USER MOD reduce.3.24.130724 H: found=0, std=0, add=843, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 844 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 90 TYR OH : rot 53:sc= 1.33 USER MOD Set 1.2: A 121 TYR OH : rot -86:sc= 1.35 USER MOD Set 2.1: A 56 GLN : amide:sc= 0.0242 K(o=-0.55,f=-1.4) USER MOD Set 2.2: A 58 GLN : amide:sc= -0.576 K(o=-0.55,f=-2) USER MOD Set 3.1: A 31 ASN : amide:sc= 1.04 K(o=1.6,f=-4.1!) USER MOD Set 3.2: A 52 SER OG : rot 180:sc= 0.566 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.0456 K(o=-0.046,f=-0.73) USER MOD Single : A 48 SER OG : rot -86:sc= 1.25 USER MOD Single : A 50 GLN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 55 GLN : amide:sc= 0.712 K(o=0.71,f=-1.5) USER MOD Single : A 59 HIS : no HD1:sc= -0.327 X(o=-0.33,f=-0.13) USER MOD Single : A 60 MET CE :methyl -103:sc= -0.255 (180deg=-1.05) USER MOD Single : A 74 HIS : no HE2:sc= -1.36! C(o=-1.4!,f=-4.9!) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -104:sc= 1.29 (180deg=-0.76) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0.0904 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -118:sc= -0.552 (180deg=-1.09) USER MOD Single : A 105 LYS NZ :NH3+ -167:sc= 1.3 (180deg=1.09) USER MOD Single : A 107 THR OG1 : rot -92:sc= 1.06 USER MOD Single : A 112 ASN : amide:sc= -0.655 K(o=-0.66,f=-5.2!) USER MOD Single : A 114 THR OG1 : rot -82:sc= 1.26 USER MOD Single : A 120 SER OG : rot 180:sc= 0.129 USER MOD Single : A 122 HIS :FLIP no HD1:sc= -0.161 F(o=-0.82,f=-0.16) USER MOD Single : A 126 LYS NZ :NH3+ -169:sc= 1.26 (180deg=1.1) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 HIS :FLIP no HD1:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 136 THR OG1 : rot -62:sc= 0.994 USER MOD Single : A 139 LYS NZ :NH3+ -154:sc= 2.12 (180deg=0.825) USER MOD Single : A 141 THR OG1 : rot -6:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 57 N PRO A 27 6.088 -8.516 -7.916 1.00 0.00 N ATOM 58 CA PRO A 27 5.586 -9.695 -8.587 1.00 0.00 C ATOM 59 C PRO A 27 5.905 -10.975 -7.818 1.00 0.00 C ATOM 60 O PRO A 27 5.162 -11.370 -6.916 1.00 0.00 O ATOM 61 CB PRO A 27 6.322 -9.657 -9.932 1.00 0.00 C ATOM 62 CG PRO A 27 7.529 -8.781 -9.733 1.00 0.00 C ATOM 63 CD PRO A 27 7.454 -8.203 -8.341 1.00 0.00 C ATOM 0 HA PRO A 27 4.500 -9.697 -8.682 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.617 -10.660 -10.241 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.678 -9.258 -10.716 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.445 -9.358 -9.858 1.00 0.00 H new ATOM 0 HG3 PRO A 27 7.550 -7.985 -10.477 1.00 0.00 H new ATOM 0 HD2 PRO A 27 8.194 -8.653 -7.679 1.00 0.00 H new ATOM 0 HD3 PRO A 27 7.638 -7.129 -8.342 1.00 0.00 H new ATOM 71 N PHE A 28 7.011 -11.609 -8.175 1.00 0.00 N ATOM 72 CA PHE A 28 7.449 -12.830 -7.529 1.00 0.00 C ATOM 73 C PHE A 28 8.950 -12.983 -7.726 1.00 0.00 C ATOM 74 O PHE A 28 9.537 -12.287 -8.555 1.00 0.00 O ATOM 75 CB PHE A 28 6.689 -14.041 -8.102 1.00 0.00 C ATOM 76 CG PHE A 28 7.378 -14.728 -9.252 1.00 0.00 C ATOM 77 CD1 PHE A 28 7.361 -14.172 -10.522 1.00 0.00 C ATOM 78 CD2 PHE A 28 8.042 -15.930 -9.060 1.00 0.00 C ATOM 79 CE1 PHE A 28 7.996 -14.801 -11.576 1.00 0.00 C ATOM 80 CE2 PHE A 28 8.677 -16.563 -10.111 1.00 0.00 C ATOM 81 CZ PHE A 28 8.654 -15.998 -11.371 1.00 0.00 C ATOM 0 H PHE A 28 7.628 -11.289 -8.921 1.00 0.00 H new ATOM 0 HA PHE A 28 7.234 -12.780 -6.462 1.00 0.00 H new ATOM 0 HB2 PHE A 28 6.533 -14.766 -7.303 1.00 0.00 H new ATOM 0 HB3 PHE A 28 5.703 -13.712 -8.431 1.00 0.00 H new ATOM 0 HD1 PHE A 28 6.846 -13.238 -10.689 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.063 -16.377 -8.077 1.00 0.00 H new ATOM 0 HE1 PHE A 28 7.978 -14.357 -12.560 1.00 0.00 H new ATOM 0 HE2 PHE A 28 9.191 -17.499 -9.947 1.00 0.00 H new ATOM 0 HZ PHE A 28 9.149 -16.491 -12.194 1.00 0.00 H new ATOM 91 N ILE A 29 9.569 -13.866 -6.961 1.00 0.00 N ATOM 92 CA ILE A 29 10.992 -14.128 -7.109 1.00 0.00 C ATOM 93 C ILE A 29 11.263 -15.622 -7.096 1.00 0.00 C ATOM 94 O ILE A 29 10.403 -16.419 -6.708 1.00 0.00 O ATOM 95 CB ILE A 29 11.843 -13.476 -5.998 1.00 0.00 C ATOM 96 CG1 ILE A 29 11.244 -13.764 -4.619 1.00 0.00 C ATOM 97 CG2 ILE A 29 11.967 -11.976 -6.223 1.00 0.00 C ATOM 98 CD1 ILE A 29 12.262 -14.243 -3.603 1.00 0.00 C ATOM 0 H ILE A 29 9.110 -14.413 -6.232 1.00 0.00 H new ATOM 0 HA ILE A 29 11.278 -13.689 -8.065 1.00 0.00 H new ATOM 0 HB ILE A 29 12.842 -13.911 -6.037 1.00 0.00 H new ATOM 0 HG12 ILE A 29 10.766 -12.859 -4.243 1.00 0.00 H new ATOM 0 HG13 ILE A 29 10.463 -14.518 -4.722 1.00 0.00 H new ATOM 0 HG21 ILE A 29 12.571 -11.538 -5.428 1.00 0.00 H new ATOM 0 HG22 ILE A 29 12.444 -11.791 -7.185 1.00 0.00 H new ATOM 0 HG23 ILE A 29 10.975 -11.524 -6.217 1.00 0.00 H new ATOM 0 HD11 ILE A 29 11.766 -14.427 -2.650 1.00 0.00 H new ATOM 0 HD12 ILE A 29 12.723 -15.166 -3.957 1.00 0.00 H new ATOM 0 HD13 ILE A 29 13.030 -13.481 -3.471 1.00 0.00 H new ATOM 110 N VAL A 30 12.460 -15.987 -7.513 1.00 0.00 N ATOM 111 CA VAL A 30 12.890 -17.370 -7.488 1.00 0.00 C ATOM 112 C VAL A 30 13.582 -17.661 -6.163 1.00 0.00 C ATOM 113 O VAL A 30 14.504 -16.950 -5.764 1.00 0.00 O ATOM 114 CB VAL A 30 13.847 -17.684 -8.656 1.00 0.00 C ATOM 115 CG1 VAL A 30 14.373 -19.110 -8.567 1.00 0.00 C ATOM 116 CG2 VAL A 30 13.156 -17.462 -9.992 1.00 0.00 C ATOM 0 H VAL A 30 13.157 -15.337 -7.876 1.00 0.00 H new ATOM 0 HA VAL A 30 12.010 -18.004 -7.596 1.00 0.00 H new ATOM 0 HB VAL A 30 14.694 -17.002 -8.583 1.00 0.00 H new ATOM 0 HG11 VAL A 30 15.045 -19.303 -9.403 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.914 -19.241 -7.630 1.00 0.00 H new ATOM 0 HG13 VAL A 30 13.537 -19.809 -8.604 1.00 0.00 H new ATOM 0 HG21 VAL A 30 13.849 -17.689 -10.802 1.00 0.00 H new ATOM 0 HG22 VAL A 30 12.286 -18.115 -10.065 1.00 0.00 H new ATOM 0 HG23 VAL A 30 12.837 -16.423 -10.068 1.00 0.00 H new ATOM 126 N ASN A 31 13.129 -18.699 -5.490 1.00 0.00 N ATOM 127 CA ASN A 31 13.629 -19.032 -4.167 1.00 0.00 C ATOM 128 C ASN A 31 14.474 -20.296 -4.218 1.00 0.00 C ATOM 129 O ASN A 31 14.649 -20.898 -5.282 1.00 0.00 O ATOM 130 CB ASN A 31 12.459 -19.223 -3.197 1.00 0.00 C ATOM 131 CG ASN A 31 12.710 -18.589 -1.843 1.00 0.00 C ATOM 132 OD1 ASN A 31 13.711 -18.872 -1.183 1.00 0.00 O ATOM 133 ND2 ASN A 31 11.797 -17.729 -1.416 1.00 0.00 N ATOM 0 H ASN A 31 12.410 -19.332 -5.839 1.00 0.00 H new ATOM 0 HA ASN A 31 14.254 -18.211 -3.816 1.00 0.00 H new ATOM 0 HB2 ASN A 31 11.557 -18.793 -3.633 1.00 0.00 H new ATOM 0 HB3 ASN A 31 12.272 -20.289 -3.065 1.00 0.00 H new ATOM 0 HD21 ASN A 31 11.909 -17.274 -0.510 1.00 0.00 H new ATOM 0 HD22 ASN A 31 10.982 -17.522 -1.993 1.00 0.00 H new ATOM 140 N GLY A 32 14.994 -20.695 -3.068 1.00 0.00 N ATOM 141 CA GLY A 32 15.782 -21.902 -2.988 1.00 0.00 C ATOM 142 C GLY A 32 17.241 -21.611 -2.728 1.00 0.00 C ATOM 143 O GLY A 32 17.573 -20.796 -1.864 1.00 0.00 O ATOM 0 H GLY A 32 14.882 -20.199 -2.184 1.00 0.00 H new ATOM 0 HA2 GLY A 32 15.392 -22.537 -2.193 1.00 0.00 H new ATOM 0 HA3 GLY A 32 15.684 -22.461 -3.919 1.00 0.00 H new ATOM 147 N LEU A 33 18.109 -22.266 -3.476 1.00 0.00 N ATOM 148 CA LEU A 33 19.544 -22.111 -3.305 1.00 0.00 C ATOM 149 C LEU A 33 20.133 -21.396 -4.512 1.00 0.00 C ATOM 150 O LEU A 33 19.433 -21.152 -5.496 1.00 0.00 O ATOM 151 CB LEU A 33 20.204 -23.485 -3.137 1.00 0.00 C ATOM 152 CG LEU A 33 20.644 -23.849 -1.711 1.00 0.00 C ATOM 153 CD1 LEU A 33 19.618 -23.393 -0.686 1.00 0.00 C ATOM 154 CD2 LEU A 33 20.872 -25.348 -1.593 1.00 0.00 C ATOM 0 H LEU A 33 17.843 -22.917 -4.215 1.00 0.00 H new ATOM 0 HA LEU A 33 19.733 -21.517 -2.411 1.00 0.00 H new ATOM 0 HB2 LEU A 33 19.507 -24.246 -3.487 1.00 0.00 H new ATOM 0 HB3 LEU A 33 21.077 -23.529 -3.788 1.00 0.00 H new ATOM 0 HG LEU A 33 21.581 -23.331 -1.507 1.00 0.00 H new ATOM 0 HD11 LEU A 33 19.957 -23.665 0.314 1.00 0.00 H new ATOM 0 HD12 LEU A 33 19.498 -22.311 -0.747 1.00 0.00 H new ATOM 0 HD13 LEU A 33 18.662 -23.876 -0.889 1.00 0.00 H new ATOM 0 HD21 LEU A 33 21.183 -25.590 -0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 33 19.947 -25.876 -1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 33 21.649 -25.654 -2.293 1.00 0.00 H new ATOM 166 N GLU A 34 21.413 -21.050 -4.438 1.00 0.00 N ATOM 167 CA GLU A 34 22.099 -20.464 -5.582 1.00 0.00 C ATOM 168 C GLU A 34 22.259 -21.518 -6.670 1.00 0.00 C ATOM 169 O GLU A 34 22.287 -21.210 -7.862 1.00 0.00 O ATOM 170 CB GLU A 34 23.464 -19.895 -5.175 1.00 0.00 C ATOM 171 CG GLU A 34 24.500 -20.951 -4.818 1.00 0.00 C ATOM 172 CD GLU A 34 24.580 -21.210 -3.331 1.00 0.00 C ATOM 173 OE1 GLU A 34 23.666 -21.869 -2.786 1.00 0.00 O ATOM 174 OE2 GLU A 34 25.557 -20.757 -2.695 1.00 0.00 O ATOM 0 H GLU A 34 21.992 -21.164 -3.606 1.00 0.00 H new ATOM 0 HA GLU A 34 21.500 -19.638 -5.966 1.00 0.00 H new ATOM 0 HB2 GLU A 34 23.849 -19.286 -5.993 1.00 0.00 H new ATOM 0 HB3 GLU A 34 23.328 -19.232 -4.321 1.00 0.00 H new ATOM 0 HG2 GLU A 34 24.257 -21.881 -5.332 1.00 0.00 H new ATOM 0 HG3 GLU A 34 25.477 -20.632 -5.180 1.00 0.00 H new ATOM 181 N GLY A 35 22.356 -22.768 -6.239 1.00 0.00 N ATOM 182 CA GLY A 35 22.378 -23.875 -7.165 1.00 0.00 C ATOM 183 C GLY A 35 23.668 -24.670 -7.121 1.00 0.00 C ATOM 184 O GLY A 35 24.472 -24.593 -8.045 1.00 0.00 O ATOM 0 H GLY A 35 22.420 -23.033 -5.256 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.542 -24.540 -6.945 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.227 -23.497 -8.176 1.00 0.00 H new ATOM 188 N PRO A 36 23.892 -25.461 -6.060 1.00 0.00 N ATOM 189 CA PRO A 36 25.044 -26.352 -5.976 1.00 0.00 C ATOM 190 C PRO A 36 24.779 -27.664 -6.711 1.00 0.00 C ATOM 191 O PRO A 36 24.932 -28.752 -6.155 1.00 0.00 O ATOM 192 CB PRO A 36 25.187 -26.582 -4.473 1.00 0.00 C ATOM 193 CG PRO A 36 23.798 -26.478 -3.937 1.00 0.00 C ATOM 194 CD PRO A 36 23.041 -25.552 -4.858 1.00 0.00 C ATOM 0 HA PRO A 36 25.942 -25.940 -6.436 1.00 0.00 H new ATOM 0 HB2 PRO A 36 25.620 -27.560 -4.262 1.00 0.00 H new ATOM 0 HB3 PRO A 36 25.843 -25.838 -4.020 1.00 0.00 H new ATOM 0 HG2 PRO A 36 23.324 -27.459 -3.900 1.00 0.00 H new ATOM 0 HG3 PRO A 36 23.805 -26.089 -2.919 1.00 0.00 H new ATOM 0 HD2 PRO A 36 22.054 -25.948 -5.098 1.00 0.00 H new ATOM 0 HD3 PRO A 36 22.890 -24.573 -4.402 1.00 0.00 H new ATOM 202 N VAL A 37 24.368 -27.548 -7.968 1.00 0.00 N ATOM 203 CA VAL A 37 23.982 -28.706 -8.758 1.00 0.00 C ATOM 204 C VAL A 37 25.200 -29.454 -9.284 1.00 0.00 C ATOM 205 O VAL A 37 25.865 -29.017 -10.222 1.00 0.00 O ATOM 206 CB VAL A 37 23.067 -28.320 -9.942 1.00 0.00 C ATOM 207 CG1 VAL A 37 21.633 -28.138 -9.470 1.00 0.00 C ATOM 208 CG2 VAL A 37 23.562 -27.058 -10.637 1.00 0.00 C ATOM 0 H VAL A 37 24.294 -26.659 -8.462 1.00 0.00 H new ATOM 0 HA VAL A 37 23.424 -29.360 -8.088 1.00 0.00 H new ATOM 0 HB VAL A 37 23.097 -29.135 -10.666 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.003 -27.866 -10.317 1.00 0.00 H new ATOM 0 HG12 VAL A 37 21.273 -29.070 -9.034 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.594 -27.347 -8.721 1.00 0.00 H new ATOM 0 HG21 VAL A 37 22.897 -26.814 -11.465 1.00 0.00 H new ATOM 0 HG22 VAL A 37 23.575 -26.232 -9.926 1.00 0.00 H new ATOM 0 HG23 VAL A 37 24.570 -27.224 -11.018 1.00 0.00 H new ATOM 218 N LEU A 38 25.491 -30.583 -8.668 1.00 0.00 N ATOM 219 CA LEU A 38 26.563 -31.442 -9.126 1.00 0.00 C ATOM 220 C LEU A 38 26.004 -32.427 -10.138 1.00 0.00 C ATOM 221 O LEU A 38 24.906 -32.958 -9.954 1.00 0.00 O ATOM 222 CB LEU A 38 27.199 -32.184 -7.945 1.00 0.00 C ATOM 223 CG LEU A 38 27.321 -31.364 -6.659 1.00 0.00 C ATOM 224 CD1 LEU A 38 26.501 -31.995 -5.545 1.00 0.00 C ATOM 225 CD2 LEU A 38 28.777 -31.234 -6.243 1.00 0.00 C ATOM 0 H LEU A 38 24.997 -30.927 -7.845 1.00 0.00 H new ATOM 0 HA LEU A 38 27.339 -30.838 -9.597 1.00 0.00 H new ATOM 0 HB2 LEU A 38 26.609 -33.076 -7.735 1.00 0.00 H new ATOM 0 HB3 LEU A 38 28.193 -32.521 -8.239 1.00 0.00 H new ATOM 0 HG LEU A 38 26.930 -30.365 -6.851 1.00 0.00 H new ATOM 0 HD11 LEU A 38 26.600 -31.399 -4.638 1.00 0.00 H new ATOM 0 HD12 LEU A 38 25.453 -32.034 -5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 38 26.862 -33.006 -5.355 1.00 0.00 H new ATOM 0 HD21 LEU A 38 28.843 -30.648 -5.327 1.00 0.00 H new ATOM 0 HD22 LEU A 38 29.196 -32.225 -6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 38 29.338 -30.736 -7.034 1.00 0.00 H new ATOM 237 N ALA A 39 26.738 -32.654 -11.210 1.00 0.00 N ATOM 238 CA ALA A 39 26.271 -33.523 -12.270 1.00 0.00 C ATOM 239 C ALA A 39 27.359 -34.490 -12.697 1.00 0.00 C ATOM 240 O ALA A 39 28.517 -34.359 -12.296 1.00 0.00 O ATOM 241 CB ALA A 39 25.799 -32.704 -13.458 1.00 0.00 C ATOM 0 H ALA A 39 27.660 -32.248 -11.369 1.00 0.00 H new ATOM 0 HA ALA A 39 25.431 -34.102 -11.887 1.00 0.00 H new ATOM 0 HB1 ALA A 39 25.451 -33.372 -14.246 1.00 0.00 H new ATOM 0 HB2 ALA A 39 24.982 -32.052 -13.149 1.00 0.00 H new ATOM 0 HB3 