USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 0 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 110 THR OG1 : rot 167:sc= 1.26 USER MOD Set 1.2: A 139 TYR OH : rot 168:sc= 1.86 USER MOD Set 2.1: A 138 HIS : no HE2:sc= -1.7! K(o=-3.1!,f=-1.2) USER MOD Set 2.2: A 141 GLN : amide:sc= -1.41! C(o=-3.1!,f=-5.9!) USER MOD Set 3.1: A 126 LYS NZ :NH3+ 172:sc= -0.0704 (180deg=-0.122) USER MOD Set 3.2: A 128 ASN : amide:sc= -0.576 X(o=-0.65,f=-0.71) USER MOD Set 4.1: A 113 SER OG : rot -147:sc= 0.621 USER MOD Set 4.2: A 116 HIS : no HD1:sc= -3.03 K(o=-3.6,f=-2.6!) USER MOD Set 4.3: A 119 LYS NZ :NH3+ -145:sc= -1.23 (180deg=0) USER MOD Set 5.1: A 109 ASN : amide:sc= -0.961! C(o=0.21!,f=-2.4!) USER MOD Set 5.2: A 111 TYR OH : rot 50:sc= 1.17 USER MOD Set 6.1: A 106 ASN : amide:sc= 0.986 K(o=1.3,f=-5.5!) USER MOD Set 6.2: A 107 HIS : no HE2:sc= 0.293 K(o=1.3,f=-1.7) USER MOD Set 7.1: A 90 SER OG : rot -88:sc= 1.63 USER MOD Set 7.2: A 92 THR OG1 : rot 40:sc= 0.753 USER MOD Set 8.1: A 77 GLN : amide:sc= -0.448 K(o=-2.1,f=-4) USER MOD Set 8.2: A 91 GLN : amide:sc= -1.68! C(o=-2.1!,f=-3.2!) USER MOD Set 9.1: A 72 SER OG : rot -116:sc= 1.15 USER MOD Set 9.2: A 75 THR OG1 : rot 160:sc= -0.198 USER MOD Set10.1: A 57 GLN : amide:sc= 0.122 K(o=-1.5,f=-8.4!) USER MOD Set10.2: A 73 THR OG1 : rot 180:sc= -1.6! USER MOD Set11.1: A 52 SER OG : rot 95:sc= 0.905 USER MOD Set11.2: A 55 HIS : no HD1:sc= 0.657 K(o=1.6,f=-5.2!) USER MOD Set12.1: A 32 ASN : amide:sc= -4.61! C(o=-8.3!,f=-11!) USER MOD Set12.2: A 35 HIS : no HD1:sc= -3.65 K(o=-8.3,f=-8.8!) USER MOD Single : A 30 CYS SG : rot 149:sc= -2.26! USER MOD Single : A 31 SER OG : rot 147:sc= 0.192 USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 48 THR OG1 : rot -139:sc= -2.23 USER MOD Single : A 54 GLN : amide:sc= 0.53 K(o=0.53,f=-0.032) USER MOD Single : A 59 GLN : amide:sc= -0.144 K(o=-0.14,f=-0.77) USER MOD Single : A 61 SER OG : rot -170:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= -0.0351 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 173:sc= 0 (180deg=-0.0582) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.116 USER MOD Single : A 88 TYR OH : rot 5:sc= 1.25 USER MOD Single : A 94 ASN : amide:sc= -0.467 K(o=-0.47,f=-8.3!) USER MOD Single : A 97 CYS SG : rot -21:sc= -3.85! USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.429) USER MOD Single : A 115 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00582) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 LYS NZ :NH3+ -129:sc= -1.51 (180deg=-4.69!) USER MOD Single : A 130 SER OG : rot 160:sc= -0.417 USER MOD Single : A 131 CYS SG : rot -20:sc= -3.38 USER MOD Single : A 132 LYS NZ :NH3+ 148:sc= -0.205 (180deg=-0.955) USER MOD Single : A 137 THR OG1 : rot 122:sc= 0.899 USER MOD Single : A 142 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0178) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -8.111 4.103 3.268 1.00 0.00 N ATOM 22 CA CYS A 30 -8.878 2.969 2.717 1.00 0.00 C ATOM 23 C CYS A 30 -10.334 2.991 3.188 1.00 0.00 C ATOM 24 O CYS A 30 -10.655 3.393 4.303 1.00 0.00 O ATOM 25 CB CYS A 30 -8.276 1.645 3.191 1.00 0.00 C ATOM 26 SG CYS A 30 -8.797 0.203 2.207 1.00 0.00 S ATOM 0 HA CYS A 30 -8.836 3.060 1.632 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -7.189 1.720 3.160 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -8.555 1.482 4.232 1.00 0.00 H new ATOM 0 HG CYS A 30 -7.840 -0.677 2.187 1.00 0.00 H new ATOM 27 N SER A 31 -11.137 2.309 2.376 1.00 0.00 N ATOM 28 CA SER A 31 -12.515 1.891 2.706 1.00 0.00 C ATOM 29 C SER A 31 -12.488 0.643 3.623 1.00 0.00 C ATOM 30 O SER A 31 -13.243 -0.312 3.480 1.00 0.00 O ATOM 31 CB SER A 31 -13.230 1.551 1.399 1.00 0.00 C ATOM 32 OG SER A 31 -13.109 2.647 0.496 1.00 0.00 O ATOM 0 H SER A 31 -10.848 2.019 1.442 1.00 0.00 H new ATOM 0 HA SER A 31 -13.034 2.693 3.230 1.00 0.00 H new ATOM 0 HB2 SER A 31 -12.798 0.653 0.958 1.00 0.00 H new ATOM 0 HB3 SER A 31 -14.282 1.338 1.591 1.00 0.00 H new ATOM 0 HG SER A 31 -13.058 2.310 -0.423 1.00 0.00 H new ATOM 33 N ASN A 32 -11.609 0.725 4.616 1.00 0.00 N ATOM 34 CA ASN A 32 -11.364 -0.352 5.579 1.00 0.00 C ATOM 35 C ASN A 32 -11.812 0.142 6.975 1.00 0.00 C ATOM 36 O ASN A 32 -12.743 0.949 7.053 1.00 0.00 O ATOM 37 CB ASN A 32 -9.906 -0.817 5.425 1.00 0.00 C ATOM 38 CG ASN A 32 -8.878 -0.456 6.503 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.272 0.603 6.550 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.573 -1.452 7.311 1.00 0.00 N ATOM 0 H ASN A 32 -11.036 1.553 4.780 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.952 -1.253 5.405 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -9.918 -1.903 5.337 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.537 -0.424 4.478 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.820 -1.345 7.990 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -9.091 -2.329 7.257 1.00 0.00 H new ATOM 41 N GLY A 33 -11.234 -0.354 8.067 1.00 0.00 N ATOM 42 CA GLY A 33 -11.206 0.374 9.360 1.00 0.00 C ATOM 43 C GLY A 33 -10.197 1.525 9.144 1.00 0.00 C ATOM 44 O GLY A 33 -9.133 1.541 9.748 1.00 0.00 O ATOM 0 H GLY A 33 -10.772 -1.263 8.094 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.193 0.757 9.620 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.893 -0.279 10.175 1.00 0.00 H new ATOM 45 N GLY A 34 -10.609 2.429 8.264 1.00 0.00 N ATOM 46 CA GLY A 34 -9.787 3.398 7.515 1.00 0.00 C ATOM 47 C GLY A 34 -8.491 3.919 8.141 1.00 0.00 C ATOM 48 O GLY A 34 -8.460 4.979 8.772 1.00 0.00 O ATOM 0 H GLY A 34 -11.598 2.519 8.031 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.529 2.940 6.560 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.416 4.261 7.296 1.00 0.00 H new ATOM 49 N HIS A 35 -7.417 3.182 7.860 1.00 0.00 N ATOM 50 CA HIS A 35 -6.049 3.610 8.190 1.00 0.00 C ATOM 51 C HIS A 35 -5.449 4.412 7.012 1.00 0.00 C ATOM 52 O HIS A 35 -6.122 4.698 6.023 1.00 0.00 O ATOM 53 CB HIS A 35 -5.169 2.382 8.478 1.00 0.00 C ATOM 54 CG HIS A 35 -5.754 1.388 9.485 1.00 0.00 C ATOM 55 ND1 HIS A 35 -6.312 0.236 9.145 1.00 0.00 N ATOM 56 CD2 HIS A 35 -5.900 1.563 10.787 1.00 0.00 C ATOM 57 CE1 HIS A 35 -6.852 -0.299 10.233 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.623 0.544 11.245 1.00 0.00 N ATOM 0 H HIS A 35 -7.465 2.274 7.399 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.082 4.243 9.077 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -4.983 1.859 7.540 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.203 2.725 8.848 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.506 2.381 11.371 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -7.378 -1.240 10.290 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -6.947 0.426 12.205 1.00 0.00 H new ATOM 59 N PHE A 36 -4.136 4.663 7.098 1.00 0.00 N ATOM 60 CA PHE A 36 -3.353 5.382 6.072 1.00 0.00 C ATOM 61 C PHE A 36 -2.144 4.526 5.689 1.00 0.00 C ATOM 62 O PHE A 36 -1.523 3.904 6.553 1.00 0.00 O ATOM 63 CB PHE A 36 -2.846 6.712 6.636 1.00 0.00 C ATOM 64 CG PHE A 36 -3.919 7.809 6.668 1.00 0.00 C ATOM 65 CD1 PHE A 36 -4.949 7.775 7.638 1.00 0.00 C ATOM 66 CD2 PHE A 36 -3.833 8.854 5.720 1.00 0.00 C ATOM 67 CE1 PHE A 36 -5.927 8.793 7.653 1.00 0.00 C ATOM 68 CE2 PHE A 36 -4.812 9.872 5.735 1.00 0.00 C ATOM 69 CZ PHE A 36 -5.847 9.835 6.697 1.00 0.00 C ATOM 0 H PHE A 36 -3.573 4.368 7.896 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.985 5.572 5.204 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.472 6.550 7.647 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.004 7.055 6.035 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.987 6.975 8.363 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.032 8.874 4.996 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -6.724 8.777 8.382 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.770 10.675 5.014 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.592 10.617 6.703 1.00 0.00 H new ATOM 70 N LEU A 37 -1.880 4.445 4.388 1.00 0.00 N ATOM 71 CA LEU A 37 -0.614 3.890 3.891 1.00 0.00 C ATOM 72 C LEU A 37 0.519 4.870 4.234 1.00 0.00 C ATOM 73 O LEU A 37 0.827 5.800 3.488 1.00 0.00 O ATOM 74 CB LEU A 37 -0.685 3.633 2.384 1.00 0.00 C ATOM 75 CG LEU A 37 -1.444 2.348 2.073 1.00 0.00 C ATOM 76 CD1 LEU A 37 -1.905 2.330 0.619 1.00 0.00 C ATOM 77 CD2 LEU A 37 -0.592 1.110 2.369 1.00 0.00 C ATOM 0 H LEU A 37 -2.520 4.754 3.657 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.420 2.930 4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.174 4.474 1.893 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.324 3.569 1.977 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.320 2.321 2.721 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.444 1.404 0.420 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.563 3.180 0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.038 2.394 -0.038 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.163 0.211 2.136 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.310 1.135 1.758 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.316 1.102 3.423 1.00 0.00 H new ATOM 78 N ARG A 38 1.018 4.696 5.451 1.00 0.00 N ATOM 79 CA ARG A 38 2.000 5.623 6.045 1.00 0.00 C ATOM 80 C ARG A 38 3.317 5.753 5.281 1.00 0.00 C ATOM 81 O ARG A 38 3.574 6.798 4.696 1.00 0.00 O ATOM 82 CB ARG A 38 2.194 5.329 7.536 1.00 0.00 C ATOM 83 CG ARG A 38 3.321 6.130 8.186 1.00 0.00 C ATOM 84 CD ARG A 38 2.918 7.044 9.356 1.00 0.00 C ATOM 85 NE ARG A 38 2.409 6.264 10.481 1.00 0.00 N ATOM 86 CZ ARG A 38 1.226 6.384 11.091 1.00 0.00 C ATOM 87 NH1 ARG A 38 0.277 7.180 10.651 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.023 5.803 12.258 1.00 0.00 N ATOM 0 H ARG A 38 0.762 3.917 6.058 1.00 0.00 H new ATOM 0 HA ARG A 38 1.563 6.617 5.950 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.263 5.540 8.062 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.398 4.266 7.663 1.00 0.00 H new ATOM 0 HG2 ARG A 38 4.077 5.430 8.543 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.792 6.744 7.418 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.779 7.631 9.676 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.156 7.750 9.025 1.00 0.00 H new ATOM 0 HE ARG A 38 3.031 5.542 10.844 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.428 7.738 9.811 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.611 7.239 11.150 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.769 5.262 12.695 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.120 5.895 12.723 1.00 0.00 H new ATOM 89 N ILE A 39 4.042 4.636 5.177 1.00 0.00 N ATOM 90 CA ILE A 39 5.493 4.598 4.839 1.00 0.00 C ATOM 91 C ILE A 39 6.285 5.433 5.859 1.00 0.00 C ATOM 92 O ILE A 39 6.521 6.633 5.726 1.00 0.00 O ATOM 93 CB ILE A 39 5.829 5.029 3.397 1.00 0.00 C ATOM 94 CG1 ILE A 39 4.804 4.566 2.355 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.191 4.412 3.075 1.00 0.00 C ATOM 96 CD1 ILE A 39 4.852 5.357 1.044 1.00 0.00 C ATOM 0 H ILE A 39 3.643 3.709 5.325 1.00 0.00 H new ATOM 0 HA ILE A 39 5.790 3.551 4.895 1.00 0.00 H new ATOM 0 HB ILE A 39 5.825 6.118 3.347 1.00 0.00 H new ATOM 0 HG12 ILE A 39 4.972 3.511 2.138 1.00 0.00 H new ATOM 0 HG13 ILE A 39 3.804 4.648 2.781 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.483 4.684 2.061 1.00 0.00 H new ATOM 0 HG22 ILE A 39 7.935 4.785 3.779 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.127 3.327 3.155 1.00 0.00 H new ATOM 0 HD11 ILE A 39 4.098 4.971 0.358 1.00 0.00 H new ATOM 0 HD12 ILE A 39 4.653 6.409 1.247 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.839 5.254 0.593 1.00 0.00 H new ATOM 97 N LEU A 40 6.640 4.720 6.926 1.00 0.00 N ATOM 98 CA LEU A 40 7.439 5.277 8.035 1.00 0.00 C ATOM 99 C LEU A 40 8.941 5.238 7.703 1.00 0.00 C ATOM 100 O LEU A 40 9.418 4.188 7.283 1.00 0.00 O ATOM 101 CB LEU A 40 7.210 4.503 9.330 1.00 0.00 C ATOM 102 CG LEU A 40 6.323 5.285 10.284 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.124 4.440 10.676 1.00 0.00 C ATOM 104 CD2 LEU A 40 7.115 5.694 11.528 1.00 0.00 C ATOM 0 H LEU A 40 6.386 3.740 7.054 1.00 0.00 H new ATOM 0 HA LEU A 40 7.116 6.309 8.169 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.749 3.541 9.106 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.168 4.294 9.807 1.00 0.00 H new ATOM 0 HG LEU A 40 5.973 6.189 9.786 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.490 5.004 11.360 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.554 4.181 9.784 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.466 3.528 11.166 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.468 6.254 12.203 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.483 4.802 12.034 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.959 6.318 11.233 1.00 0.00 H new ATOM 105 N PRO A 41 9.682 6.265 8.162 1.00 0.00 N ATOM 106 CA PRO A 41 11.149 6.361 8.036 1.00 0.00 C ATOM 107 C PRO A 41 11.902 5.176 8.648 1.00 0.00 C ATOM 108 O PRO A 41 13.016 4.875 8.224 1.00 0.00 O ATOM 109 CB PRO A 41 11.529 7.684 8.720 1.00 0.00 C ATOM 110 CG PRO A 41 10.384 7.934 9.691 1.00 0.00 C ATOM 111 CD PRO A 41 9.158 7.423 8.918 1.00 0.00 C ATOM 0 HA PRO A 41 11.438 6.336 6.985 1.00 0.00 H new ATOM 0 HB2 PRO A 41 12.484 7.606 9.240 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.625 8.495 7.998 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.524 7.395 10.628 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.291 8.991 9.942 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.352 7.131 9.592 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.756 8.187 8.253 1.00 0.00 H new ATOM 112 N ASP A 42 11.253 4.493 9.588 1.00 0.00 N ATOM 113 CA ASP A 42 11.748 3.253 10.222 1.00 0.00 C ATOM 114 C ASP A 42 11.741 2.019 9.294 1.00 0.00 C ATOM 115 O ASP A 42 12.028 0.902 9.750 1.00 0.00 O ATOM 116 CB ASP A 42 10.864 3.002 11.442 1.00 0.00 C ATOM 117 CG ASP A 42 11.700 2.764 12.708 1.00 0.00 C ATOM 118 OD1 ASP A 42 12.535 3.647 13.001 1.00 0.00 O ATOM 119 OD2 ASP A 42 11.424 1.753 13.378 1.00 0.00 O ATOM 0 H ASP A 42 10.344 4.786 9.946 1.00 0.00 H new ATOM 0 HA ASP A 42 12.796 3.395 10.486 1.00 0.00 H new ATOM 0 HB2 ASP A 42 10.205 3.856 11.596 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.227 2.137 11.258 1.00 0.00 H new ATOM 120 N GLY A 43 11.429 2.238 8.017 1.00 0.00 N ATOM 121 CA GLY A 43 11.262 1.196 6.993 1.00 0.00 C ATOM 122 C GLY A 43 10.024 0.335 7.254 1.00 0.00 C ATOM 123 O GLY A 43 10.011 -0.854 6.947 1.00 0.00 O