USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=16 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 23 SER OG : rot -102:sc= 1.2 USER MOD Set 1.2: A 31 LYS NZ :NH3+ -179:sc= 1.11 (180deg=1.04) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= 0.292 K(o=0.29,f=-6.1!) USER MOD Single : A 8 MET CE :methyl 165:sc= -0.119 (180deg=-0.826) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 LYS NZ :NH3+ -177:sc= 1.1 (180deg=1.05) USER MOD Single : A 19 TYR OH : rot 120:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0123 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 SER OG : rot 68:sc= 1.04 USER MOD Single : A 35 MET CE :methyl 162:sc= -0.752 (180deg=-0.993) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.815 K(o=0.82,f=-0.68) USER MOD Single : A 47 SER OG : rot 180:sc= -0.0387 USER MOD Single : A 50 ASN : amide:sc= 0.776 K(o=0.78,f=-6!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00549) USER MOD Single : A 55 LYS NZ :NH3+ -148:sc= 0.904 (180deg=0.263) USER MOD Single : A 60 GLN : amide:sc= 1.28 K(o=1.3,f=-6!) USER MOD Single : A 61 SER OG : rot -90:sc= 0.327 USER MOD Single : A 65 THR OG1 : rot 79:sc= 1.01 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -27.324 5.463 -3.015 1.00 0.00 N ATOM 2 CA PRO A 1 -27.884 5.263 -4.374 1.00 0.00 C ATOM 3 C PRO A 1 -29.061 6.208 -4.681 1.00 0.00 C ATOM 4 O PRO A 1 -29.732 6.679 -3.761 1.00 0.00 O ATOM 5 CB PRO A 1 -28.255 3.772 -4.491 1.00 0.00 C ATOM 6 CG PRO A 1 -27.596 3.094 -3.279 1.00 0.00 C ATOM 7 CD PRO A 1 -26.671 4.172 -2.721 1.00 0.00 C ATOM 0 H2 PRO A 1 -28.054 5.679 -2.336 1.00 0.00 H new ATOM 0 H3 PRO A 1 -26.658 6.235 -2.993 1.00 0.00 H new ATOM 0 HA PRO A 1 -27.143 5.522 -5.131 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -29.336 3.634 -4.479 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -27.889 3.348 -5.426 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -28.337 2.782 -2.543 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -27.041 2.202 -3.571 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -26.526 4.044 -1.648 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -25.686 4.119 -3.185 1.00 0.00 H new ATOM 15 N SER A 2 -29.321 6.473 -5.967 1.00 0.00 N ATOM 16 CA SER A 2 -30.323 7.452 -6.449 1.00 0.00 C ATOM 17 C SER A 2 -31.506 6.828 -7.210 1.00 0.00 C ATOM 18 O SER A 2 -32.479 7.519 -7.522 1.00 0.00 O ATOM 19 CB SER A 2 -29.619 8.500 -7.321 1.00 0.00 C ATOM 20 OG SER A 2 -28.888 7.872 -8.362 1.00 0.00 O ATOM 0 H SER A 2 -28.831 6.003 -6.728 1.00 0.00 H new ATOM 0 HA SER A 2 -30.763 7.912 -5.564 1.00 0.00 H new ATOM 0 HB2 SER A 2 -30.356 9.182 -7.746 1.00 0.00 H new ATOM 0 HB3 SER A 2 -28.947 9.100 -6.707 1.00 0.00 H new ATOM 0 HG SER A 2 -28.447 8.554 -8.910 1.00 0.00 H new ATOM 26 N GLY A 3 -31.462 5.518 -7.473 1.00 0.00 N ATOM 27 CA GLY A 3 -32.543 4.736 -8.082 1.00 0.00 C ATOM 28 C GLY A 3 -32.180 3.257 -8.263 1.00 0.00 C ATOM 29 O GLY A 3 -31.018 2.869 -8.108 1.00 0.00 O ATOM 0 H GLY A 3 -30.641 4.952 -7.259 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -33.435 4.813 -7.460 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -32.793 5.165 -9.052 1.00 0.00 H new ATOM 33 N LYS A 4 -33.173 2.422 -8.603 1.00 0.00 N ATOM 34 CA LYS A 4 -32.986 0.974 -8.862 1.00 0.00 C ATOM 35 C LYS A 4 -32.281 0.694 -10.203 1.00 0.00 C ATOM 36 O LYS A 4 -31.674 -0.362 -10.381 1.00 0.00 O ATOM 37 CB LYS A 4 -34.341 0.234 -8.808 1.00 0.00 C ATOM 38 CG LYS A 4 -34.952 0.089 -7.398 1.00 0.00 C ATOM 39 CD LYS A 4 -35.669 1.345 -6.881 1.00 0.00 C ATOM 40 CE LYS A 4 -36.392 1.060 -5.561 1.00 0.00 C ATOM 41 NZ LYS A 4 -37.121 2.261 -5.069 1.00 0.00 N ATOM 0 H LYS A 4 -34.140 2.729 -8.709 1.00 0.00 H new ATOM 0 HA LYS A 4 -32.335 0.597 -8.073 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -35.052 0.763 -9.442 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -34.212 -0.760 -9.235 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -35.660 -0.740 -7.406 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -34.159 -0.175 -6.698 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -34.946 2.148 -6.738 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -36.386 1.691 -7.625 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -37.094 0.238 -5.700 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -35.669 0.739 -4.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -37.599 2.034 -4.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -36.446 3.037 -4.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -37.827 2.552 -5.775 1.00 0.00 H new ATOM 55 N ASN A 5 -32.374 1.643 -11.136 1.00 0.00 N ATOM 56 CA ASN A 5 -31.809 1.659 -12.492 1.00 0.00 C ATOM 57 C ASN A 5 -31.807 3.126 -13.002 1.00 0.00 C ATOM 58 O ASN A 5 -32.487 3.962 -12.395 1.00 0.00 O ATOM 59 CB ASN A 5 -32.656 0.705 -13.370 1.00 0.00 C ATOM 60 CG ASN A 5 -34.107 1.129 -13.503 1.00 0.00 C ATOM 61 OD1 ASN A 5 -34.410 2.182 -14.038 1.00 0.00 O ATOM 62 ND2 ASN A 5 -35.046 0.347 -13.024 1.00 0.00 N ATOM 0 H ASN A 5 -32.894 2.500 -10.947 1.00 0.00 H new ATOM 0 HA ASN A 5 -30.778 1.307 -12.523 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -32.211 0.647 -14.363 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -32.617 -0.298 -12.944 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -36.026 0.621 -13.100 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -34.796 -0.535 -12.576 1.00 0.00 H new ATOM 69 N PRO A 6 -31.100 3.491 -14.092 1.00 0.00 N ATOM 70 CA PRO A 6 -31.030 4.888 -14.543 1.00 0.00 C ATOM 71 C PRO A 6 -32.364 5.481 -15.003 1.00 0.00 C ATOM 72 O PRO A 6 -32.597 6.679 -14.799 1.00 0.00 O ATOM 73 CB PRO A 6 -30.000 4.917 -15.682 1.00 0.00 C ATOM 74 CG PRO A 6 -30.019 3.476 -16.181 1.00 0.00 C ATOM 75 CD PRO A 6 -30.204 2.674 -14.899 1.00 0.00 C ATOM 0 HA PRO A 6 -30.744 5.514 -13.698 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -30.281 5.621 -16.465 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -29.012 5.211 -15.328 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -30.832 3.303 -16.886 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -29.093 3.213 -16.692 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -30.634 1.693 -15.102 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -29.253 2.507 -14.393 1.00 0.00 H new ATOM 83 N VAL A 7 -33.255 4.653 -15.571 1.00 0.00 N ATOM 84 CA VAL A 7 -34.617 5.086 -15.921 1.00 0.00 C ATOM 85 C VAL A 7 -35.291 5.658 -14.692 1.00 0.00 C ATOM 86 O VAL A 7 -35.769 6.779 -14.723 1.00 0.00 O ATOM 87 CB VAL A 7 -35.516 3.994 -16.533 1.00 0.00 C ATOM 88 CG1 VAL A 7 -36.917 4.509 -16.887 1.00 0.00 C ATOM 89 CG2 VAL A 7 -34.764 3.244 -17.623 1.00 0.00 C ATOM 0 H VAL A 7 -33.056 3.679 -15.798 1.00 0.00 H new ATOM 0 HA VAL A 7 -34.494 5.835 -16.703 1.00 0.00 H new ATOM 0 HB VAL A 7 -35.741 3.239 -15.780 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -37.506 3.697 -17.314 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -37.407 4.878 -15.986 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -36.835 5.318 -17.613 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -35.410 2.475 -18.048 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -34.467 3.942 -18.406 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -33.876 2.777 -17.197 1.00 0.00 H new ATOM 99 N MET A 8 -35.253 4.923 -13.585 1.00 0.00 N ATOM 100 CA MET A 8 -35.858 5.304 -12.316 1.00 0.00 C ATOM 101 C MET A 8 -35.385 6.674 -11.807 1.00 0.00 C ATOM 102 O MET A 8 -36.208 7.483 -11.381 1.00 0.00 O ATOM 103 CB MET A 8 -35.564 4.182 -11.315 1.00 0.00 C ATOM 104 CG MET A 8 -36.614 4.104 -10.205 1.00 0.00 C ATOM 105 SD MET A 8 -36.067 4.458 -8.506 1.00 0.00 S ATOM 106 CE MET A 8 -35.780 6.248 -8.521 1.00 0.00 C ATOM 0 H MET A 8 -34.785 4.017 -13.547 1.00 0.00 H new ATOM 0 HA MET A 8 -36.933 5.424 -12.449 1.00 0.00 H new ATOM 0 HB2 MET A 8 -35.525 3.229 -11.842 1.00 0.00 H new ATOM 0 HB3 MET A 8 -34.581 4.342 -10.872 1.00 0.00 H new ATOM 0 HG2 MET A 8 -37.417 4.799 -10.452 1.00 0.00 H new ATOM 0 HG3 MET A 8 -37.044 3.102 -10.218 1.00 0.00 H new ATOM 0 HE1 MET A 8 -35.706 6.613 -7.497 1.00 0.00 H new ATOM 0 HE2 MET A 8 -34.852 6.463 -9.051 1.00 0.00 H new ATOM 0 HE3 MET A 8 -36.609 6.745 -9.024 1.00 0.00 H new ATOM 116 N ILE A 9 -34.075 6.947 -11.861 1.00 0.00 N ATOM 117 CA ILE A 9 -33.487 8.264 -11.558 1.00 0.00 C ATOM 118 C ILE A 9 -34.115 9.352 -12.424 1.00 0.00 C ATOM 119 O ILE A 9 -34.734 10.278 -11.907 1.00 0.00 O ATOM 120 CB ILE A 9 -31.950 8.299 -11.728 1.00 0.00 C ATOM 121 CG1 ILE A 9 -31.256 7.060 -11.144 1.00 0.00 C ATOM 122 CG2 ILE A 9 -31.389 9.597 -11.116 1.00 0.00 C ATOM 123 CD1 ILE A 9 -29.794 6.968 -11.581 1.00 0.00 C ATOM 0 H ILE A 9 -33.379 