ALA A 39 26.624 -32.099 -13.834 1.00 0.00 H new ATOM 247 N SER A 40 26.978 -35.449 -13.521 1.00 0.00 N ATOM 248 CA SER A 40 27.894 -36.459 -14.000 1.00 0.00 C ATOM 249 C SER A 40 27.985 -36.392 -15.513 1.00 0.00 C ATOM 250 O SER A 40 26.973 -36.200 -16.192 1.00 0.00 O ATOM 251 CB SER A 40 27.410 -37.839 -13.559 1.00 0.00 C ATOM 252 OG SER A 40 26.663 -37.749 -12.356 1.00 0.00 O ATOM 0 H SER A 40 26.026 -35.547 -13.874 1.00 0.00 H new ATOM 0 HA SER A 40 28.884 -36.281 -13.581 1.00 0.00 H new ATOM 0 HB2 SER A 40 26.795 -38.281 -14.342 1.00 0.00 H new ATOM 0 HB3 SER A 40 28.264 -38.500 -13.413 1.00 0.00 H new ATOM 0 HG SER A 40 26.361 -38.643 -12.091 1.00 0.00 H new ATOM 258 N LEU A 41 29.190 -36.524 -16.042 1.00 0.00 N ATOM 259 CA LEU A 41 29.384 -36.522 -17.480 1.00 0.00 C ATOM 260 C LEU A 41 28.733 -37.758 -18.085 1.00 0.00 C ATOM 261 O LEU A 41 29.178 -38.882 -17.857 1.00 0.00 O ATOM 262 CB LEU A 41 30.875 -36.483 -17.825 1.00 0.00 C ATOM 263 CG LEU A 41 31.363 -35.180 -18.462 1.00 0.00 C ATOM 264 CD1 LEU A 41 32.862 -35.030 -18.267 1.00 0.00 C ATOM 265 CD2 LEU A 41 31.011 -35.145 -19.942 1.00 0.00 C ATOM 0 H LEU A 41 30.046 -36.634 -15.498 1.00 0.00 H new ATOM 0 HA LEU A 41 28.917 -35.630 -17.897 1.00 0.00 H new ATOM 0 HB2 LEU A 41 31.447 -36.660 -16.914 1.00 0.00 H new ATOM 0 HB3 LEU A 41 31.096 -37.306 -18.505 1.00 0.00 H new ATOM 0 HG LEU A 41 30.863 -34.344 -17.972 1.00 0.00 H new ATOM 0 HD11 LEU A 41 33.197 -34.099 -18.725 1.00 0.00 H new ATOM 0 HD12 LEU A 41 33.090 -35.013 -17.201 1.00 0.00 H new ATOM 0 HD13 LEU A 41 33.376 -35.870 -18.735 1.00 0.00 H new ATOM 0 HD21 LEU A 41 31.366 -34.211 -20.378 1.00 0.00 H new ATOM 0 HD22 LEU A 41 31.485 -35.986 -20.449 1.00 0.00 H new ATOM 0 HD23 LEU A 41 29.930 -35.213 -20.061 1.00 0.00 H new ATOM 277 N GLY A 42 27.660 -37.544 -18.834 1.00 0.00 N ATOM 278 CA GLY A 42 26.898 -38.653 -19.374 1.00 0.00 C ATOM 279 C GLY A 42 25.955 -39.251 -18.344 1.00 0.00 C ATOM 280 O GLY A 42 25.348 -40.296 -18.572 1.00 0.00 O ATOM 0 H GLY A 42 27.303 -36.620 -19.078 1.00 0.00 H new ATOM 0 HA2 GLY A 42 26.324 -38.313 -20.236 1.00 0.00 H new ATOM 0 HA3 GLY A 42 27.582 -39.424 -19.730 1.00 0.00 H new ATOM 284 N GLY A 43 25.839 -38.582 -17.202 1.00 0.00 N ATOM 285 CA GLY A 43 24.964 -39.052 -16.148 1.00 0.00 C ATOM 286 C GLY A 43 23.685 -38.247 -16.074 1.00 0.00 C ATOM 287 O GLY A 43 23.196 -37.757 -17.089 1.00 0.00 O ATOM 0 H GLY A 43 26.339 -37.719 -16.988 1.00 0.00 H new ATOM 0 HA2 GLY A 43 24.723 -40.101 -16.318 1.00 0.00 H new ATOM 0 HA3 GLY A 43 25.484 -38.995 -15.192 1.00 0.00 H new ATOM 291 N ASN A 44 23.151 -38.095 -14.874 1.00 0.00 N ATOM 292 CA ASN A 44 21.908 -37.360 -14.683 1.00 0.00 C ATOM 293 C ASN A 44 22.176 -36.052 -13.944 1.00 0.00 C ATOM 294 O ASN A 44 23.053 -35.989 -13.080 1.00 0.00 O ATOM 295 CB ASN A 44 20.897 -38.229 -13.913 1.00 0.00 C ATOM 296 CG ASN A 44 20.133 -37.468 -12.838 1.00 0.00 C ATOM 297 OD1 ASN A 44 19.092 -36.871 -13.106 1.00 0.00 O ATOM 298 ND2 ASN A 44 20.642 -37.494 -11.614 1.00 0.00 N ATOM 0 H ASN A 44 23.557 -38.470 -14.017 1.00 0.00 H new ATOM 0 HA ASN A 44 21.483 -37.118 -15.657 1.00 0.00 H new ATOM 0 HB2 ASN A 44 20.185 -38.656 -14.620 1.00 0.00 H new ATOM 0 HB3 ASN A 44 21.425 -39.063 -13.450 1.00 0.00 H new ATOM 0 HD21 ASN A 44 20.167 -37.007 -10.854 1.00 0.00 H new ATOM 0 HD22 ASN A 44 21.508 -38.001 -11.433 1.00 0.00 H new ATOM 305 N LEU A 45 21.444 -35.011 -14.311 1.00 0.00 N ATOM 306 CA LEU A 45 21.539 -33.731 -13.628 1.00 0.00 C ATOM 307 C LEU A 45 20.155 -33.257 -13.206 1.00 0.00 C ATOM 308 O LEU A 45 19.274 -33.057 -14.045 1.00 0.00 O ATOM 309 CB LEU A 45 22.204 -32.691 -14.536 1.00 0.00 C ATOM 310 CG LEU A 45 21.937 -31.226 -14.177 1.00 0.00 C ATOM 311 CD1 LEU A 45 22.715 -30.823 -12.931 1.00 0.00 C ATOM 312 CD2 LEU A 45 22.297 -30.322 -15.347 1.00 0.00 C ATOM 0 H LEU A 45 20.775 -35.029 -15.081 1.00 0.00 H new ATOM 0 HA LEU A 45 22.153 -33.856 -12.736 1.00 0.00 H new ATOM 0 HB2 LEU A 45 23.281 -32.859 -14.521 1.00 0.00 H new ATOM 0 HB3 LEU A 45 21.869 -32.862 -15.559 1.00 0.00 H new ATOM 0 HG LEU A 45 20.874 -31.113 -13.963 1.00 0.00 H new ATOM 0 HD11 LEU A 45 22.509 -29.779 -12.696 1.00 0.00 H new ATOM 0 HD12 LEU A 45 22.411 -31.450 -12.093 1.00 0.00 H new ATOM 0 HD13 LEU A 45 23.782 -30.951 -13.111 1.00 0.00 H new ATOM 0 HD21 LEU A 45 22.102 -29.284 -15.078 1.00 0.00 H new ATOM 0 HD22 LEU A 45 23.353 -30.442 -15.588 1.00 0.00 H new ATOM 0 HD23 LEU A 45 21.694 -30.591 -16.214 1.00 0.00 H new ATOM 324 N GLU A 46 19.965 -33.095 -11.906 1.00 0.00 N ATOM 325 CA GLU A 46 18.702 -32.609 -11.376 1.00 0.00 C ATOM 326 C GLU A 46 18.816 -31.135 -11.019 1.00 0.00 C ATOM 327 O GLU A 46 19.468 -30.770 -10.038 1.00 0.00 O ATOM 328 CB GLU A 46 18.281 -33.413 -10.142 1.00 0.00 C ATOM 329 CG GLU A 46 16.777 -33.424 -9.910 1.00 0.00 C ATOM 330 CD GLU A 46 16.373 -32.756 -8.610 1.00 0.00 C ATOM 331 OE1 GLU A 46 16.501 -33.395 -7.540 1.00 0.00 O ATOM 332 OE2 GLU A 46 15.914 -31.597 -8.650 1.00 0.00 O ATOM 0 H GLU A 46 20.671 -33.294 -11.198 1.00 0.00 H new ATOM 0 HA GLU A 46 17.940 -32.734 -12.145 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.632 -34.439 -10.250 1.00 0.00 H new ATOM 0 HB3 GLU A 46 18.774 -32.998 -9.262 1.00 0.00 H new ATOM 0 HG2 GLU A 46 16.283 -32.919 -10.740 1.00 0.00 H new ATOM 0 HG3 GLU A 46 16.423 -34.455 -9.908 1.00 0.00 H new ATOM 339 N LEU A 47 18.197 -30.293 -11.825 1.00 0.00 N ATOM 340 CA LEU A 47 18.160 -28.873 -11.545 1.00 0.00 C ATOM 341 C LEU A 47 16.853 -28.535 -10.849 1.00 0.00 C ATOM 342 O LEU A 47 15.777 -28.878 -11.334 1.00 0.00 O ATOM 343 CB LEU A 47 18.285 -28.071 -12.840 1.00 0.00 C ATOM 344 CG LEU A 47 19.434 -28.485 -13.757 1.00 0.00 C ATOM 345 CD1 LEU A 47 18.943 -28.612 -15.191 1.00 0.00 C ATOM 346 CD2 LEU A 47 20.575 -27.482 -13.662 1.00 0.00 C ATOM 0 H LEU A 47 17.713 -30.570 -12.679 1.00 0.00 H new ATOM 0 HA LEU A 47 18.997 -28.613 -10.897 1.00 0.00 H new ATOM 0 HB2 LEU A 47 17.350 -28.159 -13.394 1.00 0.00 H new ATOM 0 HB3 LEU A 47 18.407 -27.018 -12.585 1.00 0.00 H new ATOM 0 HG LEU A 47 19.808 -29.457 -13.436 1.00 0.00 H new ATOM 0 HD11 LEU A 47 19.772 -28.908 -15.834 1.00 0.00 H new ATOM 0 HD12 LEU A 47 18.158 -29.366 -15.241 1.00 0.00 H new ATOM 0 HD13 LEU A 47 18.547 -27.653 -15.526 1.00 0.00 H new ATOM 0 HD21 LEU A 47 21.386 -27.791 -14.321 1.00 0.00 H new ATOM 0 HD22 LEU A 47 20.219 -26.496 -13.962 1.00 0.00 H new ATOM 0 HD23 LEU A 47 20.938 -27.440 -12.635 1.00 0.00 H new ATOM 358 N SER A 48 16.944 -27.864 -9.719 1.00 0.00 N ATOM 359 CA SER A 48 15.765 -27.558 -8.932 1.00 0.00 C ATOM 360 C SER A 48 15.661 -26.065 -8.659 1.00 0.00 C ATOM 361 O SER A 48 16.581 -25.454 -8.113 1.00 0.00 O ATOM 362 CB SER A 48 15.805 -28.332 -7.614 1.00 0.00 C ATOM 363 OG SER A 48 16.826 -29.319 -7.636 1.00 0.00 O ATOM 0 H SER A 48 17.820 -27.520 -9.325 1.00 0.00 H new ATOM 0 HA SER A 48 14.886 -27.859 -9.501 1.00 0.00 H new ATOM 0 HB2 SER A 48 15.978 -27.642 -6.788 1.00 0.00 H new ATOM 0 HB3 SER A 48 14.840 -28.806 -7.437 1.00 0.00 H new ATOM 0 HG SER A 48 16.478 -30.141 -8.041 1.00 0.00 H new ATOM 369 N CYS A 49 14.540 -25.486 -9.047 1.00 0.00 N ATOM 370 CA CYS A 49 14.271 -24.087 -8.763 1.00 0.00 C ATOM 371 C CYS A 49 13.032 -23.991 -7.887 1.00 0.00 C ATOM 372 O CYS A 49 12.073 -24.742 -8.075 1.00 0.00 O ATOM 373 CB CYS A 49 14.070 -23.294 -10.062 1.00 0.00 C ATOM 374 SG CYS A 49 15.477 -22.219 -10.508 1.00 0.00 S ATOM 0 H CYS A 49 13.799 -25.963 -9.561 1.00 0.00 H new ATOM 0 HA CYS A 49 15.125 -23.657 -8.240 1.00 0.00 H new ATOM 0 HB2 CYS A 49 13.889 -23.994 -10.878 1.00 0.00 H new ATOM 0 HB3 CYS A 49 13.175 -22.680 -9.965 1.00 0.00 H new ATOM 379 N GLN A 50 13.054 -23.093 -6.920 1.00 0.00 N ATOM 380 CA GLN A 50 11.932 -22.946 -6.014 1.00 0.00 C ATOM 381 C GLN A 50 11.256 -21.606 -6.229 1.00 0.00 C ATOM 382 O GLN A 50 11.844 -20.690 -6.800 1.00 0.00 O ATOM 383 CB GLN A 50 12.391 -23.082 -4.564 1.00 0.00 C ATOM 384 CG GLN A 50 12.067 -24.433 -3.950 1.00 0.00 C ATOM 385 CD GLN A 50 11.177 -24.317 -2.731 1.00 0.00 C ATOM 386 OE1 GLN A 50 11.650 -24.351 -1.598 1.00 0.00 O ATOM 387 NE2 GLN A 50 9.881 -24.187 -2.953 1.00 0.00 N ATOM 0 H GLN A 50 13.832 -22.458 -6.743 1.00 0.00 H new ATOM 0 HA GLN A 50 11.213 -23.738 -6.223 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.468 -22.918 -4.515 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.922 -22.299 -3.968 1.00 0.00 H new ATOM 0 HG2 GLN A 50 11.577 -25.059 -4.695 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.994 -24.934 -3.673 1.00 0.00 H new ATOM 0 HE21 GLN A 50 9.527 -24.163 -3.909 1.00 0.00 H new ATOM 0 HE22 GLN A 50 9.234 -24.111 -2.168 1.00 0.00 H new ATOM 396 N LEU A 51 10.020 -21.501 -5.789 1.00 0.00 N ATOM 397 CA LEU A 51 9.257 -20.284 -5.966 1.00 0.00 C ATOM 398 C LEU A 51 8.679 -19.807 -4.647 1.00 0.00 C ATOM 399 O LEU A 51 8.395 -20.614 -3.759 1.00 0.00 O ATOM 400 CB LEU A 51 8.111 -20.525 -6.949 1.00 0.00 C ATOM 401 CG LEU A 51 8.351 -20.037 -8.371 1.00 0.00 C ATOM 402 CD1 LEU A 51 8.934 -21.155 -9.220 1.00 0.00 C ATOM 403 CD2 LEU A 51 7.050 -19.526 -8.968 1.00 0.00 C ATOM 0 H LEU A 51 9.521 -22.247 -5.304 1.00 0.00 H new ATOM 0 HA LEU A 51 9.930 -19.520 -6.355 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.903 -21.594 -6.981 1.00 0.00 H new ATOM 0 HB3 LEU A 51 7.216 -20.037 -6.563 1.00 0.00 H new ATOM 0 HG LEU A 51 9.069 -19.217 -8.351 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.101 -20.792 -10.234 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.881 -21.481 -8.791 1.00 0.00 H new ATOM 0 HD13 LEU A 51 8.239 -21.994 -9.244 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.228 -19.178 -9.986 1.00 0.00 H new ATOM 0 HD22 LEU A 51 6.316 -20.331 -8.983 1.00 0.00 H new ATOM 0 HD23 LEU A 51 6.672 -18.701 -8.364 1.00 0.00 H new ATOM 415 N SER A 52 8.543 -18.499 -4.515 1.00 0.00 N ATOM 416 CA SER A 52 7.678 -17.927 -3.501 1.00 0.00 C ATOM 417 C SER A 52 6.302 -17.744 -4.133 1.00 0.00 C ATOM 418 O SER A 52 6.015 -16.701 -4.718 1.00 0.00 O ATOM 419 CB SER A 52 8.245 -16.596 -3.000 1.00 0.00 C ATOM 420 OG SER A 52 9.663 -16.578 -3.102 1.00 0.00 O ATOM 0 H SER A 52 9.022 -17.813 -5.099 1.00 0.00 H new ATOM 0 HA SER A 52 7.607 -18.583 -2.634 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.824 -15.775 -3.581 1.00 0.00 H new ATOM 0 HB3 SER A 52 7.949 -16.437 -1.963 1.00 0.00 H new ATOM 0 HG SER A 52 10.003 -15.718 -2.778 1.00 0.00 H new ATOM 426 N PRO A 53 5.448 -18.778 -4.032 1.00 0.00 N ATOM 427 CA PRO A 53 4.258 -18.928 -4.877 1.00 0.00 C ATOM 428 C PRO A 53 3.175 -17.887 -4.623 1.00 0.00 C ATOM 429 O PRO A 53 2.597 -17.826 -3.537 1.00 0.00 O ATOM 430 CB PRO A 53 3.727 -20.327 -4.522 1.00 0.00 C ATOM 431 CG PRO A 53 4.812 -20.985 -3.740 1.00 0.00 C ATOM 432 CD PRO A 53 5.554 -19.875 -3.062 1.00 0.00 C ATOM 0 HA PRO A 53 4.522 -18.794 -5.926 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.809 -20.261 -3.938 1.00 0.00 H new ATOM 0 HB3 PRO A 53 3.492 -20.896 -5.421 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.401 -21.683 -3.011 1.00 0.00 H new ATOM 0 HG3 PRO A 53 5.473 -21.557 -4.392 1.00 0.00 H new ATOM 0 HD2 PRO A 53 5.105 -19.613 -2.104 1.00 0.00 H new ATOM 0 HD3 PRO A 53 6.592 -20.143 -2.865 1.00 0.00 H new ATOM 440 N PRO A 54 2.904 -17.042 -5.629 1.00 0.00 N ATOM 441 CA PRO A 54 1.732 -16.172 -5.639 1.00 0.00 C ATOM 442 C PRO A 54 0.491 -16.968 -6.027 1.00 0.00 C ATOM 443 O PRO A 54 -0.613 -16.703 -5.556 1.00 0.00 O ATOM 444 CB PRO A 54 2.057 -15.119 -6.714 1.00 0.00 C ATOM 445 CG PRO A 54 3.467 -15.389 -7.136 1.00 0.00 C ATOM 446 CD PRO A 54 3.729 -16.833 -6.822 1.00 0.00 C ATOM 0 HA PRO A 54 1.526 -15.725 -4.666 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.374 -15.199 -7.559 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.954 -14.109 -6.316 1.00 0.00 H new ATOM 0 HG2 PRO A 54 3.599 -15.192 -8.200 1.00 0.00 H new ATOM 0 HG3 PRO A 54 4.164 -14.742 -6.603 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.434 -17.488 -7.642 1.00 0.00 H new ATOM 0 HD3 PRO A 54 4.784 -17.023 -6.626 1.00 0.00 H new ATOM 454 N GLN A 55 0.701 -17.959 -6.889 1.00 0.00 N ATOM 455 CA GLN A 55 -0.349 -18.875 -7.306 1.00 0.00 C ATOM 456 C GLN A 55 0.253 -20.258 -7.549 1.00 0.00 C ATOM 457 O GLN A 55 1.429 -20.479 -7.262 1.00 0.00 O ATOM 458 CB GLN A 55 -1.055 -18.360 -8.564 1.00 0.00 C ATOM 459 CG GLN A 55 -0.114 -18.040 -9.712 1.00 0.00 C ATOM 460 CD GLN A 55 -0.828 -17.959 -11.048 1.00 0.00 C ATOM 461 OE1 GLN A 55 -2.057 -18.031 -11.117 1.00 0.00 O ATOM 462 NE2 GLN A 55 -0.068 -17.813 -12.115 1.00 0.00 N ATOM 0 H GLN A 55 1.607 -18.147 -7.317 1.00 0.00 H new ATOM 0 HA GLN A 55 -1.096 -18.944 -6.515 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -1.776 -19.108 -8.896 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -1.620 -17.463 -8.310 1.00 