USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 911 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 79 HIS : no HD1:sc= -0.418 K(o=-2.9,f=-5.7) USER MOD Set 1.2: B 9 ASN : amide:sc= -2.5 K(o=-2.9,f=-7.7!) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0696 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc=-0.00215 USER MOD Single : A 10 SER OG : rot 180:sc= -0.991 USER MOD Single : A 11 MET CE :methyl -118:sc= -6.28! (180deg=-13.7!) USER MOD Single : A 14 SER OG : rot 96:sc= 1.24 USER MOD Single : A 18 GLN : amide:sc= 0.0983 K(o=0.098,f=-2.4!) USER MOD Single : A 20 GLN : amide:sc= -4.36! C(o=-4.4!,f=-5.9!) USER MOD Single : A 21 LYS NZ :NH3+ -166:sc= -1.39 (180deg=-1.84) USER MOD Single : A 22 GLN : amide:sc= -0.0853 K(o=-0.085,f=-3.8!) USER MOD Single : A 23 MET CE :methyl -123:sc= -0.0167 (180deg=-0.109) USER MOD Single : A 33 GLN : amide:sc= 0.00079 X(o=0.00079,f=0) USER MOD Single : A 35 MET CE :methyl 146:sc= -3.75! (180deg=-7.99!) USER MOD Single : A 36 HIS : no HE2:sc= -8.65! C(o=-8.6!,f=-6.7!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -2.4! USER MOD Single : A 42 LYS NZ :NH3+ 145:sc= 1 (180deg=-0.362) USER MOD Single : A 44 THR OG1 : rot 81:sc= -0.514! USER MOD Single : A 46 MET CE :methyl -138:sc= 0 (180deg=-0.472) USER MOD Single : A 52 ASN : amide:sc= -8.99! C(o=-9!,f=-7.6!) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HE2:sc= -0.0283 X(o=-0.028,f=-0.38) USER MOD Single : A 58 MET CE :methyl -140:sc= -6.78! (180deg=-9.31!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 84:sc= 0.199 USER MOD Single : A 68 LYS NZ :NH3+ 179:sc= 0.942 (180deg=0.941) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= -1.13 K(o=-1.1,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.583 K(o=-0.58,f=-0.024) USER MOD Single : A 87 LYS NZ :NH3+ 146:sc= -0.273 (180deg=-1.62!) USER MOD Single : A 90 ASN : amide:sc= -3.57! C(o=-3.6!,f=-2.1!) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 VAL N :NH3+ 168:sc= -0.0597 (180deg=-0.218) USER MOD Single : B 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 4 SER OG : rot 160:sc= -0.412 USER MOD Single : B 5 LYS NZ :NH3+ 139:sc= -0.199 (180deg=-2.56!) USER MOD Single : B 7 SER OG : rot -129:sc= 0.0943 USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot 70:sc= -0.562 USER MOD Single : B 18 TYR OH : rot 180:sc= -0.742 USER MOD Single : B 19 SER OG : rot 180:sc= -1.23 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 22 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.519 -18.675 -4.950 1.00 0.00 N ATOM 2 CA GLY A 1 -13.813 -17.220 -5.068 1.00 0.00 C ATOM 3 C GLY A 1 -12.909 -16.526 -6.071 1.00 0.00 C ATOM 4 O GLY A 1 -11.928 -17.110 -6.531 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.355 -19.223 -5.238 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.717 -18.918 -5.566 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.280 -18.902 -3.964 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.853 -17.085 -5.366 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.698 -16.749 -4.092 1.00 0.00 H new ATOM 10 N PRO A 2 -13.214 -15.267 -6.429 1.00 0.00 N ATOM 11 CA PRO A 2 -12.411 -14.503 -7.386 1.00 0.00 C ATOM 12 C PRO A 2 -11.055 -14.108 -6.815 1.00 0.00 C ATOM 13 O PRO A 2 -10.942 -13.123 -6.086 1.00 0.00 O ATOM 14 CB PRO A 2 -13.262 -13.260 -7.654 1.00 0.00 C ATOM 15 CG PRO A 2 -14.092 -13.100 -6.428 1.00 0.00 C ATOM 16 CD PRO A 2 -14.366 -14.493 -5.928 1.00 0.00 C ATOM 0 HA PRO A 2 -12.186 -15.081 -8.282 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -12.639 -12.383 -7.828 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -13.884 -13.389 -8.540 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -13.567 -12.512 -5.675 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -15.021 -12.576 -6.651 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -14.429 -14.525 -4.840 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -15.309 -14.880 -6.314 1.00 0.00 H new ATOM 24 N LEU A 3 -10.028 -14.882 -7.150 1.00 0.00 N ATOM 25 CA LEU A 3 -8.680 -14.610 -6.668 1.00 0.00 C ATOM 26 C LEU A 3 -7.975 -13.600 -7.570 1.00 0.00 C ATOM 27 O LEU A 3 -7.038 -13.940 -8.291 1.00 0.00 O ATOM 28 CB LEU A 3 -7.873 -15.909 -6.589 1.00 0.00 C ATOM 29 CG LEU A 3 -7.132 -16.126 -5.266 1.00 0.00 C ATOM 30 CD1 LEU A 3 -7.273 -17.568 -4.803 1.00 0.00 C ATOM 31 CD2 LEU A 3 -5.663 -15.750 -5.408 1.00 0.00 C ATOM 0 H LEU A 3 -10.104 -15.701 -7.753 1.00 0.00 H new ATOM 0 HA LEU A 3 -8.753 -14.181 -5.669 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.547 -16.750 -6.754 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.147 -15.919 -7.402 1.00 0.00 H new ATOM 0 HG LEU A 3 -7.581 -15.479 -4.512 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -6.740 -17.702 -3.862 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.328 -17.802 -4.659 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -6.853 -18.235 -5.556 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.153 -15.911 -4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -5.202 -16.369 -6.177 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.582 -14.700 -5.690 1.00 0.00 H new ATOM 43 N GLY A 4 -8.437 -12.356 -7.524 1.00 0.00 N ATOM 44 CA GLY A 4 -7.844 -11.313 -8.341 1.00 0.00 C ATOM 45 C GLY A 4 -6.723 -10.583 -7.628 1.00 0.00 C ATOM 46 O GLY A 4 -6.718 -9.355 -7.560 1.00 0.00 O ATOM 0 H GLY A 4 -9.212 -12.050 -6.935 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.459 -11.752 -9.262 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.615 -10.597 -8.627 1.00 0.00 H new ATOM 50 N SER A 5 -5.772 -11.337 -7.091 1.00 0.00 N ATOM 51 CA SER A 5 -4.647 -10.742 -6.379 1.00 0.00 C ATOM 52 C SER A 5 -3.391 -10.686 -7.258 1.00 0.00 C ATOM 53 O SER A 5 -2.766 -9.632 -7.381 1.00 0.00 O ATOM 54 CB SER A 5 -4.365 -11.511 -5.086 1.00 0.00 C ATOM 55 OG SER A 5 -5.237 -11.098 -4.049 1.00 0.00 O ATOM 0 H SER A 5 -5.756 -12.356 -7.134 1.00 0.00 H new ATOM 0 HA SER A 5 -4.918 -9.717 -6.125 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.484 -12.580 -5.261 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.331 -11.351 -4.782 1.00 0.00 H new ATOM 0 HG SER A 5 -5.039 -11.604 -3.234 1.00 0.00 H new ATOM 61 N PRO A 6 -2.996 -11.815 -7.881 1.00 0.00 N ATOM 62 CA PRO A 6 -1.802 -11.867 -8.738 1.00 0.00 C ATOM 63 C PRO A 6 -1.824 -10.818 -9.853 1.00 0.00 C ATOM 64 O PRO A 6 -1.076 -9.841 -9.806 1.00 0.00 O ATOM 65 CB PRO A 6 -1.836 -13.283 -9.325 1.00 0.00 C ATOM 66 CG PRO A 6 -2.647 -14.076 -8.360 1.00 0.00 C ATOM 67 CD PRO A 6 -3.665 -13.127 -7.796 1.00 0.00 C ATOM 0 HA PRO A 6 -0.895 -11.650 -8.173 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -2.286 -13.289 -10.318 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -0.831 -13.693 -9.428 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -3.131 -14.917 -8.856 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -2.020 -14.489 -7.570 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -4.591 -13.143 -8.371 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -3.923 -13.380 -6.768 1.00 0.00 H new ATOM 75 N LEU A 7 -2.677 -11.024 -10.856 1.00 0.00 N ATOM 76 CA LEU A 7 -2.779 -10.092 -11.976 1.00 0.00 C ATOM 77 C LEU A 7 -3.777 -8.977 -11.664 1.00 0.00 C ATOM 78 O LEU A 7 -4.842 -9.225 -11.100 1.00 0.00 O ATOM 79 CB LEU A 7 -3.196 -10.837 -13.247 1.00 0.00 C ATOM 80 CG LEU A 7 -2.338 -10.560 -14.487 1.00 0.00 C ATOM 81 CD1 LEU A 7 -2.488 -9.114 -14.931 1.00 0.00 C ATOM 82 CD2 LEU A 7 -0.878 -10.892 -14.217 1.00 0.00 C ATOM 0 H LEU A 7 -3.305 -11.826 -10.915 1.00 0.00 H new ATOM 0 HA LEU A 7 -1.800 -9.640 -12.137 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.174 -11.908 -13.043 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -4.229 -10.578 -13.477 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.689 -11.203 -15.295 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.871 -8.938 -15.812 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.532 -8.914 -15.173 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -2.169 -8.451 -14.127 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -0.287 -10.688 -15.110 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.512 -10.280 -13.392 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.787 -11.946 -13.955 1.00 0.00 H new ATOM 94 N THR A 8 -3.411 -7.748 -12.014 1.00 0.00 N ATOM 95 CA THR A 8 -4.243 -6.584 -11.740 1.00 0.00 C ATOM 96 C THR A 8 -5.255 -6.369 -12.852 1.00 0.00 C ATOM 97 O THR A 8 -6.398 -5.994 -12.593 1.00 0.00 O ATOM 98 CB THR A 8 -3.361 -5.336 -11.601 1.00 0.00 C ATOM 99 OG1 THR A 8 -2.723 -5.038 -12.831 1.00 0.00 O ATOM 100 CG2 THR A 8 -2.279 -5.470 -10.548 1.00 0.00 C ATOM 0 H THR A 8 -2.536 -7.533 -12.492 1.00 0.00 H new ATOM 0 HA THR A 8 -4.781 -6.759 -10.809 1.00 0.00 H new ATOM 0 HB THR A 8 -4.040 -4.539 -11.297 1.00 0.00 H new ATOM 0 HG1 THR A 8 -2.166 -4.239 -12.725 1.00 0.00 H new ATOM 0 HG21 THR A 8 -1.696 -4.550 -10.506 1.00 0.00 H new ATOM 0 HG22 THR A 8 -2.738 -5.653 -9.576 1.00 0.00 H new ATOM 0 HG23 THR A 8 -1.624 -6.303 -10.803 1.00 0.00 H new ATOM 108 N ALA A 9 -4.848 -6.631 -14.086 1.00 0.00 N ATOM 109 CA ALA A 9 -5.751 -6.484 -15.214 1.00 0.00 C ATOM 110 C ALA A 9 -6.962 -7.390 -15.024 1.00 0.00 C ATOM 111 O ALA A 9 -8.077 -6.918 -14.806 1.00 0.00 O ATOM 112 CB ALA A 9 -5.034 -6.804 -16.520 1.00 0.00 C ATOM 0 H ALA A 9 -3.908 -6.943 -14.328 1.00 0.00 H new ATOM 0 HA ALA A 9 -6.091 -5.450 -15.265 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.727 -6.688 -17.353 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.193 -6.123 -16.650 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -4.668 -7.830 -16.492 1.00 0.00 H new ATOM 118 N SER A 10 -6.738 -8.697 -15.135 1.00 0.00 N ATOM 119 CA SER A 10 -7.817 -9.673 -15.001 1.00 0.00 C ATOM 120 C SER A 10 -8.530 -9.557 -13.654 1.00 0.00 C ATOM 121 O SER A 10 -9.698 -9.937 -13.532 1.00 0.00 O ATOM 122 CB SER A 10 -7.273 -11.095 -15.182 1.00 0.00 C ATOM 123 OG SER A 10 -6.140 -11.324 -14.363 1.00 0.00 O ATOM 0 H SER A 10 -5.821 -9.105 -15.317 1.00 0.00 H new ATOM 0 HA SER A 10 -8.546 -9.459 -15.782 1.00 0.00 H new ATOM 0 HB2 SER A 10 -8.052 -11.818 -14.938 1.00 0.00 H new ATOM 0 HB3 SER A 10 -7.006 -11.254 -16.227 1.00 0.00 H new ATOM 0 HG SER A 10 -5.817 -12.239 -14.499 1.00 0.00 H new ATOM 129 N MET A 11 -7.848 -9.028 -12.640 1.00 0.00 N ATOM 130 CA MET A 11 -8.464 -8.884 -11.335 1.00 0.00 C ATOM 131 C MET A 11 -9.648 -7.923 -11.422 1.00 0.00 C ATOM 132 O MET A 11 -10.730 -8.197 -10.904 1.00 0.00 O ATOM 133 CB MET A 11 -7.412 -8.413 -10.322 1.00 0.00 C ATOM 134 CG MET A 11 -7.756 -7.134 -9.591 1.00 0.00 C ATOM 135 SD MET A 11 -9.105 -7.346 -8.412 1.00 0.00 S ATOM 136 CE MET A 11 -10.222 -6.043 -8.927 1.00 0.00 C ATOM 0 H MET A 11 -6.885 -8.699 -12.700 1.00 0.00 H new ATOM 0 HA MET A 11 -8.849 -9.845 -10.994 1.00 0.00 H new ATOM 0 HB2 MET A 11 -7.257 -9.203 -9.587 1.00 0.00 H new ATOM 0 HB3 MET A 11 -6.465 -8.273 -10.843 1.00 0.00 H new ATOM 0 HG2 MET A 11 -6.873 -6.773 -9.065 1.00 0.00 H new ATOM 0 HG3 MET A 11 -8.030 -6.368 -10.317 1.00 0.00 H new ATOM 0 HE1 MET A 11 -10.349 -5.330 -8.113 1.00 0.00 H new ATOM 0 HE2 MET A 11 -9.808 -5.532 -9.796 1.00 0.00 H new ATOM 0 HE3 MET A 11 -11.189 -6.474 -9.186 1.00 0.00 H new ATOM 146 N LEU A 12 -9.432 -6.807 -12.096 1.00 0.00 N ATOM 147 CA LEU A 12 -10.474 -5.806 -12.281 1.00 0.00 C ATOM 148 C LEU A 12 -11.716 -6.442 -12.899 1.00 0.00 C ATOM 149 O LEU A 12 -12.791 -6.441 -12.298 1.00 0.00 O ATOM 150 CB LEU A 12 -9.952 -4.667 -13.169 1.00 0.00 C ATOM 151 CG LEU A 12 -10.418 -3.249 -12.804 1.00 0.00 C ATOM 152 CD1 LEU A 12 -11.690 -2.897 -13.558 1.00 0.00 C ATOM 153 CD2 LEU A 12 -10.635 -3.107 -11.305 1.00 0.00 C ATOM 0 H LEU A 12 -8.539 -6.568 -12.528 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.748 -5.395 -11.309 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.862 -4.686 -13.144 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -10.251 -4.871 -14.197 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.631 -2.554 -13.097 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -12.006 -1.889 -13.288 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.502 -2.943 -14.631 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.476 -3.606 -13.297 