6.248 -12.121 1.00 0.00 H new ATOM 0 HA ILE A 9 -33.705 8.452 -10.507 1.00 0.00 H new ATOM 0 HB ILE A 9 -31.736 8.283 -12.797 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -31.308 7.093 -10.056 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -31.787 6.163 -11.461 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -30.306 9.618 -11.238 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -31.828 10.457 -11.622 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -31.636 9.635 -10.055 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -29.340 6.078 -11.146 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -29.742 6.908 -12.668 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -29.256 7.853 -11.241 1.00 0.00 H new ATOM 135 N LEU A 10 -33.922 9.252 -13.745 1.00 0.00 N ATOM 136 CA LEU A 10 -34.398 10.241 -14.721 1.00 0.00 C ATOM 137 C LEU A 10 -35.902 10.495 -14.623 1.00 0.00 C ATOM 138 O LEU A 10 -36.370 11.634 -14.640 1.00 0.00 O ATOM 139 CB LEU A 10 -33.851 9.849 -16.106 1.00 0.00 C ATOM 140 CG LEU A 10 -34.651 9.729 -17.415 1.00 0.00 C ATOM 141 CD1 LEU A 10 -35.623 8.561 -17.468 1.00 0.00 C ATOM 142 CD2 LEU A 10 -35.311 11.023 -17.843 1.00 0.00 C ATOM 0 H LEU A 10 -33.424 8.471 -14.172 1.00 0.00 H new ATOM 0 HA LEU A 10 -34.002 11.232 -14.499 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -33.056 10.564 -16.317 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -33.377 8.878 -15.966 1.00 0.00 H new ATOM 0 HG LEU A 10 -33.882 9.501 -18.153 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -36.139 8.560 -18.428 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -35.075 7.626 -17.350 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -36.353 8.658 -16.664 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -35.857 10.863 -18.773 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -36.003 11.352 -17.068 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -34.549 11.787 -17.997 1.00 0.00 H new ATOM 154 N ASN A 11 -36.626 9.400 -14.444 1.00 0.00 N ATOM 155 CA ASN A 11 -38.063 9.350 -14.211 1.00 0.00 C ATOM 156 C ASN A 11 -38.465 10.206 -13.006 1.00 0.00 C ATOM 157 O ASN A 11 -39.250 11.142 -13.124 1.00 0.00 O ATOM 158 CB ASN A 11 -38.419 7.874 -14.013 1.00 0.00 C ATOM 159 CG ASN A 11 -39.858 7.633 -13.585 1.00 0.00 C ATOM 160 OD1 ASN A 11 -40.764 7.538 -14.398 1.00 0.00 O ATOM 161 ND2 ASN A 11 -40.119 7.526 -12.300 1.00 0.00 N ATOM 0 H ASN A 11 -36.204 8.471 -14.458 1.00 0.00 H new ATOM 0 HA ASN A 11 -38.613 9.765 -15.056 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -38.234 7.339 -14.944 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -37.752 7.448 -13.263 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -41.076 7.364 -11.986 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -39.365 7.605 -11.618 1.00 0.00 H new ATOM 168 N GLU A 12 -37.982 9.833 -11.822 1.00 0.00 N ATOM 169 CA GLU A 12 -38.171 10.569 -10.581 1.00 0.00 C ATOM 170 C GLU A 12 -37.704 12.038 -10.604 1.00 0.00 C ATOM 171 O GLU A 12 -38.432 12.919 -10.155 1.00 0.00 O ATOM 172 CB GLU A 12 -37.589 9.728 -9.444 1.00 0.00 C ATOM 173 CG GLU A 12 -37.765 10.342 -8.048 1.00 0.00 C ATOM 174 CD GLU A 12 -39.226 10.739 -7.706 1.00 0.00 C ATOM 175 OE1 GLU A 12 -40.194 10.131 -8.225 1.00 0.00 O ATOM 176 OE2 GLU A 12 -39.442 11.710 -6.944 1.00 0.00 O ATOM 0 H GLU A 12 -37.432 8.983 -11.700 1.00 0.00 H new ATOM 0 HA GLU A 12 -39.240 10.704 -10.418 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -38.060 8.745 -9.457 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -36.526 9.575 -9.629 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -37.410 9.630 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -37.133 11.226 -7.970 1.00 0.00 H new ATOM 183 N LEU A 13 -36.483 12.323 -11.076 1.00 0.00 N ATOM 184 CA LEU A 13 -35.999 13.692 -11.303 1.00 0.00 C ATOM 185 C LEU A 13 -36.884 14.548 -12.229 1.00 0.00 C ATOM 186 O LEU A 13 -36.996 15.755 -12.001 1.00 0.00 O ATOM 187 CB LEU A 13 -34.519 13.725 -11.711 1.00 0.00 C ATOM 188 CG LEU A 13 -33.506 13.262 -10.632 1.00 0.00 C ATOM 189 CD1 LEU A 13 -32.250 14.121 -10.746 1.00 0.00 C ATOM 190 CD2 LEU A 13 -33.943 13.352 -9.165 1.00 0.00 C ATOM 0 H LEU A 13 -35.798 11.605 -11.313 1.00 0.00 H new ATOM 0 HA LEU A 13 -36.081 14.176 -10.330 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -34.392 13.098 -12.593 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -34.266 14.744 -12.005 1.00 0.00 H new ATOM 0 HG LEU A 13 -33.373 12.202 -10.847 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -31.526 13.809 -9.993 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -31.816 14.001 -11.739 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -32.509 15.168 -10.587 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -33.137 12.996 -8.523 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -34.174 14.388 -8.917 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -34.829 12.736 -9.011 1.00 0.00 H new ATOM 202 N ARG A 14 -37.506 13.939 -13.256 1.00 0.00 N ATOM 203 CA ARG A 14 -38.403 14.563 -14.261 1.00 0.00 C ATOM 204 C ARG A 14 -38.045 16.017 -14.651 1.00 0.00 C ATOM 205 O ARG A 14 -38.876 16.909 -14.462 1.00 0.00 O ATOM 206 CB ARG A 14 -39.891 14.356 -13.874 1.00 0.00 C ATOM 207 CG ARG A 14 -40.285 14.852 -12.468 1.00 0.00 C ATOM 208 CD ARG A 14 -41.575 14.205 -11.937 1.00 0.00 C ATOM 209 NE ARG A 14 -41.613 14.279 -10.458 1.00 0.00 N ATOM 210 CZ ARG A 14 -41.381 13.289 -9.605 1.00 0.00 C ATOM 211 NH1 ARG A 14 -41.397 12.035 -9.954 1.00 0.00 N ATOM 212 NH2 ARG A 14 -41.113 13.539 -8.356 1.00 0.00 N ATOM 0 H ARG A 14 -37.393 12.939 -13.421 1.00 0.00 H new ATOM 0 HA ARG A 14 -38.232 14.028 -15.195 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -40.514 14.867 -14.608 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -40.122 13.293 -13.944 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -39.470 14.644 -11.775 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -40.413 15.934 -12.494 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -42.444 14.712 -12.356 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -41.627 13.165 -12.258 1.00 0.00 H new ATOM 0 HE ARG A 14 -41.842 15.187 -10.052 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -41.594 11.777 -10.921 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -41.212 11.310 -9.261 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -41.080 14.503 -8.025 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -40.936 12.771 -7.709 1.00 0.00 H new ATOM 226 N PRO A 15 -36.830 16.286 -15.182 1.00 0.00 N ATOM 227 CA PRO A 15 -36.360 17.630 -15.561 1.00 0.00 C ATOM 228 C PRO A 15 -37.106 18.247 -16.769 1.00 0.00 C ATOM 229 O PRO A 15 -36.562 18.374 -17.868 1.00 0.00 O ATOM 230 CB PRO A 15 -34.843 17.488 -15.763 1.00 0.00 C ATOM 231 CG PRO A 15 -34.666 16.030 -16.176 1.00 0.00 C ATOM 232 CD PRO A 15 -35.744 15.322 -15.364 1.00 0.00 C ATOM 0 HA PRO A 15 -36.583 18.355 -14.778 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -34.476 18.169 -16.531 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -34.295 17.714 -14.849 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -34.809 15.892 -17.248 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -33.669 15.659 -15.937 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -36.099 14.432 -15.884 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -35.352 14.994 -14.401 1.00 0.00 H new ATOM 240 N GLY A 16 -38.374 18.628 -16.572 1.00 0.00 N ATOM 241 CA GLY A 16 -39.219 19.349 -17.536 1.00 0.00 C ATOM 242 C GLY A 16 -39.494 18.596 -18.844 1.00 0.00 C ATOM 243 O GLY A 16 -39.611 19.223 -19.900 1.00 0.00 O ATOM 0 H GLY A 16 -38.862 18.434 -15.698 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -40.172 19.580 -17.060 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -38.743 20.300 -17.775 1.00 0.00 H new ATOM 247 N LEU A 17 -39.525 17.259 -18.800 1.00 0.00 N ATOM 248 CA LEU A 17 -39.286 16.412 -19.964 1.00 0.00 C ATOM 249 C LEU A 17 -40.522 15.840 -20.681 1.00 0.00 C ATOM 250 O LEU A 17 -41.631 15.791 -20.142 1.00 0.00 O ATOM 251 CB LEU A 17 -38.274 15.323 -19.584 1.00 0.00 C ATOM 252 CG LEU A 17 -38.518 14.536 -18.290 1.00 0.00 C ATOM 253 CD1 LEU A 17 -39.843 13.781 -18.238 1.00 0.00 C ATOM 254 CD2 LEU A 17 -37.385 13.536 -18.174 1.00 0.00 C ATOM 0 H LEU A 17 -39.719 16.735 -17.947 1.00 0.00 H new ATOM 0 HA LEU A 17 -38.880 17.074 -20.729 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -38.227 14.609 -20.406 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -37.292 15.790 -19.511 1.00 0.00 H new ATOM 0 HG LEU A 17 -38.561 15.253 -17.470 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -39.925 