ATOM 0 H GLY A 43 11.279 3.178 7.650 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.180 1.662 6.011 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.148 0.562 6.972 1.00 0.00 H new ATOM 124 N THR A 44 8.919 0.981 7.652 1.00 0.00 N ATOM 125 CA THR A 44 7.697 0.240 8.019 1.00 0.00 C ATOM 126 C THR A 44 6.472 0.865 7.358 1.00 0.00 C ATOM 127 O THR A 44 6.219 2.062 7.483 1.00 0.00 O ATOM 128 CB THR A 44 7.444 0.236 9.531 1.00 0.00 C ATOM 129 OG1 THR A 44 8.607 0.611 10.284 1.00 0.00 O ATOM 130 CG2 THR A 44 6.979 -1.159 9.958 1.00 0.00 C ATOM 0 H THR A 44 8.842 1.995 7.728 1.00 0.00 H new ATOM 0 HA THR A 44 7.854 -0.783 7.677 1.00 0.00 H new ATOM 0 HB THR A 44 6.674 0.978 9.741 1.00 0.00 H new ATOM 0 HG1 THR A 44 8.396 0.595 11.241 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.797 -1.169 11.033 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.059 -1.413 9.432 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.750 -1.890 9.714 1.00 0.00 H new ATOM 131 N VAL A 45 5.688 0.033 6.691 1.00 0.00 N ATOM 132 CA VAL A 45 4.403 0.518 6.147 1.00 0.00 C ATOM 133 C VAL A 45 3.272 -0.071 7.006 1.00 0.00 C ATOM 134 O VAL A 45 2.879 -1.225 6.862 1.00 0.00 O ATOM 135 CB VAL A 45 4.238 0.216 4.654 1.00 0.00 C ATOM 136 CG1 VAL A 45 2.912 0.739 4.107 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.343 0.851 3.817 1.00 0.00 C ATOM 0 H VAL A 45 5.896 -0.949 6.511 1.00 0.00 H new ATOM 0 HA VAL A 45 4.371 1.606 6.204 1.00 0.00 H new ATOM 0 HB VAL A 45 4.279 -0.871 4.578 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.838 0.503 3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.087 0.269 4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.863 1.819 4.242 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.186 0.611 2.765 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.324 1.933 3.949 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.310 0.464 4.137 1.00 0.00 H new ATOM 138 N ASP A 46 2.929 0.724 8.011 1.00 0.00 N ATOM 139 CA ASP A 46 1.782 0.423 8.895 1.00 0.00 C ATOM 140 C ASP A 46 0.741 1.531 8.779 1.00 0.00 C ATOM 141 O ASP A 46 1.072 2.676 8.507 1.00 0.00 O ATOM 142 CB ASP A 46 2.153 0.338 10.369 1.00 0.00 C ATOM 143 CG ASP A 46 3.292 -0.639 10.659 1.00 0.00 C ATOM 144 OD1 ASP A 46 3.303 -1.739 10.066 1.00 0.00 O ATOM 145 OD2 ASP A 46 4.194 -0.188 11.385 1.00 0.00 O ATOM 0 H ASP A 46 3.422 1.586 8.244 1.00 0.00 H new ATOM 0 HA ASP A 46 1.409 -0.547 8.568 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.438 1.330 10.721 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.274 0.038 10.939 1.00 0.00 H new ATOM 146 N GLY A 47 -0.514 1.093 8.864 1.00 0.00 N ATOM 147 CA GLY A 47 -1.659 2.002 9.026 1.00 0.00 C ATOM 148 C GLY A 47 -1.623 2.666 10.400 1.00 0.00 C ATOM 149 O GLY A 47 -0.628 2.625 11.131 1.00 0.00 O ATOM 0 H GLY A 47 -0.770 0.106 8.823 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.639 2.764 8.247 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.590 1.448 8.907 1.00 0.00 H new ATOM 150 N THR A 48 -2.823 3.025 10.830 1.00 0.00 N ATOM 151 CA THR A 48 -2.959 3.971 11.944 1.00 0.00 C ATOM 152 C THR A 48 -4.164 3.860 12.867 1.00 0.00 C ATOM 153 O THR A 48 -5.311 4.069 12.490 1.00 0.00 O ATOM 154 CB THR A 48 -2.743 5.428 11.477 1.00 0.00 C ATOM 155 OG1 THR A 48 -3.220 6.336 12.473 1.00 0.00 O ATOM 156 CG2 THR A 48 -3.414 5.764 10.145 1.00 0.00 C ATOM 0 H THR A 48 -3.703 2.688 10.440 1.00 0.00 H new ATOM 0 HA THR A 48 -2.152 3.646 12.600 1.00 0.00 H new ATOM 0 HB THR A 48 -1.668 5.532 11.327 1.00 0.00 H new ATOM 0 HG1 THR A 48 -3.687 7.081 12.040 1.00 0.00 H new ATOM 0 HG21 THR A 48 -3.214 6.805 9.889 1.00 0.00 H new ATOM 0 HG22 THR A 48 -3.017 5.116 9.364 1.00 0.00 H new ATOM 0 HG23 THR A 48 -4.490 5.612 10.231 1.00 0.00 H new ATOM 157 N ARG A 49 -3.821 3.516 14.097 1.00 0.00 N ATOM 158 CA ARG A 49 -4.655 3.818 15.275 1.00 0.00 C ATOM 159 C ARG A 49 -4.476 5.280 15.747 1.00 0.00 C ATOM 160 O ARG A 49 -5.356 5.868 16.361 1.00 0.00 O ATOM 161 CB ARG A 49 -4.286 2.901 16.435 1.00 0.00 C ATOM 162 CG ARG A 49 -4.820 1.493 16.190 1.00 0.00 C ATOM 163 CD ARG A 49 -4.368 0.600 17.338 1.00 0.00 C ATOM 164 NE ARG A 49 -4.667 -0.792 17.014 1.00 0.00 N ATOM 165 CZ ARG A 49 -3.760 -1.760 16.838 1.00 0.00 C ATOM 166 NH1 ARG A 49 -2.458 -1.499 16.852 1.00 0.00 N ATOM 167 NH2 ARG A 49 -4.144 -3.025 16.879 1.00 0.00 N ATOM 0 H ARG A 49 -2.959 3.019 14.320 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.691 3.662 14.975 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -3.203 2.871 16.553 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -4.697 3.296 17.364 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -5.908 1.506 16.126 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -4.449 1.107 15.241 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -3.299 0.724 17.511 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -4.875 0.888 18.259 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.649 -1.048 16.913 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -2.131 -0.544 16.999 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -1.785 -2.253 16.716 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -5.124 -3.255 17.044 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -3.460 -3.770 16.746 1.00 0.00 H new ATOM 168 N ASP A 50 -3.316 5.838 15.402 1.00 0.00 N ATOM 169 CA ASP A 50 -2.861 7.184 15.782 1.00 0.00 C ATOM 170 C ASP A 50 -1.835 7.612 14.715 1.00 0.00 C ATOM 171 O ASP A 50 -0.833 6.932 14.506 1.00 0.00 O ATOM 172 CB ASP A 50 -2.221 7.096 17.163 1.00 0.00 C ATOM 173 CG ASP A 50 -1.842 8.452 17.798 1.00 0.00 C ATOM 174 OD1 ASP A 50 -2.310 9.488 17.288 1.00 0.00 O ATOM 175 OD2 ASP A 50 -1.053 8.402 18.761 1.00 0.00 O ATOM 0 H ASP A 50 -2.634 5.346 14.824 1.00 0.00 H new ATOM 0 HA ASP A 50 -3.672 7.910 15.829 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.908 6.579 17.832 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.323 6.482 17.092 1.00 0.00 H new ATOM 176 N ARG A 51 -2.177 8.656 13.986 1.00 0.00 N ATOM 177 CA ARG A 51 -1.360 9.152 12.850 1.00 0.00 C ATOM 178 C ARG A 51 -0.073 9.797 13.335 1.00 0.00 C ATOM 179 O ARG A 51 -0.082 10.791 14.054 1.00 0.00 O ATOM 180 CB ARG A 51 -2.146 10.119 11.958 1.00 0.00 C ATOM 181 CG ARG A 51 -3.257 9.428 11.156 1.00 0.00 C ATOM 182 CD ARG A 51 -4.591 9.433 11.892 1.00 0.00 C ATOM 183 NE ARG A 51 -5.490 8.530 11.163 1.00 0.00 N ATOM 184 CZ ARG A 51 -6.026 7.401 11.607 1.00 0.00 C ATOM 185 NH1 ARG A 51 -6.059 7.066 12.897 1.00 0.00 N ATOM 186 NH2 ARG A 51 -6.672 6.610 10.764 1.00 0.00 N ATOM 0 H ARG A 51 -3.026 9.198 14.149 1.00 0.00 H new ATOM 0 HA ARG A 51 -1.100 8.283 12.245 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.586 10.900 12.578 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.458 10.608 11.268 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.373 9.929 10.195 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.964 8.399 10.946 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -4.464 9.101 12.922 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.006 10.440 11.931 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.729 8.801 10.209 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -5.659 7.691 13.597 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.484 6.184 13.184 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -6.754 6.871 9.781 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.087 5.740 11.097 1.00 0.00 H new ATOM 187 N SER A 52 1.028 9.177 12.917 1.00 0.00 N ATOM 188 CA SER A 52 2.356 9.779 13.108 1.00 0.00 C ATOM 189 C SER A 52 2.634 10.823 12.027 1.00 0.00 C ATOM 190 O SER A 52 2.914 10.535 10.857 1.00 0.00 O ATOM 191 CB SER A 52 3.502 8.781 13.265 1.00 0.00 C ATOM 192 OG SER A 52 3.887 8.173 12.027 1.00 0.00 O ATOM 0 H SER A 52 1.034 8.270 12.450 1.00 0.00 H new ATOM 0 HA SER A 52 2.318 10.279 14.076 1.00 0.00 H new ATOM 0 HB2 SER A 52 4.364 9.290 13.697 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.206 8.003 13.969 1.00 0.00 H new ATOM 0 HG SER A 52 4.638 8.669 11.639 1.00 0.00 H new ATOM 193 N ASP A 53 1.931 11.876 12.402 1.00 0.00 N ATOM 194 CA ASP A 53 1.899 13.267 11.905 1.00 0.00 C ATOM 195 C ASP A 53 2.351 13.610 10.485 1.00 0.00 C ATOM 196 O ASP A 53 1.653 14.318 9.760 1.00 0.00 O ATOM 197 CB ASP A 53 2.677 14.061 12.950 1.00 0.00 C ATOM 198 CG ASP A 53 2.054 15.435 13.177 1.00 0.00 C ATOM 199 OD1 ASP A 53 0.943 15.455 13.743 1.00 0.00 O ATOM 200 OD2 ASP A 53 2.735 16.422 12.844 1.00 0.00 O ATOM 0 H ASP A 53 1.270 11.774 13.172 1.00 0.00 H new ATOM 0 HA ASP A 53 0.845 13.518 11.787 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.697 13.508 13.889 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.711 14.177 12.626 1.00 0.00 H new ATOM 201 N GLN A 54 3.535 13.124 10.138 1.00 0.00 N ATOM 202 CA GLN A 54 4.235 13.507 8.908 1.00 0.00 C ATOM 203 C GLN A 54 4.267 12.387 7.850 1.00 0.00 C ATOM 204 O GLN A 54 3.821 12.587 6.727 1.00 0.00 O ATOM 205 CB GLN A 54 5.659 13.891 9.320 1.00 0.00 C ATOM 206 CG GLN A 54 6.517 14.392 8.156 1.00 0.00 C ATOM 207 CD GLN A 54 8.008 14.333 8.496 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.459 14.474 9.623 1.00 0.00 O ATOM 209 NE2 GLN A 54 8.805 13.973 7.525 1.00 0.00 N ATOM 0 H GLN A 54 4.046 12.446 10.704 1.00 0.00 H new ATOM 0 HA GLN A 54 3.704 14.334 8.435 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.611 14.666 10.085 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.144 13.026 9.772 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.320 13.788 7.270 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.238 15.417 7.911 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.437 13.853 6.581 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.795 13.812 7.711 1.00 0.00 H new ATOM 210 N HIS A 55 4.595 11.172 8.306 1.00 0.00 N ATOM 211 CA HIS A 55 5.091 10.081 7.443 1.00 0.00 C ATOM 212 C HIS A 55 4.072 9.576 6.414 1.00 0.00 C ATOM 213 O HIS A 55 4.468 9.264 5.292 1.00 0.00 O ATOM 214 CB HIS A 55 5.659 8.992 8.370 1.00 0.00 C ATOM 215 CG HIS A 55 6.481 9.601 9.520 1.00 0.00 C ATOM 216 ND1 HIS A 55 6.109 9.642 10.793 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.548 10.395 9.392 1.00 0.00 C ATOM 218 CE1 HIS A 55 6.944 10.440 11.453 1.00 0.00 C ATOM 219 NE2 HIS A 55 7.826 10.904 10.586 1.00 0.00 N ATOM 0 H HIS A 55 4.525 10.912 9.290 1.00 0.00 H new ATOM 0 HA HIS A 55 5.884 10.456 6.795 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.841 8.399 8.780 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.287 8.313 7.793 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.089 10.589 8.478 1.00 0.00 H new ATOM 0 HE1 HIS A 55 6.907 10.668 12.508 1.00 0.00 H new ATOM 0 HE2 HIS A 55 8.591 11.545 10.798 1.00 0.00 H new ATOM 220 N ILE A 56 2.789 9.738 6.773 1.00 0.00 N ATOM 221 CA ILE A 56 1.566 9.447 5.964 1.00 0.00 C ATOM 222 C ILE A 56 1.429 10.233 4.659 1.00 0.00 C ATOM 223 O ILE A 56 0.572 11.101 4.494 1.00 0.00 O ATOM 224 CB ILE A 56 0.291 9.615 6.824 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.267 10.953 7.582 1.00 0.00 C ATOM 226 CG2 ILE A 56 0.091 8.439 7.770 1.00 0.00 C ATOM 227 CD1 ILE A 56 -1.149 11.488 7.796 1.00 0.00 C ATOM 0 H ILE A 56 2.548 10.099 7.696 1.00 0.00 H new ATOM 0 HA ILE A 56 1.687 8.409 5.654 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.550 9.629 6.131 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.752 10.826 8.550 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.849 11.690 7.028 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.814 8.594 8.357 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.004 7.519 7.192 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.948 8.360 8.439 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.103 12.434 8.336 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.629 11.645 6.830 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.727 10.767 8.375 1.00 0.00 H new ATOM 228 N GLN A 57 2.194 9.782 3.680 1.00 0.00 N ATOM 229 CA GLN A 57 2.129 10.330 2.322 1.00 0.00 C ATOM 230 C GLN A 57 2.487 9.268 1.286 1.00 0.00 C ATOM 231 O GLN A 57 3.452 8.534 1.432 1.00 0.00 O ATOM 232 CB GLN A 57 3.083 11.525 2.211 1.00 0.00 C ATOM 233 CG GLN A 57 2.517 12.579 1.246 1.00 0.00 C ATOM 234 CD GLN A 57 2.430 12.114 -0.209 1.00 0.00 C ATOM 235 OE1 GLN A 57 3.358 11.594 -0.804 1.00 0.00 O ATOM 236 NE2 GLN A 57 1.269 12.292 -0.789 1.00 0.00 N ATOM 0 H GLN A 57 2.875 9.032 3.795 1.00 0.00 H new ATOM 0 HA GLN A 57 1.109 10.659 2.124 1.00 0.00 H new ATOM 0 HB2 GLN A 57 3.235 11.969 3.195 1.00 0.00 H new ATOM 0 HB3 GLN A 57 4.058 11.188 1.859 1.00 0.00 H new ATOM 0 HG2 GLN A 57 1.522 12.867 1.584 1.00 0.00 H new ATOM 0 HG3 GLN A 57 3.141 13.472 1.294 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.504 12.729 -0.275 1.00 0.00 H new ATOM 0 HE22 GLN A 57 1.130 11.994 -1.754 1.00 0.00 H new ATOM 237 N LEU A 58 1.608 9.170 0.287 1.00 0.00 N ATOM 238 CA LEU A 58 1.853 8.309 -0.866 1.00 0.00 C ATOM 239 C LEU A 58 1.577 9.037 -2.186 1.00 0.00 C ATOM 240 O LEU A 58 0.589 9.751 -2.359 1.00 0.00 O ATOM 241 CB LEU A 58 1.127 6.970 -0.619 1.00 0.00 C ATOM 242 CG LEU A 58 -0.211 6.719 -1.347 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.047 6.465 -2.854 1.00 0.00 C ATOM 244 CD2 LEU A 58 -0.829 5.458 -0.764 1.00 0.00 C ATOM 0 H LEU A 58 0.723 9.676 0.255 1.00 0.00 H new ATOM 0 HA LEU A 58 2.907 8.055 -0.980 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.810 6.166 -0.892 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.944 6.883 0.452 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.820 7.613 -1.212 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.026 6.296 -3.303 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.422 7.332 -3.320 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.580 5.587 -3.009 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.778 5.255 -1.260 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.152 4.617 -0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.000 5.597 0.304 1.00 0.00 H new ATOM 245 N GLN A 59 2.590 8.963 -3.041 1.00 0.00 N ATOM 246 CA GLN A 59 2.581 9.525 -4.403 1.00 0.00 C ATOM 247 C GLN A 59 3.094 8.481 -5.382 1.00 0.00 C ATOM 248 O GLN A 59 4.161 7.895 -5.171 1.00 0.00 O ATOM 249 CB GLN A 59 3.534 10.724 -4.429 1.00 0.00 C ATOM 250 CG GLN A 59 3.073 11.874 -5.334 1.00 0.00 C ATOM 251 CD GLN A 59 2.750 11.438 -6.777 1.00 0.00 C ATOM 252 OE1 