USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 837 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 25 TYR OH : rot -130:sc= -0.911 USER MOD Set 1.2: A 29 THR OG1 : rot 180:sc= 0.599 USER MOD Set 1.3: A 57 THR OG1 : rot 180:sc= 1.07 USER MOD Set 1.4: A 64 SER OG : rot -134:sc= -3.64! USER MOD Single : A 1 MET CE :methyl -129:sc= -1.18 (180deg=-7.15!) USER MOD Single : A 1 MET N :NH3+ -129:sc= 0.566 (180deg=-0.0264) USER MOD Single : A 4 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.272) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.693 K(o=-0.69,f=-3.2) USER MOD Single : A 15 ASN : amide:sc= -1.21 K(o=-1.2,f=-2) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0.0801 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 37 ASN : amide:sc= -0.0175 X(o=-0.017,f=-0.4) USER MOD Single : A 38 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0931) USER MOD Single : A 42 MET CE :methyl -121:sc= -0.728 (180deg=-6.26!) USER MOD Single : A 44 ASN : amide:sc= -5.29! C(o=-5.3!,f=-4.4!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 MET CE :methyl 166:sc= -1.13 (180deg=-1.63) USER MOD Single : A 62 GLN : amide:sc= -0.663 X(o=-0.66,f=-0.27) USER MOD Single : A 65 LYS NZ :NH3+ -166:sc= -0.478 (180deg=-0.826) USER MOD Single : A 67 TYR OH : rot -122:sc= 0.559 USER MOD Single : A 69 LYS NZ :NH3+ 145:sc= -0.0827 (180deg=-2.44!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl -133:sc= 0 (180deg=-0.499) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.01) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -2.9! C(o=-2.9!,f=-1.9!) USER MOD Single : A 94 SER OG : rot 180:sc= -0.401 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.505 -10.434 8.769 1.00 0.00 N ATOM 2 CA MET A 1 -11.079 -10.710 8.805 1.00 0.00 C ATOM 3 C MET A 1 -10.449 -10.177 10.093 1.00 0.00 C ATOM 4 O MET A 1 -11.143 -9.622 10.944 1.00 0.00 O ATOM 5 CB MET A 1 -10.402 -10.058 7.597 1.00 0.00 C ATOM 6 CG MET A 1 -10.492 -8.532 7.676 1.00 0.00 C ATOM 7 SD MET A 1 -11.817 -7.944 6.635 1.00 0.00 S ATOM 8 CE MET A 1 -11.627 -6.183 6.857 1.00 0.00 C ATOM 0 H1 MET A 1 -13.023 -11.310 8.553 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.812 -10.070 9.694 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.703 -9.725 8.035 1.00 0.00 H new ATOM 0 HA MET A 1 -10.936 -11.790 8.774 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.356 -10.363 7.553 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.874 -10.407 6.679 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.664 -8.223 8.707 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.548 -8.087 7.363 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.588 -5.745 7.127 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.905 -5.992 7.651 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.273 -5.735 5.929 1.00 0.00 H new ATOM 18 N ASP A 2 -9.141 -10.363 10.196 1.00 0.00 N ATOM 19 CA ASP A 2 -8.410 -9.908 11.366 1.00 0.00 C ATOM 20 C ASP A 2 -7.465 -8.775 10.962 1.00 0.00 C ATOM 21 O ASP A 2 -6.908 -8.787 9.866 1.00 0.00 O ATOM 22 CB ASP A 2 -7.568 -11.037 11.963 1.00 0.00 C ATOM 23 CG ASP A 2 -8.064 -11.573 13.307 1.00 0.00 C ATOM 24 OD1 ASP A 2 -8.597 -10.751 14.084 1.00 0.00 O ATOM 25 OD2 ASP A 2 -7.900 -12.792 13.527 1.00 0.00 O ATOM 0 H ASP A 2 -8.569 -10.823 9.488 1.00 0.00 H new ATOM 0 HA ASP A 2 -9.135 -9.569 12.106 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -7.535 -11.861 11.250 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -6.545 -10.681 12.086 1.00 0.00 H new ATOM 30 N ILE A 3 -7.313 -7.822 11.870 1.00 0.00 N ATOM 31 CA ILE A 3 -6.444 -6.684 11.623 1.00 0.00 C ATOM 32 C ILE A 3 -5.538 -6.466 12.836 1.00 0.00 C ATOM 33 O ILE A 3 -5.995 -6.528 13.976 1.00 0.00 O ATOM 34 CB ILE A 3 -7.270 -5.452 11.243 1.00 0.00 C ATOM 35 CG1 ILE A 3 -7.998 -5.668 9.915 1.00 0.00 C ATOM 36 CG2 ILE A 3 -6.400 -4.194 11.222 1.00 0.00 C ATOM 37 CD1 ILE A 3 -8.695 -4.386 9.457 1.00 0.00 C ATOM 0 H ILE A 3 -7.777 -7.815 12.778 1.00 0.00 H new ATOM 0 HA ILE A 3 -5.794 -6.880 10.770 1.00 0.00 H new ATOM 0 HB ILE A 3 -8.033 -5.303 12.007 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -7.287 -5.991 9.155 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -8.732 -6.466 10.024 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -7.011 -3.334 10.949 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -5.968 -4.034 12.210 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -5.600 -4.317 10.492 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -9.205 -4.567 8.511 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -9.423 -4.079 10.208 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -7.955 -3.597 9.325 1.00 0.00 H new ATOM 49 N LYS A 4 -4.269 -6.215 12.548 1.00 0.00 N ATOM 50 CA LYS A 4 -3.294 -5.988 13.601 1.00 0.00 C ATOM 51 C LYS A 4 -2.549 -4.680 13.328 1.00 0.00 C ATOM 52 O LYS A 4 -1.798 -4.580 12.359 1.00 0.00 O ATOM 53 CB LYS A 4 -2.372 -7.201 13.749 1.00 0.00 C ATOM 54 CG LYS A 4 -1.098 -7.025 12.921 1.00 0.00 C ATOM 55 CD LYS A 4 -0.201 -8.260 13.027 1.00 0.00 C ATOM 56 CE LYS A 4 -0.943 -9.518 12.572 1.00 0.00 C ATOM 57 NZ LYS A 4 -0.019 -10.672 12.514 1.00 0.00 N ATOM 0 H LYS A 4 -3.894 -6.164 11.601 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.793 -5.876 14.564 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -2.112 -7.339 14.799 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -2.896 -8.102 13.430 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -1.359 -6.849 11.877 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.554 -6.145 13.266 1.00 0.00 H new ATOM 0 HD2 LYS A 4 0.691 -8.119 12.417 1.00 0.00 H new ATOM 0 HD3 LYS A 4 0.134 -8.383 14.057 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.761 -9.734 13.260 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -1.387 -9.351 11.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -0.568 -11.553 12.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.590 -10.587 11.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.571 -10.688 13.370 1.00 0.00 H new ATOM 71 N ILE A 5 -2.784 -3.709 14.199 1.00 0.00 N ATOM 72 CA ILE A 5 -2.145 -2.412 14.063 1.00 0.00 C ATOM 73 C ILE A 5 -0.633 -2.572 14.235 1.00 0.00 C ATOM 74 O ILE A 5 -0.157 -2.862 15.332 1.00 0.00 O ATOM 75 CB ILE A 5 -2.770 -1.403 15.028 1.00 0.00 C ATOM 76 CG1 ILE A 5 -4.239 -1.150 14.681 1.00 0.00 C ATOM 77 CG2 ILE A 5 -1.960 -0.106 15.067 1.00 0.00 C ATOM 78 CD1 ILE A 5 -5.117 -1.218 15.932 1.00 0.00 C ATOM 0 H ILE A 5 -3.408 -3.795 15.001 1.00 0.00 H new ATOM 0 HA ILE A 5 -2.312 -2.009 13.064 1.00 0.00 H new ATOM 0 HB ILE A 5 -2.744 -1.829 16.031 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -4.342 -0.171 14.212 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -4.577 -1.889 13.954 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -2.426 0.594 15.761 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -0.944 -0.321 15.397 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -1.932 0.335 14.071 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.156 -1.035 15.658 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.030 -2.206 16.384 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.792 -0.462 16.646 1.00 0.00 H new ATOM 90 N ILE A 6 0.080 -2.375 13.136 1.00 0.00 N ATOM 91 CA ILE A 6 1.528 -2.494 13.152 1.00 0.00 C ATOM 92 C ILE A 6 2.126 -1.301 13.901 1.00 0.00 C ATOM 93 O ILE A 6 2.687 -1.461 14.984 1.00 0.00 O ATOM 94 CB ILE A 6 2.068 -2.661 11.730 1.00 0.00 C ATOM 95 CG1 ILE A 6 1.642 -4.006 11.137 1.00 0.00 C ATOM 96 CG2 ILE A 6 3.586 -2.474 11.695 1.00 0.00 C ATOM 97 CD1 ILE A 6 2.706 -5.076 11.385 1.00 0.00 C ATOM 0 H ILE A 6 -0.318 -2.134 12.228 1.00 0.00 H new ATOM 0 HA ILE A 6 1.830 -3.392 13.690 1.00 0.00 H new ATOM 0 HB ILE A 6 1.633 -1.881 11.105 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.696 -4.319 11.579 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.473 -3.898 10.066 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.944 -2.598 10.673 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.838 -1.474 12.049 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.059 -3.216 12.338 1.00 0.00 H new ATOM 0 HD11 ILE A 6 2.378 -6.022 10.954 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.644 -4.771 10.921 1.00 0.00 H new ATOM 0 HD13 ILE A 6 2.855 -5.199 12.458 1.00 0.00 H new ATOM 109 N LYS A 7 1.985 -0.132 13.293 1.00 0.00 N ATOM 110 CA LYS A 7 2.503 1.088 13.889 1.00 0.00 C ATOM 111 C LYS A 7 1.641 2.272 13.447 1.00 0.00 C ATOM 112 O LYS A 7 0.954 2.199 12.430 1.00 0.00 O ATOM 113 CB LYS A 7 3.989 1.253 13.563 1.00 0.00 C ATOM 114 CG LYS A 7 4.862 0.730 14.705 1.00 0.00 C ATOM 115 CD LYS A 7 6.348 0.844 14.356 1.00 0.00 C ATOM 116 CE LYS A 7 7.199 0.979 15.621 1.00 0.00 C ATOM 117 NZ LYS A 7 7.556 2.396 15.856 1.00 0.00 N ATOM 0 H LYS A 7 1.520 -0.004 12.394 1.00 0.00 H new ATOM 0 HA LYS A 7 2.442 1.038 14.976 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.225 0.716 12.644 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.211 2.305 13.383 1.00 0.00 H new ATOM 0 HG2 LYS A 7 4.654 1.294 15.614 1.00 0.00 H new ATOM 0 HG3 LYS A 7 4.612 -0.311 14.911 1.00 0.00 H new ATOM 0 HD2 LYS A 7 6.662 -0.036 13.794 1.00 0.00 H new ATOM 0 HD3 LYS A 7 6.509 1.708 13.711 1.00 0.00 H new ATOM 0 HE2 LYS A 7 6.651 0.589 16.479 1.00 0.00 H new ATOM 0 HE3 LYS A 7 8.105 0.381 15.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 8.133 2.470 16.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 8.097 2.757 15.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 6.689 2.958 15.971 1.00 0.00 H new ATOM 131 N ASP A 8 1.707 3.336 14.234 1.00 0.00 N ATOM 132 CA ASP A 8 0.941 4.535 13.937 1.00 0.00 C ATOM 133 C ASP A 8 1.885 5.737 13.877 1.00 0.00 C ATOM 134 O ASP A 8 2.416 6.165 14.901 1.00 0.00 O ATOM 135 CB ASP A 8 -0.102 4.806 15.023 1.00 0.00 C ATOM 136 CG ASP A 8 -0.510 6.273 15.176 1.00 0.00 C ATOM 137 OD1 ASP A 8 -1.147 6.786 14.232 1.00 0.00 O ATOM 138 OD2 ASP A 8 -0.175 6.847 16.235 1.00 0.00 O ATOM 0 H ASP A 8 2.279 3.393 15.077 1.00 0.00 H new ATOM 0 HA ASP A 8 0.437 4.384 12.983 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.993 4.218 14.805 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.288 4.452 15.977 1.00 0.00 H new ATOM 143 N LYS A 9 2.067 6.247 12.668 1.00 0.00 N ATOM 144 CA LYS A 9 2.938 7.391 12.461 1.00 0.00 C ATOM 145 C LYS A 9 2.089 8.659 12.344 1.00 0.00 C ATOM 146 O LYS A 9 0.993 8.626 11.788 1.00 0.00 O ATOM 147 CB LYS A 9 3.858 7.154 11.262 1.00 0.00 C ATOM 148 CG LYS A 9 4.473 8.468 10.774 1.00 0.00 C ATOM 149 CD LYS A 9 5.927 8.267 10.344 1.00 0.00 C ATOM 150 CE LYS A 9 6.365 9.358 9.365 1.00 0.00 C ATOM 151 NZ LYS A 9 7.203 10.366 10.053 1.00 0.00 N ATOM 0 H LYS A 9 1.626 5.889 11.821 1.00 0.00 H new ATOM 0 HA LYS A 9 3.598 7.527 13.318 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.650 6.458 11.539 1.00 0.00 H new ATOM 0 HB3 LYS A 9 3.294 6.690 10.453 1.00 0.00 H new ATOM 0 HG2 LYS A 9 3.893 8.856 9.937 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.425 9.213 11.568 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.574 8.279 11.221 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.040 7.288 9.878 1.00 0.00 H new ATOM 0 HE2 LYS A 9 6.924 8.913 8.542 1.00 0.00 H new ATOM 0 HE3 LYS A 9 5.488 9.840 8.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.492 11.099 9.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.658 10.803 10.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.049 9.905 10.445 1.00 0.00 H new ATOM 165 N LYS A 10 2.629 9.745 12.877 1.00 0.00 N ATOM 166 CA LYS A 10 1.934 11.021 12.839 1.00 0.00 C ATOM 167 C LYS A 10 2.704 11.989 11.938 1.00 0.00 C ATOM 168 O LYS A 10 3.928 11.913 11.841 1.00 0.00 O ATOM 169 CB LYS A 10 1.707 11.550 14.257 1.00 0.00 C ATOM 170 CG LYS A 10 0.222 11.815 14.512 1.00 0.00 C ATOM 171 CD LYS A 10 0.032 12.989 15.474 1.00 0.00 C ATOM 172 CE LYS A 10 -0.184 12.495 16.906 1.00 0.00 C ATOM 173 NZ LYS A 10 -1.336 13.189 17.525 1.00 0.00 N ATOM 0 H LYS A 10 3.539 9.768 13.337 1.00 0.00 H new ATOM 0 HA LYS A 10 0.941 10.901 12.405 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.081 10.828 14.983 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.274 12.470 14.401 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -0.280 12.028 13.568 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -0.245 10.921 14.926 1.00 0.00 H new ATOM 0 HD2 LYS A 10 0.906 13.639 15.438 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -0.823 13.587 15.159 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -0.358 11.419 16.903 1.00 0.00 H new ATOM 0 HE3 LYS A 10 0.715 12.671 17.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -1.469 12.842 18.