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.964 -2.093 -11.079 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.396 -3.816 -10.979 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.701 -3.310 -10.781 1.00 0.00 H new ATOM 165 N ALA A 13 -11.552 -7.006 -14.092 1.00 0.00 N ATOM 166 CA ALA A 13 -12.649 -7.676 -14.785 1.00 0.00 C ATOM 167 C ALA A 13 -13.019 -8.997 -14.106 1.00 0.00 C ATOM 168 O ALA A 13 -13.839 -9.761 -14.615 1.00 0.00 O ATOM 169 CB ALA A 13 -12.273 -7.922 -16.232 1.00 0.00 C ATOM 0 H ALA A 13 -10.668 -7.013 -14.600 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.521 -7.024 -14.743 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -13.096 -8.422 -16.742 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -12.068 -6.970 -16.721 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.384 -8.551 -16.275 1.00 0.00 H new ATOM 175 N SER A 14 -12.416 -9.251 -12.949 1.00 0.00 N ATOM 176 CA SER A 14 -12.685 -10.467 -12.194 1.00 0.00 C ATOM 177 C SER A 14 -13.659 -10.204 -11.040 1.00 0.00 C ATOM 178 O SER A 14 -13.877 -11.075 -10.197 1.00 0.00 O ATOM 179 CB SER A 14 -11.379 -11.054 -11.658 1.00 0.00 C ATOM 180 OG SER A 14 -10.839 -12.001 -12.562 1.00 0.00 O ATOM 0 H SER A 14 -11.736 -8.628 -12.514 1.00 0.00 H new ATOM 0 HA SER A 14 -13.150 -11.185 -12.869 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.658 -10.254 -11.491 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.558 -11.528 -10.693 1.00 0.00 H new ATOM 0 HG SER A 14 -10.169 -11.566 -13.130 1.00 0.00 H new ATOM 186 N ALA A 15 -14.251 -9.008 -11.009 1.00 0.00 N ATOM 187 CA ALA A 15 -15.202 -8.660 -9.961 1.00 0.00 C ATOM 188 C ALA A 15 -16.438 -7.977 -10.549 1.00 0.00 C ATOM 189 O ALA A 15 -16.345 -7.279 -11.559 1.00 0.00 O ATOM 190 CB ALA A 15 -14.532 -7.766 -8.935 1.00 0.00 C ATOM 0 H ALA A 15 -14.087 -8.271 -11.695 1.00 0.00 H new ATOM 0 HA ALA A 15 -15.531 -9.576 -9.470 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.247 -7.509 -8.154 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -13.685 -8.291 -8.493 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -14.181 -6.855 -9.420 1.00 0.00 H new ATOM 196 N PRO A 16 -17.622 -8.185 -9.932 1.00 0.00 N ATOM 197 CA PRO A 16 -18.883 -7.604 -10.399 1.00 0.00 C ATOM 198 C PRO A 16 -18.753 -6.135 -10.805 1.00 0.00 C ATOM 199 O PRO A 16 -17.684 -5.539 -10.686 1.00 0.00 O ATOM 200 CB PRO A 16 -19.829 -7.736 -9.195 1.00 0.00 C ATOM 201 CG PRO A 16 -19.068 -8.452 -8.120 1.00 0.00 C ATOM 202 CD PRO A 16 -17.823 -9.022 -8.746 1.00 0.00 C ATOM 0 HA PRO A 16 -19.236 -8.115 -11.294 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -20.154 -6.755 -8.850 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -20.726 -8.291 -9.468 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -18.811 -7.767 -7.312 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -19.675 -9.245 -7.685 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -16.972 -8.968 -8.067 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -17.952 -10.071 -9.012 1.00 0.00 H new ATOM 210 N PRO A 17 -19.851 -5.532 -11.299 1.00 0.00 N ATOM 211 CA PRO A 17 -19.856 -4.134 -11.732 1.00 0.00 C ATOM 212 C PRO A 17 -19.215 -3.190 -10.712 1.00 0.00 C ATOM 213 O PRO A 17 -18.059 -2.817 -10.867 1.00 0.00 O ATOM 214 CB PRO A 17 -21.343 -3.823 -11.929 1.00 0.00 C ATOM 215 CG PRO A 17 -21.961 -5.143 -12.245 1.00 0.00 C ATOM 216 CD PRO A 17 -21.169 -6.170 -11.479 1.00 0.00 C ATOM 0 HA PRO A 17 -19.262 -3.987 -12.634 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -21.779 -3.385 -11.031 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -21.496 -3.109 -12.738 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -23.011 -5.162 -11.951 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -21.926 -5.343 -13.316 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -21.635 -6.403 -10.522 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -21.089 -7.107 -12.031 1.00 0.00 H new ATOM 224 N GLN A 18 -19.964 -2.797 -9.682 1.00 0.00 N ATOM 225 CA GLN A 18 -19.441 -1.882 -8.665 1.00 0.00 C ATOM 226 C GLN A 18 -18.170 -2.420 -8.014 1.00 0.00 C ATOM 227 O GLN A 18 -17.389 -1.656 -7.448 1.00 0.00 O ATOM 228 CB GLN A 18 -20.503 -1.601 -7.599 1.00 0.00 C ATOM 229 CG GLN A 18 -20.782 -2.780 -6.677 1.00 0.00 C ATOM 230 CD GLN A 18 -22.110 -3.450 -6.971 1.00 0.00 C ATOM 231 OE1 GLN A 18 -22.308 -4.016 -8.045 1.00 0.00 O ATOM 232 NE2 GLN A 18 -23.028 -3.388 -6.014 1.00 0.00 N ATOM 0 H GLN A 18 -20.928 -3.095 -9.529 1.00 0.00 H new ATOM 0 HA GLN A 18 -19.185 -0.950 -9.168 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -20.183 -0.750 -6.997 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -21.431 -1.311 -8.093 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -19.980 -3.512 -6.777 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -20.774 -2.437 -5.642 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -22.820 -2.908 -5.138 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -23.941 -3.821 -6.154 1.00 0.00 H new ATOM 241 N GLU A 19 -17.950 -3.727 -8.103 1.00 0.00 N ATOM 242 CA GLU A 19 -16.756 -4.322 -7.522 1.00 0.00 C ATOM 243 C GLU A 19 -15.581 -4.203 -8.486 1.00 0.00 C ATOM 244 O GLU A 19 -14.730 -5.089 -8.558 1.00 0.00 O ATOM 245 CB GLU A 19 -17.002 -5.790 -7.162 1.00 0.00 C ATOM 246 CG GLU A 19 -17.260 -6.013 -5.680 1.00 0.00 C ATOM 247 CD GLU A 19 -17.456 -7.476 -5.330 1.00 0.00 C ATOM 248 OE1 GLU A 19 -16.545 -8.281 -5.613 1.00 0.00 O ATOM 249 OE2 GLU A 19 -18.522 -7.813 -4.773 1.00 0.00 O ATOM 0 H GLU A 19 -18.575 -4.386 -8.566 1.00 0.00 H new ATOM 0 HA GLU A 19 -16.514 -3.780 -6.607 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -17.856 -6.158 -7.731 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -16.138 -6.381 -7.466 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -16.422 -5.616 -5.107 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -18.145 -5.451 -5.382 1.00 0.00 H new ATOM 256 N GLN A 20 -15.513 -3.074 -9.188 1.00 0.00 N ATOM 257 CA GLN A 20 -14.407 -2.816 -10.102 1.00 0.00 C ATOM 258 C GLN A 20 -13.132 -2.576 -9.307 1.00 0.00 C ATOM 259 O GLN A 20 -12.357 -3.494 -9.043 1.00 0.00 O ATOM 260 CB GLN A 20 -14.682 -1.618 -11.044 1.00 0.00 C ATOM 261 CG GLN A 20 -15.990 -0.887 -10.793 1.00 0.00 C ATOM 262 CD GLN A 20 -16.378 0.004 -11.954 1.00 0.00 C ATOM 263 OE1 GLN A 20 -17.443 -0.158 -12.549 1.00 0.00 O ATOM 264 NE2 GLN A 20 -15.508 0.950 -12.287 1.00 0.00 N ATOM 0 H GLN A 20 -16.207 -2.328 -9.141 1.00 0.00 H new ATOM 0 HA GLN A 20 -14.292 -3.697 -10.734 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -13.862 -0.906 -10.950 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -14.676 -1.976 -12.073 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -16.782 -1.614 -10.614 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -15.900 -0.285 -9.889 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -14.637 1.048 -11.766 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -15.711 1.579 -13.064 1.00 0.00 H new ATOM 273 N LYS A 21 -12.943 -1.318 -8.926 1.00 0.00 N ATOM 274 CA LYS A 21 -11.786 -0.883 -8.151 1.00 0.00 C ATOM 275 C LYS A 21 -11.943 -1.222 -6.672 1.00 0.00 C ATOM 276 O LYS A 21 -11.235 -0.678 -5.826 1.00 0.00 O ATOM 277 CB LYS A 21 -11.595 0.619 -8.332 1.00 0.00 C ATOM 278 CG LYS A 21 -12.107 1.115 -9.671 1.00 0.00 C ATOM 279 CD LYS A 21 -11.132 2.073 -10.322 1.00 0.00 C ATOM 280 CE LYS A 21 -10.012 1.335 -11.034 1.00 0.00 C ATOM 281 NZ LYS A 21 -9.014 2.276 -11.608 1.00 0.00 N ATOM 0 H LYS A 21 -13.594 -0.565 -9.148 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.906 -1.413 -8.516 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -12.113 1.146 -7.531 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.536 0.861 -8.240 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -12.279 0.266 -10.332 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.068 1.611 -9.532 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.663 2.704 -11.035 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.709 2.733 -9.565 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.517 0.661 -10.334 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.430 0.718 -11.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.403 1.767 -12.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.508 3.045 -12.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -8.432 2.674 -10.843 1.00 0.00 H new ATOM 295 N GLN A 22 -12.869 -2.125 -6.366 1.00 0.00 N ATOM 296 CA GLN A 22 -13.120 -2.533 -4.986 1.00 0.00 C ATOM 297 C GLN A 22 -11.898 -3.195 -4.375 1.00 0.00 C ATOM 298 O GLN A 22 -11.428 -2.787 -3.312 1.00 0.00 O ATOM 299 CB GLN A 22 -14.314 -3.492 -4.918 1.00 0.00 C ATOM 300 CG GLN A 22 -15.414 -3.037 -3.969 1.00 0.00 C ATOM 301 CD GLN A 22 -15.099 -3.327 -2.515 1.00 0.00 C ATOM 302 OE1 GLN A 22 -13.933 -3.412 -2.123 1.00 0.00 O ATOM 303 NE2 GLN A 22 -16.139 -3.480 -1.705 1.00 0.00 N ATOM 0 H GLN A 22 -13.460 -2.590 -7.056 1.00 0.00 H new ATOM 0 HA GLN A 22 -13.347 -1.634 -4.414 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -14.734 -3.606 -5.917 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -13.961 -4.475 -4.606 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -15.574 -1.966 -4.094 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -16.347 -3.532 -4.239 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -17.087 -3.401 -2.072 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -15.990 -3.676 -0.715 1.00 0.00 H new ATOM 312 N MET A 23 -11.393 -4.224 -5.039 1.00 0.00 N ATOM 313 CA MET A 23 -10.237 -4.943 -4.544 1.00 0.00 C ATOM 314 C MET A 23 -9.013 -4.028 -4.481 1.00 0.00 C ATOM 315 O MET A 23 -8.831 -3.319 -3.495 1.00 0.00 O ATOM 316 CB MET A 23 -9.974 -6.174 -5.417 1.00 0.00 C ATOM 317 CG MET A 23 -11.227 -6.980 -5.726 1.00 0.00 C ATOM 318 SD MET A 23 -11.333 -8.503 -4.768 1.00 0.00 S ATOM 319 CE MET A 23 -12.069 -7.896 -3.251 1.00 0.00 C ATOM 0 H MET A 23 -11.767 -4.577 -5.920 1.00 0.00 H new ATOM 0 HA MET A 23 -10.440 -5.283 -3.528 1.00 0.00 H new ATOM 0 HB2 MET A 23 -9.518 -5.854 -6.354 1.00 0.00 H new ATOM 0 HB3 MET A 23 -9.252 -6.818 -4.914 1.00 0.00 H new ATOM 0 HG2 MET A 23 -12.106 -6.368 -5.525 1.00 0.00 H new ATOM 0 HG3 MET A 23 -11.244 -7.223 -6.788 1.00 0.00 H new ATOM 0 HE1 MET A 23 -11.422 -8.143 -2.409 1.00 0.00 H new ATOM 0 HE2 MET A 23 -12.189 -6.814 -3.312 1.00 0.00 H new ATOM 0 HE3 MET A 23 -13.044 -8.361 -3.108 1.00 0.00 H new ATOM 329 N LEU A 24 -8.176 -4.041 -5.523 1.00 0.00 N ATOM 330 CA LEU A 24 -6.968 -3.204 -5.551 1.00 0.00 C ATOM 331 C LEU A 24 -7.283 -1.712 -5.526 1.00 0.00 C ATOM 332 O LEU A 24 -6.853 -0.986 -6.423 1.00 0.00 O ATOM 333 CB LEU A 24 -6.087 -3.483 -6.781 1.00 0.00 C ATOM 334 CG LEU A 24 -6.613 -4.444 -7.838 1.00 0.00 C ATOM 335 CD1 LEU A 24 -7.789 -3.834 -8.584 1.00 0.00 C ATOM 336 CD2 LEU A 24 -5.479 -4.780 -8.798 1.00 0.00 C ATOM 0 H LEU A 24 -8.309 -4.617 -6.354 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.427 -3.474 -4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.884 -2.530 -7.269 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.131 -3.869 -6.426 1.00 0.00 H new ATOM 0 HG LEU A 24 -6.969 -5.356 -7.359 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.149 -4.538 -9.334 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.591 -3.613 -7.880 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.471 -2.913 -9.073 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.841 -5.468 -9.562 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.122 -3.866 -9.273 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.662 -5.246 -8.247 1.00 0.00 H new ATOM 348 N GLY A 25 -8.012 -1.236 -4.518 1.00 0.00 N ATOM 349 CA GLY A 25 -8.324 0.176 -4.469 1.00 0.00 C ATOM 350 C GLY A 25 -8.461 0.774 -5.861 1.00 0.00 C ATOM 351 O GLY A 25 -8.987 0.129 -6.769 1.00 0.00 O ATOM 0 H GLY A 25 -8.384 -1.794 -3.750 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.252 0.324 -3.917 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -7.541 0.702 -3.923 1.00 0.00 H new ATOM 355 N GLU A 26 -7.965 1.987 -6.038 1.00 0.00 N ATOM 356 CA GLU A 26 -8.004 2.650 -7.336 1.00 0.00 C ATOM 357 C GLU A 26 -6.955 2.045 -8.284 1.00 0.00 C ATOM 358 O GLU A 26 -7.245 1.145 -9.071 1.00 0.00 O ATOM 359 CB GLU A 26 -7.773 4.162 -7.190 