13.256 -17.287 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -40.668 14.487 -18.335 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -39.884 13.060 -19.055 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -37.511 12.947 -17.265 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -37.394 12.874 -19.040 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -36.434 14.067 -18.133 1.00 0.00 H new ATOM 266 N LYS A 18 -40.283 15.365 -21.910 1.00 0.00 N ATOM 267 CA LYS A 18 -41.127 14.444 -22.685 1.00 0.00 C ATOM 268 C LYS A 18 -40.311 13.342 -23.350 1.00 0.00 C ATOM 269 O LYS A 18 -39.201 13.598 -23.826 1.00 0.00 O ATOM 270 CB LYS A 18 -42.066 15.151 -23.672 1.00 0.00 C ATOM 271 CG LYS A 18 -41.441 16.013 -24.786 1.00 0.00 C ATOM 272 CD LYS A 18 -41.026 15.229 -26.044 1.00 0.00 C ATOM 273 CE LYS A 18 -40.758 16.196 -27.202 1.00 0.00 C ATOM 274 NZ LYS A 18 -40.347 15.467 -28.426 1.00 0.00 N ATOM 0 H LYS A 18 -39.442 15.630 -22.423 1.00 0.00 H new ATOM 0 HA LYS A 18 -41.782 13.965 -21.958 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -42.683 14.389 -24.148 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -42.736 15.788 -23.095 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -42.154 16.785 -25.074 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -40.565 16.522 -24.385 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -40.132 14.641 -25.837 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -41.813 14.527 -26.321 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -41.656 16.779 -27.407 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -39.978 16.902 -26.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -40.123 16.150 -29.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -39.506 14.890 -28.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -41.123 14.849 -28.739 1.00 0.00 H new ATOM 288 N TYR A 19 -40.875 12.133 -23.376 1.00 0.00 N ATOM 289 CA TYR A 19 -40.284 10.966 -24.028 1.00 0.00 C ATOM 290 C TYR A 19 -40.998 10.659 -25.352 1.00 0.00 C ATOM 291 O TYR A 19 -42.227 10.643 -25.452 1.00 0.00 O ATOM 292 CB TYR A 19 -40.362 9.712 -23.143 1.00 0.00 C ATOM 293 CG TYR A 19 -39.882 9.844 -21.716 1.00 0.00 C ATOM 294 CD1 TYR A 19 -40.762 10.320 -20.725 1.00 0.00 C ATOM 295 CD2 TYR A 19 -38.577 9.455 -21.366 1.00 0.00 C ATOM 296 CE1 TYR A 19 -40.324 10.443 -19.395 1.00 0.00 C ATOM 297 CE2 TYR A 19 -38.126 9.603 -20.046 1.00 0.00 C ATOM 298 CZ TYR A 19 -39.002 10.093 -19.050 1.00 0.00 C ATOM 299 OH TYR A 19 -38.594 10.226 -17.763 1.00 0.00 O ATOM 0 H TYR A 19 -41.773 11.935 -22.935 1.00 0.00 H new ATOM 0 HA TYR A 19 -39.238 11.213 -24.209 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -41.399 9.378 -23.121 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -39.783 8.923 -23.623 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -41.774 10.591 -20.987 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -37.920 9.041 -22.116 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -41.001 10.806 -18.636 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -37.109 9.343 -19.790 1.00 0.00 H new ATOM 0 HH TYR A 19 -38.316 9.353 -17.416 1.00 0.00 H new ATOM 309 N ASP A 20 -40.183 10.389 -26.360 1.00 0.00 N ATOM 310 CA ASP A 20 -40.524 9.977 -27.719 1.00 0.00 C ATOM 311 C ASP A 20 -40.181 8.493 -27.917 1.00 0.00 C ATOM 312 O ASP A 20 -39.101 8.043 -27.518 1.00 0.00 O ATOM 313 CB ASP A 20 -39.749 10.815 -28.747 1.00 0.00 C ATOM 314 CG ASP A 20 -39.973 12.324 -28.599 1.00 0.00 C ATOM 315 OD1 ASP A 20 -41.123 12.793 -28.774 1.00 0.00 O ATOM 316 OD2 ASP A 20 -38.997 13.072 -28.354 1.00 0.00 O ATOM 0 H ASP A 20 -39.173 10.458 -26.239 1.00 0.00 H new ATOM 0 HA ASP A 20 -41.593 10.131 -27.866 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -38.684 10.602 -28.649 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -40.044 10.509 -29.751 1.00 0.00 H new ATOM 321 N PHE A 21 -41.087 7.736 -28.544 1.00 0.00 N ATOM 322 CA PHE A 21 -40.864 6.334 -28.910 1.00 0.00 C ATOM 323 C PHE A 21 -40.601 6.211 -30.418 1.00 0.00 C ATOM 324 O PHE A 21 -41.333 6.727 -31.268 1.00 0.00 O ATOM 325 CB PHE A 21 -42.074 5.496 -28.476 1.00 0.00 C ATOM 326 CG PHE A 21 -42.061 4.023 -28.869 1.00 0.00 C ATOM 327 CD1 PHE A 21 -40.869 3.265 -28.909 1.00 0.00 C ATOM 328 CD2 PHE A 21 -43.279 3.398 -29.198 1.00 0.00 C ATOM 329 CE1 PHE A 21 -40.897 1.914 -29.294 1.00 0.00 C ATOM 330 CE2 PHE A 21 -43.308 2.043 -29.576 1.00 0.00 C ATOM 331 CZ PHE A 21 -42.115 1.301 -29.628 1.00 0.00 C ATOM 0 H PHE A 21 -42.007 8.084 -28.815 1.00 0.00 H new ATOM 0 HA PHE A 21 -39.981 5.955 -28.394 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -42.160 5.558 -27.391 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -42.972 5.952 -28.894 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -39.930 3.727 -28.642 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -44.198 3.963 -29.160 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -39.979 1.346 -29.333 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -44.247 1.573 -29.826 1.00 0.00 H new ATOM 0 HZ PHE A 21 -42.135 0.263 -29.924 1.00 0.00 H new ATOM 341 N LEU A 22 -39.496 5.536 -30.705 1.00 0.00 N ATOM 342 CA LEU A 22 -38.817 5.352 -31.977 1.00 0.00 C ATOM 343 C LEU A 22 -38.462 3.852 -32.060 1.00 0.00 C ATOM 344 O LEU A 22 -38.119 3.212 -31.070 1.00 0.00 O ATOM 345 CB LEU A 22 -37.570 6.258 -32.052 1.00 0.00 C ATOM 346 CG LEU A 22 -37.750 7.787 -31.990 1.00 0.00 C ATOM 347 CD1 LEU A 22 -37.802 8.325 -30.568 1.00 0.00 C ATOM 348 CD2 LEU A 22 -36.559 8.487 -32.653 1.00 0.00 C ATOM 0 H LEU A 22 -38.997 5.047 -29.962 1.00 0.00 H new ATOM 0 HA LEU A 22 -39.443 5.635 -32.824 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -36.906 5.972 -31.236 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -37.050 6.026 -32.982 1.00 0.00 H new ATOM 0 HG LEU A 22 -38.694 7.987 -32.497 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -37.930 9.407 -30.593 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -38.640 7.873 -30.038 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -36.873 8.081 -30.053 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -36.698 9.567 -32.603 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -35.641 8.215 -32.132 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -36.490 8.178 -33.696 1.00 0.00 H new ATOM 360 N SER A 23 -38.682 3.226 -33.202 1.00 0.00 N ATOM 361 CA SER A 23 -38.668 1.778 -33.371 1.00 0.00 C ATOM 362 C SER A 23 -37.317 1.046 -33.312 1.00 0.00 C ATOM 363 O SER A 23 -37.304 -0.100 -32.862 1.00 0.00 O ATOM 364 CB SER A 23 -39.444 1.453 -34.646 1.00 0.00 C ATOM 365 OG SER A 23 -39.550 0.067 -34.901 1.00 0.00 O ATOM 0 H SER A 23 -38.882 3.725 -34.068 1.00 0.00 H new ATOM 0 HA SER A 23 -39.143 1.377 -32.476 1.00 0.00 H new ATOM 0 HB2 SER A 23 -40.445 1.879 -34.572 1.00 0.00 H new ATOM 0 HB3 SER A 23 -38.955 1.934 -35.493 1.00 0.00 H new ATOM 0 HG SER A 23 -38.907 -0.188 -35.595 1.00 0.00 H new ATOM 371 N GLU A 24 -36.135 1.572 -33.641 1.00 0.00 N ATOM 372 CA GLU A 24 -35.788 2.393 -34.825 1.00 0.00 C ATOM 373 C GLU A 24 -34.364 2.046 -35.311 1.00 0.00 C ATOM 374 O GLU A 24 -34.069 2.055 -36.508 1.00 0.00 O ATOM 375 CB GLU A 24 -35.756 3.900 -34.500 1.00 0.00 C ATOM 376 CG GLU A 24 -36.055 4.805 -35.707 1.00 0.00 C ATOM 377 CD GLU A 24 -37.512 5.312 -35.734 1.00 0.00 C ATOM 378 OE1 GLU A 24 -38.451 4.484 -35.750 1.00 0.00 O ATOM 379 OE2 GLU A 24 -37.726 6.548 -35.736 1.00 0.00 O ATOM 0 H GLU A 24 -35.322 1.428 -33.042 1.00 0.00 H new ATOM 0 HA GLU A 24 -36.551 2.179 -35.573 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -36.482 4.108 -33.714 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -34.774 4.155 -34.102 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -35.379 5.660 -35.689 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -35.850 4.255 -36.626 1.00 0.00 H new ATOM 386 N SER A 25 -33.469 1.774 -34.353 1.00 0.00 N ATOM 387 CA SER A 25 -32.024 1.588 -34.514 1.00 0.00 C ATOM 388 C SER A 25 -31.694 0.214 -35.125 1.00 0.00 C ATOM 389 O SER A 25 -31.301 -0.731 -34.437 1.00 0.00 O ATOM 390 CB SER A 25 -31.337 1.880 -33.165 1.00 0.00 C ATOM 391 OG SER A 25 -29.972 1.492 -33.140 1.00 0.00 O ATOM 0 H SER A 25 -33.756 1.671 -33.380 1.00 0.00 H new ATOM 0 HA SER A 25 -31.623 2.297 -35.238 1.00 0.00 H new ATOM 0 HB2 SER A 25 -31.409 2.946 -32.950 1.00 0.00 H new ATOM 0 HB3 SER A 25 -31.872 1.358 -32.371 1.00 0.00 H new ATOM 0 HG SER A 25 -29.588 1.702 -32.263 1.00 0.00 H new ATOM 397 N GLY A 26 -31.879 0.108 -36.443 1.00 0.00 N ATOM 398 CA GLY A 26 -31.384 -0.990 -37.278 1.00 0.00 C ATOM 399 C GLY A 26 -31.752 -0.830 -38.765 1.00 0.00 C ATOM 400 O GLY