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -1.155 14.213 17.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -2.195 13.000 16.969 1.00 0.00 H new ATOM 187 N ASN A 11 1.954 12.876 11.301 1.00 0.00 N ATOM 188 CA ASN A 11 2.550 13.858 10.411 1.00 0.00 C ATOM 189 C ASN A 11 1.662 15.103 10.363 1.00 0.00 C ATOM 190 O ASN A 11 0.695 15.151 9.604 1.00 0.00 O ATOM 191 CB ASN A 11 2.672 13.309 8.988 1.00 0.00 C ATOM 192 CG ASN A 11 3.628 14.161 8.151 1.00 0.00 C ATOM 193 OD1 ASN A 11 4.248 15.097 8.630 1.00 0.00 O ATOM 194 ND2 ASN A 11 3.712 13.787 6.877 1.00 0.00 N ATOM 0 H ASN A 11 0.939 12.935 11.383 1.00 0.00 H new ATOM 0 HA ASN A 11 3.543 14.099 10.791 1.00 0.00 H new ATOM 0 HB2 ASN A 11 3.030 12.280 9.021 1.00 0.00 H new ATOM 0 HB3 ASN A 11 1.689 13.289 8.517 1.00 0.00 H new ATOM 0 HD21 ASN A 11 4.323 14.293 6.236 1.00 0.00 H new ATOM 0 HD22 ASN A 11 3.165 12.994 6.541 1.00 0.00 H new ATOM 201 N PRO A 12 2.032 16.105 11.204 1.00 0.00 N ATOM 202 CA PRO A 12 1.279 17.347 11.265 1.00 0.00 C ATOM 203 C PRO A 12 1.565 18.221 10.043 1.00 0.00 C ATOM 204 O PRO A 12 0.829 19.167 9.766 1.00 0.00 O ATOM 205 CB PRO A 12 1.700 17.998 12.573 1.00 0.00 C ATOM 206 CG PRO A 12 3.008 17.332 12.968 1.00 0.00 C ATOM 207 CD PRO A 12 3.171 16.083 12.117 1.00 0.00 C ATOM 0 HA PRO A 12 0.201 17.188 11.244 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.831 19.073 12.450 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.941 17.855 13.342 1.00 0.00 H new ATOM 0 HG2 PRO A 12 3.845 18.012 12.812 1.00 0.00 H new ATOM 0 HG3 PRO A 12 3.000 17.074 14.027 1.00 0.00 H new ATOM 0 HD2 PRO A 12 4.115 16.095 11.573 1.00 0.00 H new ATOM 0 HD3 PRO A 12 3.169 15.182 12.731 1.00 0.00 H new ATOM 215 N LEU A 13 2.635 17.874 9.344 1.00 0.00 N ATOM 216 CA LEU A 13 3.027 18.616 8.157 1.00 0.00 C ATOM 217 C LEU A 13 1.973 18.418 7.066 1.00 0.00 C ATOM 218 O LEU A 13 1.379 19.383 6.590 1.00 0.00 O ATOM 219 CB LEU A 13 4.442 18.225 7.724 1.00 0.00 C ATOM 220 CG LEU A 13 5.524 18.325 8.801 1.00 0.00 C ATOM 221 CD1 LEU A 13 6.827 17.675 8.330 1.00 0.00 C ATOM 222 CD2 LEU A 13 5.732 19.776 9.237 1.00 0.00 C ATOM 0 H LEU A 13 3.243 17.089 9.576 1.00 0.00 H new ATOM 0 HA LEU A 13 3.068 19.684 8.371 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.418 17.199 7.356 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.732 18.858 6.886 1.00 0.00 H new ATOM 0 HG LEU A 13 5.186 17.772 9.677 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.580 17.760 9.114 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.650 16.622 8.109 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.181 18.179 7.431 1.00 0.00 H new ATOM 0 HD21 LEU A 13 6.506 19.818 10.003 1.00 0.00 H new ATOM 0 HD22 LEU A 13 6.038 20.374 8.378 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.800 20.172 9.641 1.00 0.00 H new ATOM 234 N LEU A 14 1.774 17.159 6.702 1.00 0.00 N ATOM 235 CA LEU A 14 0.802 16.822 5.676 1.00 0.00 C ATOM 236 C LEU A 14 -0.600 16.819 6.288 1.00 0.00 C ATOM 237 O LEU A 14 -1.596 16.878 5.569 1.00 0.00 O ATOM 238 CB LEU A 14 1.179 15.506 4.993 1.00 0.00 C ATOM 239 CG LEU A 14 2.547 15.472 4.309 1.00 0.00 C ATOM 240 CD1 LEU A 14 2.747 14.159 3.549 1.00 0.00 C ATOM 241 CD2 LEU A 14 2.739 16.692 3.406 1.00 0.00 C ATOM 0 H LEU A 14 2.269 16.361 7.099 1.00 0.00 H new ATOM 0 HA LEU A 14 0.803 17.575 4.888 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.148 14.711 5.738 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.417 15.275 4.249 1.00 0.00 H new ATOM 0 HG LEU A 14 3.316 15.518 5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.727 14.160 3.072 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.683 13.322 4.245 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.973 14.058 2.788 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.719 16.643 2.932 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.965 16.702 2.639 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.670 17.601 4.003 1.00 0.00 H new ATOM 253 N ASN A 15 -0.632 16.749 7.611 1.00 0.00 N ATOM 254 CA ASN A 15 -1.896 16.737 8.329 1.00 0.00 C ATOM 255 C ASN A 15 -2.567 15.374 8.148 1.00 0.00 C ATOM 256 O ASN A 15 -3.793 15.273 8.174 1.00 0.00 O ATOM 257 CB ASN A 15 -2.846 17.807 7.789 1.00 0.00 C ATOM 258 CG ASN A 15 -3.366 18.699 8.918 1.00 0.00 C ATOM 259 OD1 ASN A 15 -3.185 19.906 8.924 1.00 0.00 O ATOM 260 ND2 ASN A 15 -4.020 18.041 9.870 1.00 0.00 N ATOM 0 H ASN A 15 0.196 16.700 8.204 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.689 16.936 9.380 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.329 18.417 7.048 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.685 17.331 7.281 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.406 18.547 10.667 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.136 17.030 9.804 1.00 0.00 H new ATOM 267 N ARG A 16 -1.734 14.359 7.970 1.00 0.00 N ATOM 268 CA ARG A 16 -2.232 13.006 7.785 1.00 0.00 C ATOM 269 C ARG A 16 -1.659 12.079 8.859 1.00 0.00 C ATOM 270 O ARG A 16 -1.028 12.539 9.809 1.00 0.00 O ATOM 271 CB ARG A 16 -1.859 12.466 6.403 1.00 0.00 C ATOM 272 CG ARG A 16 -0.377 12.090 6.342 1.00 0.00 C ATOM 273 CD ARG A 16 0.083 11.905 4.895 1.00 0.00 C ATOM 274 NE ARG A 16 1.423 11.278 4.866 1.00 0.00 N ATOM 275 CZ ARG A 16 2.039 10.873 3.747 1.00 0.00 C ATOM 276 NH1 ARG A 16 1.438 11.025 2.559 1.00 0.00 N ATOM 277 NH2 ARG A 16 3.255 10.314 3.816 1.00 0.00 N ATOM 0 H ARG A 16 -0.718 14.446 7.950 1.00 0.00 H new ATOM 0 HA ARG A 16 -3.318 13.038 7.869 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.469 11.592 6.173 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -2.079 13.217 5.644 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.219 12.867 6.820 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -0.208 11.170 6.901 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -0.630 11.283 4.355 1.00 0.00 H new ATOM 0 HD3 ARG A 16 0.113 12.869 4.388 1.00 0.00 H new ATOM 0 HE ARG A 16 1.908 11.146 5.753 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.512 11.449 2.507 1.00 0.00 H new ATOM 0 HH12 ARG A 16 1.907 10.717 1.707 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.712 10.197 4.720 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.724 10.006 2.964 1.00 0.00 H new ATOM 291 N ARG A 17 -1.900 10.789 8.671 1.00 0.00 N ATOM 292 CA ARG A 17 -1.416 9.793 9.612 1.00 0.00 C ATOM 293 C ARG A 17 -1.146 8.471 8.892 1.00 0.00 C ATOM 294 O ARG A 17 -2.052 7.884 8.303 1.00 0.00 O ATOM 295 CB ARG A 17 -2.429 9.557 10.734 1.00 0.00 C ATOM 296 CG ARG A 17 -1.745 9.574 12.103 1.00 0.00 C ATOM 297 CD ARG A 17 -2.750 9.883 13.214 1.00 0.00 C ATOM 298 NE ARG A 17 -2.897 8.711 14.105 1.00 0.00 N ATOM 299 CZ ARG A 17 -3.419 8.764 15.338 1.00 0.00 C ATOM 300 NH1 ARG A 17 -3.847 9.933 15.833 1.00 0.00 N ATOM 301 NH2 ARG A 17 -3.513 7.649 16.075 1.00 0.00 N ATOM 0 H ARG A 17 -2.424 10.411 7.881 1.00 0.00 H new ATOM 0 HA ARG A 17 -0.490 10.170 10.047 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -3.201 10.326 10.700 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -2.927 8.599 10.584 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.275 8.609 12.291 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -0.951 10.321 12.108 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -2.415 10.747 13.788 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -3.715 10.143 12.780 1.00 0.00 H new ATOM 0 HE ARG A 17 -2.581 7.805 13.759 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -3.775 10.781 15.271 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -4.245 9.975 16.771 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -3.187 6.759 15.698 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -3.910 7.690 17.013 1.00 0.00 H new ATOM 315 N GLU A 18 0.105 8.040 8.963 1.00 0.00 N ATOM 316 CA GLU A 18 0.506 6.797 8.326 1.00 0.00 C ATOM 317 C GLU A 18 0.378 5.631 9.308 1.00 0.00 C ATOM 318 O GLU A 18 1.210 5.472 10.200 1.00 0.00 O ATOM 319 CB GLU A 18 1.931 6.898 7.777 1.00 0.00 C ATOM 320 CG GLU A 18 2.066 8.080 6.815 1.00 0.00 C ATOM 321 CD GLU A 18 1.329 7.806 5.503 1.00 0.00 C ATOM 322 OE1 GLU A 18 1.244 6.613 5.138 1.00 0.00 O ATOM 323 OE2 GLU A 18 0.868 8.795 4.893 1.00 0.00 O ATOM 0 H GLU A 18 0.854 8.530 9.452 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.161 6.611 7.484 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.635 7.013 8.601 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.192 5.974 7.262 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.665 8.980 7.281 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.120 8.269 6.612 1.00 0.00 H new ATOM 330 N LEU A 19 -0.671 4.846 9.111 1.00 0.00 N ATOM 331 CA LEU A 19 -0.919 3.700 9.969 1.00 0.00 C ATOM 332 C LEU A 19 -0.657 2.414 9.182 1.00 0.00 C ATOM 333 O LEU A 19 -1.100 2.278 8.042 1.00 0.00 O ATOM 334 CB LEU A 19 -2.323 3.776 10.573 1.00 0.00 C ATOM 335 CG LEU A 19 -2.766 5.154 11.068 1.00 0.00 C ATOM 336 CD1 LEU A 19 -3.980 5.654 10.283 1.00 0.00 C ATOM 337 CD2 LEU A 19 -3.025 5.137 12.576 1.00 0.00 C ATOM 0 H LEU A 19 -1.359 4.981 8.370 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.233 3.702 10.816 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.038 3.433 9.825 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.376 3.077 11.408 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.954 5.859 10.889 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.275 6.635 10.655 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.724 5.728 9.226 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.807 4.955 10.408 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.339 6.129 12.903 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.810 4.415 12.802 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.111 4.855 13.099 1.00 0.00 H new ATOM 349 N ASP A 20 0.062 1.503 9.821 1.00 0.00 N ATOM 350 CA ASP A 20 0.388 0.233 9.195 1.00 0.00 C ATOM 351 C ASP A 20 -0.266 -0.903 9.985 1.00 0.00 C ATOM 352 O ASP A 20 -0.332 -0.853 11.212 1.00 0.00 O ATOM 353 CB ASP A 20 1.899 -0.006 9.188 1.00 0.00 C ATOM 354 CG ASP A 20 2.719 1.063 8.462 1.00 0.00 C ATOM 355 OD1 ASP A 20 2.084 1.986 7.908 1.00 0.00 O ATOM 356 OD2 ASP A 20 3.962 0.932 8.477 1.00 0.00 O ATOM 0 H ASP A 20 0.428 1.619 10.766 1.00 0.00 H new ATOM 0 HA ASP A 20 0.022 0.260 8.169 1.00 0.00 H new ATOM 0 HB2 ASP A 20 2.246 -0.071 10.219 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.097 -0.972 8.724 1.00 0.00 H new ATOM 361 N PHE A 21 -0.732 -1.901 9.249 1.00 0.00 N ATOM 362 CA PHE A 21 -1.379 -3.047 9.865 1.00 0.00 C ATOM 363 C PHE A 21 -1.384 -4.248 8.917 1.00 0.00 C ATOM 364 O PHE A 21 -1.139 -4.101 7.721 1.00 0.00 O ATOM 365 CB PHE A 21 -2.824 -2.640 10.160 1.00 0.00 C ATOM 366 CG PHE A 21 -3.639 -2.289 8.914 1.00 0.00 C ATOM 367 CD1 PHE A 21 -3.497 -1.070 8.329 1.00 0.00 C ATOM 368 CD2 PHE A 21 -4.506 -3.197 8.391 1.00 0.00 C ATOM 369 CE1 PHE A 21 -4.253 -0.745 7.172 1.00 0.00 C ATOM 370 CE2 PHE A 21 -5.263 -2.872 7.234 1.00 0.00 C ATOM 371 CZ PHE A 21 -5.120 -1.653 6.649 1.00 0.00 C ATOM 0 H PHE A 21 -0.674 -1.940 8.231 1.00 0.00 H new ATOM 0 HA PHE A 21 -0.844 -3.334 10.770 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.319 -3.455 10.688 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -2.819 -1.782 10.832 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -2.809 -0.349 8.745 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -4.619 -4.165 8.856 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.140 0.223 6.707 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -5.952 -3.593 6.819 1.00 0.00 H new ATOM 0 HZ PHE A 21 -5.695 -1.406 5.769 1.00 0.00 H new ATOM 381 N ILE A 22 -1.665 -5.410 9.488 1.00 0.00 N ATOM 382 CA ILE A 22 -1.705 -6.637 8.710 1.00 0.00 C ATOM 383 C ILE A 22 -3.124 -7.208 8.739 1.00 0.00 C ATOM 384 O ILE A 22 -3.736 -7.306 9.801 1.00 0.00 O ATOM 385 CB ILE A 22 -0.637 -7.617 9.199 1.00 0.00 C ATOM 386 CG1 ILE A 22 0.739 -6.949 9.249 1.00 0.00 C ATOM 387 CG2 ILE A 22 -0.627 -8.887 8.346 1.00 0.00 C ATOM 388 CD1 ILE A 22 1.286 -6.714 7.840 1.00 0.00 C ATOM 0 H ILE A 22 -1.867 -5.528 10.481 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.464 -6.434 7.666 1.00 0.00 H new ATOM 0 HB ILE A 22 -0.887 -7.915 10.217 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.667 -5.999 9.778 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.431 -7.575 9.812 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.141 -9.567 8.715 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.601 -9.373 8.406 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.414 -8.627 7.309 1.00 0.00 H new ATOM 0 HD11 ILE A 22 2.265 -6.238 7.904 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.380 -7.669 7.322 