1.00 0.00 C ATOM 360 CG GLU A 26 -7.168 4.553 -5.853 1.00 0.00 C ATOM 361 CD GLU A 26 -5.751 4.058 -5.718 1.00 0.00 C ATOM 362 OE1 GLU A 26 -4.855 4.641 -6.357 1.00 0.00 O ATOM 363 OE2 GLU A 26 -5.542 3.065 -4.992 1.00 0.00 O ATOM 0 H GLU A 26 -7.529 2.537 -5.298 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.995 2.493 -7.761 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.116 4.501 -7.991 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.723 4.681 -7.316 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.186 5.638 -5.748 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.775 4.144 -5.045 1.00 0.00 H new ATOM 370 N ARG A 27 -5.731 2.577 -8.192 1.00 0.00 N ATOM 371 CA ARG A 27 -4.607 2.138 -9.024 1.00 0.00 C ATOM 372 C ARG A 27 -3.307 2.068 -8.217 1.00 0.00 C ATOM 373 O ARG A 27 -2.216 1.979 -8.786 1.00 0.00 O ATOM 374 CB ARG A 27 -4.420 3.105 -10.199 1.00 0.00 C ATOM 375 CG ARG A 27 -4.494 2.435 -11.556 1.00 0.00 C ATOM 376 CD ARG A 27 -5.817 1.718 -11.728 1.00 0.00 C ATOM 377 NE ARG A 27 -6.086 1.385 -13.121 1.00 0.00 N ATOM 378 CZ ARG A 27 -6.755 0.298 -13.508 1.00 0.00 C ATOM 379 NH1 ARG A 27 -7.236 -0.551 -12.608 1.00 0.00 N ATOM 380 NH2 ARG A 27 -6.953 0.062 -14.799 1.00 0.00 N ATOM 0 H ARG A 27 -5.493 3.323 -7.539 1.00 0.00 H new ATOM 0 HA ARG A 27 -4.837 1.139 -9.395 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -5.183 3.881 -10.145 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.454 3.600 -10.100 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.374 3.180 -12.342 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.674 1.725 -11.662 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -5.814 0.805 -11.132 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -6.621 2.346 -11.345 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.743 2.020 -13.842 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.095 -0.374 -11.613 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.747 -1.380 -12.911 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.593 0.713 -15.497 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -7.465 -0.770 -15.093 1.00 0.00 H new ATOM 394 N LEU A 28 -3.420 2.110 -6.895 1.00 0.00 N ATOM 395 CA LEU A 28 -2.249 2.059 -6.027 1.00 0.00 C ATOM 396 C LEU A 28 -1.663 0.655 -5.938 1.00 0.00 C ATOM 397 O LEU A 28 -0.453 0.469 -6.071 1.00 0.00 O ATOM 398 CB LEU A 28 -2.615 2.546 -4.630 1.00 0.00 C ATOM 399 CG LEU A 28 -2.076 3.922 -4.270 1.00 0.00 C ATOM 400 CD1 LEU A 28 -3.060 4.659 -3.368 1.00 0.00 C ATOM 401 CD2 LEU A 28 -0.708 3.783 -3.613 1.00 0.00 C ATOM 0 H LEU A 28 -4.309 2.179 -6.401 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.492 2.710 -6.464 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.701 2.562 -4.540 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.245 1.825 -3.901 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.958 4.514 -5.178 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.660 5.642 -3.119 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.012 4.775 -3.886 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.213 4.087 -2.453 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.325 4.771 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.798 3.183 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.020 3.296 -4.304 1.00 0.00 H new ATOM 413 N PHE A 29 -2.527 -0.328 -5.714 1.00 0.00 N ATOM 414 CA PHE A 29 -2.092 -1.727 -5.604 1.00 0.00 C ATOM 415 C PHE A 29 -1.147 -2.114 -6.746 1.00 0.00 C ATOM 416 O PHE A 29 -0.112 -2.729 -6.512 1.00 0.00 O ATOM 417 CB PHE A 29 -3.302 -2.660 -5.604 1.00 0.00 C ATOM 418 CG PHE A 29 -3.195 -3.879 -4.705 1.00 0.00 C ATOM 419 CD1 PHE A 29 -2.296 -3.930 -3.646 1.00 0.00 C ATOM 420 CD2 PHE A 29 -4.015 -4.984 -4.923 1.00 0.00 C ATOM 421 CE1 PHE A 29 -2.227 -5.058 -2.840 1.00 0.00 C ATOM 422 CE2 PHE A 29 -3.946 -6.100 -4.117 1.00 0.00 C ATOM 423 CZ PHE A 29 -3.051 -6.137 -3.075 1.00 0.00 C ATOM 0 H PHE A 29 -3.532 -0.189 -5.604 1.00 0.00 H new ATOM 0 HA PHE A 29 -1.552 -1.829 -4.663 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -4.179 -2.087 -5.305 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.476 -2.999 -6.625 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -1.648 -3.088 -3.449 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -4.720 -4.966 -5.741 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -1.522 -5.090 -2.022 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -4.594 -6.944 -4.304 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.994 -7.010 -2.442 1.00 0.00 H new ATOM 433 N PRO A 30 -1.492 -1.751 -7.997 1.00 0.00 N ATOM 434 CA PRO A 30 -0.667 -2.058 -9.173 1.00 0.00 C ATOM 435 C PRO A 30 0.713 -1.422 -9.079 1.00 0.00 C ATOM 436 O PRO A 30 1.727 -2.048 -9.389 1.00 0.00 O ATOM 437 CB PRO A 30 -1.440 -1.433 -10.346 1.00 0.00 C ATOM 438 CG PRO A 30 -2.821 -1.198 -9.839 1.00 0.00 C ATOM 439 CD PRO A 30 -2.705 -1.006 -8.356 1.00 0.00 C ATOM 0 HA PRO A 30 -0.503 -3.131 -9.276 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -0.977 -0.500 -10.667 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -1.448 -2.099 -11.209 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.263 -0.320 -10.310 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -3.468 -2.044 -10.071 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -2.618 0.049 -8.095 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -3.580 -1.392 -7.834 1.00 0.00 H new ATOM 447 N LEU A 31 0.730 -0.160 -8.666 1.00 0.00 N ATOM 448 CA LEU A 31 1.974 0.599 -8.545 1.00 0.00 C ATOM 449 C LEU A 31 2.812 0.099 -7.367 1.00 0.00 C ATOM 450 O LEU A 31 4.020 -0.160 -7.485 1.00 0.00 O ATOM 451 CB LEU A 31 1.654 2.082 -8.376 1.00 0.00 C ATOM 452 CG LEU A 31 0.555 2.609 -9.301 1.00 0.00 C ATOM 453 CD1 LEU A 31 -0.032 3.913 -8.779 1.00 0.00 C ATOM 454 CD2 LEU A 31 1.101 2.790 -10.702 1.00 0.00 C ATOM 0 H LEU A 31 -0.107 0.363 -8.408 1.00 0.00 H new ATOM 0 HA LEU A 31 2.558 0.456 -9.454 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.356 2.260 -7.343 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.563 2.658 -8.550 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.250 1.875 -9.327 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.810 4.260 -9.459 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.461 3.749 -7.791 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.754 4.665 -8.713 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.312 3.165 -11.354 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.925 3.503 -10.682 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.459 1.832 -11.080 1.00 0.00 H new ATOM 466 N ILE A 32 2.153 -0.067 -6.234 1.00 0.00 N ATOM 467 CA ILE A 32 2.818 -0.554 -5.044 1.00 0.00 C ATOM 468 C ILE A 32 3.245 -1.995 -5.269 1.00 0.00 C ATOM 469 O ILE A 32 4.374 -2.363 -4.970 1.00 0.00 O ATOM 470 CB ILE A 32 1.903 -0.438 -3.809 1.00 0.00 C ATOM 471 CG1 ILE A 32 2.691 -0.654 -2.509 1.00 0.00 C ATOM 472 CG2 ILE A 32 0.746 -1.411 -3.920 1.00 0.00 C ATOM 473 CD1 ILE A 32 3.255 -2.038 -2.345 1.00 0.00 C ATOM 0 H ILE A 32 1.159 0.129 -6.115 1.00 0.00 H new ATOM 0 HA ILE A 32 3.699 0.058 -4.851 1.00 0.00 H new ATOM 0 HB ILE A 32 1.498 0.573 -3.776 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.509 0.065 -2.471 1.00 0.00 H new ATOM 0 HG13 ILE A 32 2.038 -0.439 -1.663 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.108 -1.319 -3.041 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.166 -1.186 -4.815 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.131 -2.429 -3.983 1.00 0.00 H new ATOM 0 HD11 ILE A 32 3.795 -2.101 -1.401 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.443 -2.765 -2.347 1.00 0.00 H new ATOM 0 HD13 ILE A 32 3.937 -2.253 -3.168 1.00 0.00 H new ATOM 485 N GLN A 33 2.349 -2.805 -5.837 1.00 0.00 N ATOM 486 CA GLN A 33 2.676 -4.194 -6.127 1.00 0.00 C ATOM 487 C GLN A 33 4.068 -4.284 -6.752 1.00 0.00 C ATOM 488 O GLN A 33 4.868 -5.154 -6.408 1.00 0.00 O ATOM 489 CB GLN A 33 1.647 -4.826 -7.067 1.00 0.00 C ATOM 490 CG GLN A 33 0.818 -5.909 -6.399 1.00 0.00 C ATOM 491 CD GLN A 33 -0.220 -6.508 -7.324 1.00 0.00 C ATOM 492 OE1 GLN A 33 0.112 -7.221 -8.273 1.00 0.00 O ATOM 493 NE2 GLN A 33 -1.488 -6.226 -7.052 1.00 0.00 N ATOM 0 H GLN A 33 1.405 -2.524 -6.101 1.00 0.00 H new ATOM 0 HA GLN A 33 2.660 -4.744 -5.186 1.00 0.00 H new ATOM 0 HB2 GLN A 33 0.983 -4.049 -7.444 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.163 -5.251 -7.928 1.00 0.00 H new ATOM 0 HG2 GLN A 33 1.480 -6.699 -6.043 1.00 0.00 H new ATOM 0 HG3 GLN A 33 0.320 -5.491 -5.524 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -1.719 -5.631 -6.256 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -2.232 -6.604 -7.639 1.00 0.00 H new ATOM 502 N ALA A 34 4.345 -3.364 -7.680 1.00 0.00 N ATOM 503 CA ALA A 34 5.637 -3.321 -8.364 1.00 0.00 C ATOM 504 C ALA A 34 6.784 -3.201 -7.375 1.00 0.00 C ATOM 505 O ALA A 34 7.864 -3.759 -7.581 1.00 0.00 O ATOM 506 CB ALA A 34 5.674 -2.171 -9.362 1.00 0.00 C ATOM 0 H ALA A 34 3.690 -2.639 -7.974 1.00 0.00 H new ATOM 0 HA ALA A 34 5.758 -4.260 -8.905 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.643 -2.154 -9.862 1.00 0.00 H new ATOM 0 HB2 ALA A 34 4.886 -2.306 -10.103 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.520 -1.228 -8.837 1.00 0.00 H new ATOM 512 N MET A 35 6.543 -2.466 -6.306 1.00 0.00 N ATOM 513 CA MET A 35 7.565 -2.262 -5.275 1.00 0.00 C ATOM 514 C MET A 35 7.355 -3.190 -4.073 1.00 0.00 C ATOM 515 O MET A 35 8.273 -3.903 -3.666 1.00 0.00 O ATOM 516 CB MET A 35 7.573 -0.803 -4.821 1.00 0.00 C ATOM 517 CG MET A 35 7.506 0.181 -5.977 1.00 0.00 C ATOM 518 SD MET A 35 8.241 1.778 -5.584 1.00 0.00 S ATOM 519 CE MET A 35 7.045 2.880 -6.330 1.00 0.00 C ATOM 0 H MET A 35 5.655 -1.999 -6.121 1.00 0.00 H new ATOM 0 HA MET A 35 8.531 -2.507 -5.716 1.00 0.00 H new ATOM 0 HB2 MET A 35 6.727 -0.631 -4.156 1.00 0.00 H new ATOM 0 HB3 MET A 35 8.477 -0.614 -4.242 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.017 -0.246 -6.840 1.00 0.00 H new ATOM 0 HG3 MET A 35 6.464 0.327 -6.263 1.00 0.00 H new ATOM 0 HE1 MET A 35 6.966 3.789 -5.734 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.366 3.135 -7.340 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.073 2.388 -6.371 1.00 0.00 H new ATOM 529 N HIS A 36 6.145 -3.197 -3.522 1.00 0.00 N ATOM 530 CA HIS A 36 5.820 -4.058 -2.385 1.00 0.00 C ATOM 531 C HIS A 36 6.726 -3.797 -1.190 1.00 0.00 C ATOM 532 O HIS A 36 7.236 -4.733 -0.572 1.00 0.00 O ATOM 533 CB HIS A 36 5.905 -5.535 -2.776 1.00 0.00 C ATOM 534 CG HIS A 36 4.588 -6.118 -3.163 1.00 0.00 C ATOM 535 ND1 HIS A 36 4.430 -7.408 -3.620 1.00 0.00 N ATOM 536 CD2 HIS A 36 3.357 -5.572 -3.153 1.00 0.00 C ATOM 537 CE1 HIS A 36 3.153 -7.629 -3.877 1.00 0.00 C ATOM 538 NE2 HIS A 36 2.478 -6.530 -3.600 1.00 0.00 N ATOM 0 H HIS A 36 5.371 -2.616 -3.844 1.00 0.00 H new ATOM 0 HA HIS A 36 4.797 -3.818 -2.095 1.00 0.00 H new ATOM 0 HB2 HIS A 36 6.602 -5.644 -3.607 1.00 0.00 H new ATOM 0 HB3 HIS A 36 6.314 -6.102 -1.940 1.00 0.00 H new ATOM 0 HD1 HIS A 36 5.182 -8.087 -3.741 1.00 0.00 H new ATOM 0 HD2 HIS A 36 3.106 -4.566 -2.850 1.00 0.00 H new ATOM 0 HE1 HIS A 36 2.734 -8.552 -4.250 1.00 0.00 H new ATOM 546 N PRO A 37 6.923 -2.529 -0.820 1.00 0.00 N ATOM 547 CA PRO A 37 7.747 -2.189 0.328 1.00 0.00 C ATOM 548 C PRO A 37 7.154 -2.773 1.607 1.00 0.00 C ATOM 549 O PRO A 37 7.680 -3.738 2.162 1.00 0.00 O ATOM 550 CB PRO A 37 7.738 -0.655 0.357 1.00 0.00 C ATOM 551 CG PRO A 37 6.568 -0.248 -0.471 1.00 0.00 C ATOM 552 CD PRO A 37 6.342 -1.345 -1.466 1.00 0.00 C ATOM 0 HA PRO A 37 8.757 -2.592 0.257 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.645 -0.282 1.377 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.665 -0.249 -0.048 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.685 -0.102 0.152 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.762 0.698 -0.976 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.281 -1.483 -1.675 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.829 -1.129 -2.417 1.00 0.00 H new ATOM 560 N THR A 38 6.075 -2.163 2.091 1.00 0.00 N ATOM 561 CA THR A 38 5.433 -2.605 3.328 1.00 0.00 C ATOM 562 C THR A 38 4.222 -3.496 3.061 1.00 0.00 C ATOM 563 O THR A 38 4.149 -4.618 3.561 1.00 0.00 O ATOM 564 CB THR A 38 5.014 -1.399 4.178 1.00 0.00 C ATOM 565 OG1 THR A 38 3.767 -0.887 3.746 1.00 0.00 O ATOM 566 CG2 THR A 38 6.013 -0.259 4.151 1.00 0.00 C ATOM 0 H THR A 38 5.626 -1.362 1.647 1.00 0.00 H new ATOM 0 HA THR A 38 6.167 -3.197 3.875 1.00 0.00 H new ATOM 0 HB THR A 38 4.954 -1.780 5.198 1.00 0.00 H new ATOM 0 HG1 THR A 38 3.518 -0.120 4.302 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.650 0.558 4.774 1.00 0.00 H new ATOM 0 HG22 THR A 38 6.973 -0.607 4.533 1.00 0.00 H new ATOM 0 HG23 THR A 38 6.136 0.093 3.127 1.00 0.00 H new ATOM 574 N LEU A 39 3.266 -2.997 2.283 1.00 0.00 N ATOM 575 CA LEU A 39 2.066 -3.769 1.977 1.00 0.00 C ATOM 576 C LEU A 39 1.244 -3.104 0.882 1.00 0.00 C ATOM 577 O LEU A 39 0.615 -2.073 1.104 1.00 0.00 O ATOM 578 CB LEU A 39 1.215 -3.939 3.238 1.00 0.00 C ATOM 579 CG LEU A 39 1.361 -5.295 3.936 1.00 0.00 C ATOM 580 CD1 LEU A 39 1.688 -5.115 5.414 1.00 0.00 C ATOM 581 CD2 LEU A 39 0.091 -6.117 3.763 1.00 0.00 C ATOM 0 H LEU A 39 3.297 -2.071 1.857 1.00 0.00 H new ATOM 0 HA LEU A 39 2.380 -4.749 1.617 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.478 -3.152 3.945 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.167 -3.793 2.974 1.00 0.00 H new ATOM 0 HG LEU A 39 2.189 -5.832 3.472 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.786 -6.092 5.887 1.00 0.00 H new ATOM 0 HD12 LEU A 39 2.625 -4.567 5.515 1.00 0.00 H new ATOM 0 HD13 LEU A 39 0.887 -4.557 5.899 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.209 -7.078 4.264 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.752 -5.581 4.200 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.094 -6.281 2.702 1.00 0.00 H new ATOM 593 N ALA A 40 1.242 -3.708 -0.299 1.00 0.00 N ATOM 594 CA ALA A 40 0.488 -3.189 -1.436 1.00 0.00 C ATOM 595 C ALA A 40 -0.957 -2.850 -1.064 1.00 0.00 C ATOM 596 O ALA A 40 -1.432 -1.750 -1.351 1.00 0.00 O ATOM 597 CB ALA A 40 0.568 -4.192 -2.586 1.00 0.00 C ATOM 0 H ALA A 40 1.758 -4.565 -0.497 1.00 0.00 H new ATOM 0 HA ALA A 40 0.935 -2.248 -1.757 1.00 0.00 H new ATOM 0 HB1 ALA A 40 0.007 -3.812 -3.440 1.00 0.00 H new ATOM 0 HB2 ALA A 40 1.610 -4.336 -2.871 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.144 -5.145 -2.268 1.00 0.00 H new ATOM 603 N GLY A 41 -1.659 -3.790 -0.445 1.00 0.00 N ATOM 604 CA GLY A 41 -3.044 -3.558 -0.071 1.00 0.00 C ATOM 605 C GLY A 41 -3.209 -2.429 0.932 1.00 0.00 C ATOM 606 O GLY A 41 -4.090 -1.582 0.782 1.00 0.00 O ATOM 0 H GLY A 41 -1.296 -4.710 -0.194 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.622 -3.328 -0.966 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.459 -4.474 0.350 1.00 0.00 H new ATOM 610 N LYS A 42 -2.374 -2.432 1.967 1.00 0.00 N ATOM 611 CA LYS A 42 -2.440 -1.417 3.015 1.00 0.00 C ATOM 612 C LYS A 42 -1.865 -0.069 2.564 1.00 0.00 C ATOM 613 O LYS A 42 -2.452 0.976 2.840 1.00 0.00 O ATOM 614 CB LYS A 42 -1.709 -1.907 4.265 1.00 0.00 C ATOM 615 CG LYS A 42 -2.646 -2.375 5.367 1.00 0.00 C ATOM 616 CD LYS A 42 -2.836 -1.301 6.428 1.00 0.00 C ATOM 617 CE LYS A 42 -3.981 -1.639 7.371 1.00 0.00 C ATOM 618 NZ LYS A 42 -5.082 -0.638 7.295 1.00 0.00 N ATOM 0 H LYS A 42 -1.641 -3.128 2.103 1.00 0.00 H new ATOM 0 HA LYS A 42 -3.494 -1.257 3.243 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.045 -2.726 3.991 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.082 -1.103 4.649 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -3.612 -2.639 4.937 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -2.245 -3.278 5.828 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.915 -1.187 7.000 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.032 -0.343 5.946 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.372 -2.627 7.127 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -3.606 -1.688 8.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.996 -1.117 7.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -4.955 0.075 8.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.064 -0.172 6.365 1.00 0.00 H new ATOM 632 N ILE A 43 -0.726 -0.086 1.868 1.00 0.00 N ATOM 633 CA ILE A 43 -0.112 1.158 1.399 1.00 0.00 C ATOM 634 C ILE A 43 -1.117 1.964 0.590 1.00 0.00 C ATOM 635 O ILE A 43 -1.215 3.185 0.721 1.00 0.00 O ATOM 636 CB ILE A 43 1.158 0.895 0.537 1.00 0.00 C ATOM 637 CG1 ILE A 43 2.383 1.541 1.185 1.00 0.00 C ATOM 638 CG2 ILE A 43 0.990 1.420 -0.887 1.00 0.00 C ATOM 639 CD1 ILE A 43 3.606 0.652 1.215 1.00 0.00 C ATOM 0 H ILE A 43 -0.216 -0.934 1.620 1.00 0.00 H new ATOM 0 HA ILE A 43 0.193 1.721 2.281 1.00 0.00 H new ATOM 0 HB ILE A 43 1.302 -0.184 0.485 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.626 2.457 0.646 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.131 1.829 2.206 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.896 1.218 -1.458 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.144 0.922 -1.361 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.810 2.495 -0.860 1.00 0.00 H new ATOM 0 HD11 ILE A 43 4.431 1.183 1.690 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.384 -0.253 1.780 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.886 0.384 0.196 1.00 0.00 H new ATOM 651 N THR A 44 -1.849 1.259 -0.254 1.00 0.00 N ATOM 652 CA THR A 44 -2.848 1.868 -1.114 1.00 0.00 C ATOM 653 C THR A 44 -3.868 2.665 -0.310 1.00 0.00 C ATOM 654 O THR A 44 -4.160 3.817 -0.626 1.00 0.00 O ATOM 655 CB THR A 44 -3.552 0.770 -1.917 1.00 0.00 C ATOM 656 OG1 THR A 44 -2.638 0.104 -2.770 1.00 0.00 O ATOM 657 CG2 THR A 44 -4.699 1.268 -2.771 1.00 0.00 C ATOM 0 H THR A 44 -1.768 0.248 -0.363 1.00 0.00 H new ATOM 0 HA THR A 44 -2.348 2.563 -1.789 1.00 0.00 H new ATOM 0 HB THR A 44 -3.959 0.095 -1.164 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.136 -0.562 -2.255 1.00 0.00 H new ATOM 0 HG21 THR A 44 -5.144 0.430 -3.307 1.00 0.00 H new ATOM 0 HG22 THR A 44 -5.452 1.732 -2.134 1.00 0.00 H new ATOM 0 HG23 THR A 44 -4.328 2.001 -3.487 1.00 0.00 H new ATOM 665 N GLY A 45 -4.409 2.054 0.733 1.00 0.00 N ATOM 666 CA GLY A 45 -5.393 2.731 1.551 1.00 0.00 C ATOM 667 C GLY A 45 -4.903 4.067 2.064 1.00 0.00 C ATOM 668 O GLY A 45 -5.691 4.989 2.275 1.00 0.00 O ATOM 0 H GLY A 45 -4.185 1.103 1.027 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.303 2.881 0.969 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.656 2.096 2.397 1.00 0.00 H new ATOM 672 N MET A 46 -3.596 4.169 2.264 1.00 0.00 N ATOM 673 CA MET A 46 -2.988 5.393 2.758 1.00 0.00 C ATOM 674 C MET A 46 -2.894 6.445 1.663 1.00 0.00 C ATOM 675 O MET A 46 -3.430 7.543 1.799 1.00 0.00 O ATOM 676 CB MET A 46 -1.601 5.103 3.316 1.00 0.00 C ATOM 677 CG MET A 46 -1.559 3.898 4.238 1.00 0.00 C ATOM 678 SD MET A 46 -2.550 4.116 5.728 1.00 0.00 S ATOM 679 CE MET A 46 -2.410 2.487 6.461 1.00 0.00 C ATOM 0 H MET A 46 -2.934 3.413 2.090 1.00 0.00 H new ATOM 0 HA MET A 46 -3.623 5.784 3.553 1.00 0.00 H new ATOM 0 HB2 MET A 46 -0.911 4.941 2.488 1.00 0.00 H new ATOM 0 HB3 MET A 46 -1.246 5.979 3.859 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.914 3.021 3.697 1.00 0.00 H new ATOM 0 HG3 MET A 46 -0.525 3.700 4.522 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.380 2.178 6.850 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.079 1.775 5.705 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.685 2.515 7.275 1.00 0.00 H new ATOM 689 N LEU A 47 -2.189 6.113 0.585 1.00 0.00 N ATOM 690 CA LEU A 47 -2.013 7.054 -0.510 1.00 0.00 C ATOM 691 C LEU A 47 -3.363 7.487 -1.057 1.00 0.00 C ATOM 692 O LEU A 47 -3.465 8.544 -1.681 1.00 0.00 O ATOM 693 CB LEU A 47 -1.156 6.441 -1.624 1.00 0.00 C ATOM 694 CG LEU A 47 0.316 6.159 -1.289 1.00 0.00 C ATOM 695 CD1 LEU A 47 1.232 7.141 -2.011 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.571 6.192 0.209 1.00 0.00 C ATOM 0 H LEU A 47 -1.736 5.209 0.449 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.494 7.932 -0.126 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -1.620 5.504 -1.933 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.187 7.110 -2.484 1.00 0.00 H new ATOM 0 HG LEU A 47 0.541 5.151 -1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.270 6.923 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.092 7.045 -3.088 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.990 8.158 -1.703 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.624 5.988 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.314 7.176 0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -0.042 5.436 0.699 1.00 0.00 H new ATOM 708 N LEU A 48 -4.397 6.664 -0.850 1.00 0.00 N ATOM 709 CA LEU A 48 -5.743 6.970 -1.349 1.00 0.00 C ATOM 710 C LEU A 48 -6.258 8.342 -0.876 1.00 0.00 C ATOM 711 O LEU A 48 -7.458 8.608 -0.938 1.00 0.00 O ATOM 712 CB LEU A 48 -6.732 5.880 -0.900 1.00 0.00 C ATOM 713 CG LEU A 48 -7.404 5.104 -2.038 1.00 0.00 C ATOM 714 CD1 LEU A 48 -6.388 4.236 -2.753 1.00 0.00 C ATOM 715 CD2 LEU A 48 -8.556 4.253 -1.517 1.00 0.00 C ATOM 0 H LEU A 48 -4.328 5.783 -0.341 1.00 0.00 H new ATOM 0 HA LEU A 48 -5.673 7.000 -2.436 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.204 5.173 -0.261 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -7.507 6.343 -0.290 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.812 5.826 -2.746 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.879 3.690 -3.559 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -5.600 4.865 -3.168 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.954 3.528 -2.047 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -9.014 3.714 -2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.179 3.540 -0.784 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -9.300 4.896 -1.047 1.00 0.00 H new ATOM 727 N GLU A 49 -5.362 9.207 -0.407 1.00 0.00 N ATOM 728 CA GLU A 49 -5.745 10.527 0.064 1.00 0.00 C ATOM 729 C GLU A 49 -6.092 11.450 -1.104 1.00 0.00 C ATOM 730 O GLU A 49 -6.599 12.553 -0.901 1.00 0.00 O ATOM 731 CB GLU A 49 -4.604 11.141 0.879 1.00 0.00 C ATOM 732 CG GLU A 49 -5.077 12.026 2.017 1.00 0.00 C ATOM 733 CD GLU A 49 -5.385 13.439 1.567 1.00 0.00 C ATOM 734 OE1 GLU A 49 -4.442 14.257 1.489 1.00 0.00 O ATOM 735 OE2 GLU A 49 -6.567 13.730 1.293 1.00 0.00 O ATOM 0 H GLU A 49 -4.363 9.012 -0.345 1.00 0.00 H new ATOM 0 HA GLU A 49 -6.629 10.418 0.692 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.987 10.340 1.286 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.969 11.727 0.215 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.969 11.589 2.465 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.312 12.054 2.793 1.00 0.00 H new ATOM 742 N ILE A 50 -5.817 10.999 -2.325 1.00 0.00 N ATOM 743 CA ILE A 50 -6.105 11.797 -3.510 1.00 0.00 C ATOM 744 C ILE A 50 -7.277 11.196 -4.299 1.00 0.00 C ATOM 745 O ILE A 50 -7.753 10.109 -3.970 1.00 0.00 O ATOM 746 CB ILE A 50 -4.833 11.928 -4.384 1.00 0.00 C ATOM 747 CG1 ILE A 50 -4.898 13.164 -5.293 1.00 0.00 C ATOM 748 CG2 ILE A 50 -4.588 10.662 -5.194 1.00 0.00 C ATOM 749 CD1 ILE A 50 -5.469 14.395 -4.617 1.00 0.00 C ATOM 0 H ILE A 50 -5.397 10.090 -2.518 1.00 0.00 H new ATOM 0 HA ILE A 50 -6.404 12.798 -3.199 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.987 12.062 -3.710 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.894 13.392 -5.652 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.504 12.928 -6.168 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.688 10.784 -5.797 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.459 9.817 -4.518 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.441 10.477 -5.847 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.482 15.225 -5.323 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -6.485 14.188 -4.282 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -4.851 14.659 -3.759 1.00 0.00 H new ATOM 761 N ASP A 51 -7.729 11.884 -5.349 1.00 0.00 N ATOM 762 CA ASP A 51 -8.822 11.387 -6.178 1.00 0.00 C ATOM 763 C ASP A 51 -8.360 10.233 -7.064 1.00 0.00 C ATOM 764 O ASP A 51 -7.230 10.234 -7.548 1.00 0.00 O ATOM 765 CB ASP A 51 -9.392 12.518 -7.037 1.00 0.00 C ATOM 766 CG ASP A 51 -10.012 13.621 -6.201 1.00 0.00 C ATOM 767 OD1 ASP A 51 -10.913 13.316 -5.393 1.00 0.00 O ATOM 768 OD2 ASP A 51 -9.593 14.788 -6.352 1.00 0.00 O ATOM 0 H ASP A 51 -7.354 12.786 -5.643 1.00 0.00 H new ATOM 0 HA ASP A 51 -9.605 11.014 -5.517 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -8.598 