USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 549 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 50 ASN : amide:sc= 0.756 K(o=1.6,f=-7.4!) USER MOD Set 1.2: A 52 LYS NZ :NH3+ 134:sc= 0.863 (180deg=0) USER MOD Set 2.1: A 25 SER OG : rot -94:sc= 0.629 USER MOD Set 2.2: A 47 SER OG : rot -125:sc= 0.588 USER MOD Set 3.1: A 2 SER OG : rot -93:sc= 1.3 USER MOD Set 3.2: A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= 0.307 K(o=0.31,f=-5.8!) USER MOD Single : A 11 ASN : amide:sc= 0.487 X(o=0.49,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 177:sc= 0.844 (180deg=0.833) USER MOD Single : A 19 TYR OH : rot 100:sc= 0 USER MOD Single : A 23 SER OG : rot 101:sc= 0.889 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HE2:sc= 0.934 K(o=0.93,f=-2.9!) USER MOD Single : A 31 LYS NZ :NH3+ -176:sc= 0.973 (180deg=0.853) USER MOD Single : A 32 SER OG : rot 151:sc= 0.167 USER MOD Single : A 35 MET CE :methyl -174:sc= -0.0352 (180deg=-0.104) USER MOD Single : A 36 SER OG : rot -154:sc= 1.06 USER MOD Single : A 42 GLN : amide:sc= 1.04 K(o=1,f=-0.053) USER MOD Single : A 51 LYS NZ :NH3+ -123:sc= 0.97 (180deg=0.373) USER MOD Single : A 55 LYS NZ :NH3+ 168:sc= 2.17 (180deg=1.98) USER MOD Single : A 60 GLN : amide:sc= 1.07 K(o=1.1,f=-9.4!) USER MOD Single : A 61 SER OG : rot 76:sc= 0.638 USER MOD Single : A 65 THR OG1 : rot 82:sc= 0.527 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= -0.0856 X(o=-0.086,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -32.106 9.278 -6.438 1.00 0.00 N ATOM 2 CA PRO A 1 -32.428 9.597 -5.031 1.00 0.00 C ATOM 3 C PRO A 1 -33.115 8.444 -4.273 1.00 0.00 C ATOM 4 O PRO A 1 -32.476 7.824 -3.424 1.00 0.00 O ATOM 5 CB PRO A 1 -33.188 10.934 -5.049 1.00 0.00 C ATOM 6 CG PRO A 1 -32.748 11.597 -6.366 1.00 0.00 C ATOM 7 CD PRO A 1 -31.763 10.603 -6.985 1.00 0.00 C ATOM 0 H2 PRO A 1 -32.898 8.858 -6.925 1.00 0.00 H new ATOM 0 H3 PRO A 1 -31.328 8.622 -6.512 1.00 0.00 H new ATOM 0 HA PRO A 1 -31.521 9.716 -4.438 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -34.267 10.780 -5.021 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -32.932 11.550 -4.187 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -33.598 11.775 -7.024 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -32.276 12.563 -6.186 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -31.841 10.606 -8.072 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -30.736 10.870 -6.738 1.00 0.00 H new ATOM 15 N SER A 2 -34.386 8.127 -4.565 1.00 0.00 N ATOM 16 CA SER A 2 -35.135 7.025 -3.926 1.00 0.00 C ATOM 17 C SER A 2 -34.844 5.628 -4.510 1.00 0.00 C ATOM 18 O SER A 2 -35.262 4.623 -3.927 1.00 0.00 O ATOM 19 CB SER A 2 -36.645 7.310 -3.953 1.00 0.00 C ATOM 20 OG SER A 2 -37.165 7.344 -5.268 1.00 0.00 O ATOM 0 H SER A 2 -34.933 8.634 -5.261 1.00 0.00 H new ATOM 0 HA SER A 2 -34.779 6.994 -2.896 1.00 0.00 H new ATOM 0 HB2 SER A 2 -37.167 6.544 -3.379 1.00 0.00 H new ATOM 0 HB3 SER A 2 -36.841 8.264 -3.463 1.00 0.00 H new ATOM 0 HG SER A 2 -37.152 8.266 -5.601 1.00 0.00 H new ATOM 26 N GLY A 3 -34.096 5.538 -5.618 1.00 0.00 N ATOM 27 CA GLY A 3 -33.665 4.278 -6.242 1.00 0.00 C ATOM 28 C GLY A 3 -32.357 4.384 -7.040 1.00 0.00 C ATOM 29 O GLY A 3 -31.662 5.404 -6.985 1.00 0.00 O ATOM 0 H GLY A 3 -33.764 6.362 -6.119 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -33.543 3.524 -5.464 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -34.455 3.926 -6.906 1.00 0.00 H new ATOM 33 N LYS A 4 -32.001 3.293 -7.738 1.00 0.00 N ATOM 34 CA LYS A 4 -30.647 3.027 -8.281 1.00 0.00 C ATOM 35 C LYS A 4 -30.624 2.353 -9.671 1.00 0.00 C ATOM 36 O LYS A 4 -29.680 1.640 -10.017 1.00 0.00 O ATOM 37 CB LYS A 4 -29.823 2.270 -7.215 1.00 0.00 C ATOM 38 CG LYS A 4 -30.406 0.898 -6.821 1.00 0.00 C ATOM 39 CD LYS A 4 -29.536 0.151 -5.798 1.00 0.00 C ATOM 40 CE LYS A 4 -29.477 0.876 -4.444 1.00 0.00 C ATOM 41 NZ LYS A 4 -28.692 0.106 -3.445 1.00 0.00 N ATOM 0 H LYS A 4 -32.663 2.546 -7.949 1.00 0.00 H new ATOM 0 HA LYS A 4 -30.177 3.989 -8.482 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -28.809 2.127 -7.590 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -29.748 2.890 -6.322 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -31.405 1.038 -6.408 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -30.514 0.284 -7.715 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -29.932 -0.854 -5.653 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -28.526 0.042 -6.194 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -29.030 1.861 -4.577 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -30.489 1.033 -4.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -28.673 0.625 -2.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -29.133 -0.825 -3.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -27.720 -0.022 -3.791 1.00 0.00 H new ATOM 55 N ASN A 5 -31.656 2.602 -10.477 1.00 0.00 N ATOM 56 CA ASN A 5 -31.764 2.226 -11.897 1.00 0.00 C ATOM 57 C ASN A 5 -31.856 3.521 -12.736 1.00 0.00 C ATOM 58 O ASN A 5 -32.515 4.462 -12.289 1.00 0.00 O ATOM 59 CB ASN A 5 -32.999 1.310 -12.046 1.00 0.00 C ATOM 60 CG ASN A 5 -33.491 1.166 -13.478 1.00 0.00 C ATOM 61 OD1 ASN A 5 -34.027 2.093 -14.067 1.00 0.00 O ATOM 62 ND2 ASN A 5 -33.322 0.020 -14.094 1.00 0.00 N ATOM 0 H ASN A 5 -32.484 3.096 -10.146 1.00 0.00 H new ATOM 0 HA ASN A 5 -30.896 1.673 -12.256 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -32.756 0.322 -11.655 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -33.808 1.705 -11.432 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -33.637 -0.092 -15.058 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -32.875 -0.759 -13.609 1.00 0.00 H new ATOM 69 N PRO A 6 -31.226 3.623 -13.925 1.00 0.00 N ATOM 70 CA PRO A 6 -31.113 4.912 -14.603 1.00 0.00 C ATOM 71 C PRO A 6 -32.442 5.434 -15.152 1.00 0.00 C ATOM 72 O PRO A 6 -32.727 6.623 -14.989 1.00 0.00 O ATOM 73 CB PRO A 6 -30.065 4.715 -15.704 1.00 0.00 C ATOM 74 CG PRO A 6 -30.181 3.223 -16.016 1.00 0.00 C ATOM 75 CD PRO A 6 -30.456 2.611 -14.639 1.00 0.00 C ATOM 0 HA PRO A 6 -30.810 5.684 -13.896 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -30.277 5.329 -16.579 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -29.064 4.981 -15.363 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -30.989 3.018 -16.719 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -29.266 2.830 -16.458 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -31.014 1.678 -14.725 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -29.528 2.380 -14.117 1.00 0.00 H new ATOM 83 N VAL A 7 -33.288 4.559 -15.717 1.00 0.00 N ATOM 84 CA VAL A 7 -34.654 4.933 -16.119 1.00 0.00 C ATOM 85 C VAL A 7 -35.365 5.535 -14.912 1.00 0.00 C ATOM 86 O VAL A 7 -35.912 6.627 -14.964 1.00 0.00 O ATOM 87 CB VAL A 7 -35.486 3.743 -16.658 1.00 0.00 C ATOM 88 CG1 VAL A 7 -36.880 4.198 -17.081 1.00 0.00 C ATOM 89 CG2 VAL A 7 -34.722 2.934 -17.709 1.00 0.00 C ATOM 0 H VAL A 7 -33.050 3.585 -15.906 1.00 0.00 H new ATOM 0 HA VAL A 7 -34.568 5.649 -16.936 1.00 0.00 H new ATOM 0 HB VAL A 7 -35.648 3.034 -15.846 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -37.444 3.344 -17.456 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -37.399 4.627 -16.224 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -36.795 4.949 -17.866 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -35.345 2.110 -18.058 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -34.468 3.579 -18.551 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -33.808 2.536 -17.268 1.00 0.00 H new ATOM 99 N MET A 8 -35.349 4.795 -13.814 1.00 0.00 N ATOM 100 CA MET A 8 -35.971 5.138 -12.549 1.00 0.00 C ATOM 101 C MET A 8 -35.548 6.479 -11.931 1.00 0.00 C ATOM 102 O MET A 8 -36.417 7.272 -11.567 1.00 0.00 O ATOM 103 CB MET A 8 -35.763 3.942 -11.639 1.00 0.00 C ATOM 104 CG MET A 8 -36.647 4.021 -10.404 1.00 0.00 C ATOM 105 SD MET A 8 -35.899 4.925 -9.021 1.00 0.00 S ATOM 106 CE MET A 8 -37.248 4.834 -7.817 1.00 0.00 C ATOM 0 H MET A 8 -34.876 3.892 -13.782 1.00 0.00 H new ATOM 0 HA MET A 8 -37.031 5.329 -12.713 1.00 0.00 H new ATOM 0 HB2 MET A 8 -35.981 3.025 -12.186 1.00 0.00 H new ATOM 0 HB3 MET A 8 -34.717 3.891 -11.336 1.00 0.00 H new ATOM 0 HG2 MET A 8 -37.588 4.501 -10.673 1.00 0.00 H new ATOM 0 HG3 MET A 8 -36.888 3.010 -10.076 1.00 0.00 H new ATOM 0 HE1 MET A 8 -36.953 5.345 -6.901 1.00 0.00 H new ATOM 0 HE2 MET A 8 -38.136 5.312 -8.229 1.00 0.00 H new ATOM 0 HE3 MET A 8 -37.468 3.790 -7.595 1.00 0.00 H new ATOM 116 N ILE A 9 -34.246 6.737 -11.755 1.00 0.00 N ATOM 117 CA ILE A 9 -33.771 8.066 -11.334 1.00 0.00 C ATOM 118 C ILE A 9 -34.194 9.193 -12.279 1.00 0.00 C ATOM 119 O ILE A 9 -34.673 10.226 -11.814 1.00 