A 26 -30.863 -0.701 -39.601 1.00 0.00 O ATOM 0 H GLY A 26 -32.395 0.808 -36.977 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -30.300 -1.051 -37.182 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -31.790 -1.932 -36.908 1.00 0.00 H new ATOM 404 N GLU A 27 -33.028 -0.771 -39.158 1.00 0.00 N ATOM 405 CA GLU A 27 -34.230 -1.047 -38.349 1.00 0.00 C ATOM 406 C GLU A 27 -34.202 -2.481 -37.784 1.00 0.00 C ATOM 407 O GLU A 27 -34.306 -2.677 -36.574 1.00 0.00 O ATOM 408 CB GLU A 27 -35.479 -0.816 -39.228 1.00 0.00 C ATOM 409 CG GLU A 27 -36.664 -0.171 -38.495 1.00 0.00 C ATOM 410 CD GLU A 27 -37.121 -0.937 -37.243 1.00 0.00 C ATOM 411 OE1 GLU A 27 -37.382 -2.161 -37.298 1.00 0.00 O ATOM 412 OE2 GLU A 27 -37.236 -0.315 -36.165 1.00 0.00 O ATOM 0 H GLU A 27 -33.270 -0.512 -40.114 1.00 0.00 H new ATOM 0 HA GLU A 27 -34.258 -0.371 -37.494 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -35.202 -0.183 -40.071 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -35.800 -1.773 -39.639 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -36.390 0.844 -38.207 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -37.504 -0.091 -39.185 1.00 0.00 H new ATOM 419 N SER A 28 -33.934 -3.463 -38.652 1.00 0.00 N ATOM 420 CA SER A 28 -33.717 -4.881 -38.329 1.00 0.00 C ATOM 421 C SER A 28 -32.239 -5.236 -38.095 1.00 0.00 C ATOM 422 O SER A 28 -31.932 -6.039 -37.213 1.00 0.00 O ATOM 423 CB SER A 28 -34.241 -5.738 -39.490 1.00 0.00 C ATOM 424 OG SER A 28 -33.668 -5.309 -40.722 1.00 0.00 O ATOM 0 H SER A 28 -33.858 -3.282 -39.653 1.00 0.00 H new ATOM 0 HA SER A 28 -34.250 -5.079 -37.399 1.00 0.00 H new ATOM 0 HB2 SER A 28 -33.999 -6.786 -39.315 1.00 0.00 H new ATOM 0 HB3 SER A 28 -35.327 -5.666 -39.542 1.00 0.00 H new ATOM 0 HG SER A 28 -34.010 -5.865 -41.453 1.00 0.00 H new ATOM 430 N HIS A 29 -31.316 -4.614 -38.841 1.00 0.00 N ATOM 431 CA HIS A 29 -29.874 -4.925 -38.871 1.00 0.00 C ATOM 432 C HIS A 29 -29.175 -4.896 -37.494 1.00 0.00 C ATOM 433 O HIS A 29 -28.212 -5.632 -37.265 1.00 0.00 O ATOM 434 CB HIS A 29 -29.207 -3.951 -39.857 1.00 0.00 C ATOM 435 CG HIS A 29 -27.705 -4.069 -39.954 1.00 0.00 C ATOM 436 ND1 HIS A 29 -26.798 -3.065 -39.699 1.00 0.00 N ATOM 437 CD2 HIS A 29 -26.986 -5.182 -40.304 1.00 0.00 C ATOM 438 CE1 HIS A 29 -25.561 -3.556 -39.886 1.00 0.00 C ATOM 439 NE2 HIS A 29 -25.624 -4.849 -40.258 1.00 0.00 N ATOM 0 H HIS A 29 -31.561 -3.847 -39.468 1.00 0.00 H new ATOM 0 HA HIS A 29 -29.765 -5.960 -39.196 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -29.634 -4.111 -40.847 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -29.458 -2.932 -39.563 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -27.396 -6.146 -40.569 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -24.648 -2.994 -39.757 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -24.837 -5.464 -40.465 1.00 0.00 H new ATOM 447 N ALA A 30 -29.693 -4.091 -36.562 1.00 0.00 N ATOM 448 CA ALA A 30 -29.234 -3.985 -35.175 1.00 0.00 C ATOM 449 C ALA A 30 -30.408 -3.964 -34.167 1.00 0.00 C ATOM 450 O ALA A 30 -30.239 -3.458 -33.058 1.00 0.00 O ATOM 451 CB ALA A 30 -28.327 -2.745 -35.070 1.00 0.00 C ATOM 0 H ALA A 30 -30.477 -3.469 -36.762 1.00 0.00 H new ATOM 0 HA ALA A 30 -28.660 -4.872 -34.905 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -27.970 -2.641 -34.045 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -27.476 -2.859 -35.741 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -28.892 -1.856 -35.349 1.00 0.00 H new ATOM 457 N LYS A 31 -31.580 -4.509 -34.555 1.00 0.00 N ATOM 458 CA LYS A 31 -32.920 -4.395 -33.930 1.00 0.00 C ATOM 459 C LYS A 31 -32.942 -3.892 -32.479 1.00 0.00 C ATOM 460 O LYS A 31 -32.885 -4.663 -31.519 1.00 0.00 O ATOM 461 CB LYS A 31 -33.710 -5.704 -34.129 1.00 0.00 C ATOM 462 CG LYS A 31 -35.191 -5.675 -33.693 1.00 0.00 C ATOM 463 CD LYS A 31 -36.112 -4.710 -34.465 1.00 0.00 C ATOM 464 CE LYS A 31 -36.117 -3.285 -33.898 1.00 0.00 C ATOM 465 NZ LYS A 31 -37.263 -2.502 -34.416 1.00 0.00 N ATOM 0 H LYS A 31 -31.619 -5.094 -35.390 1.00 0.00 H new ATOM 0 HA LYS A 31 -33.427 -3.589 -34.461 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -33.668 -5.973 -35.184 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -33.205 -6.497 -33.577 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -35.595 -6.683 -33.788 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -35.231 -5.414 -32.636 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -35.797 -4.676 -35.508 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -37.129 -5.102 -34.451 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -36.164 -3.325 -32.810 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -35.185 -2.784 -34.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -37.229 -1.538 -34.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -37.213 -2.459 -35.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -38.153 -2.959 -34.131 1.00 0.00 H new ATOM 479 N SER A 32 -33.032 -2.573 -32.348 1.00 0.00 N ATOM 480 CA SER A 32 -33.009 -1.812 -31.096 1.00 0.00 C ATOM 481 C SER A 32 -34.135 -0.789 -31.109 1.00 0.00 C ATOM 482 O SER A 32 -34.343 -0.101 -32.111 1.00 0.00 O ATOM 483 CB SER A 32 -31.671 -1.094 -30.903 1.00 0.00 C ATOM 484 OG SER A 32 -30.635 -2.027 -30.671 1.00 0.00 O ATOM 0 H SER A 32 -33.129 -1.965 -33.162 1.00 0.00 H new ATOM 0 HA SER A 32 -33.142 -2.510 -30.269 1.00 0.00 H new ATOM 0 HB2 SER A 32 -31.441 -0.499 -31.787 1.00 0.00 H new ATOM 0 HB3 SER A 32 -31.741 -0.403 -30.063 1.00 0.00 H new ATOM 0 HG SER A 32 -30.473 -2.545 -31.487 1.00 0.00 H new ATOM 490 N PHE A 33 -34.848 -0.678 -29.993 1.00 0.00 N ATOM 491 CA PHE A 33 -35.988 0.206 -29.805 1.00 0.00 C ATOM 492 C PHE A 33 -35.431 1.441 -29.133 1.00 0.00 C ATOM 493 O PHE A 33 -34.513 1.406 -28.314 1.00 0.00 O ATOM 494 CB PHE A 33 -37.070 -0.340 -28.866 1.00 0.00 C ATOM 495 CG PHE A 33 -37.770 -1.651 -29.160 1.00 0.00 C ATOM 496 CD1 PHE A 33 -37.534 -2.414 -30.321 1.00 0.00 C ATOM 497 CD2 PHE A 33 -38.705 -2.100 -28.213 1.00 0.00 C ATOM 498 CE1 PHE A 33 -38.210 -3.636 -30.506 1.00 0.00 C ATOM 499 CE2 PHE A 33 -39.381 -3.315 -28.395 1.00 0.00 C ATOM 500 CZ PHE A 33 -39.129 -4.089 -29.542 1.00 0.00 C ATOM 0 H PHE A 33 -34.636 -1.227 -29.160 1.00 0.00 H new ATOM 0 HA PHE A 33 -36.456 0.360 -30.777 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -36.618 -0.434 -27.879 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -37.843 0.425 -28.791 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -36.837 -2.063 -31.067 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -38.905 -1.503 -27.335 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -38.022 -4.227 -31.390 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -40.093 -3.655 -27.657 1.00 0.00 H new ATOM 0 HZ PHE A 33 -39.640 -5.030 -29.682 1.00 0.00 H new ATOM 510 N VAL A 34 -35.880 2.565 -29.635 1.00 0.00 N ATOM 511 CA VAL A 34 -35.229 3.832 -29.436 1.00 0.00 C ATOM 512 C VAL A 34 -36.153 4.734 -28.632 1.00 0.00 C ATOM 513 O VAL A 34 -37.322 4.956 -28.944 1.00 0.00 O ATOM 514 CB VAL A 34 -34.792 4.346 -30.806 1.00 0.00 C ATOM 515 CG1 VAL A 34 -34.239 5.751 -30.730 1.00 0.00 C ATOM 516 CG2 VAL A 34 -33.659 3.499 -31.365 1.00 0.00 C ATOM 0 H VAL A 34 -36.725 2.624 -30.204 1.00 0.00 H new ATOM 0 HA VAL A 34 -34.318 3.775 -28.840 1.00 0.00 H new ATOM 0 HB VAL A 34 -35.683 4.307 -31.433 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -33.940 6.079 -31.726 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -35.004 6.423 -30.342 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -33.373 5.766 -30.068 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.364 3.884 -32.341 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -32.806 3.539 -30.687 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -33.993 2.467 -31.468 1.00 0.00 H new ATOM 526 N MET A 35 -35.602 5.231 -27.539 1.00 0.00 N ATOM 527 CA MET A 35 -36.241 6.218 -26.677 1.00 0.00 C ATOM 528 C MET A 35 -35.459 7.511 -26.797 1.00 0.00 C ATOM 529 O MET A 35 -34.259 7.544 -26.529 1.00 0.00 O ATOM 530 CB MET A 35 -36.266 5.724 -25.224 1.00 0.00 C ATOM 531 CG MET A 35 -37.438 4.767 -24.995 1.00 0.00 C ATOM 532 SD MET A 35 -39.011 5.625 -24.722 1.00 0.00 S ATOM 533 CE MET A 35 -40.120 4.522 -25.625 1.00 0.00 C ATOM 0 H MET A 35 -34.675 4.955 -27.215 1.00 0.00 H new ATOM 0 HA MET A 35 -37.275 6.379 -26.982 1.00 0.00 H new ATOM 0 HB2 MET A 35 -35.328 5.220 -24.990 1.00 0.00 H new ATOM 0 HB3 MET A 35 -36.348 6.575 -24.547 1.00 0.00 H new ATOM 0 HG2 MET A 35 -37.535 4.108 -25.858 1.00 0.00 H new ATOM 0 HG3 MET A 35 -37.221 4.135 -24.134 1.00 0.00 H new ATOM 0 HE1 MET A 35 -41.148 4.702 -25.310 1.00 0.00 H new