0.00 H new ATOM 0 HG2 GLN A 55 0.386 -17.092 -9.513 1.00 0.00 H new ATOM 0 HG3 GLN A 55 0.662 -18.804 -9.765 1.00 0.00 H new ATOM 0 HE21 GLN A 55 0.946 -17.757 -12.015 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.494 -17.755 -13.040 1.00 0.00 H new ATOM 471 N GLN A 56 -0.546 -21.180 -8.079 1.00 0.00 N ATOM 472 CA GLN A 56 -0.093 -22.557 -8.283 1.00 0.00 C ATOM 473 C GLN A 56 0.869 -22.672 -9.461 1.00 0.00 C ATOM 474 O GLN A 56 1.621 -23.636 -9.555 1.00 0.00 O ATOM 475 CB GLN A 56 -1.289 -23.485 -8.497 1.00 0.00 C ATOM 476 CG GLN A 56 -2.240 -23.017 -9.585 1.00 0.00 C ATOM 477 CD GLN A 56 -3.636 -22.766 -9.061 1.00 0.00 C ATOM 478 OE1 GLN A 56 -3.893 -21.744 -8.424 1.00 0.00 O ATOM 479 NE2 GLN A 56 -4.542 -23.696 -9.312 1.00 0.00 N ATOM 0 H GLN A 56 -1.506 -21.002 -8.374 1.00 0.00 H new ATOM 0 HA GLN A 56 0.444 -22.858 -7.383 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -0.924 -24.481 -8.750 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -1.839 -23.575 -7.560 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -1.853 -22.102 -10.033 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.281 -23.767 -10.375 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -4.285 -24.528 -9.844 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.497 -23.582 -8.974 1.00 0.00 H new ATOM 488 N ALA A 57 0.806 -21.699 -10.364 1.00 0.00 N ATOM 489 CA ALA A 57 1.701 -21.629 -11.525 1.00 0.00 C ATOM 490 C ALA A 57 1.665 -22.903 -12.383 1.00 0.00 C ATOM 491 O ALA A 57 2.608 -23.192 -13.122 1.00 0.00 O ATOM 492 CB ALA A 57 3.127 -21.337 -11.071 1.00 0.00 C ATOM 0 H ALA A 57 0.134 -20.933 -10.316 1.00 0.00 H new ATOM 0 HA ALA A 57 1.342 -20.815 -12.155 1.00 0.00 H new ATOM 0 HB1 ALA A 57 3.783 -21.287 -11.940 1.00 0.00 H new ATOM 0 HB2 ALA A 57 3.153 -20.384 -10.542 1.00 0.00 H new ATOM 0 HB3 ALA A 57 3.467 -22.131 -10.405 1.00 0.00 H new ATOM 498 N GLN A 58 0.561 -23.638 -12.313 1.00 0.00 N ATOM 499 CA GLN A 58 0.429 -24.906 -13.028 1.00 0.00 C ATOM 500 C GLN A 58 0.599 -24.711 -14.535 1.00 0.00 C ATOM 501 O GLN A 58 1.286 -25.485 -15.203 1.00 0.00 O ATOM 502 CB GLN A 58 -0.932 -25.540 -12.736 1.00 0.00 C ATOM 503 CG GLN A 58 -0.856 -26.767 -11.840 1.00 0.00 C ATOM 504 CD GLN A 58 -1.586 -26.576 -10.525 1.00 0.00 C ATOM 505 OE1 GLN A 58 -2.728 -26.111 -10.494 1.00 0.00 O ATOM 506 NE2 GLN A 58 -0.939 -26.938 -9.430 1.00 0.00 N ATOM 0 H GLN A 58 -0.260 -23.378 -11.766 1.00 0.00 H new ATOM 0 HA GLN A 58 1.218 -25.571 -12.678 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.576 -24.797 -12.265 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -1.403 -25.818 -13.679 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.280 -27.623 -12.366 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.189 -27.002 -11.640 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.005 -27.319 -9.498 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.384 -26.837 -8.518 1.00 0.00 H new ATOM 515 N HIS A 59 -0.002 -23.654 -15.057 1.00 0.00 N ATOM 516 CA HIS A 59 0.028 -23.378 -16.491 1.00 0.00 C ATOM 517 C HIS A 59 1.200 -22.471 -16.847 1.00 0.00 C ATOM 518 O HIS A 59 1.343 -22.056 -17.995 1.00 0.00 O ATOM 519 CB HIS A 59 -1.275 -22.697 -16.919 1.00 0.00 C ATOM 520 CG HIS A 59 -2.177 -23.549 -17.760 1.00 0.00 C ATOM 521 ND1 HIS A 59 -3.522 -23.291 -17.898 1.00 0.00 N ATOM 522 CD2 HIS A 59 -1.929 -24.654 -18.506 1.00 0.00 C ATOM 523 CE1 HIS A 59 -4.065 -24.199 -18.687 1.00 0.00 C ATOM 524 NE2 HIS A 59 -3.122 -25.039 -19.070 1.00 0.00 N ATOM 0 H HIS A 59 -0.520 -22.968 -14.509 1.00 0.00 H new ATOM 0 HA HIS A 59 0.142 -24.327 -17.014 1.00 0.00 H new ATOM 0 HB2 HIS A 59 -1.818 -22.387 -16.026 1.00 0.00 H new ATOM 0 HB3 HIS A 59 -1.031 -21.791 -17.474 1.00 0.00 H new ATOM 0 HD2 HIS A 59 -0.973 -25.140 -18.633 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -5.106 -24.247 -18.971 1.00 0.00 H new ATOM 0 HE2 HIS A 59 -3.256 -25.842 -19.684 1.00 0.00 H new ATOM 533 N MET A 60 2.042 -22.176 -15.865 1.00 0.00 N ATOM 534 CA MET A 60 3.061 -21.146 -16.029 1.00 0.00 C ATOM 535 C MET A 60 4.284 -21.641 -16.792 1.00 0.00 C ATOM 536 O MET A 60 4.403 -22.829 -17.112 1.00 0.00 O ATOM 537 CB MET A 60 3.471 -20.586 -14.672 1.00 0.00 C ATOM 538 CG MET A 60 2.707 -19.330 -14.295 1.00 0.00 C ATOM 539 SD MET A 60 0.936 -19.459 -14.622 1.00 0.00 S ATOM 540 CE MET A 60 0.776 -18.406 -16.064 1.00 0.00 C ATOM 0 H MET A 60 2.041 -22.631 -14.952 1.00 0.00 H new ATOM 0 HA MET A 60 2.616 -20.353 -16.629 1.00 0.00 H new ATOM 0 HB2 MET A 60 3.310 -21.346 -13.907 1.00 0.00 H new ATOM 0 HB3 MET A 60 4.539 -20.366 -14.683 1.00 0.00 H new ATOM 0 HG2 MET A 60 2.861 -19.121 -13.236 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.113 -18.484 -14.849 1.00 0.00 H new ATOM 0 HE1 MET A 60 0.350 -17.447 -15.769 1.00 0.00 H new ATOM 0 HE2 MET A 60 1.758 -18.245 -16.508 1.00 0.00 H new ATOM 0 HE3 MET A 60 0.123 -18.885 -16.793 1.00 0.00 H new ATOM 550 N GLU A 61 5.195 -20.711 -17.059 1.00 0.00 N ATOM 551 CA GLU A 61 6.335 -20.965 -17.928 1.00 0.00 C ATOM 552 C GLU A 61 7.626 -21.096 -17.132 1.00 0.00 C ATOM 553 O GLU A 61 7.825 -20.406 -16.132 1.00 0.00 O ATOM 554 CB GLU A 61 6.467 -19.832 -18.941 1.00 0.00 C ATOM 555 CG GLU A 61 5.309 -19.753 -19.920 1.00 0.00 C ATOM 556 CD GLU A 61 5.063 -18.353 -20.441 1.00 0.00 C ATOM 557 OE1 GLU A 61 5.684 -17.398 -19.932 1.00 0.00 O ATOM 558 OE2 GLU A 61 4.244 -18.203 -21.366 1.00 0.00 O ATOM 0 H GLU A 61 5.163 -19.764 -16.680 1.00 0.00 H new ATOM 0 HA GLU A 61 6.163 -21.909 -18.446 1.00 0.00 H new ATOM 0 HB2 GLU A 61 6.545 -18.885 -18.406 1.00 0.00 H new ATOM 0 HB3 GLU A 61 7.395 -19.961 -19.498 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.507 -20.417 -20.761 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.404 -20.117 -19.433 1.00 0.00 H new ATOM 565 N ILE A 62 8.500 -21.987 -17.576 1.00 0.00 N ATOM 566 CA ILE A 62 9.782 -22.200 -16.916 1.00 0.00 C ATOM 567 C ILE A 62 10.923 -22.326 -17.934 1.00 0.00 C ATOM 568 O ILE A 62 10.773 -22.961 -18.979 1.00 0.00 O ATOM 569 CB ILE A 62 9.747 -23.456 -16.000 1.00 0.00 C ATOM 570 CG1 ILE A 62 11.165 -23.976 -15.721 1.00 0.00 C ATOM 571 CG2 ILE A 62 8.884 -24.549 -16.619 1.00 0.00 C ATOM 572 CD1 ILE A 62 11.203 -25.262 -14.924 1.00 0.00 C ATOM 0 H ILE A 62 8.345 -22.577 -18.394 1.00 0.00 H new ATOM 0 HA ILE A 62 9.969 -21.324 -16.295 1.00 0.00 H new ATOM 0 HB ILE A 62 9.303 -23.166 -15.048 1.00 0.00 H new ATOM 0 HG12 ILE A 62 11.676 -24.134 -16.671 1.00 0.00 H new ATOM 0 HG13 ILE A 62 11.722 -23.210 -15.182 1.00 0.00 H new ATOM 0 HG21 ILE A 62 8.873 -25.419 -15.963 1.00 0.00 H new ATOM 0 HG22 ILE A 62 7.867 -24.179 -16.749 1.00 0.00 H new ATOM 0 HG23 ILE A 62 9.294 -24.831 -17.589 1.00 0.00 H new ATOM 0 HD11 ILE A 62 12.239 -25.563 -14.769 1.00 0.00 H new ATOM 0 HD12 ILE A 62 10.722 -25.106 -13.958 1.00 0.00 H new ATOM 0 HD13 ILE A 62 10.675 -26.044 -15.470 1.00 0.00 H new ATOM 584 N ARG A 63 12.043 -21.681 -17.640 1.00 0.00 N ATOM 585 CA ARG A 63 13.280 -21.894 -18.380 1.00 0.00 C ATOM 586 C ARG A 63 14.339 -22.423 -17.418 1.00 0.00 C ATOM 587 O ARG A 63 14.488 -21.906 -16.317 1.00 0.00 O ATOM 588 CB ARG A 63 13.779 -20.600 -19.044 1.00 0.00 C ATOM 589 CG ARG A 63 12.675 -19.676 -19.535 1.00 0.00 C ATOM 590 CD ARG A 63 12.819 -19.354 -21.018 1.00 0.00 C ATOM 591 NE ARG A 63 14.209 -19.097 -21.410 1.00 0.00 N ATOM 592 CZ ARG A 63 14.668 -17.903 -21.792 1.00 0.00 C ATOM 593 NH1 ARG A 63 13.851 -16.858 -21.839 1.00 0.00 N ATOM 594 NH2 ARG A 63 15.944 -17.755 -22.140 1.00 0.00 N ATOM 0 H ARG A 63 12.121 -20.999 -16.886 1.00 0.00 H new ATOM 0 HA ARG A 63 13.089 -22.615 -19.175 1.00 0.00 H new ATOM 0 HB2 ARG A 63 14.400 -20.057 -18.331 1.00 0.00 H new ATOM 0 HB3 ARG A 63 14.418 -20.862 -19.887 1.00 0.00 H new ATOM 0 HG2 ARG A 63 11.706 -20.142 -19.357 1.00 0.00 H new ATOM 0 HG3 ARG A 63 12.694 -18.751 -18.959 1.00 0.00 H new ATOM 0 HD2 ARG A 63 12.428 -20.185 -21.605 1.00 0.00 H new ATOM 0 HD3 ARG A 63 12.211 -18.481 -21.257 1.00 0.00 H new ATOM 0 HE ARG A 63 14.865 -19.878 -21.389 1.00 0.00 H new ATOM 0 HH11 ARG A 63 12.870 -16.966 -21.583 1.00 0.00 H new ATOM 0 HH12 ARG A 63 14.205 -15.947 -22.131 1.00 0.00 H new ATOM 0 HH21 ARG A 63 16.575 -18.556 -22.116 1.00 0.00 H new ATOM 0 HH22 ARG A 63 16.290 -16.841 -22.431 1.00 0.00 H new ATOM 608 N TRP A 64 15.057 -23.455 -17.826 1.00 0.00 N ATOM 609 CA TRP A 64 16.063 -24.076 -16.969 1.00 0.00 C ATOM 610 C TRP A 64 17.185 -24.651 -17.821 1.00 0.00 C ATOM 611 O TRP A 64 17.450 -25.847 -17.784 1.00 0.00 O ATOM 612 CB TRP A 64 15.417 -25.192 -16.142 1.00 0.00 C ATOM 613 CG TRP A 64 15.739 -25.155 -14.676 1.00 0.00 C ATOM 614 CD1 TRP A 64 14.898 -25.495 -13.656 1.00 0.00 C ATOM 615 CD2 TRP A 64 16.978 -24.774 -14.062 1.00 0.00 C ATOM 616 NE1 TRP A 64 15.534 -25.349 -12.448 1.00 0.00 N ATOM 617 CE2 TRP A 64 16.808 -24.902 -12.669 1.00 0.00 C ATOM 618 CE3 TRP A 64 18.211 -24.331 -14.549 1.00 0.00 C ATOM 619 CZ2 TRP A 64 17.827 -24.611 -11.763 1.00 0.00 C ATOM 620 CZ3 TRP A 64 19.217 -24.039 -13.649 1.00 0.00 C ATOM 621 CH2 TRP A 64 19.019 -24.181 -12.271 1.00 0.00 C ATOM 0 H TRP A 64 14.965 -23.884 -18.747 1.00 0.00 H new ATOM 0 HA TRP A 64 16.476 -23.323 -16.298 1.00 0.00 H new ATOM 0 HB2 TRP A 64 14.335 -25.136 -16.264 1.00 0.00 H new ATOM 0 HB3 TRP A 64 15.734 -26.154 -16.545 1.00 0.00 H new ATOM 0 HD1 TRP A 64 13.879 -25.831 -13.781 1.00 0.00 H new ATOM 0 HE1 TRP A 64 15.123 -25.542 -11.534 1.00 0.00 H new ATOM 0 HE3 TRP A 64 18.374 -24.219 -15.611 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 17.679 -24.722 -10.699 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 20.173 -23.695 -14.015 1.00 0.00 H new ATOM 0 HH2 TRP A 64 19.827 -23.945 -11.594 1.00 0.00 H new ATOM 632 N PHE A 65 17.846 -23.797 -18.591 1.00 0.00 N ATOM 633 CA PHE A 65 18.767 -24.280 -19.620 1.00 0.00 C ATOM 634 C PHE A 65 20.049 -23.459 -19.659 1.00 0.00 C ATOM 635 O PHE A 65 20.060 -22.283 -19.292 1.00 0.00 O ATOM 636 CB PHE A 65 18.082 -24.254 -20.995 1.00 0.00 C ATOM 637 CG PHE A 65 16.709 -24.866 -20.988 1.00 0.00 C ATOM 638 CD1 PHE A 65 16.543 -26.221 -20.746 1.00 0.00 C ATOM 639 CD2 PHE A 65 15.583 -24.086 -21.205 1.00 0.00 C ATOM 640 CE1 PHE A 65 15.284 -26.785 -20.719 1.00 0.00 C ATOM 641 CE2 PHE A 65 14.318 -24.647 -21.176 1.00 0.00 C ATOM 642 CZ PHE A 65 14.171 -25.999 -20.933 1.00 0.00 C ATOM 0 H PHE A 65 17.767 -22.782 -18.528 1.00 0.00 H new ATOM 0 HA PHE A 65 19.037 -25.306 -19.369 1.00 0.00 H new ATOM 0 HB2 PHE A 65 18.010 -23.222 -21.338 1.00 0.00 H new ATOM 0 HB3 PHE A 65 18.705 -24.786 -21.714 1.00 0.00 H new ATOM 0 HD1 PHE A 65 17.410 -26.843 -20.577 1.00 0.00 H new ATOM 0 HD2 PHE A 65 15.694 -23.029 -21.399 1.00 0.00 H new ATOM 0 HE1 PHE A 65 15.170 -27.842 -20.530 1.00 0.00 H new ATOM 0 HE2 PHE A 65 13.448 -24.029 -21.343 1.00 0.00 H new ATOM 0 HZ PHE A 65 13.185 -26.440 -20.911 1.00 0.00 H new ATOM 652 N ARG A 66 21.133 -24.091 -20.096 1.00 0.00 N ATOM 653 CA ARG A 66 22.404 -23.403 -20.244 1.00 0.00 C ATOM 654 C ARG A 66 22.501 -22.816 -21.648 1.00 0.00 C ATOM 655 O ARG A 66 22.863 -23.495 -22.611 1.00 0.00 O ATOM 656 CB ARG A 66 23.568 -24.369 -19.953 1.00 0.00 C ATOM 657 CG ARG A 66 24.887 -24.023 -20.640 1.00 0.00 C ATOM 658 CD ARG A 66 25.594 -22.858 -19.967 1.00 0.00 C ATOM 659 NE ARG A 66 27.039 -22.905 -20.176 1.00 0.00 N ATOM 660 CZ ARG A 66 27.643 -22.575 -21.320 1.00 0.00 C ATOM 661 NH1 ARG A 66 26.935 -22.122 -22.351 1.00 0.00 N ATOM 662 NH2 ARG A 66 28.960 -22.695 -21.429 1.00 0.00 N ATOM 0 H ARG A 66 21.154 -25.078 -20.353 1.00 0.00 H new ATOM 0 HA ARG A 66 22.467 -22.586 -19.525 1.00 0.00 H new ATOM 0 HB2 ARG A 66 23.734 -24.398 -18.876 1.00 0.00 H new ATOM 0 HB3 ARG A 66 23.271 -25.373 -20.257 1.00 0.00 H new ATOM 0 HG2 ARG A 66 25.539 -24.896 -20.632 1.00 0.00 H new ATOM 0 HG3 ARG A 66 24.697 -23.777 -21.685 1.00 0.00 H new ATOM 0 HD2 ARG A 66 25.201 -21.920 -20.358 1.00 0.00 H new ATOM 0 HD3 ARG A 66 25.381 -22.872 -18.898 1.00 0.00 H new ATOM 0 HE ARG A 66 27.624 -23.209 -19.398 1.00 0.00 H new ATOM 0 HH11 ARG A 66 25.923 -22.025 -22.271 1.00 0.00 H new ATOM 0 HH12 ARG A 66 27.404 -21.872 -23.221 1.00 0.00 H new ATOM 0 HH21 ARG A 66 29.508 -23.039 -20.640 1.00 0.00 H new ATOM 0 HH22 ARG A 66 29.425 -22.444 -22.302 1.00 0.00 H new ATOM 789 N HIS A 74 12.998 -20.682 -26.463 1.00 0.00 N ATOM 790 CA HIS A 74 13.407 -21.878 -25.740 1.00 0.00 C ATOM 791 C HIS A 74 12.807 -21.846 -24.347 1.00 0.00 C ATOM 792 O HIS A 74 13.465 -21.451 -23.384 1.00 0.00 O ATOM 793 CB HIS A 74 14.929 -21.968 -25.649 1.00 0.00 C ATOM 794 CG HIS A 74 15.483 -23.253 -26.176 1.00 0.00 C ATOM 795 ND1 HIS A 74 14.926 -24.486 -25.918 1.00 0.00 N ATOM 796 CD2 HIS A 74 16.566 -23.487 -26.948 1.00 0.00 C ATOM 797 CE1 HIS A 74 15.646 -25.417 -26.506 1.00 0.00 C ATOM 798 NE2 HIS A 74 16.649 -24.842 -27.148 1.00 0.00 N ATOM 0 HA HIS A 74 13.049 -22.755 -26.279 1.00 0.00 H new ATOM 0 HB2 HIS A 74 15.368 -21.138 -26.203 1.00 0.00 H new ATOM 0 HB3 HIS A 74 15.230 -21.851 -24.608 1.00 0.00 H new ATOM 0 HD1 HIS A 74 14.088 -24.651 -25.360 1.00 0.00 H new ATOM 0 HD2 HIS A 74 17.244 -22.742 -27.338 1.00 0.00 H new ATOM 0 HE1 HIS A 74 15.450 -26.478 -26.470 1.00 0.00 H new ATOM 807 N LEU A 75 11.555 -22.256 -24.246 1.00 0.00 N ATOM 808 CA LEU A 75 10.799 -22.067 -23.027 1.00 0.00 C ATOM 809 C LEU A 75 9.771 -23.180 -22.828 1.00 0.00 C ATOM 810 O LEU A 75 9.163 -23.661 -23.784 1.00 0.00 O ATOM 811 CB LEU A 75 10.115 -20.696 -23.075 1.00 0.00 C ATOM 812 CG LEU A 75 8.858 -20.553 -22.224 1.00 0.00 C ATOM 813 CD1 LEU A 75 9.213 -20.023 -20.845 1.00 0.00 C ATOM 814 CD2 LEU A 75 7.855 -19.642 -22.912 1.00 0.00 C ATOM 0 H LEU A 75 11.043 -22.722 -24.995 1.00 0.00 H new ATOM 0 HA LEU A 75 11.480 -22.107 -22.177 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.834 -19.941 -22.758 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.857 -20.475 -24.111 1.00 0.00 H new ATOM 0 HG LEU A 75 8.400 -21.535 -22.105 1.00 0.00 H new ATOM 0 HD11 LEU A 75 8.306 -19.926 -20.248 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.898 -20.715 -20.355 1.00 0.00 H new ATOM 0 HD13 LEU A 75 9.690 -19.048 -20.942 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.963 -19.550 -22.293 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.299 -18.657 -23.059 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.583 -20.065 -23.879 1.00 0.00 H new ATOM 826 N TYR A 76 9.583 -23.564 -21.576 1.00 0.00 N ATOM 827 CA TYR A 76 8.621 -24.588 -21.204 1.00 0.00 C ATOM 828 C TYR A 76 7.305 -23.922 -20.811 1.00 0.00 C ATOM 829 O TYR A 76 7.248 -23.202 -19.814 1.00 0.00 O ATOM 830 CB TYR A 76 9.184 -25.383 -20.025 1.00 0.00 C ATOM 831 CG TYR A 76 8.747 -26.824 -19.953 1.00 0.00 C ATOM 832 CD1 TYR A 76 9.463 -27.816 -20.607 1.00 0.00 C ATOM 833 CD2 TYR A 76 7.636 -27.198 -19.210 1.00 0.00 C ATOM 834 CE1 TYR A 76 9.081 -29.138 -20.526 1.00 0.00 C ATOM 835 CE2 TYR A 76 7.249 -28.519 -19.127 1.00 0.00 C ATOM 836 CZ TYR A 76 7.975 -29.485 -19.786 1.00 0.00 C ATOM 837 OH TYR A 76 7.594 -30.804 -19.710 1.00 0.00 O ATOM 0 H TYR A 76 10.096 -23.172 -20.786 1.00 0.00 H new ATOM 0 HA TYR A 76 8.439 -25.261 -22.042 1.00 0.00 H new ATOM 0 HB2 TYR A 76 10.272 -25.353 -20.074 1.00 0.00 H new ATOM 0 HB3 TYR A 76 8.893 -24.885 -19.100 1.00 0.00 H new ATOM 0 HD1 TYR A 76 10.333 -27.548 -21.188 1.00 0.00 H new ATOM 0 HD2 TYR A 76 7.066 -26.443 -18.689 1.00 0.00 H new ATOM 0 HE1 TYR A 76 9.648 -29.899 -21.042 1.00 0.00 H new ATOM 0 HE2 TYR A 76 6.380 -28.794 -18.548 1.00 0.00 H new ATOM 0 HH TYR A 76 6.795 -30.882 -19.148 1.00 0.00 H new ATOM 847 N ARG A 77 6.253 -24.158 -21.586 1.00 0.00 N ATOM 848 CA ARG A 77 4.988 -23.454 -21.385 1.00 0.00 C ATOM 849 C ARG A 77 3.810 -24.341 -21.757 1.00 0.00 C ATOM 850 O ARG A 77 3.989 -25.360 -22.417 1.00 0.00 O ATOM 851 CB ARG A 77 4.952 -22.153 -22.194 1.00 0.00 C ATOM 852 CG ARG A 77 4.949 -22.348 -23.700 1.00 0.00 C ATOM 853 CD ARG A 77 3.925 -21.450 -24.377 1.00 0.00 C ATOM 854 NE ARG A 77 3.874 -20.107 -23.789 1.00 0.00 N ATOM 855 CZ ARG A 77 3.375 -19.036 -24.413 1.00 0.00 C ATOM 856 NH1 ARG A 77 2.879 -19.143 -25.641 1.00 0.00 N ATOM 857 NH2 ARG A 77 3.360 -17.863 -23.794 1.00 0.00 N ATOM 0 H ARG A 77 6.248 -24.827 -22.356 1.00 0.00 H new ATOM 0 HA ARG A 77 4.910 -23.203 -20.327 1.00 0.00 H new ATOM 0 HB2 ARG A 77 4.063 -21.589 -21.912 1.00 0.00 H new ATOM 0 HB3 ARG A 77 5.815 -21.546 -21.921 1.00 0.00 H new ATOM 0 HG2 ARG A 77 5.941 -22.134 -24.097 1.00 0.00 H new ATOM 0 HG3 ARG A 77 4.730 -23.390 -23.932 1.00 0.00 H new ATOM 0 HD2 ARG A 77 4.163 -21.369 -25.438 1.00 0.00 H new ATOM 0 HD3 ARG A 77 2.940 -21.911 -24.306 1.00 0.00 H new ATOM 0 HE ARG A 77 4.242 -19.983 -22.846 1.00 0.00 H new ATOM 0 HH11 ARG A 77 2.877 -20.047 -26.113 1.00 0.00 H new ATOM 0 HH12 ARG A 77 2.500 -18.321 -26.111 1.00 0.00 H new ATOM 0 HH21 ARG A 77 3.728 -17.782 -22.846 1.00 0.00 H new ATOM 0 HH22 ARG A 77 2.980 -17.042 -24.266 1.00 0.00 H new ATOM 871 N ASP A 78 2.609 -23.957 -21.312 1.00 0.00 N ATOM 872 CA ASP A 78 1.396 -24.762 -21.528 1.00 0.00 C ATOM 873 C ASP A 78 1.471 -26.049 -20.705 1.00 0.00 C ATOM 874 O ASP A 78 0.622 -26.932 -20.809 1.00 0.00 O ATOM 875 CB ASP A 78 1.208 -25.078 -23.023 1.00 0.00 C ATOM 876 CG ASP A 78 -0.153 -25.667 -23.359 1.00 0.00 C ATOM 877 OD1 ASP A 78 -1.169 -25.222 -22.783 1.00 0.00 O ATOM 878 OD2 ASP A 78 -0.213 -26.566 -24.226 1.00 0.00 O ATOM 0 H ASP A 78 2.448 -23.091 -20.798 1.00 0.00 H new ATOM 0 HA ASP A 78 0.531 -24.186 -21.198 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.350 -24.163 -23.599 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.984 -25.776 -23.338 1.00 0.00 H new ATOM 883 N GLY A 79 2.498 -26.133 -19.870 1.00 0.00 N ATOM 884 CA GLY A 79 2.685 -27.296 -19.033 1.00 0.00 C ATOM 885 C GLY A 79 3.677 -28.278 -19.621 1.00 0.00 C ATOM 886 O GLY A 79 4.047 -29.253 -18.971 1.00 0.00 O ATOM 0 H GLY A 79 3.208 -25.409 -19.759 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.031 -26.980 -18.049 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.726 -27.794 -18.889 1.00 0.00 H new ATOM 890 N LYS A 80 4.125 -28.009 -20.843 1.00 0.00 N ATOM 891 CA LYS A 80 5.009 -28.927 -21.553 1.00 0.00 C ATOM 892 C LYS A 80 6.026 -28.169 -22.406 1.00 0.00 C ATOM 893 O LYS A 80 6.065 -26.937 -22.405 1.00 0.00 O ATOM 894 CB LYS A 80 4.199 -29.881 -22.435 1.00 0.00 C ATOM 895 CG LYS A 80 3.073 -29.202 -23.196 1.00 0.00 C ATOM 896 CD LYS A 80 2.174 -30.220 -23.875 1.00 0.00 C ATOM 897 CE LYS A 80 0.759 -29.690 -24.053 1.00 0.00 C ATOM 898 NZ LYS A 80 0.619 -28.869 -25.283 1.00 0.00 N ATOM 0 H LYS A 80 3.891 -27.163 -21.362 1.00 0.00 H new ATOM 0 HA LYS A 80 5.551 -29.506 -20.806 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.870 -30.360 -23.148 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.780 -30.670 -21.811 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.484 -28.593 -22.511 1.00 0.00 H new ATOM 0 HG3 LYS A 80 3.491 -28.527 -23.943 1.00 0.00 H new ATOM 0 HD2 LYS A 80 2.590 -30.481 -24.848 1.00 0.00 H new ATOM 0 HD3 LYS A 80 2.148 -31.135 -23.283 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.062 -30.527 -24.095 1.00 0.00 H new ATOM 0 HE3 LYS A 80 0.485 -29.091 -23.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.587 -27.862 -25.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 1.431 -29.041 -25.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.259 -29.129 -25.776 1.00 0.00 H new ATOM 912 N ASP A 81 6.880 -28.919 -23.089 1.00 0.00 N ATOM 913 CA ASP A 81 7.834 -28.338 -24.026 1.00 0.00 C ATOM 914 C ASP A 81 7.136 -28.031 -25.347 1.00 0.00 C ATOM 915 O ASP A 81 6.009 -28.475 -25.579 1.00 0.00 O ATOM 916 CB ASP A 81 9.015 -29.290 -24.250 1.00 0.00 C ATOM 917 CG ASP A 81 8.626 -30.555 -24.990 1.00 0.00 C ATOM 918 OD1 ASP A 81 8.211 -31.532 -24.328 1.00 0.00 O ATOM 919 OD2 ASP A 81 8.739 -30.584 -26.233 1.00 0.00 O ATOM 0 H ASP A 81 6.932 -29.935 -23.012 1.00 0.00 H new ATOM 0 HA ASP A 81 8.222 -27.410 -23.607 1.00 0.00 H new ATOM 0 HB2 ASP A 81 9.791 -28.771 -24.813 1.00 0.00 H new ATOM 0 HB3 ASP A 81 9.446 -29.558 -23.285 1.00 0.00 H new ATOM 924 N MET A 82 7.797 -27.282 -26.216 1.00 0.00 N ATOM 925 CA MET A 82 7.179 -26.857 -27.467 1.00 0.00 C ATOM 926 C MET A 82 8.122 -27.060 -28.645 1.00 0.00 C ATOM 927 O MET A 82 9.325 -26.857 -28.528 1.00 0.00 O ATOM 928 CB MET A 82 6.766 -25.385 -27.371 1.00 0.00 C ATOM 929 CG MET A 82 5.405 -25.095 -27.974 1.00 0.00 C ATOM 930 SD MET A 82 5.491 -24.750 -29.742 1.00 0.00 S ATOM 931 CE MET A 82 3.759 -24.468 -30.105 1.00 0.00 C ATOM 0 H MET A 82 8.754 -26.957 -26.082 1.00 0.00 H new ATOM 0 HA MET A 82 6.294 -27.471 -27.635 1.00 0.00 H new ATOM 0 HB2 MET A 82 6.761 -25.085 -26.323 1.00 0.00 H new ATOM 0 HB3 MET A 82 7.515 -24.773 -27.874 1.00 0.00 H new ATOM 0 HG2 MET A 82 4.747 -25.948 -27.805 1.00 0.00 H new ATOM 0 HG3 MET A 82 4.959 -24.242 -27.462 1.00 0.00 H new ATOM 0 HE1 MET A 82 3.642 -24.241 -31.165 1.00 0.00 H new ATOM 0 HE2 MET A 82 3.186 -25.362 -29.860 1.00 0.00 H new ATOM 0 HE3 MET A 82 3.395 -23.629 -29.512 1.00 0.00 H new ATOM 941 N PHE A 83 7.567 -27.447 -29.788 1.00 0.00 N ATOM 942 CA PHE A 83 8.365 -27.655 -30.993 1.00 0.00 C ATOM 943 C PHE A 83 8.995 -26.346 -31.463 1.00 0.00 C ATOM 944 O PHE A 83 10.012 -26.349 -32.155 1.00 0.00 O ATOM 945 CB PHE A 83 7.503 -28.246 -32.109 1.00 0.00 C ATOM 946 CG PHE A 83 8.254 -29.184 -33.014 1.00 0.00 C ATOM 947 CD1 PHE A 83 8.745 -30.387 -32.532 1.00 0.00 C ATOM 948 CD2 PHE A 83 8.473 -28.861 -34.345 1.00 0.00 C ATOM 949 CE1 PHE A 83 9.436 -31.251 -33.360 1.00 0.00 C ATOM 950 CE2 PHE A 83 9.163 -29.720 -35.176 1.00 0.00 C ATOM 951 CZ PHE A 83 9.647 -30.916 -34.683 1.00 0.00 C ATOM 0 H PHE A 83 6.569 -27.623 -29.907 1.00 0.00 H new ATOM 0 HA PHE A 83 9.163 -28.356 -30.750 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.662 -28.778 -31.665 1.00 0.00 H new ATOM 0 HB3 PHE A 83 7.087 -27.434 -32.705 1.00 0.00 H new ATOM 0 HD1 PHE A 83 8.586 -30.652 -31.497 1.00 0.00 H new ATOM 0 HD2 PHE A 83 8.099 -27.926 -34.736 1.00 0.00 H new ATOM 0 HE1 PHE A 83 9.811 -32.187 -32.973 1.00 0.00 H new ATOM 0 HE2 PHE A 83 9.324 -29.457 -36.211 1.00 0.00 H new ATOM 0 HZ PHE A 83 10.190 -31.588 -35.331 1.00 0.00 H new ATOM 961 N GLY A 84 8.382 -25.232 -31.082 1.00 0.00 N ATOM 962 CA GLY A 84 8.919 -23.931 -31.429 1.00 0.00 C ATOM 963 C GLY A 84 10.228 -23.638 -30.720 1.00 0.00 C ATOM 964 O GLY A 84 11.097 -22.959 -31.265 1.00 0.00 O ATOM 0 H GLY A 84 7.520 -25.207 -30.537 1.00 0.00 H new ATOM 0 HA2 GLY A 84 9.073 -23.880 -32.507 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.191 -23.161 -31.175 1.00 0.00 H new ATOM 968 N GLU A 85 10.368 -24.155 -29.505 1.00 0.00 N ATOM 969 CA GLU A 85 11.577 -23.943 -28.719 1.00 0.00 C ATOM 970 C GLU A 85 12.544 -25.115 -28.903 1.00 0.00 C ATOM 971 O GLU A 85 13.759 -24.945 -28.827 1.00 0.00 O ATOM 972 CB GLU A 85 11.225 -23.749 -27.238 1.00 0.00 C ATOM 973 CG GLU A 85 10.555 -24.948 -26.595 1.00 0.00 C ATOM 974 CD GLU A 85 11.515 -25.785 -25.776 1.00 0.00 C ATOM 975 OE1 GLU A 85 12.493 -25.216 -25.233 1.00 0.00 O ATOM 976 OE2 GLU A 85 11.302 -27.013 -25.694 1.00 0.00 O ATOM 0 H GLU A 85 9.659 -24.724 -29.043 1.00 0.00 H new ATOM 0 HA GLU A 85 12.070 -23.037 -29.072 1.00 0.00 H new ATOM 0 HB2 GLU A 85 12.137 -23.518 -26.687 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.567 -22.885 -27.143 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.742 -24.605 -25.955 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.109 -25.570 -27.371 1.00 0.00 H new ATOM 983 N ILE A 86 11.965 -26.293 -29.150 1.00 0.00 N ATOM 984 CA ILE A 86 12.690 -27.533 -29.450 1.00 0.00 C ATOM 985 C ILE A 86 13.855 -27.820 -28.479 1.00 0.00 C ATOM 986 O ILE A 86 15.031 -27.564 -28.760 1.00 0.00 O ATOM 987 CB ILE A 86 13.135 -27.604 -30.944 1.00 0.00 C ATOM 988 CG1 ILE A 86 13.644 -29.006 -31.284 1.00 0.00 C ATOM 989 CG2 ILE A 86 14.184 -26.558 -31.307 1.00 0.00 C ATOM 990 CD1 ILE A 86 12.762 -29.742 -32.266 1.00 0.00 C ATOM 0 H ILE A 86 10.952 -26.415 -29.147 1.00 0.00 H new ATOM 0 HA ILE A 86 11.974 -28.338 -29.287 1.00 0.00 H new ATOM 0 HB ILE A 86 12.251 -27.381 -31.542 1.00 0.00 H new ATOM 0 HG12 ILE A 86 14.650 -28.929 -31.697 1.00 0.00 H new ATOM 0 HG13 ILE A 86 13.720 -29.590 -30.367 1.00 0.00 H new ATOM 0 HG21 ILE A 86 14.451 -26.660 -32.359 1.00 0.00 H new ATOM 0 HG22 ILE A 86 13.780 -25.561 -31.130 1.00 0.00 H new ATOM 0 HG23 ILE A 86 15.072 -26.704 -30.691 1.00 0.00 H new ATOM 0 HD11 ILE A 86 13.181 -30.729 -32.463 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.762 -29.850 -31.847 1.00 0.00 H new ATOM 0 HD13 ILE A 86 12.706 -29.179 -33.198 1.00 0.00 H new ATOM 1002 N ILE A 87 13.502 -28.387 -27.329 1.00 0.00 N ATOM 1003 CA ILE A 87 14.486 -28.819 -26.338 1.00 0.00 C ATOM 1004 C ILE A 87 15.118 -30.139 -26.767 1.00 0.00 C ATOM 1005 O ILE A 87 16.100 -30.601 -26.183 1.00 0.00 O ATOM 1006 CB ILE A 87 13.846 -28.966 -24.939 1.00 0.00 C ATOM 1007 CG1 ILE A 87 14.894 -29.297 -23.869 1.00 0.00 C ATOM 1008 CG2 ILE A 87 12.755 -30.025 -24.950 1.00 0.00 C ATOM 1009 CD1 ILE A 87 15.989 -28.263 -23.737 1.00 0.00 C ATOM 0 H ILE A 87 12.534 -28.560 -27.058 1.00 0.00 H new ATOM 0 HA ILE A 87 15.260 -28.054 -26.276 1.00 0.00 H new ATOM 0 HB ILE A 87 13.399 -28.005 -24.686 1.00 0.00 H new ATOM 0 HG12 ILE A 87 14.394 -29.405 -22.907 1.00 0.00 H new ATOM 0 HG13 ILE A 87 15.346 -30.261 -24.104 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.320 -30.110 -23.954 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.980 -29.741 -25.662 1.00 0.00 H new ATOM 0 HG23 ILE A 87 13.182 -30.984 -25.242 1.00 0.00 H new ATOM 0 HD11 ILE A 87 16.689 -28.571 -22.960 1.00 0.00 H new ATOM 0 HD12 ILE A 87 16.518 -28.170 -24.686 1.00 0.00 H new ATOM 0 HD13 ILE A 87 15.551 -27.301 -23.470 1.00 0.00 H new ATOM 1021 N SER A 88 14.566 -30.718 -27.825 1.00 0.00 N ATOM 1022 CA SER A 88 15.108 -31.928 -28.424 1.00 0.00 C ATOM 1023 C SER A 88 16.549 -31.704 -28.887 1.00 0.00 C ATOM 1024 O SER A 88 17.271 -32.651 -29.198 1.00 0.00 O ATOM 1025 CB SER A 88 14.220 -32.358 -29.590 1.00 0.00 C ATOM 1026 OG SER A 88 12.890 -31.892 -29.399 1.00 0.00 O ATOM 0 H SER A 88 13.731 -30.362 -28.291 1.00 0.00 H new ATOM 0 HA SER A 88 15.122 -32.722 -27.678 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.620 -31.964 -30.524 1.00 0.00 H new ATOM 0 HB3 SER A 88 14.223 -33.445 -29.676 1.00 0.00 H new ATOM 0 HG SER A 88 12.333 -32.174 -30.155 1.00 0.00 H new ATOM 1032 N LYS A 89 16.958 -30.435 -28.934 1.00 0.00 N ATOM 1033 CA LYS A 89 18.321 -30.084 -29.309 1.00 0.00 C ATOM 1034 C LYS A 89 19.302 -30.511 -28.221 1.00 0.00 C ATOM 1035 O LYS A 89 20.474 -30.769 -28.493 1.00 0.00 O ATOM 1036 CB LYS A 89 18.439 -28.576 -29.548 1.00 0.00 C ATOM 1037 CG LYS A 89 19.264 -28.204 -30.774 1.00 0.00 C ATOM 1038 CD LYS A 89 20.762 -28.300 -30.507 1.00 0.00 C ATOM 1039 CE LYS A 89 21.201 -27.351 -29.401 1.00 0.00 C ATOM 1040 NZ LYS A 89 22.466 -27.794 -28.754 1.00 0.00 N ATOM 0 H LYS A 89 16.362 -29.636 -28.716 1.00 0.00 H new ATOM 0 HA LYS A 89 18.566 -30.610 -30.232 1.00 0.00 H new ATOM 0 HB2 LYS A 89 17.439 -28.156 -29.655 1.00 0.00 H new ATOM 0 HB3 LYS A 89 18.886 -28.113 -28.668 1.00 0.00 H new ATOM 0 HG2 LYS A 89 19.001 -28.863 -31.601 1.00 0.00 H new ATOM 0 HG3 LYS A 89 19.016 -27.189 -31.083 1.00 0.00 H new ATOM 0 HD2 LYS A 89 21.017 -29.323 -30.231 1.00 0.00 H new ATOM 0 HD3 LYS A 89 21.310 -28.071 -31.421 1.00 0.00 H new ATOM 0 HE2 LYS A 89 21.336 -26.351 -29.814 1.00 0.00 H new ATOM 0 HE3 LYS A 89 20.415 -27.282 -28.