0.00 O ATOM 120 CB ILE A 9 -32.275 8.134 -10.970 1.00 0.00 C ATOM 121 CG1 ILE A 9 -31.311 7.633 -12.056 1.00 0.00 C ATOM 122 CG2 ILE A 9 -32.029 7.343 -9.675 1.00 0.00 C ATOM 123 CD1 ILE A 9 -29.917 8.251 -11.927 1.00 0.00 C ATOM 0 H ILE A 9 -33.505 6.050 -11.896 1.00 0.00 H new ATOM 0 HA ILE A 9 -34.295 8.238 -10.394 1.00 0.00 H new ATOM 0 HB ILE A 9 -32.055 9.195 -10.849 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -31.232 6.548 -11.995 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -31.720 7.868 -13.038 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -30.971 7.390 -9.416 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -32.620 7.774 -8.867 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -32.321 6.303 -9.823 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -29.273 7.865 -12.717 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -29.990 9.335 -12.015 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -29.493 7.994 -10.956 1.00 0.00 H new ATOM 135 N LEU A 10 -34.010 9.037 -13.596 1.00 0.00 N ATOM 136 CA LEU A 10 -34.502 10.026 -14.565 1.00 0.00 C ATOM 137 C LEU A 10 -36.007 10.301 -14.447 1.00 0.00 C ATOM 138 O LEU A 10 -36.443 11.450 -14.455 1.00 0.00 O ATOM 139 CB LEU A 10 -33.946 9.712 -15.962 1.00 0.00 C ATOM 140 CG LEU A 10 -34.746 9.650 -17.274 1.00 0.00 C ATOM 141 CD1 LEU A 10 -35.767 8.530 -17.365 1.00 0.00 C ATOM 142 CD2 LEU A 10 -35.321 10.992 -17.685 1.00 0.00 C ATOM 0 H LEU A 10 -33.527 8.241 -14.014 1.00 0.00 H new ATOM 0 HA LEU A 10 -34.102 11.010 -14.321 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -33.160 10.447 -16.135 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -33.460 8.741 -15.871 1.00 0.00 H new ATOM 0 HG LEU A 10 -33.992 9.384 -18.015 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -36.274 8.577 -18.329 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -35.262 7.569 -17.267 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -36.499 8.639 -16.564 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -35.874 10.881 -18.618 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -35.992 11.354 -16.906 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -34.511 11.707 -17.827 1.00 0.00 H new ATOM 154 N ASN A 11 -36.781 9.238 -14.247 1.00 0.00 N ATOM 155 CA ASN A 11 -38.206 9.248 -13.931 1.00 0.00 C ATOM 156 C ASN A 11 -38.510 10.101 -12.682 1.00 0.00 C ATOM 157 O ASN A 11 -39.351 10.993 -12.748 1.00 0.00 O ATOM 158 CB ASN A 11 -38.641 7.772 -13.800 1.00 0.00 C ATOM 159 CG ASN A 11 -39.742 7.500 -12.787 1.00 0.00 C ATOM 160 OD1 ASN A 11 -40.923 7.679 -13.047 1.00 0.00 O ATOM 161 ND2 ASN A 11 -39.381 7.049 -11.605 1.00 0.00 N ATOM 0 H ASN A 11 -36.408 8.290 -14.305 1.00 0.00 H new ATOM 0 HA ASN A 11 -38.786 9.725 -14.721 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -38.976 7.422 -14.777 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -37.768 7.177 -13.530 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -40.088 6.846 -10.899 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -38.394 6.902 -11.395 1.00 0.00 H new ATOM 168 N GLU A 12 -37.888 9.803 -11.536 1.00 0.00 N ATOM 169 CA GLU A 12 -38.014 10.595 -10.306 1.00 0.00 C ATOM 170 C GLU A 12 -37.613 12.080 -10.449 1.00 0.00 C ATOM 171 O GLU A 12 -38.407 12.979 -10.166 1.00 0.00 O ATOM 172 CB GLU A 12 -37.409 9.846 -9.099 1.00 0.00 C ATOM 173 CG GLU A 12 -35.999 10.232 -8.637 1.00 0.00 C ATOM 174 CD GLU A 12 -35.579 9.414 -7.413 1.00 0.00 C ATOM 175 OE1 GLU A 12 -36.216 9.534 -6.342 1.00 0.00 O ATOM 176 OE2 GLU A 12 -34.562 8.690 -7.476 1.00 0.00 O ATOM 0 H GLU A 12 -37.275 8.994 -11.435 1.00 0.00 H new ATOM 0 HA GLU A 12 -39.079 10.686 -10.092 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -38.084 9.978 -8.253 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -37.401 8.782 -9.337 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -35.289 10.069 -9.448 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -35.970 11.295 -8.396 1.00 0.00 H new ATOM 183 N LEU A 13 -36.357 12.342 -10.832 1.00 0.00 N ATOM 184 CA LEU A 13 -35.796 13.674 -11.096 1.00 0.00 C ATOM 185 C LEU A 13 -36.548 14.518 -12.142 1.00 0.00 C ATOM 186 O LEU A 13 -36.619 15.737 -11.987 1.00 0.00 O ATOM 187 CB LEU A 13 -34.274 13.581 -11.310 1.00 0.00 C ATOM 188 CG LEU A 13 -33.519 13.222 -10.004 1.00 0.00 C ATOM 189 CD1 LEU A 13 -32.026 13.080 -10.276 1.00 0.00 C ATOM 190 CD2 LEU A 13 -33.688 14.271 -8.898 1.00 0.00 C ATOM 0 H LEU A 13 -35.673 11.598 -10.973 1.00 0.00 H new ATOM 0 HA LEU A 13 -35.963 14.265 -10.195 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -34.061 12.828 -12.069 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -33.904 14.533 -11.692 1.00 0.00 H new ATOM 0 HG LEU A 13 -33.955 12.284 -9.662 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -31.510 12.828 -9.350 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -31.863 12.290 -11.009 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -31.636 14.021 -10.664 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -33.135 13.958 -8.012 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -33.305 15.231 -9.245 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -34.745 14.371 -8.649 1.00 0.00 H new ATOM 202 N ARG A 14 -37.129 13.883 -13.173 1.00 0.00 N ATOM 203 CA ARG A 14 -37.833 14.446 -14.356 1.00 0.00 C ATOM 204 C ARG A 14 -37.647 15.952 -14.667 1.00 0.00 C ATOM 205 O ARG A 14 -38.615 16.699 -14.538 1.00 0.00 O ATOM 206 CB ARG A 14 -39.308 13.968 -14.398 1.00 0.00 C ATOM 207 CG ARG A 14 -40.176 14.023 -13.120 1.00 0.00 C ATOM 208 CD ARG A 14 -40.599 15.398 -12.585 1.00 0.00 C ATOM 209 NE ARG A 14 -39.499 16.081 -11.885 1.00 0.00 N ATOM 210 CZ ARG A 14 -39.454 17.341 -11.502 1.00 0.00 C ATOM 211 NH1 ARG A 14 -40.505 18.111 -11.498 1.00 0.00 N ATOM 212 NH2 ARG A 14 -38.318 17.846 -11.118 1.00 0.00 N ATOM 0 H ARG A 14 -37.121 12.864 -13.211 1.00 0.00 H new ATOM 0 HA ARG A 14 -37.298 14.019 -15.205 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -39.818 14.556 -15.161 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -39.304 12.934 -14.743 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -41.082 13.447 -13.309 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -39.632 13.511 -12.326 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -40.943 16.019 -13.413 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -41.442 15.278 -11.905 1.00 0.00 H new ATOM 0 HE ARG A 14 -38.678 15.514 -11.672 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -41.408 17.744 -11.799 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -40.425 19.081 -11.193 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -37.478 17.268 -11.116 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -38.268 18.820 -10.819 1.00 0.00 H new ATOM 226 N PRO A 15 -36.449 16.429 -15.075 1.00 0.00 N ATOM 227 CA PRO A 15 -36.114 17.855 -15.309 1.00 0.00 C ATOM 228 C PRO A 15 -36.886 18.637 -16.413 1.00 0.00 C ATOM 229 O PRO A 15 -36.283 19.380 -17.192 1.00 0.00 O ATOM 230 CB PRO A 15 -34.594 17.880 -15.541 1.00 0.00 C ATOM 231 CG PRO A 15 -34.100 16.623 -14.840 1.00 0.00 C ATOM 232 CD PRO A 15 -35.219 15.644 -15.161 1.00 0.00 C ATOM 0 HA PRO A 15 -36.448 18.409 -14.432 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -34.351 17.867 -16.604 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -34.140 18.777 -15.121 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -33.137 16.288 -15.226 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -33.979 16.771 -13.767 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -35.094 15.215 -16.155 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -35.231 14.814 -14.455 1.00 0.00 H new ATOM 240 N GLY A 16 -38.209 18.486 -16.521 1.00 0.00 N ATOM 241 CA GLY A 16 -39.069 19.198 -17.479 1.00 0.00 C ATOM 242 C GLY A 16 -39.110 18.554 -18.870 1.00 0.00 C ATOM 243 O GLY A 16 -39.185 19.266 -19.874 1.00 0.00 O ATOM 0 H GLY A 16 -38.731 17.844 -15.925 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -40.082 19.243 -17.080 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -38.718 20.225 -17.575 1.00 0.00 H new ATOM 247 N LEU A 17 -39.003 17.221 -18.944 1.00 0.00 N ATOM 248 CA LEU A 17 -38.741 16.471 -20.166 1.00 0.00 C ATOM 249 C LEU A 17 -39.960 15.756 -20.771 1.00 0.00 C ATOM 250 O LEU A 17 -41.007 15.596 -20.135 1.00 0.00 O ATOM 251 CB LEU A 17 -37.558 15.528 -19.906 1.00 0.00 C ATOM 252 CG LEU A 17 -37.519 14.746 -18.583 1.00 0.00 C ATOM 253 CD1 LEU A 17 -38.600 13.679 -18.485 1.00 0.00 C ATOM 254 CD2 LEU A 17 -36.151 14.092 -18.488 1.00 0.00 C ATOM 0 H LEU A 17 -39.101 16.621 -18.125 1.00 0.00 H new ATOM 0 HA LEU A 17 -38.484 17.188 -20.946 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -37.527 