USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 737 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 HIS : no HD1:sc= -7.27! K(o=-9.9!,f=-4.1) USER MOD Set 1.2: A 59 TYR OH : rot 147:sc= -0.0204 USER MOD Set 1.3: A 73 GLN : amide:sc= -2.64! C(o=-9.9!,f=-4.1!) USER MOD Set 2.1: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 HIS : no HD1:sc= -0.0644 X(o=-0.064,f=-0.0067) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.29! USER MOD Single : A 43 GLN : amide:sc= -7.08! K(o=-7.1!,f=-1.7) USER MOD Single : A 44 TYR OH : rot 165:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.712 X(o=-0.71,f=-0.46) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -1.29 X(o=-1.3,f=-1.3) USER MOD Single : A 62 THR OG1 : rot -154:sc= 0.47 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.531 K(o=-0.53,f=-1.1) USER MOD Single : A 69 THR OG1 : rot -170:sc= -2.89! USER MOD Single : A 74 SER OG : rot 154:sc= -2.82! USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.321 K(o=-0.32,f=-2.4) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -2.99! K(o=-3!,f=-1.5) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0401 USER MOD Single : A 96 THR OG1 : rot -59:sc= 0.571 USER MOD Single : A 98 ASN : amide:sc= -6.5! C(o=-6.5!,f=-6.6!) USER MOD Single : A 100 TYR OH : rot -37:sc= 0.00599 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.276 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -3.49! K(o=-3.5!,f=-1) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -0.794 K(o=-0.79,f=-0.14) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 -48.087 26.126 13.486 1.00 0.00 N ATOM 2 CA GLY A 15 -49.393 26.304 12.875 1.00 0.00 C ATOM 3 C GLY A 15 -49.611 25.299 11.743 1.00 0.00 C ATOM 4 O GLY A 15 -48.688 24.581 11.359 1.00 0.00 O ATOM 0 HA2 GLY A 15 -50.171 26.182 13.629 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -49.482 27.319 12.487 1.00 0.00 H new ATOM 8 N SER A 16 -50.836 25.278 11.239 1.00 0.00 N ATOM 9 CA SER A 16 -51.186 24.373 10.159 1.00 0.00 C ATOM 10 C SER A 16 -51.170 25.119 8.823 1.00 0.00 C ATOM 11 O SER A 16 -52.223 25.446 8.278 1.00 0.00 O ATOM 12 CB SER A 16 -52.559 23.739 10.395 1.00 0.00 C ATOM 13 OG SER A 16 -52.586 22.950 11.582 1.00 0.00 O ATOM 0 H SER A 16 -51.599 25.874 11.559 1.00 0.00 H new ATOM 0 HA SER A 16 -50.445 23.574 10.130 1.00 0.00 H new ATOM 0 HB2 SER A 16 -53.313 24.523 10.463 1.00 0.00 H new ATOM 0 HB3 SER A 16 -52.823 23.117 9.540 1.00 0.00 H new ATOM 0 HG SER A 16 -53.479 22.564 11.698 1.00 0.00 H new ATOM 18 N GLY A 17 -49.963 25.367 8.336 1.00 0.00 N ATOM 19 CA GLY A 17 -49.795 26.069 7.075 1.00 0.00 C ATOM 20 C GLY A 17 -48.361 25.936 6.560 1.00 0.00 C ATOM 21 O GLY A 17 -47.970 24.877 6.069 1.00 0.00 O ATOM 0 H GLY A 17 -49.092 25.094 8.792 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -50.489 25.668 6.336 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -50.042 27.123 7.206 1.00 0.00 H new ATOM 25 N MET A 18 -47.616 27.023 6.688 1.00 0.00 N ATOM 26 CA MET A 18 -46.233 27.041 6.241 1.00 0.00 C ATOM 27 C MET A 18 -46.148 27.268 4.730 1.00 0.00 C ATOM 28 O MET A 18 -45.541 28.237 4.278 1.00 0.00 O ATOM 29 CB MET A 18 -45.564 25.711 6.597 1.00 0.00 C ATOM 30 CG MET A 18 -44.052 25.881 6.749 1.00 0.00 C ATOM 31 SD MET A 18 -43.277 24.287 6.958 1.00 0.00 S ATOM 32 CE MET A 18 -41.565 24.742 6.733 1.00 0.00 C ATOM 0 H MET A 18 -47.944 27.899 7.095 1.00 0.00 H new ATOM 0 HA MET A 18 -45.719 27.862 6.742 1.00 0.00 H new ATOM 0 HB2 MET A 18 -45.985 25.325 7.525 1.00 0.00 H new ATOM 0 HB3 MET A 18 -45.775 24.975 5.821 1.00 0.00 H new ATOM 0 HG2 MET A 18 -43.644 26.381 5.871 1.00 0.00 H new ATOM 0 HG3 MET A 18 -43.834 26.516 7.607 1.00 0.00 H new ATOM 0 HE1 MET A 18 -40.937 23.857 6.832 1.00 0.00 H new ATOM 0 HE2 MET A 18 -41.430 25.173 5.741 1.00 0.00 H new ATOM 0 HE3 MET A 18 -41.281 25.475 7.488 1.00 0.00 H new ATOM 40 N LYS A 19 -46.764 26.356 3.992 1.00 0.00 N ATOM 41 CA LYS A 19 -46.766 26.444 2.542 1.00 0.00 C ATOM 42 C LYS A 19 -45.339 26.254 2.023 1.00 0.00 C ATOM 43 O LYS A 19 -44.990 25.180 1.537 1.00 0.00 O ATOM 44 CB LYS A 19 -47.417 27.751 2.086 1.00 0.00 C ATOM 45 CG LYS A 19 -48.943 27.652 2.140 1.00 0.00 C ATOM 46 CD LYS A 19 -49.529 27.431 0.745 1.00 0.00 C ATOM 47 CE LYS A 19 -49.962 25.976 0.556 1.00 0.00 C ATOM 48 NZ LYS A 19 -49.473 25.454 -0.740 1.00 0.00 N ATOM 0 H LYS A 19 -47.265 25.553 4.371 1.00 0.00 H new ATOM 0 HA LYS A 19 -47.372 25.646 2.112 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -47.080 28.570 2.721 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -47.100 27.984 1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -49.234 26.831 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -49.355 28.565 2.571 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -50.384 28.091 0.597 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -48.789 27.695 -0.010 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -49.573 25.366 1.371 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -51.049 25.906 0.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -49.776 24.465 -0.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -49.865 26.026 -1.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -48.434 25.503 -0.764 1.00 0.00 H new ATOM 58 N GLU A 20 -44.553 27.315 2.142 1.00 0.00 N ATOM 59 CA GLU A 20 -43.173 27.278 1.690 1.00 0.00 C ATOM 60 C GLU A 20 -43.092 26.693 0.278 1.00 0.00 C ATOM 61 O GLU A 20 -42.845 25.499 0.111 1.00 0.00 O ATOM 62 CB GLU A 20 -42.299 26.486 2.664 1.00 0.00 C ATOM 63 CG GLU A 20 -41.186 27.362 3.240 1.00 0.00 C ATOM 64 CD GLU A 20 -39.963 27.373 2.319 1.00 0.00 C ATOM 65 OE1 GLU A 20 -40.108 27.891 1.190 1.00 0.00 O ATOM 66 OE2 GLU A 20 -38.913 26.862 2.764 1.00 0.00 O ATOM 0 H GLU A 20 -44.846 28.205 2.545 1.00 0.00 H new ATOM 0 HA GLU A 20 -42.793 28.299 1.660 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -42.914 26.095 3.474 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -41.863 25.628 2.152 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -41.553 28.380 3.375 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -40.901 26.992 4.225 1.00 0.00 H new ATOM 71 N THR A 21 -43.303 27.560 -0.700 1.00 0.00 N ATOM 72 CA THR A 21 -43.257 27.144 -2.091 1.00 0.00 C ATOM 73 C THR A 21 -42.457 28.150 -2.923 1.00 0.00 C ATOM 74 O THR A 21 -42.723 29.349 -2.875 1.00 0.00 O ATOM 75 CB THR A 21 -44.696 26.961 -2.579 1.00 0.00 C ATOM 76 OG1 THR A 21 -45.165 25.826 -1.855 1.00 0.00 O ATOM 77 CG2 THR A 21 -44.767 26.525 -4.043 1.00 0.00 C ATOM 0 H THR A 21 -43.506 28.549 -0.557 1.00 0.00 H new ATOM 0 HA THR A 21 -42.738 26.192 -2.201 1.00 0.00 H new ATOM 0 HB THR A 21 -45.244 27.895 -2.452 1.00 0.00 H new ATOM 0 HG1 THR A 21 -46.092 25.637 -2.109 1.00 0.00 H new ATOM 0 HG21 THR A 21 -45.810 26.410 -4.338 1.00 0.00 H new ATOM 0 HG22 THR A 21 -44.294 27.280 -4.671 1.00 0.00 H new ATOM 0 HG23 THR A 21 -44.248 25.574 -4.165 1.00 0.00 H new ATOM 85 N ALA A 22 -41.494 27.623 -3.664 1.00 0.00 N ATOM 86 CA ALA A 22 -40.655 28.460 -4.504 1.00 0.00 C ATOM 87 C ALA A 22 -39.758 27.571 -5.368 1.00 0.00 C ATOM 88 O ALA A 22 -39.660 26.367 -5.134 1.00 0.00 O ATOM 89 CB ALA A 22 -39.851 29.421 -3.627 1.00 0.00 C ATOM 0 H ALA A 22 -41.276 26.627 -3.700 1.00 0.00 H new ATOM 0 HA ALA A 22 -41.266 29.064 -5.175 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -39.222 30.049 -4.258 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -40.534 30.050 -3.055 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -39.224 28.850 -2.942 1.00 0.00 H new ATOM 95 N ALA A 23 -39.125 28.198 -6.350 1.00 0.00 N ATOM 96 CA ALA A 23 -38.241 27.477 -7.249 1.00 0.00 C ATOM 97 C ALA A 23 -37.050 28.371 -7.608 1.00 0.00 C ATOM 98 O ALA A 23 -35.903 28.017 -7.342 1.00 0.00 O ATOM 99 CB ALA A 23 -39.023 27.026 -8.483 1.00 0.00 C ATOM 0 H ALA A 23 -39.207 29.196 -6.542 1.00 0.00 H new ATOM 0 HA ALA A 23 -37.850 26.581 -6.767 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -38.359 26.485 -9.157 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -39.840 26.373 -8.177 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -39.428 27.898 -8.996 1.00 0.00 H new ATOM 105 N ALA A 24 -37.366 29.509 -8.207 1.00 0.00 N ATOM 106 CA ALA A 24 -36.337 30.455 -8.606 1.00 0.00 C ATOM 107 C ALA A 24 -35.298 29.738 -9.471 1.00 0.00 C ATOM 108 O ALA A 24 -35.398 28.533 -9.696 1.00 0.00 O ATOM 109 CB ALA A 24 -35.717 31.091 -7.359 1.00 0.00 C ATOM 0 H ALA A 24 -38.319 29.798 -8.426 1.00 0.00 H new ATOM 0 HA ALA A 24 -36.766 31.259 -9.204 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -34.945 31.800 -7.658 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -36.490 31.612 -6.794 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -35.274 30.314 -6.736 1.00 0.00 H new ATOM 115 N LYS A 25 -34.326 30.510 -9.935 1.00 0.00 N ATOM 116 CA LYS A 25 -33.271 29.963 -10.771 1.00 0.00 C ATOM 117 C LYS A 25 -31.953 30.672 -10.449 1.00 0.00 C ATOM 118 O LYS A 25 -31.912 31.896 -10.346 1.00 0.00 O ATOM 119 CB LYS A 25 -33.665 30.038 -12.247 1.00 0.00 C ATOM 120 CG LYS A 25 -33.262 28.761 -12.987 1.00 0.00 C ATOM 121 CD LYS A 25 -34.211 27.609 -12.651 1.00 0.00 C ATOM 122 CE LYS A 25 -34.204 26.552 -13.755 1.00 0.00 C ATOM 123 NZ LYS A 25 -34.117 25.193 -13.173 1.00 0.00 N ATOM 0 H LYS A 25 -34.247 31.510 -9.748 1.00 0.00 H new ATOM 0 HA LYS A 25 -33.125 28.904 -10.557 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -34.741 30.188 -12.333 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -33.185 30.899 -12.712 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -33.270 28.942 -14.062 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -32.242 28.487 -12.717 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -33.916 27.154 -11.706 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -35.222 27.994 -12.518 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -35.109 26.639 -14.356 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -33.360 26.722 -14.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -34.113 24.488 -13.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -33.241 25.108 -12.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -34.936 25.028 -12.553 1.00 0.00 H new ATOM 133 N PHE A 26 -30.909 29.870 -10.301 1.00 0.00 N ATOM 134 CA PHE A 26 -29.593 30.405 -9.994 1.00 0.00 C ATOM 135 C PHE A 26 -28.494 29.408 -10.372 1.00 0.00 C ATOM 136 O PHE A 26 -28.783 28.268 -10.731 1.00 0.00 O ATOM 137 CB PHE A 26 -29.550 30.644 -8.484 1.00 0.00 C ATOM 138 CG PHE A 26 -30.417 31.814 -8.015 1.00 0.00 C ATOM 139 CD1 PHE A 26 -30.167 33.072 -8.471 1.00 0.00 C ATOM 140 CD2 PHE A 26 -31.436 31.599 -7.142 1.00 0.00 C ATOM 141 CE1 PHE A 26 -30.972 34.158 -8.036 1.00 0.00 C ATOM 142 CE2 PHE A 26 -32.241 32.685 -6.706 1.00 0.00 C ATOM 143 CZ PHE A 26 -31.992 33.942 -7.162 1.00 0.00 C ATOM 0 H PHE A 26 -30.947 28.854 -10.388 1.00 0.00 H new ATOM 0 HA PHE A 26 -29.423 31.323 -10.557 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -29.874 29.737 -7.973 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -28.518 30.827 -8.185 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -29.356 33.244 -9.164 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -31.634 30.601 -6.779 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -30.774 35.156 -8.399 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -33.051 32.513 -6.012 1.00 0.00 H new ATOM 0 HZ PHE A 26 -32.604 34.768 -6.830 1.00 0.00 H new ATOM 152 N GLU A 27 -27.259 29.876 -10.278 1.00 0.00 N ATOM 153 CA GLU A 27 -26.116 29.041 -10.605 1.00 0.00 C ATOM 154 C GLU A 27 -24.945 29.354 -9.672 1.00 0.00 C ATOM 155 O GLU A 27 -24.739 30.506 -9.293 1.00 0.00 O ATOM 156 CB GLU A 27 -25.711 29.214 -12.070 1.00 0.00 C ATOM 157 CG GLU A 27 -26.788 28.662 -13.006 1.00 0.00 C ATOM 158 CD GLU A 27 -27.687 29.785 -13.530 1.00 0.00 C ATOM 159 OE1 GLU A 27 -28.112 30.609 -12.692 1.00 0.00 O ATOM 160 OE2 GLU A 27 -27.928 29.793 -14.756 1.00 0.00 O ATOM 0 H GLU A 27 -27.024 30.823 -9.980 1.00 0.00 H new ATOM 0 HA GLU A 27 -26.400 27.999 -10.462 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -25.546 30.270 -12.283 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -24.767 28.700 -12.253 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -26.318 28.147 -13.844 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -27.392 27.925 -12.477 1.00 0.00 H new ATOM 165 N ARG A 28 -24.207 28.308 -9.328 1.00 0.00 N ATOM 166 CA ARG A 28 -23.063 28.457 -8.446 1.00 0.00 C ATOM 167 C ARG A 28 -21.932 27.523 -8.882 1.00 0.00 C ATOM 168 O ARG A 28 -22.007 26.313 -8.675 1.00 0.00 O ATOM 169 CB ARG A 28 -23.440 28.148 -6.996 1.00 0.00 C ATOM 170 CG ARG A 28 -24.230 29.303 -6.377 1.00 0.00 C ATOM 171 CD ARG A 28 -23.332 30.522 -6.150 1.00 0.00 C ATOM 172 NE ARG A 28 -22.971 30.625 -4.718 1.00 0.00 N ATOM 173 CZ ARG A 28 -23.781 31.122 -3.773 1.00 0.00 C ATOM 174 NH1 ARG A 28 -25.001 31.566 -4.102 1.00 0.00 N ATOM 175 NH2 ARG A 28 -23.369 31.176 -2.499 1.00 0.00 N ATOM 0 H ARG A 28 -24.380 27.354 -9.645 1.00 0.00 H new ATOM 0 HA ARG A 28 -22.729 29.493 -8.509 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -24.034 27.235 -6.958 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -22.537 27.966 -6.413 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -25.058 29.574 -7.032 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -24.664 28.985 -5.429 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -22.430 30.437 -6.756 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -23.847 31.428 -6.470 1.00 0.00 H new ATOM 0 HE ARG A 28 -22.048 30.297 -4.433 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -25.314 31.526 -5.072 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -25.617 31.944 -3.383 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -22.439 30.839 -2.249 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -23.985 31.554 -1.779 1.00 0.00 H new ATOM 186 N GLN A 29 -20.909 28.121 -9.476 1.00 0.00 N ATOM 