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 22.729 -27.120 -28.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 22.331 -28.737 -28.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 23.224 -27.835 -29.465 1.00 0.00 H new ATOM 1054 N TYR A 90 18.817 -30.582 -26.989 1.00 0.00 N ATOM 1055 CA TYR A 90 19.659 -30.934 -25.858 1.00 0.00 C ATOM 1056 C TYR A 90 19.946 -32.430 -25.852 1.00 0.00 C ATOM 1057 O TYR A 90 21.053 -32.861 -26.176 1.00 0.00 O ATOM 1058 CB TYR A 90 18.979 -30.525 -24.548 1.00 0.00 C ATOM 1059 CG TYR A 90 19.826 -29.633 -23.672 1.00 0.00 C ATOM 1060 CD1 TYR A 90 20.760 -30.174 -22.799 1.00 0.00 C ATOM 1061 CD2 TYR A 90 19.694 -28.251 -23.719 1.00 0.00 C ATOM 1062 CE1 TYR A 90 21.533 -29.363 -21.995 1.00 0.00 C ATOM 1063 CE2 TYR A 90 20.466 -27.433 -22.919 1.00 0.00 C ATOM 1064 CZ TYR A 90 21.386 -27.996 -22.059 1.00 0.00 C ATOM 1065 OH TYR A 90 22.164 -27.189 -21.263 1.00 0.00 O ATOM 0 H TYR A 90 17.843 -30.400 -26.749 1.00 0.00 H new ATOM 0 HA TYR A 90 20.604 -30.399 -25.950 1.00 0.00 H new ATOM 0 HB2 TYR A 90 18.046 -30.011 -24.779 1.00 0.00 H new ATOM 0 HB3 TYR A 90 18.718 -31.424 -23.990 1.00 0.00 H new ATOM 0 HD1 TYR A 90 20.883 -31.246 -22.749 1.00 0.00 H new ATOM 0 HD2 TYR A 90 18.975 -27.809 -24.393 1.00 0.00 H new ATOM 0 HE1 TYR A 90 22.252 -29.799 -21.317 1.00 0.00 H new ATOM 0 HE2 TYR A 90 20.351 -26.360 -22.966 1.00 0.00 H new ATOM 0 HH TYR A 90 23.108 -27.420 -21.387 1.00 0.00 H new ATOM 1075 N VAL A 91 18.929 -33.211 -25.514 1.00 0.00 N ATOM 1076 CA VAL A 91 19.050 -34.659 -25.433 1.00 0.00 C ATOM 1077 C VAL A 91 17.693 -35.302 -25.652 1.00 0.00 C ATOM 1078 O VAL A 91 16.716 -34.615 -25.953 1.00 0.00 O ATOM 1079 CB VAL A 91 19.604 -35.132 -24.068 1.00 0.00 C ATOM 1080 CG1 VAL A 91 21.111 -35.320 -24.135 1.00 0.00 C ATOM 1081 CG2 VAL A 91 19.221 -34.166 -22.952 1.00 0.00 C ATOM 0 H VAL A 91 17.999 -32.859 -25.289 1.00 0.00 H new ATOM 0 HA VAL A 91 19.754 -34.961 -26.209 1.00 0.00 H new ATOM 0 HB VAL A 91 19.152 -36.097 -23.838 1.00 0.00 H new ATOM 0 HG11 VAL A 91 21.480 -35.653 -23.165 1.00 0.00 H new ATOM 0 HG12 VAL A 91 21.351 -36.068 -24.890 1.00 0.00 H new ATOM 0 HG13 VAL A 91 21.584 -34.374 -24.398 1.00 0.00 H new ATOM 0 HG21 VAL A 91 19.625 -34.525 -22.005 1.00 0.00 H new ATOM 0 HG22 VAL A 91 19.629 -33.179 -23.169 1.00 0.00 H new ATOM 0 HG23 VAL A 91 18.135 -34.102 -22.883 1.00 0.00 H new ATOM 1091 N GLU A 92 17.631 -36.615 -25.495 1.00 0.00 N ATOM 1092 CA GLU A 92 16.376 -37.342 -25.628 1.00 0.00 C ATOM 1093 C GLU A 92 15.693 -37.471 -24.271 1.00 0.00 C ATOM 1094 O GLU A 92 14.473 -37.640 -24.190 1.00 0.00 O ATOM 1095 CB GLU A 92 16.615 -38.730 -26.232 1.00 0.00 C ATOM 1096 CG GLU A 92 17.987 -39.310 -25.922 1.00 0.00 C ATOM 1097 CD GLU A 92 18.012 -40.076 -24.616 1.00 0.00 C ATOM 1098 OE1 GLU A 92 17.312 -41.104 -24.511 1.00 0.00 O ATOM 1099 OE2 GLU A 92 18.732 -39.650 -23.690 1.00 0.00 O ATOM 0 H GLU A 92 18.436 -37.201 -25.275 1.00 0.00 H new ATOM 0 HA GLU A 92 15.725 -36.781 -26.299 1.00 0.00 H new ATOM 0 HB2 GLU A 92 15.851 -39.413 -25.862 1.00 0.00 H new ATOM 0 HB3 GLU A 92 16.492 -38.671 -27.313 1.00 0.00 H new ATOM 0 HG2 GLU A 92 18.290 -39.972 -26.733 1.00 0.00 H new ATOM 0 HG3 GLU A 92 18.718 -38.503 -25.880 1.00 0.00 H new ATOM 1106 N ARG A 93 16.485 -37.381 -23.210 1.00 0.00 N ATOM 1107 CA ARG A 93 15.970 -37.520 -21.858 1.00 0.00 C ATOM 1108 C ARG A 93 15.933 -36.177 -21.140 1.00 0.00 C ATOM 1109 O ARG A 93 16.900 -35.774 -20.478 1.00 0.00 O ATOM 1110 CB ARG A 93 16.809 -38.515 -21.063 1.00 0.00 C ATOM 1111 CG ARG A 93 15.979 -39.531 -20.300 1.00 0.00 C ATOM 1112 CD ARG A 93 15.821 -40.821 -21.085 1.00 0.00 C ATOM 1113 NE ARG A 93 16.805 -41.825 -20.684 1.00 0.00 N ATOM 1114 CZ ARG A 93 16.501 -42.943 -20.030 1.00 0.00 C ATOM 1115 NH1 ARG A 93 15.238 -43.217 -19.721 1.00 0.00 N ATOM 1116 NH2 ARG A 93 17.458 -43.796 -19.686 1.00 0.00 N ATOM 0 H ARG A 93 17.489 -37.212 -23.262 1.00 0.00 H new ATOM 0 HA ARG A 93 14.950 -37.897 -21.930 1.00 0.00 H new ATOM 0 HB2 ARG A 93 17.477 -39.041 -21.745 1.00 0.00 H new ATOM 0 HB3 ARG A 93 17.437 -37.969 -20.360 1.00 0.00 H new ATOM 0 HG2 ARG A 93 16.452 -39.743 -19.341 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.996 -39.112 -20.085 1.00 0.00 H new ATOM 0 HD2 ARG A 93 14.816 -41.217 -20.935 1.00 0.00 H new ATOM 0 HD3 ARG A 93 15.927 -40.614 -22.150 1.00 0.00 H new ATOM 0 HE ARG A 93 17.783 -41.658 -20.920 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.496 -42.569 -19.985 1.00 0.00 H new ATOM 0 HH12 ARG A 93 15.010 -44.076 -19.220 1.00 0.00 H new ATOM 0 HH21 ARG A 93 18.430 -43.595 -19.923 1.00 0.00 H new ATOM 0 HH22 ARG A 93 17.222 -44.652 -19.185 1.00 0.00 H new ATOM 1130 N THR A 94 14.815 -35.490 -21.300 1.00 0.00 N ATOM 1131 CA THR A 94 14.546 -34.262 -20.582 1.00 0.00 C ATOM 1132 C THR A 94 13.334 -34.462 -19.678 1.00 0.00 C ATOM 1133 O THR A 94 12.190 -34.331 -20.118 1.00 0.00 O ATOM 1134 CB THR A 94 14.278 -33.099 -21.555 1.00 0.00 C ATOM 1135 OG1 THR A 94 14.763 -33.433 -22.865 1.00 0.00 O ATOM 1136 CG2 THR A 94 14.947 -31.822 -21.075 1.00 0.00 C ATOM 0 H THR A 94 14.068 -35.772 -21.934 1.00 0.00 H new ATOM 0 HA THR A 94 15.422 -34.011 -19.983 1.00 0.00 H new ATOM 0 HB THR A 94 13.202 -32.932 -21.595 1.00 0.00 H new ATOM 0 HG1 THR A 94 14.587 -32.689 -23.478 1.00 0.00 H new ATOM 0 HG21 THR A 94 14.742 -31.017 -21.780 1.00 0.00 H new ATOM 0 HG22 THR A 94 14.556 -31.553 -20.094 1.00 0.00 H new ATOM 0 HG23 THR A 94 16.023 -31.979 -21.006 1.00 0.00 H new ATOM 1144 N GLU A 95 13.592 -34.784 -18.423 1.00 0.00 N ATOM 1145 CA GLU A 95 12.542 -35.175 -17.493 1.00 0.00 C ATOM 1146 C GLU A 95 12.213 -34.031 -16.544 1.00 0.00 C ATOM 1147 O GLU A 95 12.905 -33.814 -15.552 1.00 0.00 O ATOM 1148 CB GLU A 95 13.006 -36.400 -16.699 1.00 0.00 C ATOM 1149 CG GLU A 95 11.891 -37.147 -15.994 1.00 0.00 C ATOM 1150 CD GLU A 95 12.420 -38.211 -15.053 1.00 0.00 C ATOM 1151 OE1 GLU A 95 12.719 -39.332 -15.518 1.00 0.00 O ATOM 1152 OE2 GLU A 95 12.539 -37.936 -13.839 1.00 0.00 O ATOM 0 H GLU A 95 14.529 -34.783 -18.019 1.00 0.00 H new ATOM 0 HA GLU A 95 11.641 -35.421 -18.054 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.515 -37.086 -17.376 1.00 0.00 H new ATOM 0 HB3 GLU A 95 13.739 -36.081 -15.958 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.280 -36.440 -15.433 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.241 -37.611 -16.736 1.00 0.00 H new ATOM 1159 N LEU A 96 11.151 -33.307 -16.847 1.00 0.00 N ATOM 1160 CA LEU A 96 10.761 -32.170 -16.032 1.00 0.00 C ATOM 1161 C LEU A 96 9.619 -32.539 -15.094 1.00 0.00 C ATOM 1162 O LEU A 96 8.529 -32.911 -15.533 1.00 0.00 O ATOM 1163 CB LEU A 96 10.357 -30.985 -16.912 1.00 0.00 C ATOM 1164 CG LEU A 96 10.469 -29.612 -16.241 1.00 0.00 C ATOM 1165 CD1 LEU A 96 11.325 -28.673 -17.075 1.00 0.00 C ATOM 1166 CD2 LEU A 96 9.092 -29.015 -16.024 1.00 0.00 C ATOM 0 H LEU A 96 10.545 -33.485 -17.648 1.00 0.00 H new ATOM 0 HA LEU A 96 11.622 -31.880 -15.430 1.00 0.00 H new ATOM 0 HB2 LEU A 96 10.980 -30.987 -17.807 1.00 0.00 H new ATOM 0 HB3 LEU A 96 9.328 -31.130 -17.240 1.00 0.00 H new ATOM 0 HG LEU A 96 10.949 -29.745 -15.272 1.00 0.00 H new ATOM 0 HD11 LEU A 96 11.391 -27.704 -16.580 1.00 0.00 H new ATOM 0 HD12 LEU A 96 12.325 -29.093 -17.185 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.874 -28.547 -18.059 1.00 0.00 H new ATOM 0 HD21 LEU A 96 9.189 -28.040 -15.547 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.590 -28.900 -16.985 1.00 0.00 H new ATOM 0 HD23 LEU A 96 8.506 -29.675 -15.385 1.00 0.00 H new ATOM 1178 N LEU A 97 9.890 -32.449 -13.804 1.00 0.00 N ATOM 1179 CA LEU A 97 8.878 -32.653 -12.784 1.00 0.00 C ATOM 1180 C LEU A 97 8.214 -31.322 -12.465 1.00 0.00 C ATOM 1181 O LEU A 97 8.838 -30.429 -11.873 1.00 0.00 O ATOM 1182 CB LEU A 97 9.503 -33.251 -11.521 1.00 0.00 C ATOM 1183 CG LEU A 97 9.177 -34.724 -11.269 1.00 0.00 C ATOM 1184 CD1 LEU A 97 9.798 -35.602 -12.344 1.00 0.00 C ATOM 1185 CD2 LEU A 97 9.659 -35.145 -9.890 1.00 0.00 C ATOM 0 H LEU A 97 10.816 -32.233 -13.435 1.00 0.00 H new ATOM 0 HA LEU A 97 8.129 -33.352 -13.156 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.586 -33.140 -11.583 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.172 -32.670 -10.661 1.00 0.00 H new ATOM 0 HG LEU A 97 8.095 -34.849 -11.310 1.00 0.00 H new ATOM 0 HD11 LEU A 97 9.555 -36.646 -12.147 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.405 -35.316 -13.320 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.880 -35.474 -12.337 1.00 0.00 H new ATOM 0 HD21 LEU A 97 9.420 -36.196 -9.726 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.738 -35.004 -9.823 1.00 0.00 H new ATOM 0 HD23 LEU A 97 9.166 -34.538 -9.131 1.00 0.00 H new ATOM 1197 N LYS A 98 6.958 -31.190 -12.877 1.00 0.00 N ATOM 1198 CA LYS A 98 6.229 -29.937 -12.735 1.00 0.00 C ATOM 1199 C LYS A 98 5.127 -30.045 -11.695 1.00 0.00 C ATOM 1200 O LYS A 98 4.541 -29.045 -11.318 1.00 0.00 O ATOM 1201 CB LYS A 98 5.605 -29.517 -14.067 1.00 0.00 C ATOM 1202 CG LYS A 98 5.946 -28.100 -14.495 1.00 0.00 C ATOM 1203 CD LYS A 98 5.718 -27.912 -15.986 1.00 0.00 C ATOM 1204 CE LYS A 98 5.439 -26.461 -16.337 1.00 0.00 C ATOM 1205 NZ LYS A 98 4.121 -26.000 -15.815 1.00 0.00 N ATOM 0 H LYS A 98 6.422 -31.940 -13.314 1.00 0.00 H new ATOM 0 HA LYS A 98 6.951 -29.188 -12.411 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.934 -30.208 -14.843 1.00 0.00 H new ATOM 0 HB3 LYS A 98 4.522 -29.612 -13.994 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.334 -27.391 -13.938 1.00 0.00 H new ATOM 0 HG3 LYS A 98 6.986 -27.883 -14.252 1.00 0.00 H new ATOM 0 HD2 LYS A 98 6.595 -28.256 -16.534 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.880 -28.531 -16.306 1.00 0.00 H new ATOM 0 HE2 LYS A 98 6.230 -25.832 -15.929 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.462 -26.340 -17.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 3.509 -25.727 -16.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.671 -26.770 -15.