOM 1648 CE LYS B 38 13.941 -13.834 -3.827 1.00 0.00 C ATOM 1649 NZ LYS B 38 14.494 -14.505 -5.037 1.00 0.00 N ATOM 0 H LYS B 38 13.230 -9.322 -4.137 1.00 0.00 H new ATOM 0 HA LYS B 38 11.686 -10.592 -5.229 1.00 0.00 H new ATOM 0 HB2 LYS B 38 10.420 -11.125 -2.510 1.00 0.00 H new ATOM 0 HB3 LYS B 38 10.284 -12.113 -3.951 1.00 0.00 H new ATOM 0 HG2 LYS B 38 12.922 -11.520 -2.511 1.00 0.00 H new ATOM 0 HG3 LYS B 38 11.992 -12.990 -2.298 1.00 0.00 H new ATOM 0 HD2 LYS B 38 12.148 -13.270 -4.891 1.00 0.00 H new ATOM 0 HD3 LYS B 38 13.370 -12.015 -4.843 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.741 -13.349 -3.268 1.00 0.00 H new ATOM 0 HE3 LYS B 38 13.490 -14.571 -3.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 15.204 -15.208 -4.750 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 13.726 -14.980 -5.552 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 14.939 -13.796 -5.654 1.00 0.00 H new ATOM 1663 N LEU B 39 10.249 -8.234 -5.117 1.00 0.00 N ATOM 1664 CA LEU B 39 9.096 -7.331 -5.401 1.00 0.00 C ATOM 1665 C LEU B 39 8.529 -7.655 -6.786 1.00 0.00 C ATOM 1666 O LEU B 39 8.691 -6.907 -7.731 1.00 0.00 O ATOM 1667 CB LEU B 39 9.576 -5.874 -5.358 1.00 0.00 C ATOM 1668 CG LEU B 39 9.700 -5.416 -3.899 1.00 0.00 C ATOM 1669 CD1 LEU B 39 10.550 -6.417 -3.113 1.00 0.00 C ATOM 1670 CD2 LEU B 39 10.366 -4.039 -3.848 1.00 0.00 C ATOM 0 H LEU B 39 11.154 -7.887 -5.436 1.00 0.00 H new ATOM 0 HA LEU B 39 8.316 -7.475 -4.653 1.00 0.00 H new ATOM 0 HB2 LEU B 39 10.538 -5.783 -5.861 1.00 0.00 H new ATOM 0 HB3 LEU B 39 8.874 -5.233 -5.892 1.00 0.00 H new ATOM 0 HG LEU B 39 8.705 -5.358 -3.457 1.00 0.00 H new ATOM 0 HD11 LEU B 39 10.635 -6.088 -2.077 1.00 0.00 H new ATOM 0 HD12 LEU B 39 10.077 -7.399 -3.144 1.00 0.00 H new ATOM 0 HD13 LEU B 39 11.543 -6.478 -3.557 1.00 0.00 H new ATOM 0 HD21 LEU B 39 10.453 -3.715 -2.811 1.00 0.00 H new ATOM 0 HD22 LEU B 39 11.359 -4.098 -4.294 1.00 0.00 H new ATOM 0 HD23 LEU B 39 9.761 -3.321 -4.402 1.00 0.00 H new ATOM 1682 N GLY B 40 7.867 -8.774 -6.913 1.00 0.00 N ATOM 1683 CA GLY B 40 7.292 -9.155 -8.235 1.00 0.00 C ATOM 1684 C GLY B 40 6.691 -10.558 -8.150 1.00 0.00 C ATOM 1685 O GLY B 40 5.739 -10.800 -7.426 1.00 0.00 O ATOM 0 H GLY B 40 7.700 -9.440 -6.159 1.00 0.00 H new ATOM 0 HA2 GLY B 40 6.526 -8.438 -8.529 1.00 0.00 H new ATOM 0 HA3 GLY B 40 8.067 -9.126 -9.001 1.00 0.00 H new ATOM 1764 N VAL B 51 -3.871 -5.478 -10.467 1.00 