GLN A 59 1.629 11.108 -7.126 1.00 0.00 O ATOM 253 NE2 GLN A 59 3.744 11.395 -7.632 1.00 0.00 N ATOM 0 H GLN A 59 3.468 8.500 -2.808 1.00 0.00 H new ATOM 0 HA GLN A 59 1.570 9.824 -4.679 1.00 0.00 H new ATOM 0 HB2 GLN A 59 3.653 11.101 -3.413 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.516 10.386 -4.761 1.00 0.00 H new ATOM 0 HG2 GLN A 59 2.188 12.336 -4.897 1.00 0.00 H new ATOM 0 HG3 GLN A 59 3.850 12.638 -5.360 1.00 0.00 H new ATOM 0 HE21 GLN A 59 4.681 11.671 -7.339 1.00 0.00 H new ATOM 0 HE22 GLN A 59 3.580 11.085 -8.590 1.00 0.00 H new ATOM 254 N LEU A 60 2.386 8.313 -6.499 1.00 0.00 N ATOM 255 CA LEU A 60 2.826 7.296 -7.455 1.00 0.00 C ATOM 256 C LEU A 60 3.599 7.729 -8.700 1.00 0.00 C ATOM 257 O LEU A 60 3.103 8.287 -9.680 1.00 0.00 O ATOM 258 CB LEU A 60 1.871 6.125 -7.749 1.00 0.00 C ATOM 259 CG LEU A 60 0.380 6.386 -8.017 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.294 6.681 -6.677 1.00 0.00 C ATOM 261 CD2 LEU A 60 0.078 7.415 -9.113 1.00 0.00 C ATOM 0 H LEU A 60 1.549 8.836 -6.757 1.00 0.00 H new ATOM 0 HA LEU A 60 3.598 6.892 -6.800 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.267 5.597 -8.616 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.931 5.440 -6.903 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.051 5.485 -8.453 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.355 6.870 -6.837 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.175 5.825 -6.013 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.167 7.559 -6.223 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.001 7.524 -9.222 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.514 8.376 -8.840 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.506 7.077 -10.057 1.00 0.00 H new ATOM 262 N SER A 61 4.824 7.243 -8.638 1.00 0.00 N ATOM 263 CA SER A 61 5.842 7.383 -9.702 1.00 0.00 C ATOM 264 C SER A 61 5.737 6.158 -10.609 1.00 0.00 C ATOM 265 O SER A 61 6.378 5.119 -10.429 1.00 0.00 O ATOM 266 CB SER A 61 7.220 7.422 -9.081 1.00 0.00 C ATOM 267 OG SER A 61 7.338 8.521 -8.172 1.00 0.00 O ATOM 0 H SER A 61 5.164 6.722 -7.829 1.00 0.00 H new ATOM 0 HA SER A 61 5.679 8.301 -10.267 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.413 6.487 -8.555 1.00 0.00 H new ATOM 0 HB3 SER A 61 7.974 7.509 -9.863 1.00 0.00 H new ATOM 0 HG SER A 61 8.275 8.624 -7.903 1.00 0.00 H new ATOM 268 N ALA A 62 4.635 6.187 -11.343 1.00 0.00 N ATOM 269 CA ALA A 62 4.279 5.107 -12.296 1.00 0.00 C ATOM 270 C ALA A 62 5.318 4.809 -13.368 1.00 0.00 C ATOM 271 O ALA A 62 5.589 5.597 -14.272 1.00 0.00 O ATOM 272 CB ALA A 62 2.920 5.372 -12.946 1.00 0.00 C ATOM 0 H ALA A 62 3.956 6.947 -11.307 1.00 0.00 H new ATOM 0 HA ALA A 62 4.236 4.211 -11.677 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.685 4.565 -13.640 1.00 0.00 H new ATOM 0 HB2 ALA A 62 2.152 5.423 -12.175 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.954 6.317 -13.488 1.00 0.00 H new ATOM 273 N GLU A 63 5.659 3.534 -13.369 1.00 0.00 N ATOM 274 CA GLU A 63 6.704 2.964 -14.242 1.00 0.00 C ATOM 275 C GLU A 63 6.039 2.016 -15.237 1.00 0.00 C ATOM 276 O GLU A 63 5.859 0.820 -15.003 1.00 0.00 O ATOM 277 CB GLU A 63 7.753 2.271 -13.370 1.00 0.00 C ATOM 278 CG GLU A 63 8.964 1.769 -14.175 1.00 0.00 C ATOM 279 CD GLU A 63 9.915 2.904 -14.572 1.00 0.00 C ATOM 280 OE1 GLU A 63 10.707 3.307 -13.684 1.00 0.00 O ATOM 281 OE2 GLU A 63 9.872 3.306 -15.752 1.00 0.00 O ATOM 0 H GLU A 63 5.220 2.844 -12.760 1.00 0.00 H new ATOM 0 HA GLU A 63 7.218 3.736 -14.814 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.096 2.965 -12.602 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.291 1.429 -12.855 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.509 1.032 -13.585 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.614 1.261 -15.074 1.00 0.00 H new ATOM 282 N SER A 64 5.556 2.679 -16.278 1.00 0.00 N ATOM 283 CA SER A 64 4.844 2.104 -17.448 1.00 0.00 C ATOM 284 C SER A 64 3.372 1.762 -17.126 1.00 0.00 C ATOM 285 O SER A 64 3.014 1.533 -15.971 1.00 0.00 O ATOM 286 CB SER A 64 5.599 0.901 -18.023 1.00 0.00 C ATOM 287 OG SER A 64 4.904 0.210 -19.072 1.00 0.00 O ATOM 0 H SER A 64 5.647 3.692 -16.348 1.00 0.00 H new ATOM 0 HA SER A 64 4.820 2.874 -18.219 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.562 1.241 -18.404 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.806 0.198 -17.216 1.00 0.00 H new ATOM 0 HG SER A 64 5.449 -0.541 -19.386 1.00 0.00 H new ATOM 288 N VAL A 65 2.656 1.474 -18.205 1.00 0.00 N ATOM 289 CA VAL A 65 1.193 1.287 -18.332 1.00 0.00 C ATOM 290 C VAL A 65 0.382 1.671 -17.064 1.00 0.00 C ATOM 291 O VAL A 65 0.071 2.845 -16.869 1.00 0.00 O ATOM 292 CB VAL A 65 0.934 -0.103 -18.955 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.485 -1.294 -18.165 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.535 -0.314 -19.305 1.00 0.00 C ATOM 0 H VAL A 65 3.117 1.351 -19.107 1.00 0.00 H new ATOM 0 HA VAL A 65 0.778 2.018 -19.025 1.00 0.00 H new ATOM 0 HB VAL A 65 1.517 -0.081 -19.876 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.248 -2.220 -18.690 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.566 -1.198 -18.069 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.033 -1.313 -17.173 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.667 -1.305 -19.740 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.140 -0.231 -18.402 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.850 0.442 -20.024 1.00 0.00 H new ATOM 295 N GLY A 66 0.100 0.679 -16.223 1.00 0.00 N ATOM 296 CA GLY A 66 -0.539 0.824 -14.910 1.00 0.00 C ATOM 297 C GLY A 66 0.292 0.086 -13.873 1.00 0.00 C ATOM 298 O GLY A 66 -0.080 -1.016 -13.492 1.00 0.00 O ATOM 0 H GLY A 66 0.319 -0.292 -16.444 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.622 1.878 -14.646 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.552 0.422 -14.937 1.00 0.00 H new ATOM 299 N GLU A 67 1.538 0.537 -13.698 1.00 0.00 N ATOM 300 CA GLU A 67 2.457 -0.034 -12.717 1.00 0.00 C ATOM 301 C GLU A 67 3.018 1.107 -11.866 1.00 0.00 C ATOM 302 O GLU A 67 3.682 1.994 -12.397 1.00 0.00 O ATOM 303 CB GLU A 67 3.623 -0.670 -13.467 1.00 0.00 C ATOM 304 CG GLU A 67 3.297 -1.660 -14.597 1.00 0.00 C ATOM 305 CD GLU A 67 4.549 -2.123 -15.355 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.546 -2.478 -14.679 1.00 0.00 O ATOM 307 OE2 GLU A 67 4.463 -2.169 -16.599 1.00 0.00 O ATOM 0 H GLU A 67 1.935 1.309 -14.234 1.00 0.00 H new ATOM 0 HA GLU A 67 1.944 -0.769 -12.097 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.227 0.133 -13.890 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.247 -1.188 -12.738 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.788 -2.528 -14.179 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.605 -1.192 -15.297 1.00 0.00 H new ATOM 308 N VAL A 68 2.799 1.076 -10.563 1.00 0.00 N ATOM 309 CA VAL A 68 3.158 2.209 -9.682 1.00 0.00 C ATOM 310 C VAL A 68 4.341 1.970 -8.745 1.00 0.00 C ATOM 311 O VAL A 68 4.412 0.965 -8.047 1.00 0.00 O ATOM 312 CB VAL A 68 1.993 2.722 -8.812 1.00 0.00 C ATOM 313 CG1 VAL A 68 0.599 2.599 -9.378 1.00 0.00 C ATOM 314 CG2 VAL A 68 1.700 1.873 -7.597 1.00 0.00 C ATOM 0 H VAL A 68 2.375 0.285 -10.078 1.00 0.00 H new ATOM 0 HA VAL A 68 3.443 2.958 -10.421 1.00 0.00 H new ATOM 0 HB VAL A 68 2.369 3.736 -8.672 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.121 2.997 -8.663 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.534 3.161 -10.310 1.00 0.00 H new ATOM 0 HG13 VAL A 68 0.376 1.550 -9.571 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.867 2.306 -7.043 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.439 0.863 -7.913 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.582 1.837 -6.957 1.00 0.00 H new ATOM 315 N TYR A 69 5.248 2.932 -8.726 1.00 0.00 N ATOM 316 CA TYR A 69 6.255 2.991 -7.656 1.00 0.00 C ATOM 317 C TYR A 69 5.805 4.017 -6.611 1.00 0.00 C ATOM 318 O TYR A 69 5.752 5.220 -6.887 1.00 0.00 O ATOM 319 CB TYR A 69 7.647 3.418 -8.146 1.00 0.00 C ATOM 320 CG TYR A 69 8.457 2.310 -8.816 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.510 1.022 -8.234 1.00 0.00 C ATOM 322 CD2 TYR A 69 9.286 2.670 -9.907 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.424 0.077 -8.733 1.00 0.00 C ATOM 324 CE2 TYR A 69 10.223 1.729 -10.385 1.00 0.00 C ATOM 325 CZ TYR A 69 10.294 0.459 -9.784 1.00 0.00 C ATOM 326 OH TYR A 69 11.346 -0.346 -10.051 1.00 0.00 O ATOM 0 H TYR A 69 5.316 3.675 -9.422 1.00 0.00 H new ATOM 0 HA TYR A 69 6.335 1.982 -7.251 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.532 4.242 -8.851 1.00 0.00 H new ATOM 0 HB3 TYR A 69 8.214 3.801 -7.297 1.00 0.00 H new ATOM 0 HD1 TYR A 69 7.855 0.767 -7.414 1.00 0.00 H new ATOM 0 HD2 TYR A 69 9.203 3.645 -10.364 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.462 -0.921 -8.323 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.879 1.982 -11.205 1.00 0.00 H new ATOM 0 HH TYR A 69 11.864 0.028 -10.794 1.00 0.00 H new ATOM 327 N ILE A 70 5.326 3.502 -5.494 1.00 0.00 N ATOM 328 CA ILE A 70 4.734 4.389 -4.480 1.00 0.00 C ATOM 329 C ILE A 70 5.801 5.033 -3.596 1.00 0.00 C ATOM 330 O ILE A 70 6.285 4.461 -2.627 1.00 0.00 O ATOM 331 CB ILE A 70 3.562 3.746 -3.735 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.491 3.352 -4.749 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.970 4.723 -2.731 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.307 2.534 -4.203 1.00 0.00 C ATOM 0 H ILE A 70 5.328 2.509 -5.259 1.00 0.00 H new ATOM 0 HA ILE A 70 4.269 5.225 -5.003 1.00 0.00 H new ATOM 0 HB ILE A 70 3.917 2.866 -3.198 1.00 0.00 H new ATOM 0 HG12 ILE A 70 2.098 4.262 -5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.967 2.778 -5.544 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.138 4.250 -2.210 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.734 5.010 -2.009 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.613 5.610 -3.254 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.612 2.314 -5.014 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.675 1.601 -3.777 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.794 3.108 -3.431 1.00 0.00 H new ATOM 335 N LYS A 71 6.063 6.256 -4.003 1.00 0.00 N ATOM 336 CA LYS A 71 6.948 7.222 -3.339 1.00 0.00 C ATOM 337 C LYS A 71 6.139 8.029 -2.320 1.00 0.00 C ATOM 338 O LYS A 71 4.920 7.934 -2.250 1.00 0.00 O ATOM 339 CB LYS A 71 7.487 8.081 -4.476 1.00 0.00 C ATOM 340 CG LYS A 71 8.678 8.949 -4.041 1.00 0.00 C ATOM 341 CD LYS A 71 9.141 9.905 -5.142 1.00 0.00 C ATOM 342 CE LYS A 71 8.173 11.076 -5.353 1.00 0.00 C ATOM 343 NZ LYS A 71 8.870 12.044 -6.196 1.00 0.00 N ATOM 0 H LYS A 71 5.647 6.636 -4.853 1.00 0.00 H new ATOM 0 HA LYS A 71 7.765 6.767 -2.779 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.792 7.437 -5.301 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.691 8.724 -4.851 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.400 9.525 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.508 8.303 -3.753 1.00 0.00 H new ATOM 0 HD2 LYS A 71 10.127 10.295 -4.889 1.00 0.00 H new ATOM 0 HD3 LYS A 71 9.247 9.353 -6.076 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.253 10.738 -5.830 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.892 11.523 -4.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.252 12.862 -6.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.737 12.361 -5.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.118 11.599 -7.103 1.00 0.00 H new ATOM 344 N SER A 72 6.891 8.667 -1.447 1.00 0.00 N ATOM 345 CA SER A 72 6.336 9.479 -0.353 1.00 0.00 C ATOM 346 C SER A 72 7.025 10.841 -0.300 1.00 0.00 C ATOM 347 O SER A 72 8.246 10.933 -0.208 1.00 0.00 O ATOM 348 CB SER A 72 6.570 8.667 0.925 1.00 0.00 C ATOM 349 OG SER A 72 7.894 8.151 0.973 1.00 0.00 O ATOM 0 H SER A 72 7.911 8.645 -1.466 1.00 0.00 H new ATOM 0 HA SER A 72 5.274 9.685 -0.488 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.391 9.297 1.797 1.00 0.00 H new ATOM 0 HB3 SER A 72 5.855 7.846 0.973 1.00 0.00 H new ATOM 0 HG SER A 72 7.865 7.172 0.945 1.00 0.00 H new ATOM 350 N THR A 73 6.244 11.921 -0.370 1.00 0.00 N ATOM 351 CA THR A 73 6.810 13.293 -0.330 1.00 0.00 C ATOM 352 C THR A 73 7.363 13.713 1.036 1.00 0.00 C ATOM 353 O THR A 73 8.165 14.641 1.122 1.00 0.00 O ATOM 354 CB THR A 73 5.813 14.362 -0.769 1.00 0.00 C ATOM 355 OG1 THR A 73 4.690 14.339 0.105 1.00 0.00 O ATOM 356 CG2 THR A 73 5.409 14.220 -2.236 1.00 0.00 C ATOM 0 H THR A 73 5.228 11.886 -0.454 1.00 0.00 H new ATOM 0 HA THR A 73 7.637 13.231 -1.038 1.00 0.00 H new ATOM 0 HB THR A 73 6.295 15.337 -0.699 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.047 15.025 -0.171 1.00 0.00 H new ATOM 0 HG21 THR A 73 4.699 15.005 -2.495 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.293 14.308 -2.867 1.00 0.00 H new ATOM 0 HG23 THR A 73 4.946 13.246 -2.393 1.00 0.00 H new ATOM 357 N GLU A 74 6.859 13.089 2.099 1.00 0.00 N ATOM 358 CA GLU A 74 7.279 13.358 3.482 1.00 0.00 C ATOM 359 C GLU A 74 8.407 12.446 4.015 1.00 0.00 C ATOM 360 O GLU A 74 9.028 12.765 5.029 1.00 0.00 O ATOM 361 CB GLU A 74 6.071 13.332 4.423 1.00 0.00 C ATOM 362 CG GLU A 74 5.410 14.708 4.550 1.00 0.00 C ATOM 363 CD GLU A 74 4.734 15.226 3.276 1.00 0.00 C ATOM 364 OE1 GLU A 74 3.536 14.934 3.109 1.00 0.00 O ATOM 365 OE2 GLU A 74 5.390 15.990 2.536 1.00 0.00 O ATOM 0 H GLU A 74 6.137 12.372 2.028 1.00 0.00 H new ATOM 0 HA GLU A 74 7.715 14.357 3.458 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.340 12.612 4.054 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.387 12.990 5.408 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.666 14.664 5.345 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.166 15.429 4.860 1.00 0.00 H new ATOM 366 N THR A 75 8.648 11.343 3.328 1.00 0.00 N ATOM 367 CA THR A 75 9.572 10.285 3.784 1.00 0.00 C ATOM 368 C THR A 75 10.561 9.727 2.756 1.00 0.00 C ATOM 369 O THR A 75 11.547 9.099 3.133 1.00 0.00 O ATOM 370 CB THR A 75 8.773 9.135 4.426 1.00 0.00 C ATOM 371 OG1 THR A 75 7.420 9.128 3.975 1.00 0.00 O ATOM 372 CG2 THR A 75 8.854 9.260 5.940 1.00 0.00 C ATOM 0 H THR A 75 8.211 11.142 2.429 1.00 0.00 H new ATOM 0 HA THR A 75 10.212 10.791 4.507 1.00 0.00 H new ATOM 0 HB THR A 75 9.208 8.183 4.123 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.029 8.242 4.127 1.00 0.00 H new ATOM 0 HG21 THR A 75 8.291 8.450 6.403 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.896 9.203 6.255 1.00 0.00 H new