14.804 -20.720 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -36.644 16.118 -19.969 1.00 0.00 H new ATOM 0 HG LEU A 17 -37.703 15.441 -17.764 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -38.517 13.164 -17.528 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -39.581 14.147 -18.561 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -38.477 12.961 -19.295 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -36.082 13.525 -17.560 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -36.009 13.420 -19.335 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -35.378 14.861 -18.502 1.00 0.00 H new ATOM 266 N LYS A 18 -39.785 15.312 -22.018 1.00 0.00 N ATOM 267 CA LYS A 18 -40.722 14.494 -22.805 1.00 0.00 C ATOM 268 C LYS A 18 -40.012 13.349 -23.512 1.00 0.00 C ATOM 269 O LYS A 18 -38.909 13.542 -24.032 1.00 0.00 O ATOM 270 CB LYS A 18 -41.558 15.299 -23.811 1.00 0.00 C ATOM 271 CG LYS A 18 -40.737 16.126 -24.818 1.00 0.00 C ATOM 272 CD LYS A 18 -41.616 16.816 -25.874 1.00 0.00 C ATOM 273 CE LYS A 18 -42.252 15.845 -26.883 1.00 0.00 C ATOM 274 NZ LYS A 18 -41.276 15.339 -27.882 1.00 0.00 N ATOM 0 H LYS A 18 -38.935 15.525 -22.540 1.00 0.00 H new ATOM 0 HA LYS A 18 -41.420 14.085 -22.074 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -42.198 14.611 -24.364 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -42.215 15.972 -23.260 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -40.163 16.880 -24.280 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -40.019 15.475 -25.317 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -42.407 17.370 -25.369 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -41.013 17.544 -26.416 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -42.687 15.002 -26.346 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -43.069 16.348 -27.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -41.743 14.651 -28.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -40.917 16.133 -28.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -40.483 14.878 -27.391 1.00 0.00 H new ATOM 288 N TYR A 19 -40.647 12.179 -23.507 1.00 0.00 N ATOM 289 CA TYR A 19 -40.145 10.958 -24.130 1.00 0.00 C ATOM 290 C TYR A 19 -40.887 10.663 -25.438 1.00 0.00 C ATOM 291 O TYR A 19 -42.118 10.727 -25.521 1.00 0.00 O ATOM 292 CB TYR A 19 -40.327 9.751 -23.200 1.00 0.00 C ATOM 293 CG TYR A 19 -39.774 9.910 -21.805 1.00 0.00 C ATOM 294 CD1 TYR A 19 -40.597 10.444 -20.796 1.00 0.00 C ATOM 295 CD2 TYR A 19 -38.457 9.513 -21.505 1.00 0.00 C ATOM 296 CE1 TYR A 19 -40.102 10.603 -19.492 1.00 0.00 C ATOM 297 CE2 TYR A 19 -37.948 9.708 -20.211 1.00 0.00 C ATOM 298 CZ TYR A 19 -38.775 10.246 -19.195 1.00 0.00 C ATOM 299 OH TYR A 19 -38.354 10.335 -17.911 1.00 0.00 O ATOM 0 H TYR A 19 -41.553 12.051 -23.055 1.00 0.00 H new ATOM 0 HA TYR A 19 -39.086 11.118 -24.331 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -41.392 9.530 -23.126 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -39.853 8.885 -23.662 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -41.612 10.732 -21.026 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -37.840 9.060 -22.267 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -40.741 11.000 -18.717 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -36.924 9.447 -19.990 1.00 0.00 H new ATOM 0 HH TYR A 19 -38.372 9.446 -17.499 1.00 0.00 H new ATOM 309 N ASP A 20 -40.111 10.308 -26.448 1.00 0.00 N ATOM 310 CA ASP A 20 -40.521 9.943 -27.803 1.00 0.00 C ATOM 311 C ASP A 20 -40.094 8.495 -28.089 1.00 0.00 C ATOM 312 O ASP A 20 -38.977 8.098 -27.754 1.00 0.00 O ATOM 313 CB ASP A 20 -39.882 10.909 -28.814 1.00 0.00 C ATOM 314 CG ASP A 20 -40.325 12.363 -28.592 1.00 0.00 C ATOM 315 OD1 ASP A 20 -41.415 12.753 -29.077 1.00 0.00 O ATOM 316 OD2 ASP A 20 -39.593 13.146 -27.941 1.00 0.00 O ATOM 0 H ASP A 20 -39.098 10.262 -26.338 1.00 0.00 H new ATOM 0 HA ASP A 20 -41.605 10.015 -27.895 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -38.797 10.847 -28.737 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -40.148 10.601 -29.825 1.00 0.00 H new ATOM 321 N PHE A 21 -40.985 7.694 -28.681 1.00 0.00 N ATOM 322 CA PHE A 21 -40.776 6.261 -28.927 1.00 0.00 C ATOM 323 C PHE A 21 -40.565 5.962 -30.415 1.00 0.00 C ATOM 324 O PHE A 21 -41.364 6.327 -31.281 1.00 0.00 O ATOM 325 CB PHE A 21 -41.955 5.489 -28.312 1.00 0.00 C ATOM 326 CG PHE A 21 -42.027 3.996 -28.597 1.00 0.00 C ATOM 327 CD1 PHE A 21 -40.866 3.196 -28.652 1.00 0.00 C ATOM 328 CD2 PHE A 21 -43.285 3.396 -28.797 1.00 0.00 C ATOM 329 CE1 PHE A 21 -40.964 1.826 -28.949 1.00 0.00 C ATOM 330 CE2 PHE A 21 -43.385 2.019 -29.064 1.00 0.00 C ATOM 331 CZ PHE A 21 -42.223 1.233 -29.149 1.00 0.00 C ATOM 0 H PHE A 21 -41.891 8.029 -29.010 1.00 0.00 H new ATOM 0 HA PHE A 21 -39.856 5.929 -28.446 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -41.923 5.626 -27.231 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -42.880 5.946 -28.664 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -39.899 3.638 -28.465 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -44.180 3.998 -28.745 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -40.069 1.226 -29.024 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -44.355 1.565 -29.204 1.00 0.00 H new ATOM 0 HZ PHE A 21 -42.297 0.178 -29.367 1.00 0.00 H new ATOM 341 N LEU A 22 -39.437 5.305 -30.680 1.00 0.00 N ATOM 342 CA LEU A 22 -38.841 4.966 -31.947 1.00 0.00 C ATOM 343 C LEU A 22 -38.467 3.467 -31.864 1.00 0.00 C ATOM 344 O LEU A 22 -38.461 2.840 -30.802 1.00 0.00 O ATOM 345 CB LEU A 22 -37.591 5.850 -32.181 1.00 0.00 C ATOM 346 CG LEU A 22 -37.687 7.392 -32.167 1.00 0.00 C ATOM 347 CD1 LEU A 22 -37.790 8.009 -30.776 1.00 0.00 C ATOM 348 CD2 LEU A 22 -36.413 7.967 -32.790 1.00 0.00 C ATOM 0 H LEU A 22 -38.860 4.962 -29.912 1.00 0.00 H new ATOM 0 HA LEU A 22 -39.519 5.140 -32.782 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -36.857 5.570 -31.425 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -37.177 5.566 -33.148 1.00 0.00 H new ATOM 0 HG LEU A 22 -38.599 7.632 -32.714 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -37.853 9.094 -30.863 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -38.682 7.633 -30.276 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -36.908 7.742 -30.193 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -36.466 9.056 -32.787 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -35.547 7.644 -32.211 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -36.317 7.611 -33.816 1.00 0.00 H new ATOM 360 N SER A 23 -38.136 2.860 -32.990 1.00 0.00 N ATOM 361 CA SER A 23 -37.364 1.609 -32.991 1.00 0.00 C ATOM 362 C SER A 23 -36.337 1.538 -34.118 1.00 0.00 C ATOM 363 O SER A 23 -36.313 2.361 -35.036 1.00 0.00 O ATOM 364 CB SER A 23 -38.275 0.373 -32.983 1.00 0.00 C ATOM 365 OG SER A 23 -38.879 0.123 -34.244 1.00 0.00 O ATOM 0 H SER A 23 -38.384 3.204 -33.918 1.00 0.00 H new ATOM 0 HA SER A 23 -36.797 1.610 -32.060 1.00 0.00 H new ATOM 0 HB2 SER A 23 -37.693 -0.499 -32.685 1.00 0.00 H new ATOM 0 HB3 SER A 23 -39.054 0.507 -32.233 1.00 0.00 H new ATOM 0 HG SER A 23 -38.395 -0.596 -34.702 1.00 0.00 H new ATOM 371 N GLU A 24 -35.478 0.528 -33.992 1.00 0.00 N ATOM 372 CA GLU A 24 -34.912 -0.324 -35.051 1.00 0.00 C ATOM 373 C GLU A 24 -33.370 -0.318 -35.092 1.00 0.00 C ATOM 374 O GLU A 24 -32.743 -0.900 -35.979 1.00 0.00 O ATOM 375 CB GLU A 24 -35.573 -0.144 -36.442 1.00 0.00 C ATOM 376 CG GLU A 24 -35.766 -1.470 -37.190 1.00 0.00 C ATOM 377 CD GLU A 24 -36.773 -2.419 -36.503 1.00 0.00 C ATOM 378 OE1 GLU A 24 -37.502 -2.010 -35.564 1.00 0.00 O ATOM 379 OE2 GLU A 24 -36.854 -3.606 -36.902 1.00 0.00 O ATOM 0 H GLU A 24 -35.127 0.258 -33.073 1.00 0.00 H new ATOM 0 HA GLU A 24 -35.186 -1.337 -34.755 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -36.541 0.341 -36.318 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -34.958 0.522 -37.047 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -36.108 -1.261 -38.204 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -34.803 -1.974 -37.276 1.00 0.00 H new ATOM 386 N SER A 25 -32.769 0.321 -34.087 1.00 0.00 N ATOM 387 CA SER A 25 -31.340 0.441 -33.757 1.00 0.00 C ATOM 388 C SER A 25 -30.605 -0.885 -33.425 1.00 0.00 C ATOM 389 O SER A 25 -29.730 -0.914 -32.552 1.00 0.00 O ATOM 390 CB SER A 25 -31.270 1.417 -32.573 1.00 0.00 C ATOM 391 OG SER A 25 -31.754 2.694 -32.954 1.00 0.00 O ATOM 0 H SER A 25 -33.334 0.826 -33.404 1.00 0.00 H new ATOM 0 HA SER A 25 -30.813 0.792 -34.644 1.00 0.00 H new ATOM 0 HB2 SER A 25 -31.859 1.032 -31.741 1.00 0.00 H new ATOM 0 HB3 SER A 25 -30.241 1.501 -32.223 1.00 0.00 H new ATOM 0 HG SER A 25 -31.003 3.258 -33.235 1.00 0.00 