0.00 N ATOM 1765 CA VAL B 51 -2.492 -6.048 -10.495 1.00 0.00 C ATOM 1766 C VAL B 51 -2.103 -6.472 -9.078 1.00 0.00 C ATOM 1767 O VAL B 51 -2.424 -5.806 -8.109 1.00 0.00 O ATOM 1768 CB VAL B 51 -1.508 -4.995 -11.013 1.00 0.00 C ATOM 1769 CG1 VAL B 51 -1.289 -3.909 -9.950 1.00 0.00 C ATOM 1770 CG2 VAL B 51 -0.173 -5.673 -11.330 1.00 0.00 C ATOM 0 HA VAL B 51 -2.462 -6.913 -11.158 1.00 0.00 H new ATOM 0 HB VAL B 51 -1.915 -4.533 -11.912 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -0.588 -3.165 -10.329 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -2.240 -3.428 -9.721 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -0.884 -4.362 -9.045 1.00 0.00 H new ATOM 0 HG21 VAL B 51 0.534 -4.930 -11.700 1.00 0.00 H new ATOM 0 HG22 VAL B 51 0.225 -6.134 -10.426 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -0.325 -6.439 -12.091 1.00 0.00 H new ATOM 1780 N GLU B 52 -1.415 -7.579 -8.956 1.00 0.00 N ATOM 1781 CA GLU B 52 -0.988 -8.082 -7.614 1.00 0.00 C ATOM 1782 C GLU B 52 0.534 -8.129 -7.547 1.00 0.00 C ATOM 1783 O GLU B 52 1.192 -8.563 -8.471 1.00 0.00 O ATOM 1784 CB GLU B 52 -1.526 -9.497 -7.406 1.00 0.00 C ATOM 1785 CG GLU B 52 -3.039 -9.442 -7.201 1.00 0.00 C ATOM 1786 CD GLU B 52 -3.594 -10.866 -7.145 1.00 0.00 C ATOM 1787 OE1 GLU B 52 -3.250 -11.649 -8.015 1.00 0.00 O ATOM 1788 OE2 GLU B 52 -4.363 -11.145 -6.240 1.00 0.00 O ATOM 0 H GLU B 52 -1.127 -8.164 -9.740 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.376 -7.416 -6.844 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -1.288 -10.119 -8.269 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -1.048 -9.956 -6.541 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -3.273 -8.912 -6.278 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -3.508 -8.888 -8.015 1.00 0.00 H new ATOM 1795 N VAL B 53 1.097 -7.696 -6.450 1.00 0.00 N ATOM 1796 CA VAL B 53 2.583 -7.723 -6.296 1.00 0.00 C ATOM 1797 C VAL B 53 2.918 -8.427 -4.990 1.00 0.00 C ATOM 1798 O VAL B 53 2.345 -8.142 -3.958 1.00 0.00 O ATOM 1799 CB VAL B 53 3.132 -6.298 -6.277 1.00 0.00 C ATOM 1800 CG1 VAL B 53 4.612 -6.324 -5.876 1.00 0.00 C ATOM 1801 CG2 VAL B 53 2.988 -5.693 -7.675 1.00 0.00 C ATOM 0 H VAL B 53 0.589 -7.322 -5.649 1.00 0.00 H new ATOM 0 HA VAL B 53 3.035 -8.255 -7.133 1.00 0.00 H new ATOM 0 HB VAL B 53 2.578 -5.697 -5.556 1.00 0.00 H new ATOM 0 HG11 VAL B 53 5.003 -5.307 -5.863 1.00 0.00 H new ATOM 0 HG12 VAL B 53 4.713 -6.765 -4.884 1.00 0.00 H new ATOM 0 HG13 VAL B 53 5.174 -6.919 -6.596 1.00 0.00 H new ATOM 0 HG21 VAL B 53 3.377 -4.675 -7.673 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.548 -6.294 -8.391 1.00 0.00 H new ATOM 0 HG23 VAL B 53 1.936 -5.678 -7.959 1.00 0.00 H new ATOM 1811 N GLU B 54 3.840 -9.357 -5.031 1.00 0.00 N ATOM 1812 CA GLU B 54 4.211 -10.112 -3.798 1.00 0.00 C ATOM 1813 C GLU B 54 5.662 -9.832 -3.426 1.00 0.00 C ATOM 1814 O GLU B 54 6.518 -9.652 -4.271 1.00 0.00 O ATOM 1815 CB GLU B 54 4.031 -11.611 -4.069 1.00 0.00 C ATOM 1816 CG GLU B 54 2.728 -11.847 -4.867 1.00 0.00 C ATOM 1817 CD GLU B 54 3.027 -11.864 -6.371 1.00 0.00 C ATOM 1818 OE1 GLU B 54 3.425 -10.835 -6.892 1.00 0.00 O ATOM 1819 OE2 GLU B 54 2.856 -12.910 -6.975 1.00 0.00 O ATOM 0 H GLU B 54 4.353 -9.626 -5.871 1.00 0.00 H new ATOM 0 HA GLU B 54 3.573 -9.799 -2.972 1.00 0.00 H new ATOM 0 HB2 GLU B 54 4.885 -11.994 -4.628 1.00 0.00 H new ATOM 0 HB3 GLU B 54 3.995 -12.158 -3.127 1.00 0.00 H new ATOM 0 HG2 GLU B 54 2.275 -12.792 -4.568 1.00 0.00 H new ATOM 0 HG3 GLU B 54 2.006 -11.062 -4.641 1.00 0.00 H new ATOM 1826 N GLY B 55 5.940 -9.801 -2.157 1.00 0.00 N ATOM 1827 CA GLY B 55 7.329 -9.545 -1.702 1.00 0.00 C ATOM 1828 C GLY B 55 7.306 -9.011 -0.273 1.00 0.00 C ATOM 1829 O GLY B 55 6.265 -8.682 0.268 1.00 0.00 O ATOM 0 H GLY B 55 5.260 -9.943 -1.410 1.00 0.00 H new ATOM 0 HA2 GLY B 55 7.914 -10.464 -1.749 1.00 0.00 H new ATOM 0 HA3 GLY B 55 7.813 -8.826 -2.363 1.00 0.00 H new ATOM 1833 N LEU B 56 8.453 -8.920 0.342 1.00 0.00 N ATOM 1834 CA LEU B 56 8.530 -8.406 1.738 1.00 0.00 C ATOM 1835 C LEU B 56 8.912 -6.927 1.702 1.00 0.00 C ATOM 1836 O LEU B 56 10.018 -6.566 1.352 1.00 0.00 O ATOM 1837 CB LEU B 56 9.588 -9.196 2.525 1.00 0.00 C ATOM 1838 CG LEU B 56 10.843 -9.461 1.649 1.00 0.00 C ATOM 1839 CD1 LEU B 56 12.096 -9.462 2.535 1.00 0.00 C ATOM 1840 CD2 LEU B 56 10.736 -10.826 0.942 1.00 0.00 C ATOM 0 H LEU B 56 9.349 -9.183 -0.068 1.00 0.00 H new ATOM 0 HA LEU B 56 7.563 -8.525 2.227 1.00 0.00 H new ATOM 0 HB2 LEU B 56 9.873 -8.640 3.418 1.00 0.00 H new ATOM 0 HB3 LEU B 56 9.166 -10.144 2.860 1.00 0.00 H new ATOM 0 HG LEU B 56 10.910 -8.674 0.898 1.00 0.00 H new ATOM 0 HD11 LEU B 56 12.976 -9.648 1.920 1.00 0.00 H new ATOM 0 HD12 LEU B 56 12.195 -8.494 3.027 1.00 0.00 H new ATOM 0 HD13 LEU B 56 12.008 -10.245 3.289 1.00 0.00 H new ATOM 0 HD21 LEU B 56 11.625 -10.991 0.334 1.00 0.00 H new