187 CA GLN A 29 -19.765 27.357 -9.942 1.00 0.00 C ATOM 188 C GLN A 29 -18.485 27.852 -9.266 1.00 0.00 C ATOM 189 O GLN A 29 -17.656 27.051 -8.837 1.00 0.00 O ATOM 190 CB GLN A 29 -19.641 27.428 -11.466 1.00 0.00 C ATOM 191 CG GLN A 29 -19.381 26.043 -12.060 1.00 0.00 C ATOM 192 CD GLN A 29 -20.612 25.529 -12.812 1.00 0.00 C ATOM 193 OE1 GLN A 29 -21.451 24.826 -12.273 1.00 0.00 O ATOM 194 NE2 GLN A 29 -20.672 25.918 -14.082 1.00 0.00 N ATOM 0 H GLN A 29 -20.849 29.125 -9.645 1.00 0.00 H new ATOM 0 HA GLN A 29 -19.917 26.312 -9.670 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -20.555 27.844 -11.890 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -18.829 28.102 -11.737 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -18.529 26.088 -12.738 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -19.119 25.345 -11.265 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -19.935 26.507 -14.470 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -21.455 25.628 -14.668 1.00 0.00 H new ATOM 201 N HIS A 30 -18.364 29.169 -9.191 1.00 0.00 N ATOM 202 CA HIS A 30 -17.199 29.780 -8.573 1.00 0.00 C ATOM 203 C HIS A 30 -17.085 29.313 -7.121 1.00 0.00 C ATOM 204 O HIS A 30 -17.961 28.611 -6.619 1.00 0.00 O ATOM 205 CB HIS A 30 -17.252 31.304 -8.703 1.00 0.00 C ATOM 206 CG HIS A 30 -16.043 31.904 -9.380 1.00 0.00 C ATOM 207 ND1 HIS A 30 -16.140 32.819 -10.414 1.00 0.00 N ATOM 208 CD2 HIS A 30 -14.711 31.710 -9.162 1.00 0.00 C ATOM 209 CE1 HIS A 30 -14.916 33.155 -10.793 1.00 0.00 C ATOM 210 NE2 HIS A 30 -14.031 32.466 -10.016 1.00 0.00 N ATOM 0 H HIS A 30 -19.054 29.830 -9.548 1.00 0.00 H new ATOM 0 HA HIS A 30 -16.296 29.460 -9.093 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -18.145 31.580 -9.265 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -17.353 31.740 -7.709 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -14.282 31.053 -8.420 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -14.663 33.852 -11.579 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -13.015 32.522 -10.081 1.00 0.00 H new ATOM 217 N MET A 31 -15.996 29.721 -6.485 1.00 0.00 N ATOM 218 CA MET A 31 -15.756 29.354 -5.100 1.00 0.00 C ATOM 219 C MET A 31 -15.678 27.834 -4.942 1.00 0.00 C ATOM 220 O MET A 31 -16.632 27.124 -5.261 1.00 0.00 O ATOM 221 CB MET A 31 -16.882 29.903 -4.223 1.00 0.00 C ATOM 222 CG MET A 31 -16.631 31.368 -3.862 1.00 0.00 C ATOM 223 SD MET A 31 -16.749 31.591 -2.094 1.00 0.00 S ATOM 224 CE MET A 31 -17.002 33.356 -2.020 1.00 0.00 C ATOM 0 H MET A 31 -15.270 30.302 -6.904 1.00 0.00 H new ATOM 0 HA MET A 31 -14.803 29.782 -4.790 1.00 0.00 H new ATOM 0 HB2 MET A 31 -17.833 29.812 -4.747 1.00 0.00 H new ATOM 0 HB3 MET A 31 -16.961 29.309 -3.313 1.00 0.00 H new ATOM 0 HG2 MET A 31 -15.644 31.673 -4.210 1.00 0.00 H new ATOM 0 HG3 MET A 31 -17.358 32.005 -4.366 1.00 0.00 H new ATOM 0 HE1 MET A 31 -17.097 33.667 -0.980 1.00 0.00 H new ATOM 0 HE2 MET A 31 -16.152 33.865 -2.475 1.00 0.00 H new ATOM 0 HE3 MET A 31 -17.912 33.616 -2.561 1.00 0.00 H new ATOM 232 N ASP A 32 -14.536 27.379 -4.449 1.00 0.00 N ATOM 233 CA ASP A 32 -14.322 25.956 -4.245 1.00 0.00 C ATOM 234 C ASP A 32 -13.782 25.724 -2.833 1.00 0.00 C ATOM 235 O ASP A 32 -13.378 26.669 -2.156 1.00 0.00 O ATOM 236 CB ASP A 32 -13.300 25.404 -5.239 1.00 0.00 C ATOM 237 CG ASP A 32 -13.726 24.124 -5.961 1.00 0.00 C ATOM 238 OD1 ASP A 32 -14.909 24.063 -6.359 1.00 0.00 O ATOM 239 OD2 ASP A 32 -12.857 23.234 -6.098 1.00 0.00 O ATOM 0 H ASP A 32 -13.748 27.971 -4.185 1.00 0.00 H new ATOM 0 HA ASP A 32 -15.275 25.448 -4.390 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -13.090 26.171 -5.985 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -12.367 25.211 -4.709 1.00 0.00 H new ATOM 243 N SER A 33 -13.791 24.463 -2.430 1.00 0.00 N ATOM 244 CA SER A 33 -13.307 24.093 -1.111 1.00 0.00 C ATOM 245 C SER A 33 -11.785 23.939 -1.136 1.00 0.00 C ATOM 246 O SER A 33 -11.196 23.729 -2.196 1.00 0.00 O ATOM 247 CB SER A 33 -13.964 22.801 -0.624 1.00 0.00 C ATOM 248 OG SER A 33 -15.330 22.996 -0.272 1.00 0.00 O ATOM 0 H SER A 33 -14.126 23.683 -2.995 1.00 0.00 H new ATOM 0 HA SER A 33 -13.574 24.888 -0.414 1.00 0.00 H new ATOM 0 HB2 SER A 33 -13.896 22.043 -1.404 1.00 0.00 H new ATOM 0 HB3 SER A 33 -13.418 22.420 0.239 1.00 0.00 H new ATOM 0 HG SER A 33 -15.714 22.147 0.032 1.00 0.00 H new ATOM 253 N PRO A 34 -11.175 24.051 0.074 1.00 0.00 N ATOM 254 CA PRO A 34 -9.733 23.926 0.199 1.00 0.00 C ATOM 255 C PRO A 34 -9.296 22.464 0.077 1.00 0.00 C ATOM 256 O PRO A 34 -10.050 21.627 -0.417 1.00 0.00 O ATOM 257 CB PRO A 34 -9.402 24.533 1.553 1.00 0.00 C ATOM 258 CG PRO A 34 -10.707 24.553 2.332 1.00 0.00 C ATOM 259 CD PRO A 34 -11.840 24.300 1.349 1.00 0.00 C ATOM 0 HA PRO A 34 -9.196 24.442 -0.597 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -8.647 23.942 2.072 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.998 25.539 1.442 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -10.699 23.790 3.110 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.840 25.514 2.829 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -12.445 23.446 1.653 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -12.509 25.158 1.286 1.00 0.00 H new ATOM 264 N ASP A 35 -8.081 22.202 0.535 1.00 0.00 N ATOM 265 CA ASP A 35 -7.536 20.857 0.484 1.00 0.00 C ATOM 266 C ASP A 35 -7.185 20.398 1.900 1.00 0.00 C ATOM 267 O ASP A 35 -6.425 21.065 2.602 1.00 0.00 O ATOM 268 CB ASP A 35 -6.259 20.813 -0.357 1.00 0.00 C ATOM 269 CG ASP A 35 -6.238 21.768 -1.553 1.00 0.00 C ATOM 270 OD1 ASP A 35 -5.787 22.916 -1.354 1.00 0.00 O ATOM 271 OD2 ASP A 35 -6.674 21.327 -2.638 1.00 0.00 O ATOM 0 H ASP A 35 -7.458 22.899 0.943 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.287 20.206 0.036 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.410 21.043 0.287 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.117 19.796 -0.721 1.00 0.00 H new ATOM 275 N LEU A 36 -7.755 19.264 2.280 1.00 0.00 N ATOM 276 CA LEU A 36 -7.513 18.709 3.599 1.00 0.00 C ATOM 277 C LEU A 36 -8.272 17.388 3.740 1.00 0.00 C ATOM 278 O LEU A 36 -9.255 17.309 4.477 1.00 0.00 O ATOM 279 CB LEU A 36 -7.854 19.733 4.683 1.00 0.00 C ATOM 280 CG LEU A 36 -7.946 19.193 6.112 1.00 0.00 C ATOM 281 CD1 LEU A 36 -7.137 20.060 7.079 1.00 0.00 C ATOM 282 CD2 LEU A 36 -9.405 19.053 6.552 1.00 0.00 C ATOM 0 H LEU A 36 -8.385 18.714 1.696 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.454 18.484 3.728 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.100 20.520 4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -8.807 20.197 4.429 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.507 18.196 6.129 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -7.219 19.654 8.087 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -6.090 20.065 6.774 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -7.524 21.079 7.065 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.442 18.667 7.571 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.891 20.028 6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.922 18.364 5.884 1.00 0.00 H new ATOM 293 N GLY A 37 -7.789 16.384 3.024 1.00 0.00 N ATOM 294 CA GLY A 37 -8.412 15.072 3.059 1.00 0.00 C ATOM 295 C GLY A 37 -8.811 14.694 4.487 1.00 0.00 C ATOM 296 O GLY A 37 -9.994 14.693 4.824 1.00 0.00 O ATOM 0 H GLY A 37 -6.973 16.453 2.416 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.293 15.066 2.418 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -7.723 14.327 2.661 1.00 0.00 H new ATOM 300 N THR A 38 -7.803 14.380 5.287 1.00 0.00 N ATOM 301 CA THR A 38 -8.034 14.001 6.670 1.00 0.00 C ATOM 302 C THR A 38 -9.348 13.230 6.798 1.00 0.00 C ATOM 303 O THR A 38 -10.403 13.826 7.013 1.00 0.00 O ATOM 304 CB THR A 38 -7.988 15.270 7.522 1.00 0.00 C ATOM 305 OG1 THR A 38 -6.606 15.618 7.553 1.00 0.00 O ATOM 306 CG2 THR A 38 -8.337 15.005 8.988 1.00 0.00 C ATOM 0 H THR A 38 -6.823 14.380 5.003 1.00 0.00 H new ATOM 0 HA THR A 38 -7.260 13.323 7.030 1.00 0.00 H new ATOM 0 HB THR A 38 -8.679 16.007 7.112 1.00 0.00 H new ATOM 0 HG1 THR A 38 -6.486 16.433 8.084 1.00 0.00 H new ATOM 0 HG21 THR A 38 -8.289 15.939 9.548 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.344 14.594 9.054 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.626 14.293 9.408 1.00 0.00 H new ATOM 314 N THR A 39 -9.243 11.916 6.662 1.00 0.00 N ATOM 315 CA THR A 39 -10.411 11.057 6.760 1.00 0.00 C ATOM 316 C THR A 39 -11.052 10.869 5.383 1.00 0.00 C ATOM 317 O THR A 39 -10.362 10.583 4.407 1.00 0.00 O ATOM 318 CB THR A 39 -11.360 11.666 7.794 1.00 0.00 C ATOM 319 OG1 THR A 39 -10.496 12.128 8.829 1.00 0.00 O ATOM 320 CG2 THR A 39 -12.231 10.612 8.480 1.00 0.00 C ATOM 0 H THR A 39 -8.367 11.425 6.485 1.00 0.00 H new ATOM 0 HA THR A 39 -10.139 10.056 7.096 1.00 0.00 H new ATOM 0 HB THR A 39 -11.997 12.406 7.310 1.00 0.00 H new ATOM 0 HG1 THR A 39 -11.029 12.539 9.541 1.00 0.00 H new ATOM 0 HG21 THR A 39 -12.886 11.096 9.204 1.00 0.00 H new ATOM 0 HG22 THR A 39 -12.834 10.096 7.733 1.00 0.00 H new ATOM 0 HG23 THR A 39 -11.594 9.891 8.992 1.00 0.00 H new ATOM 328 N LEU A 40 -12.366 11.040 5.350 1.00 0.00 N ATOM 329 CA LEU A 40 -13.108 10.893 4.109 1.00 0.00 C ATOM 330 C LEU A 40 -12.629 9.636 3.380 1.00 0.00 C ATOM 331 O LEU A 40 -11.981 8.777 3.975 1.00 0.00 O ATOM 332 CB LEU A 40 -13.007 12.169 3.270 1.00 0.00 C ATOM 333 CG LEU A 40 -12.716 13.457 4.042 1.00 0.00 C ATOM 334 CD1 LEU A 40 -12.330 14.591 3.090 1.00 0.00 C ATOM 335 CD2 LEU A 40 -13.897 13.839 4.936 1.00 0.00 C ATOM 0 H LEU A 40 -12.935 11.279 6.162 1.00 0.00 H new ATOM 0 HA LEU A 40 -14.170 10.758 4.313 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -12.223 12.030 2.526 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -13.943 12.298 2.727 1.00 0.00 H new ATOM 0 HG LEU A 40 -11.862 13.278 4.695 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -12.128 15.495 3.664 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -11.437 14.309 2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -13.149 14.777 2.395 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -13.664 14.758 5.474 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -14.784 13.993 4.321 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -14.086 13.038 5.651 1.00 0.00 H new ATOM 346 N LEU A 41 -12.966 9.570 2.100 1.00 0.00 N ATOM 347 CA LEU A 41 -12.579 8.432 1.282 1.00 0.00 C ATOM 348 C LEU A 41 -11.241 8.730 0.604 1.00 0.00 C ATOM 349 O LEU A 41 -10.916 8.138 -0.424 1.00 0.00 O ATOM 350 CB LEU A 41 -13.698 8.071 0.303 1.00 0.00 C ATOM 351 CG LEU A 41 -14.181 9.200 -0.609 1.00 0.00 C ATOM 352 CD1 LEU A 41 -13.853 8.901 -2.074 1.00 0.00 C ATOM 353 CD2 LEU A 41 -15.673 9.472 -0.401 1.00 0.00 C ATOM 0 H LEU A 41 -13.502 10.285 1.609 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.433 7.548 1.903 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -13.355 7.247 -0.323 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -14.550 7.703 0.875 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.646 10.110 -0.338 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -14.207 9.720 -2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -12.775 8.795 -2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.343 7.975 -2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -15.991 10.279 -1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -16.242 8.571 -0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -15.849 9.760 0.635 1.00 0.00 H new ATOM 364 N GLU A 42 -10.499 9.648 1.207 1.00 0.00 N ATOM 365 CA GLU A 42 -9.203 10.031 0.674 1.00 0.00 C ATOM 366 C GLU A 42 -9.336 10.458 -0.788 1.00 0.00 C ATOM 367 O GLU A 42 -8.711 9.870 -1.670 1.00 0.00 O ATOM 368 CB GLU A 42 -8.190 8.893 0.823 1.00 0.00 C ATOM 369 CG GLU A 42 -7.492 8.957 2.183 1.00 0.00 C ATOM 370 CD GLU A 42 -8.491 8.747 3.323 1.00 0.00 C ATOM 371 OE1 GLU A 42 -9.513 8.075 3.065 1.00 0.00 O ATOM 372 OE2 GLU A 42 -8.209 9.262 4.426 1.00 0.00 O ATOM 0 H GLU A 42 -10.771 10.137 2.060 1.00 0.00 H new ATOM 0 HA GLU A 42 -8.833 10.880 1.248 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.696 7.934 0.715 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.449 8.954 0.026 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.713 8.196 2.232 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.001 9.923 2.299 1.00 0.00 H new ATOM 377 N GLN A 43 -10.154 11.479 -1.001 1.00 0.00 N ATOM 378 CA GLN A 43 -10.377 11.992 -2.343 1.00 0.00 C ATOM 379 C GLN A 43 -9.077 12.558 -2.917 1.00 0.00 C ATOM 380 O GLN A 43 -8.894 13.773 -2.971 1.00 0.00 O ATOM 381 CB GLN A 43 -11.484 13.047 -2.349 1.00 0.00 C ATOM 382 CG GLN A 43 -12.726 12.544 -1.610 1.00 0.00 C ATOM 383 CD GLN A 43 -13.199 13.566 -0.574 1.00 0.00 C ATOM 384 OE1 GLN A 43 -13.419 14.729 -0.867 1.00 0.00 O ATOM 385 NE2 GLN A 43 -13.341 13.068 0.652 1.00 0.00 N ATOM 0 H GLN A 43 -10.670 11.965 -0.267 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.703 11.167 -2.977 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -11.122 13.961 -1.879 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.745 13.299 -3.377 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -13.525 12.349 -2.325 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -12.502 11.598 -1.117 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -13.140 12.084 0.829 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -13.651 13.670 1.414 1.00 0.00 H new ATOM 392 N TYR A 44 -8.206 11.649 -3.332 1.00 0.00 N ATOM 393 CA TYR A 44 -6.927 12.042 -3.901 1.00 0.00 C ATOM 394 C TYR A 44 -6.264 10.869 -4.624 1.00 0.00 C ATOM 395 O TYR A 44 -6.523 9.711 -4.301 1.00 0.00 O ATOM 396 CB TYR A 44 -6.050 12.460 -2.718 1.00 0.00 C ATOM 397 CG TYR A 44 -6.441 13.801 -2.095 1.00 0.00 C ATOM 398 CD1 TYR A 44 -6.112 14.979 -2.734 1.00 0.00 C ATOM 399 CD2 TYR A 44 -7.123 13.833 -0.897 1.00 0.00 C ATOM 400 CE1 TYR A 44 -6.480 16.243 -2.148 1.00 0.00 C ATOM 401 CE2 TYR A 44 -7.491 15.096 -0.311 1.00 0.00 C ATOM 