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.604 -6.067 7.288 1.00 0.00 H new ATOM 400 N VAL A 23 -3.605 -7.571 7.559 1.00 0.00 N ATOM 401 CA VAL A 23 -4.941 -8.131 7.436 1.00 0.00 C ATOM 402 C VAL A 23 -4.839 -9.646 7.250 1.00 0.00 C ATOM 403 O VAL A 23 -4.223 -10.118 6.296 1.00 0.00 O ATOM 404 CB VAL A 23 -5.696 -7.438 6.300 1.00 0.00 C ATOM 405 CG1 VAL A 23 -7.174 -7.833 6.303 1.00 0.00 C ATOM 406 CG2 VAL A 23 -5.533 -5.919 6.380 1.00 0.00 C ATOM 0 H VAL A 23 -3.094 -7.488 6.680 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.515 -7.953 8.345 1.00 0.00 H new ATOM 0 HB VAL A 23 -5.263 -7.771 5.357 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -7.688 -7.327 5.486 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -7.263 -8.912 6.174 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -7.626 -7.542 7.251 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -6.079 -5.451 5.561 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.927 -5.560 7.331 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.476 -5.662 6.305 1.00 0.00 H new ATOM 416 N LYS A 24 -5.454 -10.367 8.177 1.00 0.00 N ATOM 417 CA LYS A 24 -5.440 -11.819 8.127 1.00 0.00 C ATOM 418 C LYS A 24 -6.868 -12.331 7.928 1.00 0.00 C ATOM 419 O LYS A 24 -7.820 -11.738 8.433 1.00 0.00 O ATOM 420 CB LYS A 24 -4.748 -12.391 9.365 1.00 0.00 C ATOM 421 CG LYS A 24 -3.242 -12.530 9.137 1.00 0.00 C ATOM 422 CD LYS A 24 -2.523 -12.909 10.433 1.00 0.00 C ATOM 423 CE LYS A 24 -1.103 -13.403 10.149 1.00 0.00 C ATOM 424 NZ LYS A 24 -0.955 -14.818 10.555 1.00 0.00 N ATOM 0 H LYS A 24 -5.965 -9.972 8.967 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.855 -12.166 7.275 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.931 -11.741 10.221 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.174 -13.365 9.607 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.054 -13.289 8.378 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.840 -11.591 8.755 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -2.485 -12.046 11.098 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.085 -13.686 10.951 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.881 -13.298 9.087 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.383 -12.787 10.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.015 -15.137 10.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.146 -14.909 11.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.629 -15.404 10.022 1.00 0.00 H new ATOM 438 N TYR A 25 -6.972 -13.427 7.191 1.00 0.00 N ATOM 439 CA TYR A 25 -8.268 -14.026 6.920 1.00 0.00 C ATOM 440 C TYR A 25 -8.113 -15.468 6.430 1.00 0.00 C ATOM 441 O TYR A 25 -6.997 -15.941 6.223 1.00 0.00 O ATOM 442 CB TYR A 25 -8.895 -13.187 5.805 1.00 0.00 C ATOM 443 CG TYR A 25 -8.054 -13.119 4.529 1.00 0.00 C ATOM 444 CD1 TYR A 25 -6.920 -12.335 4.490 1.00 0.00 C ATOM 445 CD2 TYR A 25 -8.431 -13.842 3.415 1.00 0.00 C ATOM 446 CE1 TYR A 25 -6.128 -12.271 3.289 1.00 0.00 C ATOM 447 CE2 TYR A 25 -7.640 -13.779 2.214 1.00 0.00 C ATOM 448 CZ TYR A 25 -6.528 -12.996 2.210 1.00 0.00 C ATOM 449 OH TYR A 25 -5.781 -12.936 1.075 1.00 0.00 O ATOM 0 H TYR A 25 -6.180 -13.916 6.773 1.00 0.00 H new ATOM 0 HA TYR A 25 -8.878 -14.046 7.823 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -9.874 -13.599 5.561 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -9.059 -12.175 6.174 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -6.626 -11.768 5.361 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -9.320 -14.455 3.445 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -5.237 -11.662 3.246 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -7.923 -14.341 1.336 1.00 0.00 H new ATOM 0 HH TYR A 25 -6.363 -12.745 0.310 1.00 0.00 H new ATOM 459 N GLU A 26 -9.251 -16.126 6.261 1.00 0.00 N ATOM 460 CA GLU A 26 -9.256 -17.504 5.800 1.00 0.00 C ATOM 461 C GLU A 26 -10.351 -17.709 4.751 1.00 0.00 C ATOM 462 O GLU A 26 -11.357 -18.365 5.017 1.00 0.00 O ATOM 463 CB GLU A 26 -9.432 -18.473 6.971 1.00 0.00 C ATOM 464 CG GLU A 26 -8.082 -19.026 7.432 1.00 0.00 C ATOM 465 CD GLU A 26 -8.042 -19.177 8.954 1.00 0.00 C ATOM 466 OE1 GLU A 26 -8.500 -20.238 9.431 1.00 0.00 O ATOM 467 OE2 GLU A 26 -7.555 -18.229 9.606 1.00 0.00 O ATOM 0 H GLU A 26 -10.175 -15.731 6.435 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.292 -17.715 5.337 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.922 -17.962 7.800 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.083 -19.295 6.673 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.902 -19.993 6.962 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.282 -18.360 7.108 1.00 0.00 H new ATOM 474 N GLY A 27 -10.117 -17.135 3.579 1.00 0.00 N ATOM 475 CA GLY A 27 -11.071 -17.246 2.489 1.00 0.00 C ATOM 476 C GLY A 27 -11.018 -16.011 1.587 1.00 0.00 C ATOM 477 O GLY A 27 -9.961 -15.405 1.419 1.00 0.00 O ATOM 0 H GLY A 27 -9.281 -16.592 3.361 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -10.856 -18.139 1.902 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.077 -17.364 2.892 1.00 0.00 H new ATOM 481 N SER A 28 -12.172 -15.676 1.029 1.00 0.00 N ATOM 482 CA SER A 28 -12.271 -14.525 0.148 1.00 0.00 C ATOM 483 C SER A 28 -11.442 -13.366 0.706 1.00 0.00 C ATOM 484 O SER A 28 -11.524 -13.055 1.893 1.00 0.00 O ATOM 485 CB SER A 28 -13.728 -14.094 -0.035 1.00 0.00 C ATOM 486 OG SER A 28 -14.633 -15.178 0.158 1.00 0.00 O ATOM 0 H SER A 28 -13.047 -16.182 1.170 1.00 0.00 H new ATOM 0 HA SER A 28 -11.878 -14.808 -0.829 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.962 -13.297 0.670 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.862 -13.684 -1.036 1.00 0.00 H new ATOM 0 HG SER A 28 -15.553 -14.862 0.034 1.00 0.00 H new ATOM 492 N THR A 29 -10.662 -12.760 -0.177 1.00 0.00 N ATOM 493 CA THR A 29 -9.818 -11.643 0.213 1.00 0.00 C ATOM 494 C THR A 29 -10.676 -10.452 0.645 1.00 0.00 C ATOM 495 O THR A 29 -11.757 -10.231 0.101 1.00 0.00 O ATOM 496 CB THR A 29 -8.884 -11.326 -0.957 1.00 0.00 C ATOM 497 OG1 THR A 29 -7.863 -12.315 -0.864 1.00 0.00 O ATOM 498 CG2 THR A 29 -8.139 -10.003 -0.768 1.00 0.00 C ATOM 0 H THR A 29 -10.597 -13.021 -1.161 1.00 0.00 H new ATOM 0 HA THR A 29 -9.205 -11.893 1.079 1.00 0.00 H new ATOM 0 HB THR A 29 -9.460 -11.290 -1.882 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.214 -12.184 -1.587 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.490 -9.825 -1.625 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.859 -9.189 -0.683 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.537 -10.051 0.139 1.00 0.00 H new ATOM 506 N PRO A 30 -10.149 -9.697 1.646 1.00 0.00 N ATOM 507 CA PRO A 30 -10.854 -8.535 2.158 1.00 0.00 C ATOM 508 C PRO A 30 -10.763 -7.363 1.179 1.00 0.00 C ATOM 509 O PRO A 30 -9.746 -7.186 0.510 1.00 0.00 O ATOM 510 CB PRO A 30 -10.204 -8.240 3.500 1.00 0.00 C ATOM 511 CG PRO A 30 -8.862 -8.953 3.479 1.00 0.00 C ATOM 512 CD PRO A 30 -8.871 -9.930 2.314 1.00 0.00 C ATOM 0 HA PRO A 30 -11.923 -8.711 2.278 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -10.074 -7.167 3.644 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -10.824 -8.599 4.322 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.050 -8.235 3.368 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.695 -9.480 4.418 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -8.033 -9.751 1.640 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -8.787 -10.960 2.660 1.00 0.00 H new ATOM 520 N SER A 31 -11.839 -6.592 1.126 1.00 0.00 N ATOM 521 CA SER A 31 -11.893 -5.442 0.239 1.00 0.00 C ATOM 522 C SER A 31 -11.337 -4.207 0.951 1.00 0.00 C ATOM 523 O SER A 31 -11.373 -4.124 2.177 1.00 0.00 O ATOM 524 CB SER A 31 -13.323 -5.181 -0.237 1.00 0.00 C ATOM 525 OG SER A 31 -13.866 -6.298 -0.937 1.00 0.00 O ATOM 0 H SER A 31 -12.680 -6.741 1.683 1.00 0.00 H new ATOM 0 HA SER A 31 -11.281 -5.656 -0.637 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.954 -4.950 0.621 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.335 -4.306 -0.887 1.00 0.00 H new ATOM 0 HG SER A 31 -14.781 -6.092 -1.223 1.00 0.00 H new ATOM 531 N ARG A 32 -10.835 -3.278 0.150 1.00 0.00 N ATOM 532 CA ARG A 32 -10.272 -2.052 0.687 1.00 0.00 C ATOM 533 C ARG A 32 -11.302 -1.332 1.561 1.00 0.00 C ATOM 534 O ARG A 32 -10.952 -0.746 2.584 1.00 0.00 O ATOM 535 CB ARG A 32 -9.822 -1.114 -0.435 1.00 0.00 C ATOM 536 CG ARG A 32 -8.465 -1.543 -0.997 1.00 0.00 C ATOM 537 CD ARG A 32 -8.100 -0.723 -2.235 1.00 0.00 C ATOM 538 NE ARG A 32 -8.762 -1.289 -3.431 1.00 0.00 N ATOM 539 CZ ARG A 32 -8.658 -0.773 -4.663 1.00 0.00 C ATOM 540 NH1 ARG A 32 -7.917 0.325 -4.869 1.00 0.00 N ATOM 541 NH2 ARG A 32 -9.294 -1.354 -5.690 1.00 0.00 N ATOM 0 H ARG A 32 -10.807 -3.351 -0.867 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.405 -2.323 1.289 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -10.565 -1.112 -1.232 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -9.757 -0.094 -0.057 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.696 -1.419 -0.235 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.492 -2.602 -1.253 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -8.405 0.314 -2.097 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.019 -0.721 -2.374 1.00 0.00 H new ATOM 0 HE ARG A 32 -9.334 -2.125 -3.310 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -7.433 0.767 -4.088 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -7.838 0.718 -5.807 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -9.858 -2.190 -5.534 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -9.214 -0.960 -6.628 1.00 0.00 H new ATOM 555 N ASN A 33 -12.551 -1.402 1.125 1.00 0.00 N ATOM 556 CA ASN A 33 -13.635 -0.765 1.854 1.00 0.00 C ATOM 557 C ASN A 33 -13.938 -1.573 3.117 1.00 0.00 C ATOM 558 O ASN A 33 -14.453 -1.033 4.095 1.00 0.00 O ATOM 559 CB ASN A 33 -14.910 -0.711 1.010 1.00 0.00 C ATOM 560 CG ASN A 33 -14.729 0.209 -0.199 1.00 0.00 C ATOM 561 OD1 ASN A 33 -14.099 1.252 -0.130 1.00 0.00 O ATOM 562 ND2 ASN A 33 -15.314 -0.233 -1.308 1.00 0.00 N ATOM 0 H ASN A 33 -12.837 -1.890 0.276 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.324 0.250 2.102 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.170 -1.714 0.672 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -15.740 -0.356 1.621 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -15.250 0.310 -2.169 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -15.826 -1.115 -1.298 1.00 0.00 H new ATOM 569 N ASP A 34 -13.605 -2.854 3.056 1.00 0.00 N ATOM 570 CA ASP A 34 -13.835 -3.741 4.183 1.00 0.00 C ATOM 571 C ASP A 34 -12.799 -3.455 5.272 1.00 0.00 C ATOM 572 O ASP A 34 -13.149 -3.297 6.440 1.00 0.00 O ATOM 573 CB ASP A 34 -13.692 -5.207 3.768 1.00 0.00 C ATOM 574 CG ASP A 34 -14.985 -6.023 3.820 1.00 0.00 C ATOM 575 OD1 ASP A 34 -16.042 -5.432 3.511 1.00 0.00 O ATOM 576 OD2 ASP A 34 -14.887 -7.220 4.169 1.00 0.00 O ATOM 0 H ASP A 34 -13.178 -3.299 2.243 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.847 -3.566 4.548 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.297 -5.245 2.753 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.954 -5.682 4.415 1.00 0.00 H new ATOM 581 N VAL A 35 -11.544 -3.398 4.850 1.00 0.00 N ATOM 582 CA VAL A 35 -10.455 -3.134 5.774 1.00 0.00 C ATOM 583 C VAL A 35 -10.612 -1.725 6.351 1.00 0.00 C ATOM 584 O VAL A 35 -10.425 -1.517 7.549 1.00 0.00 O ATOM 585 CB VAL A 35 -9.111 -3.347 5.075 1.00 0.00 C ATOM 586 CG1 VAL A 35 -7.975 -2.685 5.856 1.00 0.00 C ATOM 587 CG2 VAL A 35 -8.835 -4.837 4.862 1.00 0.00 C ATOM 0 H VAL A 35 -11.258 -3.530 3.880 1.00 0.00 H new ATOM 0 HA VAL A 35 -10.486 -3.833 6.609 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.164 -2.872 4.095 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.031 -2.852 5.337 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.162 -1.614 5.933 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.921 -3.117 6.855 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -7.874 -4.961 4.363 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.812 -5.344 5.826 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -9.623 -5.268 4.244 1.00 0.00 H new ATOM 597 N ARG A 36 -10.953 -0.795 5.472 1.00 0.00 N ATOM 598 CA ARG A 36 -11.137 0.588 5.879 1.00 0.00 C ATOM 599 C ARG A 36 -12.204 0.682 6.972 1.00 0.00 C ATOM 600 O ARG A 36 -11.968 1.275 8.024 1.00 0.00 O ATOM 601 CB ARG A 36 -11.554 1.460 4.693 1.00 0.00 C ATOM 602 CG ARG A 36 -10.424 2.407 4.285 1.00 0.00 C ATOM 603 CD ARG A 36 -10.982 3.700 3.686 1.00 0.00 C ATOM 604 NE ARG A 36 -10.287 4.011 2.417 1.00 0.00 N ATOM 605 CZ ARG A 36 -10.746 4.875 1.501 1.00 0.00 C ATOM 606 NH1 ARG A 36 -11.903 5.519 1.708 1.00 0.00 N ATOM 607 NH2 ARG A 36 -10.048 5.095 0.378 1.00 0.00 N ATOM 0 H ARG A 36 -11.107 -0.972 4.479 1.00 0.00 H new ATOM 0 HA ARG A 36 -10.184 0.950 6.264 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -11.825 0.826 3.849 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -12.440 2.037 4.955 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -9.809 2.640 5.154 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.777 1.915 3.559 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -12.052 3.596 3.508 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -10.855 4.522 4.391 1.00 0.00 H new ATOM 0 HE ARG A 36 -9.403 3.538 2.228 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -12.434 5.352 2.563 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -12.252 6.177 1.011 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -9.167 4.605 0.221 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -10.397 5.753 -0.319 1.00 0.00 H new ATOM 621 N ASN A 37 -13.353 0.089 6.686 1.00 0.00 N ATOM 622 CA ASN A 37 -14.456 0.099 7.631 1.00 0.00 C ATOM 623 C ASN A 37 -13.989 -0.502 8.959 1.00 0.00 C ATOM 624 O ASN A 37 -14.452 -0.097 10.024 1.00 0.00 O ATOM 625 CB ASN A 37 -15.628 -0.740 7.119 1.00 0.00 C ATOM 626 CG ASN A 37 -16.740 0.152 6.564 1.00 0.00 C ATOM 627 OD1 ASN A 37 -17.194 1.090 7.199 1.00 0.00 O ATOM 628 ND2 ASN A 37 -17.153 -0.192 5.347 1.00 0.00 N ATOM 0 H ASN A 37 -13.544 -0.402 5.813 1.00 0.00 H new ATOM 0 HA ASN A 37 -14.781 1.132 7.759 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -15.281 -1.420 6.341 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -16.020 -1.355 7.929 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -17.893 0.341 4.890 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -16.730 -0.989 4.871 1.00 0.00 H new ATOM 635 N LYS A 38 -13.078 -1.458 8.852 1.00 0.00 N ATOM 636 CA LYS A 38 -12.544 -2.118 10.030 1.00 0.00 C ATOM 637 C LYS A 38 -11.638 -1.145 10.788 1.00 0.00 C ATOM 638 O LYS A 38 -11.808 -0.940 11.989 1.00 0.00 O ATOM 639 CB LYS A 38 -11.853 -3.427 9.644 1.00 0.00 C ATOM 640 CG LYS A 38 -11.876 -4.423 10.806 1.00 0.00 C ATOM 641 CD LYS A 38 -12.262 -5.822 10.321 1.00 0.00 C ATOM 642 CE LYS A 38 -12.733 -6.695 11.486 1.00 0.00 C ATOM 643 NZ LYS A 38 -11.655 -6.844 12.490 1.00 0.00 N ATOM 0 H LYS A 38 -12.696 -1.791 7.967 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.350 -2.398 10.708 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -12.350 -3.863 8.777 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -10.822 -3.226 9.353 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.895 -4.456 11.281 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -12.585 -4.088 11.563 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.053 -5.747 9.575 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.407 -6.290 9.833 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.612 -6.248 11.951 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.032 -7.676 11.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -11.925 -7.569 13.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -10.775 -7.130 12.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -11.506 -5.937 12.977 1.00 0.00 H new ATOM 657 N LEU A 39 -10.695 -0.571 10.055 1.00 0.00 N ATOM 658 CA LEU A 39 -9.762 0.375 10.642 1.00 0.00 C ATOM 659 C LEU A 39 -10.537 1.576 11.190 1.00 0.00 C ATOM 660 O LEU A 39 -10.393 1.932 12.358 1.00 0.00 O ATOM 661 CB LEU A 39 -8.675 0.753 9.634 1.00 0.00 C ATOM 662 CG LEU A 39 -7.234 0.479 10.067 1.00 0.00 C ATOM 663 CD1 LEU A 39 -6.737 -0.855 9.508 1.00 0.00 C ATOM 664 CD2 LEU A 39 -6.315 1.640 9.681 1.00 0.00 C ATOM 0 H LEU A 39 -10.557 -0.743 9.059 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.239 -0.079 11.484 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.864 0.212 8.707 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.770 1.815 9.409 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.214 0.400 11.154 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.710 -1.025 9.831 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.371 -1.662 9.875 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.775 -0.830 8.419 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -5.296 1.419 10.000 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.335 1.776 8.600 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.658 2.553 10.168 1.00 0.00 H new ATOM 676 N ALA A 40 -11.343 2.166 10.319 1.00 0.00 N ATOM 677 CA ALA A 40 -12.141 3.319 10.701 1.00 0.00 C ATOM 678 C ALA A 40 -12.863 3.021 12.016 1.00 0.00 C ATOM 679 O ALA A 40 -13.019 3.906 12.857 1.00 0.00 O ATOM 680 CB ALA A 40 -13.110 3.666 9.569 1.00 0.00 C ATOM 0 H ALA A 40 -11.460 1.867 9.351 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.505 4.189 10.864 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -13.709 4.531 9.855 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.546 3.898 8.666 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -13.766 2.817 9.379 1.00 0.00 H new ATOM 686 N ALA A 41 -13.284 1.772 12.153 1.00 0.00 N ATOM 687 CA ALA A 41 -13.986 1.347 13.353 1.00 0.00 C ATOM 688 C ALA A 41 -12.983 1.189 14.497 1.00 0.00 C ATOM 689 O ALA A 41 -13.289 1.507 15.644 1.00 0.00 O ATOM 690 CB ALA A 41 -14.751 0.054 13.065 1.00 0.00 C ATOM 0 H ALA A 41 -13.153 1.041 11.454 1.00 0.00 H new ATOM 0 HA ALA A 41 -14.716 2.097 13.657 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -15.278 -0.265 13.964 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -15.471 0.228 12.265 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -14.050 -0.723 12.760 1.00 0.00 H new ATOM 696 N MET A 42 -11.804 0.696 14.144 1.00 0.00 N ATOM 697 CA MET A 42 -10.754 0.492 15.126 1.00 0.00 C ATOM 698 C MET A 42 -10.236 1.828 15.662 1.00 0.00 C ATOM 699 O MET A 42 -10.096 2.004 16.871 1.00 0.00 O ATOM 700 CB MET A 42 -9.600 -0.284 14.487 1.00 0.00 C ATOM 701 CG MET A 42 -9.959 -1.762 14.320 1.00 0.00 C ATOM 702 SD MET A 42 -8.866 -2.525 13.133 1.00 0.00 S ATOM 703 CE MET A 42 -7.520 -2.993 14.208 1.00 0.00 C ATOM 0 H MET A 42 -11.554 0.432 13.191 1.00 0.00 H new ATOM 0 HA MET A 42 -11.168 -0.076 15.959 1.00 0.00 H new ATOM 0 HB2 MET A 42 -9.361 0.148 13.515 1.00 0.00 H new ATOM 0 HB3 MET A 42 -8.708 -0.191 15.106 1.00 0.00 H new ATOM 0 HG2 MET A 42 -9.882 -2.274 15.279 1.00 0.00 H new ATOM 0 HG3 MET A 42 -10.993 -1.858 13.989 1.00 0.00 H new ATOM 0 HE1 MET A 42 -6.601 -2.515 13.869 1.00 0.00 H new ATOM 0 HE2 MET A 42 -7.740 -2.674 15.227 1.00 0.00 H new ATOM 0 HE3 MET A 42 -7.396 -4.076 14.185 1.00 0.00 H new ATOM 713 N LEU A 43 -9.966 2.736 14.735 1.00 0.00 N ATOM 714 CA LEU A 43 -9.467 4.051 15.099 1.00 0.00 C ATOM 715 C LEU A 43 -10.648 4.998 15.315 1.00 0.00 C ATOM 716 O LEU A 43 -10.458 6.197 15.518 1.00 0.00 O ATOM 717 CB LEU A 43 -8.461 4.549 14.058 1.00 0.00 C ATOM 718 CG LEU A 43 -7.805 3.473 13.191 1.00 0.00 C ATOM 719 CD1 LEU A 43 -6.661 4.059 12.362 1.00 0.00 C ATOM 720 CD2 LEU A 43 -7.347 2.287 14.042 1.00 0.00 C ATOM 0 H LEU A 43 -10.083 2.587 13.733 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.920 4.004 16.041 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.967 5.257 13.402 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.675 5.100 14.575 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.551 3.098 12.490 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.212 3.273 11.755 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.048 4.844 11.712 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.907 4.479 13.028 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.884 1.537 13.401 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.623 2.628 14.782 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.207 1.850 14.550 1.00 0.00 H new ATOM 732 N ASN A 44 -11.842 4.426 15.264 1.00 0.00 N ATOM 733 CA ASN A 44 -13.054 5.204 15.452 1.00 0.00 C ATOM 734 C ASN A 44 -12.929 6.526 14.692 1.00 0.00 C ATOM 735 O ASN A 44 -13.368 7.569 15.176 1.00 0.00 O ATOM 736 CB ASN A 44 -13.277 5.528 16.930 1.00 0.00 C ATOM 737 CG ASN A 44 -11.959 5.894 17.616 1.00 0.00 C ATOM 738 OD1 ASN A 44 -11.614 7.054 17.777 1.00 0.00 O ATOM 739 ND2 ASN A 44 -11.244 4.844 18.010 1.00 0.00 N ATOM 0 H ASN A 44 -11.996 3.432 15.095 1.00 0.00 H new ATOM 0 HA ASN A 44 -13.893 4.615 15.081 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -13.981 6.355 17.022 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -13.726 4.670 17.430 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -10.349 4.983 18.478 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -11.591 3.899 17.844 1.00 0.00 H new ATOM 746 N ALA A 45 -12.329 6.440 13.514 1.00 0.00 N ATOM 747 CA ALA A 45 -12.140 7.617 12.682 1.00 0.00 C ATOM 748 C ALA A 45 -13.089 7.546 11.484 1.00 0.00 C ATOM 749 O ALA A 45 -13.663 6.495 11.203 1.00 0.00 O ATOM 750 CB ALA A 45 -10.673 7.714 12.259 1.00 0.00 C ATOM 0 H ALA A 45 -11.967 5.574 13.116 1.00 0.00 H new ATOM 0 HA ALA A 45 -12.379 8.523 13.239 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.532 8.597 11.635 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.043 7.791 13.145 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -10.397 6.823 11.695 1.00 0.00 H new ATOM 756 N PRO A 46 -13.228 8.708 10.791 1.00 0.00 N ATOM 757 CA PRO A 46 -14.097 8.788 9.630 1.00 0.00 C ATOM 758 C PRO A 46 -13.459 8.103 8.419 1.00 0.00 C ATOM 759 O PRO A 46 -12.366 8.475 7.996 1.00 0.00 O ATOM 760 CB PRO A 46 -14.332 10.274 9.415 1.00 0.00 C ATOM 761 CG PRO A 46 -13.221 10.985 10.171 1.00 0.00 C ATOM 762 CD PRO A 46 -12.564 9.972 11.095 1.00 0.00 C ATOM 0 HA PRO A 46 -15.043 8.266 9.776 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -14.305 10.524 8.354 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -15.312 10.573 9.788 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -12.490 11.398 9.476 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -13.623 11.820 10.744 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -11.491 9.909 10.915 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -12.696 10.247 12.142 1.00 0.00 H new ATOM 770 N LEU A 47 -14.169 7.114 7.897 1.00 0.00 N ATOM 771 CA LEU A 47 -13.686 6.374 6.744 1.00 0.00 C ATOM 772 C LEU A 47 -13.238 7.359 5.662 1.00 0.00 C ATOM 773 O LEU A 47 -12.145 7.229 5.114 1.00 0.00 O ATOM 774 CB LEU A 47 -14.742 5.375 6.267 1.00 0.00 C ATOM 775 CG LEU A 47 -14.228 4.202 5.430 1.00 0.00 C ATOM 776 CD1 LEU A 47 -14.262 2.900 6.232 1.00 0.00 C ATOM 777 CD2 LEU A 47 -15.000 4.086 4.115 1.00 0.00 C ATOM 0 H LEU A 47 -15.075 6.808 8.251 1.00 0.00 H new ATOM 0 HA LEU A 47 -12.815 5.777 7.013 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -15.255 4.974 7.141 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -15.486 5.915 5.681 1.00 0.00 H new ATOM 0 HG LEU A 47 -13.186 4.396 5.175 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -13.892 2.082 5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -13.632 3.001 7.116 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -15.286 2.688 6.538 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -14.614 3.244 3.540 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -16.057 3.927 4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -14.879 5.004 3.540 1.00 0.00 H new ATOM 789 N GLU A 48 -14.106 8.321 5.387 1.00 0.00 N ATOM 790 CA GLU A 48 -13.814 9.327 4.380 1.00 0.00 C ATOM 791 C GLU A 48 -12.386 9.850 4.551 1.00 0.00 C ATOM 792 O GLU A 48 -11.620 9.899 3.590 1.00 0.00 O ATOM 793 CB GLU A 48 -14.827 10.472 4.439 1.00 0.00 C ATOM 794 CG GLU A 48 -14.280 11.724 3.750 1.00 0.00 C ATOM 795 CD GLU A 48 -15.406 12.524 3.093 1.00 0.00 C ATOM 796 OE1 GLU A 48 -16.466 12.652 3.743 1.00 0.00 O ATOM 797 OE2 GLU A 48 -15.182 12.990 1.955 1.00 0.00 O ATOM 0 H GLU A 48 -15.012 8.425 5.844 1.00 0.00 H new ATOM 0 HA GLU A 48 -13.896 8.863 3.397 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -15.756 10.165 3.959 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -15.065 10.699 5.478 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -13.763 12.348 4.479 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -13.545 11.438 2.997 1.00 0.00 H new ATOM 804 N LEU A 49 -12.070 10.226 5.782 1.00 0.00 N ATOM 805 CA LEU A 49 -10.748 10.742 6.091 1.00 0.00 C ATOM 806 C LEU A 49 -9.724 9.612 5.975 1.00 0.00 C ATOM 807 O LEU A 49 -8.546 9.860 5.721 1.00 0.00 O ATOM 808 CB LEU A 49 -10.748 11.434 7.455 1.00 0.00 C ATOM 809 CG LEU A 49 -11.581 12.714 7.558 1.00 0.00 C ATOM 810 CD1 LEU A 49 -11.356 13.408 8.902 1.00 0.00 C ATOM 811 CD2 LEU A 49 -11.302 13.646 6.377 1.00 0.00 C ATOM 0 H LEU A 49 -12.708 10.183 6.577 1.00 0.00 H new ATOM 0 HA LEU A 49 -10.461 11.508 5.371 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -11.112 10.726 8.199 