H new ATOM 397 N GLY A 26 -31.000 -1.999 -34.055 1.00 0.00 N ATOM 398 CA GLY A 26 -30.579 -3.373 -33.740 1.00 0.00 C ATOM 399 C GLY A 26 -29.972 -4.119 -34.936 1.00 0.00 C ATOM 400 O GLY A 26 -30.007 -3.647 -36.077 1.00 0.00 O ATOM 0 H GLY A 26 -31.654 -1.966 -34.837 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -29.848 -3.344 -32.932 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -31.439 -3.932 -33.372 1.00 0.00 H new ATOM 404 N GLU A 27 -29.379 -5.283 -34.670 1.00 0.00 N ATOM 405 CA GLU A 27 -28.714 -6.133 -35.672 1.00 0.00 C ATOM 406 C GLU A 27 -29.700 -6.785 -36.668 1.00 0.00 C ATOM 407 O GLU A 27 -30.909 -6.858 -36.426 1.00 0.00 O ATOM 408 CB GLU A 27 -27.914 -7.268 -34.996 1.00 0.00 C ATOM 409 CG GLU A 27 -27.155 -6.928 -33.706 1.00 0.00 C ATOM 410 CD GLU A 27 -28.051 -7.168 -32.479 1.00 0.00 C ATOM 411 OE1 GLU A 27 -28.106 -8.312 -31.970 1.00 0.00 O ATOM 412 OE2 GLU A 27 -28.750 -6.230 -32.034 1.00 0.00 O ATOM 0 H GLU A 27 -29.344 -5.676 -33.729 1.00 0.00 H new ATOM 0 HA GLU A 27 -28.053 -5.462 -36.220 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -28.605 -8.082 -34.775 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -27.194 -7.649 -35.720 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -26.256 -7.540 -33.633 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -26.831 -5.887 -33.730 1.00 0.00 H new ATOM 419 N SER A 28 -29.167 -7.407 -37.727 1.00 0.00 N ATOM 420 CA SER A 28 -29.858 -8.391 -38.589 1.00 0.00 C ATOM 421 C SER A 28 -30.116 -9.748 -37.879 1.00 0.00 C ATOM 422 O SER A 28 -29.918 -10.826 -38.451 1.00 0.00 O ATOM 423 CB SER A 28 -29.060 -8.549 -39.896 1.00 0.00 C ATOM 424 OG SER A 28 -27.721 -8.961 -39.648 1.00 0.00 O ATOM 0 H SER A 28 -28.206 -7.236 -38.024 1.00 0.00 H new ATOM 0 HA SER A 28 -30.854 -8.013 -38.821 1.00 0.00 H new ATOM 0 HB2 SER A 28 -29.553 -9.280 -40.537 1.00 0.00 H new ATOM 0 HB3 SER A 28 -29.055 -7.602 -40.436 1.00 0.00 H new ATOM 0 HG SER A 28 -27.244 -9.053 -40.499 1.00 0.00 H new ATOM 430 N HIS A 29 -30.501 -9.692 -36.596 1.00 0.00 N ATOM 431 CA HIS A 29 -30.630 -10.828 -35.669 1.00 0.00 C ATOM 432 C HIS A 29 -31.661 -10.567 -34.549 1.00 0.00 C ATOM 433 O HIS A 29 -32.433 -11.471 -34.217 1.00 0.00 O ATOM 434 CB HIS A 29 -29.230 -11.147 -35.093 1.00 0.00 C ATOM 435 CG HIS A 29 -29.205 -11.707 -33.689 1.00 0.00 C ATOM 436 ND1 HIS A 29 -28.852 -11.022 -32.543 1.00 0.00 N ATOM 437 CD2 HIS A 29 -29.531 -12.983 -33.311 1.00 0.00 C ATOM 438 CE1 HIS A 29 -28.966 -11.864 -31.503 1.00 0.00 C ATOM 439 NE2 HIS A 29 -29.376 -13.076 -31.920 1.00 0.00 N ATOM 0 H HIS A 29 -30.744 -8.806 -36.152 1.00 0.00 H new ATOM 0 HA HIS A 29 -31.011 -11.689 -36.217 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -28.739 -11.859 -35.756 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -28.635 -10.234 -35.110 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -28.556 -10.047 -32.495 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -29.851 -13.778 -33.969 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -28.758 -11.605 -30.475 1.00 0.00 H new ATOM 447 N ALA A 30 -31.711 -9.350 -33.987 1.00 0.00 N ATOM 448 CA ALA A 30 -32.600 -8.998 -32.872 1.00 0.00 C ATOM 449 C ALA A 30 -32.932 -7.491 -32.821 1.00 0.00 C ATOM 450 O ALA A 30 -32.164 -6.648 -33.292 1.00 0.00 O ATOM 451 CB ALA A 30 -31.931 -9.452 -31.567 1.00 0.00 C ATOM 0 H ALA A 30 -31.127 -8.574 -34.299 1.00 0.00 H new ATOM 0 HA ALA A 30 -33.553 -9.507 -33.015 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -32.573 -9.201 -30.723 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -31.773 -10.530 -31.595 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -30.971 -8.947 -31.455 1.00 0.00 H new ATOM 457 N LYS A 31 -34.087 -7.162 -32.226 1.00 0.00 N ATOM 458 CA LYS A 31 -34.620 -5.793 -32.097 1.00 0.00 C ATOM 459 C LYS A 31 -33.768 -4.864 -31.233 1.00 0.00 C ATOM 460 O LYS A 31 -33.089 -5.291 -30.298 1.00 0.00 O ATOM 461 CB LYS A 31 -36.029 -5.841 -31.470 1.00 0.00 C ATOM 462 CG LYS A 31 -37.152 -6.208 -32.441 1.00 0.00 C ATOM 463 CD LYS A 31 -37.373 -5.150 -33.534 1.00 0.00 C ATOM 464 CE LYS A 31 -38.715 -5.404 -34.232 1.00 0.00 C ATOM 465 NZ LYS A 31 -38.988 -4.377 -35.266 1.00 0.00 N ATOM 0 H LYS A 31 -34.698 -7.863 -31.806 1.00 0.00 H new ATOM 0 HA LYS A 31 -34.627 -5.390 -33.110 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -36.023 -6.563 -30.654 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -36.250 -4.867 -31.033 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -36.920 -7.164 -32.911 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -38.078 -6.343 -31.882 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -37.363 -4.152 -33.096 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -36.561 -5.188 -34.260 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -38.707 -6.392 -34.691 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -39.517 -5.402 -33.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -39.932 -4.536 -35.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -38.952 -3.432 -34.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -38.272 -4.442 -36.017 1.00 0.00 H new ATOM 479 N SER A 32 -33.966 -3.572 -31.476 1.00 0.00 N ATOM 480 CA SER A 32 -33.764 -2.492 -30.510 1.00 0.00 C ATOM 481 C SER A 32 -34.936 -1.527 -30.573 1.00 0.00 C ATOM 482 O SER A 32 -35.346 -1.120 -31.661 1.00 0.00 O ATOM 483 CB SER A 32 -32.461 -1.733 -30.733 1.00 0.00 C ATOM 484 OG SER A 32 -31.349 -2.586 -30.544 1.00 0.00 O ATOM 0 H SER A 32 -34.283 -3.234 -32.384 1.00 0.00 H new ATOM 0 HA SER A 32 -33.700 -2.951 -29.524 1.00 0.00 H new ATOM 0 HB2 SER A 32 -32.442 -1.320 -31.742 1.00 0.00 H new ATOM 0 HB3 SER A 32 -32.402 -0.891 -30.043 1.00 0.00 H new ATOM 0 HG SER A 32 -30.605 -2.283 -31.105 1.00 0.00 H new ATOM 490 N PHE A 33 -35.442 -1.114 -29.419 1.00 0.00 N ATOM 491 CA PHE A 33 -36.418 -0.036 -29.328 1.00 0.00 C ATOM 492 C PHE A 33 -35.604 1.214 -29.003 1.00 0.00 C ATOM 493 O PHE A 33 -34.643 1.175 -28.236 1.00 0.00 O ATOM 494 CB PHE A 33 -37.447 -0.260 -28.208 1.00 0.00 C ATOM 495 CG PHE A 33 -38.375 -1.470 -28.260 1.00 0.00 C ATOM 496 CD1 PHE A 33 -38.319 -2.439 -29.286 1.00 0.00 C ATOM 497 CD2 PHE A 33 -39.312 -1.634 -27.220 1.00 0.00 C ATOM 498 CE1 PHE A 33 -39.153 -3.570 -29.242 1.00 0.00 C ATOM 499 CE2 PHE A 33 -40.151 -2.762 -27.178 1.00 0.00 C ATOM 500 CZ PHE A 33 -40.068 -3.736 -28.187 1.00 0.00 C ATOM 0 H PHE A 33 -35.187 -1.518 -28.518 1.00 0.00 H new ATOM 0 HA PHE A 33 -36.983 0.035 -30.258 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -36.898 -0.312 -27.268 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -38.075 0.630 -28.161 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -37.632 -2.310 -30.109 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -39.387 -0.884 -26.446 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -39.091 -4.315 -30.022 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -40.859 -2.879 -26.371 1.00 0.00 H new ATOM 0 HZ PHE A 33 -40.704 -4.608 -28.153 1.00 0.00 H new ATOM 510 N VAL A 34 -35.895 2.316 -29.674 1.00 0.00 N ATOM 511 CA VAL A 34 -35.236 3.587 -29.372 1.00 0.00 C ATOM 512 C VAL A 34 -36.156 4.567 -28.670 1.00 0.00 C ATOM 513 O VAL A 34 -37.323 4.727 -28.995 1.00 0.00 O ATOM 514 CB VAL A 34 -34.414 4.113 -30.550 1.00 0.00 C ATOM 515 CG1 VAL A 34 -34.831 3.756 -31.966 1.00 0.00 C ATOM 516 CG2 VAL A 34 -33.959 5.569 -30.407 1.00 0.00 C ATOM 0 H VAL A 34 -36.579 2.362 -30.429 1.00 0.00 H new ATOM 0 HA VAL A 34 -34.471 3.408 -28.616 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.535 3.479 -30.432 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -34.139 4.211 -32.675 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -34.815 2.673 -32.088 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -35.839 4.127 -32.153 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.383 5.858 -31.286 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -34.832 6.216 -30.316 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -33.338 5.670 -29.517 1.00 0.00 H new ATOM 526 N MET A 35 -35.613 5.187 -27.636 1.00 0.00 N ATOM 527 CA MET A 35 -36.324 6.126 -26.775 1.00 0.00 C ATOM 528 C MET A 35 -35.548 7.428 -26.743 1.00 0.00 C ATOM 529 O MET A 35 -34.402 7.474 -26.298 1.00 0.00 O ATOM 530 CB MET A 35 -36.505 5.552 -25.363 1.00 0.00 C ATOM 531 CG MET A 35 -37.550 4.429 -25.317 1.00 0.00 C ATOM 532 SD MET A 35 -39.236 4.840 -25.858 1.00 0.00 S ATOM 533 CE MET A 35 -39.603 6.317 -24.872 1.00 0.00 C ATOM 0 H MET A 35 -34.640 5.050 -27.362 1.00 0.00 H new ATOM 0 HA MET A 35 -37.323 6.306 -27.173 1.00 0.00 H new ATOM 0 HB2 MET A 35 -35.549 5.170 -25.004 1.00 0.00 H new ATOM 0 HB3 MET A 35 -36.804 6.351 -24.685 1.00 0.00 