402 CZ TYR A 44 -7.151 16.238 -0.965 1.00 0.00 C ATOM 403 OH TYR A 44 -7.498 17.431 -0.412 1.00 0.00 O ATOM 0 H TYR A 44 -8.361 10.642 -3.286 1.00 0.00 H new ATOM 0 HA TYR A 44 -7.060 12.844 -4.627 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -6.100 11.687 -1.951 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -5.013 12.514 -3.049 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -5.579 14.954 -3.673 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -7.381 12.911 -0.398 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -6.229 17.173 -2.637 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -8.025 15.135 0.627 1.00 0.00 H new ATOM 0 HH TYR A 44 -8.168 17.284 0.288 1.00 0.00 H new ATOM 412 N CYS A 45 -5.423 11.209 -5.590 1.00 0.00 N ATOM 413 CA CYS A 45 -4.721 10.198 -6.361 1.00 0.00 C ATOM 414 C CYS A 45 -5.695 9.615 -7.387 1.00 0.00 C ATOM 415 O CYS A 45 -6.496 8.740 -7.061 1.00 0.00 O ATOM 416 CB CYS A 45 -4.123 9.114 -5.461 1.00 0.00 C ATOM 417 SG CYS A 45 -3.296 9.738 -3.953 1.00 0.00 S ATOM 0 H CYS A 45 -5.212 12.171 -5.856 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.877 10.653 -6.880 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -4.917 8.428 -5.165 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -3.403 8.537 -6.041 1.00 0.00 H new ATOM 421 N HIS A 46 -5.594 10.124 -8.606 1.00 0.00 N ATOM 422 CA HIS A 46 -6.455 9.665 -9.683 1.00 0.00 C ATOM 423 C HIS A 46 -5.629 9.473 -10.956 1.00 0.00 C ATOM 424 O HIS A 46 -4.533 10.021 -11.077 1.00 0.00 O ATOM 425 CB HIS A 46 -7.634 10.620 -9.880 1.00 0.00 C ATOM 426 CG HIS A 46 -8.721 10.077 -10.778 1.00 0.00 C ATOM 427 ND1 HIS A 46 -9.990 9.771 -10.318 1.00 0.00 N ATOM 428 CD2 HIS A 46 -8.713 9.791 -12.111 1.00 0.00 C ATOM 429 CE1 HIS A 46 -10.706 9.321 -11.338 1.00 0.00 C ATOM 430 NE2 HIS A 46 -9.913 9.333 -12.448 1.00 0.00 N ATOM 0 H HIS A 46 -4.929 10.850 -8.872 1.00 0.00 H new ATOM 0 HA HIS A 46 -6.885 8.698 -9.422 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -8.065 10.855 -8.907 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.264 11.556 -10.299 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -7.874 9.916 -12.779 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -11.737 9.001 -11.298 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -10.195 9.039 -13.383 1.00 0.00 H new ATOM 437 N ARG A 47 -6.184 8.695 -11.872 1.00 0.00 N ATOM 438 CA ARG A 47 -5.511 8.425 -13.132 1.00 0.00 C ATOM 439 C ARG A 47 -5.766 9.561 -14.124 1.00 0.00 C ATOM 440 O ARG A 47 -5.039 10.553 -14.137 1.00 0.00 O ATOM 441 CB ARG A 47 -5.994 7.107 -13.742 1.00 0.00 C ATOM 442 CG ARG A 47 -5.545 6.979 -15.199 1.00 0.00 C ATOM 443 CD ARG A 47 -4.747 5.692 -15.415 1.00 0.00 C ATOM 444 NE ARG A 47 -3.464 5.999 -16.089 1.00 0.00 N ATOM 445 CZ ARG A 47 -2.389 6.496 -15.465 1.00 0.00 C ATOM 446 NH1 ARG A 47 -2.433 6.746 -14.148 1.00 0.00 N ATOM 447 NH2 ARG A 47 -1.267 6.743 -16.155 1.00 0.00 N ATOM 0 H ARG A 47 -7.092 8.242 -11.768 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.443 8.349 -12.928 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -5.604 6.270 -13.163 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -7.081 7.054 -13.687 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.416 6.985 -15.854 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.935 7.840 -15.472 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.557 5.207 -14.458 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -5.326 4.992 -16.018 1.00 0.00 H new ATOM 0 HE ARG A 47 -3.395 5.821 -17.091 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -3.286 6.557 -13.621 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -1.614 7.125 -13.673 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.232 6.552 -17.156 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.448 7.122 -15.679 1.00 0.00 H new ATOM 458 N THR A 48 -6.801 9.379 -14.931 1.00 0.00 N ATOM 459 CA THR A 48 -7.161 10.377 -15.924 1.00 0.00 C ATOM 460 C THR A 48 -8.440 9.965 -16.656 1.00 0.00 C ATOM 461 O THR A 48 -9.262 10.813 -17.000 1.00 0.00 O ATOM 462 CB THR A 48 -5.963 10.569 -16.857 1.00 0.00 C ATOM 463 OG1 THR A 48 -6.338 11.667 -17.683 1.00 0.00 O ATOM 464 CG2 THR A 48 -5.792 9.406 -17.837 1.00 0.00 C ATOM 0 H THR A 48 -7.402 8.555 -14.917 1.00 0.00 H new ATOM 0 HA THR A 48 -7.386 11.336 -15.457 1.00 0.00 H new ATOM 0 HB THR A 48 -5.055 10.680 -16.264 1.00 0.00 H new ATOM 0 HG1 THR A 48 -5.617 11.860 -18.318 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.928 9.592 -18.476 1.00 0.00 H new ATOM 0 HG22 THR A 48 -5.639 8.481 -17.281 1.00 0.00 H new ATOM 0 HG23 THR A 48 -6.686 9.315 -18.454 1.00 0.00 H new ATOM 472 N THR A 49 -8.568 8.664 -16.871 1.00 0.00 N ATOM 473 CA THR A 49 -9.733 8.130 -17.555 1.00 0.00 C ATOM 474 C THR A 49 -10.942 9.042 -17.340 1.00 0.00 C ATOM 475 O THR A 49 -11.299 9.349 -16.204 1.00 0.00 O ATOM 476 CB THR A 49 -9.956 6.699 -17.062 1.00 0.00 C ATOM 477 OG1 THR A 49 -11.077 6.243 -17.814 1.00 0.00 O ATOM 478 CG2 THR A 49 -10.435 6.648 -15.610 1.00 0.00 C ATOM 0 H THR A 49 -7.884 7.964 -16.584 1.00 0.00 H new ATOM 0 HA THR A 49 -9.578 8.097 -18.633 1.00 0.00 H new ATOM 0 HB THR A 49 -9.029 6.134 -17.158 1.00 0.00 H new ATOM 0 HG1 THR A 49 -11.289 5.321 -17.558 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.578 5.610 -15.310 1.00 0.00 H new ATOM 0 HG22 THR A 49 -9.690 7.113 -14.964 1.00 0.00 H new ATOM 0 HG23 THR A 49 -11.379 7.185 -15.519 1.00 0.00 H new ATOM 486 N ILE A 50 -11.540 9.450 -18.450 1.00 0.00 N ATOM 487 CA ILE A 50 -12.702 10.320 -18.398 1.00 0.00 C ATOM 488 C ILE A 50 -12.337 11.606 -17.653 1.00 0.00 C ATOM 489 O ILE A 50 -12.044 11.574 -16.459 1.00 0.00 O ATOM 490 CB ILE A 50 -13.899 9.580 -17.797 1.00 0.00 C ATOM 491 CG1 ILE A 50 -15.115 9.662 -18.723 1.00 0.00 C ATOM 492 CG2 ILE A 50 -14.214 10.096 -16.392 1.00 0.00 C ATOM 493 CD1 ILE A 50 -16.202 10.556 -18.124 1.00 0.00 C ATOM 0 H ILE A 50 -11.241 9.194 -19.391 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.007 10.609 -19.404 1.00 0.00 H new ATOM 0 HB ILE A 50 -13.636 8.526 -17.702 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.811 10.054 -19.694 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -15.515 8.662 -18.893 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -15.069 9.553 -15.988 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -13.349 9.944 -15.746 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -14.449 11.159 -16.439 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -17.054 10.597 -18.802 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -16.521 10.148 -17.165 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -15.807 11.561 -17.978 1.00 0.00 H new ATOM 504 N GLY A 51 -12.367 12.707 -18.389 1.00 0.00 N ATOM 505 CA GLY A 51 -12.043 14.002 -17.814 1.00 0.00 C ATOM 506 C GLY A 51 -10.882 13.887 -16.825 1.00 0.00 C ATOM 507 O GLY A 51 -9.787 13.466 -17.194 1.00 0.00 O ATOM 0 H GLY A 51 -12.611 12.729 -19.379 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -11.781 14.701 -18.608 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -12.918 14.408 -17.307 1.00 0.00 H new ATOM 511 N ASN A 52 -11.161 14.268 -15.587 1.00 0.00 N ATOM 512 CA ASN A 52 -10.153 14.213 -14.542 1.00 0.00 C ATOM 513 C ASN A 52 -10.549 13.154 -13.512 1.00 0.00 C ATOM 514 O ASN A 52 -9.688 12.543 -12.881 1.00 0.00 O ATOM 515 CB ASN A 52 -10.035 15.556 -13.819 1.00 0.00 C ATOM 516 CG ASN A 52 -11.408 16.058 -13.367 1.00 0.00 C ATOM 517 OD1 ASN A 52 -11.828 15.865 -12.238 1.00 0.00 O ATOM 518 ND2 ASN A 52 -12.084 16.708 -14.310 1.00 0.00 N ATOM 0 H ASN A 52 -12.071 14.616 -15.284 1.00 0.00 H new ATOM 0 HA ASN A 52 -9.198 13.969 -15.008 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -9.379 15.451 -12.954 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -9.575 16.290 -14.481 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -13.012 17.080 -14.108 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -11.674 16.835 -15.235 1.00 0.00 H new ATOM 524 N PHE A 53 -11.855 12.968 -13.374 1.00 0.00 N ATOM 525 CA PHE A 53 -12.376 11.994 -12.431 1.00 0.00 C ATOM 526 C PHE A 53 -13.474 11.144 -13.072 1.00 0.00 C ATOM 527 O PHE A 53 -13.932 11.442 -14.174 1.00 0.00 O ATOM 528 CB PHE A 53 -12.972 12.778 -11.261 1.00 0.00 C ATOM 529 CG PHE A 53 -12.100 12.780 -10.004 1.00 0.00 C ATOM 530 CD1 PHE A 53 -10.815 13.224 -10.069 1.00 0.00 C ATOM 531 CD2 PHE A 53 -12.608 12.340 -8.822 1.00 0.00 C ATOM 532 CE1 PHE A 53 -10.005 13.226 -8.903 1.00 0.00 C ATOM 533 CE2 PHE A 53 -11.797 12.342 -7.656 1.00 0.00 C ATOM 534 CZ PHE A 53 -10.513 12.785 -7.721 1.00 0.00 C ATOM 0 H PHE A 53 -12.566 13.476 -13.900 1.00 0.00 H new ATOM 0 HA PHE A 53 -11.578 11.325 -12.108 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -13.140 13.808 -11.576 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -13.947 12.357 -11.014 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -10.412 13.575 -11.007 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -13.628 11.989 -8.770 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -8.985 13.578 -8.955 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -12.200 11.992 -6.717 1.00 0.00 H new ATOM 0 HZ PHE A 53 -9.897 12.787 -6.834 1.00 0.00 H new ATOM 543 N SER A 54 -13.868 10.102 -12.354 1.00 0.00 N ATOM 544 CA SER A 54 -14.904 9.206 -12.840 1.00 0.00 C ATOM 545 C SER A 54 -14.354 8.329 -13.966 1.00 0.00 C ATOM 546 O SER A 54 -13.164 8.385 -14.276 1.00 0.00 O ATOM 547 CB SER A 54 -16.125 9.990 -13.326 1.00 0.00 C ATOM 548 OG SER A 54 -17.287 9.702 -12.552 1.00 0.00 O ATOM 0 H SER A 54 -13.488 9.858 -11.439 1.00 0.00 H new ATOM 0 HA SER A 54 -15.219 8.568 -12.014 1.00 0.00 H new ATOM 0 HB2 SER A 54 -15.913 11.058 -13.278 1.00 0.00 H new ATOM 0 HB3 SER A 54 -16.317 9.750 -14.372 1.00 0.00 H new ATOM 0 HG SER A 54 -18.044 10.223 -12.892 1.00 0.00 H new ATOM 553 N GLY A 55 -15.245 7.541 -14.549 1.00 0.00 N ATOM 554 CA GLY A 55 -14.862 6.654 -15.634 1.00 0.00 C ATOM 555 C GLY A 55 -16.032 5.759 -16.048 1.00 0.00 C ATOM 556 O GLY A 55 -17.036 5.678 -15.343 1.00 0.00 O ATOM 0 H GLY A 55 -16.231 7.498 -14.291 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -14.529 7.242 -16.489 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -14.019 6.037 -15.324 1.00 0.00 H new ATOM 560 N PRO A 56 -15.858 5.091 -17.220 1.00 0.00 N ATOM 561 CA PRO A 56 -16.888 4.206 -17.737 1.00 0.00 C ATOM 562 C PRO A 56 -16.923 2.891 -16.954 1.00 0.00 C ATOM 563 O PRO A 56 -17.829 2.666 -16.152 1.00 0.00 O ATOM 564 CB PRO A 56 -16.541 4.013 -19.204 1.00 0.00 C ATOM 565 CG PRO A 56 -15.083 4.417 -19.345 1.00 0.00 C ATOM 566 CD PRO A 56 -14.682 5.162 -18.081 1.00 0.00 C ATOM 0 HA PRO A 56 -17.891 4.619 -17.630 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.690 2.977 -19.507 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -17.179 4.626 -19.840 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.455 3.537 -19.485 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.945 5.050 -20.221 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -13.816 4.700 -17.607 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.413 6.195 -18.299 1.00 0.00 H new ATOM 571 N TYR A 57 -15.926 2.057 -17.213 1.00 0.00 N ATOM 572 CA TYR A 57 -15.832 0.772 -16.543 1.00 0.00 C ATOM 573 C TYR A 57 -15.414 0.945 -15.082 1.00 0.00 C ATOM 574 O TYR A 57 -14.901 1.996 -14.699 1.00 0.00 O ATOM 575 CB TYR A 57 -14.746 -0.012 -17.283 1.00 0.00 C ATOM 576 CG TYR A 57 -13.453 0.776 -17.506 1.00 0.00 C ATOM 577 CD1 TYR A 57 -12.505 0.844 -16.506 1.00 0.00 C ATOM 578 CD2 TYR A 57 -13.237 1.422 -18.707 1.00 0.00 C ATOM 579 CE1 TYR A 57 -11.288 1.586 -16.716 1.00 0.00 C ATOM 580 CE2 TYR A 57 -12.020 2.163 -18.917 1.00 0.00 C ATOM 581 CZ TYR A 57 -11.106 2.209 -17.911 1.00 0.00 C ATOM 582 OH TYR A 57 -9.957 2.909 -18.110 1.00 0.00 O ATOM 0 H TYR A 57 -15.176 2.247 -17.878 1.00 0.00 H new ATOM 0 HA TYR A 57 -16.796 0.262 -16.554 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -14.516 -0.916 -16.719 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -15.137 -0.331 -18.249 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -12.675 0.341 -15.566 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -13.980 1.372 -19.489 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -10.537 1.646 -15.942 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -11.837 2.671 -19.852 1.00 0.00 H new ATOM 0 HH TYR A 57 -9.963 3.300 -19.009 1.00 0.00 H new ATOM 591 N THR A 58 -15.647 -0.103 -14.305 1.00 0.00 N ATOM 592 CA THR A 58 -15.301 -0.080 -12.893 1.00 0.00 C ATOM 593 C THR A 58 -13.902 -0.662 -12.679 1.00 0.00 C ATOM 594 O THR A 58 -13.748 -1.871 -12.513 1.00 0.00 O ATOM 595 CB THR A 58 -16.394 -0.825 -12.126 1.00 0.00 C ATOM 596 OG1 THR A 58 -16.042 -0.644 -10.757 1.00 0.00 O ATOM 597 CG2 THR A 58 -16.326 -2.340 -12.332 1.00 0.00 C ATOM 0 H THR A 58 -16.071 -0.973 -14.626 1.00 0.00 H new ATOM 0 HA THR A 58 -15.256 0.940 -12.512 1.00 0.00 H new ATOM 0 HB THR A 58 -17.372 -0.460 -12.441 1.00 0.00 H new ATOM 0 HG1 THR A 58 -16.700 -1.095 -10.188 1.00 0.00 H new ATOM 0 HG21 THR A 58 -17.124 -2.820 -11.766 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.444 -2.569 -13.391 1.00 0.00 H new ATOM 0 HG23 THR A 58 -15.361 -2.711 -11.986 1.00 0.00 H new ATOM 605 N TYR A 59 -12.919 0.225 -12.688 1.00 0.00 N ATOM 606 CA TYR A 59 -11.538 -0.187 -12.496 1.00 0.00 C ATOM 607 C TYR A 59 -11.065 0.129 -11.076 1.00 0.00 C ATOM 608 O TYR A 59 -11.725 0.868 -10.347 1.00 0.00 O ATOM 609 CB TYR A 59 -10.712 0.634 -13.490 1.00 0.00 C ATOM 610 CG TYR A 59 -10.897 2.146 -13.354 1.00 0.00 C ATOM 611 CD1 TYR A 59 -11.941 2.775 -14.003 1.00 0.00 C ATOM 612 CD2 TYR A 59 -10.021 2.883 -12.582 1.00 0.00 C ATOM 613 CE1 TYR A 59 -12.115 4.198 -13.876 1.00 0.00 C ATOM 614 CE2 TYR A 59 -10.196 4.307 -12.455 1.00 0.00 C ATOM 615 CZ TYR A 59 -11.234 4.893 -13.108 1.00 0.00 C ATOM 616 OH TYR A 59 -11.398 6.238 -12.988 1.00 0.00 O ATOM 0 H TYR A 59 -13.050 