ATOM 0 HD22 LEU B 56 10.654 -11.617 1.688 1.00 0.00 H new ATOM 0 HD23 LEU B 56 9.853 -10.837 0.304 1.00 0.00 H new ATOM 1852 N ILE B 57 8.005 -6.064 2.056 1.00 0.00 N ATOM 1853 CA ILE B 57 8.323 -4.613 2.034 1.00 0.00 C ATOM 1854 C ILE B 57 9.199 -4.278 3.242 1.00 0.00 C ATOM 1855 O ILE B 57 8.825 -4.499 4.378 1.00 0.00 O ATOM 1856 CB ILE B 57 7.015 -3.814 2.090 1.00 0.00 C ATOM 1857 CG1 ILE B 57 6.304 -3.896 0.730 1.00 0.00 C ATOM 1858 CG2 ILE B 57 7.313 -2.346 2.413 1.00 0.00 C ATOM 1859 CD1 ILE B 57 5.773 -5.314 0.488 1.00 0.00 C ATOM 0 H ILE B 57 7.060 -6.300 2.359 1.00 0.00 H new ATOM 0 HA ILE B 57 8.859 -4.356 1.121 1.00 0.00 H new ATOM 0 HB ILE B 57 6.376 -4.233 2.867 1.00 0.00 H new ATOM 0 HG12 ILE B 57 5.481 -3.183 0.700 1.00 0.00 H new ATOM 0 HG13 ILE B 57 6.995 -3.619 -0.066 1.00 0.00 H new ATOM 0 HG21 ILE B 57 6.379 -1.785 2.451 1.00 0.00 H new ATOM 0 HG22 ILE B 57 7.815 -2.281 3.378 1.00 0.00 H new ATOM 0 HG23 ILE B 57 7.957 -1.927 1.640 1.00 0.00 H new ATOM 0 HD11 ILE B 57 5.272 -5.355 -0.479 1.00 0.00 H new ATOM 0 HD12 ILE B 57 6.603 -6.020 0.497 1.00 0.00 H new ATOM 0 HD13 ILE B 57 5.065 -5.577 1.274 1.00 0.00 H new ATOM 1871 N ASP B 58 10.362 -3.737 2.999 1.00 0.00 N ATOM 1872 CA ASP B 58 11.285 -3.366 4.110 1.00 0.00 C ATOM 1873 C ASP B 58 11.267 -1.844 4.291 1.00 0.00 C ATOM 1874 O ASP B 58 11.597 -1.326 5.342 1.00 0.00 O ATOM 1875 CB ASP B 58 12.698 -3.835 3.765 1.00 0.00 C ATOM 1876 CG ASP B 58 13.585 -3.729 5.004 1.00 0.00 C ATOM 1877 OD1 ASP B 58 13.418 -4.540 5.899 1.00 0.00 O ATOM 1878 OD2 ASP B 58 14.418 -2.836 5.038 1.00 0.00 O ATOM 0 H ASP B 58 10.717 -3.534 2.065 1.00 0.00 H new ATOM 0 HA ASP B 58 10.965 -3.842 5.037 1.00 0.00 H new ATOM 0 HB2 ASP B 58 12.674 -4.865 3.408 1.00 0.00 H new ATOM 0 HB3 ASP B 58 13.108 -3.228 2.958 1.00 0.00 H new ATOM 1883 N ALA B 59 10.886 -1.113 3.276 1.00 0.00 N ATOM 1884 CA ALA B 59 10.854 0.376 3.417 1.00 0.00 C ATOM 1885 C ALA B 59 9.969 1.002 2.336 1.00 0.00 C ATOM 1886 O ALA B 59 9.827 0.481 1.248 1.00 0.00 O ATOM 1887 CB ALA B 59 12.273 0.944 3.293 1.00 0.00 C ATOM 0 H ALA B 59 10.599 -1.475 2.367 1.00 0.00 H new ATOM 0 HA ALA B 59 10.444 0.616 4.398 1.00 0.00 H new ATOM 0 HB1 ALA B 59 12.241 2.029 3.397 1.00 0.00 H new ATOM 0 HB2 ALA B 59 12.903 0.523 4.076 1.00 0.00 H new ATOM 0 HB3 ALA B 59 12.685 0.685 2.318 1.00 0.00 H new ATOM 1893 N LEU B 60 9.372 2.133 2.637 1.00 0.00 N ATOM 1894 CA LEU B 60 