12.937 -7.655 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -10.144 12.113 -7.715 1.00 0.00 H new ATOM 773 N ASN A 52 -9.238 9.255 -7.289 1.00 0.00 N ATOM 774 CA ASN A 52 -8.897 8.112 -8.140 1.00 0.00 C ATOM 775 C ASN A 52 -8.279 8.576 -9.464 1.00 0.00 C ATOM 776 O ASN A 52 -7.549 7.829 -10.113 1.00 0.00 O ATOM 777 CB ASN A 52 -10.142 7.258 -8.430 1.00 0.00 C ATOM 778 CG ASN A 52 -9.813 5.995 -9.213 1.00 0.00 C ATOM 779 OD1 ASN A 52 -8.650 5.725 -9.512 1.00 0.00 O ATOM 780 ND2 ASN A 52 -10.839 5.210 -9.546 1.00 0.00 N ATOM 0 H ASN A 52 -10.180 9.229 -6.899 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.166 7.509 -7.601 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -10.618 6.984 -7.489 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -10.863 7.852 -8.991 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -10.674 4.349 -10.068 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -11.788 5.470 -9.279 1.00 0.00 H new ATOM 787 N SER A 53 -8.588 9.809 -9.863 1.00 0.00 N ATOM 788 CA SER A 53 -8.082 10.362 -11.119 1.00 0.00 C ATOM 789 C SER A 53 -6.601 10.727 -11.039 1.00 0.00 C ATOM 790 O SER A 53 -5.886 10.678 -12.042 1.00 0.00 O ATOM 791 CB SER A 53 -8.899 11.597 -11.504 1.00 0.00 C ATOM 792 OG SER A 53 -9.618 11.381 -12.704 1.00 0.00 O ATOM 0 H SER A 53 -9.186 10.444 -9.335 1.00 0.00 H new ATOM 0 HA SER A 53 -8.186 9.590 -11.881 1.00 0.00 H new ATOM 0 HB2 SER A 53 -9.593 11.842 -10.700 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.235 12.453 -11.624 1.00 0.00 H new ATOM 0 HG SER A 53 -10.133 12.185 -12.926 1.00 0.00 H new ATOM 798 N GLU A 54 -6.145 11.105 -9.854 1.00 0.00 N ATOM 799 CA GLU A 54 -4.751 11.492 -9.662 1.00 0.00 C ATOM 800 C GLU A 54 -3.842 10.271 -9.655 1.00 0.00 C ATOM 801 O GLU A 54 -2.800 10.256 -10.312 1.00 0.00 O ATOM 802 CB GLU A 54 -4.600 12.261 -8.351 1.00 0.00 C ATOM 803 CG GLU A 54 -3.969 13.633 -8.514 1.00 0.00 C ATOM 804 CD GLU A 54 -2.580 13.714 -7.910 1.00 0.00 C ATOM 805 OE1 GLU A 54 -2.245 12.852 -7.070 1.00 0.00 O ATOM 806 OE2 GLU A 54 -1.827 14.638 -8.278 1.00 0.00 O ATOM 0 H GLU A 54 -6.717 11.153 -9.011 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.456 12.133 -10.493 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -5.582 12.375 -7.893 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -3.994 11.672 -7.663 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.915 13.880 -9.574 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.609 14.381 -8.045 1.00 0.00 H new ATOM 813 N LEU A 55 -4.239 9.251 -8.910 1.00 0.00 N ATOM 814 CA LEU A 55 -3.457 8.028 -8.821 1.00 0.00 C ATOM 815 C LEU A 55 -3.324 7.370 -10.191 1.00 0.00 C ATOM 816 O LEU A 55 -2.355 6.660 -10.457 1.00 0.00 O ATOM 817 CB LEU A 55 -4.098 7.081 -7.811 1.00 0.00 C ATOM 818 CG LEU A 55 -4.348 7.719 -6.441 1.00 0.00 C ATOM 819 CD1 LEU A 55 -5.826 7.683 -6.092 1.00 0.00 C ATOM 820 CD2 LEU A 55 -3.520 7.040 -5.359 1.00 0.00 C ATOM 0 H LEU A 55 -5.097 9.246 -8.359 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.452 8.272 -8.478 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.045 6.722 -8.213 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.455 6.210 -7.684 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.035 8.762 -6.495 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.980 8.141 -5.115 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.391 8.233 -6.844 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.169 6.649 -6.066 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -3.718 7.514 -4.398 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -3.787 5.985 -5.305 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.461 7.134 -5.598 1.00 0.00 H new ATOM 832 N LEU A 56 -4.291 7.633 -11.065 1.00 0.00 N ATOM 833 CA LEU A 56 -4.258 7.087 -12.417 1.00 0.00 C ATOM 834 C LEU A 56 -3.105 7.710 -13.201 1.00 0.00 C ATOM 835 O LEU A 56 -2.370 7.018 -13.905 1.00 0.00 O ATOM 836 CB LEU A 56 -5.584 7.339 -13.133 1.00 0.00 C ATOM 837 CG LEU A 56 -6.763 6.517 -12.606 1.00 0.00 C ATOM 838 CD1 LEU A 56 -8.084 7.145 -13.024 1.00 0.00 C ATOM 839 CD2 LEU A 56 -6.668 5.079 -13.093 1.00 0.00 C ATOM 0 H LEU A 56 -5.102 8.217 -10.863 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.104 6.010 -12.354 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -5.831 8.397 -13.050 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.455 7.125 -14.194 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.722 6.512 -11.517 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.909 6.546 -12.640 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.150 8.155 -12.620 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.140 7.184 -14.112 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.514 4.508 -12.709 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.683 5.062 -14.183 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.739 4.635 -12.736 1.00 0.00 H new ATOM 851 N HIS A 57 -2.953 9.027 -13.064 1.00 0.00 N ATOM 852 CA HIS A 57 -1.888 9.757 -13.748 1.00 0.00 C ATOM 853 C HIS A 57 -0.523 9.184 -13.385 1.00 0.00 C ATOM 854 O HIS A 57 0.400 9.177 -14.198 1.00 0.00 O ATOM 855 CB HIS A 57 -1.935 11.238 -13.373 1.00 0.00 C ATOM 856 CG HIS A 57 -2.845 12.047 -14.239 1.00 0.00 C ATOM 857 ND1 HIS A 57 -2.790 12.030 -15.616 1.00 0.00 N ATOM 858 CD2 HIS A 57 -3.838 12.910 -13.917 1.00 0.00 C ATOM 859 CE1 HIS A 57 -3.708 12.844 -16.104 1.00 0.00 C ATOM 860 NE2 HIS A 57 -4.356 13.391 -15.093 1.00 0.00 N ATOM 0 H HIS A 57 -3.556 9.611 -12.484 1.00 0.00 H new ATOM 0 HA HIS A 57 -2.041 9.652 -14.822 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -2.257 11.331 -12.336 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -0.928 11.651 -13.433 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -2.140 11.474 -16.172 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -4.162 13.171 -12.920 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -3.896 13.030 -17.151 1.00 0.00 H new ATOM 868 N MET A 58 -0.409 8.703 -12.157 1.00 0.00 N ATOM 869 CA MET A 58 0.834 8.123 -11.670 1.00 0.00 C ATOM 870 C MET A 58 1.170 6.856 -12.447 1.00 0.00 C ATOM 871 O MET A 58 2.311 6.640 -12.853 1.00 0.00 O ATOM 872 CB MET A 58 0.701 7.799 -10.184 1.00 0.00 C ATOM 873 CG MET A 58 0.066 8.915 -9.369 1.00 0.00 C ATOM 874 SD MET A 58 0.051 8.576 -7.596 1.00 0.00 S ATOM 875 CE MET A 58 -0.571 6.895 -7.553 1.00 0.00 C ATOM 0 H MET A 58 -1.167 8.703 -11.475 1.00 0.00 H new ATOM 0 HA MET A 58 1.639 8.844 -11.814 1.00 0.00 H new ATOM 0 HB2 MET A 58 0.104 6.894 -10.071 1.00 0.00 H new ATOM 0 HB3 MET A 58 1.689 7.582 -9.779 1.00 0.00 H new ATOM 0 HG2 MET A 58 0.608 9.843 -9.551 1.00 0.00 H new ATOM 0 HG3 MET A 58 -0.957 9.071 -9.712 1.00 0.00 H new ATOM 0 HE1 MET A 58 -1.266 6.785 -6.720 1.00 0.00 H new ATOM 0 HE2 MET A 58 -1.087 6.674 -8.487 1.00 0.00 H new ATOM 0 HE3 MET A 58 0.261 6.202 -7.425 1.00 0.00 H new ATOM 885 N LEU A 59 0.161 6.017 -12.636 1.00 0.00 N ATOM 886 CA LEU A 59 0.331 4.757 -13.347 1.00 0.00 C ATOM 887 C LEU A 59 0.817 4.994 -14.776 1.00 0.00 C ATOM 888 O LEU A 59 1.435 4.118 -15.378 1.00 0.00 O ATOM 889 CB LEU A 59 -0.994 3.978 -13.333 1.00 0.00 C ATOM 890 CG LEU A 59 -1.188 2.957 -14.461 1.00 0.00 C ATOM 891 CD1 LEU A 59 -1.625 1.613 -13.895 1.00 0.00 C ATOM 892 CD2 LEU A 59 -2.207 3.472 -15.467 1.00 0.00 C ATOM 0 H LEU A 59 -0.789 6.187 -12.305 1.00 0.00 H new ATOM 0 HA LEU A 59 1.094 4.165 -12.841 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.075 3.456 -12.380 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.814 4.695 -13.374 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.236 2.818 -14.973 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.758 0.901 -14.710 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.863 1.242 -13.209 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.567 1.732 -13.360 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.336 2.738 -16.263 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.161 3.636 -14.967 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.855 4.411 -15.893 1.00 0.00 H new ATOM 904 N GLU A 60 0.558 6.183 -15.309 1.00 0.00 N ATOM 905 CA GLU A 60 1.000 6.512 -16.659 1.00 0.00 C ATOM 906 C GLU A 60 2.345 7.248 -16.633 1.00 0.00 C ATOM 907 O GLU A 60 2.946 7.493 -17.679 1.00 0.00 O ATOM 908 CB GLU A 60 -0.060 7.350 -17.386 1.00 0.00 C ATOM 909 CG GLU A 60 -0.130 8.801 -16.935 1.00 0.00 C ATOM 910 CD GLU A 60 -0.178 9.771 -18.100 1.00 0.00 C ATOM 911 OE1 GLU A 60 0.334 9.423 -19.185 1.00 0.00 O ATOM 912 OE2 GLU A 60 -0.725 10.879 -17.926 1.00 0.00 O ATOM 0 H GLU A 60 0.050 6.928 -14.833 1.00 0.00 H new ATOM 0 HA GLU A 60 1.136 5.579 -17.206 1.00 0.00 H new ATOM 0 HB2 GLU A 60 0.145 7.324 -18.456 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.036 6.888 -17.237 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -1.014 8.942 -16.313 1.00 0.00 H new ATOM 0 HG3 GLU A 60 0.737 9.027 -16.314 1.00 0.00 H new ATOM 919 N SER A 61 2.815 7.593 -15.430 1.00 0.00 N ATOM 920 CA SER A 61 4.087 8.295 -15.275 1.00 0.00 C ATOM 921 C SER A 61 4.835 7.813 -14.030 1.00 0.00 C ATOM 922 O SER A 61 4.581 8.289 -12.923 1.00 0.00 O ATOM 923 CB SER A 61 3.853 9.804 -15.183 1.00 0.00 C ATOM 924 OG SER A 61 3.300 10.309 -16.385 1.00 0.00 O ATOM 0 H SER A 61 2.333 7.397 -14.553 1.00 0.00 H new ATOM 0 HA SER A 61 4.697 8.077 -16.151 1.00 0.00 H new ATOM 0 HB2 SER A 61 3.183 10.021 -14.351 1.00 0.00 H new ATOM 0 HB3 SER A 61 4.796 10.309 -14.973 1.00 0.00 H new ATOM 0 HG SER A 61 3.159 11.275 -16.300 1.00 0.00 H new ATOM 930 N PRO A 62 5.771 6.862 -14.195 1.00 0.00 N ATOM 931 CA PRO A 62 6.558 6.321 -13.077 1.00 0.00 C ATOM 932 C PRO A 62 7.199 7.418 -12.230 1.00 0.00 C ATOM 933 O PRO A 62 7.378 7.262 -11.022 1.00 0.00 O ATOM 934 CB PRO A 62 7.637 5.491 -13.776 1.00 0.00 C ATOM 935 CG PRO A 62 7.029 5.097 -15.077 1.00 0.00 C ATOM 936 CD PRO A 62 6.140 6.240 -15.482 1.00 0.00 C ATOM 0 HA PRO A 62 5.940 5.751 -12.383 1.00 0.00 H new ATOM 0 HB2 PRO A 62 8.548 6.071 -13.924 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.908 4.616 -13.185 1.00 0.00 H new ATOM 0 HG2 PRO A 62 7.798 4.916 -15.828 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.457 4.174 -14.977 1.00 0.00 H new ATOM 0 HD2 PRO A 62 6.661 6.943 -16.133 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.262 5.892 -16.026 1.00 0.00 H new ATOM 944 N GLU A 63 7.552 8.522 -12.877 1.00 0.00 N ATOM 945 CA GLU A 63 8.189 9.653 -12.203 1.00 0.00 C ATOM 946 C GLU A 63 7.353 10.164 -11.029 1.00 0.00 C ATOM 947 O GLU A 63 7.827 10.225 -9.895 1.00 0.00 O ATOM 948 CB GLU A 63 8.431 10.790 -13.200 1.00 0.00 C ATOM 949 CG GLU A 63 7.256 11.046 -14.135 1.00 0.00 C ATOM 950 CD GLU A 63 6.569 12.374 -13.875 1.00 0.00 C ATOM 951 OE1 GLU A 63 7.144 13.211 -13.148 1.00 0.00 O ATOM 952 OE2 GLU A 63 5.455 12.576 -14.400 1.00 0.00 O ATOM 0 H GLU A 63 7.407 8.661 -13.877 1.00 0.00 H new ATOM 0 HA GLU A 63 9.141 9.302 -11.805 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.651 11.704 -12.648 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.314 10.557 -13.796 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.608 11.021 -15.166 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.530 10.240 -14.026 1.00 0.00 H new ATOM 959 N SER A 64 6.108 10.526 -11.309 1.00 0.00 N ATOM 960 CA SER A 64 5.204 11.027 -10.279 1.00 0.00 C ATOM 961 C SER A 64 4.706 9.874 -9.430 1.00 0.00 C ATOM 962 O SER A 64 4.396 10.032 -8.252 1.00 0.00 O ATOM 963 CB SER A 64 4.022 11.762 -10.912 1.00 0.00 C ATOM 964 OG SER A 64 3.407 12.635 -9.980 1.00 0.00 O ATOM 0 H SER A 64 5.699 10.482 -12.242 1.00 0.00 H new ATOM 0 HA SER A 64 5.748 11.730 -9.648 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.364 12.330 -11.777 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.292 11.039 -11.274 1.00 0.00 H new ATOM 0 HG SER A 64 2.655 13.094 -10.409 1.00 0.00 H new ATOM 970 N LEU A 65 4.618 8.714 -10.056 1.00 0.00 N ATOM 971 CA LEU A 65 4.152 7.523 -9.383 1.00 0.00 C ATOM 972 C LEU A 65 5.011 7.219 -8.169 1.00 0.00 C ATOM 973 O LEU A 65 4.528 7.236 -7.035 1.00 0.00 O ATOM 974 CB LEU A 65 4.172 6.335 -10.348 1.00 0.00 C ATOM 975 CG LEU A 65 3.948 4.957 -9.720 1.00 0.00 C ATOM 976 CD1 LEU A 65 5.268 4.350 -9.276 1.00 0.00 C ATOM 977 CD2 LEU A 65 2.971 5.040 -8.554 