1.227 -12.825 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.432 -1.261 -12.650 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -9.657 0.394 -13.356 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -10.980 0.335 -14.503 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -12.627 2.199 -14.606 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -9.205 2.392 -12.073 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -12.927 4.702 -14.379 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.518 4.896 -11.855 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.110 6.524 -12.096 1.00 0.00 H new ATOM 625 N CYS A 60 -9.926 -0.449 -10.724 1.00 0.00 N ATOM 626 CA CYS A 60 -9.356 -0.239 -9.403 1.00 0.00 C ATOM 627 C CYS A 60 -9.522 1.238 -9.038 1.00 0.00 C ATOM 628 O CYS A 60 -9.245 2.117 -9.852 1.00 0.00 O ATOM 629 CB CYS A 60 -7.893 -0.683 -9.342 1.00 0.00 C ATOM 630 SG CYS A 60 -7.549 -2.303 -10.117 1.00 0.00 S ATOM 0 H CYS A 60 -9.382 -1.063 -11.330 1.00 0.00 H new ATOM 0 HA CYS A 60 -9.884 -0.853 -8.673 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.278 0.074 -9.828 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.584 -0.723 -8.298 1.00 0.00 H new ATOM 634 N ASN A 61 -9.973 1.463 -7.813 1.00 0.00 N ATOM 635 CA ASN A 61 -10.178 2.819 -7.330 1.00 0.00 C ATOM 636 C ASN A 61 -8.955 3.259 -6.525 1.00 0.00 C ATOM 637 O ASN A 61 -8.060 2.457 -6.260 1.00 0.00 O ATOM 638 CB ASN A 61 -11.400 2.897 -6.414 1.00 0.00 C ATOM 639 CG ASN A 61 -11.880 4.343 -6.260 1.00 0.00 C ATOM 640 OD1 ASN A 61 -12.296 4.990 -7.207 1.00 0.00 O ATOM 641 ND2 ASN A 61 -11.796 4.810 -5.019 1.00 0.00 N ATOM 0 H ASN A 61 -10.202 0.731 -7.141 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.332 3.466 -8.194 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.204 2.285 -6.822 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.152 2.486 -5.435 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -12.090 5.765 -4.812 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -11.438 4.214 -4.273 1.00 0.00 H new ATOM 647 N THR A 62 -8.955 4.532 -6.156 1.00 0.00 N ATOM 648 CA THR A 62 -7.857 5.089 -5.385 1.00 0.00 C ATOM 649 C THR A 62 -8.095 4.881 -3.888 1.00 0.00 C ATOM 650 O THR A 62 -9.175 5.183 -3.381 1.00 0.00 O ATOM 651 CB THR A 62 -7.701 6.559 -5.778 1.00 0.00 C ATOM 652 OG1 THR A 62 -6.735 7.063 -4.860 1.00 0.00 O ATOM 653 CG2 THR A 62 -8.958 7.380 -5.484 1.00 0.00 C ATOM 0 H THR A 62 -9.699 5.194 -6.377 1.00 0.00 H new ATOM 0 HA THR A 62 -6.920 4.578 -5.606 1.00 0.00 H new ATOM 0 HB THR A 62 -7.463 6.628 -6.839 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.861 8.029 -4.750 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.794 8.416 -5.782 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.799 6.971 -6.043 1.00 0.00 H new ATOM 0 HG23 THR A 62 -9.178 7.339 -4.417 1.00 0.00 H new ATOM 661 N THR A 63 -7.071 4.367 -3.223 1.00 0.00 N ATOM 662 CA THR A 63 -7.156 4.116 -1.795 1.00 0.00 C ATOM 663 C THR A 63 -5.766 3.842 -1.218 1.00 0.00 C ATOM 664 O THR A 63 -4.783 3.787 -1.956 1.00 0.00 O ATOM 665 CB THR A 63 -8.142 2.966 -1.575 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.717 3.241 -0.300 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.440 1.620 -1.385 1.00 0.00 C ATOM 0 H THR A 63 -6.178 4.117 -3.647 1.00 0.00 H new ATOM 0 HA THR A 63 -7.529 4.990 -1.261 1.00 0.00 H new ATOM 0 HB THR A 63 -8.822 2.903 -2.425 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.370 2.545 -0.079 1.00 0.00 H new ATOM 0 HG21 THR A 63 -8.185 0.839 -1.233 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.849 1.390 -2.271 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.785 1.671 -0.515 1.00 0.00 H new ATOM 675 N LEU A 64 -5.728 3.678 0.097 1.00 0.00 N ATOM 676 CA LEU A 64 -4.475 3.412 0.782 1.00 0.00 C ATOM 677 C LEU A 64 -4.546 2.038 1.451 1.00 0.00 C ATOM 678 O LEU A 64 -5.628 1.573 1.806 1.00 0.00 O ATOM 679 CB LEU A 64 -4.139 4.551 1.747 1.00 0.00 C ATOM 680 CG LEU A 64 -3.535 5.808 1.118 1.00 0.00 C ATOM 681 CD1 LEU A 64 -3.795 7.037 1.991 1.00 0.00 C ATOM 682 CD2 LEU A 64 -2.045 5.614 0.828 1.00 0.00 C ATOM 0 H LEU A 64 -6.545 3.724 0.706 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.651 3.377 0.069 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -5.050 4.835 2.274 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.442 4.173 2.495 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.028 5.983 0.162 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.355 7.917 1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.869 7.184 2.102 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.346 6.887 2.973 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.640 6.522 0.381 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.518 5.401 1.758 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.914 4.781 0.138 1.00 0.00 H new ATOM 693 N ASP A 65 -3.380 1.429 1.605 1.00 0.00 N ATOM 694 CA ASP A 65 -3.297 0.119 2.227 1.00 0.00 C ATOM 695 C ASP A 65 -2.028 0.041 3.077 1.00 0.00 C ATOM 696 O ASP A 65 -1.534 1.061 3.557 1.00 0.00 O ATOM 697 CB ASP A 65 -3.227 -0.987 1.172 1.00 0.00 C ATOM 698 CG ASP A 65 -3.922 -2.296 1.560 1.00 0.00 C ATOM 699 OD1 ASP A 65 -5.151 -2.368 1.350 1.00 0.00 O ATOM 700 OD2 ASP A 65 -3.206 -3.192 2.057 1.00 0.00 O ATOM 0 H ASP A 65 -2.485 1.819 1.310 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.188 -0.020 2.839 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.672 -0.616 0.249 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -2.179 -1.199 0.958 1.00 0.00 H new ATOM 704 N GLN A 66 -1.535 -1.178 3.238 1.00 0.00 N ATOM 705 CA GLN A 66 -0.332 -1.401 4.023 1.00 0.00 C ATOM 706 C GLN A 66 0.758 -0.409 3.617 1.00 0.00 C ATOM 707 O GLN A 66 1.612 -0.052 4.428 1.00 0.00 O ATOM 708 CB GLN A 66 0.157 -2.843 3.878 1.00 0.00 C ATOM 709 CG GLN A 66 0.166 -3.559 5.231 1.00 0.00 C ATOM 710 CD GLN A 66 -1.199 -3.455 5.914 1.00 0.00 C ATOM 711 OE1 GLN A 66 -1.445 -2.588 6.737 1.00 0.00 O ATOM 712 NE2 GLN A 66 -2.068 -4.384 5.530 1.00 0.00 N ATOM 0 H GLN A 66 -1.946 -2.022 2.839 1.00 0.00 H new ATOM 0 HA GLN A 66 -0.571 -1.237 5.074 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.487 -3.381 3.182 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.161 -2.849 3.453 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.427 -4.608 5.090 1.00 0.00 H new ATOM 0 HG3 GLN A 66 0.932 -3.123 5.872 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -1.796 -5.081 4.836 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -3.007 -4.400 5.929 1.00 0.00 H new ATOM 719 N ILE A 67 0.695 0.011 2.361 1.00 0.00 N ATOM 720 CA ILE A 67 1.667 0.956 1.837 1.00 0.00 C ATOM 721 C ILE A 67 0.981 2.301 1.589 1.00 0.00 C ATOM 722 O ILE A 67 0.164 2.426 0.678 1.00 0.00 O ATOM 723 CB ILE A 67 2.360 0.380 0.600 1.00 0.00 C ATOM 724 CG1 ILE A 67 3.451 1.326 0.094 1.00 0.00 C ATOM 725 CG2 ILE A 67 1.343 0.044 -0.491 1.00 0.00 C ATOM 726 CD1 ILE A 67 4.830 0.669 0.185 1.00 0.00 C ATOM 0 H ILE A 67 -0.014 -0.286 1.691 1.00 0.00 H new ATOM 0 HA ILE A 67 2.459 1.132 2.564 1.00 0.00 H new ATOM 0 HB ILE A 67 2.847 -0.553 0.884 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.245 1.606 -0.939 1.00 0.00 H new ATOM 0 HG13 ILE A 67 3.442 2.245 0.681 1.00 0.00 H new ATOM 0 HG21 ILE A 67 1.862 -0.363 -1.359 1.00 0.00 H new ATOM 0 HG22 ILE A 67 0.634 -0.693 -0.113 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.807 0.948 -0.780 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.588 1.362 -0.181 1.00 0.00 H new ATOM 0 HD12 ILE A 67 5.043 0.413 1.223 1.00 0.00 H new ATOM 0 HD13 ILE A 67 4.843 -0.236 -0.422 1.00 0.00 H new ATOM 737 N GLY A 68 1.340 3.272 2.415 1.00 0.00 N ATOM 738 CA GLY A 68 0.769 4.604 2.296 1.00 0.00 C ATOM 739 C GLY A 68 0.873 5.119 0.860 1.00 0.00 C ATOM 740 O GLY A 68 0.328 6.171 0.532 1.00 0.00 O ATOM 0 H GLY A 68 2.018 3.164 3.169 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -0.276 4.584 2.604 1.00 0.00 H new ATOM 0 HA3 GLY A 68 1.287 5.287 2.969 1.00 0.00 H new ATOM 744 N THR A 69 1.578 4.353 0.040 1.00 0.00 N ATOM 745 CA THR A 69 1.761 4.718 -1.354 1.00 0.00 C ATOM 746 C THR A 69 0.413 4.763 -2.076 1.00 0.00 C ATOM 747 O THR A 69 0.110 3.889 -2.888 1.00 0.00 O ATOM 748 CB THR A 69 2.751 3.732 -1.977 1.00 0.00 C ATOM 749 OG1 THR A 69 3.828 3.687 -1.044 1.00 0.00 O ATOM 750 CG2 THR A 69 3.389 4.271 -3.258 1.00 0.00 C ATOM 0 H THR A 69 2.029 3.481 0.315 1.00 0.00 H new ATOM 0 HA THR A 69 2.178 5.721 -1.447 1.00 0.00 H new ATOM 0 HB THR A 69 2.240 2.794 -2.195 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.581 3.199 -1.437 1.00 0.00 H new ATOM 0 HG21 THR A 69 4.083 3.531 -3.658 1.00 0.00 H new ATOM 0 HG22 THR A 69 2.611 4.475 -3.994 1.00 0.00 H new ATOM 0 HG23 THR A 69 3.928 5.192 -3.036 1.00 0.00 H new ATOM 758 N CYS A 70 -0.362 5.788 -1.753 1.00 0.00 N ATOM 759 CA CYS A 70 -1.671 5.957 -2.361 1.00 0.00 C ATOM 760 C CYS A 70 -1.571 5.562 -3.835 1.00 0.00 C ATOM 761 O CYS A 70 -0.704 6.053 -4.556 1.00 0.00 O ATOM 762 CB CYS A 70 -2.195 7.384 -2.186 1.00 0.00 C ATOM 763 SG CYS A 70 -1.775 8.528 -3.552 1.00 0.00 S ATOM 0 H CYS A 70 -0.109 6.510 -1.078 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.393 5.311 -1.862 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -3.279 7.348 -2.081 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -1.798 7.790 -1.256 1.00 0.00 H new ATOM 767 N TRP A 71 -2.471 4.678 -4.241 1.00 0.00 N ATOM 768 CA TRP A 71 -2.496 4.212 -5.616 1.00 0.00 C ATOM 769 C TRP A 71 -3.620 4.949 -6.346 1.00 0.00 C ATOM 770 O TRP A 71 -4.793 4.789 -6.009 1.00 0.00 O ATOM 771 CB TRP A 71 -2.641 2.690 -5.677 1.00 0.00 C ATOM 772 CG TRP A 71 -1.631 1.934 -4.810 1.00 0.00 C ATOM 773 CD1 TRP A 71 -1.765 1.547 -3.534 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.319 1.486 -5.212 1.00 0.00 C ATOM 775 NE1 TRP A 71 -0.640 0.885 -3.085 1.00 0.00 N ATOM 776 CE2 TRP A 71 0.266 0.846 -4.138 1.00 0.00 C ATOM 777 CE3 TRP A 71 0.349 1.615 -6.441 1.00 0.00 C ATOM 778 CZ2 TRP A 71 1.549 0.287 -4.185 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.630 1.050 -6.473 1.00 0.00 C ATOM 780 CH2 TRP A 71 2.234 0.404 -5.401 1.00 0.00 C ATOM 0 H TRP A 71 -3.189 4.272 -3.640 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.553 4.435 -6.115 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.649 2.418 -5.363 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.531 2.366 -6.712 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -2.643 1.730 -2.932 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -0.500 0.496 -2.152 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.091 2.111 -7.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 1.986 -0.207 -3.330 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.187 1.121 -7.395 1.00 0.00 H new ATOM 0 HH2 TRP A 71 3.228 -0.006 -5.505 1.00 0.00 H new ATOM 790 N PRO A 72 -3.214 5.762 -7.357 1.00 0.00 N ATOM 791 CA PRO A 72 -4.174 6.524 -8.137 1.00 0.00 C ATOM 792 C PRO A 72 -4.923 5.621 -9.118 1.00 0.00 C ATOM 793 O PRO A 72 -4.654 5.644 -10.318 1.00 0.00 O ATOM 794 CB PRO A 72 -3.353 7.600 -8.828 1.00 0.00 C ATOM 795 CG PRO A 72 -1.912 7.120 -8.781 1.00 0.00 C ATOM 796 CD PRO A 72 -1.834 5.976 -7.783 1.00 0.00 C ATOM 0 HA PRO A 72 -4.955 6.971 -7.523 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.684 7.743 -9.857 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.462 8.559 -8.322 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.588 6.789 -9.767 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.249 7.932 -8.483 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.417 5.079 -8.241 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.194 6.230 -6.938 1.00 0.00 H new ATOM 801 N GLN A 73 -5.850 4.847 -8.572 1.00 0.00 N ATOM 802 CA GLN A 73 -6.640 3.938 -9.384 1.00 0.00 C ATOM 803 C GLN A 73 -5.726 3.053 -10.233 1.00 0.00 C ATOM 804 O GLN A 73 -4.514 3.262 -10.270 1.00 0.00 O ATOM 805 CB GLN A 73 -7.630 4.707 -10.262 1.00 0.00 C ATOM 806 CG GLN A 73 -8.955 4.929 -9.529 1.00 0.00 C ATOM 807 CD GLN A 73 -9.434 6.374 -9.691 1.00 0.00 C ATOM 808 OE1 GLN A 73 -10.475 6.649 -10.265 1.00 0.00 O ATOM 809 NE2 GLN A 73 -8.620 7.277 -9.154 1.00 0.00 N ATOM 0 H GLN A 73 -6.071 4.831 -7.576 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.218 3.296 -8.719 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -7.201 5.668 -10.544 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -7.809 4.155 -11.185 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.710 4.246 -9.919 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.833 4.699 -8.471 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.764 6.978 -8.687 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.852 8.269 -9.208 1.00 0.00 H new ATOM 816 N SER A 74 -6.340 2.084 -10.895 1.00 0.00 N ATOM 817 CA SER A 74 -5.597 1.167 -11.742 1.00 0.00 C ATOM 818 C SER A 74 -6.538 0.510 -12.754 1.00 0.00 C ATOM 819 O SER A 74 -7.604 1.044 -13.054 1.00 0.00 O ATOM 820 CB SER A 74 -4.886 0.100 -10.907 1.00 0.00 C ATOM 821 OG SER A 74 -4.268 0.654 -9.748 1.00 0.00 O ATOM 0 H SER A 74 -7.345 1.914 -10.862 1.00 0.00 H new ATOM 0 HA SER A 74 -4.837 1.736 -12.278 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.604 -0.663 -10.606 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.132 -0.396 -11.518 1.00 0.00 H new ATOM 0 HG SER A 74 -4.191 -0.036 -9.057 1.00 0.00 H new ATOM 826 N ALA A 75 -6.108 -0.640 -13.253 1.00 0.00 N ATOM 827 CA ALA A 75 -6.898 -1.376 -14.224 1.00 0.00 C ATOM 828 C ALA A 75 -7.028 -2.832 -13.773 1.00 0.00 C ATOM 829 O ALA A 75 -6.162 -3.345 -13.065 1.00 0.00 O ATOM 830 CB ALA A 75 -6.255 -1.249 -15.607 1.00 0.00 C ATOM 0 H ALA A 75 -5.222 -1.080 -13.003 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.904 -0.962 -14.292 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -6.848 -1.801 -16.336 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.214 -0.198 -15.894 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.245 -1.657 -15.577 1.00 0.00 H new ATOM 836 N PRO A 76 -8.145 -3.473 -14.212 1.00 0.00 N ATOM 837 CA PRO A 76 -8.398 -4.860 -13.861 1.00 0.00 C ATOM 838 C PRO A 76 -7.499 -5.803 -14.663 1.00 0.00 C ATOM 839 O PRO A 76 -7.274 -5.587 -15.854 1.00 0.00 O ATOM 840 CB PRO A 76 -9.878 -5.071 -14.138 1.00 0.00 C ATOM 841 CG PRO A 76 -10.294 -3.942 -15.066 1.00 0.00 C ATOM 842 CD PRO A 76 -9.190 -2.897 -15.052 1.00 0.00 C ATOM 0 HA PRO A 76 -8.165 -5.079 -12.819 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.054 -6.042 -14.601 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.455 -5.049 -13.214 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.452 -4.317 -16.077 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.237 -3.505 -14.737 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.823 -2.695 -16.058 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.546 -1.950 -14.647 1.00 0.00 H new ATOM 847 N GLY A 77 -7.010 -6.826 -13.980 1.00 0.00 N ATOM 848 CA GLY A 77 -6.139 -7.802 -14.615 1.00 0.00 C ATOM 849 C GLY A 77 -4.771 -7.195 -14.930 1.00 0.00 C ATOM 850 O GLY A 77 -4.043 -7.705 -15.780 1.00 0.00 O ATOM 0 H GLY A 77 -7.200 -7.001 -12.993 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.016 -8.665 -13.960 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.601 -8.163 -15.534 1.00 0.00 H new ATOM 854 N ALA A 78 -4.464 -6.113 -14.230 1.00 0.00 N ATOM 855 CA ALA A 78 -3.197 -5.430 -14.425 1.00 0.00 C ATOM 856 C ALA A 78 -2.484 -5.292 -13.078 1.00 0.00 C ATOM 857 O ALA A 78 -3.121 -5.342 -12.027 1.00 0.00 O ATOM 858 CB ALA A 78 -3.443 -4.078 -15.096 1.00 0.00 C ATOM 0 H ALA A 78 -5.071 -5.692 -13.527 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.548 -6.007 -15.084 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.492 -3.566 -15.242 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.924 -4.233 -16.062 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.089 -3.470 -14.463 1.00 0.00 H new ATOM 864 N LEU A 79 -1.172 -5.120 -13.153 1.00 0.00 N ATOM 865 CA LEU A 79 -0.366 -4.974 -11.954 1.00 0.00 C ATOM 866 C LEU A 79 0.415 -3.660 -12.026 1.00 0.00 C ATOM 867 O LEU A 79 1.330 -3.523 -12.837 1.00 0.00 O ATOM 868 CB LEU A 79 0.518 -6.206 -11.749 1.00 0.00 C ATOM 869 CG LEU A 79 0.550 -7.208 -12.904 1.00 0.00 C ATOM 870 CD1 LEU A 79 -0.842 -7.786 -13.169 1.00 0.00 C ATOM 871 CD2 LEU A 79 1.157 -6.576 -14.160 1.00 0.00 C ATOM 0 H LEU A 79 -0.647 -5.079 -14.027 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.003 -4.918 -11.071 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.537 -5.870 -11.558 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.180 -6.726 -10.852 1.00 0.00 H new ATOM 0 HG LEU A 79 1.194 -8.040 -12.617 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.790 -8.495 -13.995 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.201 -8.296 -12.275 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.528 -6.979 -13.426 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.168 -7.309 -14.967 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.559 -5.716 -14.460 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.176 -6.253 -13.949 1.00 0.00 H new ATOM 882 N VAL A 80 0.027 -2.730 -11.167 1.00 0.00 N ATOM 883 CA VAL A 80 0.680 -1.432 -11.125 1.00 0.00 C ATOM 884 C VAL A 80 2.105 -1.602 -10.595 1.00 0.00 C ATOM 885 O VAL A 80 2.445 -1.080 -9.535 1.00 0.00 O ATOM 886 CB VAL A 80 -0.153 -0.454 -10.294 1.00 0.00 C ATOM 887 CG1 VAL A 80 0.595 0.865 -10.087 1.00 0.00 C ATOM 888 CG2 VAL A 80 -1.520 -0.214 -10.938 1.00 0.00 C ATOM 0 H VAL A 80 -0.731 -2.849 -10.495 1.00 0.00 H new ATOM 0 HA VAL A 80 0.752 -1.008 -12.126 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.318 -0.903 -9.314 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.019 1.542 -9.493 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.533 0.674 -9.565 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.805 1.320 -11.055 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.092 0.485 -10.328 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.384 0.203 -11.936 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.059 -1.159 -11.010 1.00 0.00 H new ATOM 898 N GLU A 81 2.904 -2.334 -11.360 1.00 0.00 N ATOM 899 CA GLU A 81 4.284 -2.578 -10.982 1.00 0.00 C ATOM 900 C GLU A 81 5.137 -1.336 -11.253 1.00 0.00 C ATOM 901 O GLU A 81 5.088 -0.771 -12.344 1.00 0.00 O ATOM 902 CB GLU A 81 4.846 -3.798 -11.715 1.00 0.00 C ATOM 903 CG GLU A 81 4.688 -3.649 -13.229 1.00 0.00 C ATOM 904 CD GLU A 81 5.667 -4.558 -13.975 1.00 0.00 C ATOM 905 OE1 GLU A 81 5.345 -5.759 -14.100 1.00 0.00 O ATOM 906 OE2 GLU A 81 6.716 -4.030 -14.403 1.00 0.00 O ATOM 0 H GLU A 81 2.620 -2.765 -12.240 1.00 0.00 H new ATOM 0 HA GLU A 81 4.315 -2.790 -9.913 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.900 -3.922 -11.466 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.331 -4.698 -11.379 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.666 -3.895 -13.517 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.859 -2.611 -13.516 1.00 0.00 H new ATOM 911 N ARG A 82 5.899 -0.949 -10.240 1.00 0.00 N ATOM 912 CA ARG A 82 6.760 0.215 -10.355 1.00 0.00 C ATOM 913 C ARG A 82 8.166 -0.112 -9.848 1.00 0.00 C ATOM 914 O ARG A 82 8.505 0.191 -8.705 1.00 0.00 O ATOM 915 CB ARG A 82 6.201 1.395 -9.558 1.00 0.00 C ATOM 916 CG ARG A 82 6.451 2.718 -10.288 1.00 0.00 C ATOM 917 CD ARG A 82 5.133 3.425 -10.608 1.00 0.00 C ATOM 918 NE ARG A 82 4.248 2.523 -11.379 1.00 0.00 N ATOM 919 CZ ARG A 82 4.346 2.322 -12.700 1.00 0.00 C ATOM 920 NH1 ARG A 82 5.292 2.959 -13.405 1.00 0.00 N ATOM 921 NH2 ARG A 82 3.501 1.485 -13.315 1.00 0.00 N ATOM 0 H ARG A 82 5.938 -1.421 -9.337 1.00 0.00 H new ATOM 0 HA ARG A 82 6.804 0.491 -11.409 1.00 0.00 H new ATOM 0 HB2 ARG A 82 5.131 1.258 -9.402 1.00 0.00 H new ATOM 0 HB3 ARG A 82 6.666 1.426 -8.573 1.00 0.00 H new ATOM 0 HG2 ARG A 82 7.075 3.365 -9.672 1.00 0.00 H new ATOM 0 HG3 ARG A 82 7.000 2.530 -11.210 1.00 0.00 H new ATOM 0 HD2 ARG A 82 4.640 3.729 -9.684 1.00 0.00 H new ATOM 0 HD3 ARG A 82 5.327 4.333 -11.179 1.00 0.00 H new ATOM 0 HE ARG A 82 3.517 2.023 -10.873 1.00 0.00 H new ATOM 0 HH11 ARG A 82 5.936 3.596 -12.936 1.00 0.00 H new ATOM 0 HH12 ARG A 82 5.368 2.807 -14.411 1.00 0.00 H new ATOM 0 HH21 ARG A 82 2.782 1.000 -12.778 1.00 0.00 H new ATOM 0 HH22 ARG A 82 3.576 1.332 -14.321 1.00 0.00 H new ATOM 932 N PRO A 83 8.968 -0.745 -10.747 1.00 0.00 N ATOM 933 CA PRO A 83 10.330 -1.117 -10.402 1.00 0.00 C ATOM 934 C PRO A 83 11.247 0.106 -10.393 1.00 0.00 C ATOM 935 O PRO A 83 11.552 0.666 -11.444 1.00 0.00 O ATOM 936 CB PRO A 83 10.729 -2.152 -11.442 1.00 0.00 C ATOM 937 CG PRO A 83 9.756 -1.979 -12.597 1.00 0.00 C ATOM 938 CD PRO A 83 8.601 -1.121 -12.109 1.00 0.00 C ATOM 0 HA PRO A 83 10.412 -1.529 -9.396 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.757 -1.999 -11.771 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.673 -3.160 -11.031 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.251 -1.506 -13.445 1.00 0.00 H new ATOM 0 HG3 PRO A 83 9.393 -2.948 -12.939 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.466 -0.242 -12.740 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.662 -1.674 -12.128 1.00 0.00 H new ATOM 943 N CYS A 84 11.663 0.486 -9.192 1.00 0.00 N ATOM 944 CA CYS A 84 12.540 1.633 -9.033 1.00 0.00 C ATOM 945 C CYS A 84 13.528 1.649 -10.200 1.00 0.00 C ATOM 946 O CYS A 84 14.532 0.937 -10.180 1.00 0.00 O ATOM 947 CB CYS A 84 13.255 1.614 -7.680 1.00 0.00 C ATOM 948 SG CYS A 84 13.835 -0.035 -7.141 1.00 0.00 S ATOM 0 H CYS A 84 11.408 0.019 -8.321 1.00 0.00 H new ATOM 0 HA CYS A 84 11.950 2.549 -9.046 1.00 0.00 H new ATOM 0 HB2 CYS A 84 14.111 2.287 -7.728 1.00 0.00 H new ATOM 0 HB3 CYS A 84 12.579 2.011 -6.922 1.00 0.00 H new ATOM 952 N PRO A 85 13.203 2.490 -11.218 1.00 0.00 N ATOM 953 CA PRO A 85 14.050 2.608 -12.392 1.00 0.00 C ATOM 954 C PRO A 85 15.310 3.418 -12.080 1.00 0.00 C ATOM 955 O PRO A 85 16.077 3.751 -12.982 1.00 0.00 O ATOM 956 CB PRO A 85 13.171 3.259 -13.449 1.00 0.00 C ATOM 957 CG PRO A 85 12.020 3.903 -12.693 1.00 0.00 C ATOM 958 CD PRO A 85 12.022 3.347 -11.278 1.00 0.00 C ATOM 0 HA PRO A 85 14.421 1.644 -12.741 1.00 0.00 H new ATOM 0 HB2 PRO A 85 13.729 4.002 -14.018 1.00 0.00 H new ATOM 0 HB3 PRO A 85 12.805 2.520 -14.162 1.00 0.00 H new ATOM 0 HG2 PRO A 85 12.133 4.987 -12.677 1.00 0.00 H new ATOM 0 HG3 PRO A 85 11.072 3.688 -13.186 1.00 0.00 H new ATOM 0 HD2 PRO A 85 12.075 4.146 -10.539 1.00 0.00 H new ATOM 0 HD3 PRO A 85 11.112 2.783 -11.073 1.00 0.00 H new ATOM 963 N GLU A 86 15.483 3.713 -10.800 1.00 0.00 N ATOM 964 CA GLU A 86 16.637 4.478 -10.357 1.00 0.00 C ATOM 965 C GLU A 86 17.862 4.128 -11.204 1.00 0.00 C ATOM 966 O GLU A 86 17.952 3.029 -11.748 1.00 0.00 O ATOM 967 CB GLU A 86 16.912 4.243 -8.871 1.00 0.00 C ATOM 968 CG GLU A 86 16.222 5.304 -8.012 1.00 0.00 C ATOM 969 CD GLU A 86 17.034 5.601 -6.749 1.00 0.00 C ATOM 970 OE1 GLU A 86 18.279 5.619 -6.866 1.00 0.00 O ATOM 971 OE2 GLU A 86 16.393 5.804 -5.696 1.00 0.00 O ATOM 0 H GLU A 86 14.843 3.436 -10.055 1.00 0.00 H new ATOM 0 HA GLU A 86 16.419 5.538 -10.489 1.00 0.00 H new ATOM 0 HB2 GLU A 86 16.560 3.252 -8.584 1.00 0.00 H new ATOM 0 HB3 GLU A 86 17.986 4.264 -8.688 1.00 0.00 H new ATOM 0 HG2 GLU A 86 16.095 6.219 -8.590 1.00 0.00 H new ATOM 0 HG3 GLU A 86 15.225 4.961 -7.735 1.00 0.00 H new ATOM 976 N TYR A 87 18.775 5.084 -11.290 1.00 0.00 N ATOM 977 CA TYR A 87 19.991 4.891 -12.060 1.00 0.00 C ATOM 978 C TYR A 87 20.494 3.451 -11.940 1.00 0.00 C ATOM 979 O TYR A 87 20.819 2.817 -12.942 1.00 0.00 O ATOM 980 CB TYR A 87 21.030 5.834 -11.451 1.00 0.00 C ATOM 981 CG TYR A 87 22.244 6.085 -12.349 1.00 0.00 C ATOM 982 CD1 TYR A 87 22.115 6.857 -13.486 1.00 0.00 C ATOM 983 CD2 TYR A 87 23.469 5.540 -12.021 1.00 0.00 C ATOM 984 CE1 TYR A 87 23.257 7.092 -14.330 1.00 0.00 C ATOM 985 CE2 TYR A 87 24.611 5.775 -12.865 1.00 0.00 C ATOM 986 CZ TYR A 87 24.449 6.540 -13.979 1.00 0.00 C ATOM 987 OH TYR A 87 25.528 6.763 -14.775 1.00 0.00 O ATOM 0 H TYR A 87 18.697 5.995 -10.839 1.00 0.00 H new ATOM 0 HA TYR A 87 19.812 5.092 -13.116 1.00 0.00 H new ATOM 0 HB2 TYR A 87 20.553 6.788 -11.227 1.00 0.00 H new ATOM 0 HB3 TYR A 87 21.372 5.418 -10.503 1.00 0.00 H new ATOM 0 HD1 TYR A 87 21.157 7.285 -13.742 1.00 0.00 H new ATOM 0 HD2 TYR A 87 23.571 4.937 -11.131 1.00 0.00 H new ATOM 0 HE1 TYR A 87 23.169 7.694 -15.223 1.00 0.00 H new ATOM 0 HE2 TYR A 87 25.575 5.354 -12.620 1.00 0.00 H new ATOM 0 HH TYR A 87 26.311 6.308 -14.400 1.00 0.00 H new ATOM 996 N PHE A 88 20.542 2.976 -10.703 1.00 0.00 N ATOM 997 CA PHE A 88 21.001 1.623 -10.439 1.00 0.00 C ATOM 998 C PHE A 88 20.445 0.644 -11.476 1.00 0.00 C ATOM 999 O PHE A 88 21.141 -0.278 -11.898 1.00 0.00 O ATOM 1000 CB PHE A 88 20.474 1.235 -9.056 1.00 0.00 C ATOM 1001 CG PHE A 88 19.044 0.690 -9.065 1.00 0.00 C ATOM 1002 CD1 PHE A 88 18.778 -0.512 -9.643 1.00 0.00 C ATOM 1003 CD2 PHE A 88 18.040 1.408 -8.495 1.00 0.00 C ATOM 1004 CE1 PHE A 88 17.452 -1.018 -9.651 1.00 0.00 C ATOM 1005 CE2 PHE A 88 16.713 0.901 -8.503 1.00 0.00 C ATOM 1006 CZ PHE A 88 16.447 -0.300 -9.081 1.00 0.00 C ATOM 0 H PHE A 88 20.271 3.504 -9.874 1.00 0.00 H new ATOM 0 HA PHE A 88 22.089 1.583 -10.487 1.00 0.00 H new ATOM 0 HB2 PHE A 88 21.135 0.484 -8.624 1.00 0.00 H new ATOM 0 HB3 PHE A 88 20.515 2.108 -8.405 1.00 0.00 H new ATOM 0 HD1 PHE A 88 19.576 -1.082 -10.096 1.00 0.00 H new ATOM 0 HD2 PHE A 88 18.251 2.363 -8.037 1.00 0.00 H new ATOM 0 HE1 PHE A 88 17.241 -1.973 -10.109 1.00 0.00 H new ATOM 0 HE2 PHE A 88 15.915 1.470 -8.050 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.438 -0.684 -9.088 1.00 0.00 H new ATOM 1015 N ASN A 89 19.199 0.879 -11.857 1.00 0.00 N ATOM 1016 CA ASN A 89 18.542 0.029 -12.837 1.00 0.00 C ATOM 1017 C ASN A 89 18.956 0.467 -14.243 1.00 0.00 C ATOM 1018 O ASN A 89 19.458 1.574 -14.430 1.00 0.00 O ATOM 1019 CB ASN A 89 17.020 0.144 -12.734 1.00 0.00 C ATOM 1020 CG ASN A 89 16.371 -1.239 -12.649 1.00 0.00 C ATOM 1021 OD1 ASN A 89 16.844 -2.210 -13.215 1.00 0.00 O ATOM 1022 ND2 ASN A 89 15.263 -1.273 -11.914 1.00 0.00 N ATOM 0 H ASN A 89 18.626 1.646 -11.505 1.00 0.00 H new ATOM 0 HA ASN A 89 18.839 -1.002 -12.643 1.00 0.00 H new ATOM 0 HB2 ASN A 89 16.755 0.729 -11.854 1.00 0.00 H new ATOM 0 HB3 ASN A 89 16.632 0.679 -13.601 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.755 -2.150 -11.797 1.00 0.00 H new ATOM 0 HD22 ASN A 89 14.921 -0.422 -11.467 1.00 0.00 H new ATOM 1028 N GLY A 90 18.729 -0.425 -15.196 1.00 0.00 N ATOM 1029 CA GLY A 90 19.072 -0.145 -16.580 1.00 0.00 C ATOM 1030 C GLY A 90 17.981 0.687 -17.257 1.00 0.00 C ATOM 1031 O GLY A 90 17.535 0.357 -18.355 1.00 0.00 O ATOM 0 H GLY A 90 18.312 -1.342 -15.037 1.00 0.00 H new ATOM 0 HA2 GLY A 90 20.021 0.389 -16.622 1.00 0.00 H new ATOM 0 HA3 GLY A 90 19.209 -1.081 -17.121 1.00 0.00 H new ATOM 1035 N ILE A 91 17.582 1.750 -16.574 1.00 0.00 N ATOM 1036 CA ILE A 91 16.552 2.631 -17.095 1.00 0.00 C ATOM 1037 C ILE A 91 16.605 3.967 -16.352 1.00 0.00 C ATOM 1038 O ILE A 91 17.015 4.021 -15.193 1.00 0.00 O ATOM 1039 CB ILE A 91 15.184 1.949 -17.038 1.00 0.00 C ATOM 1040 CG1 ILE A 91 14.103 2.833 -17.666 1.00 0.00 C ATOM 1041 CG2 ILE A 91 14.833 1.545 -15.606 1.00 0.00 C ATOM 1042 CD1 ILE A 91 13.475 3.756 -16.620 1.00 0.00 C ATOM 0 H ILE A 91 17.954 2.021 -15.664 1.00 0.00 H new ATOM 0 HA ILE A 91 16.732 2.845 -18.149 1.00 0.00 H new ATOM 0 HB ILE A 91 15.234 1.034 -17.628 1.00 0.00 H new ATOM 0 HG12 ILE A 91 14.537 3.429 -18.469 1.00 0.00 H new ATOM 0 HG13 ILE A 91 13.331 2.207 -18.114 1.00 0.00 H new ATOM 0 HG21 ILE A 91 13.856 1.062 -15.593 1.00 0.00 H new ATOM 0 HG22 ILE A 91 15.585 0.852 -15.229 1.00 0.00 H new ATOM 0 HG23 ILE A 91 14.808 2.432 -14.973 1.00 0.00 H new ATOM 0 HD11 ILE A 91 12.710 4.373 -17.092 1.00 0.00 H new ATOM 0 HD12 ILE A 91 13.021 3.156 -15.831 1.00 0.00 H new ATOM 0 HD13 ILE A 91 14.245 4.397 -16.191 1.00 0.00 H new ATOM 1053 N LYS A 92 16.183 5.013 -17.049 1.00 0.00 N ATOM 1054 CA LYS A 92 16.178 6.345 -16.468 1.00 0.00 C ATOM 1055 C LYS A 92 14.918 6.520 -15.618 1.00 0.00 C ATOM 1056 O LYS A 92 13.802 6.444 -16.132 1.00 0.00 O ATOM 1057 CB LYS A 92 16.336 7.405 -17.560 1.00 0.00 C ATOM 1058 CG LYS A 92 15.071 7.504 -18.416 1.00 0.00 C ATOM 1059 CD LYS A 92 15.358 8.221 -19.736 1.00 0.00 C ATOM 1060 CE LYS A 92 14.355 7.807 -20.815 1.00 0.00 C ATOM 1061 NZ LYS A 92 14.229 8.867 -21.840 1.00 0.00 N ATOM 0 H LYS A 92 15.843 4.965 -18.009 1.00 0.00 H new ATOM 0 HA LYS A 92 17.032 6.475 -15.803 1.00 0.00 H new ATOM 0 HB2 LYS A 92 16.548 8.372 -17.105 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.189 7.157 -18.192 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.684 6.505 -18.617 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.297 8.041 -17.867 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.311 9.300 -19.586 1.00 0.00 H new ATOM 0 HD3 LYS A 92 16.370 7.989 -20.067 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.678 6.877 -21.283 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.383 7.614 -20.