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -9.718 11.672 7.719 1.00 0.00 H new ATOM 0 HG LEU A 49 -12.635 12.441 7.510 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.960 14.314 8.949 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -11.645 12.737 9.711 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -10.302 13.668 9.005 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.906 14.548 6.474 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.246 13.916 6.368 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -11.554 13.139 5.446 1.00 0.00 H new ATOM 823 N LEU A 50 -10.210 8.394 6.167 1.00 0.00 N ATOM 824 CA LEU A 50 -9.351 7.225 6.088 1.00 0.00 C ATOM 825 C LEU A 50 -9.186 6.817 4.622 1.00 0.00 C ATOM 826 O LEU A 50 -10.153 6.814 3.862 1.00 0.00 O ATOM 827 CB LEU A 50 -9.888 6.104 6.980 1.00 0.00 C ATOM 828 CG LEU A 50 -8.881 5.474 7.945 1.00 0.00 C ATOM 829 CD1 LEU A 50 -9.416 5.481 9.378 1.00 0.00 C ATOM 830 CD2 LEU A 50 -8.488 4.069 7.487 1.00 0.00 C ATOM 0 H LEU A 50 -11.187 8.192 6.377 1.00 0.00 H new ATOM 0 HA LEU A 50 -8.357 7.457 6.470 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -10.722 6.497 7.562 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.289 5.318 6.340 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.975 6.080 7.937 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -8.681 5.028 10.043 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.604 6.508 9.691 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -10.345 4.912 9.422 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.772 3.644 8.190 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -9.376 3.438 7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -8.036 4.122 6.497 1.00 0.00 H new ATOM 842 N VAL A 51 -7.953 6.484 4.269 1.00 0.00 N ATOM 843 CA VAL A 51 -7.649 6.076 2.908 1.00 0.00 C ATOM 844 C VAL A 51 -6.669 4.901 2.939 1.00 0.00 C ATOM 845 O VAL A 51 -6.006 4.668 3.949 1.00 0.00 O ATOM 846 CB VAL A 51 -7.125 7.270 2.108 1.00 0.00 C ATOM 847 CG1 VAL A 51 -7.196 6.997 0.605 1.00 0.00 C ATOM 848 CG2 VAL A 51 -7.885 8.548 2.470 1.00 0.00 C ATOM 0 H VAL A 51 -7.153 6.488 4.902 1.00 0.00 H new ATOM 0 HA VAL A 51 -8.552 5.734 2.402 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.078 7.417 2.372 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -6.818 7.862 0.060 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.590 6.123 0.365 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.231 6.811 0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.493 9.382 1.887 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.944 8.417 2.248 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -7.760 8.757 3.532 1.00 0.00 H new ATOM 858 N ILE A 52 -6.608 4.193 1.821 1.00 0.00 N ATOM 859 CA ILE A 52 -5.720 3.049 1.708 1.00 0.00 C ATOM 860 C ILE A 52 -4.744 3.278 0.552 1.00 0.00 C ATOM 861 O ILE A 52 -5.160 3.586 -0.564 1.00 0.00 O ATOM 862 CB ILE A 52 -6.526 1.754 1.585 1.00 0.00 C ATOM 863 CG1 ILE A 52 -7.541 1.630 2.724 1.00 0.00 C ATOM 864 CG2 ILE A 52 -5.602 0.538 1.504 1.00 0.00 C ATOM 865 CD1 ILE A 52 -6.918 0.940 3.939 1.00 0.00 C ATOM 0 H ILE A 52 -7.159 4.390 0.985 1.00 0.00 H new ATOM 0 HA ILE A 52 -5.123 2.940 2.613 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.091 1.790 0.653 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -7.899 2.620 3.007 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.408 1.063 2.384 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.201 -0.369 1.417 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.955 0.630 0.632 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.991 0.485 2.405 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.660 0.864 4.734 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.583 -0.059 3.658 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.067 1.522 4.291 1.00 0.00 H new ATOM 877 N GLN A 53 -3.465 3.119 0.858 1.00 0.00 N ATOM 878 CA GLN A 53 -2.427 3.305 -0.141 1.00 0.00 C ATOM 879 C GLN A 53 -2.449 2.154 -1.149 1.00 0.00 C ATOM 880 O GLN A 53 -2.593 2.378 -2.350 1.00 0.00 O ATOM 881 CB GLN A 53 -1.051 3.433 0.514 1.00 0.00 C ATOM 882 CG GLN A 53 0.037 3.666 -0.536 1.00 0.00 C ATOM 883 CD GLN A 53 1.270 4.322 0.089 1.00 0.00 C ATOM 884 OE1 GLN A 53 1.475 5.522 0.006 1.00 0.00 O ATOM 885 NE2 GLN A 53 2.077 3.471 0.716 1.00 0.00 N ATOM 0 H GLN A 53 -3.124 2.863 1.785 1.00 0.00 H new ATOM 0 HA GLN A 53 -2.626 4.234 -0.675 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -1.058 4.259 1.225 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -0.828 2.528 1.079 1.00 0.00 H new ATOM 0 HG2 GLN A 53 0.317 2.716 -0.991 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -0.352 4.299 -1.333 1.00 0.00 H new ATOM 0 HE21 GLN A 53 1.846 2.478 0.748 1.00 0.00 H new ATOM 0 HE22 GLN A 53 2.927 3.811 1.165 1.00 0.00 H new ATOM 894 N ARG A 54 -2.304 0.946 -0.624 1.00 0.00 N ATOM 895 CA ARG A 54 -2.306 -0.240 -1.463 1.00 0.00 C ATOM 896 C ARG A 54 -2.136 -1.496 -0.606 1.00 0.00 C ATOM 897 O ARG A 54 -1.212 -1.582 0.201 1.00 0.00 O ATOM 898 CB ARG A 54 -1.182 -0.183 -2.500 1.00 0.00 C ATOM 899 CG ARG A 54 -1.722 -0.435 -3.909 1.00 0.00 C ATOM 900 CD ARG A 54 -0.939 0.370 -4.948 1.00 0.00 C ATOM 901 NE ARG A 54 -1.768 0.576 -6.157 1.00 0.00 N ATOM 902 CZ ARG A 54 -1.442 1.406 -7.158 1.00 0.00 C ATOM 903 NH1 ARG A 54 -0.305 2.112 -7.100 1.00 0.00 N ATOM 904 NH2 ARG A 54 -2.255 1.530 -8.216 1.00 0.00 N ATOM 0 H ARG A 54 -2.184 0.763 0.372 1.00 0.00 H new ATOM 0 HA ARG A 54 -3.263 -0.277 -1.983 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -0.696 0.792 -2.462 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -0.422 -0.927 -2.259 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.657 -1.498 -4.143 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -2.777 -0.163 -3.952 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -0.646 1.333 -4.529 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -0.021 -0.156 -5.211 1.00 0.00 H new ATOM 0 HE ARG A 54 -2.641 0.054 -6.233 1.00 0.00 H new ATOM 0 HH11 ARG A 54 0.313 2.018 -6.294 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -0.057 2.743 -7.862 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -3.121 0.993 -8.259 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -2.008 2.161 -8.978 1.00 0.00 H new ATOM 918 N ILE A 55 -3.043 -2.441 -0.812 1.00 0.00 N ATOM 919 CA ILE A 55 -3.006 -3.688 -0.068 1.00 0.00 C ATOM 920 C ILE A 55 -2.197 -4.722 -0.855 1.00 0.00 C ATOM 921 O ILE A 55 -2.291 -4.788 -2.079 1.00 0.00 O ATOM 922 CB ILE A 55 -4.423 -4.149 0.276 1.00 0.00 C ATOM 923 CG1 ILE A 55 -5.017 -3.302 1.404 1.00 0.00 C ATOM 924 CG2 ILE A 55 -4.449 -5.643 0.607 1.00 0.00 C ATOM 925 CD1 ILE A 55 -6.466 -3.704 1.687 1.00 0.00 C ATOM 0 H ILE A 55 -3.807 -2.367 -1.483 1.00 0.00 H new ATOM 0 HA ILE A 55 -2.501 -3.547 0.888 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.052 -4.003 -0.602 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -4.419 -3.423 2.308 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -4.975 -2.247 1.132 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.468 -5.945 0.848 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.096 -6.212 -0.253 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -3.801 -5.838 1.462 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -6.864 -3.087 2.492 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -7.066 -3.559 0.789 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.502 -4.753 1.982 1.00 0.00 H new ATOM 937 N LYS A 56 -1.420 -5.503 -0.119 1.00 0.00 N ATOM 938 CA LYS A 56 -0.596 -6.530 -0.732 1.00 0.00 C ATOM 939 C LYS A 56 -0.935 -7.888 -0.114 1.00 0.00 C ATOM 940 O LYS A 56 -0.637 -8.134 1.054 1.00 0.00 O ATOM 941 CB LYS A 56 0.885 -6.161 -0.629 1.00 0.00 C ATOM 942 CG LYS A 56 1.286 -5.188 -1.740 1.00 0.00 C ATOM 943 CD LYS A 56 2.256 -4.127 -1.216 1.00 0.00 C ATOM 944 CE LYS A 56 1.507 -3.024 -0.465 1.00 0.00 C ATOM 945 NZ LYS A 56 2.199 -1.725 -0.628 1.00 0.00 N ATOM 0 H LYS A 56 -1.344 -5.445 0.896 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.810 -6.603 -1.798 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.085 -5.711 0.343 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.494 -7.063 -0.693 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.750 -5.737 -2.559 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.396 -4.705 -2.144 1.00 0.00 H new ATOM 0 HD2 LYS A 56 2.986 -4.592 -0.554 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.811 -3.693 -2.048 1.00 0.00 H new ATOM 0 HE2 LYS A 56 0.486 -2.949 -0.840 1.00 0.00 H new ATOM 0 HE3 LYS A 56 1.440 -3.277 0.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 1.678 -0.987 -0.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.165 -1.796 -0.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.241 -1.478 -1.637 1.00 0.00 H new ATOM 959 N THR A 57 -1.554 -8.734 -0.924 1.00 0.00 N ATOM 960 CA THR A 57 -1.937 -10.060 -0.471 1.00 0.00 C ATOM 961 C THR A 57 -0.797 -11.053 -0.704 1.00 0.00 C ATOM 962 O THR A 57 -0.135 -11.012 -1.740 1.00 0.00 O ATOM 963 CB THR A 57 -3.235 -10.446 -1.184 1.00 0.00 C ATOM 964 OG1 THR A 57 -4.106 -9.346 -0.939 1.00 0.00 O ATOM 965 CG2 THR A 57 -3.937 -11.632 -0.520 1.00 0.00 C ATOM 0 H THR A 57 -1.800 -8.527 -1.892 1.00 0.00 H new ATOM 0 HA THR A 57 -2.123 -10.073 0.603 1.00 0.00 H new ATOM 0 HB THR A 57 -3.019 -10.688 -2.225 1.00 0.00 H new ATOM 0 HG1 THR A 57 -4.972 -9.512 -1.367 1.00 0.00 H new ATOM 0 HG21 THR A 57 -4.852 -11.865 -1.065 1.00 0.00 H new ATOM 0 HG22 THR A 57 -3.277 -12.499 -0.532 1.00 0.00 H new ATOM 0 HG23 THR A 57 -4.183 -11.378 0.511 1.00 0.00 H new ATOM 973 N GLU A 58 -0.603 -11.922 0.277 1.00 0.00 N ATOM 974 CA GLU A 58 0.446 -12.924 0.192 1.00 0.00 C ATOM 975 C GLU A 58 -0.117 -14.237 -0.357 1.00 0.00 C ATOM 976 O GLU A 58 -1.323 -14.359 -0.569 1.00 0.00 O ATOM 977 CB GLU A 58 1.110 -13.140 1.553 1.00 0.00 C ATOM 978 CG GLU A 58 1.926 -11.913 1.966 1.00 0.00 C ATOM 979 CD GLU A 58 3.425 -12.221 1.950 1.00 0.00 C ATOM 980 OE1 GLU A 58 3.837 -12.989 1.054 1.00 0.00 O ATOM 981 OE2 GLU A 58 4.124 -11.681 2.834 1.00 0.00 O ATOM 0 H GLU A 58 -1.154 -11.953 1.135 1.00 0.00 H new ATOM 0 HA GLU A 58 1.211 -12.563 -0.496 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.348 -13.344 2.305 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.759 -14.015 1.510 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.714 -11.086 1.289 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.628 -11.592 2.964 1.00 0.00 H new ATOM 988 N TYR A 59 0.782 -15.186 -0.572 1.00 0.00 N ATOM 989 CA TYR A 59 0.390 -16.484 -1.093 1.00 0.00 C ATOM 990 C TYR A 59 0.993 -17.615 -0.256 1.00 0.00 C ATOM 991 O TYR A 59 2.173 -17.935 -0.396 1.00 0.00 O ATOM 992 CB TYR A 59 0.957 -16.558 -2.512 1.00 0.00 C ATOM 993 CG TYR A 59 -0.086 -16.345 -3.611 1.00 0.00 C ATOM 994 CD1 TYR A 59 -0.372 -15.069 -4.052 1.00 0.00 C ATOM 995 CD2 TYR A 59 -0.742 -17.428 -4.160 1.00 0.00 C ATOM 996 CE1 TYR A 59 -1.354 -14.868 -5.086 1.00 0.00 C ATOM 997 CE2 TYR A 59 -1.724 -17.227 -5.194 1.00 0.00 C ATOM 998 CZ TYR A 59 -1.982 -15.957 -5.606 1.00 0.00 C ATOM 999 OH TYR A 59 -2.909 -15.767 -6.582 1.00 0.00 O ATOM 0 H TYR A 59 1.781 -15.082 -0.395 1.00 0.00 H new ATOM 0 HA TYR A 59 -0.694 -16.596 -1.070 1.00 0.00 H new ATOM 0 HB2 TYR A 59 1.741 -15.808 -2.619 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.426 -17.531 -2.654 1.00 0.00 H new ATOM 0 HD1 TYR A 59 0.141 -14.221 -3.622 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -0.519 -18.426 -3.814 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -1.587 -13.875 -5.441 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -2.244 -18.066 -5.632 1.00 0.00 H new ATOM 0 HH TYR A 59 -3.274 -16.633 -6.859 1.00 0.00 H new ATOM 1009 N GLY A 60 0.156 -18.189 0.595 1.00 0.00 N ATOM 1010 CA GLY A 60 0.591 -19.277 1.454 1.00 0.00 C ATOM 1011 C GLY A 60 0.395 -18.923 2.929 1.00 0.00 C ATOM 1012 O GLY A 60 0.541 -19.778 3.801 1.00 0.00 O ATOM 0 H GLY A 60 -0.822 -17.921 0.708 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.029 -20.180 1.215 1.00 0.00 H new ATOM 0 HA3 GLY A 60 1.642 -19.496 1.265 1.00 0.00 H new ATOM 1016 N MET A 61 0.067 -17.661 3.163 1.00 0.00 N ATOM 1017 CA MET A 61 -0.151 -17.183 4.518 1.00 0.00 C ATOM 1018 C MET A 61 -1.509 -16.490 4.644 1.00 0.00 C ATOM 1019 O MET A 61 -1.851 -15.974 5.707 1.00 0.00 O ATOM 1020 CB MET A 61 0.960 -16.202 4.899 1.00 0.00 C ATOM 1021 CG MET A 61 0.926 -14.961 4.005 1.00 0.00 C ATOM 1022 SD MET A 61 2.283 -13.876 4.413 1.00 0.00 S ATOM 1023 CE MET A 61 3.636 -14.786 3.688 1.00 0.00 C ATOM 0 H MET A 61 -0.053 -16.955 2.437 1.00 0.00 H new ATOM 0 HA MET A 61 -0.138 -18.040 5.191 1.00 0.00 