ATOM 0 HE2 MET A 35 -40.030 4.712 -26.695 1.00 0.00 H new ATOM 0 HE3 MET A 35 -39.852 3.486 -25.416 1.00 0.00 H new ATOM 543 N SER A 36 -36.141 8.577 -27.190 1.00 0.00 N ATOM 544 CA SER A 36 -35.530 9.893 -27.356 1.00 0.00 C ATOM 545 C SER A 36 -36.258 10.905 -26.481 1.00 0.00 C ATOM 546 O SER A 36 -37.474 10.854 -26.349 1.00 0.00 O ATOM 547 CB SER A 36 -35.474 10.308 -28.823 1.00 0.00 C ATOM 548 OG SER A 36 -34.695 9.387 -29.572 1.00 0.00 O ATOM 0 H SER A 36 -37.138 8.556 -27.404 1.00 0.00 H new ATOM 0 HA SER A 36 -34.492 9.850 -27.026 1.00 0.00 H new ATOM 0 HB2 SER A 36 -36.483 10.356 -29.232 1.00 0.00 H new ATOM 0 HB3 SER A 36 -35.047 11.307 -28.908 1.00 0.00 H new ATOM 0 HG SER A 36 -34.671 9.667 -30.511 1.00 0.00 H new ATOM 554 N VAL A 37 -35.523 11.758 -25.778 1.00 0.00 N ATOM 555 CA VAL A 37 -36.053 12.618 -24.708 1.00 0.00 C ATOM 556 C VAL A 37 -35.659 14.061 -24.916 1.00 0.00 C ATOM 557 O VAL A 37 -34.490 14.351 -25.174 1.00 0.00 O ATOM 558 CB VAL A 37 -35.649 12.189 -23.280 1.00 0.00 C ATOM 559 CG1 VAL A 37 -36.834 11.623 -22.531 1.00 0.00 C ATOM 560 CG2 VAL A 37 -34.463 11.230 -23.185 1.00 0.00 C ATOM 0 H VAL A 37 -34.522 11.879 -25.933 1.00 0.00 H new ATOM 0 HA VAL A 37 -37.135 12.504 -24.781 1.00 0.00 H new ATOM 0 HB VAL A 37 -35.306 13.112 -22.813 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -36.524 11.328 -21.528 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -37.616 12.380 -22.461 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -37.218 10.752 -23.062 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -34.267 10.996 -22.139 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -34.693 10.312 -23.725 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -33.581 11.697 -23.623 1.00 0.00 H new ATOM 570 N VAL A 38 -36.629 14.954 -24.725 1.00 0.00 N ATOM 571 CA VAL A 38 -36.370 16.393 -24.593 1.00 0.00 C ATOM 572 C VAL A 38 -36.515 16.701 -23.110 1.00 0.00 C ATOM 573 O VAL A 38 -37.548 16.388 -22.521 1.00 0.00 O ATOM 574 CB VAL A 38 -37.361 17.259 -25.396 1.00 0.00 C ATOM 575 CG1 VAL A 38 -37.109 18.757 -25.166 1.00 0.00 C ATOM 576 CG2 VAL A 38 -37.252 17.013 -26.903 1.00 0.00 C ATOM 0 H VAL A 38 -37.616 14.704 -24.657 1.00 0.00 H new ATOM 0 HA VAL A 38 -35.381 16.627 -24.987 1.00 0.00 H new ATOM 0 HB VAL A 38 -38.352 16.974 -25.042 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -37.824 19.340 -25.746 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -37.227 18.988 -24.107 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -36.096 19.008 -25.481 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -37.969 17.645 -27.428 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -36.243 17.253 -27.239 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -37.466 15.966 -27.117 1.00 0.00 H new ATOM 586 N VAL A 39 -35.464 17.258 -22.507 1.00 0.00 N ATOM 587 CA VAL A 39 -35.343 17.566 -21.068 1.00 0.00 C ATOM 588 C VAL A 39 -34.593 18.891 -20.920 1.00 0.00 C ATOM 589 O VAL A 39 -33.739 19.186 -21.754 1.00 0.00 O ATOM 590 CB VAL A 39 -34.644 16.430 -20.259 1.00 0.00 C ATOM 591 CG1 VAL A 39 -34.648 15.049 -20.931 1.00 0.00 C ATOM 592 CG2 VAL A 39 -33.219 16.729 -19.769 1.00 0.00 C ATOM 0 H VAL A 39 -34.628 17.523 -23.029 1.00 0.00 H new ATOM 0 HA VAL A 39 -36.345 17.649 -20.648 1.00 0.00 H new ATOM 0 HB VAL A 39 -35.297 16.398 -19.387 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -34.139 14.330 -20.289 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -35.676 14.726 -21.093 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -34.132 15.109 -21.889 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -32.835 15.869 -19.220 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -32.575 16.930 -20.625 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -33.235 17.600 -19.114 1.00 0.00 H new ATOM 602 N ASP A 40 -34.853 19.655 -19.853 1.00 0.00 N ATOM 603 CA ASP A 40 -34.259 20.978 -19.556 1.00 0.00 C ATOM 604 C ASP A 40 -34.494 22.042 -20.662 1.00 0.00 C ATOM 605 O ASP A 40 -35.303 22.958 -20.496 1.00 0.00 O ATOM 606 CB ASP A 40 -32.769 20.782 -19.194 1.00 0.00 C ATOM 607 CG ASP A 40 -31.957 22.083 -19.232 1.00 0.00 C ATOM 608 OD1 ASP A 40 -32.312 23.047 -18.516 1.00 0.00 O ATOM 609 OD2 ASP A 40 -30.975 22.130 -20.011 1.00 0.00 O ATOM 0 H ASP A 40 -35.514 19.360 -19.134 1.00 0.00 H new ATOM 0 HA ASP A 40 -34.779 21.402 -18.697 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -32.699 20.348 -18.197 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -32.326 20.065 -19.886 1.00 0.00 H new ATOM 614 N GLY A 41 -33.837 21.876 -21.809 1.00 0.00 N ATOM 615 CA GLY A 41 -34.055 22.569 -23.085 1.00 0.00 C ATOM 616 C GLY A 41 -33.321 21.900 -24.266 1.00 0.00 C ATOM 617 O GLY A 41 -33.060 22.549 -25.280 1.00 0.00 O ATOM 0 H GLY A 41 -33.077 21.200 -21.879 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -35.124 22.599 -23.298 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -33.719 23.602 -22.993 1.00 0.00 H new ATOM 621 N GLN A 42 -32.920 20.632 -24.105 1.00 0.00 N ATOM 622 CA GLN A 42 -32.022 19.857 -24.969 1.00 0.00 C ATOM 623 C GLN A 42 -32.546 18.432 -25.232 1.00 0.00 C ATOM 624 O GLN A 42 -33.504 17.996 -24.592 1.00 0.00 O ATOM 625 CB GLN A 42 -30.600 19.871 -24.378 1.00 0.00 C ATOM 626 CG GLN A 42 -30.488 19.729 -22.847 1.00 0.00 C ATOM 627 CD GLN A 42 -29.059 19.986 -22.372 1.00 0.00 C ATOM 628 OE1 GLN A 42 -28.082 19.629 -23.016 1.00 0.00 O ATOM 629 NE2 GLN A 42 -28.869 20.652 -21.255 1.00 0.00 N ATOM 0 H GLN A 42 -33.239 20.081 -23.308 1.00 0.00 H new ATOM 0 HA GLN A 42 -31.987 20.331 -25.950 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -30.032 19.062 -24.838 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -30.119 20.805 -24.670 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -31.167 20.431 -22.363 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -30.799 18.728 -22.548 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -29.669 20.959 -20.702 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -27.921 20.861 -20.941 1.00 0.00 H new ATOM 638 N PHE A 43 -31.931 17.705 -26.173 1.00 0.00 N ATOM 639 CA PHE A 43 -32.464 16.458 -26.742 1.00 0.00 C ATOM 640 C PHE A 43 -31.420 15.331 -26.838 1.00 0.00 C ATOM 641 O PHE A 43 -30.274 15.565 -27.238 1.00 0.00 O ATOM 642 CB PHE A 43 -33.047 16.774 -28.126 1.00 0.00 C ATOM 643 CG PHE A 43 -33.580 15.580 -28.900 1.00 0.00 C ATOM 644 CD1 PHE A 43 -34.773 14.952 -28.499 1.00 0.00 C ATOM 645 CD2 PHE A 43 -32.901 15.113 -30.042 1.00 0.00 C ATOM 646 CE1 PHE A 43 -35.313 13.898 -29.257 1.00 0.00 C ATOM 647 CE2 PHE A 43 -33.430 14.046 -30.792 1.00 0.00 C ATOM 648 CZ PHE A 43 -34.642 13.448 -30.408 1.00 0.00 C ATOM 0 H PHE A 43 -31.030 17.972 -26.569 1.00 0.00 H new ATOM 0 HA PHE A 43 -33.235 16.083 -26.069 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -33.855 17.496 -28.004 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -32.275 17.257 -28.724 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -35.278 15.282 -27.603 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -31.972 15.575 -30.343 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -36.241 13.435 -28.956 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -32.904 13.686 -31.664 1.00 0.00 H new ATOM 0 HZ PHE A 43 -35.058 12.643 -30.996 1.00 0.00 H new ATOM 658 N PHE A 44 -31.840 14.106 -26.508 1.00 0.00 N ATOM 659 CA PHE A 44 -31.021 12.881 -26.516 1.00 0.00 C ATOM 660 C PHE A 44 -31.752 11.695 -27.162 1.00 0.00 C ATOM 661 O PHE A 44 -32.982 11.650 -27.160 1.00 0.00 O ATOM 662 CB PHE A 44 -30.625 12.502 -25.077 1.00 0.00 C ATOM 663 CG PHE A 44 -30.247 13.680 -24.205 1.00 0.00 C ATOM 664 CD1 PHE A 44 -28.959 14.232 -24.287 1.00 0.00 C ATOM 665 CD2 PHE A 44 -31.219 14.280 -23.383 1.00 0.00 C ATOM 666 CE1 PHE A 44 -28.643 15.383 -23.548 1.00 0.00 C ATOM 667 CE2 PHE A 44 -30.900 15.430 -22.644 1.00 0.00 C ATOM 668 CZ PHE A 44 -29.609 15.982 -22.721 1.00 0.00 C ATOM 0 H PHE A 44 -32.801 13.929 -26.215 1.00 0.00 H new ATOM 0 HA PHE A 44 -30.133 13.095 -27.111 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -31.456 11.972 -24.611 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -29.785 11.808 -25.114 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -28.212 13.772 -24.917 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -32.210 13.856 -23.321 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -27.653 15.810 -23.615 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -31.647 15.891 -22.015 1.00 0.00 H new ATOM 0 HZ PHE A 44 -29.361 16.863 -22.147 1.00 0.00 H new ATOM 678 N GLU A 45 -30.996 10.693 -27.616 1.00 0.00 N ATOM 679 CA GLU A 45 -31.466 9.422 -28.193 1.00 0.00 C ATOM 