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.545 8.570 -22.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 13.899 9.746 -21.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.155 9.031 -22.285 1.00 0.00 H new ATOM 1071 N TYR A 93 15.138 6.754 -14.333 1.00 0.00 N ATOM 1072 CA TYR A 93 14.034 6.941 -13.406 1.00 0.00 C ATOM 1073 C TYR A 93 13.498 8.372 -13.474 1.00 0.00 C ATOM 1074 O TYR A 93 14.241 9.304 -13.783 1.00 0.00 O ATOM 1075 CB TYR A 93 14.607 6.689 -12.011 1.00 0.00 C ATOM 1076 CG TYR A 93 15.612 7.747 -11.550 1.00 0.00 C ATOM 1077 CD1 TYR A 93 15.174 8.871 -10.880 1.00 0.00 C ATOM 1078 CD2 TYR A 93 16.958 7.577 -11.806 1.00 0.00 C ATOM 1079 CE1 TYR A 93 16.120 9.866 -10.447 1.00 0.00 C ATOM 1080 CE2 TYR A 93 17.904 8.573 -11.373 1.00 0.00 C ATOM 1081 CZ TYR A 93 17.438 9.668 -10.715 1.00 0.00 C ATOM 1082 OH TYR A 93 18.331 10.608 -10.306 1.00 0.00 O ATOM 0 H TYR A 93 16.064 6.818 -13.911 1.00 0.00 H new ATOM 0 HA TYR A 93 13.212 6.267 -13.647 1.00 0.00 H new ATOM 0 HB2 TYR A 93 13.786 6.646 -11.295 1.00 0.00 H new ATOM 0 HB3 TYR A 93 15.092 5.713 -12.000 1.00 0.00 H new ATOM 0 HD1 TYR A 93 14.121 9.004 -10.680 1.00 0.00 H new ATOM 0 HD2 TYR A 93 17.301 6.698 -12.331 1.00 0.00 H new ATOM 0 HE1 TYR A 93 15.790 10.750 -9.921 1.00 0.00 H new ATOM 0 HE2 TYR A 93 18.960 8.453 -11.567 1.00 0.00 H new ATOM 0 HH TYR A 93 19.236 10.334 -10.564 1.00 0.00 H new ATOM 1091 N ASN A 94 12.213 8.504 -13.180 1.00 0.00 N ATOM 1092 CA ASN A 94 11.569 9.806 -13.204 1.00 0.00 C ATOM 1093 C ASN A 94 11.027 10.129 -11.810 1.00 0.00 C ATOM 1094 O ASN A 94 11.340 11.175 -11.245 1.00 0.00 O ATOM 1095 CB ASN A 94 10.394 9.822 -14.183 1.00 0.00 C ATOM 1096 CG ASN A 94 9.660 8.480 -14.182 1.00 0.00 C ATOM 1097 OD1 ASN A 94 8.537 8.357 -13.723 1.00 0.00 O ATOM 1098 ND2 ASN A 94 10.357 7.483 -14.721 1.00 0.00 N ATOM 0 H ASN A 94 11.600 7.730 -12.924 1.00 0.00 H new ATOM 0 HA ASN A 94 12.310 10.542 -13.517 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.702 10.619 -13.912 1.00 0.00 H new ATOM 0 HB3 ASN A 94 10.756 10.042 -15.187 1.00 0.00 H new ATOM 0 HD21 ASN A 94 9.955 6.547 -14.768 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.293 7.655 -15.087 1.00 0.00 H new ATOM 1104 N THR A 95 10.224 9.209 -11.296 1.00 0.00 N ATOM 1105 CA THR A 95 9.635 9.381 -9.978 1.00 0.00 C ATOM 1106 C THR A 95 10.533 8.759 -8.907 1.00 0.00 C ATOM 1107 O THR A 95 11.632 8.295 -9.207 1.00 0.00 O ATOM 1108 CB THR A 95 8.225 8.788 -10.010 1.00 0.00 C ATOM 1109 OG1 THR A 95 7.698 9.078 -8.718 1.00 0.00 O ATOM 1110 CG2 THR A 95 8.234 7.259 -10.074 1.00 0.00 C ATOM 0 H THR A 95 9.967 8.342 -11.768 1.00 0.00 H new ATOM 0 HA THR A 95 9.553 10.436 -9.715 1.00 0.00 H new ATOM 0 HB THR A 95 7.684 9.184 -10.869 1.00 0.00 H new ATOM 0 HG1 THR A 95 6.784 8.730 -8.652 1.00 0.00 H new ATOM 0 HG21 THR A 95 7.209 6.890 -10.095 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.754 6.936 -10.975 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.745 6.861 -9.197 1.00 0.00 H new ATOM 1118 N THR A 96 10.030 8.767 -7.681 1.00 0.00 N ATOM 1119 CA THR A 96 10.773 8.209 -6.564 1.00 0.00 C ATOM 1120 C THR A 96 9.869 7.310 -5.718 1.00 0.00 C ATOM 1121 O THR A 96 9.841 7.428 -4.494 1.00 0.00 O ATOM 1122 CB THR A 96 11.385 9.369 -5.776 1.00 0.00 C ATOM 1123 OG1 THR A 96 12.197 8.732 -4.795 1.00 0.00 O ATOM 1124 CG2 THR A 96 10.343 10.135 -4.958 1.00 0.00 C ATOM 0 H THR A 96 9.117 9.151 -7.437 1.00 0.00 H new ATOM 0 HA THR A 96 11.584 7.568 -6.910 1.00 0.00 H new ATOM 0 HB THR A 96 11.881 10.054 -6.464 1.00 0.00 H new ATOM 0 HG1 THR A 96 11.640 8.151 -4.236 1.00 0.00 H new ATOM 0 HG21 THR A 96 10.830 10.947 -4.418 1.00 0.00 H new ATOM 0 HG22 THR A 96 9.586 10.546 -5.626 1.00 0.00 H new ATOM 0 HG23 THR A 96 9.870 9.458 -4.246 1.00 0.00 H new ATOM 1132 N ARG A 97 9.153 6.432 -6.405 1.00 0.00 N ATOM 1133 CA ARG A 97 8.250 5.513 -5.732 1.00 0.00 C ATOM 1134 C ARG A 97 8.137 4.208 -6.522 1.00 0.00 C ATOM 1135 O ARG A 97 7.547 4.179 -7.601 1.00 0.00 O ATOM 1136 CB ARG A 97 6.858 6.127 -5.573 1.00 0.00 C ATOM 1137 CG ARG A 97 6.874 7.263 -4.548 1.00 0.00 C ATOM 1138 CD ARG A 97 5.461 7.791 -4.293 1.00 0.00 C ATOM 1139 NE ARG A 97 5.524 9.055 -3.525 1.00 0.00 N ATOM 1140 CZ ARG A 97 6.012 10.205 -4.010 1.00 0.00 C ATOM 1141 NH1 ARG A 97 6.483 10.257 -5.263 1.00 0.00 N ATOM 1142 NH2 ARG A 97 6.029 11.302 -3.241 1.00 0.00 N ATOM 0 H ARG A 97 9.180 6.337 -7.420 1.00 0.00 H new ATOM 0 HA ARG A 97 8.660 5.309 -4.743 1.00 0.00 H new ATOM 0 HB2 ARG A 97 6.511 6.505 -6.535 1.00 0.00 H new ATOM 0 HB3 ARG A 97 6.151 5.359 -5.259 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.308 6.908 -3.613 1.00 0.00 H new ATOM 0 HG3 ARG A 97 7.509 8.073 -4.907 1.00 0.00 H new ATOM 0 HD2 ARG A 97 4.949 7.957 -5.241 1.00 0.00 H new ATOM 0 HD3 ARG A 97 4.881 7.050 -3.743 1.00 0.00 H new ATOM 0 HE ARG A 97 5.174 9.050 -2.567 1.00 0.00 H new ATOM 0 HH11 ARG A 97 6.470 9.421 -5.848 1.00 0.00 H new ATOM 0 HH12 ARG A 97 6.854 11.132 -5.632 1.00 0.00 H new ATOM 0 HH21 ARG A 97 5.671 11.262 -2.287 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.400 12.178 -3.610 1.00 0.00 H new ATOM 1153 N ASN A 98 8.711 3.157 -5.954 1.00 0.00 N ATOM 1154 CA ASN A 98 8.682 1.852 -6.590 1.00 0.00 C ATOM 1155 C ASN A 98 7.804 0.907 -5.766 1.00 0.00 C ATOM 1156 O ASN A 98 7.457 1.212 -4.626 1.00 0.00 O ATOM 1157 CB ASN A 98 10.084 1.246 -6.669 1.00 0.00 C ATOM 1158 CG ASN A 98 10.793 1.325 -5.316 1.00 0.00 C ATOM 1159 OD1 ASN A 98 11.534 2.250 -5.027 1.00 0.00 O ATOM 1160 ND2 ASN A 98 10.527 0.305 -4.506 1.00 0.00 N ATOM 0 H ASN A 98 9.199 3.184 -5.059 1.00 0.00 H new ATOM 0 HA ASN A 98 8.286 1.977 -7.598 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.017 0.206 -6.988 1.00 0.00 H new ATOM 0 HB3 ASN A 98 10.670 1.773 -7.422 1.00 0.00 H new ATOM 0 HD21 ASN A 98 10.953 0.265 -3.580 1.00 0.00 H new ATOM 0 HD22 ASN A 98 9.897 -0.437 -4.810 1.00 0.00 H new ATOM 1166 N ALA A 99 7.472 -0.222 -6.375 1.00 0.00 N ATOM 1167 CA ALA A 99 6.643 -1.214 -5.711 1.00 0.00 C ATOM 1168 C ALA A 99 6.067 -2.172 -6.757 1.00 0.00 C ATOM 1169 O ALA A 99 6.416 -2.095 -7.933 1.00 0.00 O ATOM 1170 CB ALA A 99 5.551 -0.509 -4.903 1.00 0.00 C ATOM 0 H ALA A 99 7.762 -0.472 -7.321 1.00 0.00 H new ATOM 0 HA ALA A 99 7.236 -1.805 -5.012 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.929 -1.253 -4.405 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.011 0.138 -4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 99 4.934 0.091 -5.572 1.00 0.00 H new ATOM 1176 N TYR A 100 5.195 -3.052 -6.288 1.00 0.00 N ATOM 1177 CA TYR A 100 4.567 -4.025 -7.167 1.00 0.00 C ATOM 1178 C TYR A 100 3.217 -4.476 -6.610 1.00 0.00 C ATOM 1179 O TYR A 100 3.162 -5.232 -5.641 1.00 0.00 O ATOM 1180 CB TYR A 100 5.515 -5.225 -7.212 1.00 0.00 C ATOM 1181 CG TYR A 100 6.974 -4.857 -7.485 1.00 0.00 C ATOM 1182 CD1 TYR A 100 7.783 -4.430 -6.451 1.00 0.00 C ATOM 1183 CD2 TYR A 100 7.482 -4.952 -8.765 1.00 0.00 C ATOM 1184 CE1 TYR A 100 9.157 -4.083 -6.708 1.00 0.00 C ATOM 1185 CE2 TYR A 100 8.856 -4.605 -9.022 1.00 0.00 C ATOM 1186 CZ TYR A 100 9.625 -4.188 -7.981 1.00 0.00 C ATOM 1187 OH TYR A 100 10.923 -3.860 -8.223 1.00 0.00 O ATOM 0 H TYR A 100 4.908 -3.112 -5.311 1.00 0.00 H new ATOM 0 HA TYR A 100 4.390 -3.595 -8.153 1.00 0.00 H new ATOM 0 HB2 TYR A 100 5.457 -5.756 -6.262 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.175 -5.915 -7.984 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.386 -4.356 -5.449 1.00 0.00 H new ATOM 0 HD2 TYR A 100 6.849 -5.287 -9.574 1.00 0.00 H new ATOM 0 HE1 TYR A 100 9.801 -3.747 -5.909 1.00 0.00 H new ATOM 0 HE2 TYR A 100 9.266 -4.674 -10.019 1.00 0.00 H new ATOM 0 HH TYR A 100 11.177 -3.097 -7.663 1.00 0.00 H new ATOM 1196 N ARG A 101 2.158 -3.993 -7.246 1.00 0.00 N ATOM 1197 CA ARG A 101 0.811 -4.339 -6.825 1.00 0.00 C ATOM 1198 C ARG A 101 0.025 -4.931 -7.997 1.00 0.00 C ATOM 1199 O ARG A 101 0.182 -4.496 -9.136 1.00 0.00 O ATOM 1200 CB ARG A 101 0.070 -3.110 -6.291 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.475 -3.369 -4.884 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.608 -2.397 -4.550 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.628 -3.076 -3.719 1.00 0.00 N ATOM 1204 CZ ARG A 101 -2.574 -3.161 -2.383 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -1.549 -2.612 -1.717 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -3.544 -3.798 -1.712 1.00 0.00 N ATOM 0 H ARG A 101 2.206 -3.366 -8.049 1.00 0.00 H new ATOM 0 HA ARG A 101 0.891 -5.077 -6.027 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.744 -2.254 -6.272 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.750 -2.855 -6.962 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.838 -4.395 -4.813 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.327 -3.263 -4.154 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.211 -1.532 -4.019 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.063 -2.026 -5.468 1.00 0.00 H new ATOM 0 HE ARG A 101 -3.422 -3.506 -4.194 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.809 -2.129 -2.227 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -1.508 -2.677 -0.700 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -4.323 -4.218 -2.219 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -3.503 -3.863 -0.695 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.804 -5.912 -7.675 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.615 -6.569 -8.687 1.00 0.00 C ATOM 1219 C GLU A 102 -3.090 -6.204 -8.502 1.00 0.00 C ATOM 1220 O GLU A 102 -3.523 -5.898 -7.393 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.416 -8.086 -8.650 1.00 0.00 C ATOM 1222 CG GLU A 102 -1.880 -8.668 -7.314 1.00 0.00 C ATOM 1223 CD GLU A 102 -1.708 -10.188 -7.289 1.00 0.00 C ATOM 1224 OE1 GLU A 102 -2.668 -10.875 -7.700 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -0.620 -10.627 -6.858 1.00 0.00 O ATOM 0 H GLU A 102 -0.932 -6.268 -6.728 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.294 -6.218 -9.668 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.972 -8.549 -9.465 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.364 -8.322 -8.808 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -1.309 -8.220 -6.500 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.927 -8.414 -7.146 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.819 -6.251 -9.607 1.00 0.00 N ATOM 1231 CA CYS A 103 -5.236 -5.930 -9.581 1.00 0.00 C ATOM 1232 C CYS A 103 -6.000 -7.074 -10.250 1.00 0.00 C ATOM 1233 O CYS A 103 -5.626 -7.526 -11.331 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.524 -4.583 -10.250 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.162 -3.289 -9.125 1.00 0.00 S ATOM 0 H CYS A 103 -3.456 -6.506 -10.525 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.569 -5.827 -8.548 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.607 -4.221 -10.715 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.248 -4.738 -11.050 1.00 0.00 H new ATOM 1239 N LEU A 104 -7.058 -7.508 -9.582 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.877 -8.591 -10.098 1.00 0.00 C ATOM 1241 C LEU A 104 -8.573 -8.131 -11.381 1.00 0.00 C ATOM 1242 O LEU A 104 -8.562 -6.945 -11.706 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.843 -9.093 -9.022 1.00 0.00 C ATOM 1244 CG LEU A 104 -8.229 -9.965 -7.924 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -9.186 -10.111 -6.740 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.795 -11.322 -8.482 1.00 0.00 C ATOM 0 H LEU A 104 -7.367 -7.129 -8.687 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.255 -9.447 -10.360 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -9.313 -8.229 -8.552 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.635 -9.661 -9.509 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.333 -9.468 -7.553 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.725 -10.735 -5.974 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -9.403 -9.127 -6.324 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -10.113 -10.575 -7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.362 -11.923 -7.682 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.661 -11.839 -8.896 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.053 -11.172 -9.266 1.00 0.00 H new ATOM 1257 N GLU A 105 -9.161 -9.094 -12.075 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.860 -8.803 -13.314 1.00 0.00 C ATOM 1259 C GLU A 105 -11.251 -8.235 -13.020 1.00 0.00 C ATOM 1260 O GLU A 105 -12.014 -7.944 -13.940 1.00 0.00 O ATOM 1261 CB GLU A 105 -9.953 -10.048 -14.198 1.00 0.00 C ATOM 1262 CG GLU A 105 -9.104 -9.890 -15.461 1.00 0.00 C ATOM 1263 CD GLU A 105 -9.560 -10.858 -16.553 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -10.778 -10.859 -16.839 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -8.682 -11.576 -17.080 1.00 0.00 