ATOM 0 HG23 THR A 75 8.433 10.217 6.249 1.00 0.00 H new ATOM 373 N GLY A 76 10.174 9.777 1.478 1.00 0.00 N ATOM 374 CA GLY A 76 10.960 9.319 0.317 1.00 0.00 C ATOM 375 C GLY A 76 10.873 7.804 0.092 1.00 0.00 C ATOM 376 O GLY A 76 10.845 7.326 -1.048 1.00 0.00 O ATOM 0 H GLY A 76 9.265 10.153 1.207 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.610 9.834 -0.578 1.00 0.00 H new ATOM 0 HA3 GLY A 76 12.004 9.600 0.458 1.00 0.00 H new ATOM 377 N GLN A 77 10.900 7.071 1.198 1.00 0.00 N ATOM 378 CA GLN A 77 10.788 5.595 1.248 1.00 0.00 C ATOM 379 C GLN A 77 9.543 5.083 0.525 1.00 0.00 C ATOM 380 O GLN A 77 8.450 5.646 0.587 1.00 0.00 O ATOM 381 CB GLN A 77 10.807 5.133 2.702 1.00 0.00 C ATOM 382 CG GLN A 77 12.195 5.395 3.294 1.00 0.00 C ATOM 383 CD GLN A 77 12.363 5.043 4.774 1.00 0.00 C ATOM 384 OE1 GLN A 77 11.555 4.407 5.437 1.00 0.00 O ATOM 385 NE2 GLN A 77 13.451 5.508 5.329 1.00 0.00 N ATOM 0 H GLN A 77 11.003 7.489 2.123 1.00 0.00 H new ATOM 0 HA GLN A 77 11.644 5.172 0.722 1.00 0.00 H new ATOM 0 HB2 GLN A 77 10.047 5.665 3.275 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.567 4.071 2.762 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.928 4.828 2.719 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.433 6.450 3.161 1.00 0.00 H new ATOM 0 HE21 GLN A 77 14.121 6.038 4.772 1.00 0.00 H new ATOM 0 HE22 GLN A 77 13.630 5.341 6.319 1.00 0.00 H new ATOM 386 N TYR A 78 9.766 3.978 -0.174 1.00 0.00 N ATOM 387 CA TYR A 78 8.757 3.373 -1.060 1.00 0.00 C ATOM 388 C TYR A 78 7.857 2.350 -0.366 1.00 0.00 C ATOM 389 O TYR A 78 8.269 1.659 0.569 1.00 0.00 O ATOM 390 CB TYR A 78 9.487 2.728 -2.240 1.00 0.00 C ATOM 391 CG TYR A 78 10.208 3.727 -3.160 1.00 0.00 C ATOM 392 CD1 TYR A 78 11.497 4.152 -2.778 1.00 0.00 C ATOM 393 CD2 TYR A 78 9.503 4.337 -4.215 1.00 0.00 C ATOM 394 CE1 TYR A 78 12.077 5.260 -3.415 1.00 0.00 C ATOM 395 CE2 TYR A 78 10.092 5.437 -4.880 1.00 0.00 C ATOM 396 CZ TYR A 78 11.360 5.899 -4.450 1.00 0.00 C ATOM 397 OH TYR A 78 11.811 7.100 -4.905 1.00 0.00 O ATOM 0 H TYR A 78 10.649 3.469 -0.149 1.00 0.00 H new ATOM 0 HA TYR A 78 8.087 4.167 -1.392 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.216 2.015 -1.855 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.768 2.161 -2.831 1.00 0.00 H new ATOM 0 HD1 TYR A 78 12.034 3.629 -2.001 1.00 0.00 H new ATOM 0 HD2 TYR A 78 8.531 3.972 -4.511 1.00 0.00 H new ATOM 0 HE1 TYR A 78 13.053 5.617 -3.119 1.00 0.00 H new ATOM 0 HE2 TYR A 78 9.583 5.917 -5.703 1.00 0.00 H new ATOM 0 HH TYR A 78 11.221 7.422 -5.618 1.00 0.00 H new ATOM 398 N LEU A 79 6.588 2.368 -0.767 1.00 0.00 N ATOM 399 CA LEU A 79 5.613 1.322 -0.377 1.00 0.00 C ATOM 400 C LEU A 79 6.003 0.034 -1.124 1.00 0.00 C ATOM 401 O LEU A 79 5.895 -0.064 -2.346 1.00 0.00 O ATOM 402 CB LEU A 79 4.193 1.683 -0.802 1.00 0.00 C ATOM 403 CG LEU A 79 3.143 0.956 0.035 1.00 0.00 C ATOM 404 CD1 LEU A 79 2.556 2.011 0.968 1.00 0.00 C ATOM 405 CD2 LEU A 79 2.011 0.424 -0.839 1.00 0.00 C ATOM 0 H LEU A 79 6.198 3.096 -1.366 1.00 0.00 H new ATOM 0 HA LEU A 79 5.634 1.211 0.707 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.049 2.759 -0.709 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.055 1.433 -1.854 1.00 0.00 H new ATOM 0 HG LEU A 79 3.595 0.114 0.559 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.793 1.555 1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.347 2.423 1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.108 2.810 0.377 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.279 -0.089 -0.215 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.529 1.254 -1.356 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.415 -0.274 -1.572 1.00 0.00 H new ATOM 406 N ALA A 80 6.585 -0.862 -0.353 1.00 0.00 N ATOM 407 CA ALA A 80 7.108 -2.135 -0.854 1.00 0.00 C ATOM 408 C ALA A 80 6.471 -3.315 -0.129 1.00 0.00 C ATOM 409 O ALA A 80 5.928 -3.151 0.968 1.00 0.00 O ATOM 410 CB ALA A 80 8.618 -2.152 -0.617 1.00 0.00 C ATOM 0 H ALA A 80 6.714 -0.734 0.651 1.00 0.00 H new ATOM 0 HA ALA A 80 6.876 -2.227 -1.915 1.00 0.00 H new ATOM 0 HB1 ALA A 80 9.033 -3.091 -0.982 1.00 0.00 H new ATOM 0 HB2 ALA A 80 9.079 -1.320 -1.150 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.820 -2.056 0.450 1.00 0.00 H new ATOM 411 N MET A 81 6.624 -4.507 -0.689 1.00 0.00 N ATOM 412 CA MET A 81 6.138 -5.740 -0.063 1.00 0.00 C ATOM 413 C MET A 81 7.156 -6.871 -0.184 1.00 0.00 C ATOM 414 O MET A 81 7.952 -6.920 -1.124 1.00 0.00 O ATOM 415 CB MET A 81 4.782 -6.112 -0.659 1.00 0.00 C ATOM 416 CG MET A 81 4.154 -7.313 0.057 1.00 0.00 C ATOM 417 SD MET A 81 2.356 -7.142 0.376 1.00 0.00 S ATOM 418 CE MET A 81 1.714 -6.809 -1.247 1.00 0.00 C ATOM 0 H MET A 81 7.086 -4.652 -1.587 1.00 0.00 H new ATOM 0 HA MET A 81 6.006 -5.569 1.005 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.109 -5.257 -0.592 1.00 0.00 H new ATOM 0 HB3 MET A 81 4.901 -6.342 -1.718 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.322 -8.208 -0.543 1.00 0.00 H new ATOM 0 HG3 MET A 81 4.667 -7.465 1.007 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.624 -6.808 -1.214 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.068 -5.835 -1.585 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.055 -7.579 -1.938 1.00 0.00 H new ATOM 419 N ASP A 82 7.218 -7.615 0.904 1.00 0.00 N ATOM 420 CA ASP A 82 8.041 -8.832 0.975 1.00 0.00 C ATOM 421 C ASP A 82 7.191 -10.103 0.938 1.00 0.00 C ATOM 422 O ASP A 82 6.061 -10.117 1.417 1.00 0.00 O ATOM 423 CB ASP A 82 8.957 -8.821 2.195 1.00 0.00 C ATOM 424 CG ASP A 82 8.278 -8.437 3.517 1.00 0.00 C ATOM 425 OD1 ASP A 82 7.501 -9.308 3.989 1.00 0.00 O ATOM 426 OD2 ASP A 82 8.520 -7.317 4.005 1.00 0.00 O ATOM 0 H ASP A 82 6.708 -7.405 1.762 1.00 0.00 H new ATOM 0 HA ASP A 82 8.671 -8.836 0.085 1.00 0.00 H new ATOM 0 HB2 ASP A 82 9.400 -9.811 2.306 1.00 0.00 H new ATOM 0 HB3 ASP A 82 9.775 -8.125 2.009 1.00 0.00 H new ATOM 427 N THR A 83 7.893 -11.169 0.581 1.00 0.00 N ATOM 428 CA THR A 83 7.426 -12.572 0.405 1.00 0.00 C ATOM 429 C THR A 83 6.720 -13.188 1.628 1.00 0.00 C ATOM 430 O THR A 83 6.251 -14.323 1.573 1.00 0.00 O ATOM 431 CB THR A 83 8.616 -13.459 0.020 1.00 0.00 C ATOM 432 OG1 THR A 83 9.693 -12.637 -0.460 1.00 0.00 O ATOM 433 CG2 THR A 83 8.208 -14.460 -1.054 1.00 0.00 C ATOM 0 H THR A 83 8.891 -11.087 0.386 1.00 0.00 H new ATOM 0 HA THR A 83 6.674 -12.529 -0.383 1.00 0.00 H new ATOM 0 HB THR A 83 8.945 -14.011 0.901 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.454 -13.204 -0.704 1.00 0.00 H new ATOM 0 HG21 THR A 83 9.064 -15.082 -1.316 1.00 0.00 H new ATOM 0 HG22 THR A 83 7.403 -15.091 -0.677 1.00 0.00 H new ATOM 0 HG23 THR A 83 7.864 -13.924 -1.939 1.00 0.00 H new ATOM 434 N ASP A 84 6.838 -12.514 2.761 1.00 0.00 N ATOM 435 CA ASP A 84 6.120 -12.822 4.023 1.00 0.00 C ATOM 436 C ASP A 84 4.648 -12.385 3.999 1.00 0.00 C ATOM 437 O ASP A 84 3.842 -12.900 4.763 1.00 0.00 O ATOM 438 CB ASP A 84 6.895 -12.170 5.174 1.00 0.00 C ATOM 439 CG ASP A 84 8.331 -12.700 5.244 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.174 -12.091 4.557 1.00 0.00 O ATOM 441 OD2 ASP A 84 8.535 -13.712 5.948 1.00 0.00 O ATOM 0 H ASP A 84 7.454 -11.706 2.848 1.00 0.00 H new ATOM 0 HA ASP A 84 6.084 -13.903 4.159 1.00 0.00 H new ATOM 0 HB2 ASP A 84 6.910 -11.088 5.040 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.385 -12.367 6.117 1.00 0.00 H new ATOM 442 N GLY A 85 4.350 -11.408 3.144 1.00 0.00 N ATOM 443 CA GLY A 85 3.020 -10.771 3.028 1.00 0.00 C ATOM 444 C GLY A 85 3.034 -9.303 3.478 1.00 0.00 C ATOM 445 O GLY A 85 2.168 -8.508 3.123 1.00 0.00 O ATOM 0 H GLY A 85 5.035 -11.022 2.494 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.682 -10.828 1.993 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.300 -11.326 3.630 1.00 0.00 H new ATOM 446 N LEU A 86 4.194 -8.878 3.965 1.00 0.00 N ATOM 447 CA LEU A 86 4.292 -7.628 4.729 1.00 0.00 C ATOM 448 C LEU A 86 4.768 -6.467 3.877 1.00 0.00 C ATOM 449 O LEU A 86 5.801 -6.541 3.195 1.00 0.00 O ATOM 450 CB LEU A 86 5.233 -7.786 5.924 1.00 0.00 C ATOM 451 CG LEU A 86 5.126 -9.088 6.735 1.00 0.00 C ATOM 452 CD1 LEU A 86 5.570 -8.662 8.130 1.00 0.00 C ATOM 453 CD2 LEU A 86 3.753 -9.739 6.902 1.00 0.00 C ATOM 0 H LEU A 86 5.078 -9.373 3.849 1.00 0.00 H new ATOM 0 HA LEU A 86 3.284 -7.407 5.080 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.257 -7.697 5.562 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.061 -6.950 6.602 1.00 0.00 H new ATOM 0 HG LEU A 86 5.704 -9.842 6.200 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.533 -9.520 8.801 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.590 -8.279 8.086 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.905 -7.882 8.501 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.851 -10.646 7.498 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.080 -9.045 7.405 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.348 -9.991 5.922 1.00 0.00 H new ATOM 454 N LEU A 87 4.136 -5.345 4.206 1.00 0.00 N ATOM 455 CA LEU A 87 4.467 -4.054 3.568 1.00 0.00 C ATOM 456 C LEU A 87 5.543 -3.339 4.370 1.00 0.00 C ATOM 457 O LEU A 87 5.391 -3.013 5.557 1.00 0.00 O ATOM 458 CB LEU A 87 3.284 -3.104 3.391 1.00 0.00 C ATOM 459 CG LEU A 87 2.174 -3.645 2.494 1.00 0.00 C ATOM 460 CD1 LEU A 87 0.885 -2.854 2.742 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.533 -3.609 1.015 1.00 0.00 C ATOM 0 H LEU A 87 3.395 -5.292 4.905 1.00 0.00 H new ATOM 0 HA LEU A 87 4.812 -4.313 2.567 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.865 -2.877 4.371 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.647 -2.164 2.974 1.00 0.00 H new ATOM 0 HG LEU A 87 2.031 -4.694 2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.092 -3.240 2.101 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.590 -2.957 3.786 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.055 -1.802 2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.704 -4.006 0.430 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.730 -2.580 0.713 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.423 -4.214 0.842 1.00 0.00 H new ATOM 462 N TYR A 88 6.605 -3.039 3.639 1.00 0.00 N ATOM 463 CA TYR A 88 7.773 -2.327 4.186 1.00 0.00 C ATOM 464 C TYR A 88 8.141 -1.052 3.419 1.00 0.00 C ATOM 465 O TYR A 88 7.876 -0.918 2.232 1.00 0.00 O ATOM 466 CB TYR A 88 8.977 -3.267 4.371 1.00 0.00 C ATOM 467 CG TYR A 88 9.700 -3.834 3.153 1.00 0.00 C ATOM 468 CD1 TYR A 88 9.023 -4.524 2.117 1.00 0.00 C ATOM 469 CD2 TYR A 88 11.101 -3.860 3.252 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.774 -5.246 1.164 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.856 -4.593 2.325 1.00 0.00 C ATOM 472 CZ TYR A 88 11.182 -5.274 1.284 1.00 0.00 C ATOM 473 OH TYR A 88 11.950 -5.992 0.430 1.00 0.00 O ATOM 0 H TYR A 88 6.692 -3.277 2.651 1.00 0.00 H new ATOM 0 HA TYR A 88 7.471 -1.982 5.175 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.717 -2.732 4.966 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.638 -4.113 4.969 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.945 -4.498 2.057 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.597 -3.315 4.042 1.00 0.00 H new ATOM 0 HE1 TYR A 88 9.281 -5.768 0.357 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.932 -4.637 2.404 1.00 0.00 H new ATOM 0 HH TYR A 88 11.385 -6.380 -0.271 1.00 0.00 H new ATOM 474 N GLY A 89 8.677 -0.114 4.201 1.00 0.00 N ATOM 475 CA GLY A 89 9.107 1.214 3.723 1.00 0.00 C ATOM 476 C GLY A 89 10.505 1.164 3.089 1.00 0.00 C ATOM 477 O GLY A 89 11.410 1.875 3.503 1.00 0.00 O ATOM 0 H GLY A 89 8.830 -0.251 5.200 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.389 1.588 2.993 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.110 1.917 4.556 1.00 0.00 H new ATOM 478 N SER A 90 10.634 0.298 2.085 1.00 0.00 N ATOM 479 CA SER A 90 11.899 0.066 1.355 1.00 0.00 C ATOM 480 C SER A 90 12.371 1.297 0.577 1.00 0.00 C ATOM 481 O SER A 90 11.683 1.839 -0.277 1.00 0.00 O ATOM 482 CB SER A 90 11.779 -1.152 0.430 1.00 0.00 C ATOM 483 OG SER A 90 12.728 -1.135 -0.656 1.00 0.00 O ATOM 0 H SER A 90 9.860 -0.273 1.745 1.00 0.00 H new ATOM 0 HA SER A 90 12.661 -0.138 2.107 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.922 -2.060 1.015 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.769 -1.192 0.021 1.00 0.00 H new ATOM 0 HG SER A 90 12.347 -0.647 -1.416 1.00 0.00 H new ATOM 484 N GLN A 91 13.636 1.626 0.824 1.00 0.00 N ATOM 485 CA GLN A 91 14.391 2.700 0.152 1.00 0.00 C ATOM 486 C GLN A 91 14.505 2.523 -1.378 1.00 0.00 C ATOM 487 O GLN A 91 14.629 3.493 -2.123 1.00 0.00 O ATOM 488 CB GLN A 91 15.805 2.696 0.742 1.00 0.00 C ATOM 489 CG GLN A 91 15.894 3.156 2.211 1.00 0.00 C ATOM 490 CD GLN A 91 15.270 2.151 3.196 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.362 0.935 3.068 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.490 2.651 4.128 1.00 0.00 N ATOM 0 H GLN A 91 14.193 1.137 1.525 1.00 0.00 H new ATOM 0 HA GLN A 91 13.855 3.635 0.318 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.212 1.688 0.666 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.439 3.342 0.135 1.00 0.00 H new ATOM 0 HG2 GLN A 91 16.940 3.312 2.474 1.00 0.00 H new ATOM 0 HG3 GLN A 91 15.392 4.118 2.316 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.410 3.662 4.238 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.964 2.028 4.741 1.00 0.00 H new ATOM 493 N THR A 92 14.609 1.256 -1.767 1.00 0.00 N ATOM 494 CA THR A 92 14.695 0.798 -3.172 1.00 0.00 C ATOM 495 C THR A 92 13.310 0.604 -3.792 1.00 0.00 C ATOM 496 O THR A 92 12.452 -0.017 -3.154 1.00 0.00 O ATOM 497 CB THR A 92 15.404 -0.556 -3.275 1.00 0.00 C ATOM 498 OG1 THR A 92 15.213 -1.352 -2.095 1.00 0.00 O ATOM 499 CG2 THR A 92 16.874 -0.397 -3.638 1.00 0.00 C ATOM 0 H THR A 92 14.638 0.485 -1.100 1.00 0.00 H new ATOM 0 HA THR A 92 15.249 1.574 -3.700 1.00 0.00 H new ATOM 0 HB THR A 92 14.938 -1.103 -4.095 1.00 0.00 H new ATOM 0 HG1 THR A 92 14.289 -1.256 -1.782 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.341 -1.380 -3.701 1.00 0.00 H new ATOM 0 HG22 THR A 92 16.959 0.108 -4.600 1.00 0.00 H new ATOM 0 HG23 THR A 92 17.376 0.195 -2.873 1.00 0.00 H new ATOM 500 N PRO A 93 13.147 1.024 -5.054 1.00 0.00 N ATOM 501 CA PRO A 93 12.040 0.556 -5.868 1.00 0.00 C ATOM 502 C PRO A 93 12.431 -0.660 -6.717 1.00 0.00 C ATOM 503 O PRO A 93 13.494 -0.729 -7.332 1.00 0.00 O ATOM 504 CB PRO A 93 11.614 1.728 -6.717 1.00 0.00 C