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.262 -25.181 -15.190 1.00 0.00 H new ATOM 1219 N ASP A 99 4.831 -31.249 -11.231 1.00 0.00 N ATOM 1220 CA ASP A 99 3.737 -31.422 -10.278 1.00 0.00 C ATOM 1221 C ASP A 99 4.055 -30.747 -8.946 1.00 0.00 C ATOM 1222 O ASP A 99 3.165 -30.473 -8.139 1.00 0.00 O ATOM 1223 CB ASP A 99 3.417 -32.898 -10.070 1.00 0.00 C ATOM 1224 CG ASP A 99 1.942 -33.182 -10.269 1.00 0.00 C ATOM 1225 OD1 ASP A 99 1.121 -32.659 -9.486 1.00 0.00 O ATOM 1226 OD2 ASP A 99 1.593 -33.905 -11.226 1.00 0.00 O ATOM 0 H ASP A 99 5.319 -32.107 -11.490 1.00 0.00 H new ATOM 0 HA ASP A 99 2.855 -30.940 -10.699 1.00 0.00 H new ATOM 0 HB2 ASP A 99 4.001 -33.499 -10.767 1.00 0.00 H new ATOM 0 HB3 ASP A 99 3.713 -33.197 -9.065 1.00 0.00 H new ATOM 1231 N GLY A 100 5.332 -30.467 -8.736 1.00 0.00 N ATOM 1232 CA GLY A 100 5.763 -29.722 -7.568 1.00 0.00 C ATOM 1233 C GLY A 100 5.455 -28.238 -7.688 1.00 0.00 C ATOM 1234 O GLY A 100 5.500 -27.502 -6.702 1.00 0.00 O ATOM 0 H GLY A 100 6.088 -30.746 -9.362 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.271 -30.123 -6.682 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.835 -29.859 -7.427 1.00 0.00 H new ATOM 1238 N ILE A 101 5.186 -27.798 -8.918 1.00 0.00 N ATOM 1239 CA ILE A 101 4.980 -26.385 -9.223 1.00 0.00 C ATOM 1240 C ILE A 101 3.840 -25.788 -8.396 1.00 0.00 C ATOM 1241 O ILE A 101 3.864 -24.605 -8.067 1.00 0.00 O ATOM 1242 CB ILE A 101 4.733 -26.173 -10.742 1.00 0.00 C ATOM 1243 CG1 ILE A 101 5.178 -24.782 -11.176 1.00 0.00 C ATOM 1244 CG2 ILE A 101 3.279 -26.408 -11.129 1.00 0.00 C ATOM 1245 CD1 ILE A 101 5.460 -24.684 -12.660 1.00 0.00 C ATOM 0 H ILE A 101 5.105 -28.412 -9.729 1.00 0.00 H new ATOM 0 HA ILE A 101 5.894 -25.857 -8.950 1.00 0.00 H new ATOM 0 HB ILE A 101 5.334 -26.916 -11.266 1.00 0.00 H new ATOM 0 HG12 ILE A 101 4.405 -24.061 -10.911 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.075 -24.505 -10.623 1.00 0.00 H new ATOM 0 HG21 ILE A 101 3.157 -26.248 -12.200 1.00 0.00 H new ATOM 0 HG22 ILE A 101 2.997 -27.431 -10.881 1.00 0.00 H new ATOM 0 HG23 ILE A 101 2.640 -25.713 -10.583 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.772 -23.669 -12.905 1.00 0.00 H new ATOM 0 HD12 ILE A 101 6.254 -25.382 -12.926 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.557 -24.931 -13.219 1.00 0.00 H new ATOM 1257 N GLY A 102 2.867 -26.622 -8.029 1.00 0.00 N ATOM 1258 CA GLY A 102 1.758 -26.168 -7.207 1.00 0.00 C ATOM 1259 C GLY A 102 2.201 -25.707 -5.830 1.00 0.00 C ATOM 1260 O GLY A 102 1.489 -24.960 -5.159 1.00 0.00 O ATOM 0 H GLY A 102 2.829 -27.608 -8.288 1.00 0.00 H new ATOM 0 HA2 GLY A 102 1.247 -25.349 -7.713 1.00 0.00 H new ATOM 0 HA3 GLY A 102 1.035 -26.977 -7.100 1.00 0.00 H new ATOM 1264 N GLU A 103 3.378 -26.159 -5.409 1.00 0.00 N ATOM 1265 CA GLU A 103 3.953 -25.753 -4.134 1.00 0.00 C ATOM 1266 C GLU A 103 5.152 -24.838 -4.364 1.00 0.00 C ATOM 1267 O GLU A 103 5.839 -24.439 -3.423 1.00 0.00 O ATOM 1268 CB GLU A 103 4.385 -26.977 -3.328 1.00 0.00 C ATOM 1269 CG GLU A 103 4.014 -26.902 -1.858 1.00 0.00 C ATOM 1270 CD GLU A 103 5.231 -26.898 -0.960 1.00 0.00 C ATOM 1271 OE1 GLU A 103 5.932 -27.929 -0.900 1.00 0.00 O ATOM 1272 OE2 GLU A 103 5.501 -25.861 -0.319 1.00 0.00 O ATOM 0 H GLU A 103 3.955 -26.812 -5.938 1.00 0.00 H new ATOM 0 HA GLU A 103 3.193 -25.211 -3.571 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.930 -27.867 -3.763 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.465 -27.096 -3.415 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.429 -26.000 -1.678 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.379 -27.750 -1.602 1.00 0.00 H new ATOM 1279 N GLY A 104 5.393 -24.503 -5.622 1.00 0.00 N ATOM 1280 CA GLY A 104 6.518 -23.665 -5.966 1.00 0.00 C ATOM 1281 C GLY A 104 7.815 -24.440 -6.067 1.00 0.00 C ATOM 1282 O GLY A 104 8.852 -23.988 -5.582 1.00 0.00 O ATOM 0 H GLY A 104 4.824 -24.800 -6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 104 6.320 -23.171 -6.917 1.00 0.00 H new ATOM 0 HA3 GLY A 104 6.625 -22.882 -5.216 1.00 0.00 H new ATOM 1286 N LYS A 105 7.763 -25.616 -6.676 1.00 0.00 N ATOM 1287 CA LYS A 105 8.968 -26.400 -6.911 1.00 0.00 C ATOM 1288 C LYS A 105 8.994 -26.924 -8.340 1.00 0.00 C ATOM 1289 O LYS A 105 8.005 -27.459 -8.825 1.00 0.00 O ATOM 1290 CB LYS A 105 9.032 -27.578 -5.938 1.00 0.00 C ATOM 1291 CG LYS A 105 9.621 -27.223 -4.586 1.00 0.00 C ATOM 1292 CD LYS A 105 8.591 -27.358 -3.477 1.00 0.00 C ATOM 1293 CE LYS A 105 9.207 -27.954 -2.223 1.00 0.00 C ATOM 1294 NZ LYS A 105 8.528 -27.481 -0.990 1.00 0.00 N ATOM 0 H LYS A 105 6.903 -26.047 -7.015 1.00 0.00 H new ATOM 0 HA LYS A 105 9.831 -25.753 -6.753 1.00 0.00 H new ATOM 0 HB2 LYS A 105 8.026 -27.973 -5.794 1.00 0.00 H new ATOM 0 HB3 LYS A 105 9.626 -28.375 -6.385 1.00 0.00 H new ATOM 0 HG2 LYS A 105 10.470 -27.873 -4.376 1.00 0.00 H new ATOM 0 HG3 LYS A 105 10.000 -26.201 -4.610 1.00 0.00 H new ATOM 0 HD2 LYS A 105 8.169 -26.379 -3.248 1.00 0.00 H new ATOM 0 HD3 LYS A 105 7.769 -27.988 -3.816 1.00 0.00 H new ATOM 0 HE2 LYS A 105 9.151 -29.041 -2.273 1.00 0.00 H new ATOM 0 HE3 LYS A 105 10.264 -27.691 -2.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 9.104 -27.728 -0.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 8.408 -26.449 -1.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 7.595 -27.935 -0.911 1.00 0.00 H new ATOM 1308 N VAL A 106 10.118 -26.771 -9.015 1.00 0.00 N ATOM 1309 CA VAL A 106 10.274 -27.343 -10.344 1.00 0.00 C ATOM 1310 C VAL A 106 11.602 -28.072 -10.450 1.00 0.00 C ATOM 1311 O VAL A 106 12.648 -27.534 -10.068 1.00 0.00 O ATOM 1312 CB VAL A 106 10.187 -26.282 -11.465 1.00 0.00 C ATOM 1313 CG1 VAL A 106 8.804 -26.290 -12.096 1.00 0.00 C ATOM 1314 CG2 VAL A 106 10.527 -24.891 -10.948 1.00 0.00 C ATOM 0 H VAL A 106 10.931 -26.261 -8.671 1.00 0.00 H new ATOM 0 HA VAL A 106 9.447 -28.040 -10.482 1.00 0.00 H new ATOM 0 HB VAL A 106 10.924 -26.542 -12.225 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.759 -25.538 -12.883 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.604 -27.273 -12.522 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.056 -26.065 -11.336 1.00 0.00 H new ATOM 0 HG21 VAL A 106 10.455 -24.172 -11.764 1.00 0.00 H new ATOM 0 HG22 VAL A 106 9.828 -24.615 -10.159 1.00 0.00 H new ATOM 0 HG23 VAL A 106 11.542 -24.889 -10.551 1.00 0.00 H new ATOM 1324 N THR A 107 11.560 -29.285 -10.975 1.00 0.00 N ATOM 1325 CA THR A 107 12.758 -30.096 -11.098 1.00 0.00 C ATOM 1326 C THR A 107 12.980 -30.502 -12.551 1.00 0.00 C ATOM 1327 O THR A 107 12.098 -31.073 -13.185 1.00 0.00 O ATOM 1328 CB THR A 107 12.674 -31.354 -10.194 1.00 0.00 C ATOM 1329 OG1 THR A 107 13.165 -31.054 -8.880 1.00 0.00 O ATOM 1330 CG2 THR A 107 13.469 -32.519 -10.767 1.00 0.00 C ATOM 0 H THR A 107 10.710 -29.729 -11.322 1.00 0.00 H new ATOM 0 HA THR A 107 13.606 -29.496 -10.768 1.00 0.00 H new ATOM 0 HB THR A 107 11.625 -31.645 -10.145 1.00 0.00 H new ATOM 0 HG1 THR A 107 14.123 -31.256 -8.835 1.00 0.00 H new ATOM 0 HG21 THR A 107 13.383 -33.379 -10.103 1.00 0.00 H new ATOM 0 HG22 THR A 107 13.077 -32.779 -11.750 1.00 0.00 H new ATOM 0 HG23 THR A 107 14.517 -32.234 -10.858 1.00 0.00 H new ATOM 1338 N LEU A 108 14.146 -30.188 -13.081 1.00 0.00 N ATOM 1339 CA LEU A 108 14.498 -30.607 -14.421 1.00 0.00 C ATOM 1340 C LEU A 108 15.619 -31.626 -14.368 1.00 0.00 C ATOM 1341 O LEU A 108 16.742 -31.308 -13.978 1.00 0.00 O ATOM 1342 CB LEU A 108 14.917 -29.416 -15.286 1.00 0.00 C ATOM 1343 CG LEU A 108 15.422 -29.782 -16.687 1.00 0.00 C ATOM 1344 CD1 LEU A 108 14.384 -30.606 -17.438 1.00 0.00 C ATOM 1345 CD2 LEU A 108 15.776 -28.528 -17.470 1.00 0.00 C ATOM 0 H LEU A 108 14.865 -29.644 -12.603 1.00 0.00 H new ATOM 0 HA LEU A 108 13.616 -31.060 -14.874 1.00 0.00 H new ATOM 0 HB2 LEU A 108 14.067 -28.742 -15.387 1.00 0.00 H new ATOM 0 HB3 LEU A 108 15.701 -28.865 -14.766 1.00 0.00 H new ATOM 0 HG LEU A 108 16.322 -30.387 -16.578 1.00 0.00 H new ATOM 0 HD11 LEU A 108 14.764 -30.854 -18.429 1.00 0.00 H new ATOM 0 HD12 LEU A 108 14.180 -31.524 -16.887 1.00 0.00 H new ATOM 0 HD13 LEU A 108 13.464 -30.030 -17.536 1.00 0.00 H new ATOM 0 HD21 LEU A 108 16.132 -28.807 -18.462 1.00 0.00 H new ATOM 0 HD22 LEU A 108 14.892 -27.897 -17.566 1.00 0.00 H new ATOM 0 HD23 LEU A 108 16.558 -27.979 -16.944 1.00 0.00 H new ATOM 1357 N ARG A 109 15.300 -32.853 -14.730 1.00 0.00 N ATOM 1358 CA ARG A 109 16.297 -33.895 -14.842 1.00 0.00 C ATOM 1359 C ARG A 109 16.747 -34.006 -16.289 1.00 0.00 C ATOM 1360 O ARG A 109 16.013 -34.505 -17.143 1.00 0.00 O ATOM 1361 CB ARG A 109 15.733 -35.233 -14.356 1.00 0.00 C ATOM 1362 CG ARG A 109 15.921 -35.470 -12.867 1.00 0.00 C ATOM 1363 CD ARG A 109 14.642 -35.966 -12.213 1.00 0.00 C ATOM 1364 NE ARG A 109 14.905 -36.645 -10.944 1.00 0.00 N ATOM 1365 CZ ARG A 109 14.475 -37.874 -10.648 1.00 0.00 C ATOM 1366 NH1 ARG A 109 13.719 -38.553 -11.505 1.00 0.00 N ATOM 1367 NH2 ARG A 109 14.799 -38.419 -9.482 1.00 0.00 N ATOM 0 H ARG A 109 14.351 -33.152 -14.953 1.00 0.00 H new ATOM 0 HA ARG A 109 17.152 -33.641 -14.216 1.00 0.00 H new ATOM 0 HB2 ARG A 109 14.669 -35.275 -14.590 1.00 0.00 H new ATOM 0 HB3 ARG A 109 16.213 -36.041 -14.907 1.00 0.00 H new ATOM 0 HG2 ARG A 109 16.716 -36.199 -12.712 1.00 0.00 H new ATOM 0 HG3 ARG A 109 16.240 -34.544 -12.388 1.00 0.00 H new ATOM 0 HD2 ARG A 109 13.972 -35.124 -12.042 1.00 0.00 H new ATOM 0 HD3 ARG A 109 14.129 -36.649 -12.890 1.00 0.00 H new ATOM 0 HE ARG A 109 15.452 -36.148 -10.241 1.00 0.00 H new ATOM 0 HH11 ARG A 109 13.462 -38.136 -12.400 1.00 0.00 H new ATOM 0 HH12 ARG A 109 13.396 -39.491 -11.268 1.00 0.00 H new ATOM 0 HH21 ARG A 109 15.373 -37.899 -8.818 1.00 0.00 H new ATOM 0 HH22 ARG A 109 14.474 -39.357 -9.250 1.00 0.00 H new ATOM 1381 N ILE A 110 17.942 -33.524 -16.559 1.00 0.00 N ATOM 1382 CA ILE A 110 18.508 -33.601 -17.890 1.00 0.00 C ATOM 1383 C ILE A 110 19.556 -34.708 -17.916 1.00 0.00 C ATOM 1384 O ILE A 110 20.383 -34.813 -17.002 1.00 0.00 O ATOM 1385 CB ILE A 110 19.105 -32.230 -18.330 1.00 0.00 C ATOM 1386 CG1 ILE A 110 18.266 -31.618 -19.463 1.00 0.00 C ATOM 1387 CG2 ILE A 110 20.563 -32.351 -18.758 1.00 0.00 C ATOM 1388 CD1 ILE A 110 18.537 -30.143 -19.686 1.00 0.00 C ATOM 0 H ILE A 110 18.543 -33.072 -15.870 1.00 0.00 H new ATOM 0 HA ILE A 110 17.722 -33.840 -18.607 1.00 0.00 H new ATOM 0 HB ILE A 110 19.073 -31.570 -17.463 1.00 0.00 H new ATOM 0 HG12 ILE A 110 18.467 -32.160 -20.387 1.00 0.00 H new ATOM 0 HG13 ILE A 110 17.209 -31.755 -19.236 1.00 0.00 H new ATOM 0 HG21 ILE A 110 20.937 -31.372 -19.056 1.00 0.00 H new ATOM 0 HG22 ILE A 110 21.157 -32.728 -17.925 1.00 0.00 H new ATOM 0 HG23 ILE A 110 20.639 -33.040 -19.599 1.00 0.00 H new ATOM 0 HD11 ILE A 110 17.911 -29.777 -20.500 1.00 0.00 H new ATOM 0 HD12 ILE A 110 18.309 -29.589 -18.775 1.00 0.00 H new ATOM 0 HD13 ILE A 110 19.587 -30.001 -19.944 1.00 0.00 H new ATOM 1400 N PHE A 111 19.489 -35.568 -18.920 1.00 0.00 N ATOM 1401 CA PHE A 111 20.447 -36.655 -19.029 1.00 0.00 C ATOM 1402 C PHE A 111 21.591 -36.282 -19.959 1.00 0.00 C ATOM 1403 O PHE A 111 21.387 -35.591 -20.956 1.00 0.00 O ATOM 1404 CB PHE A 111 19.762 -37.930 -19.513 1.00 0.00 C ATOM 1405 CG PHE A 111 19.529 -38.929 -18.416 1.00 0.00 C ATOM 1406 CD1 PHE A 111 18.534 -38.722 -17.474 1.00 0.00 C ATOM 1407 CD2 PHE A 111 20.308 -40.071 -18.324 1.00 0.00 C ATOM 1408 CE1 PHE A 111 18.318 -39.638 -16.462 1.00 0.00 C ATOM 1409 CE2 PHE A 111 20.096 -40.991 -17.316 1.00 0.00 C ATOM 1410 CZ PHE A 111 19.100 -40.774 -16.383 1.00 0.00 C ATOM 0 H PHE A 111 18.790 -35.536 -19.662 1.00 0.00 H new ATOM 0 HA PHE A 111 20.860 -36.838 -18.037 1.00 0.00 H new ATOM 0 HB2 PHE A 111 18.806 -37.671 -19.969 1.00 0.00 H new ATOM 0 HB3 PHE A 111 20.372 -38.390 -20.291 1.00 0.00 H new ATOM 0 HD1 PHE A 111 17.921 -37.835 -17.531 1.00 0.00 H new ATOM 0 HD2 PHE A 111 21.090 -40.244 -19.049 1.00 0.00 H new ATOM 0 HE1 PHE A 111 17.539 -39.466 -15.734 1.00 0.00 H new ATOM 0 HE2 PHE A 111 20.708 -41.879 -17.257 1.00 0.00 H new ATOM 0 HZ PHE A 111 18.933 -41.492 -15.593 1.00 0.00 H new ATOM 1420 N ASN A 112 22.789 -36.739 -19.606 1.00 0.00 N ATOM 1421 CA ASN A 112 24.001 -36.487 -20.387 1.00 0.00 C ATOM 1422 C ASN A 112 24.374 -35.012 -20.359 1.00 0.00 C ATOM 1423 O ASN A 112 24.036 -34.245 -21.259 1.00 0.00 O ATOM 1424 CB ASN A 112 23.848 -36.975 -21.832 1.00 0.00 C ATOM 1425 CG ASN A 112 25.117 -36.786 -22.644 1.00 0.00 C ATOM 1426 OD1 ASN A 112 26.212 -37.112 -22.190 1.00 0.00 O ATOM 1427 ND2 ASN A 112 24.976 -36.261 -23.852 1.00 0.00 N ATOM 0 H ASN A 112 22.949 -37.297 -18.767 1.00 0.00 H new ATOM 0 HA ASN A 112 24.809 -37.054 -19.925 1.00 0.00 H new ATOM 0 HB2 ASN A 112 23.575 -38.030 -21.829 1.00 0.00 H new ATOM 0 HB3 ASN A 112 23.030 -36.436 -22.310 1.00 0.00 H new ATOM 0 HD21 ASN A 112 25.794 -36.114 -24.443 1.00 0.00 H new ATOM 0 HD22 ASN A 112 24.049 -36.004 -24.191 1.00 0.00 H new ATOM 1434 N VAL A 113 25.078 -34.634 -19.306 1.00 0.00 N ATOM 1435 CA VAL A 113 25.545 -33.271 -19.139 1.00 0.00 C ATOM 1436 C VAL A 113 26.973 -33.142 -19.656 1.00 0.00 C ATOM 1437 O VAL A 113 27.843 -33.936 -19.288 1.00 0.00 O ATOM 1438 CB VAL A 113 25.506 -32.852 -17.658 1.00 0.00 C ATOM 1439 CG1 VAL A 113 25.203 -31.369 -17.529 1.00 0.00 C ATOM 1440 CG2 VAL A 113 24.489 -33.678 -16.882 1.00 0.00 C ATOM 0 H VAL A 113 25.341 -35.262 -18.546 1.00 0.00 H new ATOM 0 HA VAL A 113 24.884 -32.617 -19.708 1.00 0.00 H new ATOM 0 HB VAL A 113 26.490 -33.041 -17.229 1.00 0.00 H new ATOM 0 HG11 VAL A 113 25.180 -31.093 -16.475 1.00 0.00 H new ATOM 0 HG12 VAL A 113 25.977 -30.794 -18.038 1.00 0.00 H new ATOM 0 HG13 VAL A 113 24.235 -31.155 -17.982 1.00 0.00 H new ATOM 0 HG21 VAL A 