O ATOM 0 H GLU A 105 -9.167 -10.077 -11.802 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.290 -8.051 -13.860 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.619 -10.921 -13.638 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.992 -10.225 -14.474 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.175 -8.865 -15.826 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.056 -10.072 -15.224 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.537 -8.095 -11.734 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.822 -7.568 -11.307 1.00 0.00 C ATOM 1272 C ASN A 106 -12.696 -6.062 -11.066 1.00 0.00 C ATOM 1273 O ASN A 106 -13.679 -5.397 -10.744 1.00 0.00 O ATOM 1274 CB ASN A 106 -13.277 -8.220 -9.999 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.801 -8.343 -9.951 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -15.500 -7.510 -9.396 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -15.276 -9.425 -10.558 1.00 0.00 N ATOM 0 H ASN A 106 -10.901 -8.337 -10.974 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.551 -7.781 -12.089 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.825 -9.207 -9.904 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.929 -7.628 -9.153 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.281 -9.598 -10.579 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -14.636 -10.082 -11.003 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.477 -5.569 -11.230 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.209 -4.155 -11.035 1.00 0.00 C ATOM 1285 C GLY A 107 -11.007 -3.835 -9.553 1.00 0.00 C ATOM 1286 O GLY A 107 -11.360 -2.749 -9.094 1.00 0.00 O ATOM 0 H GLY A 107 -10.664 -6.124 -11.496 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.320 -3.869 -11.597 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.038 -3.566 -11.428 1.00 0.00 H new ATOM 1290 N THR A 108 -10.439 -4.799 -8.844 1.00 0.00 N ATOM 1291 CA THR A 108 -10.186 -4.634 -7.423 1.00 0.00 C ATOM 1292 C THR A 108 -8.700 -4.835 -7.120 1.00 0.00 C ATOM 1293 O THR A 108 -7.966 -5.392 -7.934 1.00 0.00 O ATOM 1294 CB THR A 108 -11.097 -5.601 -6.664 1.00 0.00 C ATOM 1295 OG1 THR A 108 -10.680 -6.890 -7.109 1.00 0.00 O ATOM 1296 CG2 THR A 108 -12.556 -5.506 -7.113 1.00 0.00 C ATOM 0 H THR A 108 -10.147 -5.698 -9.227 1.00 0.00 H new ATOM 0 HA THR A 108 -10.419 -3.621 -7.095 1.00 0.00 H new ATOM 0 HB THR A 108 -11.033 -5.397 -5.595 1.00 0.00 H new ATOM 0 HG1 THR A 108 -11.218 -7.579 -6.665 1.00 0.00 H new ATOM 0 HG21 THR A 108 -13.159 -6.213 -6.543 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.924 -4.494 -6.942 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.626 -5.743 -8.175 1.00 0.00 H new ATOM 1304 N TRP A 109 -8.301 -4.368 -5.945 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.915 -4.489 -5.524 1.00 0.00 C ATOM 1306 C TRP A 109 -6.708 -5.905 -4.982 1.00 0.00 C ATOM 1307 O TRP A 109 -7.589 -6.754 -5.099 1.00 0.00 O ATOM 1308 CB TRP A 109 -6.553 -3.401 -4.511 1.00 0.00 C ATOM 1309 CG TRP A 109 -6.148 -2.070 -5.146 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.708 -0.865 -4.965 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -5.067 -1.854 -6.076 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.068 0.106 -5.708 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.038 -0.515 -6.405 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -4.142 -2.763 -6.622 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.106 0.038 -7.291 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -3.216 -2.194 -7.506 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.175 -0.847 -7.847 1.00 0.00 C ATOM 0 H TRP A 109 -8.913 -3.906 -5.272 1.00 0.00 H new ATOM 0 HA TRP A 109 -6.240 -4.337 -6.367 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -7.406 -3.233 -3.853 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -5.734 -3.758 -3.887 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.553 -0.678 -4.319 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.307 1.097 -5.740 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -4.146 -3.815 -6.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -4.105 1.091 -7.533 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -2.482 -2.848 -7.954 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -2.428 -0.485 -8.538 1.00 0.00 H new ATOM 1327 N ALA A 110 -5.536 -6.115 -4.400 1.00 0.00 N ATOM 1328 CA ALA A 110 -5.202 -7.413 -3.839 1.00 0.00 C ATOM 1329 C ALA A 110 -4.875 -7.252 -2.353 1.00 0.00 C ATOM 1330 O ALA A 110 -5.307 -6.292 -1.719 1.00 0.00 O ATOM 1331 CB ALA A 110 -4.043 -8.027 -4.628 1.00 0.00 C ATOM 0 H ALA A 110 -4.807 -5.408 -4.305 1.00 0.00 H new ATOM 0 HA ALA A 110 -6.048 -8.095 -3.919 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -3.792 -9.001 -4.207 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.336 -8.147 -5.671 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -3.174 -7.371 -4.568 1.00 0.00 H new ATOM 1337 N SER A 111 -4.114 -8.209 -1.840 1.00 0.00 N ATOM 1338 CA SER A 111 -3.725 -8.186 -0.441 1.00 0.00 C ATOM 1339 C SER A 111 -2.988 -6.882 -0.124 1.00 0.00 C ATOM 1340 O SER A 111 -3.487 -6.054 0.637 1.00 0.00 O ATOM 1341 CB SER A 111 -2.845 -9.389 -0.094 1.00 0.00 C ATOM 1342 OG SER A 111 -3.143 -9.912 1.198 1.00 0.00 O ATOM 0 H SER A 111 -3.757 -9.005 -2.369 1.00 0.00 H new ATOM 0 HA SER A 111 -4.629 -8.243 0.166 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.985 -10.169 -0.842 1.00 0.00 H new ATOM 0 HB3 SER A 111 -1.796 -9.095 -0.133 1.00 0.00 H new ATOM 0 HG SER A 111 -2.562 -10.679 1.382 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.815 -6.743 -0.723 1.00 0.00 N ATOM 1348 CA ARG A 112 -1.006 -5.554 -0.514 1.00 0.00 C ATOM 1349 C ARG A 112 0.266 -5.623 -1.360 1.00 0.00 C ATOM 1350 O ARG A 112 0.638 -6.691 -1.843 1.00 0.00 O ATOM 1351 CB ARG A 112 -0.624 -5.400 0.960 1.00 0.00 C ATOM 1352 CG ARG A 112 0.177 -6.609 1.447 1.00 0.00 C ATOM 1353 CD ARG A 112 -0.722 -7.595 2.197 1.00 0.00 C ATOM 1354 NE ARG A 112 -0.348 -7.633 3.628 1.00 0.00 N ATOM 1355 CZ ARG A 112 0.853 -8.017 4.081 1.00 0.00 C ATOM 1356 NH1 ARG A 112 1.804 -8.398 3.217 1.00 0.00 N ATOM 1357 NH2 ARG A 112 1.104 -8.019 5.397 1.00 0.00 N ATOM 0 H ARG A 112 -1.405 -7.433 -1.353 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.600 -4.691 -0.815 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -0.036 -4.492 1.094 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -1.525 -5.289 1.563 1.00 0.00 H new ATOM 0 HG2 ARG A 112 0.641 -7.109 0.597 1.00 0.00 H new ATOM 0 HG3 ARG A 112 0.983 -6.276 2.101 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -1.766 -7.299 2.093 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -0.628 -8.590 1.761 1.00 0.00 H new ATOM 0 HE ARG A 112 -1.049 -7.349 4.313 1.00 0.00 H new ATOM 0 HH11 ARG A 112 1.613 -8.396 2.215 1.00 0.00 H new ATOM 0 HH12 ARG A 112 2.718 -8.690 3.561 1.00 0.00 H new ATOM 0 HH21 ARG A 112 0.381 -7.728 6.055 1.00 0.00 H new ATOM 0 HH22 ARG A 112 2.019 -8.311 5.741 1.00 0.00 H new ATOM 1368 N VAL A 113 0.901 -4.469 -1.513 1.00 0.00 N ATOM 1369 CA VAL A 113 2.124 -4.385 -2.292 1.00 0.00 C ATOM 1370 C VAL A 113 2.982 -5.621 -2.020 1.00 0.00 C ATOM 1371 O VAL A 113 2.990 -6.144 -0.906 1.00 0.00 O ATOM 1372 CB VAL A 113 2.850 -3.073 -1.987 1.00 0.00 C ATOM 1373 CG1 VAL A 113 3.728 -3.210 -0.742 1.00 0.00 C ATOM 1374 CG2 VAL A 113 3.672 -2.609 -3.190 1.00 0.00 C ATOM 0 H VAL A 113 0.591 -3.585 -1.110 1.00 0.00 H new ATOM 0 HA VAL A 113 1.898 -4.375 -3.358 1.00 0.00 H new ATOM 0 HB VAL A 113 2.097 -2.312 -1.783 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.233 -2.264 -0.547 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.107 -3.473 0.114 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.471 -3.991 -0.905 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.178 -1.675 -2.947 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.413 -3.369 -3.439 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.012 -2.453 -4.043 1.00 0.00 H new ATOM 1384 N ASN A 114 3.686 -6.054 -3.056 1.00 0.00 N ATOM 1385 CA ASN A 114 4.547 -7.219 -2.942 1.00 0.00 C ATOM 1386 C ASN A 114 5.900 -6.794 -2.370 1.00 0.00 C ATOM 1387 O ASN A 114 6.333 -7.310 -1.341 1.00 0.00 O ATOM 1388 CB ASN A 114 4.793 -7.858 -4.310 1.00 0.00 C ATOM 1389 CG ASN A 114 6.212 -8.422 -4.406 1.00 0.00 C ATOM 1390 OD1 ASN A 114 6.484 -9.553 -4.039 1.00 0.00 O ATOM 1391 ND2 ASN A 114 7.097 -7.572 -4.917 1.00 0.00 N ATOM 0 H ASN A 114 3.678 -5.619 -3.978 1.00 0.00 H new ATOM 0 HA ASN A 114 4.054 -7.940 -2.290 1.00 0.00 H new ATOM 0 HB2 ASN A 114 4.069 -8.655 -4.478 1.00 0.00 H new ATOM 0 HB3 ASN A 114 4.639 -7.117 -5.094 1.00 0.00 H new ATOM 0 HD21 ASN A 114 8.072 -7.853 -5.022 1.00 0.00 H new ATOM 0 HD22 ASN A 114 6.801 -6.639 -5.204 1.00 0.00 H new ATOM 1397 N TYR A 115 6.531 -5.856 -3.060 1.00 0.00 N ATOM 1398 CA TYR A 115 7.827 -5.356 -2.634 1.00 0.00 C ATOM 1399 C TYR A 115 8.815 -6.504 -2.422 1.00 0.00 C ATOM 1400 O TYR A 115 8.876 -7.084 -1.339 1.00 0.00 O ATOM 1401 CB TYR A 115 7.587 -4.651 -1.298 1.00 0.00 C ATOM 1402 CG TYR A 115 7.885 -3.151 -1.323 1.00 0.00 C ATOM 1403 CD1 TYR A 115 6.897 -2.258 -1.685 1.00 0.00 C ATOM 1404 CD2 TYR A 115 9.141 -2.690 -0.983 1.00 0.00 C ATOM 1405 CE1 TYR A 115 7.177 -0.845 -1.708 1.00 0.00 C ATOM 1406 CE2 TYR A 115 9.421 -1.278 -1.007 1.00 0.00 C ATOM 1407 CZ TYR A 115 8.425 -0.425 -1.369 1.00 0.00 C ATOM 1408 OH TYR A 115 8.690 0.909 -1.391 1.00 0.00 O ATOM 0 H TYR A 115 6.169 -5.428 -3.912 1.00 0.00 H new ATOM 0 HA TYR A 115 8.249 -4.691 -3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 115 6.549 -4.800 -1.002 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.207 -5.121 -0.534 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.914 -2.618 -1.951 1.00 0.00 H new ATOM 0 HD2 TYR A 115 9.914 -3.389 -0.699 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.413 -0.135 -1.988 1.00 0.00 H new ATOM 0 HE2 TYR A 115 10.400 -0.904 -0.744 1.00 0.00 H new ATOM 0 HH TYR A 115 9.621 1.062 -1.125 1.00 0.00 H new ATOM 1417 N SER A 116 9.566 -6.799 -3.474 1.00 0.00 N ATOM 1418 CA SER A 116 10.548 -7.868 -3.416 1.00 0.00 C ATOM 1419 C SER A 116 11.818 -7.374 -2.720 1.00 0.00 C ATOM 1420 O SER A 116 12.005 -7.604 -1.526 1.00 0.00 O ATOM 1421 CB SER A 116 10.879 -8.388 -4.817 1.00 0.00 C ATOM 1422 OG SER A 116 10.348 -9.691 -5.041 1.00 0.00 O ATOM 0 H SER A 116 9.514 -6.316 -4.371 1.00 0.00 H new ATOM 0 HA SER A 116 10.124 -8.692 -2.842 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.480 -7.701 -5.563 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.961 -8.409 -4.950 1.00 0.00 H new ATOM 0 HG SER A 116 10.579 -9.987 -5.946 1.00 0.00 H new ATOM 1427 N HIS A 117 12.658 -6.705 -3.496 1.00 0.00 N ATOM 1428 CA HIS A 117 13.905 -6.177 -2.967 1.00 0.00 C ATOM 1429 C HIS A 117 14.412 -5.055 -3.876 1.00 0.00 C ATOM 1430 O HIS A 117 15.491 -5.160 -4.456 1.00 0.00 O ATOM 1431 CB HIS A 117 14.932 -7.295 -2.778 1.00 0.00 C ATOM 1432 CG HIS A 117 14.748 -8.464 -3.718 1.00 0.00 C ATOM 1433 ND1 HIS A 117 14.727 -9.777 -3.284 1.00 0.00 N ATOM 1434 CD2 HIS A 117 14.576 -8.501 -5.070 1.00 0.00 C ATOM 1435 CE1 HIS A 117 14.551 -10.563 -4.338 1.00 0.00 C ATOM 1436 NE2 HIS A 117 14.457 -9.769 -5.444 1.00 0.00 N ATOM 0 H HIS A 117 12.500 -6.516 -4.486 1.00 0.00 H new ATOM 0 HA HIS A 117 13.733 -5.750 -1.979 1.00 0.00 H new ATOM 0 HB2 HIS A 117 15.932 -6.884 -2.918 1.00 0.00 H new ATOM 0 HB3 HIS A 117 14.876 -7.656 -1.751 1.00 0.00 H new ATOM 0 HD2 HIS A 117 14.542 -7.644 -5.726 1.00 0.00 H new ATOM 0 HE1 HIS A 117 14.492 -11.641 -4.323 1.00 0.00 H new ATOM 0 HE2 HIS A 117 14.318 -10.096 -6.400 1.00 0.00 H new ATOM 1443 N CYS A 118 13.608 -4.005 -3.971 1.00 0.00 N ATOM 1444 CA CYS A 118 13.962 -2.864 -4.797 1.00 0.00 C ATOM 1445 C CYS A 118 15.365 -2.400 -4.401 1.00 0.00 C ATOM 1446 O CYS A 118 16.294 -2.465 -5.204 1.00 0.00 O ATOM 1447 CB CYS A 118 12.932 -1.738 -4.677 1.00 0.00 C ATOM 1448 SG CYS A 118 12.376 -1.034 -6.272 1.00 0.00 S ATOM 0 H CYS A 118 12.713 -3.921 -3.489 1.00 0.00 H new ATOM 0 HA CYS A 118 13.961 -3.157 -5.847 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.062 -2.116 -4.140 1.00 0.00 H new ATOM 0 HB3 CYS A 118 13.358 -0.938 -4.071 1.00 0.00 H new ATOM 1452 N GLU A 119 15.473 -1.941 -3.163 1.00 0.00 N ATOM 1453 CA GLU A 119 16.748 -1.466 -2.650 1.00 0.00 C ATOM 1454 C GLU A 119 17.803 -2.569 -2.746 1.00 0.00 C ATOM 1455 O GLU A 119 18.839 -2.389 -3.384 1.00 0.00 O ATOM 1456 CB GLU A 119 16.607 -0.965 -1.211 1.00 0.00 C ATOM 1457 CG GLU A 119 16.949 0.522 -1.112 1.00 0.00 C ATOM 1458 CD GLU A 119 15.727 1.389 -1.426 1.00 0.00 C ATOM 1459 OE1 GLU A 119 14.966 1.661 -0.473 1.00 0.00 O ATOM 1460 OE2 GLU A 119 15.584 1.759 -2.611 1.00 0.00 O ATOM 0 H GLU A 119 14.700 -1.888 -2.500 1.00 0.00 H new ATOM 0 HA GLU A 119 17.074 -0.625 -3.262 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.588 -1.131 -0.863 1.00 0.00 H new ATOM 0 HB3 GLU A 119 17.265 -1.537 -0.557 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.312 0.749 -0.110 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.756 0.760 -1.805 1.00 0.00 H new ATOM 1465 N PRO A 120 17.496 -3.718 -2.085 1.00 0.00 N ATOM 1466 CA PRO A 120 18.407 -4.850 -2.090 1.00 0.00 C ATOM 1467 C PRO A 120 18.372 -5.576 -3.437 1.00 0.00 C ATOM 1468 O PRO A 120 18.073 -6.768 -3.497 1.00 0.00 O ATOM 1469 CB PRO A 120 17.952 -5.725 -0.932 1.00 0.00 C ATOM 1470 CG PRO A 120 16.530 -5.291 -0.616 1.00 0.00 C ATOM 1471 CD PRO A 120 16.280 -3.967 -1.319 1.00 0.00 C ATOM 0 HA PRO A 120 19.448 -4.553 -1.964 1.00 0.00 H new ATOM 0 HB2 PRO A 120 17.987 -6.780 -1.202 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.601 -5.596 -0.066 1.00 0.00 H new ATOM 0 HG2 PRO A 120 15.817 -6.043 -0.954 1.00 0.00 H new ATOM 0 HG3 PRO A 120 16.394 -5.184 0.460 1.00 0.00 H new ATOM 0 HD2 PRO A 120 15.407 -4.023 -1.969 1.00 0.00 H new ATOM 0 HD3 PRO A 120 16.093 -3.167 -0.602 1.00 0.00 H new ATOM 1476 N ILE A 121 18.683 -4.825 -4.484 1.00 0.00 N ATOM 1477 CA ILE A 121 18.692 -5.382 -5.827 1.00 0.00 C ATOM 1478 C ILE A 121 20.103 -5.281 -6.407 1.00 0.00 C ATOM 1479 O ILE A 121 20.833 -4.336 -6.112 1.00 0.00 O ATOM 1480 CB ILE A 121 17.622 -4.712 -6.691 1.00 0.00 C ATOM 1481 CG1 ILE A 121 17.061 -5.690 -7.725 1.00 0.00 C ATOM 1482 CG2 ILE A 121 18.163 -3.438 -7.342 1.00 0.00 C ATOM 1483 CD1 ILE A 121 17.800 -5.563 -9.058 1.00 0.00 C ATOM 0 H ILE A 121 18.930 -3.837 -4.430 1.00 0.00 H new ATOM 0 HA ILE A 121 18.433 -6.440 -5.803 1.00 0.00 H new ATOM 0 HB ILE A 121 16.795 -4.418 -6.045 1.00 0.00 H new ATOM 0 HG12 ILE A 121 17.150 -6.710 -7.352 1.00 0.00 H new ATOM 0 HG13 ILE A 121 15.999 -5.497 -7.874 1.00 0.00 H new ATOM 0 HG21 ILE A 121 17.383 -2.981 -7.951 1.00 0.00 H new ATOM 0 HG22 ILE A 121 18.476 -2.738 -6.567 1.00 0.00 H new ATOM 0 HG23 ILE A 121 19.017 -3.686 -7.973 1.00 0.00 H new ATOM 0 HD11 ILE A 121 17.381 -6.269 -9.775 1.00 0.00 H new ATOM 0 HD12 ILE A 121 17.688 -4.548 -9.441 1.00 0.00 H new ATOM 0 HD13 ILE A 121 18.858 -5.781 -8.910 1.00 0.00 H new ATOM 1494 N LEU A 122 20.446 -6.269 -7.221 1.00 0.00 N ATOM 1495 CA LEU A 122 21.757 -6.304 -7.845 1.00 0.00 C ATOM 1496 C LEU A 122 21.643 -5.815 -9.291 1.00 0.00 C ATOM 1497 O LEU A 122 20.924 -6.407 -10.094 1.00 0.00 O ATOM 1498 CB LEU A 122 22.377 -7.696 -7.714 1.00 0.00 C ATOM 1499 CG LEU A 122 21.631 -8.831 -8.420 1.00 0.00 C ATOM 1500 CD1 LEU A 122 22.559 -9.590 -9.369 1.00 0.00 C ATOM 1501 CD2 LEU A 122 20.965 -9.762 -7.405 1.00 0.00 C ATOM 0 H LEU A 122 19.838 -7.051 -7.463 1.00 0.00 H new ATOM 0 HA LEU A 122 22.440 -5.627 -7.332 1.00 0.00 H new ATOM 0 HB2 LEU A 122 23.394 -7.658 -8.105 1.00 0.00 H new ATOM 0 HB3 LEU A 122 22.452 -7.941 -6.654 1.00 0.00 H new ATOM 0 HG LEU A 122 20.838 -8.394 -9.027 1.00 0.00 H new ATOM 0 HD11 LEU A 122 22.004 -10.391 -9.858 1.00 0.00 H new ATOM 0 HD12 LEU A 122 22.947 -8.905 -10.123 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.388 -10.016 -8.804 1.00 0.00 H new ATOM 0 HD21 LEU A 122 20.442 -10.560 -7.932 1.00 0.00 H new ATOM 0 HD22 LEU A 122 21.725 -10.194 -6.754 1.00 0.00 H new ATOM 0 HD23 LEU A 122 20.253 -9.196 -6.804 1.00 0.00 H new ATOM 1512 N ASP A 123 22.362 -4.740 -9.578 1.00 0.00 N ATOM 1513 CA ASP A 123 22.349 -4.165 -10.912 1.00 0.00 C ATOM 1514 C ASP A 123 23.788 -4.001 -11.405 1.00 0.00 C ATOM 1515 O ASP A 123 24.710 -3.852 -10.604 1.00 0.00 O ATOM 1516 CB ASP A 123 21.690 -2.784 -10.911 1.00 0.00 C ATOM 1517 CG ASP A 123 22.410 -1.725 -10.074 1.00 0.00 C ATOM 1518 OD1 ASP A 123 23.378 -1.142 -10.609 1.00 0.00 O ATOM 1519 OD2 ASP A 123 21.974 -1.521 -8.921 1.00 0.00 O ATOM 0 H ASP A 123 22.958 -4.252 -8.909 1.00 0.00 H new ATOM 0 HA ASP A 123 21.784 -4.833 -11.562 1.00 0.00 H new ATOM 0 HB2 ASP A 123 21.623 -2.429 -11.939 1.00 0.00 H new ATOM 0 HB3 ASP A 123 20.669 -2.885 -10.542 1.00 0.00 H new ATOM 1523 N ASP A 124 23.936 -4.035 -12.721 1.00 0.00 N ATOM 1524 CA ASP A 124 25.247 -3.891 -13.331 1.00 0.00 C ATOM 1525 C ASP A 124 26.006 -5.215 -13.215 1.00 0.00 C ATOM 1526 O ASP A 124 26.555 -5.530 -12.160 1.00 0.00 O ATOM 1527 CB ASP A 124 26.069 -2.813 -12.623 1.00 0.00 C ATOM 1528 CG ASP A 124 26.778 -1.825 -13.553 1.00 0.00 C ATOM 1529 OD1 ASP A 124 26.061 -0.997 -14.154 1.00 0.00 O ATOM 1530 OD2 ASP A 124 28.022 -1.922 -13.642 1.00 0.00 O ATOM 0 H ASP A 124 23.169 -4.160 -13.382 1.00 0.00 H new ATOM 0 HA ASP A 124 25.104 -3.609 -14.374 1.00 0.00 H new ATOM 0 HB2 ASP A 124 25.411 -2.254 -11.957 1.00 0.00 H new ATOM 0 HB3 ASP A 124 26.817 -3.300 -11.997 1.00 0.00 H new ATOM 1534 N LYS A 125 26.013 -5.955 -14.315 1.00 0.00 N ATOM 1535 CA LYS A 125 26.695 -7.237 -14.349 1.00 0.00 C ATOM 1536 C LYS A 125 28.205 -7.009 -14.263 1.00 0.00 C ATOM 1537 O LYS A 125 28.677 -5.884 -14.424 1.00 0.00 O ATOM 1538 CB LYS A 125 26.264 -8.040 -15.579 1.00 0.00 C ATOM 1539 CG LYS A 125 25.201 -9.077 -15.211 1.00 0.00 C ATOM 1540 CD LYS A 125 24.218 -9.288 -16.365 1.00 0.00 C ATOM 1541 CE LYS A 125 22.771 -9.184 -15.878 1.00 0.00 C ATOM 1542 NZ LYS A 125 21.953 -8.421 -16.847 1.00 0.00 N ATOM 0 H LYS A 125 25.557 -5.691 -15.188 1.00 0.00 H new ATOM 0 HA LYS A 125 26.414 -7.841 -13.487 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.871 -7.365 -16.339 1.00 0.00 H new ATOM 0 HB3 LYS A 125 27.130 -8.540 -16.013 1.00 0.00 H new ATOM 0 HG2 LYS A 125 25.682 -10.023 -14.961 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.660 -8.749 -14.323 1.00 0.00 H new ATOM 0 HD2 LYS A 125 24.398 -8.545 -17.142 1.00 0.00 H new ATOM 0 HD3 LYS A 125 24.385 -10.267 -16.815 1.00 0.00 H new ATOM 0 HE2 LYS A 125 22.353 -10.182 -15.746 1.00 0.00 H new ATOM 0 HE3 LYS A 125 22.743 -8.695 -14.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 20.974 -8.359 -16.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 22.344 -7.463 -16.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 21.966 -8.904 -17.768 1.00 0.00 H new ATOM 1552 N GLN A 126 28.922 -8.095 -14.009 1.00 0.00 N ATOM 1553 CA GLN A 126 30.369 -8.026 -13.899 1.00 0.00 C ATOM 1554 C GLN A 126 31.025 -8.602 -15.156 1.00 0.00 C ATOM 1555 O GLN A 126 30.385 -9.326 -15.918 1.00 0.00 O ATOM 1556 CB GLN A 126 30.858 -8.753 -12.644 1.00 0.00 C ATOM 1557 CG GLN A 126 30.409 -8.023 -11.377 1.00 0.00 C ATOM 1558 CD GLN A 126 30.063 -9.015 -10.265 1.00 0.00 C ATOM 1559 OE1 GLN A 126 30.923 -9.550 -9.586 1.00 0.00 O ATOM 1560 NE2 GLN A 126 28.758 -9.228 -10.117 1.00 0.00 N ATOM 0 H GLN A 126 28.528 -9.026 -13.876 1.00 0.00 H new ATOM 0 HA GLN A 126 30.658 -6.979 -13.809 1.00 0.00 H new ATOM 0 HB2 GLN A 126 30.472 -9.772 -12.637 1.00 0.00 H new ATOM 0 HB3 GLN A 126 31.946 -8.824 -12.661 1.00 0.00 H new ATOM 0 HG2 GLN A 126 31.200 -7.354 -11.039 1.00 0.00 H new ATOM 0 HG3 GLN A 126 29.541 -7.403 -11.599 1.00 0.00 H new ATOM 0 HE21 GLN A 126 28.091 -8.747 -10.720 1.00 0.00 H new ATOM 0 HE22 GLN A 126 28.425 -9.873 -9.400 1.00 0.00 H new ATOM 1567 N ARG A 127 32.292 -8.260 -15.333 1.00 0.00 N ATOM 1568 CA ARG A 127 33.041 -8.734 -16.484 1.00 0.00 C ATOM 1569 C ARG A 127 34.435 -9.197 -16.056 1.00 0.00 C ATOM 1570 O ARG A 127 35.080 -8.554 -15.229 1.00 0.00 O ATOM 1571 CB ARG A 127 33.178 -7.637 -17.542 1.00 0.00 C ATOM 1572 CG ARG A 127 32.928 -8.192 -18.945 1.00 0.00 C ATOM 1573 CD ARG A 127 33.987 -7.693 -19.930 1.00 0.00 C ATOM 1574 NE ARG A 127 33.369 -7.436 -21.251 1.00 0.00 N ATOM 1575 CZ ARG A 127 32.505 -6.443 -21.494 1.00 0.00 C ATOM 1576 NH1 ARG A 127 32.150 -5.607 -20.510 1.00 0.00 N ATOM 1577 NH2 ARG A 127 31.994 -6.286 -22.724 1.00 0.00 N ATOM 0 H ARG A 127 32.819 -7.660 -14.699 1.00 0.00 H new ATOM 0 HA ARG A 127 32.492 -9.572 -16.915 1.00 0.00 H new ATOM 0 HB2 ARG A 127 32.470 -6.835 -17.333 1.00 0.00 H new ATOM 0 HB3 ARG A 127 34.176 -7.202 -17.492 1.00 0.00 H new ATOM 0 HG2 ARG A 127 32.938 -9.282 -18.916 1.00 0.00 H new ATOM 0 HG3 ARG A 127 31.938 -7.892 -19.287 1.00 0.00 H new ATOM 0 HD2 ARG A 127 34.447 -6.780 -19.551 1.00 0.00 H new ATOM 0 HD3 ARG A 127 34.781 -8.433 -20.029 1.00 0.00 H new ATOM 0 HE ARG A 127 33.617 -8.054 -22.024 1.00 0.00 H new ATOM 0 HH11 ARG A 127 32.538 -5.727 -19.574 1.00 0.00 H new ATOM 0 HH12 ARG A 127 31.492 -4.851 -20.696 1.00 0.00 H new ATOM 0 HH21 ARG A 127 32.264 -6.923 -23.473 1.00 0.00 H new ATOM 0 HH22 ARG A 127 31.336 -5.530 -22.910 1.00 0.00 H new ATOM 1588 N LYS A 128 34.859 -10.309 -16.639 1.00 0.00 N ATOM 1589 CA LYS A 128 36.164 -10.866 -16.328 1.00 0.00 C ATOM 1590 C LYS A 128 36.965 -11.031 -17.622 1.00 0.00 C ATOM 1591 O LYS A 128 36.458 -10.756 -18.709 1.00 0.00 O ATOM 1592 CB LYS A 128 36.018 -12.161 -15.527 1.00 0.00 C ATOM 1593 CG LYS A 128 35.522 -13.303 -16.417 1.00 0.00 C ATOM 1594 CD LYS A 128 34.215 -13.889 -15.881 1.00 0.00 C ATOM 1595 CE LYS A 128 33.458 -14.638 -16.980 1.00 0.00 C ATOM 1596 NZ LYS A 128 33.210 -16.040 -16.575 1.00 0.00 N ATOM 0 H LYS A 128 34.322 -10.839 -17.325 1.00 0.00 H new ATOM 0 HA LYS A 128 36.726 -10.185 -15.689 1.00 0.00 H new ATOM 0 HB2 LYS A 128 36.978 -12.430 -15.085 1.00 0.00 H new ATOM 0 HB3 LYS A 128 35.320 -12.007 -14.704 1.00 0.00 H new ATOM 0 HG2 LYS A 128 35.371 -12.938 -17.433 1.00 0.00 H new ATOM 0 HG3 LYS A 128 36.281 -14.084 -16.469 1.00 0.00 H new ATOM 0 HD2 LYS A 128 34.428 -14.567 -15.055 1.00 0.00 H new ATOM 0 HD3 LYS A 128 33.590 -13.089 -15.484 1.00 0.00 H new ATOM 0 HE2 LYS A 128 32.510 -14.139 -17.182 1.00 0.00 H new ATOM 0 HE3 LYS A 128 34.033 -14.617 -17.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 32.696 -16.534 -17.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 34.118 -16.518 -16.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 32.642 -16.054 -15.704 1.00 0.00 H new ATOM 1606 N TYR A 129 38.202 -11.478 -17.463 1.00 0.00 N ATOM 1607 CA TYR A 129 39.078 -11.681 -18.604 1.00 0.00 C ATOM 1608 C TYR A 129 38.955 -13.109 -19.141 1.00 0.00 C ATOM 1609 O TYR A 129 38.327 -13.960 -18.513 1.00 0.00 O ATOM 1610 CB TYR A 129 40.501 -11.464 -18.088 1.00 0.00 C ATOM 1611 CG TYR A 129 40.751 -10.064 -17.525 1.00 0.00 C ATOM 1612 CD1 TYR A 129 40.473 -8.950 -18.292 1.00 0.00 C ATOM 1613 CD2 TYR A 129 41.256 -9.913 -16.249 1.00 0.00 C ATOM 1614 CE1 TYR A 129 40.709 -7.633 -17.762 1.00 0.00 C ATOM 1615 CE2 TYR A 129 41.492 -8.596 -15.718 1.00 0.00 C ATOM 1616 CZ TYR A 129 41.207 -7.521 -16.501 1.00 0.00 C ATOM 1617 OH TYR A 129 41.429 -6.276 -16.000 1.00 0.00 O ATOM 0 H TYR A 129 38.619 -11.705 -16.560 1.00 0.00 H new ATOM 0 HA TYR A 129 38.819 -10.998 -19.413 1.00 0.00 H new ATOM 0 HB2 TYR A 129 40.711 -12.200 -17.312 1.00 0.00 H new ATOM 0 HB3 TYR A 129 41.203 -11.649 -18.901 1.00 0.00 H new ATOM 0 HD1 TYR A 129 40.078 -9.067 -19.290 1.00 0.00 H new ATOM 0 HD2 TYR A 129 41.474 -10.784 -15.649 1.00 0.00 H new ATOM 0 HE1 TYR A 129 40.496 -6.754 -18.352 1.00 0.00 H new ATOM 0 HE2 TYR A 129 41.886 -8.465 -14.721 1.00 0.00 H new ATOM 0 HH TYR A 129 41.784 -6.348 -15.090 1.00 0.00 H new ATOM 1626 N ASP A 130 39.563 -13.327 -20.297 1.00 0.00 N ATOM 1627 CA ASP A 130 39.530 -14.636 -20.925 1.00 0.00 C ATOM 1628 C ASP A 130 40.329 -15.626 -20.076 1.00 0.00 C ATOM 1629 O ASP A 130 41.220 -15.228 -19.326 1.00 0.00 O ATOM 1630 CB ASP A 130 40.159 -14.595 -22.320 1.00 0.00 C ATOM 1631 CG ASP A 130 39.798 -13.366 -23.156 1.00 0.00 C ATOM 1632 OD1 ASP A 130 38.584 -13.163 -23.372 1.00 0.00 O ATOM 1633 OD2 ASP A 130 40.744 -12.656 -23.560 1.00 0.00 O ATOM 0 H ASP A 130 40.082 -12.618 -20.816 1.00 0.00 H new ATOM 0 HA ASP A 130 38.487 -14.942 -21.008 1.00 0.00 H new ATOM 0 HB2 ASP A 130 41.243 -14.639 -22.215 1.00 0.00 H new ATOM 0 HB3 ASP A 130 39.856 -15.489 -22.865 1.00 0.00 H new ATOM 1637 N LEU A 131 39.983 -16.896 -20.220 1.00 0.00 N ATOM 1638 CA LEU A 131 40.657 -17.946 -19.475 1.00 0.00 C ATOM 1639 C LEU A 131 40.517 -19.271 -20.227 1.00 0.00 C ATOM 1640 O LEU A 131 39.744 -19.369 -21.178 1.00 0.00 O ATOM 1641 CB LEU A 131 40.140 -17.997 -18.036 1.00 0.00 C ATOM 1642 CG LEU A 131 38.681 -18.426 -17.862 1.00 0.00 C ATOM 1643 CD1 LEU A 131 38.590 -19.858 -17.332 1.00 0.00 C ATOM 1644 CD2 LEU A 131 37.921 -17.437 -16.976 1.00 0.00 C ATOM 0 H LEU A 131 39.244 -17.223 -20.842 1.00 0.00 H new ATOM 0 HA LEU A 131 41.724 -17.735 -19.399 1.00 0.00 H new ATOM 0 HB2 LEU A 131 40.770 -18.683 -17.469 1.00 0.00 H new ATOM 0 HB3 LEU A 131 40.263 -17.009 -17.592 1.00 0.00 H new ATOM 0 HG LEU A 131 38.202 -18.415 -18.841 1.00 0.00 H new ATOM 0 HD11 LEU A 131 37.543 -20.138 -17.217 1.00 0.00 H new ATOM 0 HD12 LEU A 131 39.072 -20.537 -18.035 1.00 0.00 H new ATOM 0 HD13 LEU A 131 39.090 -19.921 -16.365 1.00 0.00 H new ATOM 0 HD21 LEU A 131 36.887 -17.765 -16.868 1.00 0.00 H new ATOM 0 HD22 LEU A 131 38.392 -17.392 -15.994 1.00 0.00 H new ATOM 0 HD23 LEU A 131 37.942 -16.448 -17.434 1.00 0.00 H new ATOM 1655 N HIS A 132 41.277 -20.256 -19.772 1.00 0.00 N ATOM 1656 CA HIS A 132 41.247 -21.570 -20.390 1.00 0.00 C ATOM 1657 C HIS A 132 42.027 -21.537 -21.706 1.00 0.00 C ATOM 1658 O HIS A 132 42.107 -20.497 -22.357 1.00 0.00 O ATOM 1659 CB HIS A 132 39.806 -22.055 -20.567 1.00 0.00 C ATOM 1660 CG HIS A 132 39.515 -23.374 -19.893 1.00 0.00 C ATOM 1661 ND1 HIS A 132 39.731 -24.594 -20.508 1.00 0.00 N ATOM 1662 CD2 HIS A 132 39.022 -23.651 -18.651 1.00 0.00 C ATOM 1663 CE1 HIS A 132 39.381 -25.555 -19.666 1.00 0.00 C ATOM 1664 NE2 HIS A 132 38.941 -24.968 -18.516 1.00 0.00 N ATOM 0 H HIS A 132 41.917 -20.170 -18.983 1.00 0.00 H new ATOM 0 HA HIS A 132 41.735 -22.293 -19.737 1.00 0.00 H new ATOM 0 HB2 HIS A 132 39.128 -21.299 -20.171 1.00 0.00 H new ATOM 0 HB3 HIS A 132 39.593 -22.148 -21.632 1.00 0.00 H new ATOM 0 HD2 HIS A 132 38.745 -22.921 -17.904 1.00 0.00 H new ATOM 0 HE1 HIS A 132 39.435 -26.617 -19.857 1.00 0.00 H new ATOM 0 HE2 HIS A 132 38.605 -25.461 -17.689 1.00 0.00 H new ATOM 1672 N TYR A 133 42.582 -22.687 -22.056 1.00 0.00 N ATOM 1673 CA TYR A 133 43.354 -22.803 -23.282 1.00 0.00 C ATOM 1674 C TYR A 133 43.125 -24.162 -23.947 1.00 0.00 C ATOM 1675 O TYR A 133 42.142 -24.841 -23.657 1.00 0.00 O ATOM 1676 CB TYR A 133 44.822 -22.692 -22.868 1.00 0.00 C ATOM 1677 CG TYR A 133 45.742 -22.167 -23.973 1.00 0.00 C ATOM 1678 CD1 TYR A 133 46.112 -22.995 -25.013 1.00 0.00 C ATOM 1679 CD2 TYR A 133 46.201 -20.866 -23.929 1.00 0.00 C ATOM 1680 CE1 TYR A 133 46.977 -22.500 -26.053 1.00 0.00 C ATOM 1681 CE2 TYR A 133 47.067 -20.373 -24.968 1.00 0.00 C ATOM 1682 CZ TYR A 133 47.412 -21.214 -25.979 1.00 0.00 C ATOM 1683 OH TYR A 133 48.229 -20.747 -26.961 1.00 0.00 O ATOM 0 H TYR A 133 42.513 -23.547 -21.512 1.00 0.00 H new ATOM 0 HA TYR A 133 43.061 -22.032 -23.994 1.00 0.00 H new ATOM 0 HB2 TYR A 133 44.896 -22.032 -22.003 1.00 0.00 H new ATOM 0 HB3 TYR A 133 45.175 -23.673 -22.551 1.00 0.00 H new ATOM 0 HD1 TYR A 133 45.753 -24.013 -25.047 1.00 0.00 H new ATOM 0 HD2 TYR A 133 45.911 -20.218 -23.115 1.00 0.00 H new ATOM 0 HE1 TYR A 133 47.274 -23.136 -26.874 1.00 0.00 H new ATOM 0 HE2 TYR A 133 47.434 -19.358 -24.945 1.00 0.00 H new ATOM 0 HH TYR A 133 48.459 -19.812 -26.778 1.00 0.00 H new TER 1692 TYR A 133