ATOM 505 CG PRO A 93 12.937 2.472 -6.962 1.00 0.00 C ATOM 506 CD PRO A 93 13.740 2.207 -5.678 1.00 0.00 C ATOM 0 HA PRO A 93 11.215 0.212 -5.244 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.153 1.405 -7.650 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.886 2.356 -6.203 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.453 2.093 -7.844 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.775 3.538 -7.121 1.00 0.00 H new ATOM 0 HD2 PRO A 93 14.792 2.039 -5.906 1.00 0.00 H new ATOM 0 HD3 PRO A 93 13.693 3.065 -5.007 1.00 0.00 H new ATOM 507 N ASN A 94 11.705 -1.707 -6.408 1.00 0.00 N ATOM 508 CA ASN A 94 11.793 -3.030 -7.063 1.00 0.00 C ATOM 509 C ASN A 94 10.380 -3.443 -7.496 1.00 0.00 C ATOM 510 O ASN A 94 9.411 -2.766 -7.170 1.00 0.00 O ATOM 511 CB ASN A 94 12.455 -3.951 -6.024 1.00 0.00 C ATOM 512 CG ASN A 94 12.456 -5.453 -6.358 1.00 0.00 C ATOM 513 OD1 ASN A 94 11.484 -6.157 -6.187 1.00 0.00 O ATOM 514 ND2 ASN A 94 13.550 -5.951 -6.879 1.00 0.00 N ATOM 0 H ASN A 94 11.004 -1.681 -5.668 1.00 0.00 H new ATOM 0 HA ASN A 94 12.392 -3.059 -7.973 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.487 -3.629 -5.887 1.00 0.00 H new ATOM 0 HB3 ASN A 94 11.948 -3.812 -5.069 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.587 -6.936 -7.143 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.365 -5.354 -7.021 1.00 0.00 H new ATOM 515 N GLU A 95 10.252 -4.559 -8.194 1.00 0.00 N ATOM 516 CA GLU A 95 8.958 -5.215 -8.496 1.00 0.00 C ATOM 517 C GLU A 95 8.041 -5.323 -7.259 1.00 0.00 C ATOM 518 O GLU A 95 6.817 -5.271 -7.355 1.00 0.00 O ATOM 519 CB GLU A 95 9.247 -6.661 -8.895 1.00 0.00 C ATOM 520 CG GLU A 95 10.184 -6.787 -10.105 1.00 0.00 C ATOM 521 CD GLU A 95 10.833 -8.178 -10.181 1.00 0.00 C ATOM 522 OE1 GLU A 95 11.781 -8.378 -9.397 1.00 0.00 O ATOM 523 OE2 GLU A 95 10.371 -8.977 -11.013 1.00 0.00 O ATOM 0 H GLU A 95 11.053 -5.057 -8.582 1.00 0.00 H new ATOM 0 HA GLU A 95 8.472 -4.619 -9.268 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.690 -7.182 -8.046 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.306 -7.162 -9.121 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.623 -6.597 -11.020 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.962 -6.026 -10.043 1.00 0.00 H new ATOM 524 N GLU A 96 8.685 -5.549 -6.126 1.00 0.00 N ATOM 525 CA GLU A 96 8.090 -5.558 -4.781 1.00 0.00 C ATOM 526 C GLU A 96 7.338 -4.260 -4.431 1.00 0.00 C ATOM 527 O GLU A 96 6.326 -4.284 -3.738 1.00 0.00 O ATOM 528 CB GLU A 96 9.206 -5.754 -3.770 1.00 0.00 C ATOM 529 CG GLU A 96 9.672 -7.213 -3.804 1.00 0.00 C ATOM 530 CD GLU A 96 10.374 -7.640 -2.506 1.00 0.00 C ATOM 531 OE1 GLU A 96 11.119 -6.792 -1.957 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.169 -8.803 -2.108 1.00 0.00 O ATOM 0 H GLU A 96 9.686 -5.742 -6.108 1.00 0.00 H new ATOM 0 HA GLU A 96 7.359 -6.366 -4.757 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.039 -5.089 -3.998 1.00 0.00 H new ATOM 0 HB3 GLU A 96 8.856 -5.496 -2.771 1.00 0.00 H new ATOM 0 HG2 GLU A 96 8.813 -7.861 -3.978 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.352 -7.354 -4.644 1.00 0.00 H new ATOM 533 N CYS A 97 7.914 -3.155 -4.892 1.00 0.00 N ATOM 534 CA CYS A 97 7.377 -1.794 -4.738 1.00 0.00 C ATOM 535 C CYS A 97 6.475 -1.393 -5.913 1.00 0.00 C ATOM 536 O CYS A 97 5.792 -0.365 -5.851 1.00 0.00 O ATOM 537 CB CYS A 97 8.553 -0.836 -4.650 1.00 0.00 C ATOM 538 SG CYS A 97 8.045 0.915 -4.540 1.00 0.00 S ATOM 0 H CYS A 97 8.798 -3.175 -5.401 1.00 0.00 H new ATOM 0 HA CYS A 97 6.765 -1.757 -3.837 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.155 -1.089 -3.777 1.00 0.00 H new ATOM 0 HB3 CYS A 97 9.189 -0.969 -5.525 1.00 0.00 H new ATOM 0 HG CYS A 97 6.832 1.044 -4.989 1.00 0.00 H new ATOM 539 N LEU A 98 6.693 -2.034 -7.059 1.00 0.00 N ATOM 540 CA LEU A 98 5.905 -1.792 -8.269 1.00 0.00 C ATOM 541 C LEU A 98 4.552 -2.480 -8.212 1.00 0.00 C ATOM 542 O LEU A 98 4.423 -3.678 -7.972 1.00 0.00 O ATOM 543 CB LEU A 98 6.700 -2.105 -9.529 1.00 0.00 C ATOM 544 CG LEU A 98 6.133 -1.301 -10.708 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.184 0.180 -10.460 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.053 -1.462 -11.906 1.00 0.00 C ATOM 0 H LEU A 98 7.422 -2.738 -7.177 1.00 0.00 H new ATOM 0 HA LEU A 98 5.685 -0.725 -8.316 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.751 -1.858 -9.379 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.651 -3.172 -9.746 1.00 0.00 H new ATOM 0 HG LEU A 98 5.114 -1.661 -10.854 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.773 0.707 -11.321 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.598 0.421 -9.573 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.218 0.488 -10.306 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.657 -0.894 -12.748 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.047 -1.092 -11.654 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.116 -2.516 -12.177 1.00 0.00 H new ATOM 547 N PHE A 99 3.557 -1.607 -8.268 1.00 0.00 N ATOM 548 CA PHE A 99 2.160 -1.982 -8.079 1.00 0.00 C ATOM 549 C PHE A 99 1.176 -1.654 -9.199 1.00 0.00 C ATOM 550 O PHE A 99 0.876 -0.520 -9.530 1.00 0.00 O ATOM 551 CB PHE A 99 1.623 -1.366 -6.774 1.00 0.00 C ATOM 552 CG PHE A 99 2.108 -2.012 -5.480 1.00 0.00 C ATOM 553 CD1 PHE A 99 3.244 -1.450 -4.856 1.00 0.00 C ATOM 554 CD2 PHE A 99 1.334 -2.978 -4.800 1.00 0.00 C ATOM 555 CE1 PHE A 99 3.600 -1.824 -3.548 1.00 0.00 C ATOM 556 CE2 PHE A 99 1.680 -3.356 -3.483 1.00 0.00 C ATOM 557 CZ PHE A 99 2.813 -2.772 -2.866 1.00 0.00 C ATOM 0 H PHE A 99 3.695 -0.612 -8.447 1.00 0.00 H new ATOM 0 HA PHE A 99 2.205 -3.071 -8.059 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.896 -0.311 -6.754 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.534 -1.413 -6.794 1.00 0.00 H new ATOM 0 HD1 PHE A 99 3.844 -0.727 -5.388 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.480 -3.427 -5.285 1.00 0.00 H new ATOM 0 HE1 PHE A 99 4.467 -1.389 -3.072 1.00 0.00 H new ATOM 0 HE2 PHE A 99 1.085 -4.084 -2.951 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.077 -3.058 -1.859 1.00 0.00 H new ATOM 558 N LEU A 100 0.600 -2.734 -9.692 1.00 0.00 N ATOM 559 CA LEU A 100 -0.300 -2.738 -10.850 1.00 0.00 C ATOM 560 C LEU A 100 -1.621 -1.993 -10.615 1.00 0.00 C ATOM 561 O LEU A 100 -2.381 -2.389 -9.727 1.00 0.00 O ATOM 562 CB LEU A 100 -0.557 -4.218 -11.154 1.00 0.00 C ATOM 563 CG LEU A 100 -0.739 -4.494 -12.635 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.577 -4.254 -13.378 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.135 -5.967 -12.805 1.00 0.00 C ATOM 0 H LEU A 100 0.743 -3.662 -9.294 1.00 0.00 H new ATOM 0 HA LEU A 100 0.163 -2.205 -11.681 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.277 -4.811 -10.779 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.447 -4.545 -10.617 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.507 -3.834 -13.039 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.437 -4.455 -14.440 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.888 -3.218 -13.242 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.345 -4.918 -12.982 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.271 -6.187 -13.864 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.349 -6.604 -12.400 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.067 -6.157 -12.272 1.00 0.00 H new ATOM 566 N GLU A 101 -1.925 -0.999 -11.448 1.00 0.00 N ATOM 567 CA GLU A 101 -3.223 -0.298 -11.396 1.00 0.00 C ATOM 568 C GLU A 101 -4.385 -1.162 -11.889 1.00 0.00 C ATOM 569 O GLU A 101 -4.793 -1.183 -13.052 1.00 0.00 O ATOM 570 CB GLU A 101 -3.209 1.083 -12.068 1.00 0.00 C ATOM 571 CG GLU A 101 -2.571 2.112 -11.136 1.00 0.00 C ATOM 572 CD GLU A 101 -2.575 3.508 -11.753 1.00 0.00 C ATOM 573 OE1 GLU A 101 -1.597 3.816 -12.459 1.00 0.00 O ATOM 574 OE2 GLU A 101 -3.552 4.252 -11.485 1.00 0.00 O ATOM 0 H GLU A 101 -1.294 -0.655 -12.171 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.395 -0.111 -10.336 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.654 1.035 -13.005 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.226 1.386 -12.316 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.111 2.130 -10.189 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -1.546 1.815 -10.913 1.00 0.00 H new ATOM 575 N ARG A 102 -4.941 -1.798 -10.876 1.00 0.00 N ATOM 576 CA ARG A 102 -5.999 -2.832 -10.922 1.00 0.00 C ATOM 577 C ARG A 102 -7.407 -2.240 -10.649 1.00 0.00 C ATOM 578 O ARG A 102 -8.416 -2.950 -10.713 1.00 0.00 O ATOM 579 CB ARG A 102 -5.469 -3.779 -9.840 1.00 0.00 C ATOM 580 CG ARG A 102 -6.250 -5.009 -9.402 1.00 0.00 C ATOM 581 CD ARG A 102 -6.559 -6.040 -10.490 1.00 0.00 C ATOM 582 NE ARG A 102 -7.656 -5.596 -11.360 1.00 0.00 N ATOM 583 CZ ARG A 102 -8.406 -6.347 -12.154 1.00 0.00 C ATOM 584 NH1 ARG A 102 -8.235 -7.664 -12.243 1.00 0.00 N ATOM 585 NH2 ARG A 102 -9.361 -5.772 -12.865 1.00 0.00 N ATOM 0 H ARG A 102 -4.654 -1.602 -9.917 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.160 -3.319 -11.884 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.493 -4.128 -10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.302 -3.176 -8.947 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -5.690 -5.505 -8.610 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.193 -4.678 -8.967 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.666 -6.215 -11.090 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.823 -6.991 -10.027 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.864 -4.597 -11.352 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -7.510 -8.123 -11.691 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -8.829 -8.215 -12.863 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -9.511 -4.765 -12.797 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.947 -6.335 -13.481 1.00 0.00 H new ATOM 586 N LEU A 103 -7.393 -0.989 -10.216 1.00 0.00 N ATOM 587 CA LEU A 103 -8.515 -0.044 -10.021 1.00 0.00 C ATOM 588 C LEU A 103 -9.969 -0.547 -10.059 1.00 0.00 C ATOM 589 O LEU A 103 -10.427 -1.098 -11.062 1.00 0.00 O ATOM 590 CB LEU A 103 -8.346 1.086 -11.042 1.00 0.00 C ATOM 591 CG LEU A 103 -7.662 2.348 -10.488 1.00 0.00 C ATOM 592 CD1 LEU A 103 -8.614 3.059 -9.529 1.00 0.00 C ATOM 593 CD2 LEU A 103 -6.286 2.071 -9.868 1.00 0.00 C ATOM 0 H LEU A 103 -6.508 -0.551 -9.962 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.418 0.246 -8.975 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.764 0.713 -11.885 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -9.328 1.360 -11.428 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.449 3.014 -11.324 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -8.132 3.954 -9.135 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.523 3.341 -10.061 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.868 2.391 -8.706 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -5.860 3.003 -9.497 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -6.394 1.368 -9.042 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -5.626 1.645 -10.623 1.00 0.00 H new ATOM 594 N GLU A 104 -10.728 -0.034 -9.095 1.00 0.00 N ATOM 595 CA GLU A 104 -12.199 -0.200 -9.027 1.00 0.00 C ATOM 596 C GLU A 104 -12.977 0.733 -9.973 1.00 0.00 C ATOM 597 O GLU A 104 -14.198 0.906 -9.844 1.00 0.00 O ATOM 598 CB GLU A 104 -12.660 0.079 -7.591 1.00 0.00 C ATOM 599 CG GLU A 104 -12.252 -1.014 -6.599 1.00 0.00 C ATOM 600 CD GLU A 104 -13.100 -2.290 -6.623 1.00 0.00 C ATOM 601 OE1 GLU A 104 -13.696 -2.626 -7.672 1.00 0.00 O ATOM 602 OE2 GLU A 104 -13.163 -2.925 -5.548 1.00 0.00 O ATOM 0 H GLU A 104 -10.347 0.516 -8.325 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.411 -1.222 -9.340 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.244 1.031 -7.262 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.745 0.184 -7.579 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.215 -1.286 -6.795 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.287 -0.596 -5.593 1.00 0.00 H new ATOM 603 N GLU A 105 -12.288 1.147 -11.035 1.00 0.00 N ATOM 604 CA GLU A 105 -12.642 2.246 -11.963 1.00 0.00 C ATOM 605 C GLU A 105 -12.845 3.609 -11.288 1.00 0.00 C ATOM 606 O GLU A 105 -12.322 4.614 -11.764 1.00 0.00 O ATOM 607 CB GLU A 105 -13.824 1.808 -12.853 1.00 0.00 C ATOM 608 CG GLU A 105 -13.914 2.554 -14.198 1.00 0.00 C ATOM 609 CD GLU A 105 -14.468 3.970 -14.104 1.00 0.00 C ATOM 610 OE1 GLU A 105 -15.577 4.121 -13.541 1.00 0.00 O ATOM 611 OE2 GLU A 105 -13.805 4.875 -14.667 1.00 0.00 O ATOM 0 H GLU A 105 -11.408 0.702 -11.297 1.00 0.00 H new ATOM 0 HA GLU A 105 -11.779 2.426 -12.604 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -13.740 0.739 -13.048 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -14.753 1.960 -12.304 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -12.919 2.596 -14.642 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -14.542 1.977 -14.877 1.00 0.00 H new ATOM 612 N ASN A 106 -13.609 3.597 -10.209 1.00 0.00 N ATOM 613 CA ASN A 106 -13.639 4.678 -9.213 1.00 0.00 C ATOM 614 C ASN A 106 -12.257 4.758 -8.522 1.00 0.00 C ATOM 615 O ASN A 106 -11.519 3.765 -8.533 1.00 0.00 O ATOM 616 CB ASN A 106 -14.726 4.278 -8.217 1.00 0.00 C ATOM 617 CG ASN A 106 -15.405 5.521 -7.632 1.00 0.00 C ATOM 618 OD1 ASN A 106 -14.789 6.398 -7.050 1.00 0.00 O ATOM 619 ND2 ASN A 106 -16.694 5.654 -7.854 1.00 0.00 N ATOM 0 H ASN A 106 -14.240 2.827 -9.988 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.848 5.655 -9.648 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.467 3.651 -8.712 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -14.290 3.683 -7.414 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -17.182 6.493 -7.539 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.206 4.919 -8.341 1.00 0.00 H new ATOM 620 N HIS A 107 -12.122 5.751 -7.658 1.00 0.00 N ATOM 621 CA HIS A 107 -10.853 6.200 -7.025 1.00 0.00 C ATOM 622 C HIS A 107 -10.336 5.301 -5.891 1.00 0.00 C ATOM 623 O HIS A 107 -9.399 5.649 -5.172 1.00 0.00 O ATOM 624 CB HIS A 107 -11.020 7.640 -6.526 1.00 0.00 C ATOM 625 CG HIS A 107 -11.626 8.576 -7.569 1.00 0.00 C ATOM 626 ND1 HIS A 107 -12.932 8.673 -7.841 1.00 0.00 N ATOM 627 CD2 HIS A 107 -10.983 9.369 -8.411 1.00 0.00 C ATOM 628 CE1 HIS A 107 -13.090 9.501 -8.864 1.00 0.00 C ATOM 629 NE2 HIS A 107 -11.885 9.947 -9.207 1.00 0.00 N ATOM 0 H HIS A 107 -12.922 6.305 -7.352 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.091 