1.00 0.00 C ATOM 0 H LEU A 65 4.866 8.575 -11.036 1.00 0.00 H new ATOM 0 HA LEU A 65 3.130 7.696 -9.047 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.406 6.496 -11.107 1.00 0.00 H new ATOM 0 HB3 LEU A 65 5.133 6.326 -10.862 1.00 0.00 H new ATOM 0 HG LEU A 65 3.510 4.307 -10.478 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.087 3.371 -8.832 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.927 4.242 -10.138 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.738 5.001 -8.539 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.830 4.047 -8.126 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.370 5.710 -7.792 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.013 5.422 -8.908 1.00 0.00 H new ATOM 989 N ARG A 66 6.280 6.931 -8.403 1.00 0.00 N ATOM 990 CA ARG A 66 7.182 6.608 -7.305 1.00 0.00 C ATOM 991 C ARG A 66 7.194 7.720 -6.271 1.00 0.00 C ATOM 992 O ARG A 66 7.321 7.468 -5.077 1.00 0.00 O ATOM 993 CB ARG A 66 8.599 6.353 -7.822 1.00 0.00 C ATOM 994 CG ARG A 66 9.339 5.282 -7.035 1.00 0.00 C ATOM 995 CD ARG A 66 9.968 4.241 -7.950 1.00 0.00 C ATOM 996 NE ARG A 66 11.427 4.339 -7.968 1.00 0.00 N ATOM 997 CZ ARG A 66 12.225 3.738 -7.087 1.00 0.00 C ATOM 998 NH1 ARG A 66 11.717 2.979 -6.123 1.00 0.00 N ATOM 999 NH2 ARG A 66 13.539 3.893 -7.173 1.00 0.00 N ATOM 0 H ARG A 66 6.707 6.913 -9.329 1.00 0.00 H new ATOM 0 HA ARG A 66 6.817 5.697 -6.830 1.00 0.00 H new ATOM 0 HB2 ARG A 66 8.549 6.056 -8.870 1.00 0.00 H new ATOM 0 HB3 ARG A 66 9.167 7.283 -7.781 1.00 0.00 H new ATOM 0 HG2 ARG A 66 10.115 5.748 -6.428 1.00 0.00 H new ATOM 0 HG3 ARG A 66 8.648 4.793 -6.349 1.00 0.00 H new ATOM 0 HD2 ARG A 66 9.675 3.244 -7.620 1.00 0.00 H new ATOM 0 HD3 ARG A 66 9.583 4.368 -8.962 1.00 0.00 H new ATOM 0 HE ARG A 66 11.860 4.902 -8.700 1.00 0.00 H new ATOM 0 HH11 ARG A 66 10.707 2.852 -6.052 1.00 0.00 H new ATOM 0 HH12 ARG A 66 12.336 2.523 -5.453 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.937 4.472 -7.913 1.00 0.00 H new ATOM 0 HH22 ARG A 66 14.152 3.434 -6.499 1.00 0.00 H new ATOM 1013 N SER A 67 7.043 8.948 -6.737 1.00 0.00 N ATOM 1014 CA SER A 67 7.026 10.106 -5.852 1.00 0.00 C ATOM 1015 C SER A 67 6.059 9.910 -4.685 1.00 0.00 C ATOM 1016 O SER A 67 6.401 10.165 -3.530 1.00 0.00 O ATOM 1017 CB SER A 67 6.628 11.355 -6.636 1.00 0.00 C ATOM 1018 OG SER A 67 7.746 11.933 -7.287 1.00 0.00 O ATOM 0 H SER A 67 6.930 9.172 -7.726 1.00 0.00 H new ATOM 0 HA SER A 67 8.030 10.226 -5.446 1.00 0.00 H new ATOM 0 HB2 SER A 67 5.868 11.097 -7.374 1.00 0.00 H new ATOM 0 HB3 SER A 67 6.181 12.084 -5.960 1.00 0.00 H new ATOM 0 HG SER A 67 7.895 11.481 -8.144 1.00 0.00 H new ATOM 1024 N LYS A 68 4.847 9.475 -4.999 1.00 0.00 N ATOM 1025 CA LYS A 68 3.818 9.273 -3.982 1.00 0.00 C ATOM 1026 C LYS A 68 3.989 7.941 -3.253 1.00 0.00 C ATOM 1027 O LYS A 68 3.949 7.892 -2.024 1.00 0.00 O ATOM 1028 CB LYS A 68 2.427 9.365 -4.621 1.00 0.00 C ATOM 1029 CG LYS A 68 2.364 10.322 -5.807 1.00 0.00 C ATOM 1030 CD LYS A 68 1.248 11.346 -5.656 1.00 0.00 C ATOM 1031 CE LYS A 68 1.496 12.570 -6.525 1.00 0.00 C ATOM 1032 NZ LYS A 68 0.439 13.605 -6.347 1.00 0.00 N ATOM 0 H LYS A 68 4.549 9.254 -5.949 1.00 0.00 H new ATOM 0 HA LYS A 68 3.924 10.062 -3.237 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.120 8.372 -4.949 1.00 0.00 H new ATOM 0 HB3 LYS A 68 1.710 9.687 -3.866 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.319 10.839 -5.907 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.212 9.753 -6.724 1.00 0.00 H new ATOM 0 HD2 LYS A 68 0.296 10.891 -5.929 1.00 0.00 H new ATOM 0 HD3 LYS A 68 1.169 11.649 -4.612 1.00 0.00 H new ATOM 0 HE2 LYS A 68 2.468 12.998 -6.279 1.00 0.00 H new ATOM 0 HE3 LYS A 68 1.536 12.269 -7.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.655 14.428 -6.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -0.483 13.210 -6.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 0.406 13.899 -5.350 1.00 0.00 H new ATOM 1046 N VAL A 69 4.186 6.865 -4.008 1.00 0.00 N ATOM 1047 CA VAL A 69 4.370 5.540 -3.419 1.00 0.00 C ATOM 1048 C VAL A 69 5.603 5.498 -2.528 1.00 0.00 C ATOM 1049 O VAL A 69 5.520 5.097 -1.366 1.00 0.00 O ATOM 1050 CB VAL A 69 4.510 4.466 -4.505 1.00 0.00 C ATOM 1051 CG1 VAL A 69 4.567 3.078 -3.879 1.00 0.00 C ATOM 1052 CG2 VAL A 69 3.370 4.578 -5.504 1.00 0.00 C ATOM 0 H VAL A 69 4.223 6.883 -5.027 1.00 0.00 H new ATOM 0 HA VAL A 69 3.484 5.336 -2.818 1.00 0.00 H new ATOM 0 HB VAL A 69 5.445 4.625 -5.042 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.666 2.329 -4.664 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.424 3.016 -3.208 1.00 0.00 H new ATOM 0 HG13 VAL A 69 3.652 2.895 -3.316 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.481 3.810 -6.270 1.00 0.00 H new ATOM 0 HG22 VAL A 69 2.419 4.442 -4.988 1.00 0.00 H new ATOM 0 HG23 VAL A 69 3.391 5.562 -5.971 1.00 0.00 H new ATOM 1062 N ASP A 70 6.747 5.920 -3.069 1.00 0.00 N ATOM 1063 CA ASP A 70 7.993 5.938 -2.302 1.00 0.00 C ATOM 1064 C ASP A 70 7.722 6.575 -0.954 1.00 0.00 C ATOM 1065 O ASP A 70 7.981 5.990 0.099 1.00 0.00 O ATOM 1066 CB ASP A 70 9.081 6.731 -3.040 1.00 0.00 C ATOM 1067 CG ASP A 70 10.374 5.956 -3.204 1.00 0.00 C ATOM 1068 OD1 ASP A 70 10.311 4.765 -3.572 1.00 0.00 O ATOM 1069 OD2 ASP A 70 11.451 6.546 -2.970 1.00 0.00 O ATOM 0 H ASP A 70 6.836 6.252 -4.029 1.00 0.00 H new ATOM 0 HA ASP A 70 8.349 4.916 -2.175 1.00 0.00 H new ATOM 0 HB2 ASP A 70 8.709 7.018 -4.024 1.00 0.00 H new ATOM 0 HB3 ASP A 70 9.284 7.653 -2.495 1.00 0.00 H new ATOM 1074 N GLU A 71 7.172 7.779 -1.006 1.00 0.00 N ATOM 1075 CA GLU A 71 6.823 8.516 0.191 1.00 0.00 C ATOM 1076 C GLU A 71 6.028 7.632 1.147 1.00 0.00 C ATOM 1077 O GLU A 71 6.364 7.526 2.325 1.00 0.00 O ATOM 1078 CB GLU A 71 6.040 9.762 -0.207 1.00 0.00 C ATOM 1079 CG GLU A 71 6.914 10.995 -0.380 1.00 0.00 C ATOM 1080 CD GLU A 71 8.251 10.692 -1.032 1.00 0.00 C ATOM 1081 OE1 GLU A 71 9.196 10.324 -0.303 1.00 0.00 O ATOM 1082 OE2 GLU A 71 8.353 10.821 -2.270 1.00 0.00 O ATOM 0 H GLU A 71 6.958 8.267 -1.876 1.00 0.00 H new ATOM 0 HA GLU A 71 7.727 8.825 0.716 1.00 0.00 H new ATOM 0 HB2 GLU A 71 5.511 9.567 -1.140 1.00 0.00 H new ATOM 0 HB3 GLU A 71 5.284 9.965 0.552 1.00 0.00 H new ATOM 0 HG2 GLU A 71 6.380 11.729 -0.984 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.087 11.450 0.595 1.00 0.00 H new ATOM 1089 N ALA A 72 4.991 6.973 0.631 1.00 0.00 N ATOM 1090 CA ALA A 72 4.173 6.078 1.447 1.00 0.00 C ATOM 1091 C ALA A 72 5.052 5.195 2.318 1.00 0.00 C ATOM 1092 O ALA A 72 4.878 5.116 3.532 1.00 0.00 O ATOM 1093 CB ALA A 72 3.308 5.199 0.557 1.00 0.00 C ATOM 0 H ALA A 72 4.699 7.042 -0.344 1.00 0.00 H new ATOM 0 HA ALA A 72 3.536 6.690 2.086 1.00 0.00 H new ATOM 0 HB1 ALA A 72 2.703 4.537 1.177 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.654 5.826 -0.049 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.946 4.603 -0.096 1.00 0.00 H new ATOM 1099 N VAL A 73 5.999 4.535 1.674 1.00 0.00 N ATOM 1100 CA VAL A 73 6.921 3.645 2.360 1.00 0.00 C ATOM 1101 C VAL A 73 7.599 4.328 3.538 1.00 0.00 C ATOM 1102 O VAL A 73 7.681 3.760 4.618 1.00 0.00 O ATOM 1103 CB VAL A 73 8.002 3.112 1.402 1.00 0.00 C ATOM 1104 CG1 VAL A 73 8.771 1.963 2.038 1.00 0.00 C ATOM 1105 CG2 VAL A 73 7.378 2.682 0.084 1.00 0.00 C ATOM 0 H VAL A 73 6.151 4.600 0.667 1.00 0.00 H new ATOM 0 HA VAL A 73 6.323 2.813 2.732 1.00 0.00 H new ATOM 0 HB VAL A 73 8.709 3.917 1.200 1.00 0.00 H new ATOM 0 HG11 VAL A 73 9.529 1.603 1.342 1.00 0.00 H new ATOM 0 HG12 VAL A 73 9.253 2.310 2.952 1.00 0.00 H new ATOM 0 HG13 VAL A 73 8.083 1.152 2.276 1.00 0.00 H new ATOM 0 HG21 VAL A 73 8.156 2.308 -0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.647 1.894 0.267 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.883 3.535 -0.380 1.00 0.00 H new ATOM 1115 N ALA A 74 8.098 5.541 3.326 1.00 0.00 N ATOM 1116 CA ALA A 74 8.778 6.275 4.385 1.00 0.00 C ATOM 1117 C ALA A 74 7.798 6.810 5.431 1.00 0.00 C ATOM 1118 O ALA A 74 7.979 6.587 6.628 1.00 0.00 O ATOM 1119 CB ALA A 74 9.597 7.413 3.798 1.00 0.00 C ATOM 0 H ALA A 74 8.045 6.034 2.435 1.00 0.00 H new ATOM 0 HA ALA A 74 9.446 5.577 4.889 1.00 0.00 H new ATOM 0 HB1 ALA A 74 10.099 7.952 4.601 1.00 0.00 H new ATOM 0 HB2 ALA A 74 10.341 7.009 3.111 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.939 8.095 3.260 1.00 0.00 H new ATOM 1125 N VAL A 75 6.771 7.529 4.978 1.00 0.00 N ATOM 1126 CA VAL A 75 5.779 8.104 5.884 1.00 0.00 C ATOM 1127 C VAL A 75 4.958 7.033 6.577 1.00 0.00 C ATOM 1128 O VAL A 75 4.926 6.950 7.805 1.00 0.00 O ATOM 1129 CB VAL A 75 4.847 9.078 5.143 1.00 0.00 C ATOM 1130 CG1 VAL A 75 4.062 8.410 4.024 1.00 0.00 C ATOM 1131 CG2 VAL A 75 3.921 9.793 6.115 1.00 0.00 C ATOM 0 H VAL A 75 6.605 7.726 3.991 1.00 0.00 H new ATOM 0 HA VAL A 75 6.332 8.654 6.645 1.00 0.00 H new ATOM 0 HB VAL A 75 5.487 9.821 4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.422 9.147 3.538 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.754 7.992 3.293 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.446 7.612 4.438 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.273 10.475 5.565 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.311 9.060 6.643 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.514 10.357 6.835 1.00 0.00 H new ATOM 1141 N LEU A 76 4.287 6.221 5.781 1.00 0.00 N ATOM 1142 CA LEU A 76 3.448 5.145 6.310 1.00 0.00 C ATOM 1143 C LEU A 76 4.224 4.318 7.321 1.00 0.00 C ATOM 1144 O LEU A 76 3.762 4.082 8.437 1.00 0.00 O ATOM 1145 CB LEU A 76 2.977 4.236 5.170 1.00 0.00 C ATOM 1146 CG LEU A 76 1.733 3.383 5.455 1.00 0.00 C ATOM 1147 CD1 LEU A 76 1.383 2.555 4.235 1.00 0.00 C ATOM 1148 CD2 LEU A 76 1.931 2.464 6.654 1.00 0.00 C ATOM 0 H LEU A 76 4.302 6.281 4.763 1.00 0.00 H new ATOM 0 HA LEU A 76 2.583 5.593 6.800 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.774 4.857 4.298 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.796 3.569 4.903 1.00 0.00 H new ATOM 0 HG LEU A 76 0.917 4.066 5.689 1.00 0.00 H new ATOM 0 HD11 LEU A 76 0.499 1.953 4.445 1.00 0.00 H new ATOM 0 HD12 LEU A 76 1.179 3.216 3.393 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.218 1.900 3.988 1.00 0.00 H new ATOM 0 HD21 LEU A 76 1.026 1.880 6.818 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.767 1.791 6.463 1.00 0.00 H new ATOM 0 HD23 LEU A 76 2.142 3.062 7.540 1.00 0.00 H new ATOM 1160 N GLN A 77 5.406 3.880 6.911 1.00 0.00 N ATOM 1161 CA GLN A 77 6.249 3.066 7.773 1.00 0.00 C ATOM 1162 C GLN A 77 6.402 3.727 9.143 1.00 0.00 C ATOM 1163 O GLN A 77 6.473 3.053 10.170 1.00 0.00 O ATOM 1164 CB GLN A 77 7.631 2.860 7.154 1.00 0.00 C ATOM 1165 CG GLN A 77 7.775 1.539 6.419 1.00 0.00 C ATOM 1166 CD GLN A 77 8.782 0.619 7.082 1.00 0.00 C ATOM 1167 OE1 GLN A 77 8.636 0.259 8.250 1.00 0.00 O ATOM 1168 NE2 GLN A 77 9.813 0.237 6.339 1.00 0.00 N ATOM 0 H GLN A 77 5.801 4.074 5.991 1.00 0.00 H new ATOM 0 HA GLN A 77 5.768 2.095 7.888 1.00 0.00 H new ATOM 0 HB2 GLN A 77 7.835 3.676 6.461 1.00 0.00 H new ATOM 0 HB3 GLN A 77 8.384 2.913 7.940 1.00 0.00 H new ATOM 0 HG2 GLN A 77 6.806 1.042 6.376 1.00 0.00 H new ATOM 0 HG3 GLN A 77 8.082 1.729 5.391 1.00 0.00 H new ATOM 0 HE21 GLN A 77 9.894 0.560 5.375 1.00 0.00 H new ATOM 0 HE22 GLN A 77 10.524 -0.379 6.732 1.00 0.00 H new ATOM 1177 N ALA A 78 6.452 5.058 9.137 1.00 0.00 N ATOM 1178 CA ALA A 78 6.596 5.835 10.363 1.00 0.00 C ATOM 1179 C ALA A 78 5.258 5.995 11.080 1.00 0.00 C ATOM 1180 O ALA A 78 5.156 5.751 12.283 1.00 0.00 O ATOM 1181 CB ALA A 78 7.187 7.201 10.051 1.00 0.00 C ATOM 0 H ALA A 78 6.394 5.622 8.289 1.00 0.00 H new ATOM 0 HA ALA A 78 7.271 5.294 11.026 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.290 7.772 10.974 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.167 7.077 9.590 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.528 7.734 9.366 1.00 0.00 H new ATOM 1187 N HIS A 79 4.234 6.405 10.333 1.00 0.00 N ATOM 1188 CA HIS A 79 2.901 6.596 10.897 1.00 0.00 C ATOM 1189 C HIS A 79 2.193 5.255 11.124 1.00 0.00 C ATOM 1190 O HIS A 79 0.988 5.220 11.379 1.00 0.00 O ATOM 1191 CB HIS A 79 2.061 7.490 9.977 1.00 0.00 C ATOM 1192 CG HIS A 79 1.693 8.807 10.590 1.00 0.00 C ATOM 1193 ND1 HIS A 79 0.741 8.939 11.581 1.00 0.00 N ATOM 1194 CD2 HIS A 79 2.153 10.059 10.348 1.00 0.00 C ATOM 1195 CE1 