8.486 2.826 1.645 1.00 0.00 C ATOM 1895 C LEU B 60 8.838 4.308 1.590 1.00 0.00 C ATOM 1896 O LEU B 60 9.222 4.902 2.577 1.00 0.00 O ATOM 1897 CB LEU B 60 7.022 2.666 2.075 1.00 0.00 C ATOM 1898 CG LEU B 60 6.508 1.267 1.690 1.00 0.00 C ATOM 1899 CD1 LEU B 60 5.307 0.900 2.568 1.00 0.00 C ATOM 1900 CD2 LEU B 60 6.064 1.252 0.217 1.00 0.00 C ATOM 0 H LEU B 60 9.462 2.609 3.535 1.00 0.00 H new ATOM 0 HA LEU B 60 8.630 2.384 0.659 1.00 0.00 H new ATOM 0 HB2 LEU B 60 6.933 2.811 3.152 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.409 3.431 1.598 1.00 0.00 H new ATOM 0 HG LEU B 60 7.314 0.547 1.837 1.00 0.00 H new ATOM 0 HD11 LEU B 60 4.945 -0.091 2.294 1.00 0.00 H new ATOM 0 HD12 LEU B 60 5.609 0.899 3.615 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.512 1.631 2.421 1.00 0.00 H new ATOM 0 HD21 LEU B 60 5.702 0.257 -0.044 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.265 1.979 0.070 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.910 1.509 -0.421 1.00 0.00 H new ATOM 1912 N VAL B 61 8.710 4.915 0.435 1.00 0.00 N ATOM 1913 CA VAL B 61 9.035 6.369 0.316 1.00 0.00 C ATOM 1914 C VAL B 61 7.980 7.080 -0.541 1.00 0.00 C ATOM 1915 O VAL B 61 7.842 6.823 -1.724 1.00 0.00 O ATOM 1916 CB VAL B 61 10.416 6.517 -0.329 1.00 0.00 C ATOM 1917 CG1 VAL B 61 10.668 7.982 -0.701 1.00 0.00 C ATOM 1918 CG2 VAL B 61 11.482 6.055 0.667 1.00 0.00 C ATOM 0 H VAL B 61 8.396 4.468 -0.426 1.00 0.00 H new ATOM 0 HA VAL B 61 9.039 6.823 1.307 1.00 0.00 H new ATOM 0 HB VAL B 61 10.460 5.909 -1.233 1.00 0.00 H new ATOM 0 HG11 VAL B 61 11.653 8.077 -1.159 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.906 8.315 -1.406 1.00 0.00 H new ATOM 0 HG13 VAL B 61 10.625 8.598 0.197 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.469 6.157 0.216 1.00 0.00 H new ATOM 0 HG22 VAL B 61 11.429 6.668 1.567 1.00 0.00 H new ATOM 0 HG23 VAL B 61 11.308 5.011 0.928 1.00 0.00 H new ATOM 1928 N TYR B 62 7.249 7.991 0.051 1.00 0.00 N ATOM 1929 CA TYR B 62 6.220 8.760 -0.706 1.00 0.00 C ATOM 1930 C TYR B 62 6.298 10.236 -0.257 1.00 0.00 C ATOM 1931 O TYR B 62 5.855 10.570 0.822 1.00 0.00 O ATOM 1932 CB TYR B 62 4.835 8.206 -0.378 1.00 0.00 C ATOM 1933 CG TYR B 62 3.778 9.008 -1.111 1.00 0.00 C ATOM 1934 CD1 TYR B 62 3.234 10.156 -0.525 1.00 0.00 C ATOM 1935 CD2 TYR B 62 3.333 8.595 -2.370 1.00 0.00 C ATOM 1936 CE1 TYR B 62 2.246 10.883 -1.196 1.00 0.00 C ATOM 1937 CE2 TYR B 62 2.348 9.322 -3.043 1.00 0.00 C ATOM 1938 CZ TYR B 62 1.804 10.467 -2.456 1.00 0.00 C ATOM 1939 OH TYR B 62 0.825 11.182 -3.115 1.00 0.00 O ATOM 0 H TYR B 62 7.324 8.236 1.038 1.00 0.00 H new ATOM 0 HA TYR B 62 6.396 8.678 -1.779 1.00 0.00 H new ATOM 0 HB2 TYR B 62 4.775 7.157 -0.667 1.00 0.00 H new ATOM 0 HB3 TYR B 62 4.660 8.251 0.697 1.00 0.00 H new ATOM 0 HD1 TYR B 62 3.577 10.481 0.446 1.00 0.00 H new ATOM 0 HD2 TYR B 62 3.753 7.710 -2.825 1.00 0.00 H new ATOM 0 HE1 TYR B 62 1.824 11.767 -0.741 1.00 0.00 H new ATOM 0 HE2 TYR B 62 2.008 8.999 -4.016 1.00 0.00 H new ATOM 0 HH TYR B 62 0.881 12.126 -2.859 1.00 0.00 H new ATOM 1949 N PRO B 63 6.869 11.116 -1.056 1.00 0.00 N ATOM 1950 CA PRO B 63 6.996 12.560 -0.690 1.00 0.00 C ATOM 1951 C PRO B 63 5.713 13.120 -0.065 1.00 0.00 C ATOM 1952 O PRO B 63 4.727 13.373 -0.735 1.00 0.00 O ATOM 1953 CB PRO B 63 7.309 13.238 -2.028 1.00 0.00 C ATOM 1954 CG PRO B 63 8.045 12.198 -2.807 1.00 0.00 C ATOM 1955 CD PRO B 63 7.460 10.846 -2.375 1.00 0.00 C ATOM 0 HA PRO B 63 7.761 12.729 0.068 1.00 0.00 H new ATOM 0 HB2 PRO B 63 6.398 13.547 -2.540 1.00 0.00 H new ATOM 0 HB3 PRO B 63 7.915 14.133 -1.888 1.00 0.00 H new ATOM 0 HG2 PRO B 63 7.919 12.352 -3.879 1.00 0.00 H new ATOM 0 HG3 PRO B 63 9.115 12.243 -2.602 1.00 0.00 H new ATOM 0 HD2 PRO B 63 6.711 10.492 -3.083 1.00 0.00 H new ATOM 0 HD3 PRO B 63 8.231 10.078 -2.317 1.00 0.00 H new ATOM 1963 N LEU B 64 5.735 13.325 1.220 1.00 0.00 N ATOM 1964 CA LEU B 64 4.547 13.876 1.920 1.00 0.00 C ATOM 1965 C LEU B 64 4.481 15.376 1.680 1.00 0.00 C ATOM 1966 O LEU B 64 3.548 16.008 2.104 1.00 0.00 O ATOM 1967 CB LEU B 64 4.641 13.622 3.443 1.00 0.00 C ATOM 1968 CG LEU B 64 6.110 13.594 3.927 1.00 0.00 C ATOM 1969 CD1 LEU B 64 6.814 12.282 3.495 1.00 0.00 C ATOM 1970 CD2 LEU B 64 6.881 14.838 3.418 1.00 0.00 C ATOM 0 H LEU B 64 6.536 13.132 1.821 1.00 0.00 H new ATOM 0 HA LEU B 64 3.655 13.384 1.532 1.00 0.00 H new ATOM 0 HB2 LEU B 64 4.097 14.401 3.976 1.00 0.00 H new ATOM 0 HB3 LEU B 64 4.160 12.674 3.685 1.00 0.00 H new ATOM 0 HG LEU B 64 6.108 13.624 5.017 1.00 0.00 H new ATOM 0 HD11 LEU B 64 7.845 12.289 3.848 1.00 0.00 H new ATOM 0 HD12 LEU B 64 6.289 11.429 3.925 1.00 0.00 H new ATOM 0 HD13 LEU B 64 6.804 12.204 2.408 1.00 0.00 H new ATOM 0 HD21 LEU B 64 7.912 14.797 3.771 1.00 0.00 H new ATOM 0 HD22 LEU B 64 6.871 14.852 2.328 1.00 0.00 H new ATOM 0 HD23 LEU B 64 6.404 15.742 3.797 1.00 0.00 H new