6.136 -7.802 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.653 7.638 -5.639 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -10.047 8.027 -6.223 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -13.681 8.191 -7.344 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -9.914 9.522 -8.448 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.026 9.765 -9.333 1.00 0.00 H new ATOM 630 N TYR A 108 -10.753 4.039 -5.967 1.00 0.00 N ATOM 631 CA TYR A 108 -10.413 2.957 -5.036 1.00 0.00 C ATOM 632 C TYR A 108 -9.368 2.067 -5.713 1.00 0.00 C ATOM 633 O TYR A 108 -9.645 1.211 -6.552 1.00 0.00 O ATOM 634 CB TYR A 108 -11.676 2.162 -4.660 1.00 0.00 C ATOM 635 CG TYR A 108 -12.765 3.036 -4.036 1.00 0.00 C ATOM 636 CD1 TYR A 108 -12.667 3.378 -2.678 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.754 3.581 -4.877 1.00 0.00 C ATOM 638 CE1 TYR A 108 -13.569 4.323 -2.150 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.644 4.530 -4.357 1.00 0.00 C ATOM 640 CZ TYR A 108 -14.532 4.900 -3.005 1.00 0.00 C ATOM 641 OH TYR A 108 -15.354 5.864 -2.522 1.00 0.00 O ATOM 0 H TYR A 108 -11.369 3.724 -6.717 1.00 0.00 H new ATOM 0 HA TYR A 108 -10.002 3.358 -4.110 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.073 1.677 -5.552 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -11.406 1.371 -3.960 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -11.914 2.925 -2.050 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -13.826 3.272 -5.909 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -13.524 4.601 -1.107 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.404 4.971 -4.985 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.960 6.163 -3.232 1.00 0.00 H new ATOM 642 N ASN A 109 -8.164 2.590 -5.563 1.00 0.00 N ATOM 643 CA ASN A 109 -6.911 2.082 -6.131 1.00 0.00 C ATOM 644 C ASN A 109 -6.496 0.763 -5.492 1.00 0.00 C ATOM 645 O ASN A 109 -6.097 0.711 -4.333 1.00 0.00 O ATOM 646 CB ASN A 109 -5.859 3.165 -5.926 1.00 0.00 C ATOM 647 CG ASN A 109 -5.940 4.328 -6.914 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.162 4.433 -7.851 1.00 0.00 O ATOM 649 ND2 ASN A 109 -6.818 5.272 -6.661 1.00 0.00 N ATOM 0 H ASN A 109 -8.018 3.433 -5.008 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.033 1.866 -7.192 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -5.954 3.558 -4.914 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -4.871 2.711 -6.000 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.856 6.104 -7.249 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.462 5.173 -5.876 1.00 0.00 H new ATOM 650 N THR A 110 -6.853 -0.294 -6.205 1.00 0.00 N ATOM 651 CA THR A 110 -6.431 -1.669 -5.921 1.00 0.00 C ATOM 652 C THR A 110 -5.204 -1.921 -6.807 1.00 0.00 C ATOM 653 O THR A 110 -5.141 -1.471 -7.948 1.00 0.00 O ATOM 654 CB THR A 110 -7.587 -2.621 -6.272 1.00 0.00 C ATOM 655 OG1 THR A 110 -8.116 -2.251 -7.545 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.672 -2.594 -5.192 1.00 0.00 C ATOM 0 H THR A 110 -7.461 -0.224 -7.021 1.00 0.00 H new ATOM 0 HA THR A 110 -6.180 -1.831 -4.873 1.00 0.00 H new ATOM 0 HB THR A 110 -7.213 -3.644 -6.320 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.704 -2.963 -7.874 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.476 -3.276 -5.467 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.244 -2.903 -4.238 1.00 0.00 H new ATOM 0 HG23 THR A 110 -9.069 -1.583 -5.101 1.00 0.00 H new ATOM 657 N TYR A 111 -4.228 -2.594 -6.207 1.00 0.00 N ATOM 658 CA TYR A 111 -2.880 -2.736 -6.800 1.00 0.00 C ATOM 659 C TYR A 111 -2.282 -4.115 -6.501 1.00 0.00 C ATOM 660 O TYR A 111 -2.218 -4.495 -5.330 1.00 0.00 O ATOM 661 CB TYR A 111 -1.889 -1.710 -6.238 1.00 0.00 C ATOM 662 CG TYR A 111 -2.236 -0.227 -6.399 1.00 0.00 C ATOM 663 CD1 TYR A 111 -2.737 0.261 -7.623 1.00 0.00 C ATOM 664 CD2 TYR A 111 -1.918 0.644 -5.330 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.947 1.638 -7.780 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.101 2.032 -5.495 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.610 2.508 -6.722 1.00 0.00 C ATOM 668 OH TYR A 111 -2.638 3.834 -6.962 1.00 0.00 O ATOM 0 H TYR A 111 -4.335 -3.057 -5.304 1.00 0.00 H new ATOM 0 HA TYR A 111 -3.020 -2.586 -7.871 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.763 -1.912 -5.174 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.922 -1.882 -6.712 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -2.957 -0.420 -8.432 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -1.539 0.250 -4.398 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -3.361 2.027 -8.698 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -1.856 2.718 -4.698 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.488 4.071 -7.388 1.00 0.00 H new ATOM 669 N ILE A 112 -1.771 -4.769 -7.540 1.00 0.00 N ATOM 670 CA ILE A 112 -1.002 -6.022 -7.397 1.00 0.00 C ATOM 671 C ILE A 112 0.485 -5.661 -7.314 1.00 0.00 C ATOM 672 O ILE A 112 1.027 -5.034 -8.227 1.00 0.00 O ATOM 673 CB ILE A 112 -1.189 -6.986 -8.587 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.659 -7.300 -8.909 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.384 -8.294 -8.457 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.462 -7.953 -7.784 1.00 0.00 C ATOM 0 H ILE A 112 -1.872 -4.455 -8.505 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.364 -6.527 -6.501 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.781 -6.428 -9.430 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.155 -6.372 -9.193 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.689 -7.956 -9.779 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.566 -8.921 -9.330 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.679 -8.062 -8.392 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.695 -8.825 -7.558 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.483 -8.129 -8.121 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -3.001 -8.902 -7.512 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.475 -7.294 -6.916 1.00 0.00 H new ATOM 677 N SER A 113 1.147 -6.242 -6.317 1.00 0.00 N ATOM 678 CA SER A 113 2.622 -6.178 -6.225 1.00 0.00 C ATOM 679 C SER A 113 3.211 -7.041 -7.345 1.00 0.00 C ATOM 680 O SER A 113 2.948 -8.238 -7.406 1.00 0.00 O ATOM 681 CB SER A 113 3.108 -6.700 -4.867 1.00 0.00 C ATOM 682 OG SER A 113 4.537 -6.690 -4.812 1.00 0.00 O ATOM 0 H SER A 113 0.699 -6.761 -5.562 1.00 0.00 H new ATOM 0 HA SER A 113 2.946 -5.142 -6.326 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.702 -6.082 -4.066 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.739 -7.713 -4.706 1.00 0.00 H new ATOM 0 HG SER A 113 4.849 -7.441 -4.265 1.00 0.00 H new ATOM 683 N LYS A 114 3.900 -6.379 -8.278 1.00 0.00 N ATOM 684 CA LYS A 114 4.484 -7.002 -9.486 1.00 0.00 C ATOM 685 C LYS A 114 5.204 -8.329 -9.234 1.00 0.00 C ATOM 686 O LYS A 114 4.956 -9.317 -9.930 1.00 0.00 O ATOM 687 CB LYS A 114 5.470 -6.069 -10.200 1.00 0.00 C ATOM 688 CG LYS A 114 4.760 -4.898 -10.870 1.00 0.00 C ATOM 689 CD LYS A 114 3.799 -5.364 -11.962 1.00 0.00 C ATOM 690 CE LYS A 114 4.450 -5.281 -13.333 1.00 0.00 C ATOM 691 NZ LYS A 114 3.579 -6.027 -14.252 1.00 0.00 N ATOM 0 H LYS A 114 4.075 -5.376 -8.221 1.00 0.00 H new ATOM 0 HA LYS A 114 3.613 -7.199 -10.111 1.00 0.00 H new ATOM 0 HB2 LYS A 114 6.197 -5.690 -9.481 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.026 -6.633 -10.949 1.00 0.00 H new ATOM 0 HG2 LYS A 114 4.209 -4.330 -10.120 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.500 -4.223 -11.301 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.489 -6.390 -11.765 1.00 0.00 H new ATOM 0 HD3 LYS A 114 2.899 -4.750 -11.945 1.00 0.00 H new ATOM 0 HE2 LYS A 114 4.553 -4.244 -13.652 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.452 -5.710 -13.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 4.134 -6.759 -14.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 2.810 -6.476 -13.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.175 -5.375 -14.954 1.00 0.00 H new ATOM 692 N LYS A 115 6.016 -8.343 -8.175 1.00 0.00 N ATOM 693 CA LYS A 115 6.693 -9.574 -7.746 1.00 0.00 C ATOM 694 C LYS A 115 5.651 -10.637 -7.344 1.00 0.00 C ATOM 695 O LYS A 115 5.573 -11.720 -7.937 1.00 0.00 O ATOM 696 CB LYS A 115 7.667 -9.293 -6.591 1.00 0.00 C ATOM 697 CG LYS A 115 8.303 -10.640 -6.216 1.00 0.00 C ATOM 698 CD LYS A 115 8.626 -10.791 -4.737 1.00 0.00 C ATOM 699 CE LYS A 115 8.630 -12.287 -4.430 1.00 0.00 C ATOM 700 NZ LYS A 115 9.796 -12.965 -5.027 1.00 0.00 N ATOM 0 H LYS A 115 6.221 -7.525 -7.601 1.00 0.00 H new ATOM 0 HA LYS A 115 7.277 -9.959 -8.582 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.430 -8.575 -6.893 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.143 -8.861 -5.738 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.627 -11.442 -6.512 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.220 -10.768 -6.791 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.595 -10.348 -4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.886 -10.274 -4.126 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.636 -12.437 -3.350 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.713 -12.738 -4.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.791 -13.969 -4.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.750 -12.887 -6.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.670 -12.518 -4.685 1.00 0.00 H new ATOM 701 N HIS A 116 4.816 -10.277 -6.375 1.00 0.00 N ATOM 702 CA HIS A 116 3.768 -11.137 -5.799 1.00 0.00 C ATOM 703 C HIS A 116 2.538 -11.351 -6.707 1.00 0.00 C ATOM 704 O HIS A 116 1.524 -11.850 -6.240 1.00 0.00 O ATOM 705 CB HIS A 116 3.369 -10.522 -4.455 1.00 0.00 C ATOM 706 CG HIS A 116 4.566 -10.334 -3.529 1.00 0.00 C ATOM 707 ND1 HIS A 116 4.971 -9.170 -3.036 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.381 -11.277 -3.086 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.048 -9.399 -2.285 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.300 -10.699 -2.320 1.00 0.00 N ATOM 0 H HIS A 116 4.844 -9.350 -5.950 1.00 0.00 H new ATOM 0 HA HIS A 116 4.178 -12.140 -5.679 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.890 -9.558 -4.627 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.633 -11.162 -3.969 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.312 -12.332 -3.308 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.615 -8.656 -1.744 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.066 -11.174 -1.842 1.00 0.00 H new ATOM 711 N ALA A 117 2.738 -11.198 -8.020 1.00 0.00 N ATOM 712 CA ALA A 117 1.740 -11.541 -9.050 1.00 0.00 C ATOM 713 C ALA A 117 1.344 -13.021 -8.969 1.00 0.00 C ATOM 714 O ALA A 117 0.158 -13.338 -8.947 1.00 0.00 O ATOM 715 CB ALA A 117 2.312 -11.230 -10.432 1.00 0.00 C ATOM 0 H ALA A 117 3.606 -10.828 -8.407 1.00 0.00 H new ATOM 0 HA ALA A 117 0.844 -10.944 -8.877 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.576 -11.483 -11.196 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.552 -10.169 -10.496 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.217 -11.817 -10.592 1.00 0.00 H new ATOM 716 N GLU A 118 2.327 -13.842 -8.591 1.00 0.00 N ATOM 717 CA GLU A 118 2.164 -15.297 -8.393 1.00 0.00 C ATOM 718 C GLU A 118 1.400 -15.721 -7.107 1.00 0.00 C ATOM 719 O GLU A 118 1.219 -16.914 -6.849 1.00 0.00 O ATOM 720 CB GLU A 118 3.514 -16.002 -8.524 1.00 0.00 C ATOM 721 CG GLU A 118 4.606 -15.359 -7.669 1.00 0.00 C ATOM 722 CD GLU A 118 5.954 -16.059 -7.813 1.00 0.00 C ATOM 723 OE1 GLU A 118 6.630 -15.782 -8.827 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.312 -16.802 -6.875 1.00 0.00 O ATOM 0 H GLU A 118 3.276 -13.516 -8.409 1.00 0.00 H new ATOM 0 HA GLU A 118 1.502 -15.628 -9.194 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.402 -17.047 -8.236 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.824 -15.991 -9.569 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.713 -14.312 -7.951 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.301 -15.378 -6.623 1.00 0.00 H new ATOM 725 N LYS A 119 1.127 -14.735 -6.270 1.00 0.00 N ATOM 726 CA LYS A 119 0.278 -14.857 -5.058 1.00 0.00 C ATOM 727 C LYS A 119 -0.940 -13.925 -5.082 1.00 0.00 C ATOM 728 O LYS A 119 -1.739 -13.946 -4.139 1.00 0.00 O ATOM 729 CB LYS A 119 1.163 -14.537 -3.849 1.00 0.00 C ATOM 730 CG LYS A 119 1.956 -15.765 -3.407 1.00 0.00 C ATOM 731 CD LYS A 119 3.369 -15.369 -2.981 1.00 0.00 C ATOM 732 CE LYS A 119 4.189 -14.959 -4.198 1.00 0.00 C ATOM 733 NZ LYS A 119 5.489 -14.436 -3.749 1.00 0.00 N ATOM 0 H LYS A 119 1.492 -13.792 -6.403 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.122 -15.870 -5.010 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.849 -13.728 -4.101 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.544 -14.184 -3.024 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.445 -16.256 -2.579 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.005 -16.486 -4.223 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.325 -14.545 -2.269 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.851 -16.204 -2.473 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.335 -15.814 -4.858 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.657 -14.201 -4.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.789 -13.665 -4.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.401 -14.075 -2.