HIS A 79 0.630 10.209 11.920 1.00 0.00 C ATOM 1196 NE2 HIS A 79 1.476 10.911 11.188 1.00 0.00 N ATOM 0 H HIS A 79 4.303 6.611 9.336 1.00 0.00 H new ATOM 0 HA HIS A 79 3.012 7.084 11.865 1.00 0.00 H new ATOM 0 HB2 HIS A 79 2.615 7.670 9.055 1.00 0.00 H new ATOM 0 HB3 HIS A 79 1.149 6.959 9.703 1.00 0.00 H new ATOM 0 HD2 HIS A 79 2.910 10.336 9.629 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -0.039 10.607 12.669 1.00 0.00 H new ATOM 0 HE2 HIS A 79 1.606 11.921 11.238 1.00 0.00 H new ATOM 1204 N GLN A 80 2.944 4.157 11.036 1.00 0.00 N ATOM 1205 CA GLN A 80 2.383 2.826 11.239 1.00 0.00 C ATOM 1206 C GLN A 80 2.054 2.597 12.710 1.00 0.00 C ATOM 1207 O GLN A 80 1.025 2.008 13.044 1.00 0.00 O ATOM 1208 CB GLN A 80 3.368 1.754 10.762 1.00 0.00 C ATOM 1209 CG GLN A 80 3.254 1.430 9.281 1.00 0.00 C ATOM 1210 CD GLN A 80 3.518 -0.034 8.981 1.00 0.00 C ATOM 1211 OE1 GLN A 80 2.655 -0.887 9.190 1.00 0.00 O ATOM 1212 NE2 GLN A 80 4.713 -0.332 8.486 1.00 0.00 N ATOM 0 H GLN A 80 3.942 4.166 10.825 1.00 0.00 H new ATOM 0 HA GLN A 80 1.464 2.755 10.657 1.00 0.00 H new ATOM 0 HB2 GLN A 80 4.384 2.087 10.974 1.00 0.00 H new ATOM 0 HB3 GLN A 80 3.205 0.843 11.337 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.256 1.694 8.931 1.00 0.00 H new ATOM 0 HG3 GLN A 80 3.961 2.044 8.723 1.00 0.00 H new ATOM 0 HE21 GLN A 80 5.398 0.407 8.328 1.00 0.00 H new ATOM 0 HE22 GLN A 80 4.946 -1.300 8.263 1.00 0.00 H new ATOM 1221 N ALA A 81 2.939 3.061 13.587 1.00 0.00 N ATOM 1222 CA ALA A 81 2.751 2.902 15.024 1.00 0.00 C ATOM 1223 C ALA A 81 1.943 4.056 15.609 1.00 0.00 C ATOM 1224 O ALA A 81 1.547 4.977 14.897 1.00 0.00 O ATOM 1225 CB ALA A 81 4.099 2.794 15.720 1.00 0.00 C ATOM 0 H ALA A 81 3.795 3.551 13.326 1.00 0.00 H new ATOM 0 HA ALA A 81 2.189 1.983 15.191 1.00 0.00 H new ATOM 0 HB1 ALA A 81 3.946 2.676 16.793 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.640 1.931 15.333 1.00 0.00 H new ATOM 0 HB3 ALA A 81 4.678 3.698 15.534 1.00 0.00 H new ATOM 1231 N LYS A 82 1.703 3.994 16.916 1.00 0.00 N ATOM 1232 CA LYS A 82 0.943 5.032 17.605 1.00 0.00 C ATOM 1233 C LYS A 82 1.774 6.299 17.764 1.00 0.00 C ATOM 1234 O LYS A 82 2.825 6.289 18.405 1.00 0.00 O ATOM 1235 CB LYS A 82 0.484 4.532 18.976 1.00 0.00 C ATOM 1236 CG LYS A 82 -0.387 3.290 18.911 1.00 0.00 C ATOM 1237 CD LYS A 82 -1.770 3.608 18.366 1.00 0.00 C ATOM 1238 CE LYS A 82 -1.866 3.305 16.880 1.00 0.00 C ATOM 1239 NZ LYS A 82 -3.279 3.257 16.411 1.00 0.00 N ATOM 0 H LYS A 82 2.024 3.236 17.519 1.00 0.00 H new ATOM 0 HA LYS A 82 0.067 5.268 17.001 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.361 4.319 19.588 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.068 5.327 19.477 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.091 2.542 18.279 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -0.478 2.856 19.907 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -2.518 3.027 18.906 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -1.998 4.660 18.539 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -1.323 4.066 16.319 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -1.382 2.350 16.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.300 3.048 15.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.791 2.514 16.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.734 4.176 16.585 1.00 0.00 H new ATOM 1253 N GLU A 83 1.296 7.390 17.176 1.00 0.00 N ATOM 1254 CA GLU A 83 1.994 8.666 17.253 1.00 0.00 C ATOM 1255 C GLU A 83 1.829 9.292 18.632 1.00 0.00 C ATOM 1256 O GLU A 83 0.725 9.340 19.175 1.00 0.00 O ATOM 1257 CB GLU A 83 1.470 9.623 16.180 1.00 0.00 C ATOM 1258 CG GLU A 83 2.554 10.482 15.550 1.00 0.00 C ATOM 1259 CD GLU A 83 3.606 9.661 14.832 1.00 0.00 C ATOM 1260 OE1 GLU A 83 3.249 8.947 13.872 1.00 0.00 O ATOM 1261 OE2 GLU A 83 4.788 9.730 15.233 1.00 0.00 O ATOM 0 H GLU A 83 0.428 7.415 16.641 1.00 0.00 H new ATOM 0 HA GLU A 83 3.055 8.483 17.081 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.976 9.045 15.399 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.714 10.272 16.622 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.098 11.177 14.845 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.033 11.082 16.324 1.00 0.00 H new ATOM 1268 N ALA A 84 2.933 9.772 19.194 1.00 0.00 N ATOM 1269 CA ALA A 84 2.909 10.395 20.510 1.00 0.00 C ATOM 1270 C ALA A 84 2.126 11.702 20.478 1.00 0.00 C ATOM 1271 O ALA A 84 2.078 12.382 19.454 1.00 0.00 O ATOM 1272 CB ALA A 84 4.326 10.643 21.004 1.00 0.00 C ATOM 0 H ALA A 84 3.855 9.741 18.758 1.00 0.00 H new ATOM 0 HA ALA A 84 2.410 9.714 21.199 1.00 0.00 H new ATOM 0 HB1 ALA A 84 4.292 11.109 21.989 1.00 0.00 H new ATOM 0 HB2 ALA A 84 4.860 9.695 21.070 1.00 0.00 H new ATOM 0 HB3 ALA A 84 4.844 11.303 20.308 1.00 0.00 H new ATOM 1278 N ALA A 85 1.518 12.050 21.606 1.00 0.00 N ATOM 1279 CA ALA A 85 0.745 13.280 21.703 1.00 0.00 C ATOM 1280 C ALA A 85 1.647 14.471 22.008 1.00 0.00 C ATOM 1281 O ALA A 85 1.403 15.223 22.954 1.00 0.00 O ATOM 1282 CB ALA A 85 -0.337 13.145 22.764 1.00 0.00 C ATOM 0 H ALA A 85 1.546 11.499 22.464 1.00 0.00 H new ATOM 0 HA ALA A 85 0.268 13.457 20.739 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -0.906 14.073 22.824 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.006 12.326 22.499 1.00 0.00 H new ATOM 0 HB3 ALA A 85 0.124 12.939 23.730 1.00 0.00 H new ATOM 1288 N GLN A 86 2.690 14.643 21.201 1.00 0.00 N ATOM 1289 CA GLN A 86 3.626 15.745 21.384 1.00 0.00 C ATOM 1290 C GLN A 86 3.066 17.032 20.786 1.00 0.00 C ATOM 1291 O GLN A 86 3.701 17.667 19.944 1.00 0.00 O ATOM 1292 CB GLN A 86 4.974 15.410 20.740 1.00 0.00 C ATOM 1293 CG GLN A 86 5.919 14.656 21.663 1.00 0.00 C ATOM 1294 CD GLN A 86 6.799 13.671 20.916 1.00 0.00 C ATOM 1295 OE1 GLN A 86 7.450 14.026 19.933 1.00 0.00 O ATOM 1296 NE2 GLN A 86 6.824 12.428 21.381 1.00 0.00 N ATOM 0 H GLN A 86 2.907 14.032 20.414 1.00 0.00 H new ATOM 0 HA GLN A 86 3.773 15.895 22.454 1.00 0.00 H new ATOM 0 HB2 GLN A 86 4.801 14.813 19.844 1.00 0.00 H new ATOM 0 HB3 GLN A 86 5.454 16.335 20.419 1.00 0.00 H new ATOM 0 HG2 GLN A 86 6.548 15.370 22.195 1.00 0.00 H new ATOM 0 HG3 GLN A 86 5.338 14.122 22.415 1.00 0.00 H new ATOM 0 HE21 GLN A 86 6.268 12.178 22.199 1.00 0.00 H new ATOM 0 HE22 GLN A 86 7.399 11.723 20.920 1.00 0.00 H new ATOM 1305 N LYS A 87 1.870 17.408 21.226 1.00 0.00 N ATOM 1306 CA LYS A 87 1.219 18.615 20.736 1.00 0.00 C ATOM 1307 C LYS A 87 1.839 19.855 21.373 1.00 0.00 C ATOM 1308 O LYS A 87 2.926 19.789 21.950 1.00 0.00 O ATOM 1309 CB LYS A 87 -0.283 18.558 21.031 1.00 0.00 C ATOM 1310 CG LYS A 87 -1.155 18.792 19.807 1.00 0.00 C ATOM 1311 CD LYS A 87 -1.294 17.530 18.968 1.00 0.00 C ATOM 1312 CE LYS A 87 -2.715 16.989 18.998 1.00 0.00 C ATOM 1313 NZ LYS A 87 -3.726 18.058 18.760 1.00 0.00 N ATOM 0 H LYS A 87 1.332 16.892 21.922 1.00 0.00 H new ATOM 0 HA LYS A 87 1.364 18.676 19.657 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -0.524 17.584 21.457 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -0.525 19.305 21.787 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -2.142 19.130 20.122 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -0.724 19.588 19.199 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -1.008 17.744 17.938 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -0.607 16.769 19.338 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -2.823 16.213 18.240 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -2.904 16.520 19.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.532 17.663 18.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.057 18.432 19.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -3.296 18.826 18.206 1.00 0.00 H new ATOM 1327 N ALA A 88 1.147 20.983 21.268 1.00 0.00 N ATOM 1328 CA ALA A 88 1.635 22.232 21.835 1.00 0.00 C ATOM 1329 C ALA A 88 1.500 22.232 23.354 1.00 0.00 C ATOM 1330 O ALA A 88 0.944 21.301 23.937 1.00 0.00 O ATOM 1331 CB ALA A 88 0.886 23.412 21.232 1.00 0.00 C ATOM 0 H ALA A 88 0.246 21.057 20.795 1.00 0.00 H new ATOM 0 HA ALA A 88 2.693 22.328 21.592 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.260 24.340 21.664 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.039 23.427 20.153 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -0.178 23.315 21.446 1.00 0.00 H new ATOM 1337 N VAL A 89 2.007 23.283 23.993 1.00 0.00 N ATOM 1338 CA VAL A 89 1.935 23.402 25.445 1.00 0.00 C ATOM 1339 C VAL A 89 0.637 24.080 25.875 1.00 0.00 C ATOM 1340 O VAL A 89 0.639 24.961 26.734 1.00 0.00 O ATOM 1341 CB VAL A 89 3.126 24.199 26.012 1.00 0.00 C ATOM 1342 CG1 VAL A 89 3.165 24.088 27.528 1.00 0.00 C ATOM 1343 CG2 VAL A 89 4.438 23.725 25.404 1.00 0.00 C ATOM 0 H VAL A 89 2.471 24.063 23.528 1.00 0.00 H new ATOM 0 HA VAL A 89 1.968 22.388 25.844 1.00 0.00 H new ATOM 0 HB VAL A 89 2.992 25.247 25.745 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.012 24.656 27.913 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.241 24.487 27.946 1.00 0.00 H new ATOM 0 HG13 VAL A 89 3.271 23.041 27.814 1.00 0.00 H new ATOM 0 HG21 VAL A 89 5.262 24.304 25.821 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.584 22.669 25.632 1.00 0.00 H new ATOM 0 HG23 VAL A 89 4.409 23.862 24.323 1.00 0.00 H new ATOM 1353 N ASN A 90 -0.471 23.664 25.271 1.00 0.00 N ATOM 1354 CA ASN A 90 -1.774 24.231 25.592 1.00 0.00 C ATOM 1355 C ASN A 90 -2.297 23.663 26.907 1.00 0.00 C ATOM 1356 O ASN A 90 -2.108 22.484 27.205 1.00 0.00 O ATOM 1357 CB ASN A 90 -2.764 23.947 24.463 1.00 0.00 C ATOM 1358 CG ASN A 90 -2.477 24.756 23.216 1.00 0.00 C ATOM 1359 OD1 ASN A 90 -2.738 25.958 23.167 1.00 0.00 O ATOM 1360 ND2 ASN A 90 -1.938 24.098 22.195 1.00 0.00 N ATOM 0 H ASN A 90 -0.492 22.936 24.557 1.00 0.00 H new ATOM 0 HA ASN A 90 -1.664 25.310 25.702 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.734 22.885 24.217 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -3.775 24.165 24.808 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -1.724 24.590 21.327 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -1.738 23.101 22.279 1.00 0.00 H new ATOM 1367 N SER A 91 -2.950 24.511 27.695 1.00 0.00 N ATOM 1368 CA SER A 91 -3.491 24.093 28.983 1.00 0.00 C ATOM 1369 C SER A 91 -4.965 23.712 28.869 1.00 0.00 C ATOM 1370 O SER A 91 -5.347 22.577 29.158 1.00 0.00 O ATOM 1371 CB SER A 91 -3.321 25.215 30.012 1.00 0.00 C ATOM 1372 OG SER A 91 -2.215 24.963 30.862 1.00 0.00 O ATOM 0 H SER A 91 -3.117 25.490 27.465 1.00 0.00 H new ATOM 0 HA SER A 91 -2.938 23.213 29.310 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.180 26.166 29.498 1.00 0.00 H new ATOM 0 HB3 SER A 91 -4.229 25.307 30.608 1.00 0.00 H new ATOM 0 HG SER A 91 -2.126 25.694 31.509 1.00 0.00 H new ATOM 1378 N ALA A 92 -5.789 24.668 28.452 1.00 0.00 N ATOM 1379 CA ALA A 92 -7.222 24.435 28.307 1.00 0.00 C ATOM 1380 C ALA A 92 -7.537 23.636 27.046 1.00 0.00 C ATOM 1381 O ALA A 92 -8.574 22.979 26.961 1.00 0.00 O ATOM 1382 CB ALA A 92 -7.969 25.759 28.290 1.00 0.00 C ATOM 0 H ALA A 92 -5.489 25.612 28.208 1.00 0.00 H new ATOM 0 HA ALA A 92 -7.552 23.847 29.163 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -9.037 25.573 28.181 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.787 26.292 29.223 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.619 26.363 27.453 1.00 0.00 H new ATOM 1388 N THR A 93 -6.641 23.698 26.066 1.00 0.00 N ATOM 1389 CA THR A 93 -6.831 22.982 24.809 1.00 0.00 C ATOM 1390 C THR A 93 -6.227 21.583 24.879 1.00 0.00 C ATOM 1391 O THR A 93 -6.942 20.582 24.849 1.00 0.00 O ATOM 1392 CB THR A 93 -6.195 23.763 23.657 1.00 0.00 C ATOM 1393 OG1 THR A 93 -6.033 25.126 24.006 1.00 0.00 O ATOM 1394 CG2 THR A 93 -7.003 23.711 22.379 1.00 0.00 C ATOM 0 H THR A 93 -5.776 24.237 26.118 1.00 0.00 H new ATOM 0 HA THR A 93 -7.902 22.886 24.633 1.00 0.00 H new ATOM 0 HB THR A 93 -5.233 23.282 23.479 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.623 25.609 23.258 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.495 24.285 21.604 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.105 22.675 22.055 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.991 24.135 22.556 1.00 0.00 H new ATOM 1402 N GLY A 94 -4.905 21.527 24.968 1.00 0.00 N ATOM 1403 CA GLY A 94 -4.212 20.256 25.039 1.00 0.00 C ATOM 1404 C