H new ATOM 0 HG2 MET A 35 -37.189 3.606 -25.934 1.00 0.00 H new ATOM 0 HG3 MET A 35 -37.604 4.060 -24.293 1.00 0.00 H new ATOM 0 HE1 MET A 35 -40.642 6.609 -25.027 1.00 0.00 H new ATOM 0 HE2 MET A 35 -39.440 6.099 -23.816 1.00 0.00 H new ATOM 0 HE3 MET A 35 -38.948 7.132 -25.180 1.00 0.00 H new ATOM 543 N SER A 36 -36.173 8.490 -27.228 1.00 0.00 N ATOM 544 CA SER A 36 -35.527 9.783 -27.420 1.00 0.00 C ATOM 545 C SER A 36 -36.176 10.824 -26.508 1.00 0.00 C ATOM 546 O SER A 36 -37.394 10.846 -26.369 1.00 0.00 O ATOM 547 CB SER A 36 -35.567 10.153 -28.903 1.00 0.00 C ATOM 548 OG SER A 36 -34.882 9.158 -29.646 1.00 0.00 O ATOM 0 H SER A 36 -37.155 8.480 -27.503 1.00 0.00 H new ATOM 0 HA SER A 36 -34.476 9.740 -27.136 1.00 0.00 H new ATOM 0 HB2 SER A 36 -36.599 10.233 -29.243 1.00 0.00 H new ATOM 0 HB3 SER A 36 -35.103 11.127 -29.061 1.00 0.00 H new ATOM 0 HG SER A 36 -34.547 9.546 -30.481 1.00 0.00 H new ATOM 554 N VAL A 37 -35.382 11.652 -25.830 1.00 0.00 N ATOM 555 CA VAL A 37 -35.854 12.629 -24.830 1.00 0.00 C ATOM 556 C VAL A 37 -35.470 14.052 -25.197 1.00 0.00 C ATOM 557 O VAL A 37 -34.320 14.320 -25.549 1.00 0.00 O ATOM 558 CB VAL A 37 -35.416 12.364 -23.374 1.00 0.00 C ATOM 559 CG1 VAL A 37 -36.314 11.405 -22.625 1.00 0.00 C ATOM 560 CG2 VAL A 37 -33.945 11.963 -23.218 1.00 0.00 C ATOM 0 H VAL A 37 -34.370 11.668 -25.958 1.00 0.00 H new ATOM 0 HA VAL A 37 -36.936 12.499 -24.860 1.00 0.00 H new ATOM 0 HB VAL A 37 -35.527 13.342 -22.906 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -35.938 11.272 -21.610 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -37.326 11.808 -22.587 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -36.326 10.443 -23.137 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -33.723 11.796 -22.164 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -33.756 11.047 -23.778 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -33.308 12.760 -23.601 1.00 0.00 H new ATOM 570 N VAL A 38 -36.429 14.967 -25.044 1.00 0.00 N ATOM 571 CA VAL A 38 -36.170 16.415 -25.057 1.00 0.00 C ATOM 572 C VAL A 38 -36.246 16.888 -23.606 1.00 0.00 C ATOM 573 O VAL A 38 -37.232 16.620 -22.917 1.00 0.00 O ATOM 574 CB VAL A 38 -37.199 17.196 -25.904 1.00 0.00 C ATOM 575 CG1 VAL A 38 -36.900 18.703 -25.903 1.00 0.00 C ATOM 576 CG2 VAL A 38 -37.235 16.745 -27.368 1.00 0.00 C ATOM 0 H VAL A 38 -37.411 14.728 -24.907 1.00 0.00 H new ATOM 0 HA VAL A 38 -35.194 16.600 -25.506 1.00 0.00 H new ATOM 0 HB VAL A 38 -38.162 16.988 -25.437 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -37.643 19.222 -26.508 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -36.937 19.081 -24.881 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -35.908 18.877 -26.319 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -37.977 17.331 -27.911 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -36.254 16.894 -27.819 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -37.500 15.689 -27.417 1.00 0.00 H new ATOM 586 N VAL A 39 -35.190 17.559 -23.146 1.00 0.00 N ATOM 587 CA VAL A 39 -35.003 18.088 -21.782 1.00 0.00 C ATOM 588 C VAL A 39 -34.195 19.389 -21.855 1.00 0.00 C ATOM 589 O VAL A 39 -33.322 19.507 -22.713 1.00 0.00 O ATOM 590 CB VAL A 39 -34.292 17.042 -20.885 1.00 0.00 C ATOM 591 CG1 VAL A 39 -32.877 16.675 -21.325 1.00 0.00 C ATOM 592 CG2 VAL A 39 -34.254 17.490 -19.421 1.00 0.00 C ATOM 0 H VAL A 39 -34.391 17.763 -23.746 1.00 0.00 H new ATOM 0 HA VAL A 39 -35.975 18.297 -21.336 1.00 0.00 H new ATOM 0 HB VAL A 39 -34.901 16.145 -20.995 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -32.462 15.938 -20.637 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -32.906 16.257 -22.331 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -32.252 17.568 -21.321 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -33.749 16.733 -18.822 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -33.714 18.434 -19.343 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -35.272 17.623 -19.055 1.00 0.00 H new ATOM 602 N ASP A 40 -34.466 20.369 -20.983 1.00 0.00 N ATOM 603 CA ASP A 40 -33.759 21.670 -20.856 1.00 0.00 C ATOM 604 C ASP A 40 -33.806 22.622 -22.086 1.00 0.00 C ATOM 605 O ASP A 40 -33.673 23.838 -21.934 1.00 0.00 O ATOM 606 CB ASP A 40 -32.316 21.392 -20.377 1.00 0.00 C ATOM 607 CG ASP A 40 -31.418 22.640 -20.368 1.00 0.00 C ATOM 608 OD1 ASP A 40 -31.532 23.466 -19.431 1.00 0.00 O ATOM 609 OD2 ASP A 40 -30.579 22.766 -21.295 1.00 0.00 O ATOM 0 H ASP A 40 -35.224 20.280 -20.306 1.00 0.00 H new ATOM 0 HA ASP A 40 -34.316 22.248 -20.119 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -32.351 20.973 -19.372 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -31.867 20.637 -21.022 1.00 0.00 H new ATOM 614 N GLY A 41 -34.022 22.094 -23.292 1.00 0.00 N ATOM 615 CA GLY A 41 -33.849 22.768 -24.587 1.00 0.00 C ATOM 616 C GLY A 41 -33.022 21.951 -25.603 1.00 0.00 C ATOM 617 O GLY A 41 -32.734 22.447 -26.693 1.00 0.00 O ATOM 0 H GLY A 41 -34.340 21.131 -23.401 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -34.831 22.975 -25.013 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -33.362 23.730 -24.425 1.00 0.00 H new ATOM 621 N GLN A 42 -32.626 20.722 -25.248 1.00 0.00 N ATOM 622 CA GLN A 42 -31.727 19.833 -25.988 1.00 0.00 C ATOM 623 C GLN A 42 -32.264 18.388 -26.040 1.00 0.00 C ATOM 624 O GLN A 42 -33.208 18.028 -25.332 1.00 0.00 O ATOM 625 CB GLN A 42 -30.301 19.921 -25.409 1.00 0.00 C ATOM 626 CG GLN A 42 -30.186 19.968 -23.871 1.00 0.00 C ATOM 627 CD GLN A 42 -28.753 20.261 -23.426 1.00 0.00 C ATOM 628 OE1 GLN A 42 -27.788 19.674 -23.898 1.00 0.00 O ATOM 629 NE2 GLN A 42 -28.546 21.193 -22.523 1.00 0.00 N ATOM 0 H GLN A 42 -32.947 20.296 -24.379 1.00 0.00 H new ATOM 0 HA GLN A 42 -31.682 20.167 -27.025 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -29.733 19.063 -25.768 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -29.822 20.812 -25.815 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -30.854 20.734 -23.478 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -30.511 19.016 -23.451 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -29.336 21.694 -22.117 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -27.595 21.415 -22.228 1.00 0.00 H new ATOM 638 N PHE A 43 -31.688 17.567 -26.926 1.00 0.00 N ATOM 639 CA PHE A 43 -32.266 16.295 -27.374 1.00 0.00 C ATOM 640 C PHE A 43 -31.241 15.149 -27.385 1.00 0.00 C ATOM 641 O PHE A 43 -30.104 15.311 -27.844 1.00 0.00 O ATOM 642 CB PHE A 43 -32.867 16.530 -28.764 1.00 0.00 C ATOM 643 CG PHE A 43 -33.512 15.328 -29.428 1.00 0.00 C ATOM 644 CD1 PHE A 43 -34.659 14.743 -28.861 1.00 0.00 C ATOM 645 CD2 PHE A 43 -33.006 14.831 -30.645 1.00 0.00 C ATOM 646 CE1 PHE A 43 -35.321 13.696 -29.523 1.00 0.00 C ATOM 647 CE2 PHE A 43 -33.662 13.775 -31.301 1.00 0.00 C ATOM 648 CZ PHE A 43 -34.824 13.213 -30.746 1.00 0.00 C ATOM 0 H PHE A 43 -30.788 17.773 -27.360 1.00 0.00 H new ATOM 0 HA PHE A 43 -33.037 15.978 -26.672 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -33.614 17.319 -28.685 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -32.079 16.901 -29.419 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -35.032 15.101 -27.913 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -32.113 15.262 -31.074 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -36.211 13.262 -29.093 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -33.272 13.395 -32.234 1.00 0.00 H new ATOM 0 HZ PHE A 43 -35.335 12.411 -31.258 1.00 0.00 H new ATOM 658 N PHE A 44 -31.667 13.976 -26.908 1.00 0.00 N ATOM 659 CA PHE A 44 -30.860 12.750 -26.767 1.00 0.00 C ATOM 660 C PHE A 44 -31.635 11.526 -27.273 1.00 0.00 C ATOM 661 O PHE A 44 -32.862 11.489 -27.168 1.00 0.00 O ATOM 662 CB PHE A 44 -30.471 12.558 -25.290 1.00 0.00 C ATOM 663 CG PHE A 44 -29.931 13.809 -24.623 1.00 0.00 C ATOM 664 CD1 PHE A 44 -30.827 14.747 -24.074 1.00 0.00 C ATOM 665 CD2 PHE A 44 -28.550 14.084 -24.635 1.00 0.00 C ATOM 666 CE1 PHE A 44 -30.350 15.970 -23.582 1.00 0.00 C ATOM 667 CE2 PHE A 44 -28.073 15.298 -24.110 1.00 0.00 C ATOM 668 CZ PHE A 44 -28.977 16.241 -23.592 1.00 0.00 C ATOM 0 H PHE A 44 -32.628 13.844 -26.594 1.00 0.00 H new ATOM 0 HA PHE A 44 -29.958 12.853 -27.370 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -31.345 12.213 -24.737 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -29.720 11.771 -25.223 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -31.883 14.524 -24.032 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -27.859 13.364 -25.047 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -31.042 16.703 -23.195 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -27.013 15.506 -24.105 1.00 0.00 H new ATOM 0 HZ PHE A 44 -28.611 17.178 -23.200 1.00 0.00 H new ATOM 678 N GLU A 45 -30.938 10.502 -27.775 1.00 0.00 N ATOM 679 CA GLU A 45 -31.544 9.314 -28.406 1.00 0.00 C ATOM 680 C GLU A 45 -30.911 8.026 -27.852 1.00 0.00 C ATOM 681 O GLU A 45 -29.736 7.733 -28.088 1.00 0.00 O ATOM 682 CB GLU A 45 -31.439 9.396 -29.941 1.00 0.00 C ATOM 683 CG GLU A 45 -32.053 10.687 -30.510 1.00 0.00 C ATOM 684 CD GLU A 45 -32.616 10.468 -31.928 1.00 0.00 C ATOM 685 OE1 GLU A 45 -31.862 10.638 -32.920 1.00 0.00 O ATOM 686 OE2 GLU A 45 -33.820 10.136 -32.047 1.00 0.00 O ATOM 0 H GLU A 45 -29.919 10.470 -27.756 1.00 0.00 H new ATOM 0 HA GLU A 45 -32.605 9.289 -28.158 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.390 9.338 -30.233 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -31.941 8.535 -30.382 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -32.849 11.034 -29.851 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -31.296 11.471 -30.535 1.00 0.00 H new ATOM 693 N GLY A 46 -31.696 7.271 -27.080 1.00 0.00 N ATOM 694 CA GLY A 46 -31.280 6.091 -26.325 1.00 0.00 C ATOM 695 C GLY A 46 -31.754 4.796 -26.980 1.00 0.00 C ATOM 696 O GLY A 46 -32.947 4.504 -26.966 1.00 0.00 O ATOM 0 H GLY A 46 -32.688 7.478 -26.960 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -30.193 6.078 -26.242 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -31.677 6.151 -25.311 1.00 0.00 H new ATOM 700 N SER A 47 -30.841 4.015 -27.558 1.00 0.00 N ATOM 701 CA SER A 47 -31.181 2.832 -28.368 1.00 0.00 C ATOM 702 C SER A 47 -30.849 1.515 -27.656 1.00 0.00 C ATOM 703 O SER A 47 -29.680 1.161 -27.492 1.00 0.00 O ATOM 704 CB SER A 47 -30.455 2.898 -29.707 1.00 0.00 C ATOM 705 OG SER A 47 -30.923 3.984 -30.489 1.00 0.00 O ATOM 0 H SER A 47 -29.838 4.181 -27.480 1.00 0.00 H new ATOM 0 HA SER A 47 -32.259 2.847 -28.526 1.00 0.00 H new ATOM 0 HB2 SER A 47 -29.383 3.003 -29.538 1.00 0.00 H new ATOM 0 HB3 SER A 47 -30.602 1.965 -30.250 1.00 0.00 H new ATOM 0 HG SER A 47 -31.216 3.654 -31.364 1.00 0.00 H new ATOM 711 N GLY A 48 -31.886 0.835 -27.159 1.00 0.00 N ATOM 712 CA GLY A 48 -31.803 -0.365 -26.319 1.00 0.00 C ATOM 713 C GLY A 48 -32.838 -1.451 -26.644 1.00 0.00 C ATOM 714 O GLY A 48 -33.993 -1.113 -26.869 1.00 0.00 O ATOM 0 H GLY A 48 -32.849 1.118 -27.339 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -30.805 -0.792 -26.418 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -31.921 -0.070 -25.276 1.00 0.00 H new ATOM 718 N ARG A 49 -32.457 -2.738 -26.692 1.00 0.00 N ATOM 719 CA ARG A 49 -33.340 -3.933 -26.844 1.00 0.00 C ATOM 720 C ARG A 49 -34.851 -3.710 -26.635 1.00 0.00 C ATOM 721 O ARG A 49 -35.623 -3.920 -27.568 1.00 0.00 O ATOM 722 CB ARG A 49 -32.859 -5.059 -25.904 1.00 0.00 C ATOM 723 CG ARG A 49 -31.617 -5.806 -26.419 1.00 0.00 C ATOM 724 CD ARG A 49 -32.005 -6.899 -27.425 1.00 0.00 C ATOM 725 NE ARG A 49 -30.817 -7.611 -27.932 1.00 0.00 N ATOM 726 CZ ARG A 49 -30.199 -7.434 -29.090 1.00 0.00 C ATOM 727 NH1 ARG A 49 -30.588 -6.585 -29.991 1.00 0.00 N ATOM 728 NH2 ARG A 49 -29.148 -8.140 -29.380 1.00 0.00 N ATOM 0 H ARG A 49 -31.474 -3.000 -26.623 1.00 0.00 H new ATOM 0 HA ARG A 49 -33.244 -4.201 -27.896 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -32.636 -4.633 -24.926 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -33.670 -5.774 -25.763 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -30.934 -5.100 -26.891 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -31.084 -6.253 -25.580 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -32.681 -7.609 -26.950 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -32.547 -6.452 -28.259 1.00 0.00 H new ATOM 0 HE ARG A 49 -30.425 -8.325 -27.318 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -31.413 -6.008 -29.826 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -30.069 -6.495 -30.864 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -28.799 -8.831 -28.716 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -28.672 -8.004 -30.272 1.00 0.00 H new ATOM 742 N ASN A 50 -35.248 -3.235 -25.448 1.00 0.00 N ATOM 743 CA ASN A 50 -36.598 -2.745 -25.117 1.00 0.00 C ATOM 744 C ASN A 50 -36.497 -1.443 -24.284 1.00 0.00 C ATOM 745 O ASN A 50 -35.386 -1.056 -23.918 1.00 0.00 O ATOM 746 CB ASN A 50 -37.402 -3.836 -24.371 1.00 0.00 C ATOM 747 CG ASN A 50 -37.211 -5.251 -24.897 1.00 0.00 C ATOM 748 OD1 ASN A 50 -36.538 -6.068 -24.279 1.00 0.00 O ATOM 749 ND2 ASN A 50 -37.774 -5.585 -26.034 1.00 0.00 N ATOM 0 H ASN A 50 -34.610 -3.178 -24.654 1.00 0.00 H new ATOM 0 HA ASN A 50 -37.133 -2.517 -26.039 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -37.122 -3.816 -23.318 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -38.461 -3.585 -24.424 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -37.652 -6.527 -26.406 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -38.333 -4.903 -26.546 1.00 0.00 H new ATOM 756 N LYS A 51 -37.617 -0.788 -23.918 1.00 0.00 N ATOM 757 CA LYS A 51 -37.627 0.486 -23.142 1.00 0.00 C ATOM 758 C LYS A 51 -36.705 0.482 -21.926 1.00 0.00 C ATOM 759 O LYS A 51 -35.914 1.403 -21.798 1.00 0.00 O ATOM 760 CB LYS A 51 -39.039 0.915 -22.717 1.00 0.00 C ATOM 761 CG LYS A 51 -39.821 1.494 -23.907 1.00 0.00 C ATOM 762 CD LYS A 51 -41.254 1.889 -23.514 1.00 0.00 C ATOM 763 CE LYS A 51 -41.965 2.705 -24.606 1.00 0.00 C ATOM 764 NZ LYS A 51 -42.145 1.941 -25.868 1.00 0.00 N ATOM 0 H LYS A 51 -38.552 -1.124 -24.150 1.00 0.00 H new ATOM 0 HA LYS A 51 -37.235 1.220 -23.846 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -39.575 0.059 -22.307 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -38.973 1.660 -21.924 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -39.297 2.368 -24.295 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -39.855 0.759 -24.711 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -41.831 0.988 -23.306 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -41.227 2.470 -22.592 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -42.940 3.025 -24.238 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -41.390 3.608 -24.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -41.700 2.458 -26.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -41.701 1.005 -25.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -43.160 1.824 -26.061 1.00 0.00 H new ATOM 778 N LYS A 52 -36.711 -0.569 -21.105 1.00 0.00 N ATOM 779 CA LYS A 52 -35.801 -0.766 -19.950 1.00 0.00 C ATOM 780 C LYS A 52 -34.308 -0.566 -20.236 1.00 0.00 C ATOM 781 O LYS A 52 -33.557 -0.259 -19.313 1.00 0.00 O ATOM 782 CB LYS A 52 -36.067 -2.142 -19.311 1.00 0.00 C ATOM 783 CG LYS A 52 -35.932 -3.336 -20.275 1.00 0.00 C ATOM 784 CD LYS A 52 -34.535 -3.964 -20.420 1.00 0.00 C ATOM 785 CE LYS A 52 -34.457 -4.818 -21.700 1.00 0.00 C ATOM 786 NZ LYS A 52 -35.322 -6.028 -21.639 1.00 0.00 N ATOM 0 H LYS A 52 -37.369 -1.340 -21.221 1.00 0.00 H new ATOM 0 HA LYS A 52 -36.040 0.035 -19.250 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -35.374 -2.282 -18.481 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -37.073 -2.144 -18.890 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -36.621 -4.115 -19.948 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -36.262 -3.013 -21.262 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -33.779 -3.180 -20.453 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -34.316 -4.582 -19.549 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -34.750 -4.210 -22.556 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -33.424 -5.123 -21.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -35.854 -6.120 -22.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -34.730 -6.872 -21.