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.197 -15.198 -3.772 1.00 0.00 H new ATOM 734 N ASN A 120 -1.056 -13.107 -6.140 1.00 0.00 N ATOM 735 CA ASN A 120 -2.101 -12.084 -6.357 1.00 0.00 C ATOM 736 C ASN A 120 -2.162 -10.956 -5.322 1.00 0.00 C ATOM 737 O ASN A 120 -3.029 -10.094 -5.442 1.00 0.00 O ATOM 738 CB ASN A 120 -3.474 -12.774 -6.437 1.00 0.00 C ATOM 739 CG ASN A 120 -3.593 -13.690 -7.650 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.636 -14.907 -7.594 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.698 -13.073 -8.812 1.00 0.00 N ATOM 0 H ASN A 120 -0.389 -13.140 -6.911 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.828 -11.594 -7.291 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.640 -13.354 -5.529 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.257 -12.017 -6.479 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.816 -13.615 -9.668 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.661 -12.055 -8.854 1.00 0.00 H new ATOM 742 N TRP A 121 -1.108 -10.819 -4.523 1.00 0.00 N ATOM 743 CA TRP A 121 -1.133 -9.900 -3.368 1.00 0.00 C ATOM 744 C TRP A 121 -1.364 -8.430 -3.709 1.00 0.00 C ATOM 745 O TRP A 121 -0.541 -7.753 -4.335 1.00 0.00 O ATOM 746 CB TRP A 121 0.082 -9.989 -2.447 1.00 0.00 C ATOM 747 CG TRP A 121 0.236 -11.355 -1.775 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.708 -12.282 -1.636 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.388 -11.802 -1.162 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.192 -13.328 -0.991 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.071 -13.071 -0.641 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.656 -11.237 -0.945 1.00 0.00 C ATOM 753 CZ2 TRP A 121 2.000 -13.779 0.138 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.602 -11.957 -0.197 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.265 -13.205 0.366 1.00 0.00 C ATOM 0 H TRP A 121 -0.230 -11.323 -4.644 1.00 0.00 H new ATOM 0 HA TRP A 121 -2.008 -10.273 -2.835 1.00 0.00 H new ATOM 0 HB2 TRP A 121 0.982 -9.772 -3.023 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.003 -9.221 -1.678 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.726 -12.200 -1.988 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.689 -14.197 -0.794 1.00 0.00 H new ATOM 0 HE3 TRP A 121 2.899 -10.265 -1.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.749 -14.744 0.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.593 -11.553 -0.052 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.985 -13.726 0.979 1.00 0.00 H new ATOM 756 N PHE A 122 -2.540 -8.022 -3.263 1.00 0.00 N ATOM 757 CA PHE A 122 -2.914 -6.607 -3.270 1.00 0.00 C ATOM 758 C PHE A 122 -2.422 -5.961 -1.988 1.00 0.00 C ATOM 759 O PHE A 122 -2.430 -6.566 -0.910 1.00 0.00 O ATOM 760 CB PHE A 122 -4.429 -6.420 -3.309 1.00 0.00 C ATOM 761 CG PHE A 122 -5.141 -6.979 -4.534 1.00 0.00 C ATOM 762 CD1 PHE A 122 -5.341 -8.366 -4.649 1.00 0.00 C ATOM 763 CD2 PHE A 122 -5.761 -6.084 -5.429 1.00 0.00 C ATOM 764 CE1 PHE A 122 -6.168 -8.884 -5.670 1.00 0.00 C ATOM 765 CE2 PHE A 122 -6.615 -6.596 -6.434 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.796 -7.984 -6.561 1.00 0.00 C ATOM 0 H PHE A 122 -3.256 -8.646 -2.890 1.00 0.00 H new ATOM 0 HA PHE A 122 -2.470 -6.156 -4.157 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.855 -6.887 -2.421 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.645 -5.354 -3.243 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.860 -9.038 -3.954 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -5.586 -5.021 -5.349 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.318 -9.949 -5.768 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -7.128 -5.921 -7.103 1.00 0.00 H new ATOM 0 HZ PHE A 122 -7.424 -8.369 -7.351 1.00 0.00 H new ATOM 767 N VAL A 123 -2.004 -4.721 -2.153 1.00 0.00 N ATOM 768 CA VAL A 123 -1.816 -3.790 -1.037 1.00 0.00 C ATOM 769 C VAL A 123 -3.152 -3.675 -0.280 1.00 0.00 C ATOM 770 O VAL A 123 -4.212 -3.654 -0.901 1.00 0.00 O ATOM 771 CB VAL A 123 -1.290 -2.439 -1.584 1.00 0.00 C ATOM 772 CG1 VAL A 123 -2.042 -1.932 -2.819 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.300 -1.315 -0.567 1.00 0.00 C ATOM 0 H VAL A 123 -1.782 -4.321 -3.065 1.00 0.00 H new ATOM 0 HA VAL A 123 -1.068 -4.145 -0.327 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.262 -2.685 -1.852 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -1.615 -0.982 -3.141 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -1.953 -2.661 -3.624 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -3.094 -1.791 -2.572 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.917 -0.404 -1.028 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -2.320 -1.146 -0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.670 -1.585 0.280 1.00 0.00 H new ATOM 774 N GLY A 124 -3.041 -3.702 1.038 1.00 0.00 N ATOM 775 CA GLY A 124 -4.213 -3.774 1.924 1.00 0.00 C ATOM 776 C GLY A 124 -3.927 -3.295 3.336 1.00 0.00 C ATOM 777 O GLY A 124 -2.782 -3.174 3.775 1.00 0.00 O ATOM 0 H GLY A 124 -2.148 -3.675 1.530 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -5.018 -3.174 1.500 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.569 -4.804 1.962 1.00 0.00 H new ATOM 778 N LEU A 125 -4.997 -2.686 3.813 1.00 0.00 N ATOM 779 CA LEU A 125 -5.054 -2.116 5.158 1.00 0.00 C ATOM 780 C LEU A 125 -5.689 -3.063 6.153 1.00 0.00 C ATOM 781 O LEU A 125 -6.858 -3.454 6.080 1.00 0.00 O ATOM 782 CB LEU A 125 -5.686 -0.725 5.062 1.00 0.00 C ATOM 783 CG LEU A 125 -4.577 0.321 5.158 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.358 0.061 4.293 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.118 1.715 4.855 1.00 0.00 C ATOM 0 H LEU A 125 -5.859 -2.569 3.280 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.053 -1.981 5.568 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -6.226 -0.619 4.121 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.411 -0.583 5.863 1.00 0.00 H new ATOM 0 HG LEU A 125 -4.233 0.250 6.190 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.633 0.862 4.436 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.908 -0.891 4.575 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.656 0.025 3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.310 2.443 4.930 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.531 1.734 3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.900 1.966 5.572 1.00 0.00 H new ATOM 786 N LYS A 126 -4.757 -3.626 6.911 1.00 0.00 N ATOM 787 CA LYS A 126 -5.053 -4.658 7.899 1.00 0.00 C ATOM 788 C LYS A 126 -6.000 -4.078 8.968 1.00 0.00 C ATOM 789 O LYS A 126 -5.703 -3.045 9.566 1.00 0.00 O ATOM 790 CB LYS A 126 -3.744 -5.107 8.539 1.00 0.00 C ATOM 791 CG LYS A 126 -3.862 -6.447 9.260 1.00 0.00 C ATOM 792 CD LYS A 126 -2.968 -6.488 10.501 1.00 0.00 C ATOM 793 CE LYS A 126 -3.319 -5.383 11.492 1.00 0.00 C ATOM 794 NZ LYS A 126 -2.635 -5.659 12.768 1.00 0.00 N ATOM 0 H LYS A 126 -3.769 -3.379 6.858 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.537 -5.513 7.427 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.976 -5.181 7.769 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.413 -4.347 9.247 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -4.899 -6.617 9.550 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -3.584 -7.254 8.582 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -3.068 -7.458 10.988 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -1.925 -6.388 10.200 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.012 -4.413 11.101 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -4.398 -5.339 11.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -2.754 -4.848 13.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.046 -6.509 13.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -1.622 -5.815 12.592 1.00 0.00 H new ATOM 795 N LYS A 127 -7.023 -4.868 9.290 1.00 0.00 N ATOM 796 CA LYS A 127 -8.219 -4.406 10.038 1.00 0.00 C ATOM 797 C LYS A 127 -8.093 -4.176 11.571 1.00 0.00 C ATOM 798 O LYS A 127 -9.027 -4.405 12.331 1.00 0.00 O ATOM 799 CB LYS A 127 -9.374 -5.360 9.725 1.00 0.00 C ATOM 800 CG LYS A 127 -10.006 -5.153 8.343 1.00 0.00 C ATOM 801 CD LYS A 127 -10.854 -3.874 8.301 1.00 0.00 C ATOM 802 CE LYS A 127 -11.822 -3.893 7.117 1.00 0.00 C ATOM 803 NZ LYS A 127 -11.115 -3.899 5.832 1.00 0.00 N ATOM 0 H LYS A 127 -7.057 -5.857 9.043 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.389 -3.391 9.680 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.012 -6.386 9.796 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.145 -5.240 10.486 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.222 -5.097 7.588 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.628 -6.012 8.093 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.414 -3.775 9.231 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.202 -3.004 8.227 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -12.460 -4.774 7.184 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -12.475 -3.022 7.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.494 -3.146 5.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -10.101 -3.736 5.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.248 -4.820 5.367 1.00 0.00 H new ATOM 804 N ASN A 128 -6.959 -3.612 11.972 1.00 0.00 N ATOM 805 CA ASN A 128 -6.676 -3.280 13.380 1.00 0.00 C ATOM 806 C ASN A 128 -6.118 -1.855 13.504 1.00 0.00 C ATOM 807 O ASN A 128 -6.835 -0.937 13.890 1.00 0.00 O ATOM 808 CB ASN A 128 -5.695 -4.307 13.962 1.00 0.00 C ATOM 809 CG ASN A 128 -6.255 -5.701 14.274 1.00 0.00 C ATOM 810 OD1 ASN A 128 -5.542 -6.693 14.229 1.00 0.00 O ATOM 811 ND2 ASN A 128 -7.524 -5.819 14.619 1.00 0.00 N ATOM 0 H ASN A 128 -6.202 -3.368 11.334 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.606 -3.319 13.948 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -4.869 -4.422 13.261 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.278 -3.895 14.881 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -7.907 -6.736 14.847 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.121 -4.993 14.657 1.00 0.00 H new ATOM 812 N GLY A 129 -4.834 -1.725 13.207 1.00 0.00 N ATOM 813 CA GLY A 129 -4.131 -0.432 13.154 1.00 0.00 C ATOM 814 C GLY A 129 -2.766 -0.496 12.458 1.00 0.00 C ATOM 815 O GLY A 129 -1.843 0.203 12.841 1.00 0.00 O ATOM 0 H GLY A 129 -4.233 -2.521 12.991 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.759 0.291 12.634 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.993 -0.062 14.170 1.00 0.00 H new ATOM 816 N SER A 130 -2.690 -1.368 11.453 1.00 0.00 N ATOM 817 CA SER A 130 -1.461 -1.576 10.661 1.00 0.00 C ATOM 818 C SER A 130 -1.825 -1.924 9.199 1.00 0.00 C ATOM 819 O SER A 130 -3.008 -1.993 8.864 1.00 0.00 O ATOM 820 CB SER A 130 -0.596 -2.667 11.291 1.00 0.00 C ATOM 821 OG SER A 130 0.661 -2.741 10.617 1.00 0.00 O ATOM 0 H SER A 130 -3.472 -1.953 11.159 1.00 0.00 H new ATOM 0 HA SER A 130 -0.881 -0.653 10.657 1.00 0.00 H new ATOM 0 HB2 SER A 130 -0.439 -2.454 12.348 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.107 -3.628 11.232 1.00 0.00 H new ATOM 0 HG SER A 130 1.316 -3.188 11.194 1.00 0.00 H new ATOM 822 N CYS A 131 -0.828 -1.945 8.321 1.00 0.00 N ATOM 823 CA CYS A 131 -1.068 -2.306 6.909 1.00 0.00 C ATOM 824 C CYS A 131 -0.842 -3.794 6.627 1.00 0.00 C ATOM 825 O CYS A 131 -1.751 -4.452 6.158 1.00 0.00 O ATOM 826 CB CYS A 131 -0.169 -1.549 5.933 1.00 0.00 C ATOM 827 SG CYS A 131 -0.317 0.278 5.912 1.00 0.00 S ATOM 0 H CYS A 131 0.142 -1.722 8.546 1.00 0.00 H new ATOM 0 HA CYS A 131 -2.113 -2.036 6.754 1.00 0.00 H new ATOM 0 HB2 CYS A 131 0.867 -1.802 6.160 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -0.374 -1.917 4.928 1.00 0.00 H new ATOM 0 HG CYS A 131 -1.458 0.627 6.429 1.00 0.00 H new ATOM 828 N LYS A 132 0.228 -4.332 7.203 1.00 0.00 N ATOM 829 CA LYS A 132 0.872 -5.550 6.680 1.00 0.00 C ATOM 830 C LYS A 132 0.115 -6.879 6.805 1.00 0.00 C ATOM 831 O LYS A 132 -0.455 -7.186 7.850 1.00 0.00 O ATOM 832 CB LYS A 132 2.324 -5.616 7.208 1.00 0.00 C ATOM 833 CG LYS A 132 2.592 -6.280 8.571 1.00 0.00 C ATOM 834 CD LYS A 132 2.120 -5.516 9.816 1.00 0.00 C ATOM 835 CE LYS A 132 0.917 -6.193 10.506 1.00 0.00 C ATOM 836 NZ LYS A 132 1.196 -7.598 10.842 1.00 0.00 N ATOM 0 H LYS A 132 0.675 -3.948 8.036 1.00 0.00 H new ATOM 0 HA LYS A 132 0.860 -5.435 5.596 1.00 0.00 H new ATOM 0 HB2 LYS A 132 2.922 -6.141 6.463 1.00 0.00 H new ATOM 0 HB3 LYS A 132 2.703 -4.595 7.259 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.114 -7.260 8.572 1.00 0.00 H new ATOM 0 HG3 LYS A 132 3.665 -6.449 8.662 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.945 -5.439 10.525 1.00 0.00 H new ATOM 0 HD3 LYS A 132 1.847 -4.500 9.532 1.00 0.00 H new ATOM 0 HE2 LYS A 132 0.664 -5.646 11.414 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.047 -6.142 9.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 0.683 -7.856 11.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 0.885 -8.210 10.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.217 -7.722 10.994 1.00 0.00 H new ATOM 837 N ARG A 133 -0.063 -7.512 5.644 1.00 0.00 N ATOM 838 CA ARG A 133 -0.684 -8.856 5.579 1.00 0.00 C ATOM 839 C ARG A 133 -0.261 -9.803 4.446 1.00 0.00 C ATOM 840 O ARG A 133 0.393 -10.798 4.749 1.00 0.00 O ATOM 841 CB ARG A 133 -2.227 -8.810 5.736 1.00 0.00 C ATOM 842 CG ARG A 133 -3.013 -8.265 4.545 1.00 0.00 C ATOM 843 CD ARG A 133 -2.870 -6.761 4.316 1.00 0.00 C ATOM 844 NE ARG A 133 -2.279 -6.652 2.973 1.00 0.00 N ATOM 845 CZ ARG A 133 -1.070 -6.181 2.693 1.00 0.00 C ATOM 846 NH1 ARG A 133 -0.314 -5.599 3.597 1.00 0.00 N ATOM 847 NH2 ARG A 133 -0.606 -6.279 1.459 1.00 0.00 N ATOM 0 H ARG A 133 0.208 -7.128 4.739 1.00 0.00 H new ATOM 0 HA ARG A 133 -0.240 -9.329 6.455 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -2.580 -9.820 5.945 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.464 -8.202 6.609 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -2.690 -8.788 3.645 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -4.068 -8.498 4.687 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -3.835 -6.257 4.368 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -2.230 -6.303 5.070 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.849 -6.966 2.188 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.651 -5.496 4.554 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.610 -5.250 3.341 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -1.176 -6.713 0.733 1.00 0.00 H new ATOM 0 HH22 ARG A 133 0.322 -5.920 1.233 1.00 0.00 H new ATOM 848 N GLY A 134 -0.558 -9.452 3.196 1.00 0.00 N ATOM 849 CA GLY A 134 -0.309 -10.294 1.996 1.00 0.00 C ATOM 850 C GLY A 134 -1.404 -11.351 1.708 1.00 0.00 C ATOM 851 O GLY A 134 -2.428 -10.970 1.140 1.00 0.00 O ATOM 0 H GLY A 134 -0.989 -8.556 2.969 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.213 -9.644 1.126 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.646 -10.805 2.119 1.00 0.00 H new ATOM 852 N PRO A 135 -1.237 -12.631 2.104 1.00 0.00 N ATOM 853 CA PRO A 135 -2.121 -13.749 1.695 1.00 0.00 C ATOM 854 C PRO A 135 -3.494 -13.849 2.397 1.00 0.00 C ATOM 855 O PRO A 135 -4.059 -14.927 2.604 1.00 0.00 O ATOM 856 CB PRO A 135 -1.235 -14.979 1.881 1.00 0.00 C ATOM 857 CG PRO A 135 -0.441 -14.636 3.138 1.00 0.00 C ATOM 858 CD PRO A 135 -0.120 -13.157 2.931 1.00 0.00 C ATOM 0 HA PRO A 135 -2.467 -13.609 0.671 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.825 -15.887 2.010 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.583 -15.142 1.023 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.024 -14.802 4.044 1.00 0.00 H new ATOM 0 HG3 PRO A 135 0.463 -15.239 3.225 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.053 -12.631 3.883 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.838 -13.028 2.427 1.00 0.00 H new ATOM 859 N ARG A 136 -4.025 -12.671 2.653 1.00 0.00 N ATOM 860 CA ARG A 136 -5.357 -12.367 3.200 1.00 0.00 C ATOM 861 C ARG A 136 -6.110 -11.452 2.220 1.00 0.00 C ATOM 862 O ARG A 136 -7.293 -11.644 1.943 1.00 0.00 O ATOM 863 CB ARG A 136 -5.073 -11.640 4.518 1.00 0.00 C ATOM 864 CG ARG A 136 -6.302 -11.172 5.297 1.00 0.00 C ATOM 865 CD ARG A 136 -5.830 -10.282 6.448 1.00 0.00 C ATOM 866 NE ARG A 136 -6.985 -9.779 7.205 1.00 0.00 N ATOM 867 CZ ARG A 136 -7.470 -8.536 7.172 1.00 0.00 C ATOM 868 NH1 ARG A 136 -6.871 -7.537 6.527 1.00 0.00 N ATOM 869 NH2 ARG A 136 -8.590 -8.278 7.826 1.00 0.00 N ATOM 0 H ARG A 136 -3.498 -11.817 2.472 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.974 -13.253 3.352 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.491 -12.302 5.158 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.449 -10.772 4.305 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.979 -10.621 4.644 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.857 -12.028 5.682 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.171 -10.847 7.108 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.250 -9.446 6.057 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.462 -10.444 7.814 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.998 -7.704 6.026 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.285 -6.605 6.534 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -9.063 -9.021 8.340 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.981 -7.336 7.816 1.00 0.00 H new ATOM 870 N THR A 137 -5.344 -10.543 1.603 1.00 0.00 N ATOM 871 CA THR A 137 -5.839 -9.445 0.752 1.00 0.00 C ATOM 872 C THR A 137 -5.868 -9.716 -0.752 1.00 0.00 C ATOM 873 O THR A 137 -4.881 -9.585 -1.484 1.00 0.00 O ATOM 874 CB THR A 137 -5.053 -8.167 1.048 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.656 -8.445 1.171 1.00 0.00 O ATOM 876 CG2 THR A 137 -5.710 -7.439 2.226 1.00 0.00 C ATOM 0 H THR A 137 -4.327 -10.549 1.683 1.00 0.00 H new ATOM 0 HA THR A 137 -6.889 -9.336 1.022 1.00 0.00 H new ATOM 0 HB THR A 137 -5.097 -7.467 0.214 1.00 0.00 H new ATOM 0 HG1 THR A 137 -3.158 -7.913 0.516 1.00 0.00 H new ATOM 0 HG21 THR A 137 -5.156 -6.526 2.444 1.00 0.00 H new ATOM 0 HG22 THR A 137 -6.739 -7.187 1.970 1.00 0.00 H new ATOM 0 HG23 THR A 137 -5.703 -8.086 3.103 1.00 0.00 H new ATOM 877 N HIS A 138 -7.105 -9.961 -1.148 1.00 0.00 N ATOM 878 CA HIS A 138 -7.563 -10.122 -2.536 1.00 0.00 C ATOM 879 C HIS A 138 -8.906 -9.380 -2.745 1.00 0.00 C ATOM 880 O HIS A 138 -9.488 -8.844 -1.803 1.00 0.00 O ATOM 881 CB HIS A 138 -7.668 -11.610 -2.908 1.00 0.00 C ATOM 882 CG HIS A 138 -8.908 -12.336 -2.362 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.296 -12.426 -1.092 1.00 0.00 N ATOM 884 CD2 HIS A 138 -9.804 -12.971 -3.109 1.00 0.00 C ATOM 885 CE1 HIS A 138 -10.437 -13.115 -1.056 1.00 0.00 C ATOM 886 NE2 HIS A 138 -10.743 -13.450 -2.300 1.00 0.00 N ATOM 0 H HIS A 138 -7.868 -10.060 -0.478 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.827 -9.675 -3.204 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.665 -11.697 -3.994 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.777 -12.123 -2.544 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -8.806 -12.036 -0.287 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -9.775 -13.079 -4.183 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.008 -13.356 -0.172 1.00 0.00 H new ATOM 887 N TYR A 139 -9.208 -9.125 -4.018 1.00 0.00 N ATOM 888 CA TYR A 139 -10.513 -8.587 -4.446 1.00 0.00 C ATOM 889 C TYR A 139 -11.731 -9.177 -3.742 1.00 0.00 C ATOM 890 O TYR A 139 -12.126 -10.331 -3.948 1.00 0.00 O ATOM 891 CB TYR A 139 -10.658 -8.708 -5.971 1.00 0.00 C ATOM 892 CG TYR A 139 -10.598 -7.365 -6.719 1.00 0.00 C ATOM 893 CD1 TYR A 139 -11.135 -6.181 -6.151 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.985 -7.353 -7.988 1.00 0.00 C ATOM 895 CE1 TYR A 139 -11.010 -4.967 -6.853 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.869 -6.134 -8.688 1.00 0.00 C ATOM 897 CZ TYR A 139 -10.357 -4.944 -8.102 1.00 0.00 C ATOM 898 OH TYR A 139 -9.975 -3.746 -8.600 1.00 0.00 O ATOM 0 H TYR A 139 -8.558 -9.284 -4.788 1.00 0.00 H new ATOM 0 HA TYR A 139 -10.503 -7.540 -4.142 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.868 -9.357 -6.349 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -11.607 -9.195 -6.197 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.633 -6.211 -5.193 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -9.608 -8.268 -8.420 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.413 -4.056 -6.436 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -9.410 -6.110 -9.665 1.00 0.00 H new ATOM 0 HH TYR A 139 -9.376 -3.885 -9.363 1.00 0.00 H new ATOM 899 N GLY A 140 -12.207 -8.382 -2.791 1.00 0.00 N ATOM 900 CA GLY A 140 -13.345 -8.719 -1.923 1.00 0.00 C ATOM 901 C GLY A 140 -13.186 -8.022 -0.565 1.00 0.00 C ATOM 902 O GLY A 140 -14.124 -7.416 -0.058 1.00 0.00 O ATOM 0 H GLY A 140 -11.809 -7.464 -2.592 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.278 -8.409 -2.394 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.401 -9.799 -1.784 1.00 0.00 H new ATOM 903 N GLN A 141 -11.962 -8.064 -0.027 1.00 0.00 N ATOM 904 CA GLN A 141 -11.652 -7.308 1.191 1.00 0.00 C ATOM 905 C GLN A 141 -11.589 -5.826 0.859 1.00 0.00 C ATOM 906 O GLN A 141 -10.787 -5.330 0.081 1.00 0.00 O ATOM 907 CB GLN A 141 -10.309 -7.658 1.833 1.00 0.00 C ATOM 908 CG GLN A 141 -10.261 -9.056 2.472 1.00 0.00 C ATOM 909 CD GLN A 141 -10.095 -10.136 1.415 1.00 0.00 C ATOM 910 OE1 GLN A 141 -9.155 -10.137 0.639 1.00 0.00 O ATOM 911 NE2 GLN A 141 -11.071 -11.004 1.267 1.00 0.00 N ATOM 0 H GLN A 141 -11.183 -8.602 -0.407 1.00 0.00 H new ATOM 0 HA GLN A 141 -12.444 -7.566 1.894 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.528 -7.590 1.075 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -10.079 -6.914 2.596 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -9.435 -9.107 3.181 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -11.177 -9.233 3.036 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -11.857 -11.003 1.917 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -11.042 -11.679 0.503 1.00 0.00 H new ATOM 912 N LYS A 142 -12.385 -5.164 1.665 1.00 0.00 N ATOM 913 CA LYS A 142 -12.449 -3.697 1.741 1.00 0.00 C ATOM 914 C LYS A 142 -11.099 -3.037 2.082 1.00 0.00 C ATOM 915 O LYS A 142 -10.787 -1.959 1.587 1.00 0.00 O ATOM 916 CB LYS A 142 -13.528 -3.392 2.762 1.00 0.00 C ATOM 917 CG LYS A 142 -14.836 -3.975 2.229 1.00 0.00 C ATOM 918 CD LYS A 142 -16.056 -3.498 2.986 1.00 0.00 C ATOM 919 CE LYS A 142 -16.057 -3.985 4.426 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.588 -2.828 5.137 1.00 0.00 N ATOM 0 H LYS A 142 -13.027 -5.628 2.307 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.690 -3.271 0.767 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -13.278 -3.830 3.728 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.620 -2.317 2.914 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.942 -3.709 1.177 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.788 -5.063 2.279 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -16.089 -2.409 2.971 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -16.956 -3.851 2.483 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -16.683 -4.867 4.558 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -15.056 -4.250 4.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -16.671 -3.051 6.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -15.946 -2.019 5.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -17.526 -2.588 4.757 1.00 0.00 H new ATOM 921 N ALA A 143 -10.249 -3.878 2.675 1.00 0.00 N ATOM 922 CA ALA A 143 -8.837 -3.605 2.975 1.00 0.00 C ATOM 923 C ALA A 143 -8.004 -3.135 1.765 1.00 0.00 C ATOM 924 O ALA A 143 -7.088 -2.332 1.951 1.00 0.00 O ATOM 925 CB ALA A 143 -8.208 -4.854 3.590 1.00 0.00 C ATOM 0 H ALA A 143 -10.536 -4.810 2.973 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.826 -2.770 3.676 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -7.159 -4.660 3.816 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.735 -5.112 4.508 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.280 -5.682 2.885 1.00 0.00 H new ATOM 926 N ILE A 144 -8.376 -3.568 0.563 1.00 0.00 N ATOM 927 CA ILE A 144 -7.601 -3.248 -0.666 1.00 0.00 C ATOM 928 C ILE A 144 -8.048 -1.991 -1.447 1.00 0.00 C ATOM 929 O ILE A 144 -7.434 -1.654 -2.457 1.00 0.00 O ATOM 930 CB ILE A 144 -7.498 -4.477 -1.602 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.849 -4.878 -2.202 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.725 -5.587 -0.895 1.00 0.00 C ATOM 933 CD1 ILE A 144 -8.670 -5.717 -3.458 1.00 0.00 C ATOM 0 H ILE A 144 -9.204 -4.140 0.398 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.612 -2.988 -0.289 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.918 -4.221 -2.489 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -9.424 -5.440 -1.466 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -9.424 -3.983 -2.439 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.651 -6.454 -1.552 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.724 -5.233 -0.647 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -7.247 -5.868 0.020 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -9.648 -5.985 -3.859 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -8.117 -5.144 -4.202 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -8.117 -6.624 -3.214 1.00 0.00 H new ATOM 934 N LEU A 145 -9.024 -1.246 -0.932 1.00 0.00 N ATOM 935 CA LEU A 145 -9.647 -0.107 -1.645 1.00 0.00 C ATOM 936 C LEU A 145 -9.184 1.268 -1.132 1.00 0.00 C ATOM 937 O LEU A 145 -9.765 1.833 -0.201 1.00 0.00 O ATOM 938 CB LEU A 145 -11.175 -0.193 -1.559 1.00 0.00 C ATOM 939 CG LEU A 145 -11.812 -1.210 -2.509 1.00 0.00 C ATOM 940 CD1 LEU A 145 -11.741 -2.636 -1.985 1.00 0.00 C ATOM 941 CD2 LEU A 145 -13.296 -0.841 -2.673 1.00 0.00 C ATOM 0 H LEU A 145 -9.415 -1.408 -0.004 1.00 0.00 H new ATOM 0 HA LEU A 145 -9.319 -0.188 -2.681 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -11.454 -0.447 -0.536 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.593 0.791 -1.769 1.00 0.00 H new ATOM 0 HG LEU A 145 -11.262 -1.174 -3.449 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -12.209 -3.311 -2.702 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -10.698 -2.921 -1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -12.265 -2.700 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -13.775 -1.551 -3.347 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -13.789 -0.874 -1.701 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -13.377 0.164 -3.088 1.00 0.00 H new ATOM 942 N PHE A 146 -8.080 1.759 -1.702 1.00 0.00 N ATOM 943 CA PHE A 146 -7.519 3.076 -1.290 1.00 0.00 C ATOM 944 C PHE A 146 -7.888 4.276 -2.161 1.00 0.00 C ATOM 945 O PHE A 146 -7.962 4.170 -3.377 1.00 0.00 O ATOM 946 CB PHE A 146 -5.986 3.043 -1.309 1.00 0.00 C ATOM 947 CG PHE A 146 -5.404 1.774 -0.695 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.519 1.549 0.691 1.00 0.00 C ATOM 949 CD2 PHE A 146 -4.982 0.758 -1.577 1.00 0.00 C ATOM 950 CE1 PHE A 146 -5.236 0.277 1.209 1.00 0.00 C ATOM 951 CE2 PHE A 146 -4.721 -0.523 -1.067 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.848 -0.747 0.314 1.00 0.00 C ATOM 0 H PHE A 146 -7.556 1.285 -2.437 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.958 3.214 -0.302 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.640 3.132 -2.339 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -5.604 3.909 -0.768 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -5.823 2.350 1.349 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.861 0.963 -2.630 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -5.313 0.083 2.269 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.427 -1.326 -1.727 1.00 0.00 H new ATOM 0 HZ PHE A 146 -4.643 -1.733 0.705 1.00 0.00 H new ATOM 953 N LEU A 147 -7.851 5.447 -1.526 1.00 0.00 N ATOM 954 CA LEU A 147 -8.013 6.738 -2.227 1.00 0.00 C ATOM 955 C LEU A 147 -6.715 7.593 -2.238 1.00 0.00 C ATOM 956 O LEU A 147 -6.374 8.176 -1.210 1.00 0.00 O ATOM 957 CB LEU A 147 -9.178 7.552 -1.645 1.00 0.00 C ATOM 958 CG LEU A 147 -10.507 6.830 -1.813 1.00 0.00 C ATOM 959 CD1 LEU A 147 -10.792 5.963 -0.584 1.00 0.00 C ATOM 960 CD2 LEU A 147 -11.631 7.851 -1.980 1.00 0.00 C ATOM 0 H LEU A 147 -7.710 5.537 -0.520 1.00 0.00 H new ATOM 0 HA LEU A 147 -8.241 6.485 -3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.997 7.741 -0.587 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.226 8.523 -2.138 1.00 0.00 H new ATOM 0 HG LEU A 147 -10.453 6.196 -2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -11.745 5.450 -0.714 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -9.997 5.227 -0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -10.837 6.594 0.304 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -12.581 7.330 -2.100 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -11.676 8.490 -1.098 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -11.439 8.463 -2.861 1.00 0.00 H new ATOM 961 N PRO A 148 -5.878 7.381 -3.265 1.00 0.00 N ATOM 962 CA PRO A 148 -4.801 8.329 -3.595 1.00 0.00 C ATOM 963 C PRO A 148 -5.059 8.997 -4.966 1.00 0.00 C ATOM 964 O PRO A 148 -6.162 9.485 -5.216 1.00 0.00 O ATOM 965 CB PRO A 148 -3.560 7.434 -3.537 1.00 0.00 C ATOM 966 CG PRO A 148 -4.026 6.139 -4.203 1.00 0.00 C ATOM 967 CD PRO A 148 -5.472 6.031 -3.700 1.00 0.00 C ATOM 0 HA PRO A 148 -4.707 9.184 -2.925 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -2.719 7.879 -4.068 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.235 7.264 -2.511 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -3.974 6.197 -5.290 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.423 5.283 -3.900 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.129 5.666 -4.490 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -5.542 5.322 -2.875 1.00 0.00 H new