680 C GLU A 45 -30.770 8.249 -27.483 1.00 0.00 C ATOM 681 O GLU A 45 -29.556 8.269 -27.261 1.00 0.00 O ATOM 682 CB GLU A 45 -31.181 9.346 -29.710 1.00 0.00 C ATOM 683 CG GLU A 45 -31.569 10.585 -30.541 1.00 0.00 C ATOM 684 CD GLU A 45 -30.436 11.630 -30.721 1.00 0.00 C ATOM 685 OE1 GLU A 45 -29.495 11.719 -29.894 1.00 0.00 O ATOM 686 OE2 GLU A 45 -30.470 12.374 -31.731 1.00 0.00 O ATOM 0 H GLU A 45 -29.978 10.746 -27.591 1.00 0.00 H new ATOM 0 HA GLU A 45 -32.545 9.365 -28.048 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.116 9.161 -29.849 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -31.710 8.483 -30.115 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -31.900 10.255 -31.526 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -32.421 11.072 -30.065 1.00 0.00 H new ATOM 693 N GLY A 46 -31.539 7.219 -27.127 1.00 0.00 N ATOM 694 CA GLY A 46 -31.078 6.012 -26.436 1.00 0.00 C ATOM 695 C GLY A 46 -31.620 4.752 -27.101 1.00 0.00 C ATOM 696 O GLY A 46 -32.836 4.594 -27.203 1.00 0.00 O ATOM 0 H GLY A 46 -32.541 7.201 -27.320 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -29.988 5.985 -26.435 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -31.398 6.042 -25.394 1.00 0.00 H new ATOM 700 N SER A 47 -30.739 3.849 -27.541 1.00 0.00 N ATOM 701 CA SER A 47 -31.118 2.719 -28.407 1.00 0.00 C ATOM 702 C SER A 47 -30.836 1.383 -27.716 1.00 0.00 C ATOM 703 O SER A 47 -29.685 0.982 -27.539 1.00 0.00 O ATOM 704 CB SER A 47 -30.414 2.807 -29.771 1.00 0.00 C ATOM 705 OG SER A 47 -30.414 4.130 -30.290 1.00 0.00 O ATOM 0 H SER A 47 -29.746 3.877 -27.310 1.00 0.00 H new ATOM 0 HA SER A 47 -32.191 2.777 -28.589 1.00 0.00 H new ATOM 0 HB2 SER A 47 -29.386 2.458 -29.671 1.00 0.00 H new ATOM 0 HB3 SER A 47 -30.910 2.141 -30.478 1.00 0.00 H new ATOM 0 HG SER A 47 -29.956 4.142 -31.156 1.00 0.00 H new ATOM 711 N GLY A 48 -31.910 0.746 -27.248 1.00 0.00 N ATOM 712 CA GLY A 48 -31.912 -0.434 -26.379 1.00 0.00 C ATOM 713 C GLY A 48 -32.914 -1.519 -26.789 1.00 0.00 C ATOM 714 O GLY A 48 -33.974 -1.207 -27.322 1.00 0.00 O ATOM 0 H GLY A 48 -32.854 1.056 -27.477 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -30.911 -0.865 -26.370 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -32.133 -0.119 -25.359 1.00 0.00 H new ATOM 718 N ARG A 49 -32.593 -2.803 -26.585 1.00 0.00 N ATOM 719 CA ARG A 49 -33.466 -3.951 -26.936 1.00 0.00 C ATOM 720 C ARG A 49 -34.957 -3.812 -26.551 1.00 0.00 C ATOM 721 O ARG A 49 -35.811 -4.295 -27.292 1.00 0.00 O ATOM 722 CB ARG A 49 -32.883 -5.261 -26.369 1.00 0.00 C ATOM 723 CG ARG A 49 -31.478 -5.628 -26.883 1.00 0.00 C ATOM 724 CD ARG A 49 -31.431 -5.868 -28.396 1.00 0.00 C ATOM 725 NE ARG A 49 -30.057 -6.186 -28.836 1.00 0.00 N ATOM 726 CZ ARG A 49 -29.509 -5.847 -29.988 1.00 0.00 C ATOM 727 NH1 ARG A 49 -30.205 -5.301 -30.937 1.00 0.00 N ATOM 728 NH2 ARG A 49 -28.242 -6.042 -30.214 1.00 0.00 N ATOM 0 H ARG A 49 -31.708 -3.087 -26.165 1.00 0.00 H new ATOM 0 HA ARG A 49 -33.468 -3.969 -28.026 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -32.847 -5.184 -25.282 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -33.565 -6.077 -26.608 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -30.784 -4.827 -26.627 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -31.133 -6.525 -26.369 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -32.100 -6.687 -28.659 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -31.789 -4.982 -28.920 1.00 0.00 H new ATOM 0 HE ARG A 49 -29.477 -6.718 -28.188 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -31.200 -5.124 -30.802 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -29.757 -5.049 -31.818 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -27.655 -6.463 -29.494 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -27.837 -5.773 -31.111 1.00 0.00 H new ATOM 742 N ASN A 50 -35.269 -3.130 -25.442 1.00 0.00 N ATOM 743 CA ASN A 50 -36.601 -2.588 -25.105 1.00 0.00 C ATOM 744 C ASN A 50 -36.447 -1.394 -24.125 1.00 0.00 C ATOM 745 O ASN A 50 -35.325 -1.084 -23.722 1.00 0.00 O ATOM 746 CB ASN A 50 -37.500 -3.729 -24.561 1.00 0.00 C ATOM 747 CG ASN A 50 -38.997 -3.505 -24.757 1.00 0.00 C ATOM 748 OD1 ASN A 50 -39.502 -2.391 -24.758 1.00 0.00 O ATOM 749 ND2 ASN A 50 -39.764 -4.557 -24.927 1.00 0.00 N ATOM 0 H ASN A 50 -34.575 -2.930 -24.722 1.00 0.00 H new ATOM 0 HA ASN A 50 -37.097 -2.195 -25.993 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -37.218 -4.661 -25.051 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -37.301 -3.855 -23.497 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -40.769 -4.440 -25.058 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -39.355 -5.491 -24.928 1.00 0.00 H new ATOM 756 N LYS A 51 -37.536 -0.738 -23.695 1.00 0.00 N ATOM 757 CA LYS A 51 -37.589 0.427 -22.772 1.00 0.00 C ATOM 758 C LYS A 51 -36.675 0.345 -21.545 1.00 0.00 C ATOM 759 O LYS A 51 -35.992 1.326 -21.264 1.00 0.00 O ATOM 760 CB LYS A 51 -39.051 0.664 -22.356 1.00 0.00 C ATOM 761 CG LYS A 51 -39.799 1.434 -23.458 1.00 0.00 C ATOM 762 CD LYS A 51 -41.328 1.359 -23.326 1.00 0.00 C ATOM 763 CE LYS A 51 -41.852 -0.043 -23.676 1.00 0.00 C ATOM 764 NZ LYS A 51 -43.338 -0.091 -23.684 1.00 0.00 N ATOM 0 H LYS A 51 -38.469 -1.019 -23.998 1.00 0.00 H new ATOM 0 HA LYS A 51 -37.194 1.275 -23.332 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -39.543 -0.291 -22.171 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -39.085 1.226 -21.423 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -39.491 2.479 -23.434 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -39.506 1.038 -24.430 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -41.620 1.615 -22.307 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -41.788 2.096 -23.984 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -41.474 -0.339 -24.654 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -41.469 -0.765 -22.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -43.653 -1.053 -23.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -43.699 0.167 -22.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -43.703 0.579 -24.390 1.00 0.00 H new ATOM 778 N LYS A 52 -36.568 -0.811 -20.878 1.00 0.00 N ATOM 779 CA LYS A 52 -35.631 -1.043 -19.749 1.00 0.00 C ATOM 780 C LYS A 52 -34.145 -0.770 -20.054 1.00 0.00 C ATOM 781 O LYS A 52 -33.346 -0.630 -19.130 1.00 0.00 O ATOM 782 CB LYS A 52 -35.836 -2.447 -19.139 1.00 0.00 C ATOM 783 CG LYS A 52 -35.116 -3.622 -19.831 1.00 0.00 C ATOM 784 CD LYS A 52 -35.618 -3.925 -21.251 1.00 0.00 C ATOM 785 CE LYS A 52 -34.852 -5.065 -21.937 1.00 0.00 C ATOM 786 NZ LYS A 52 -35.040 -6.376 -21.255 1.00 0.00 N ATOM 0 H LYS A 52 -37.134 -1.629 -21.103 1.00 0.00 H new ATOM 0 HA LYS A 52 -35.894 -0.287 -19.010 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -35.511 -2.415 -18.099 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -36.905 -2.661 -19.132 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -34.049 -3.404 -19.875 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -35.234 -4.516 -19.219 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -36.676 -4.183 -21.207 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -35.534 -3.024 -21.858 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -35.183 -5.148 -22.972 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -33.790 -4.821 -21.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -34.529 -7.116 -21.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -34.669 -6.319 -20.