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -35.988 -5.939 -20.845 1.00 0.00 H new ATOM 800 N LEU A 53 -33.886 -0.711 -21.496 1.00 0.00 N ATOM 801 CA LEU A 53 -32.522 -0.467 -21.962 1.00 0.00 C ATOM 802 C LEU A 53 -32.443 0.812 -22.818 1.00 0.00 C ATOM 803 O LEU A 53 -31.514 1.599 -22.663 1.00 0.00 O ATOM 804 CB LEU A 53 -32.030 -1.733 -22.699 1.00 0.00 C ATOM 805 CG LEU A 53 -30.566 -1.712 -23.182 1.00 0.00 C ATOM 806 CD1 LEU A 53 -29.581 -1.307 -22.089 1.00 0.00 C ATOM 807 CD2 LEU A 53 -30.164 -3.097 -23.685 1.00 0.00 C ATOM 0 H LEU A 53 -34.509 -1.013 -22.245 1.00 0.00 H new ATOM 0 HA LEU A 53 -31.856 -0.282 -21.119 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -32.160 -2.588 -22.036 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -32.674 -1.899 -23.563 1.00 0.00 H new ATOM 0 HG LEU A 53 -30.520 -0.968 -23.977 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -28.568 -1.311 -22.492 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -29.825 -0.307 -21.732 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -29.645 -2.013 -21.261 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -29.128 -3.074 -24.025 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -30.265 -3.821 -22.877 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -30.811 -3.385 -24.513 1.00 0.00 H new ATOM 819 N ALA A 54 -33.430 1.064 -23.683 1.00 0.00 N ATOM 820 CA ALA A 54 -33.559 2.297 -24.466 1.00 0.00 C ATOM 821 C ALA A 54 -33.566 3.558 -23.585 1.00 0.00 C ATOM 822 O ALA A 54 -32.699 4.422 -23.708 1.00 0.00 O ATOM 823 CB ALA A 54 -34.817 2.176 -25.329 1.00 0.00 C ATOM 0 H ALA A 54 -34.182 0.398 -23.863 1.00 0.00 H new ATOM 0 HA ALA A 54 -32.686 2.415 -25.108 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -34.939 3.081 -25.924 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -34.722 1.316 -25.992 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -35.688 2.044 -24.687 1.00 0.00 H new ATOM 829 N LYS A 55 -34.503 3.626 -22.630 1.00 0.00 N ATOM 830 CA LYS A 55 -34.496 4.582 -21.518 1.00 0.00 C ATOM 831 C LYS A 55 -33.220 4.536 -20.696 1.00 0.00 C ATOM 832 O LYS A 55 -32.862 5.593 -20.221 1.00 0.00 O ATOM 833 CB LYS A 55 -35.689 4.380 -20.580 1.00 0.00 C ATOM 834 CG LYS A 55 -36.983 4.989 -21.061 1.00 0.00 C ATOM 835 CD LYS A 55 -37.371 6.287 -20.345 1.00 0.00 C ATOM 836 CE LYS A 55 -38.884 6.148 -20.249 1.00 0.00 C ATOM 837 NZ LYS A 55 -39.587 7.250 -19.548 1.00 0.00 N ATOM 0 H LYS A 55 -35.308 3.000 -22.610 1.00 0.00 H new ATOM 0 HA LYS A 55 -34.564 5.560 -21.994 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -35.840 3.311 -20.432 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -35.444 4.805 -19.607 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -36.903 5.187 -22.130 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -37.784 4.262 -20.930 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -36.905 6.368 -19.363 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -37.076 7.170 -20.911 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -39.288 6.068 -21.258 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -39.113 5.213 -19.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -40.611 7.168 -19.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -39.393 7.192 -18.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -39.250 8.164 -19.913 1.00 0.00 H new ATOM 851 N ALA A 56 -32.557 3.395 -20.458 1.00 0.00 N ATOM 852 CA ALA A 56 -31.294 3.395 -19.710 1.00 0.00 C ATOM 853 C ALA A 56 -30.273 4.336 -20.359 1.00 0.00 C ATOM 854 O ALA A 56 -29.824 5.279 -19.726 1.00 0.00 O ATOM 855 CB ALA A 56 -30.749 1.977 -19.502 1.00 0.00 C ATOM 0 H ALA A 56 -32.869 2.474 -20.767 1.00 0.00 H new ATOM 0 HA ALA A 56 -31.496 3.784 -18.712 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -29.814 2.025 -18.944 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -31.475 1.387 -18.943 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -30.570 1.510 -20.471 1.00 0.00 H new ATOM 861 N ARG A 57 -30.000 4.136 -21.653 1.00 0.00 N ATOM 862 CA ARG A 57 -29.235 5.014 -22.547 1.00 0.00 C ATOM 863 C ARG A 57 -29.764 6.457 -22.612 1.00 0.00 C ATOM 864 O ARG A 57 -28.987 7.392 -22.421 1.00 0.00 O ATOM 865 CB ARG A 57 -29.212 4.372 -23.948 1.00 0.00 C ATOM 866 CG ARG A 57 -28.599 2.963 -24.047 1.00 0.00 C ATOM 867 CD ARG A 57 -27.198 2.844 -23.438 1.00 0.00 C ATOM 868 NE ARG A 57 -27.216 2.383 -22.033 1.00 0.00 N ATOM 869 CZ ARG A 57 -26.870 1.195 -21.572 1.00 0.00 C ATOM 870 NH1 ARG A 57 -26.473 0.223 -22.344 1.00 0.00 N ATOM 871 NH2 ARG A 57 -26.915 0.972 -20.293 1.00 0.00 N ATOM 0 H ARG A 57 -30.330 3.300 -22.136 1.00 0.00 H new ATOM 0 HA ARG A 57 -28.227 5.105 -22.141 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -30.236 4.326 -24.319 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -28.660 5.032 -24.617 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -29.261 2.255 -23.549 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -28.553 2.672 -25.096 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -26.606 2.150 -24.035 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -26.702 3.813 -23.490 1.00 0.00 H new ATOM 0 HE ARG A 57 -27.532 3.061 -21.340 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -26.419 0.363 -23.353 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -26.216 -0.677 -21.939 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -27.215 1.711 -19.657 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -26.650 0.058 -19.925 1.00 0.00 H new ATOM 885 N ALA A 58 -31.056 6.645 -22.900 1.00 0.00 N ATOM 886 CA ALA A 58 -31.708 7.963 -22.957 1.00 0.00 C ATOM 887 C ALA A 58 -31.529 8.749 -21.650 1.00 0.00 C ATOM 888 O ALA A 58 -30.952 9.842 -21.640 1.00 0.00 O ATOM 889 CB ALA A 58 -33.193 7.796 -23.313 1.00 0.00 C ATOM 0 H ALA A 58 -31.692 5.874 -23.104 1.00 0.00 H new ATOM 0 HA ALA A 58 -31.224 8.548 -23.739 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -33.670 8.775 -23.354 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -33.282 7.309 -24.284 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -33.683 7.185 -22.554 1.00 0.00 H new ATOM 895 N ALA A 59 -31.964 8.136 -20.543 1.00 0.00 N ATOM 896 CA ALA A 59 -31.649 8.569 -19.186 1.00 0.00 C ATOM 897 C ALA A 59 -30.170 8.890 -18.985 1.00 0.00 C ATOM 898 O ALA A 59 -29.866 10.021 -18.658 1.00 0.00 O ATOM 899 CB ALA A 59 -32.093 7.512 -18.166 1.00 0.00 C ATOM 0 H ALA A 59 -32.558 7.307 -20.572 1.00 0.00 H new ATOM 0 HA ALA A 59 -32.202 9.494 -19.026 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -31.850 7.853 -17.160 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -33.169 7.358 -18.247 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -31.576 6.573 -18.366 1.00 0.00 H new ATOM 905 N GLN A 60 -29.254 7.944 -19.185 1.00 0.00 N ATOM 906 CA GLN A 60 -27.808 8.105 -18.982 1.00 0.00 C ATOM 907 C GLN A 60 -27.239 9.352 -19.684 1.00 0.00 C ATOM 908 O GLN A 60 -26.541 10.155 -19.057 1.00 0.00 O ATOM 909 CB GLN A 60 -27.129 6.805 -19.459 1.00 0.00 C ATOM 910 CG GLN A 60 -27.051 5.760 -18.337 1.00 0.00 C ATOM 911 CD GLN A 60 -26.507 4.436 -18.861 1.00 0.00 C ATOM 912 OE1 GLN A 60 -27.232 3.577 -19.348 1.00 0.00 O ATOM 913 NE2 GLN A 60 -25.210 4.221 -18.811 1.00 0.00 N ATOM 0 H GLN A 60 -29.504 7.008 -19.505 1.00 0.00 H new ATOM 0 HA GLN A 60 -27.604 8.272 -17.924 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -27.684 6.393 -20.302 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -26.124 7.030 -19.818 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -26.411 6.129 -17.536 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -28.041 5.606 -17.909 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -24.591 4.925 -18.409 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -24.823 3.350 -19.174 1.00 0.00 H new ATOM 922 N SER A 61 -27.581 9.534 -20.964 1.00 0.00 N ATOM 923 CA SER A 61 -27.260 10.730 -21.759 1.00 0.00 C ATOM 924 C SER A 61 -27.755 12.025 -21.098 1.00 0.00 C ATOM 925 O SER A 61 -26.961 12.925 -20.775 1.00 0.00 O ATOM 926 CB SER A 61 -27.831 10.607 -23.182 1.00 0.00 C ATOM 927 OG SER A 61 -27.401 9.413 -23.818 1.00 0.00 O ATOM 0 H SER A 61 -28.103 8.835 -21.493 1.00 0.00 H new ATOM 0 HA SER A 61 -26.173 10.789 -21.813 1.00 0.00 H new ATOM 0 HB2 SER A 61 -28.920 10.625 -23.140 1.00 0.00 H new ATOM 0 HB3 SER A 61 -27.520 11.467 -23.775 1.00 0.00 H new ATOM 0 HG SER A 61 -27.905 8.652 -23.460 1.00 0.00 H new ATOM 933 N ALA A 62 -29.073 12.099 -20.875 1.00 0.00 N ATOM 934 CA ALA A 62 -29.728 13.218 -20.209 1.00 0.00 C ATOM 935 C ALA A 62 -29.122 13.499 -18.826 1.00 0.00 C ATOM 936 O ALA A 62 -28.609 14.594 -18.638 1.00 0.00 O ATOM 937 CB ALA A 62 -31.236 12.956 -20.168 1.00 0.00 C ATOM 0 H ALA A 62 -29.722 11.365 -21.160 1.00 0.00 H new ATOM 0 HA ALA A 62 -29.558 14.132 -20.778 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -31.736 13.787 -19.672 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -31.616 12.859 -21.185 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -31.430 12.035 -19.618 1.00 0.00 H new ATOM 943 N LEU A 63 -29.101 12.519 -17.917 1.00 0.00 N ATOM 944 CA LEU A 63 -28.493 12.531 -16.578 1.00 0.00 C ATOM 945 C LEU A 63 -27.126 13.202 -16.602 1.00 0.00 C ATOM 946 O LEU A 63 -26.975 14.265 -16.007 1.00 0.00 O ATOM 947 CB LEU A 63 -28.346 11.090 -16.026 1.00 0.00 C ATOM 948 CG LEU A 63 -29.488 10.531 -15.157 1.00 0.00 C ATOM 949 CD1 LEU A 63 -30.865 11.117 -15.430 1.00 0.00 C ATOM 950 CD2 LEU A 63 -29.577 9.013 -15.306 1.00 0.00 C ATOM 0 H LEU A 63 -29.545 11.622 -18.113 1.00 0.00 H new ATOM 0 HA LEU A 63 -29.155 13.100 -15.926 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -28.212 10.419 -16.874 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -27.428 11.049 -15.439 1.00 0.00 H new ATOM 0 HG LEU A 63 -29.220 10.827 -14.143 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -31.595 10.655 -14.765 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -30.844 12.193 -15.255 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -31.144 10.923 -16.466 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -30.389 8.633 -14.686 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -29.769 8.760 -16.349 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -28.637 8.561 -14.990 1.00 0.00 H new ATOM 962 N ALA A 64 -26.151 12.623 -17.314 1.00 0.00 N ATOM 963 CA ALA A 64 -24.802 13.177 -17.365 1.00 0.00 C ATOM 964 C ALA A 64 -24.825 14.652 -17.807 1.00 0.00 C ATOM 965 O ALA A 64 -24.278 15.519 -17.114 1.00 0.00 O ATOM 966 CB ALA A 64 -23.944 12.300 -18.285 1.00 0.00 C ATOM 0 H ALA A 64 -26.276 11.771 -17.861 1.00 0.00 H new ATOM 0 HA ALA A 64 -24.358 13.170 -16.370 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -22.932 12.703 -18.332 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -23.912 11.284 -17.893 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -24.377 12.289 -19.285 1.00 0.00 H new ATOM 972 N THR A 65 -25.511 14.940 -18.920 1.00 0.00 N ATOM 973 CA THR A 65 -25.709 16.312 -19.412 1.00 0.00 C ATOM 974 C THR A 65 -26.348 17.262 -18.385 1.00 0.00 C ATOM 975 O THR A 65 -25.687 18.167 -17.873 1.00 0.00 O ATOM 976 CB THR A 65 -26.481 16.322 -20.741 1.00 0.00 C ATOM 977 OG1 THR A 65 -25.832 15.493 -21.683 1.00 0.00 O ATOM 978 CG2 THR A 65 -26.543 17.737 -21.315 1.00 0.00 C ATOM 0 H THR A 65 -25.946 14.228 -19.507 1.00 0.00 H new ATOM 0 HA THR A 65 -24.708 16.706 -19.588 1.00 0.00 H new ATOM 0 HB THR A 65 -27.490 15.958 -20.546 1.00 0.00 H new ATOM 0 HG1 THR A 65 -26.093 14.560 -21.532 1.00 0.00 H new ATOM 0 HG21 THR A 65 -27.093 17.724 -22.256 1.00 0.00 H new ATOM 0 HG22 THR A 65 -27.048 18.395 -20.608 1.00 0.00 H new ATOM 0 HG23 THR A 65 -25.531 18.103 -21.491 1.00 0.00 H new ATOM 986 N VAL A 66 -27.647 17.116 -18.112 1.00 0.00 N ATOM 987 CA VAL A 66 -28.419 17.993 -17.220 1.00 0.00 C ATOM 988 C VAL A 66 -27.831 18.117 -15.815 1.00 0.00 C ATOM 989 O VAL A 66 -27.778 19.219 -15.281 1.00 0.00 O ATOM 990 CB VAL A 66 -29.933 17.705 -17.236 1.00 0.00 C ATOM 991 CG1 VAL A 66 -30.455 17.715 -18.679 1.00 0.00 C ATOM 992 CG2 VAL A 66 -30.351 16.399 -16.559 1.00 0.00 C ATOM 0 H VAL A 66 -28.208 16.365 -18.515 1.00 0.00 H new ATOM 0 HA VAL A 66 -28.316 18.990 -17.649 1.00 0.00 H new ATOM 0 HB VAL A 66 -30.380 18.505 -16.646 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -31.526 17.511 -18.680 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -30.272 18.692 -19.125 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -29.939 16.949 -19.258 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -31.433 16.287 -16.622 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -29.869 15.559 -17.060 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -30.049 16.419 -15.512 1.00 0.00 H new ATOM 1002 N PHE A 67 -27.359 17.030 -15.198 1.00 0.00 N ATOM 1003 CA PHE A 67 -26.585 17.091 -13.949 1.00 0.00 C ATOM 1004 C PHE A 67 -25.328 17.970 -14.052 1.00 0.00 C ATOM 1005 O PHE A 67 -25.091 18.798 -13.172 1.00 0.00 O ATOM 1006 CB PHE A 67 -26.291 15.698 -13.385 1.00 0.00 C ATOM 1007 CG PHE A 67 -27.499 14.808 -13.099 1.00 0.00 C ATOM 1008 CD1 PHE A 67 -28.829 15.261 -13.262 1.00 0.00 C ATOM 1009 CD2 PHE A 67 -27.279 13.481 -12.682 1.00 0.00 C ATOM 1010 CE1 PHE A 67 -29.910 14.392 -13.059 1.00 0.00 C ATOM 1011 CE2 PHE A 67 -28.365 12.617 -12.448 1.00 0.00 C ATOM 1012 CZ PHE A 67 -29.681 13.068 -12.657 1.00 0.00 C ATOM 0 H PHE A 67 -27.501 16.082 -15.548 1.00 0.00 H new ATOM 0 HA PHE A 67 -27.225 17.593 -13.224 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -25.642 15.176 -14.088 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -25.728 15.817 -12.459 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -29.013 16.287 -13.546 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -26.270 13.124 -12.541 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -30.920 14.742 -13.212 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -28.188 11.607 -12.108 1.00 0.00 H new ATOM 0 HZ PHE A 67 -30.513 12.396 -12.508 1.00 0.00 H new ATOM 1022 N ASN A 68 -24.518 17.815 -15.114 1.00 0.00 N ATOM 1023 CA ASN A 68 -23.427 18.754 -15.421 1.00 0.00 C ATOM 1024 C ASN A 68 -23.887 20.225 -15.552 1.00 0.00 C ATOM 1025 O ASN A 68 -23.143 21.120 -15.146 1.00 0.00 O ATOM 1026 CB ASN A 68 -22.629 18.254 -16.639 1.00 0.00 C ATOM 1027 CG ASN A 68 -21.421 19.124 -16.944 1.00 0.00 C ATOM 1028 OD1 ASN A 68 -20.372 19.012 -16.325 1.00 0.00 O ATOM 1029 ND2 ASN A 68 -21.523 20.014 -17.909 1.00 0.00 N ATOM 0 H ASN A 68 -24.600 17.044 -15.777 1.00 0.00 H new ATOM 0 HA ASN A 68 -22.757 18.769 -14.562 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -22.299 17.231 -16.457 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -23.283 18.228 -17.511 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -20.728 20.609 -18.140 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -22.397 20.108 -18.426 1.00 0.00 H new ATOM 1036 N LEU A 69 -25.103 20.490 -16.060 1.00 0.00 N ATOM 1037 CA LEU A 69 -25.719 21.832 -15.970 1.00 0.00 C ATOM 1038 C LEU A 69 -25.966 22.222 -14.499 1.00 0.00 C ATOM 1039 O LEU A 69 -25.408 23.213 -14.025 1.00 0.00 O ATOM 1040 CB LEU A 69 -27.034 21.948 -16.775 1.00 0.00 C ATOM 1041 CG LEU A 69 -27.025 21.359 -18.191 1.00 0.00 C ATOM 1042 CD1 LEU A 69 -28.412 21.498 -18.818 1.00 0.00 C ATOM 1043 CD2 LEU A 69 -26.013 22.055 -19.104 1.00 0.00 C ATOM 0 H LEU A 69 -25.680 19.797 -16.537 1.00 0.00 H new ATOM 0 HA LEU A 69 -25.007 22.526 -16.417 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -27.826 21.459 -16.207 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -27.298 23.003 -16.846 1.00 0.00 H new ATOM 0 HG LEU A 69 -26.741 20.311 -18.097 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -28.400 21.078 -19.824 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -29.141 20.963 -18.210 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -28.685 22.552 -18.868 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -26.045 21.602 -20.095 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -26.260 23.114 -19.181 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -25.012 21.946 -18.687 1.00 0.00 H new ATOM 1055 N HIS A 70 -26.760 21.416 -13.777 1.00 0.00 N ATOM 1056 CA HIS A 70 -26.877 21.417 -12.310 1.00 0.00 C ATOM 1057 C HIS A 70 -27.665 20.214 -11.744 1.00 0.00 C ATOM 1058 O HIS A 70 -27.272 19.649 -10.717 1.00 0.00 O ATOM 1059 CB HIS A 70 -27.537 22.726 -11.817 1.00 0.00 C ATOM 1060 CG HIS A 70 -26.787 23.351 -10.667 1.00 0.00 C ATOM 1061 ND1 HIS A 70 -27.296 23.670 -9.428 1.00 0.00 N ATOM 1062 CD2 HIS A 70 -25.462 23.701 -10.664 1.00 0.00 C ATOM 1063 CE1 HIS A 70 -26.303 24.200 -8.692 1.00 0.00 C ATOM 1064 NE2 HIS A 70 -25.160 24.239 -9.404 1.00 0.00 N ATOM 0 H HIS A 70 -27.361 20.719 -14.216 1.00 0.00 H new ATOM 0 HA HIS A 70 -25.855 21.337 -11.938 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -27.589 23.436 -12.642 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -28.562 22.519 -11.509 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -24.772 23.583 -11.486 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -26.407 24.546 -7.674 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -24.255 24.590 -9.090 1.00 0.00 H new ATOM 1072 N LEU A 71 -28.783 19.844 -12.389 1.00 0.00 N ATOM 1073 CA LEU A 71 -29.760 18.814 -11.979 1.00 0.00 C ATOM 1074 C LEU A 71 -30.767 18.517 -13.114 1.00 0.00 C ATOM 1075 O LEU A 71 -31.409 17.449 -13.063 1.00 0.00 O ATOM 1076 CB LEU A 71 -30.506 19.275 -10.694 1.00 0.00 C ATOM 1077 CG LEU A 71 -30.383 18.317 -9.495 1.00 0.00 C ATOM 1078 CD1 LEU A 71 -31.089 18.939 -8.290 1.00 0.00 C ATOM 1079 CD2 LEU A 71 -31.015 16.949 -9.753 1.00 0.00 C ATOM 1080 OXT LEU A 71 -30.927 19.375 -14.014 1.00 0.00 O ATOM 0 H LEU A 71 -29.049 20.284 -13.270 1.00 0.00 H new ATOM 0 HA LEU A 71 -29.219 17.892 -11.765 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -30.124 20.253 -10.400 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -31.562 19.404 -10.931 1.00 0.00 H new ATOM 0 HG LEU A 71 -29.318 18.167 -9.317 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -31.008 18.268 -7.435 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -30.622 19.894 -8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -32.141 19.099 -8.527 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -30.895 16.321 -8.871 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -32.076 17.073 -9.968 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -30.525 16.477 -10.604 1.00 0.00 H new TER 1092 LEU A 71