113 24.482 -33.361 -15.839 1.00 0.00 H new ATOM 0 HG22 VAL A 113 23.498 -33.532 -17.312 1.00 0.00 H new ATOM 0 HG23 VAL A 113 24.758 -34.733 -16.939 1.00 0.00 H new ATOM 1450 N THR A 114 27.209 -32.160 -20.516 1.00 0.00 N ATOM 1451 CA THR A 114 28.524 -31.971 -21.109 1.00 0.00 C ATOM 1452 C THR A 114 29.330 -30.917 -20.356 1.00 0.00 C ATOM 1453 O THR A 114 28.825 -30.263 -19.436 1.00 0.00 O ATOM 1454 CB THR A 114 28.412 -31.552 -22.587 1.00 0.00 C ATOM 1455 OG1 THR A 114 27.832 -30.241 -22.680 1.00 0.00 O ATOM 1456 CG2 THR A 114 27.567 -32.545 -23.372 1.00 0.00 C ATOM 0 H THR A 114 26.508 -31.484 -20.817 1.00 0.00 H new ATOM 0 HA THR A 114 29.040 -32.929 -21.042 1.00 0.00 H new ATOM 0 HB THR A 114 29.414 -31.539 -23.016 1.00 0.00 H new ATOM 0 HG1 THR A 114 26.856 -30.310 -22.617 1.00 0.00 H new ATOM 0 HG21 THR A 114 27.504 -32.226 -24.412 1.00 0.00 H new ATOM 0 HG22 THR A 114 28.026 -33.532 -23.322 1.00 0.00 H new ATOM 0 HG23 THR A 114 26.565 -32.589 -22.944 1.00 0.00 H new ATOM 1464 N VAL A 115 30.583 -30.738 -20.766 1.00 0.00 N ATOM 1465 CA VAL A 115 31.455 -29.740 -20.159 1.00 0.00 C ATOM 1466 C VAL A 115 30.979 -28.327 -20.505 1.00 0.00 C ATOM 1467 O VAL A 115 31.363 -27.353 -19.858 1.00 0.00 O ATOM 1468 CB VAL A 115 32.926 -29.934 -20.597 1.00 0.00 C ATOM 1469 CG1 VAL A 115 33.141 -29.475 -22.032 1.00 0.00 C ATOM 1470 CG2 VAL A 115 33.877 -29.216 -19.645 1.00 0.00 C ATOM 0 H VAL A 115 31.017 -31.273 -21.518 1.00 0.00 H new ATOM 0 HA VAL A 115 31.406 -29.872 -19.078 1.00 0.00 H new ATOM 0 HB VAL A 115 33.147 -31.001 -20.555 1.00 0.00 H new ATOM 0 HG11 VAL A 115 34.184 -29.624 -22.309 1.00 0.00 H new ATOM 0 HG12 VAL A 115 32.502 -30.054 -22.699 1.00 0.00 H new ATOM 0 HG13 VAL A 115 32.891 -28.418 -22.117 1.00 0.00 H new ATOM 0 HG21 VAL A 115 34.905 -29.368 -19.975 1.00 0.00 H new ATOM 0 HG22 VAL A 115 33.651 -28.150 -19.640 1.00 0.00 H new ATOM 0 HG23 VAL A 115 33.756 -29.617 -18.639 1.00 0.00 H new ATOM 1480 N ASP A 116 30.133 -28.225 -21.523 1.00 0.00 N ATOM 1481 CA ASP A 116 29.542 -26.947 -21.899 1.00 0.00 C ATOM 1482 C ASP A 116 28.389 -26.633 -20.958 1.00 0.00 C ATOM 1483 O ASP A 116 28.270 -25.521 -20.448 1.00 0.00 O ATOM 1484 CB ASP A 116 29.045 -26.981 -23.349 1.00 0.00 C ATOM 1485 CG ASP A 116 29.158 -25.634 -24.046 1.00 0.00 C ATOM 1486 OD1 ASP A 116 30.048 -24.836 -23.679 1.00 0.00 O ATOM 1487 OD2 ASP A 116 28.371 -25.375 -24.984 1.00 0.00 O ATOM 0 H ASP A 116 29.841 -29.012 -22.103 1.00 0.00 H new ATOM 0 HA ASP A 116 30.302 -26.169 -21.821 1.00 0.00 H new ATOM 0 HB2 ASP A 116 29.618 -27.722 -23.907 1.00 0.00 H new ATOM 0 HB3 ASP A 116 28.005 -27.306 -23.363 1.00 0.00 H new ATOM 1492 N ASP A 117 27.562 -27.644 -20.708 1.00 0.00 N ATOM 1493 CA ASP A 117 26.425 -27.519 -19.794 1.00 0.00 C ATOM 1494 C ASP A 117 26.906 -27.289 -18.370 1.00 0.00 C ATOM 1495 O ASP A 117 26.193 -26.720 -17.548 1.00 0.00 O ATOM 1496 CB ASP A 117 25.554 -28.773 -19.845 1.00 0.00 C ATOM 1497 CG ASP A 117 25.125 -29.121 -21.250 1.00 0.00 C ATOM 1498 OD1 ASP A 117 24.491 -28.272 -21.910 1.00 0.00 O ATOM 1499 OD2 ASP A 117 25.435 -30.245 -21.703 1.00 0.00 O ATOM 0 H ASP A 117 27.658 -28.568 -21.129 1.00 0.00 H new ATOM 0 HA ASP A 117 25.831 -26.662 -20.111 1.00 0.00 H new ATOM 0 HB2 ASP A 117 26.104 -29.612 -19.418 1.00 0.00 H new ATOM 0 HB3 ASP A 117 24.670 -28.623 -19.225 1.00 0.00 H new ATOM 1504 N ASP A 118 28.125 -27.744 -18.096 1.00 0.00 N ATOM 1505 CA ASP A 118 28.791 -27.512 -16.812 1.00 0.00 C ATOM 1506 C ASP A 118 28.866 -26.016 -16.476 1.00 0.00 C ATOM 1507 O ASP A 118 29.076 -25.635 -15.328 1.00 0.00 O ATOM 1508 CB ASP A 118 30.200 -28.118 -16.858 1.00 0.00 C ATOM 1509 CG ASP A 118 31.051 -27.771 -15.651 1.00 0.00 C ATOM 1510 OD1 ASP A 118 30.876 -28.402 -14.588 1.00 0.00 O ATOM 1511 OD2 ASP A 118 31.921 -26.877 -15.770 1.00 0.00 O ATOM 0 H ASP A 118 28.682 -28.285 -18.757 1.00 0.00 H new ATOM 0 HA ASP A 118 28.206 -27.993 -16.028 1.00 0.00 H new ATOM 0 HB2 ASP A 118 30.118 -29.202 -16.934 1.00 0.00 H new ATOM 0 HB3 ASP A 118 30.706 -27.773 -17.760 1.00 0.00 H new ATOM 1516 N GLY A 119 28.677 -25.169 -17.479 1.00 0.00 N ATOM 1517 CA GLY A 119 28.713 -23.739 -17.254 1.00 0.00 C ATOM 1518 C GLY A 119 27.499 -23.223 -16.495 1.00 0.00 C ATOM 1519 O GLY A 119 26.825 -23.969 -15.780 1.00 0.00 O ATOM 0 H GLY A 119 28.499 -25.447 -18.444 1.00 0.00 H new ATOM 0 HA2 GLY A 119 29.616 -23.487 -16.697 1.00 0.00 H new ATOM 0 HA3 GLY A 119 28.778 -23.228 -18.214 1.00 0.00 H new ATOM 1523 N SER A 120 27.219 -21.941 -16.659 1.00 0.00 N ATOM 1524 CA SER A 120 26.133 -21.286 -15.949 1.00 0.00 C ATOM 1525 C SER A 120 24.775 -21.602 -16.576 1.00 0.00 C ATOM 1526 O SER A 120 24.440 -21.097 -17.649 1.00 0.00 O ATOM 1527 CB SER A 120 26.386 -19.780 -15.958 1.00 0.00 C ATOM 1528 OG SER A 120 27.569 -19.480 -16.689 1.00 0.00 O ATOM 0 H SER A 120 27.737 -21.326 -17.287 1.00 0.00 H new ATOM 0 HA SER A 120 26.105 -21.658 -14.925 1.00 0.00 H new ATOM 0 HB2 SER A 120 25.535 -19.265 -16.404 1.00 0.00 H new ATOM 0 HB3 SER A 120 26.480 -19.415 -14.935 1.00 0.00 H new ATOM 0 HG SER A 120 27.718 -18.511 -16.688 1.00 0.00 H new ATOM 1534 N TYR A 121 24.000 -22.449 -15.912 1.00 0.00 N ATOM 1535 CA TYR A 121 22.633 -22.718 -16.330 1.00 0.00 C ATOM 1536 C TYR A 121 21.765 -21.519 -15.976 1.00 0.00 C ATOM 1537 O TYR A 121 21.985 -20.864 -14.954 1.00 0.00 O ATOM 1538 CB TYR A 121 22.086 -23.963 -15.626 1.00 0.00 C ATOM 1539 CG TYR A 121 21.955 -25.187 -16.499 1.00 0.00 C ATOM 1540 CD1 TYR A 121 23.074 -25.900 -16.902 1.00 0.00 C ATOM 1541 CD2 TYR A 121 20.708 -25.643 -16.900 1.00 0.00 C ATOM 1542 CE1 TYR A 121 22.954 -27.032 -17.685 1.00 0.00 C ATOM 1543 CE2 TYR A 121 20.581 -26.775 -17.680 1.00 0.00 C ATOM 1544 CZ TYR A 121 21.707 -27.464 -18.069 1.00 0.00 C ATOM 1545 OH TYR A 121 21.582 -28.589 -18.845 1.00 0.00 O ATOM 0 H TYR A 121 24.296 -22.961 -15.081 1.00 0.00 H new ATOM 0 HA TYR A 121 22.620 -22.893 -17.406 1.00 0.00 H new ATOM 0 HB2 TYR A 121 22.739 -24.203 -14.787 1.00 0.00 H new ATOM 0 HB3 TYR A 121 21.107 -23.726 -15.211 1.00 0.00 H new ATOM 0 HD1 TYR A 121 24.055 -25.565 -16.599 1.00 0.00 H new ATOM 0 HD2 TYR A 121 19.822 -25.104 -16.597 1.00 0.00 H new ATOM 0 HE1 TYR A 121 23.835 -27.575 -17.994 1.00 0.00 H new ATOM 0 HE2 TYR A 121 19.603 -27.118 -17.983 1.00 0.00 H new ATOM 0 HH TYR A 121 21.673 -28.346 -19.790 1.00 0.00 H new ATOM 1555 N HIS A 122 20.794 -21.216 -16.813 1.00 0.00 N ATOM 1556 CA HIS A 122 19.904 -20.105 -16.541 1.00 0.00 C ATOM 1557 C HIS A 122 18.513 -20.610 -16.199 1.00 0.00 C ATOM 1558 O HIS A 122 17.834 -21.213 -17.039 1.00 0.00 O ATOM 1559 CB HIS A 122 19.842 -19.143 -17.730 1.00 0.00 C ATOM 1560 CG HIS A 122 19.891 -17.695 -17.330 1.00 0.00 C ATOM 1561 ND1 HIS A 122 20.526 -17.080 -16.300 1.00 0.00 N flip ATOM 1562 CD2 HIS A 122 19.232 -16.695 -18.014 1.00 0.00 C flip ATOM 1563 CE1 HIS A 122 20.240 -15.741 -16.383 1.00 0.00 C flip ATOM 1564 NE2 HIS A 122 19.458 -15.536 -17.425 1.00 0.00 N flip ATOM 0 H HIS A 122 20.601 -21.718 -17.680 1.00 0.00 H new ATOM 0 HA HIS A 122 20.301 -19.560 -15.684 1.00 0.00 H new ATOM 0 HB2 HIS A 122 20.673 -19.355 -18.403 1.00 0.00 H new ATOM 0 HB3 HIS A 122 18.925 -19.327 -18.289 1.00 0.00 H new ATOM 0 HD2 HIS A 122 18.625 -16.838 -18.896 1.00 0.00 H new ATOM 0 HE1 HIS A 122 20.597 -14.979 -15.706 1.00 0.00 H new ATOM 0 HE2 HIS A 122 19.090 -14.633 -17.725 1.00 0.00 H new ATOM 1573 N CYS A 123 18.114 -20.379 -14.957 1.00 0.00 N ATOM 1574 CA CYS A 123 16.764 -20.676 -14.518 1.00 0.00 C ATOM 1575 C CYS A 123 15.945 -19.400 -14.579 1.00 0.00 C ATOM 1576 O CYS A 123 16.261 -18.424 -13.908 1.00 0.00 O ATOM 1577 CB CYS A 123 16.771 -21.231 -13.086 1.00 0.00 C ATOM 1578 SG CYS A 123 15.124 -21.692 -12.441 1.00 0.00 S ATOM 0 H CYS A 123 18.713 -19.984 -14.233 1.00 0.00 H new ATOM 0 HA CYS A 123 16.327 -21.432 -15.170 1.00 0.00 H new ATOM 0 HB2 CYS A 123 17.418 -22.108 -13.053 1.00 0.00 H new ATOM 0 HB3 CYS A 123 17.211 -20.485 -12.423 1.00 0.00 H new ATOM 1583 N VAL A 124 14.925 -19.398 -15.415 1.00 0.00 N ATOM 1584 CA VAL A 124 14.065 -18.241 -15.581 1.00 0.00 C ATOM 1585 C VAL A 124 12.612 -18.673 -15.504 1.00 0.00 C ATOM 1586 O VAL A 124 12.089 -19.275 -16.437 1.00 0.00 O ATOM 1587 CB VAL A 124 14.302 -17.527 -16.932 1.00 0.00 C ATOM 1588 CG1 VAL A 124 13.620 -16.169 -16.942 1.00 0.00 C ATOM 1589 CG2 VAL A 124 15.789 -17.379 -17.231 1.00 0.00 C ATOM 0 H VAL A 124 14.669 -20.196 -15.997 1.00 0.00 H new ATOM 0 HA VAL A 124 14.304 -17.541 -14.781 1.00 0.00 H new ATOM 0 HB VAL A 124 13.865 -18.145 -17.716 1.00 0.00 H new ATOM 0 HG11 VAL A 124 13.797 -15.680 -17.900 1.00 0.00 H new ATOM 0 HG12 VAL A 124 12.548 -16.299 -16.793 1.00 0.00 H new ATOM 0 HG13 VAL A 124 14.025 -15.552 -16.140 1.00 0.00 H new ATOM 0 HG21 VAL A 124 15.919 -16.873 -18.188 1.00 0.00 H new ATOM 0 HG22 VAL A 124 16.262 -16.793 -16.443 1.00 0.00 H new ATOM 0 HG23 VAL A 124 16.251 -18.365 -17.276 1.00 0.00 H new ATOM 1599 N PHE A 125 11.964 -18.385 -14.397 1.00 0.00 N ATOM 1600 CA PHE A 125 10.581 -18.780 -14.229 1.00 0.00 C ATOM 1601 C PHE A 125 9.662 -17.619 -14.555 1.00 0.00 C ATOM 1602 O PHE A 125 9.948 -16.474 -14.210 1.00 0.00 O ATOM 1603 CB PHE A 125 10.325 -19.283 -12.810 1.00 0.00 C ATOM 1604 CG PHE A 125 9.090 -20.112 -12.705 1.00 0.00 C ATOM 1605 CD1 PHE A 125 9.151 -21.470 -12.902 1.00 0.00 C ATOM 1606 CD2 PHE A 125 7.868 -19.527 -12.420 1.00 0.00 C ATOM 1607 CE1 PHE A 125 8.020 -22.238 -12.817 1.00 0.00 C ATOM 1608 CE2 PHE A 125 6.727 -20.293 -12.332 1.00 0.00 C ATOM 1609 CZ PHE A 125 6.803 -21.652 -12.533 1.00 0.00 C ATOM 0 H PHE A 125 12.367 -17.883 -13.606 1.00 0.00 H new ATOM 0 HA PHE A 125 10.372 -19.598 -14.919 1.00 0.00 H new ATOM 0 HB2 PHE A 125 11.181 -19.871 -12.478 1.00 0.00 H new ATOM 0 HB3 PHE A 125 10.243 -18.430 -12.136 1.00 0.00 H new ATOM 0 HD1 PHE A 125 10.099 -21.936 -13.126 1.00 0.00 H new ATOM 0 HD2 PHE A 125 7.809 -18.460 -12.265 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.081 -23.305 -12.973 1.00 0.00 H new ATOM 0 HE2 PHE A 125 5.778 -19.830 -12.106 1.00 0.00 H new ATOM 0 HZ PHE A 125 5.912 -22.259 -12.469 1.00 0.00 H new ATOM 1619 N LYS A 126 8.573 -17.919 -15.238 1.00 0.00 N ATOM 1620 CA LYS A 126 7.609 -16.908 -15.616 1.00 0.00 C ATOM 1621 C LYS A 126 6.237 -17.255 -15.058 1.00 0.00 C ATOM 1622 O LYS A 126 5.547 -18.140 -15.573 1.00 0.00 O ATOM 1623 CB LYS A 126 7.555 -16.777 -17.137 1.00 0.00 C ATOM 1624 CG LYS A 126 8.923 -16.596 -17.777 1.00 0.00 C ATOM 1625 CD LYS A 126 8.823 -16.360 -19.278 1.00 0.00 C ATOM 1626 CE LYS A 126 8.015 -15.112 -19.608 1.00 0.00 C ATOM 1627 NZ LYS A 126 7.116 -15.332 -20.771 1.00 0.00 N ATOM 0 H LYS A 126 8.335 -18.863 -15.543 1.00 0.00 H new ATOM 0 HA LYS A 126 7.918 -15.950 -15.197 1.00 0.00 H new ATOM 0 HB2 LYS A 126 7.082 -17.666 -17.554 1.00 0.00 H new ATOM 0 HB3 LYS A 126 6.924 -15.927 -17.399 1.00 0.00 H new ATOM 0 HG2 LYS A 126 9.433 -15.753 -17.311 1.00 0.00 H new ATOM 0 HG3 LYS A 126 9.531 -17.481 -17.589 1.00 0.00 H new ATOM 0 HD2 LYS A 126 9.825 -16.264 -19.697 1.00 0.00 H new ATOM 0 HD3 LYS A 126 8.361 -17.226 -19.751 1.00 0.00 H new ATOM 0 HE2 LYS A 126 7.423 -14.821 -18.740 1.00 0.00 H new ATOM 0 HE3 LYS A 126 8.693 -14.286 -19.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 6.723 -14.421 -21.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 7.655 -15.762 -21.