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -36.053 -6.610 -21.225 1.00 0.00 H new ATOM 800 N LEU A 53 -33.791 -0.677 -21.339 1.00 0.00 N ATOM 801 CA LEU A 53 -32.450 -0.423 -21.865 1.00 0.00 C ATOM 802 C LEU A 53 -32.430 0.827 -22.768 1.00 0.00 C ATOM 803 O LEU A 53 -31.529 1.651 -22.642 1.00 0.00 O ATOM 804 CB LEU A 53 -31.990 -1.717 -22.571 1.00 0.00 C ATOM 805 CG LEU A 53 -30.579 -1.706 -23.186 1.00 0.00 C ATOM 806 CD1 LEU A 53 -29.497 -1.259 -22.203 1.00 0.00 C ATOM 807 CD2 LEU A 53 -30.225 -3.113 -23.668 1.00 0.00 C ATOM 0 H LEU A 53 -34.478 -0.784 -22.085 1.00 0.00 H new ATOM 0 HA LEU A 53 -31.744 -0.189 -21.069 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -32.041 -2.534 -21.851 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -32.704 -1.945 -23.362 1.00 0.00 H new ATOM 0 HG LEU A 53 -30.605 -0.989 -24.007 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -28.526 -1.273 -22.699 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -29.714 -0.248 -21.859 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -29.478 -1.937 -21.349 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -29.226 -3.108 -24.104 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -30.249 -3.803 -22.825 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -30.947 -3.433 -24.419 1.00 0.00 H new ATOM 819 N ALA A 54 -33.428 1.014 -23.641 1.00 0.00 N ATOM 820 CA ALA A 54 -33.631 2.220 -24.446 1.00 0.00 C ATOM 821 C ALA A 54 -33.714 3.489 -23.584 1.00 0.00 C ATOM 822 O ALA A 54 -32.899 4.405 -23.729 1.00 0.00 O ATOM 823 CB ALA A 54 -34.882 2.010 -25.312 1.00 0.00 C ATOM 0 H ALA A 54 -34.140 0.303 -23.810 1.00 0.00 H new ATOM 0 HA ALA A 54 -32.768 2.379 -25.093 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -35.055 2.896 -25.922 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -34.735 1.146 -25.960 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -35.745 1.838 -24.669 1.00 0.00 H new ATOM 829 N LYS A 55 -34.674 3.515 -22.642 1.00 0.00 N ATOM 830 CA LYS A 55 -34.773 4.550 -21.606 1.00 0.00 C ATOM 831 C LYS A 55 -33.476 4.652 -20.816 1.00 0.00 C ATOM 832 O LYS A 55 -33.032 5.761 -20.606 1.00 0.00 O ATOM 833 CB LYS A 55 -35.980 4.326 -20.675 1.00 0.00 C ATOM 834 CG LYS A 55 -36.366 5.637 -19.979 1.00 0.00 C ATOM 835 CD LYS A 55 -37.873 5.932 -19.965 1.00 0.00 C ATOM 836 CE LYS A 55 -38.468 6.045 -21.377 1.00 0.00 C ATOM 837 NZ LYS A 55 -39.891 6.474 -21.335 1.00 0.00 N ATOM 0 H LYS A 55 -35.408 2.810 -22.581 1.00 0.00 H new ATOM 0 HA LYS A 55 -34.938 5.501 -22.113 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -36.826 3.949 -21.250 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -35.737 3.568 -19.930 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -36.005 5.608 -18.951 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -35.852 6.461 -20.474 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -38.389 5.141 -19.420 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -38.052 6.861 -19.424 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -37.888 6.760 -21.961 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -38.392 5.083 -21.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -40.406 6.048 -22.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -40.321 6.164 -20.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -39.943 7.510 -21.403 1.00 0.00 H new ATOM 851 N ALA A 56 -32.849 3.546 -20.401 1.00 0.00 N ATOM 852 CA ALA A 56 -31.585 3.561 -19.661 1.00 0.00 C ATOM 853 C ALA A 56 -30.465 4.329 -20.379 1.00 0.00 C ATOM 854 O ALA A 56 -29.877 5.215 -19.773 1.00 0.00 O ATOM 855 CB ALA A 56 -31.165 2.128 -19.313 1.00 0.00 C ATOM 0 H ALA A 56 -33.209 2.607 -20.572 1.00 0.00 H new ATOM 0 HA ALA A 56 -31.759 4.112 -18.737 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -30.224 2.148 -18.763 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -31.935 1.662 -18.698 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -31.037 1.554 -20.230 1.00 0.00 H new ATOM 861 N ARG A 57 -30.177 4.034 -21.653 1.00 0.00 N ATOM 862 CA ARG A 57 -29.275 4.791 -22.538 1.00 0.00 C ATOM 863 C ARG A 57 -29.652 6.274 -22.662 1.00 0.00 C ATOM 864 O ARG A 57 -28.806 7.144 -22.451 1.00 0.00 O ATOM 865 CB ARG A 57 -29.202 4.128 -23.934 1.00 0.00 C ATOM 866 CG ARG A 57 -28.719 2.667 -24.070 1.00 0.00 C ATOM 867 CD ARG A 57 -27.869 2.054 -22.944 1.00 0.00 C ATOM 868 NE ARG A 57 -26.704 2.864 -22.539 1.00 0.00 N ATOM 869 CZ ARG A 57 -25.617 3.179 -23.216 1.00 0.00 C ATOM 870 NH1 ARG A 57 -25.397 2.792 -24.439 1.00 0.00 N ATOM 871 NH2 ARG A 57 -24.717 3.913 -22.634 1.00 0.00 N ATOM 0 H ARG A 57 -30.584 3.223 -22.119 1.00 0.00 H new ATOM 0 HA ARG A 57 -28.289 4.762 -22.073 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -30.199 4.182 -24.371 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -28.549 4.744 -24.552 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -29.601 2.039 -24.195 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -28.143 2.595 -24.993 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -28.505 1.896 -22.073 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -27.518 1.073 -23.265 1.00 0.00 H new ATOM 0 HE ARG A 57 -26.746 3.237 -21.591 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -26.085 2.214 -24.923 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -24.537 3.066 -24.914 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -24.860 4.231 -21.676 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -23.867 4.171 -23.135 1.00 0.00 H new ATOM 885 N ALA A 58 -30.906 6.562 -23.017 1.00 0.00 N ATOM 886 CA ALA A 58 -31.434 7.927 -23.128 1.00 0.00 C ATOM 887 C ALA A 58 -31.251 8.733 -21.827 1.00 0.00 C ATOM 888 O ALA A 58 -30.670 9.818 -21.814 1.00 0.00 O ATOM 889 CB ALA A 58 -32.901 7.856 -23.563 1.00 0.00 C ATOM 0 H ALA A 58 -31.595 5.844 -23.239 1.00 0.00 H new ATOM 0 HA ALA A 58 -30.864 8.466 -23.884 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -33.304 8.865 -23.649 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -32.970 7.354 -24.528 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -33.474 7.298 -22.822 1.00 0.00 H new ATOM 895 N ALA A 59 -31.703 8.135 -20.724 1.00 0.00 N ATOM 896 CA ALA A 59 -31.520 8.570 -19.346 1.00 0.00 C ATOM 897 C ALA A 59 -30.053 8.796 -18.998 1.00 0.00 C ATOM 898 O ALA A 59 -29.729 9.847 -18.476 1.00 0.00 O ATOM 899 CB ALA A 59 -32.119 7.524 -18.391 1.00 0.00 C ATOM 0 H ALA A 59 -32.245 7.273 -20.778 1.00 0.00 H new ATOM 0 HA ALA A 59 -32.034 9.525 -19.235 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -31.981 7.851 -17.360 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -33.183 7.411 -18.597 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -31.617 6.567 -18.538 1.00 0.00 H new ATOM 905 N GLN A 60 -29.166 7.850 -19.291 1.00 0.00 N ATOM 906 CA GLN A 60 -27.724 7.944 -19.060 1.00 0.00 C ATOM 907 C GLN A 60 -27.119 9.193 -19.723 1.00 0.00 C ATOM 908 O GLN A 60 -26.452 9.989 -19.052 1.00 0.00 O ATOM 909 CB GLN A 60 -27.084 6.634 -19.564 1.00 0.00 C ATOM 910 CG GLN A 60 -26.900 5.619 -18.427 1.00 0.00 C ATOM 911 CD GLN A 60 -26.270 4.309 -18.898 1.00 0.00 C ATOM 912 OE1 GLN A 60 -26.004 4.084 -20.072 1.00 0.00 O ATOM 913 NE2 GLN A 60 -25.990 3.387 -18.004 1.00 0.00 N ATOM 0 H GLN A 60 -29.440 6.962 -19.712 1.00 0.00 H new ATOM 0 HA GLN A 60 -27.518 8.062 -17.996 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -27.710 6.199 -20.343 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -26.117 6.852 -20.017 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -26.274 6.059 -17.651 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -27.869 5.409 -17.974 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -26.202 3.550 -17.020 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -25.561 2.508 -18.295 1.00 0.00 H new ATOM 922 N SER A 61 -27.402 9.393 -21.015 1.00 0.00 N ATOM 923 CA SER A 61 -27.053 10.617 -21.750 1.00 0.00 C ATOM 924 C SER A 61 -27.600 11.889 -21.083 1.00 0.00 C ATOM 925 O SER A 61 -26.833 12.799 -20.751 1.00 0.00 O ATOM 926 CB SER A 61 -27.515 10.493 -23.206 1.00 0.00 C ATOM 927 OG SER A 61 -26.920 11.505 -23.998 1.00 0.00 O ATOM 0 H SER A 61 -27.886 8.702 -21.588 1.00 0.00 H new ATOM 0 HA SER A 61 -25.968 10.721 -21.731 1.00 0.00 H new ATOM 0 HB2 SER A 61 -27.248 9.511 -23.597 1.00 0.00 H new ATOM 0 HB3 SER A 61 -28.601 10.572 -23.258 1.00 0.00 H new ATOM 0 HG SER A 61 -27.500 12.295 -24.010 1.00 0.00 H new ATOM 933 N ALA A 62 -28.913 11.931 -20.824 1.00 0.00 N ATOM 934 CA ALA A 62 -29.590 13.033 -20.144 1.00 0.00 C ATOM 935 C ALA A 62 -28.981 13.362 -18.766 1.00 0.00 C ATOM 936 O ALA A 62 -28.548 14.491 -18.558 1.00 0.00 O ATOM 937 CB ALA A 62 -31.086 12.710 -20.059 1.00 0.00 C ATOM 0 H ALA A 62 -29.547 11.178 -21.090 1.00 0.00 H new ATOM 0 HA ALA A 62 -29.448 13.942 -20.729 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -31.606 13.524 -19.553 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -31.490 12.590 -21.064 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -31.227 11.786 -19.499 1.00 0.00 H new ATOM 943 N LEU A 63 -28.898 12.379 -17.861 1.00 0.00 N ATOM 944 CA LEU A 63 -28.317 12.442 -16.513 1.00 0.00 C ATOM 945 C LEU A 63 -26.924 13.061 -16.559 1.00 0.00 C ATOM 946 O LEU A 63 -26.708 14.113 -15.958 1.00 0.00 O ATOM 947 CB LEU A 63 -28.231 11.023 -15.891 1.00 0.00 C ATOM 948 CG LEU A 63 -29.423 10.522 -15.049 1.00 0.00 C ATOM 949 CD1 LEU A 63 -30.763 11.167 -15.372 1.00 0.00 C ATOM 950 CD2 LEU A 63 -29.567 9.003 -15.151 1.00 0.00 C ATOM 0 H LEU A 63 -29.262 11.449 -18.067 1.00 0.00 H new ATOM 0 HA LEU A 63 -28.964 13.065 -15.896 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -28.075 10.313 -16.703 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -27.341 10.989 -15.262 1.00 0.00 H new ATOM 0 HG LEU A 63 -29.174 10.824 -14.032 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -31.534 