H new ATOM 0 HB2 MET A 61 0.847 -15.906 5.942 1.00 0.00 H new ATOM 0 HB3 MET A 61 1.929 -16.692 4.810 1.00 0.00 H new ATOM 0 HG2 MET A 61 0.988 -15.256 2.957 1.00 0.00 H new ATOM 0 HG3 MET A 61 -0.021 -14.436 4.133 1.00 0.00 H new ATOM 0 HE1 MET A 61 4.515 -14.145 3.629 1.00 0.00 H new ATOM 0 HE2 MET A 61 3.862 -15.656 4.305 1.00 0.00 H new ATOM 0 HE3 MET A 61 3.358 -15.114 2.686 1.00 0.00 H new ATOM 1033 N GLN A 62 -2.246 -16.500 3.543 1.00 0.00 N ATOM 1034 CA GLN A 62 -3.559 -15.878 3.516 1.00 0.00 C ATOM 1035 C GLN A 62 -3.556 -14.594 4.349 1.00 0.00 C ATOM 1036 O GLN A 62 -4.367 -14.440 5.261 1.00 0.00 O ATOM 1037 CB GLN A 62 -4.635 -16.848 4.009 1.00 0.00 C ATOM 1038 CG GLN A 62 -4.581 -18.167 3.234 1.00 0.00 C ATOM 1039 CD GLN A 62 -4.610 -17.917 1.725 1.00 0.00 C ATOM 1040 OE1 GLN A 62 -3.814 -18.447 0.967 1.00 0.00 O ATOM 1041 NE2 GLN A 62 -5.569 -17.083 1.333 1.00 0.00 N ATOM 0 H GLN A 62 -1.959 -16.929 2.663 1.00 0.00 H new ATOM 0 HA GLN A 62 -3.795 -15.618 2.484 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -4.496 -17.041 5.073 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -5.619 -16.394 3.894 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -3.675 -18.712 3.499 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -5.425 -18.795 3.519 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.202 -16.674 2.021 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.672 -16.852 0.345 1.00 0.00 H new ATOM 1050 N GLU A 63 -2.635 -13.706 4.004 1.00 0.00 N ATOM 1051 CA GLU A 63 -2.516 -12.441 4.708 1.00 0.00 C ATOM 1052 C GLU A 63 -2.317 -11.296 3.712 1.00 0.00 C ATOM 1053 O GLU A 63 -1.706 -11.482 2.661 1.00 0.00 O ATOM 1054 CB GLU A 63 -1.375 -12.485 5.727 1.00 0.00 C ATOM 1055 CG GLU A 63 -1.139 -11.107 6.347 1.00 0.00 C ATOM 1056 CD GLU A 63 -0.040 -10.350 5.598 1.00 0.00 C ATOM 1057 OE1 GLU A 63 1.059 -10.930 5.464 1.00 0.00 O ATOM 1058 OE2 GLU A 63 -0.324 -9.208 5.176 1.00 0.00 O ATOM 0 H GLU A 63 -1.965 -13.838 3.247 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.442 -12.264 5.256 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.611 -13.205 6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.462 -12.830 5.241 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.064 -10.530 6.323 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.860 -11.219 7.395 1.00 0.00 H new ATOM 1065 N SER A 64 -2.846 -10.138 4.079 1.00 0.00 N ATOM 1066 CA SER A 64 -2.734 -8.963 3.230 1.00 0.00 C ATOM 1067 C SER A 64 -2.425 -7.730 4.082 1.00 0.00 C ATOM 1068 O SER A 64 -3.036 -7.526 5.130 1.00 0.00 O ATOM 1069 CB SER A 64 -4.015 -8.743 2.424 1.00 0.00 C ATOM 1070 OG SER A 64 -4.272 -9.818 1.525 1.00 0.00 O ATOM 0 H SER A 64 -3.353 -9.988 4.951 1.00 0.00 H new ATOM 0 HA SER A 64 -1.917 -9.125 2.527 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.858 -8.632 3.106 1.00 0.00 H new ATOM 0 HB3 SER A 64 -3.934 -7.812 1.862 1.00 0.00 H new ATOM 0 HG SER A 64 -4.522 -9.459 0.648 1.00 0.00 H new ATOM 1076 N LYS A 65 -1.476 -6.941 3.601 1.00 0.00 N ATOM 1077 CA LYS A 65 -1.078 -5.734 4.305 1.00 0.00 C ATOM 1078 C LYS A 65 -1.299 -4.522 3.397 1.00 0.00 C ATOM 1079 O LYS A 65 -1.137 -4.616 2.181 1.00 0.00 O ATOM 1080 CB LYS A 65 0.357 -5.862 4.819 1.00 0.00 C ATOM 1081 CG LYS A 65 1.365 -5.474 3.736 1.00 0.00 C ATOM 1082 CD LYS A 65 2.770 -5.322 4.323 1.00 0.00 C ATOM 1083 CE LYS A 65 3.575 -6.612 4.159 1.00 0.00 C ATOM 1084 NZ LYS A 65 3.103 -7.642 5.111 1.00 0.00 N ATOM 0 H LYS A 65 -0.971 -7.114 2.732 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.698 -5.588 5.190 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.492 -5.224 5.692 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.541 -6.887 5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.374 -6.233 2.954 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.059 -4.538 3.268 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.288 -4.501 3.828 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.701 -5.064 5.380 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.478 -6.981 3.138 1.00 0.00 H new ATOM 0 HE3 LYS A 65 4.633 -6.411 4.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.797 -8.416 5.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.993 -7.218 6.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.187 -8.017 4.791 1.00 0.00 H new ATOM 1098 N GLY A 66 -1.667 -3.414 4.022 1.00 0.00 N ATOM 1099 CA GLY A 66 -1.912 -2.185 3.285 1.00 0.00 C ATOM 1100 C GLY A 66 -1.805 -0.965 4.202 1.00 0.00 C ATOM 1101 O GLY A 66 -2.398 -0.940 5.279 1.00 0.00 O ATOM 0 H GLY A 66 -1.802 -3.341 5.030 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.193 -2.096 2.470 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.903 -2.219 2.833 1.00 0.00 H new ATOM 1105 N TYR A 67 -1.043 0.016 3.742 1.00 0.00 N ATOM 1106 CA TYR A 67 -0.850 1.236 4.507 1.00 0.00 C ATOM 1107 C TYR A 67 -2.014 2.206 4.296 1.00 0.00 C ATOM 1108 O TYR A 67 -2.285 2.621 3.170 1.00 0.00 O ATOM 1109 CB TYR A 67 0.433 1.873 3.969 1.00 0.00 C ATOM 1110 CG TYR A 67 1.714 1.314 4.591 1.00 0.00 C ATOM 1111 CD1 TYR A 67 1.985 -0.037 4.517 1.00 0.00 C ATOM 1112 CD2 TYR A 67 2.598 2.162 5.227 1.00 0.00 C ATOM 1113 CE1 TYR A 67 3.191 -0.563 5.102 1.00 0.00 C ATOM 1114 CE2 TYR A 67 3.804 1.636 5.813 1.00 0.00 C ATOM 1115 CZ TYR A 67 4.041 0.300 5.722 1.00 0.00 C ATOM 1116 OH TYR A 67 5.180 -0.197 6.275 1.00 0.00 O ATOM 0 H TYR A 67 -0.552 -0.009 2.849 1.00 0.00 H new ATOM 0 HA TYR A 67 -0.792 1.015 5.573 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.473 1.729 2.889 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.395 2.948 4.146 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.292 -0.700 4.020 1.00 0.00 H new ATOM 0 HD2 TYR A 67 2.386 3.219 5.285 1.00 0.00 H new ATOM 0 HE1 TYR A 67 3.416 -1.618 5.050 1.00 0.00 H new ATOM 0 HE2 TYR A 67 4.504 2.288 6.314 1.00 0.00 H new ATOM 0 HH TYR A 67 5.200 0.017 7.231 1.00 0.00 H new ATOM 1126 N ALA A 68 -2.673 2.538 5.397 1.00 0.00 N ATOM 1127 CA ALA A 68 -3.802 3.451 5.346 1.00 0.00 C ATOM 1128 C ALA A 68 -3.337 4.853 5.747 1.00 0.00 C ATOM 1129 O ALA A 68 -2.327 5.004 6.432 1.00 0.00 O ATOM 1130 CB ALA A 68 -4.922 2.929 6.248 1.00 0.00 C ATOM 0 H ALA A 68 -2.447 2.191 6.329 1.00 0.00 H new ATOM 0 HA ALA A 68 -4.200 3.512 4.333 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.769 3.614 6.210 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.236 1.944 5.904 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.560 2.857 7.273 1.00 0.00 H new ATOM 1136 N LYS A 69 -4.096 5.843 5.301 1.00 0.00 N ATOM 1137 CA LYS A 69 -3.775 7.227 5.604 1.00 0.00 C ATOM 1138 C LYS A 69 -4.952 7.871 6.340 1.00 0.00 C ATOM 1139 O LYS A 69 -6.030 8.033 5.770 1.00 0.00 O ATOM 1140 CB LYS A 69 -3.363 7.973 4.333 1.00 0.00 C ATOM 1141 CG LYS A 69 -2.091 7.370 3.732 1.00 0.00 C ATOM 1142 CD LYS A 69 -2.071 7.537 2.211 1.00 0.00 C ATOM 1143 CE LYS A 69 -2.489 6.243 1.511 1.00 0.00 C ATOM 1144 NZ LYS A 69 -3.883 6.344 1.024 1.00 0.00 N ATOM 0 H LYS A 69 -4.933 5.714 4.732 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.914 7.280 6.271 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.171 7.929 3.603 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.198 9.026 4.562 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.215 7.853 4.166 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.031 6.312 3.986 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.743 8.345 1.922 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.071 7.823 1.886 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.819 6.042 0.675 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.398 5.404 2.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.976 5.827 0.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -4.528 5.933 1.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.127 7.344 0.874 1.00 0.00 H new ATOM 1158 N LEU A 70 -4.706 8.220 7.594 1.00 0.00 N ATOM 1159 CA LEU A 70 -5.732 8.841 8.413 1.00 0.00 C ATOM 1160 C LEU A 70 -5.477 10.348 8.485 1.00 0.00 C ATOM 1161 O LEU A 70 -4.395 10.780 8.880 1.00 0.00 O ATOM 1162 CB LEU A 70 -5.807 8.164 9.783 1.00 0.00 C ATOM 1163 CG LEU A 70 -6.612 8.904 10.853 1.00 0.00 C ATOM 1164 CD1 LEU A 70 -8.008 9.263 10.339 1.00 0.00 C ATOM 1165 CD2 LEU A 70 -6.670 8.096 12.152 1.00 0.00 C ATOM 0 H LEU A 70 -3.810 8.084 8.063 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.715 8.704 7.962 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.239 7.172 9.653 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -4.791 8.023 10.153 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.101 9.840 11.078 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.559 9.788 11.119 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.919 9.905 9.463 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.542 8.352 10.069 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.248 8.644 12.896 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.145 7.134 11.961 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.659 7.934 12.525 1.00 0.00 H new ATOM 1177 N TYR A 71 -6.492 11.107 8.098 1.00 0.00 N ATOM 1178 CA TYR A 71 -6.392 12.556 8.114 1.00 0.00 C ATOM 1179 C TYR A 71 -7.314 13.158 9.177 1.00 0.00 C ATOM 1180 O TYR A 71 -8.164 12.463 9.732 1.00 0.00 O ATOM 1181 CB TYR A 71 -6.851 13.026 6.733 1.00 0.00 C ATOM 1182 CG TYR A 71 -5.877 12.683 5.603 1.00 0.00 C ATOM 1183 CD1 TYR A 71 -5.837 11.401 5.093 1.00 0.00 C ATOM 1184 CD2 TYR A 71 -5.039 13.654 5.096 1.00 0.00 C ATOM 1185 CE1 TYR A 71 -4.921 11.078 4.030 1.00 0.00 C ATOM 1186 CE2 TYR A 71 -4.122 13.331 4.033 1.00 0.00 C ATOM 1187 CZ TYR A 71 -4.109 12.059 3.553 1.00 0.00 C ATOM 1188 OH TYR A 71 -3.243 11.753 2.549 1.00 0.00 O ATOM 0 H TYR A 71 -7.388 10.745 7.771 1.00 0.00 H new ATOM 0 HA TYR A 71 -5.373 12.867 8.344 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -7.820 12.579 6.512 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.997 14.106 6.758 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -6.492 10.641 5.491 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.070 14.657 5.496 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -4.880 10.079 3.621 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -3.460 14.082 3.627 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.727 12.550 2.308 1.00 0.00 H new ATOM 1198 N GLU A 72 -7.115 14.444 9.427 1.00 0.00 N ATOM 1199 CA GLU A 72 -7.918 15.147 10.413 1.00 0.00 C ATOM 1200 C GLU A 72 -9.083 15.869 9.732 1.00 0.00 C ATOM 1201 O GLU A 72 -10.176 15.954 10.290 1.00 0.00 O ATOM 1202 CB GLU A 72 -7.063 16.126 11.220 1.00 0.00 C ATOM 1203 CG GLU A 72 -6.002 15.385 12.035 1.00 0.00 C ATOM 1204 CD GLU A 72 -5.424 16.284 13.130 1.00 0.00 C ATOM 1205 OE1 GLU A 72 -6.237 16.809 13.921 1.00 0.00 O ATOM 1206 OE2 GLU A 72 -4.182 16.425 13.152 1.00 0.00 O ATOM 0 H GLU A 72 -6.410 15.017 8.964 1.00 0.00 H new ATOM 0 HA GLU A 72 -8.327 14.414 11.109 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.580 16.834 10.546 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.700 16.706 11.888 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.440 14.494 12.485 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.202 15.048 11.376 1.00 0.00 H new ATOM 1213 N ASP A 73 -8.809 16.369 8.537 1.00 0.00 N ATOM 1214 CA ASP A 73 -9.820 17.081 7.774 1.00 0.00 C ATOM 1215 C ASP A 73 -9.760 16.633 6.312 1.00 0.00 C ATOM 1216 O ASP A 73 -8.738 16.119 5.858 1.00 0.00 O ATOM 1217 CB ASP A 73 -9.581 18.591 7.815 1.00 0.00 C ATOM 1218 CG ASP A 73 -9.525 19.199 9.218 1.00 0.00 C ATOM 1219 OD1 ASP A 73 -10.495 18.974 9.973 1.00 0.00 O ATOM 1220 OD2 ASP A 73 -8.513 19.875 9.504 1.00 0.00 O ATOM 0 H ASP A 73 -7.901 16.295 8.078 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.792 16.858 8.214 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -8.644 18.809 7.303 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.374 19.085 7.253 1.00 0.00 H new ATOM 1225 N ALA A 74 -10.867 16.843 5.615 1.00 0.00 N ATOM 1226 CA ALA A 74 -10.952 16.467 4.215 1.00 0.00 C ATOM 1227 C ALA A 74 -10.255 17.529 3.362 1.00 0.00 C ATOM 1228 O ALA A 74 -9.494 17.200 2.454 1.00 0.00 O ATOM 1229 CB ALA A 74 -12.420 16.278 3.825 1.00 0.00 C ATOM 0 H ALA A 74 -11.713 17.269 5.994 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.443 15.519 4.041 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.484 15.996 2.774 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.861 15.493 4.439 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -12.962 17.210 3.984 1.00 0.00 H new ATOM 1235 N ASP A 75 -10.540 18.782 3.685 1.00 0.00 N ATOM 1236 CA ASP A 75 -9.950 19.895 2.961 1.00 0.00 C ATOM 1237 C ASP A 75 -8.439 19.684 2.855 1.00 0.00 