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 6.340 -15.967 -20.495 1.00 0.00 H new ATOM 1641 N ASP A 127 5.850 -16.545 -14.009 1.00 0.00 N ATOM 1642 CA ASP A 127 4.566 -16.763 -13.357 1.00 0.00 C ATOM 1643 C ASP A 127 3.627 -15.622 -13.697 1.00 0.00 C ATOM 1644 O ASP A 127 4.038 -14.461 -13.708 1.00 0.00 O ATOM 1645 CB ASP A 127 4.722 -16.877 -11.836 1.00 0.00 C ATOM 1646 CG ASP A 127 3.383 -17.046 -11.138 1.00 0.00 C ATOM 1647 OD1 ASP A 127 2.523 -17.777 -11.674 1.00 0.00 O ATOM 1648 OD2 ASP A 127 3.186 -16.447 -10.064 1.00 0.00 O ATOM 0 H ASP A 127 6.412 -15.806 -13.587 1.00 0.00 H new ATOM 0 HA ASP A 127 4.152 -17.704 -13.721 1.00 0.00 H new ATOM 0 HB2 ASP A 127 5.364 -17.726 -11.600 1.00 0.00 H new ATOM 0 HB3 ASP A 127 5.220 -15.985 -11.455 1.00 0.00 H new ATOM 1653 N GLY A 128 2.372 -15.948 -13.970 1.00 0.00 N ATOM 1654 CA GLY A 128 1.438 -14.951 -14.449 1.00 0.00 C ATOM 1655 C GLY A 128 1.971 -14.254 -15.683 1.00 0.00 C ATOM 1656 O GLY A 128 2.076 -14.862 -16.751 1.00 0.00 O ATOM 0 H GLY A 128 1.984 -16.886 -13.868 1.00 0.00 H new ATOM 0 HA2 GLY A 128 0.483 -15.423 -14.678 1.00 0.00 H new ATOM 0 HA3 GLY A 128 1.251 -14.217 -13.665 1.00 0.00 H new ATOM 1660 N ASP A 129 2.319 -12.984 -15.535 1.00 0.00 N ATOM 1661 CA ASP A 129 2.937 -12.236 -16.620 1.00 0.00 C ATOM 1662 C ASP A 129 4.310 -11.709 -16.211 1.00 0.00 C ATOM 1663 O ASP A 129 4.898 -10.876 -16.904 1.00 0.00 O ATOM 1664 CB ASP A 129 2.041 -11.081 -17.062 1.00 0.00 C ATOM 1665 CG ASP A 129 2.125 -10.834 -18.556 1.00 0.00 C ATOM 1666 OD1 ASP A 129 1.812 -11.759 -19.336 1.00 0.00 O ATOM 1667 OD2 ASP A 129 2.505 -9.717 -18.959 1.00 0.00 O ATOM 0 H ASP A 129 2.184 -12.451 -14.676 1.00 0.00 H new ATOM 0 HA ASP A 129 3.067 -12.918 -17.460 1.00 0.00 H new ATOM 0 HB2 ASP A 129 1.009 -11.298 -16.788 1.00 0.00 H new ATOM 0 HB3 ASP A 129 2.328 -10.175 -16.528 1.00 0.00 H new ATOM 1672 N PHE A 130 4.821 -12.188 -15.082 1.00 0.00 N ATOM 1673 CA PHE A 130 6.109 -11.726 -14.576 1.00 0.00 C ATOM 1674 C PHE A 130 7.129 -12.854 -14.609 1.00 0.00 C ATOM 1675 O PHE A 130 6.768 -14.028 -14.651 1.00 0.00 O ATOM 1676 CB PHE A 130 5.991 -11.168 -13.147 1.00 0.00 C ATOM 1677 CG PHE A 130 4.653 -11.383 -12.487 1.00 0.00 C ATOM 1678 CD1 PHE A 130 3.568 -10.573 -12.795 1.00 0.00 C ATOM 1679 CD2 PHE A 130 4.485 -12.395 -11.554 1.00 0.00 C ATOM 1680 CE1 PHE A 130 2.344 -10.771 -12.183 1.00 0.00 C ATOM 1681 CE2 PHE A 130 3.263 -12.595 -10.941 1.00 0.00 C ATOM 1682 CZ PHE A 130 2.191 -11.785 -11.257 1.00 0.00 C ATOM 0 H PHE A 130 4.366 -12.893 -14.502 1.00 0.00 H new ATOM 0 HA PHE A 130 6.445 -10.918 -15.227 1.00 0.00 H new ATOM 0 HB2 PHE A 130 6.762 -11.628 -12.529 1.00 0.00 H new ATOM 0 HB3 PHE A 130 6.199 -10.098 -13.173 1.00 0.00 H new ATOM 0 HD1 PHE A 130 3.681 -9.780 -13.520 1.00 0.00 H new ATOM 0 HD2 PHE A 130 5.319 -13.034 -11.304 1.00 0.00 H new ATOM 0 HE1 PHE A 130 1.508 -10.133 -12.429 1.00 0.00 H new ATOM 0 HE2 PHE A 130 3.147 -13.385 -10.214 1.00 0.00 H new ATOM 0 HZ PHE A 130 1.234 -11.944 -10.781 1.00 0.00 H new ATOM 1692 N TYR A 131 8.406 -12.504 -14.582 1.00 0.00 N ATOM 1693 CA TYR A 131 9.458 -13.502 -14.672 1.00 0.00 C ATOM 1694 C TYR A 131 10.618 -13.165 -13.741 1.00 0.00 C ATOM 1695 O TYR A 131 10.844 -12.000 -13.408 1.00 0.00 O ATOM 1696 CB TYR A 131 9.941 -13.639 -16.124 1.00 0.00 C ATOM 1697 CG TYR A 131 10.947 -12.594 -16.560 1.00 0.00 C ATOM 1698 CD1 TYR A 131 10.583 -11.259 -16.705 1.00 0.00 C ATOM 1699 CD2 TYR A 131 12.263 -12.946 -16.831 1.00 0.00 C ATOM 1700 CE1 TYR A 131 11.505 -10.306 -17.104 1.00 0.00 C ATOM 1701 CE2 TYR A 131 13.188 -12.002 -17.229 1.00 0.00 C ATOM 1702 CZ TYR A 131 12.806 -10.685 -17.364 1.00 0.00 C ATOM 1703 OH TYR A 131 13.733 -9.744 -17.755 1.00 0.00 O ATOM 0 H TYR A 131 8.736 -11.543 -14.499 1.00 0.00 H new ATOM 0 HA TYR A 131 9.047 -14.460 -14.353 1.00 0.00 H new ATOM 0 HB2 TYR A 131 10.385 -14.626 -16.253 1.00 0.00 H new ATOM 0 HB3 TYR A 131 9.076 -13.589 -16.786 1.00 0.00 H new ATOM 0 HD1 TYR A 131 9.565 -10.961 -16.503 1.00 0.00 H new ATOM 0 HD2 TYR A 131 12.568 -13.977 -16.728 1.00 0.00 H new ATOM 0 HE1 TYR A 131 11.208 -9.273 -17.211 1.00 0.00 H new ATOM 0 HE2 TYR A 131 14.207 -12.295 -17.434 1.00 0.00 H new ATOM 0 HH TYR A 131 14.600 -10.178 -17.896 1.00 0.00 H new ATOM 1713 N GLU A 132 11.337 -14.196 -13.323 1.00 0.00 N ATOM 1714 CA GLU A 132 12.495 -14.037 -12.457 1.00 0.00 C ATOM 1715 C GLU A 132 13.576 -15.035 -12.860 1.00 0.00 C ATOM 1716 O GLU A 132 13.274 -16.063 -13.471 1.00 0.00 O ATOM 1717 CB GLU A 132 12.098 -14.231 -10.993 1.00 0.00 C ATOM 1718 CG GLU A 132 12.466 -13.053 -10.109 1.00 0.00 C ATOM 1719 CD GLU A 132 13.917 -13.086 -9.682 1.00 0.00 C ATOM 1720 OE1 GLU A 132 14.787 -12.718 -10.499 1.00 0.00 O ATOM 1721 OE2 GLU A 132 14.192 -13.483 -8.529 1.00 0.00 O ATOM 0 H GLU A 132 11.135 -15.164 -13.574 1.00 0.00 H new ATOM 0 HA GLU A 132 12.889 -13.027 -12.568 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.022 -14.398 -10.935 1.00 0.00 H new ATOM 0 HB3 GLU A 132 12.581 -15.129 -10.609 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.268 -12.124 -10.644 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.829 -13.053 -9.224 1.00 0.00 H new ATOM 1728 N GLU A 133 14.824 -14.746 -12.518 1.00 0.00 N ATOM 1729 CA GLU A 133 15.940 -15.550 -12.997 1.00 0.00 C ATOM 1730 C GLU A 133 16.916 -15.907 -11.879 1.00 0.00 C ATOM 1731 O GLU A 133 17.013 -15.210 -10.870 1.00 0.00 O ATOM 1732 CB GLU A 133 16.680 -14.808 -14.110 1.00 0.00 C ATOM 1733 CG GLU A 133 17.030 -13.374 -13.751 1.00 0.00 C ATOM 1734 CD GLU A 133 18.469 -13.035 -14.065 1.00 0.00 C ATOM 1735 OE1 GLU A 133 18.758 -12.655 -15.218 1.00 0.00 O ATOM 1736 OE2 GLU A 133 19.323 -13.150 -13.162 1.00 0.00 O ATOM 0 H GLU A 133 15.088 -13.967 -11.915 1.00 0.00 H new ATOM 0 HA GLU A 133 15.526 -16.481 -13.383 1.00 0.00 H new ATOM 0 HB2 GLU A 133 17.596 -15.348 -14.350 1.00 0.00 H new ATOM 0 HB3 GLU A 133 16.064 -14.809 -15.009 1.00 0.00 H new ATOM 0 HG2 GLU A 133 16.373 -12.696 -14.295 1.00 0.00 H new ATOM 0 HG3 GLU A 133 16.845 -13.213 -12.689 1.00 0.00 H new ATOM 1743 N HIS A 134 17.621 -17.010 -12.074 1.00 0.00 N ATOM 1744 CA HIS A 134 18.678 -17.442 -11.170 1.00 0.00 C ATOM 1745 C HIS A 134 19.801 -18.079 -11.981 1.00 0.00 C ATOM 1746 O HIS A 134 19.560 -18.995 -12.775 1.00 0.00 O ATOM 1747 CB HIS A 134 18.145 -18.452 -10.145 1.00 0.00 C ATOM 1748 CG HIS A 134 18.302 -18.017 -8.714 1.00 0.00 C ATOM 1749 ND1 HIS A 134 17.389 -17.558 -7.824 1.00 0.00 N flip ATOM 1750 CD2 HIS A 134 19.504 -18.039 -8.040 1.00 0.00 C flip ATOM 1751 CE1 HIS A 134 18.049 -17.317 -6.645 1.00 0.00 C flip ATOM 1752 NE2 HIS A 134 19.321 -17.617 -6.804 1.00 0.00 N flip ATOM 0 H HIS A 134 17.476 -17.635 -12.867 1.00 0.00 H new ATOM 0 HA HIS A 134 19.053 -16.573 -10.630 1.00 0.00 H new ATOM 0 HB2 HIS A 134 17.089 -18.633 -10.345 1.00 0.00 H new ATOM 0 HB3 HIS A 134 18.662 -19.401 -10.284 1.00 0.00 H new ATOM 0 HD2 HIS A 134 20.449 -18.353 -8.459 1.00 0.00 H new ATOM 0 HE1 HIS A 134 17.599 -16.943 -5.737 1.00 0.00 H new ATOM 0 HE2 HIS A 134 20.045 -17.536 -6.090 1.00 0.00 H new ATOM 1761 N ILE A 135 21.014 -17.572 -11.821 1.00 0.00 N ATOM 1762 CA ILE A 135 22.169 -18.139 -12.502 1.00 0.00 C ATOM 1763 C ILE A 135 22.748 -19.289 -11.689 1.00 0.00 C ATOM 1764 O ILE A 135 23.339 -19.082 -10.630 1.00 0.00 O ATOM 1765 CB ILE A 135 23.266 -17.086 -12.756 1.00 0.00 C ATOM 1766 CG1 ILE A 135 22.685 -15.888 -13.509 1.00 0.00 C ATOM 1767 CG2 ILE A 135 24.414 -17.704 -13.541 1.00 0.00 C ATOM 1768 CD1 ILE A 135 23.696 -14.797 -13.800 1.00 0.00 C ATOM 0 H ILE A 135 21.224 -16.770 -11.227 1.00 0.00 H new ATOM 0 HA ILE A 135 21.824 -18.506 -13.469 1.00 0.00 H new ATOM 0 HB ILE A 135 23.649 -16.738 -11.797 1.00 0.00 H new ATOM 0 HG12 ILE A 135 22.258 -16.235 -14.450 1.00 0.00 H new ATOM 0 HG13 ILE A 135 21.867 -15.466 -12.925 1.00 0.00 H new ATOM 0 HG21 ILE A 135 25.183 -16.951 -13.715 1.00 0.00 H new ATOM 0 HG22 ILE A 135 24.839 -18.532 -12.974 1.00 0.00 H new ATOM 0 HG23 ILE A 135 24.044 -18.072 -14.498 1.00 0.00 H new ATOM 0 HD11 ILE A 135 23.208 -13.983 -14.336 1.00 0.00 H new ATOM 0 HD12 ILE A 135 24.105 -14.421 -12.862 1.00 0.00 H new ATOM 0 HD13 ILE A 135 24.502 -15.202 -14.411 1.00 0.00 H new ATOM 1780 N THR A 136 22.568 -20.495 -12.188 1.00 0.00 N ATOM 1781 CA THR A 136 22.995 -21.683 -11.481 1.00 0.00 C ATOM 1782 C THR A 136 23.967 -22.495 -12.328 1.00 0.00 C ATOM 1783 O THR A 136 23.564 -23.188 -13.256 1.00 0.00 O ATOM 1784 CB THR A 136 21.771 -22.541 -11.115 1.00 0.00 C ATOM 1785 OG1 THR A 136 20.901 -21.795 -10.254 1.00 0.00 O ATOM 1786 CG2 THR A 136 22.180 -23.833 -10.434 1.00 0.00 C ATOM 0 H THR A 136 22.125 -20.678 -13.088 1.00 0.00 H new ATOM 0 HA THR A 136 23.507 -21.378 -10.568 1.00 0.00 H new ATOM 0 HB THR A 136 21.250 -22.798 -12.038 1.00 0.00 H new ATOM 0 HG1 THR A 136 21.374 -21.572 -9.425 1.00 0.00 H new ATOM 0 HG21 THR A 136 21.290 -24.413 -10.190 1.00 0.00 H new ATOM 0 HG22 THR A 136 22.818 -24.411 -11.103 1.00 0.00 H new ATOM 0 HG23 THR A 136 22.726 -23.605 -9.519 1.00 0.00 H new ATOM 1794 N GLU A 137 25.249 -22.396 -12.022 1.00 0.00 N ATOM 1795 CA GLU A 137 26.256 -23.122 -12.779 1.00 0.00 C ATOM 1796 C GLU A 137 26.371 -24.554 -12.275 1.00 0.00 C ATOM 1797 O GLU A 137 26.290 -24.808 -11.073 1.00 0.00 O ATOM 1798 CB GLU A 137 27.608 -22.419 -12.696 1.00 0.00 C ATOM 1799 CG GLU A 137 27.950 -21.911 -11.309 1.00 0.00 C ATOM 1800 CD GLU A 137 29.360 -21.380 -11.234 1.00 0.00 C ATOM 1801 OE1 GLU A 137 30.307 -22.190 -11.298 1.00 0.00 O ATOM 1802 OE2 GLU A 137 29.528 -20.147 -11.135 1.00 0.00 O ATOM 0 H GLU A 137 25.616 -21.825 -11.261 1.00 0.00 H new ATOM 0 HA GLU A 137 25.946 -23.144 -13.824 1.00 0.00 H new ATOM 0 HB2 GLU A 137 28.386 -23.109 -13.022 1.00 0.00 H new ATOM 0 HB3 GLU A 137 27.614 -21.580 -13.392 1.00 0.00 H new ATOM 0 HG2 GLU A 137 27.251 -21.123 -11.029 1.00 0.00 H new ATOM 0 HG3 GLU A 137 27.828 -22.718 -10.587 1.00 0.00 H new ATOM 1809 N VAL A 138 26.568 -25.477 -13.199 1.00 0.00 N ATOM 1810 CA VAL A 138 26.617 -26.893 -12.867 1.00 0.00 C ATOM 1811 C VAL A 138 28.030 -27.309 -12.463 1.00 0.00 C ATOM 1812 O VAL A 138 29.011 -26.691 -12.870 1.00 0.00 O ATOM 1813 CB VAL A 138 26.126 -27.751 -14.058 1.00 0.00 C ATOM 1814 CG1 VAL A 138 26.196 -29.236 -13.743 1.00 0.00 C ATOM 1815 CG2 VAL A 138 24.708 -27.365 -14.430 1.00 0.00 C ATOM 0 H VAL A 138 26.697 -25.272 -14.190 1.00 0.00 H new ATOM 0 HA VAL A 138 25.953 -27.062 -12.019 1.00 0.00 H new ATOM 0 HB VAL A 138 26.787 -27.557 -14.903 1.00 0.00 H new ATOM 0 HG11 VAL A 138 25.844 -29.807 -14.602 1.00 0.00 H new ATOM 0 HG12 VAL A 138 27.227 -29.513 -13.521 1.00 0.00 H new ATOM 0 HG13 VAL A 138 25.568 -29.455 -12.879 1.00 0.00 H new ATOM 0 HG21 VAL A 138 24.373 -27.975 -15.269 1.00 0.00 H new ATOM 0 HG22 VAL A 138 24.050 -27.529 -13.576 1.00 0.00 H new ATOM 0 HG23 VAL A 138 24.680 -26.313 -14.712 1.00 0.00 H new ATOM 1825 N LYS A 139 28.128 -28.320 -11.613 1.00 0.00 N ATOM 1826 CA LYS A 139 29.414 -28.879 -11.237 1.00 0.00 C ATOM 1827 C LYS A 139 29.536 -30.302 -11.758 1.00 0.00 C ATOM 1828 O LYS A 139 29.095 -31.242 -11.101 1.00 0.00 O ATOM 1829 CB LYS A 139 29.587 -28.886 -9.713 1.00 0.00 C ATOM 1830 CG LYS A 139 29.246 -27.569 -9.042 1.00 0.00 C ATOM 1831 CD LYS A 139 30.296 -26.512 -9.329 1.00 0.00 C ATOM 1832 CE LYS A 139 29.685 -25.321 -10.040 1.00 0.00 C ATOM 1833 NZ LYS A 139 30.481 -24.905 -11.225 1.00 0.00 N ATOM 0 H LYS A 139 27.327 -28.771 -11.170 1.00 0.00 H new ATOM 0 HA LYS A 139 30.192 -28.255 -11.677 1.00 0.00 H new ATOM 0 HB2 LYS A 139 28.958 -29.670 -9.291 1.00 0.00 H new ATOM 0 HB3 LYS A 139 30.619 -29.144 -9.477 1.00 0.00 H new ATOM 0 HG2 LYS A 139 28.274 -27.222 -9.392 1.00 0.00 H new ATOM 0 HG3 LYS A 139 29.163 -27.718 -7.965 1.00 0.00 H new ATOM 0 HD2 LYS A 139 30.755 -26.187 -8.395 1.00 0.00 H new ATOM 0 HD3 LYS A 139 31.089 -26.939 -9.942 1.00 0.00 H new ATOM 0 HE2 LYS A 139 28.671 -25.569 -10.354 1.00 0.00 H new ATOM 0 HE3 LYS A 139 29.608 -24.485 -9.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 30.321 -23.895 -11.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 31.491 -25.066 -11.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 30.189 -25.463 -12.053 1.00 0.00 H new ATOM 1847 N ILE A 140 30.097 -30.468 -12.948 1.00 0.00 N ATOM 1848 CA ILE A 140 30.393 -31.803 -13.443 1.00 0.00 C ATOM 1849 C ILE A 140 31.566 -32.365 -12.651 1.00 0.00 C ATOM 1850 O ILE A 140 32.647 -31.769 -12.608 1.00 0.00 O ATOM 1851 CB ILE A 140 30.684 -31.815 -14.972 1.00 0.00 C ATOM 1852 CG1 ILE A 140 29.419 -32.192 -15.745 1.00 0.00 C ATOM 1853 CG2 ILE A 140 31.809 -32.780 -15.331 1.00 0.00 C ATOM 1854 CD1 ILE A 140 28.478 -31.033 -15.977 1.00 0.00 C ATOM 0 H ILE A 140 30.352 -29.708 -13.579 1.00 0.00 H new ATOM 0 HA ILE A 140 29.515 -32.433 -13.301 1.00 0.00 H new ATOM 0 HB ILE A 140 31.002 -30.810 -15.250 1.00 0.00 H new ATOM 0 HG12 ILE A 140 29.705 -32.614 -16.708 1.00 0.00 H new ATOM 0 HG13 ILE A 140 28.890 -32.974 -15.199 1.00 0.00 H new ATOM 0 HG21 ILE A 140 31.979 -32.757 -16.407 1.00 0.00 H new ATOM 0 HG22 ILE A 140 32.721 -32.484 -14.813 1.00 0.00 H new ATOM 0 HG23 ILE A 140 31.532 -33.790 -15.029 1.00 0.00 H new ATOM 0 HD11 ILE A 140 27.605 -31.378 -16.531 1.00 0.00 H new ATOM 0 HD12 ILE A 140 28.161 -30.624 -15.018 1.00 0.00 H new ATOM 0 HD13 ILE A 140 28.988 -30.259 -16.550 1.00 0.00 H new ATOM 1866 N THR A 141 31.334 -33.482 -11.987 1.00 0.00 N ATOM 1867 CA THR A 141 32.318 -34.058 -11.096 1.00 0.00 C ATOM 1868 C THR A 141 31.900 -35.480 -10.722 1.00 0.00 C ATOM 1869 O THR A 141 32.471 -36.057 -9.770 1.00 0.00 O ATOM 1870 CB THR A 141 32.497 -33.165 -9.833 1.00 0.00 C ATOM 1871 OG1 THR A 141 33.300 -33.821 -8.844 1.00 0.00 O ATOM 1872 CG2 THR A 141 31.150 -32.774 -9.229 1.00 0.00 C ATOM 1873 OXT THR A 141 31.011 -36.027 -11.407 1.00 0.00 O ATOM 0 H THR A 141 30.464 -34.011 -12.051 1.00 0.00 H new ATOM 0 HA THR A 141 33.282 -34.105 -11.602 1.00 0.00 H new ATOM 0 HB THR A 141 33.008 -32.257 -10.154 1.00 0.00 H new ATOM 0 HG1 THR A 141 33.486 -34.740 -9.130 1.00 0.00 H new ATOM 0 HG21 THR A 141 31.313 -32.151 -8.349 1.00 0.00 H new ATOM 0 HG22 THR A 141 30.569 -32.218 -9.965 1.00 0.00 H new ATOM 0 HG23 THR A 141 30.606 -33.673 -8.941 1.00 0.00 H new