10.747 -14.726 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -30.698 12.243 -15.207 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -31.018 10.974 -16.414 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -30.414 8.677 -14.548 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -29.732 8.722 -16.191 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -28.657 8.526 -14.786 1.00 0.00 H new ATOM 962 N ALA A 64 -26.001 12.440 -17.304 1.00 0.00 N ATOM 963 CA ALA A 64 -24.636 12.937 -17.427 1.00 0.00 C ATOM 964 C ALA A 64 -24.621 14.404 -17.888 1.00 0.00 C ATOM 965 O ALA A 64 -23.985 15.244 -17.250 1.00 0.00 O ATOM 966 CB ALA A 64 -23.858 12.021 -18.379 1.00 0.00 C ATOM 0 H ALA A 64 -26.183 11.586 -17.832 1.00 0.00 H new ATOM 0 HA ALA A 64 -24.148 12.919 -16.453 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -22.835 12.384 -18.478 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -23.846 11.007 -17.980 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -24.339 12.020 -19.357 1.00 0.00 H new ATOM 972 N THR A 65 -25.364 14.718 -18.954 1.00 0.00 N ATOM 973 CA THR A 65 -25.549 16.082 -19.468 1.00 0.00 C ATOM 974 C THR A 65 -26.078 17.074 -18.426 1.00 0.00 C ATOM 975 O THR A 65 -25.336 17.966 -18.011 1.00 0.00 O ATOM 976 CB THR A 65 -26.409 16.102 -20.740 1.00 0.00 C ATOM 977 OG1 THR A 65 -25.857 15.239 -21.711 1.00 0.00 O ATOM 978 CG2 THR A 65 -26.448 17.500 -21.355 1.00 0.00 C ATOM 0 H THR A 65 -25.866 14.016 -19.497 1.00 0.00 H new ATOM 0 HA THR A 65 -24.548 16.427 -19.727 1.00 0.00 H new ATOM 0 HB THR A 65 -27.413 15.787 -20.456 1.00 0.00 H new ATOM 0 HG1 THR A 65 -26.100 14.313 -21.501 1.00 0.00 H new ATOM 0 HG21 THR A 65 -27.064 17.485 -22.254 1.00 0.00 H new ATOM 0 HG22 THR A 65 -26.872 18.202 -20.637 1.00 0.00 H new ATOM 0 HG23 THR A 65 -25.436 17.812 -21.614 1.00 0.00 H new ATOM 986 N VAL A 66 -27.358 16.984 -18.031 1.00 0.00 N ATOM 987 CA VAL A 66 -27.969 17.945 -17.097 1.00 0.00 C ATOM 988 C VAL A 66 -27.217 18.079 -15.772 1.00 0.00 C ATOM 989 O VAL A 66 -26.976 19.192 -15.308 1.00 0.00 O ATOM 990 CB VAL A 66 -29.489 17.784 -16.882 1.00 0.00 C ATOM 991 CG1 VAL A 66 -30.256 18.112 -18.168 1.00 0.00 C ATOM 992 CG2 VAL A 66 -29.981 16.427 -16.364 1.00 0.00 C ATOM 0 H VAL A 66 -27.994 16.251 -18.346 1.00 0.00 H new ATOM 0 HA VAL A 66 -27.858 18.893 -17.623 1.00 0.00 H new ATOM 0 HB VAL A 66 -29.694 18.493 -16.080 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -31.325 17.992 -17.994 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -30.049 19.141 -18.463 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -29.940 17.436 -18.963 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -31.066 16.450 -16.258 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -29.702 15.645 -17.070 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -29.526 16.221 -15.395 1.00 0.00 H new ATOM 1002 N PHE A 67 -26.830 16.971 -15.141 1.00 0.00 N ATOM 1003 CA PHE A 67 -26.012 16.998 -13.928 1.00 0.00 C ATOM 1004 C PHE A 67 -24.640 17.685 -14.097 1.00 0.00 C ATOM 1005 O PHE A 67 -24.253 18.460 -13.225 1.00 0.00 O ATOM 1006 CB PHE A 67 -25.891 15.609 -13.314 1.00 0.00 C ATOM 1007 CG PHE A 67 -27.187 14.845 -13.023 1.00 0.00 C ATOM 1008 CD1 PHE A 67 -28.451 15.469 -13.083 1.00 0.00 C ATOM 1009 CD2 PHE A 67 -27.133 13.470 -12.717 1.00 0.00 C ATOM 1010 CE1 PHE A 67 -29.630 14.723 -12.954 1.00 0.00 C ATOM 1011 CE2 PHE A 67 -28.317 12.733 -12.513 1.00 0.00 C ATOM 1012 CZ PHE A 67 -29.573 13.348 -12.674 1.00 0.00 C ATOM 0 H PHE A 67 -27.074 16.032 -15.455 1.00 0.00 H new ATOM 0 HA PHE A 67 -26.549 17.635 -13.225 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -25.284 14.998 -13.982 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -25.339 15.702 -12.379 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -28.511 16.537 -13.231 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -26.175 12.977 -12.638 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -30.588 15.208 -13.071 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -28.260 11.692 -12.232 1.00 0.00 H new ATOM 0 HZ PHE A 67 -30.481 12.770 -12.583 1.00 0.00 H new ATOM 1022 N ASN A 68 -23.884 17.416 -15.175 1.00 0.00 N ATOM 1023 CA ASN A 68 -22.685 18.194 -15.544 1.00 0.00 C ATOM 1024 C ASN A 68 -22.947 19.708 -15.706 1.00 0.00 C ATOM 1025 O ASN A 68 -22.137 20.538 -15.294 1.00 0.00 O ATOM 1026 CB ASN A 68 -22.029 17.581 -16.794 1.00 0.00 C ATOM 1027 CG ASN A 68 -20.777 18.327 -17.225 1.00 0.00 C ATOM 1028 OD1 ASN A 68 -20.730 18.966 -18.267 1.00 0.00 O ATOM 1029 ND2 ASN A 68 -19.722 18.279 -16.439 1.00 0.00 N ATOM 0 H ASN A 68 -24.086 16.651 -15.818 1.00 0.00 H new ATOM 0 HA ASN A 68 -21.989 18.126 -14.708 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -21.776 16.540 -16.593 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -22.748 17.581 -17.614 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -18.869 18.774 -16.700 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -19.758 17.747 -15.569 1.00 0.00 H new ATOM 1036 N LEU A 69 -24.094 20.065 -16.292 1.00 0.00 N ATOM 1037 CA LEU A 69 -24.653 21.425 -16.321 1.00 0.00 C ATOM 1038 C LEU A 69 -24.986 21.953 -14.900 1.00 0.00 C ATOM 1039 O LEU A 69 -24.897 23.155 -14.648 1.00 0.00 O ATOM 1040 CB LEU A 69 -25.862 21.387 -17.291 1.00 0.00 C ATOM 1041 CG LEU A 69 -27.082 22.246 -16.924 1.00 0.00 C ATOM 1042 CD1 LEU A 69 -26.820 23.731 -17.211 1.00 0.00 C ATOM 1043 CD2 LEU A 69 -28.294 21.883 -17.784 1.00 0.00 C ATOM 0 H LEU A 69 -24.683 19.390 -16.779 1.00 0.00 H new ATOM 0 HA LEU A 69 -23.924 22.148 -16.688 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -25.515 21.697 -18.277 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -26.192 20.352 -17.380 1.00 0.00 H new ATOM 0 HG LEU A 69 -27.267 22.063 -15.866 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -27.700 24.314 -16.942 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -25.966 24.070 -16.624 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -26.607 23.865 -18.272 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -29.141 22.508 -17.501 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -28.057 22.048 -18.835 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -28.549 20.834 -17.630 1.00 0.00 H new ATOM 1055 N HIS A 70 -25.333 21.053 -13.977 1.00 0.00 N ATOM 1056 CA HIS A 70 -25.815 21.279 -12.605 1.00 0.00 C ATOM 1057 C HIS A 70 -27.292 21.729 -12.546 1.00 0.00 C ATOM 1058 O HIS A 70 -27.656 22.670 -11.832 1.00 0.00 O ATOM 1059 CB HIS A 70 -24.825 22.088 -11.741 1.00 0.00 C ATOM 1060 CG HIS A 70 -23.473 21.427 -11.608 1.00 0.00 C ATOM 1061 ND1 HIS A 70 -23.148 20.408 -10.739 1.00 0.00 N ATOM 1062 CD2 HIS A 70 -22.345 21.708 -12.333 1.00 0.00 C ATOM 1063 CE1 HIS A 70 -21.862 20.074 -10.941 1.00 0.00 C ATOM 1064 NE2 HIS A 70 -21.322 20.850 -11.899 1.00 0.00 N ATOM 0 H HIS A 70 -25.280 20.056 -14.186 1.00 0.00 H new ATOM 0 HA HIS A 70 -25.834 20.306 -12.114 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -24.697 23.078 -12.178 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -25.252 22.231 -10.748 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -22.258 22.459 -13.104 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -21.337 19.294 -10.410 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -20.362 20.821 -12.241 1.00 0.00 H new ATOM 1072 N LEU A 71 -28.145 21.011 -13.294 1.00 0.00 N ATOM 1073 CA LEU A 71 -29.616 21.078 -13.291 1.00 0.00 C ATOM 1074 C LEU A 71 -30.206 19.742 -12.794 1.00 0.00 C ATOM 1075 O LEU A 71 -29.914 18.689 -13.401 1.00 0.00 O ATOM 1076 CB LEU A 71 -30.079 21.495 -14.710 1.00 0.00 C ATOM 1077 CG LEU A 71 -31.582 21.697 -14.983 1.00 0.00 C ATOM 1078 CD1 LEU A 71 -32.389 20.401 -15.061 1.00 0.00 C ATOM 1079 CD2 LEU A 71 -32.227 22.631 -13.961 1.00 0.00 C ATOM 1080 OXT LEU A 71 -30.914 19.760 -11.761 1.00 0.00 O ATOM 0 H LEU A 71 -27.802 20.321 -13.963 1.00 0.00 H new ATOM 0 HA LEU A 71 -29.988 21.829 -12.594 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -29.572 22.427 -14.959 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -29.718 20.740 -15.408 1.00 0.00 H new ATOM 0 HG LEU A 71 -31.613 22.154 -15.972 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -33.436 20.635 -15.256 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -32.001 19.778 -15.867 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -32.307 19.864 -14.116 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -33.286 22.746 -14.191 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -32.116 22.210 -12.962 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -31.740 23.605 -14.000 1.00 0.00 H new TER 1092 LEU A 71