C ATOM 1238 O ASP A 75 -7.853 19.887 1.792 1.00 0.00 O ATOM 1239 CB ASP A 75 -10.193 21.218 3.690 1.00 0.00 C ATOM 1240 CG ASP A 75 -10.741 22.347 2.815 1.00 0.00 C ATOM 1241 OD1 ASP A 75 -11.691 22.065 2.054 1.00 0.00 O ATOM 1242 OD2 ASP A 75 -10.197 23.467 2.927 1.00 0.00 O ATOM 0 H ASP A 75 -11.172 19.051 4.439 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.411 19.938 1.974 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -10.891 21.042 4.509 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -9.255 21.547 4.136 1.00 0.00 H new ATOM 1247 N ARG A 76 -7.850 19.279 3.971 1.00 0.00 N ATOM 1248 CA ARG A 76 -6.418 19.039 4.016 1.00 0.00 C ATOM 1249 C ARG A 76 -6.037 17.916 3.050 1.00 0.00 C ATOM 1250 O ARG A 76 -5.131 18.076 2.233 1.00 0.00 O ATOM 1251 CB ARG A 76 -5.967 18.662 5.429 1.00 0.00 C ATOM 1252 CG ARG A 76 -5.114 19.771 6.047 1.00 0.00 C ATOM 1253 CD ARG A 76 -3.829 19.986 5.246 1.00 0.00 C ATOM 1254 NE ARG A 76 -2.916 20.887 5.984 1.00 0.00 N ATOM 1255 CZ ARG A 76 -1.596 20.963 5.766 1.00 0.00 C ATOM 1256 NH1 ARG A 76 -1.027 20.191 4.830 1.00 0.00 N ATOM 1257 NH2 ARG A 76 -0.846 21.810 6.484 1.00 0.00 N ATOM 0 H ARG A 76 -8.339 19.111 4.850 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.918 19.961 3.721 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.839 18.477 6.056 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.396 17.734 5.397 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -5.686 20.699 6.080 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -4.866 19.513 7.077 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -3.340 19.029 5.064 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -4.066 20.413 4.272 1.00 0.00 H new ATOM 0 HE ARG A 76 -3.317 21.488 6.704 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -1.599 19.546 4.284 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -0.022 20.248 4.663 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -1.280 22.397 7.197 1.00 0.00 H new ATOM 0 HH22 ARG A 76 0.159 21.868 6.318 1.00 0.00 H new ATOM 1271 N MET A 77 -6.747 16.805 3.175 1.00 0.00 N ATOM 1272 CA MET A 77 -6.495 15.655 2.323 1.00 0.00 C ATOM 1273 C MET A 77 -6.488 16.058 0.847 1.00 0.00 C ATOM 1274 O MET A 77 -5.687 15.550 0.064 1.00 0.00 O ATOM 1275 CB MET A 77 -7.575 14.597 2.559 1.00 0.00 C ATOM 1276 CG MET A 77 -7.562 13.544 1.449 1.00 0.00 C ATOM 1277 SD MET A 77 -8.259 12.015 2.051 1.00 0.00 S ATOM 1278 CE MET A 77 -9.997 12.414 1.973 1.00 0.00 C ATOM 0 H MET A 77 -7.497 16.676 3.854 1.00 0.00 H new ATOM 0 HA MET A 77 -5.515 15.248 2.574 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.413 14.116 3.524 1.00 0.00 H new ATOM 0 HB3 MET A 77 -8.554 15.074 2.601 1.00 0.00 H new ATOM 0 HG2 MET A 77 -8.132 13.901 0.591 1.00 0.00 H new ATOM 0 HG3 MET A 77 -6.541 13.378 1.106 1.00 0.00 H new ATOM 0 HE1 MET A 77 -10.480 12.122 2.906 1.00 0.00 H new ATOM 0 HE2 MET A 77 -10.118 13.487 1.823 1.00 0.00 H new ATOM 0 HE3 MET A 77 -10.457 11.877 1.143 1.00 0.00 H new ATOM 1288 N LYS A 78 -7.392 16.967 0.510 1.00 0.00 N ATOM 1289 CA LYS A 78 -7.500 17.444 -0.858 1.00 0.00 C ATOM 1290 C LYS A 78 -6.232 18.217 -1.226 1.00 0.00 C ATOM 1291 O LYS A 78 -5.530 17.852 -2.167 1.00 0.00 O ATOM 1292 CB LYS A 78 -8.787 18.249 -1.044 1.00 0.00 C ATOM 1293 CG LYS A 78 -10.011 17.434 -0.620 1.00 0.00 C ATOM 1294 CD LYS A 78 -11.223 17.771 -1.490 1.00 0.00 C ATOM 1295 CE LYS A 78 -12.255 16.642 -1.454 1.00 0.00 C ATOM 1296 NZ LYS A 78 -13.597 17.155 -1.805 1.00 0.00 N ATOM 0 H LYS A 78 -8.056 17.386 1.161 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.574 16.605 -1.550 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -8.735 19.166 -0.456 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.887 18.545 -2.088 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.788 16.370 -0.697 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -10.242 17.636 0.426 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.680 18.697 -1.141 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -10.901 17.942 -2.517 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.966 15.855 -2.151 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.279 16.195 -0.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.285 16.376 -1.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.877 17.890 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.574 17.561 -2.762 1.00 0.00 H new ATOM 1310 N GLN A 79 -5.978 19.271 -0.464 1.00 0.00 N ATOM 1311 CA GLN A 79 -4.807 20.099 -0.699 1.00 0.00 C ATOM 1312 C GLN A 79 -3.539 19.243 -0.675 1.00 0.00 C ATOM 1313 O GLN A 79 -2.606 19.488 -1.438 1.00 0.00 O ATOM 1314 CB GLN A 79 -4.723 21.233 0.326 1.00 0.00 C ATOM 1315 CG GLN A 79 -5.252 22.542 -0.262 1.00 0.00 C ATOM 1316 CD GLN A 79 -4.673 23.749 0.479 1.00 0.00 C ATOM 1317 OE1 GLN A 79 -3.978 24.580 -0.082 1.00 0.00 O ATOM 1318 NE2 GLN A 79 -4.997 23.799 1.768 1.00 0.00 N ATOM 0 H GLN A 79 -6.563 19.570 0.316 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.898 20.552 -1.686 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -5.299 20.970 1.213 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -3.689 21.365 0.644 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -4.993 22.601 -1.319 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.340 22.560 -0.199 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -5.583 23.070 2.175 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -4.659 24.566 2.349 1.00 0.00 H new ATOM 1327 N VAL A 80 -3.545 18.257 0.210 1.00 0.00 N ATOM 1328 CA VAL A 80 -2.407 17.364 0.344 1.00 0.00 C ATOM 1329 C VAL A 80 -2.252 16.547 -0.941 1.00 0.00 C ATOM 1330 O VAL A 80 -1.177 16.520 -1.537 1.00 0.00 O ATOM 1331 CB VAL A 80 -2.568 16.493 1.591 1.00 0.00 C ATOM 1332 CG1 VAL A 80 -1.403 15.511 1.728 1.00 0.00 C ATOM 1333 CG2 VAL A 80 -2.711 17.354 2.847 1.00 0.00 C ATOM 0 H VAL A 80 -4.321 18.057 0.842 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.488 17.934 0.480 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.484 15.912 1.478 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.542 14.904 2.623 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -1.368 14.864 0.852 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.468 16.065 1.807 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.824 16.710 3.719 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.822 17.974 2.966 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -3.589 17.993 2.752 1.00 0.00 H new ATOM 1343 N GLU A 81 -3.342 15.901 -1.328 1.00 0.00 N ATOM 1344 CA GLU A 81 -3.341 15.086 -2.531 1.00 0.00 C ATOM 1345 C GLU A 81 -3.243 15.973 -3.774 1.00 0.00 C ATOM 1346 O GLU A 81 -3.099 15.472 -4.888 1.00 0.00 O ATOM 1347 CB GLU A 81 -4.583 14.194 -2.590 1.00 0.00 C ATOM 1348 CG GLU A 81 -4.227 12.789 -3.080 1.00 0.00 C ATOM 1349 CD GLU A 81 -4.983 12.448 -4.365 1.00 0.00 C ATOM 1350 OE1 GLU A 81 -6.232 12.462 -4.309 1.00 0.00 O ATOM 1351 OE2 GLU A 81 -4.296 12.182 -5.374 1.00 0.00 O ATOM 0 H GLU A 81 -4.232 15.925 -0.830 1.00 0.00 H new ATOM 0 HA GLU A 81 -2.467 14.435 -2.504 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.039 14.134 -1.602 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -5.323 14.638 -3.256 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.154 12.723 -3.257 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.468 12.059 -2.307 1.00 0.00 H new ATOM 1358 N GLN A 82 -3.324 17.274 -3.540 1.00 0.00 N ATOM 1359 CA GLN A 82 -3.246 18.236 -4.627 1.00 0.00 C ATOM 1360 C GLN A 82 -1.810 18.738 -4.790 1.00 0.00 C ATOM 1361 O GLN A 82 -1.528 19.548 -5.672 1.00 0.00 O ATOM 1362 CB GLN A 82 -4.212 19.400 -4.399 1.00 0.00 C ATOM 1363 CG GLN A 82 -5.481 19.232 -5.237 1.00 0.00 C ATOM 1364 CD GLN A 82 -6.659 19.974 -4.603 1.00 0.00 C ATOM 1365 OE1 GLN A 82 -6.668 21.188 -4.481 1.00 0.00 O ATOM 1366 NE2 GLN A 82 -7.650 19.180 -4.209 1.00 0.00 N ATOM 0 H GLN A 82 -3.443 17.685 -2.614 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.542 17.737 -5.550 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -4.475 19.458 -3.343 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.723 20.339 -4.658 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -5.308 19.610 -6.245 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -5.722 18.173 -5.331 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.578 18.171 -4.341 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -8.482 19.580 -3.775 1.00 0.00 H new ATOM 1375 N GLU A 83 -0.941 18.237 -3.925 1.00 0.00 N ATOM 1376 CA GLU A 83 0.459 18.625 -3.961 1.00 0.00 C ATOM 1377 C GLU A 83 1.155 17.989 -5.166 1.00 0.00 C ATOM 1378 O GLU A 83 1.964 18.633 -5.832 1.00 0.00 O ATOM 1379 CB GLU A 83 1.167 18.249 -2.658 1.00 0.00 C ATOM 1380 CG GLU A 83 0.500 18.925 -1.458 1.00 0.00 C ATOM 1381 CD GLU A 83 1.498 19.801 -0.698 1.00 0.00 C ATOM 1382 OE1 GLU A 83 2.370 19.214 -0.021 1.00 0.00 O ATOM 1383 OE2 GLU A 83 1.367 21.039 -0.812 1.00 0.00 O ATOM 0 H GLU A 83 -1.179 17.566 -3.195 1.00 0.00 H new ATOM 0 HA GLU A 83 0.512 19.709 -4.065 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.147 17.167 -2.528 1.00 0.00 H new ATOM 0 HB3 GLU A 83 2.215 18.545 -2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.338 19.533 -1.798 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.093 18.167 -0.789 1.00 0.00 H new ATOM 1390 N TYR A 84 0.815 16.731 -5.409 1.00 0.00 N ATOM 1391 CA TYR A 84 1.397 16.001 -6.522 1.00 0.00 C ATOM 1392 C TYR A 84 0.522 16.118 -7.772 1.00 0.00 C ATOM 1393 O TYR A 84 0.552 15.245 -8.639 1.00 0.00 O ATOM 1394 CB TYR A 84 1.448 14.536 -6.085 1.00 0.00 C ATOM 1395 CG TYR A 84 2.810 13.871 -6.293 1.00 0.00 C ATOM 1396 CD1 TYR A 84 3.944 14.433 -5.743 1.00 0.00 C ATOM 1397 CD2 TYR A 84 2.905 12.709 -7.032 1.00 0.00 C ATOM 1398 CE1 TYR A 84 5.226 13.807 -5.939 1.00 0.00 C ATOM 1399 CE2 TYR A 84 4.187 12.083 -7.228 1.00 0.00 C ATOM 1400 CZ TYR A 84 5.284 12.663 -6.672 1.00 0.00 C ATOM 1401 OH TYR A 84 6.495 12.072 -6.857 1.00 0.00 O ATOM 0 H TYR A 84 0.144 16.199 -4.854 1.00 0.00 H new ATOM 0 HA TYR A 84 2.382 16.398 -6.768 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.182 14.473 -5.030 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.694 13.976 -6.638 1.00 0.00 H new ATOM 0 HD1 TYR A 84 3.870 15.343 -5.165 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.018 12.269 -7.463 1.00 0.00 H new ATOM 0 HE1 TYR A 84 6.121 14.236 -5.514 1.00 0.00 H new ATOM 0 HE2 TYR A 84 4.275 11.173 -7.804 1.00 0.00 H new ATOM 0 HH TYR A 84 6.385 11.263 -7.399 1.00 0.00 H new ATOM 1411 N VAL A 85 -0.236 17.203 -7.826 1.00 0.00 N ATOM 1412 CA VAL A 85 -1.117 17.445 -8.955 1.00 0.00 C ATOM 1413 C VAL A 85 -0.725 18.760 -9.631 1.00 0.00 C ATOM 1414 O VAL A 85 0.458 19.026 -9.839 1.00 0.00 O ATOM 1415 CB VAL A 85 -2.576 17.422 -8.495 1.00 0.00 C ATOM 1416 CG1 VAL A 85 -3.518 17.155 -9.670 1.00 0.00 C ATOM 1417 CG2 VAL A 85 -2.783 16.393 -7.381 1.00 0.00 C ATOM 0 H VAL A 85 -0.258 17.925 -7.106 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.011 16.654 -9.697 1.00 0.00 H new ATOM 0 HB VAL A 85 -2.815 18.406 -8.092 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.548 17.144 -9.315 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -3.400 17.940 -10.417 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.278 16.190 -10.117 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -3.828 16.397 -7.072 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.516 15.402 -7.747 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.152 16.647 -6.529 1.00 0.00 H new ATOM 1427 N LEU A 86 -1.739 19.549 -9.954 1.00 0.00 N ATOM 1428 CA LEU A 86 -1.515 20.830 -10.601 1.00 0.00 C ATOM 1429 C LEU A 86 -0.651 21.710 -9.695 1.00 0.00 C ATOM 1430 O LEU A 86 -1.173 22.532 -8.944 1.00 0.00 O ATOM 1431 CB LEU A 86 -2.847 21.472 -10.995 1.00 0.00 C ATOM 1432 CG LEU A 86 -3.764 21.875 -9.839 1.00 0.00 C ATOM 1433 CD1 LEU A 86 -3.583 23.353 -9.484 1.00 0.00 C ATOM 1434 CD2 LEU A 86 -5.223 21.536 -10.152 1.00 0.00 C ATOM 0 H LEU A 86 -2.719 19.325 -9.779 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.965 20.695 -11.533 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -2.638 22.359 -11.593 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.388 20.776 -11.636 1.00 0.00 H new ATOM 0 HG LEU A 86 -3.480 21.296 -8.961 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -4.247 23.613 -8.659 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.549 23.532 -9.188 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.824 23.968 -10.351 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.853 21.833 -9.314 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.536 22.070 -11.049 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.320 20.463 -10.317 1.00 0.00 H new ATOM 1446 N LYS A 87 0.654 21.507 -9.797 1.00 0.00 N ATOM 1447 CA LYS A 87 1.594 22.272 -8.996 1.00 0.00 C ATOM 1448 C LYS A 87 2.146 23.429 -9.831 1.00 0.00 C ATOM 1449 O LYS A 87 2.080 23.399 -11.059 1.00 0.00 O ATOM 1450 CB LYS A 87 2.678 21.357 -8.421 1.00 0.00 C ATOM 1451 CG LYS A 87 3.704 20.983 -9.492 1.00 0.00 C ATOM 1452 CD LYS A 87 4.697 19.946 -8.963 1.00 0.00 C ATOM 1453 CE LYS A 87 5.693 19.536 -10.049 1.00 0.00 C ATOM 1454 NZ LYS A 87 7.055 19.412 -9.483 1.00 0.00 N ATOM 0 H LYS A 87 1.082 20.824 -10.422 1.00 0.00 H new ATOM 0 HA LYS A 87 1.090 22.711 -8.135 1.00 0.00 H new ATOM 0 HB2 LYS A 87 3.178 21.857 -7.592 1.00 0.00 H new ATOM 0 HB3 LYS A 87 2.220 20.453 -8.019 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.192 20.587 -10.369 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.241 21.875 -9.813 1.00 0.00 H new ATOM 0 HD2 LYS A 87 5.234 20.355 -8.108 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.157 19.068 -8.610 1.00 0.00 H new ATOM 0 HE2 LYS A 87 5.388 18.587 -10.491 1.00 0.00 H new ATOM 0 HE3 LYS A 87 5.692 20.275 -10.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 7.719 19.133 -10.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 7.349 20.326 -9.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 7.055 18.690 -8.735 1.00 0.00 H new ATOM 1468 N ARG A 88 2.678 24.421 -9.132 1.00 0.00 N ATOM 1469 CA ARG A 88 3.241 25.585 -9.794 1.00 0.00 C ATOM 1470 C ARG A 88 4.561 25.987 -9.131 1.00 0.00 C ATOM 1471 O ARG A 88 4.983 25.367 -8.156 1.00 0.00 O ATOM 1472 CB ARG A 88 2.273 26.769 -9.745 1.00 0.00 C ATOM 1473 CG ARG A 88 1.776 27.129 -11.146 1.00 0.00 C ATOM 1474 CD ARG A 88 0.932 28.405 -11.117 1.00 0.00 C ATOM 1475 NE ARG A 88 -0.472 28.076 -10.783 1.00 0.00 N ATOM 1476 CZ ARG A 88 -1.519 28.856 -11.083 1.00 0.00 C ATOM 1477 NH1 ARG A 88 -1.327 30.016 -11.727 1.00 0.00 N ATOM 1478 NH2 ARG A 88 -2.757 28.478 -10.741 1.00 0.00 N ATOM 0 H ARG A 88 2.731 24.442 -8.114 1.00 0.00 H new ATOM 0 HA ARG A 88 3.420 25.319 -10.836 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.425 26.523 -9.106 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.769 27.631 -9.299 1.00 0.00 H new ATOM 0 HG2 ARG A 88 2.627 27.266 -11.813 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.185 26.307 -11.549 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.336 29.101 -10.382 1.00 0.00 H new ATOM 0 HD3 ARG A 88 0.977 28.903 -12.086 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.654 27.200 -10.293 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.384 30.304 -11.988 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -2.124 30.610 -11.956 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -2.904 27.595 -10.251 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -3.553 29.073 -10.970 1.00 0.00 H new ATOM 1492 N ASN A 89 5.175 27.021 -9.686 1.00 0.00 N ATOM 1493 CA ASN A 89 6.437 27.512 -9.161 1.00 0.00 C ATOM 1494 C ASN A 89 6.570 29.004 -9.476 1.00 0.00 C ATOM 1495 O ASN A 89 7.603 29.447 -9.976 1.00 0.00 O ATOM 1496 CB ASN A 89 7.621 26.786 -9.804 1.00 0.00 C ATOM 1497 CG ASN A 89 7.340 25.288 -9.934 1.00 0.00 C ATOM 1498 OD1 ASN A 89 7.160 24.755 -11.016 1.00 0.00 O ATOM 1499 ND2 ASN A 89 7.313 24.640 -8.772 1.00 0.00 N ATOM 0 H ASN A 89 4.822 27.533 -10.495 1.00 0.00 H new ATOM 0 HA ASN A 89 6.446 27.335 -8.085 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.820 27.209 -10.789 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.517 26.941 -9.203 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.133 23.636 -8.752 1.00 0.00 H new ATOM 0 HD22 ASN A 89 7.472 25.147 -7.901 1.00 0.00 H new ATOM 1506 N ALA A 90 5.509 29.737 -9.170 1.00 0.00 N ATOM 1507 CA ALA A 90 5.494 31.169 -9.414 1.00 0.00 C ATOM 1508 C ALA A 90 4.283 31.789 -8.714 1.00 0.00 C ATOM 1509 O ALA A 90 3.186 31.235 -8.757 1.00 0.00 O ATOM 1510 CB ALA A 90 5.493 31.430 -10.922 1.00 0.00 C ATOM 0 H ALA A 90 4.654 29.366 -8.755 1.00 0.00 H new ATOM 0 HA ALA A 90 6.388 31.638 -9.003 1.00 0.00 H new ATOM 0 HB1 ALA A 90 5.482 32.504 -11.105 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.388 30.995 -11.367 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.608 30.976 -11.369 1.00 0.00 H new ATOM 1516 N VAL A 91 4.523 32.930 -8.085 1.00 0.00 N ATOM 1517 CA VAL A 91 3.466 33.631 -7.376 1.00 0.00 C ATOM 1518 C VAL A 91 2.222 33.699 -8.264 1.00 0.00 C ATOM 1519 O VAL A 91 2.284 34.191 -9.390 1.00 0.00 O ATOM 1520 CB VAL A 91 3.959 35.009 -6.930 1.00 0.00 C ATOM 1521 CG1 VAL A 91 4.187 35.925 -8.134 1.00 0.00 C ATOM 1522 CG2 VAL A 91 2.986 35.643 -5.935 1.00 0.00 C ATOM 0 H VAL A 91 5.434 33.387 -8.052 1.00 0.00 H new ATOM 0 HA VAL A 91 3.190 33.091 -6.470 1.00 0.00 H new ATOM 0 HB VAL A 91 4.915 34.876 -6.424 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.537 36.898 -7.790 1.00 0.00 H new ATOM 0 HG12 VAL A 91 4.935 35.482 -8.792 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.252 36.048 -8.680 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.360 36.622 -5.634 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.009 35.756 -6.404 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.895 35.003 -5.057 1.00 0.00 H new ATOM 1532 N PRO A 92 1.091 33.186 -7.710 1.00 0.00 N ATOM 1533 CA PRO A 92 -0.166 33.184 -8.439 1.00 0.00 C ATOM 1534 C PRO A 92 -0.780 34.585 -8.477 1.00 0.00 C ATOM 1535 O PRO A 92 -0.090 35.575 -8.236 1.00 0.00 O ATOM 1536 CB PRO A 92 -1.039 32.173 -7.714 1.00 0.00 C ATOM 1537 CG PRO A 92 -0.414 31.990 -6.341 1.00 0.00 C ATOM 1538 CD PRO A 92 0.979 32.596 -6.379 1.00 0.00 C ATOM 0 HA PRO A 92 -0.045 32.908 -9.486 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -2.065 32.532 -7.631 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -1.074 31.228 -8.256 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -1.021 32.476 -5.577 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.363 30.932 -6.082 1.00 0.00 H new ATOM 0 HD2 PRO A 92 1.105 33.349 -5.601 1.00 0.00 H new ATOM 0 HD3 PRO A 92 1.745 31.838 -6.216 1.00 0.00 H new ATOM 1546 N GLY A 93 -2.068 34.624 -8.781 1.00 0.00 N ATOM 1547 CA GLY A 93 -2.783 35.887 -8.854 1.00 0.00 C ATOM 1548 C GLY A 93 -2.943 36.507 -7.464 1.00 0.00 C ATOM 1549 O GLY A 93 -1.970 36.639 -6.723 1.00 0.00 O ATOM 0 H GLY A 93 -2.636 33.801 -8.980 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -2.245 36.577 -9.504 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.765 35.728 -9.301 1.00 0.00 H new ATOM 1553 N SER A 94 -4.178 36.873 -7.153 1.00 0.00 N ATOM 1554 CA SER A 94 -4.478 37.476 -5.866 1.00 0.00 C ATOM 1555 C SER A 94 -5.821 36.960 -5.346 1.00 0.00 C ATOM 1556 O SER A 94 -6.110 35.768 -5.439 1.00 0.00 O ATOM 1557 CB SER A 94 -4.498 39.003 -5.964 1.00 0.00 C ATOM 1558 OG SER A 94 -5.636 39.477 -6.679 1.00 0.00 O ATOM 0 H SER A 94 -4.982 36.763 -7.771 1.00 0.00 H new ATOM 0 HA SER A 94 -3.692 37.194 -5.165 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.496 39.431 -4.961 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.590 39.346 -6.459 1.00 0.00 H new ATOM 0 HG SER A 94 -5.613 40.456 -6.718 1.00 0.00 H new ATOM 1564 N GLU A 95 -6.607 37.883 -4.811 1.00 0.00 N ATOM 1565 CA GLU A 95 -7.913 37.536 -4.277 1.00 0.00 C ATOM 1566 C GLU A 95 -8.760 38.796 -4.086 1.00 0.00 C ATOM 1567 O GLU A 95 -8.223 39.884 -3.880 1.00 0.00 O ATOM 1568 CB GLU A 95 -7.780 36.760 -2.966 1.00 0.00 C ATOM 1569 CG GLU A 95 -8.983 35.838 -2.750 1.00 0.00 C ATOM 1570 CD GLU A 95 -9.429 35.853 -1.286 1.00 0.00 C ATOM 1571 OE1 GLU A 95 -8.565 35.575 -0.427 1.00 0.00 O ATOM 1572 OE2 GLU A 95 -10.624 36.142 -1.060 1.00 0.00 O ATOM 0 H GLU A 95 -6.364 38.871 -4.736 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.417 36.889 -4.994 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.863 36.171 -2.980 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.698 37.458 -2.133 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.808 36.155 -3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.724 34.821 -3.045 1.00 0.00 H new ATOM 1579 N THR A 96 -10.069 38.607 -4.159 1.00 0.00 N ATOM 1580 CA THR A 96 -10.995 39.715 -3.996 1.00 0.00 C ATOM 1581 C THR A 96 -12.439 39.225 -4.115 1.00 0.00 C ATOM 1582 O THR A 96 -12.773 38.483 -5.038 1.00 0.00 O ATOM 1583 CB THR A 96 -10.631 40.790 -5.022 1.00 0.00 C ATOM 1584 OG1 THR A 96 -11.780 41.632 -5.064 1.00 0.00 O ATOM 1585 CG2 THR A 96 -10.526 40.232 -6.443 1.00 0.00 C ATOM 0 H THR A 96 -10.511 37.703 -4.329 1.00 0.00 H new ATOM 0 HA THR A 96 -10.915 40.154 -3.002 1.00 0.00 H new ATOM 0 HB THR A 96 -9.684 41.252 -4.743 1.00 0.00 H new ATOM 0 HG1 THR A 96 -11.630 42.359 -5.704 1.00 0.00 H new ATOM 0 HG21 THR A 96 -10.266 41.036 -7.131 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.755 39.462 -6.476 1.00 0.00 H new ATOM 0 HG23 THR A 96 -11.483 39.799 -6.736 1.00 0.00 H new ATOM 1593 N GLU A 97 -13.258 39.659 -3.168 1.00 0.00 N ATOM 1594 CA GLU A 97 -14.659 39.273 -3.156 1.00 0.00 C ATOM 1595 C GLU A 97 -15.543 40.493 -2.886 1.00 0.00 C ATOM 1596 O GLU A 97 -15.318 41.225 -1.923 1.00 0.00 O ATOM 1597 CB GLU A 97 -14.915 38.172 -2.126 1.00 0.00 C ATOM 1598 CG GLU A 97 -16.020 37.225 -2.599 1.00 0.00 C ATOM 1599 CD GLU A 97 -17.163 37.165 -1.583 1.00 0.00 C ATOM 1600 OE1 GLU A 97 -17.756 38.236 -1.332 1.00 0.00 O ATOM 1601 OE2 GLU A 97 -17.418 36.049 -1.081 1.00 0.00 O ATOM 0 H GLU A 97 -12.978 40.274 -2.404 1.00 0.00 H new ATOM 0 HA GLU A 97 -14.914 38.873 -4.137 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -13.997 37.609 -1.954 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -15.198 38.619 -1.173 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -16.403 37.560 -3.563 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -15.609 36.227 -2.749 1.00 0.00 H new ATOM 1608 N GLY A 98 -16.529 40.673 -3.752 1.00 0.00 N ATOM 1609 CA GLY A 98 -17.447 41.791 -3.619 1.00 0.00 C ATOM 1610 C GLY A 98 -18.508 41.763 -4.721 1.00 0.00 C ATOM 1611 O GLY A 98 -18.693 40.743 -5.384 1.00 0.00 O ATOM 0 H GLY A 98 -16.712 40.063 -4.549 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -17.930 41.755 -2.643 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -16.893 42.729 -3.666 1.00 0.00 H new ATOM 1615 N GLU A 99 -19.177 42.895 -4.883 1.00 0.00 N ATOM 1616 CA GLU A 99 -20.215 43.013 -5.893 1.00 0.00 C ATOM 1617 C GLU A 99 -19.977 44.253 -6.757 1.00 0.00 C ATOM 1618 O GLU A 99 -18.836 44.676 -6.941 1.00 0.00 O ATOM 1619 CB GLU A 99 -21.603 43.050 -5.251 1.00 0.00 C ATOM 1620 CG GLU A 99 -22.622 42.290 -6.103 1.00 0.00 C ATOM 1621 CD GLU A 99 -24.035 42.833 -5.883 1.00 0.00 C ATOM 1622 OE1 GLU A 99 -24.535 42.671 -4.749 1.00 0.00 O ATOM 1623 OE2 GLU A 99 -24.583 43.398 -6.854 1.00 0.00 O ATOM 0 H GLU A 99 -19.020 43.739 -4.332 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.171 42.133 -6.535 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -21.558 42.612 -4.254 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.924 44.085 -5.130 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -22.356 42.375 -7.157 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -22.593 41.230 -5.852 1.00 0.00 H new ATOM 1630 N GLU A 100 -21.071 44.802 -7.263 1.00 0.00 N ATOM 1631 CA GLU A 100 -20.995 45.985 -8.103 1.00 0.00 C ATOM 1632 C GLU A 100 -22.281 46.805 -7.982 1.00 0.00 C ATOM 1633 O GLU A 100 -23.299 46.303 -7.507 1.00 0.00 O ATOM 1634 CB GLU A 100 -20.721 45.607 -9.560 1.00 0.00 C ATOM 1635 CG GLU A 100 -19.722 46.575 -10.199 1.00 0.00 C ATOM 1636 CD GLU A 100 -18.435 45.850 -10.597 1.00 0.00 C ATOM 1637 OE1 GLU A 100 -18.539 44.651 -10.932 1.00 0.00 O ATOM 1638 OE2 GLU A 100 -17.375 46.513 -10.557 1.00 0.00 O ATOM 0 H GLU A 100 -22.015 44.449 -7.107 1.00 0.00 H new ATOM 0 HA GLU A 100 -20.162 46.598 -7.759 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -20.330 44.591 -9.608 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -21.654 45.617 -10.124 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -20.170 47.038 -11.078 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -19.490 47.378 -9.500 1.00 0.00 H new ATOM 1645 N ALA A 101 -22.194 48.052 -8.421 1.00 0.00 N ATOM 1646 CA ALA A 101 -23.338 48.946 -8.369 1.00 0.00 C ATOM 1647 C ALA A 101 -22.984 50.262 -9.064 1.00 0.00 C ATOM 1648 O ALA A 101 -22.446 51.174 -8.437 1.00 0.00 O ATOM 1649 CB ALA A 101 -23.759 49.151 -6.912 1.00 0.00 C ATOM 0 H ALA A 101 -21.348 48.465 -8.815 1.00 0.00 H new ATOM 0 HA ALA A 101 -24.188 48.513 -8.897 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -24.617 49.822 -6.872 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -24.028 48.191 -6.473 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -22.932 49.587 -6.352 1.00 0.00 H new TER 1655 ALA A 101