GLY A 94 -4.031 19.779 26.464 1.00 0.00 C ATOM 1405 O GLY A 94 -3.872 20.583 27.381 1.00 0.00 O ATOM 0 H GLY A 94 -4.297 22.345 24.992 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -4.771 19.508 24.476 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -3.236 20.350 24.563 1.00 0.00 H new ATOM 1409 N VAL A 95 -4.062 18.468 26.649 1.00 0.00 N ATOM 1410 CA VAL A 95 -3.908 17.881 27.972 1.00 0.00 C ATOM 1411 C VAL A 95 -2.435 17.650 28.310 1.00 0.00 C ATOM 1412 O VAL A 95 -1.785 16.787 27.721 1.00 0.00 O ATOM 1413 CB VAL A 95 -4.665 16.545 28.070 1.00 0.00 C ATOM 1414 CG1 VAL A 95 -6.162 16.778 27.926 1.00 0.00 C ATOM 1415 CG2 VAL A 95 -4.163 15.568 27.015 1.00 0.00 C ATOM 0 H VAL A 95 -4.193 17.789 25.899 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.328 18.588 28.688 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.478 16.107 29.051 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.687 15.825 27.997 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.505 17.441 28.720 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.368 17.234 26.958 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.710 14.629 27.099 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.320 15.991 26.023 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -3.099 15.384 27.167 1.00 0.00 H new ATOM 1425 N PRO A 96 -1.887 18.421 29.268 1.00 0.00 N ATOM 1426 CA PRO A 96 -0.485 18.286 29.677 1.00 0.00 C ATOM 1427 C PRO A 96 -0.221 16.968 30.395 1.00 0.00 C ATOM 1428 O PRO A 96 0.860 16.392 30.284 1.00 0.00 O ATOM 1429 CB PRO A 96 -0.273 19.466 30.629 1.00 0.00 C ATOM 1430 CG PRO A 96 -1.633 19.778 31.152 1.00 0.00 C ATOM 1431 CD PRO A 96 -2.584 19.475 30.029 1.00 0.00 C ATOM 0 HA PRO A 96 0.191 18.288 28.822 1.00 0.00 H new ATOM 0 HB2 PRO A 96 0.412 19.206 31.436 1.00 0.00 H new ATOM 0 HB3 PRO A 96 0.158 20.322 30.109 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -1.861 19.175 32.031 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.705 20.823 31.454 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -3.549 19.131 30.401 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -2.775 20.355 29.415 1.00 0.00 H new ATOM 1439 N THR A 97 -1.223 16.494 31.130 1.00 0.00 N ATOM 1440 CA THR A 97 -1.106 15.239 31.866 1.00 0.00 C ATOM 1441 C THR A 97 -1.940 14.145 31.207 1.00 0.00 C ATOM 1442 O THR A 97 -3.143 14.307 31.001 1.00 0.00 O ATOM 1443 CB THR A 97 -1.538 15.424 33.324 1.00 0.00 C ATOM 1444 OG1 THR A 97 -1.633 14.171 33.978 1.00 0.00 O ATOM 1445 CG2 THR A 97 -2.874 16.121 33.478 1.00 0.00 C ATOM 0 H THR A 97 -2.125 16.960 31.232 1.00 0.00 H new ATOM 0 HA THR A 97 -0.059 14.936 31.848 1.00 0.00 H new ATOM 0 HB THR A 97 -0.769 16.053 33.772 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.908 14.308 34.908 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.114 16.217 34.537 1.00 0.00 H new ATOM 0 HG22 THR A 97 -2.822 17.112 33.027 1.00 0.00 H new ATOM 0 HG23 THR A 97 -3.649 15.537 32.982 1.00 0.00 H new ATOM 1453 N VAL A 98 -1.293 13.032 30.877 1.00 0.00 N ATOM 1454 CA VAL A 98 -1.973 11.911 30.240 1.00 0.00 C ATOM 1455 C VAL A 98 -1.986 10.689 31.151 1.00 0.00 C ATOM 1456 O VAL A 98 -0.921 10.362 31.717 1.00 0.00 O ATOM 1457 CB VAL A 98 -1.305 11.532 28.904 1.00 0.00 C ATOM 1458 CG1 VAL A 98 -2.185 10.568 28.121 1.00 0.00 C ATOM 1459 CG2 VAL A 98 -1.003 12.776 28.083 1.00 0.00 C ATOM 1460 OXT VAL A 98 -3.060 10.069 31.294 1.00 0.00 O ATOM 0 H VAL A 98 -0.297 12.883 31.041 1.00 0.00 H new ATOM 0 HA VAL A 98 -2.997 12.231 30.047 1.00 0.00 H new ATOM 0 HB VAL A 98 -0.361 11.032 29.121 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -1.697 10.312 27.181 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.343 9.662 28.706 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -3.146 11.039 27.914 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -0.532 12.487 27.144 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -1.931 13.308 27.874 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -0.330 13.426 28.642 1.00 0.00 H new TER 1470 VAL A 98 ATOM 1471 N VAL B 1 9.905 21.678 11.618 1.00 0.00 N ATOM 1472 CA VAL B 1 8.837 21.511 10.600 1.00 0.00 C ATOM 1473 C VAL B 1 8.602 20.037 10.290 1.00 0.00 C ATOM 1474 O VAL B 1 9.539 19.297 9.990 1.00 0.00 O ATOM 1475 CB VAL B 1 9.184 22.251 9.291 1.00 0.00 C ATOM 1476 CG1 VAL B 1 10.495 21.741 8.711 1.00 0.00 C ATOM 1477 CG2 VAL B 1 8.058 22.114 8.276 1.00 0.00 C ATOM 0 H1 VAL B 1 10.188 22.678 11.664 1.00 0.00 H new ATOM 0 H2 VAL B 1 9.549 21.376 12.547 1.00 0.00 H new ATOM 0 H3 VAL B 1 10.727 21.098 11.357 1.00 0.00 H new ATOM 0 HA VAL B 1 7.929 21.942 11.021 1.00 0.00 H new ATOM 0 HB VAL B 1 9.304 23.309 9.525 1.00 0.00 H new ATOM 0 HG11 VAL B 1 10.718 22.278 7.789 1.00 0.00 H new ATOM 0 HG12 VAL B 1 11.298 21.904 9.429 1.00 0.00 H new ATOM 0 HG13 VAL B 1 10.409 20.675 8.499 1.00 0.00 H new ATOM 0 HG21 VAL B 1 8.326 22.644 7.362 1.00 0.00 H new ATOM 0 HG22 VAL B 1 7.898 21.060 8.051 1.00 0.00 H new ATOM 0 HG23 VAL B 1 7.143 22.540 8.688 1.00 0.00 H new ATOM 1489 N LEU B 2 7.344 19.617 10.361 1.00 0.00 N ATOM 1490 CA LEU B 2 6.990 18.233 10.081 1.00 0.00 C ATOM 1491 C LEU B 2 7.029 17.971 8.581 1.00 0.00 C ATOM 1492 O LEU B 2 5.991 17.818 7.938 1.00 0.00 O ATOM 1493 CB LEU B 2 5.598 17.913 10.637 1.00 0.00 C ATOM 1494 CG LEU B 2 5.400 16.482 11.150 1.00 0.00 C ATOM 1495 CD1 LEU B 2 5.444 15.487 10.000 1.00 0.00 C ATOM 1496 CD2 LEU B 2 6.443 16.132 12.203 1.00 0.00 C ATOM 0 H LEU B 2 6.555 20.214 10.609 1.00 0.00 H new ATOM 0 HA LEU B 2 7.717 17.585 10.570 1.00 0.00 H new ATOM 0 HB2 LEU B 2 5.385 18.604 11.452 1.00 0.00 H new ATOM 0 HB3 LEU B 2 4.862 18.104 9.856 1.00 0.00 H new ATOM 0 HG LEU B 2 4.416 16.424 11.616 1.00 0.00 H new ATOM 0 HD11 LEU B 2 5.301 14.478 10.386 1.00 0.00 H new ATOM 0 HD12 LEU B 2 4.652 15.718 9.288 1.00 0.00 H new ATOM 0 HD13 LEU B 2 6.411 15.551 9.500 1.00 0.00 H new ATOM 0 HD21 LEU B 2 6.281 15.112 12.551 1.00 0.00 H new ATOM 0 HD22 LEU B 2 7.440 16.213 11.769 1.00 0.00 H new ATOM 0 HD23 LEU B 2 6.356 16.820 13.044 1.00 0.00 H new ATOM 1508 N MET B 3 8.236 17.922 8.029 1.00 0.00 N ATOM 1509 CA MET B 3 8.408 17.676 6.606 1.00 0.00 C ATOM 1510 C MET B 3 8.232 16.197 6.308 1.00 0.00 C ATOM 1511 O MET B 3 9.180 15.506 5.936 1.00 0.00 O ATOM 1512 CB MET B 3 9.787 18.140 6.134 1.00 0.00 C ATOM 1513 CG MET B 3 10.019 17.935 4.644 1.00 0.00 C ATOM 1514 SD MET B 3 11.767 17.817 4.219 1.00 0.00 S ATOM 1515 CE MET B 3 12.073 16.077 4.516 1.00 0.00 C ATOM 0 H MET B 3 9.106 18.049 8.545 1.00 0.00 H new ATOM 0 HA MET B 3 7.650 18.245 6.068 1.00 0.00 H new ATOM 0 HB2 MET B 3 9.906 19.197 6.370 1.00 0.00 H new ATOM 0 HB3 MET B 3 10.553 17.601 6.691 1.00 0.00 H new ATOM 0 HG2 MET B 3 9.510 17.026 4.323 1.00 0.00 H new ATOM 0 HG3 MET B 3 9.571 18.763 4.094 1.00 0.00 H new ATOM 0 HE1 MET B 3 13.116 15.848 4.297 1.00 0.00 H new ATOM 0 HE2 MET B 3 11.862 15.843 5.560 1.00 0.00 H new ATOM 0 HE3 MET B 3 11.427 15.479 3.873 1.00 0.00 H new ATOM 1525 N SER B 4 7.007 15.716 6.474 1.00 0.00 N ATOM 1526 CA SER B 4 6.707 14.320 6.222 1.00 0.00 C ATOM 1527 C SER B 4 6.773 14.042 4.725 1.00 0.00 C ATOM 1528 O SER B 4 7.498 14.719 3.996 1.00 0.00 O ATOM 1529 CB SER B 4 5.322 13.965 6.780 1.00 0.00 C ATOM 1530 OG SER B 4 5.191 12.566 6.992 1.00 0.00 O ATOM 0 H SER B 4 6.210 16.273 6.781 1.00 0.00 H new ATOM 0 HA SER B 4 7.446 13.698 6.726 1.00 0.00 H new ATOM 0 HB2 SER B 4 5.160 14.494 7.719 1.00 0.00 H new ATOM 0 HB3 SER B 4 4.551 14.303 6.087 1.00 0.00 H new ATOM 0 HG SER B 4 4.462 12.398 7.625 1.00 0.00 H new ATOM 1536 N LYS B 5 6.035 13.044 4.267 1.00 0.00 N ATOM 1537 CA LYS B 5 6.041 12.691 2.860 1.00 0.00 C ATOM 1538 C LYS B 5 4.949 13.432 2.091 1.00 0.00 C ATOM 1539 O LYS B 5 4.200 14.227 2.658 1.00 0.00 O ATOM 1540 CB LYS B 5 5.862 11.187 2.711 1.00 0.00 C ATOM 1541 CG LYS B 5 7.159 10.407 2.854 1.00 0.00 C ATOM 1542 CD LYS B 5 7.756 10.542 4.246 1.00 0.00 C ATOM 1543 CE LYS B 5 9.155 11.137 4.200 1.00 0.00 C ATOM 1544 NZ LYS B 5 9.332 12.228 5.196 1.00 0.00 N ATOM 0 H LYS B 5 5.427 12.467 4.848 1.00 0.00 H new ATOM 0 HA LYS B 5 7.001 12.989 2.437 1.00 0.00 H new ATOM 0 HB2 LYS B 5 5.152 10.837 3.460 1.00 0.00 H new ATOM 0 HB3 LYS B 5 5.425 10.976 1.735 1.00 0.00 H new ATOM 0 HG2 LYS B 5 6.974 9.354 2.640 1.00 0.00 H new ATOM 0 HG3 LYS B 5 7.878 10.761 2.115 1.00 0.00 H new ATOM 0 HD2 LYS B 5 7.112 11.172 4.859 1.00 0.00 H new ATOM 0 HD3 LYS B 5 7.792 9.563 4.724 1.00 0.00 H new ATOM 0 HE2 LYS B 5 9.888 10.353 4.388 1.00 0.00 H new ATOM 0 HE3 LYS B 5 9.351 11.524 3.200 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 10.269 12.145 5.639 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 9.255 13.149 4.719 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 8.596 12.154 5.927 1.00 0.00 H new ATOM 1558 N LEU B 6 4.873 13.157 0.794 1.00 0.00 N ATOM 1559 CA LEU B 6 3.889 13.778 -0.079 1.00 0.00 C ATOM 1560 C LEU B 6 2.516 13.150 0.135 1.00 0.00 C ATOM 1561 O LEU B 6 1.489 13.812 -0.005 1.00 0.00 O ATOM 1562 CB LEU B 6 4.309 13.622 -1.544 1.00 0.00 C ATOM 1563 CG LEU B 6 5.589 14.368 -1.938 1.00 0.00 C ATOM 1564 CD1 LEU B 6 6.484 13.486 -2.798 1.00 0.00 C ATOM 1565 CD2 LEU B 6 5.247 15.657 -2.671 1.00 0.00 C ATOM 0 H LEU B 6 5.491 12.498 0.321 1.00 0.00 H new ATOM 0 HA LEU B 6 3.832 14.839 0.164 1.00 0.00 H new ATOM 0 HB2 LEU B 6 4.446 12.561 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU B 6 3.494 13.971 -2.178 1.00 0.00 H new ATOM 0 HG LEU B 6 6.133 14.620 -1.028 1.00 0.00 H new ATOM 0 HD11 LEU B 6 7.387 14.035 -3.066 1.00 0.00 H new ATOM 0 HD12 LEU B 6 6.757 12.590 -2.240 1.00 0.00 H new ATOM 0 HD13 LEU B 6 5.950 13.200 -3.704 1.00 0.00 H new ATOM 0 HD21 LEU B 6 6.166 16.175 -2.944 1.00 0.00 H new ATOM 0 HD22 LEU B 6 4.681 15.424 -3.573 1.00 0.00 H new ATOM 0 HD23 LEU B 6 4.649 16.297 -2.022 1.00 0.00 H new ATOM 1577 N SER B 7 2.512 11.867 0.483 1.00 0.00 N ATOM 1578 CA SER B 7 1.272 11.145 0.727 1.00 0.00 C ATOM 1579 C SER B 7 0.878 11.246 2.206 1.00 0.00 C ATOM 1580 O SER B 7 1.009 12.313 2.805 1.00 0.00 O ATOM 1581 CB SER B 7 1.433 9.689 0.286 1.00 0.00 C ATOM 1582 OG SER B 7 2.695 9.174 0.674 1.00 0.00 O ATOM 0 H SER B 7 3.356 11.307 0.602 1.00 0.00 H new ATOM 0 HA SER B 7 0.468 11.593 0.143 1.00 0.00 H new ATOM 0 HB2 SER B 7 0.640 9.083 0.724 1.00 0.00 H new ATOM 0 HB3 SER B 7 1.326 9.620 -0.797 1.00 0.00 H new ATOM 0 HG SER B 7 3.134 8.766 -0.101 1.00 0.00 H new ATOM 1588 N VAL B 8 0.388 10.148 2.792 1.00 0.00 N ATOM 1589 CA VAL B 8 -0.025 10.147 4.194 1.00 0.00 C ATOM 1590 C VAL B 8 -0.694 8.824 4.556 1.00 0.00 C ATOM 1591 O VAL B 8 -1.228 8.134 3.686 1.00 0.00 O ATOM 1592 CB VAL B 8 -1.010 11.301 4.478 1.00 0.00 C ATOM 1593 CG1 VAL B 8 -2.328 11.066 3.760 1.00 0.00 C ATOM 1594 CG2 VAL B 8 -1.229 11.482 5.972 1.00 0.00 C ATOM 0 H VAL B 8 0.269 9.253 2.317 1.00 0.00 H new ATOM 0 HA VAL B 8 0.870 10.281 4.801 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.571 12.222 4.095 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -3.010 11.890 3.972 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.152 11.008 2.686 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -2.769 10.131 4.106 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.927 12.302 6.141 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.638 10.564 6.394 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.278 11.710 6.454 1.00 0.00 H new ATOM 1604 N ASN B 9 -0.673 8.474 5.840 1.00 0.00 N ATOM 1605 CA ASN B 9 -1.289 7.235 6.303 1.00 0.00 C ATOM 1606 C ASN B 9 -2.812 7.370 6.396 1.00 0.00 C ATOM 1607 O ASN B 9 -3.403 7.055 7.430 1.00 0.00 O ATOM 1608 CB ASN B 9 -0.718 6.846 7.672 1.00 0.00 C ATOM 1609 CG ASN B 9 -1.034 7.869 8.747 1.00 0.00 C ATOM 1610 OD1 ASN B 9 -1.189 9.057 8.466 1.00 0.00 O ATOM 1611 ND2 ASN B 9 -1.129 7.409 9.991 1.00 0.00 N ATOM 0 H ASN B 9 -0.237 9.030 6.576 1.00 0.00 H new ATOM 0 HA ASN B 9 -1.061 6.455 5.577 1.00 0.00 H new ATOM 0 HB2 ASN B 9 -1.121 5.877 7.968 1.00 0.00 H new ATOM 0 HB3 ASN B 9 0.363 6.731 7.591 1.00 0.00 H new ATOM 0 HD21 ASN B 9 -1.338 8.049 10.757 1.00 0.00 H new ATOM 0 HD22 ASN B 9 -0.993 6.416 10.179 1.00 0.00 H new ATOM 1618 N ALA B 10 -3.450 7.846 5.323 1.00 0.00 N ATOM 1619 CA ALA B 10 -4.898 8.023 5.311 1.00 0.00 C ATOM 1620 C ALA B 10 -5.622 6.711 5.616 1.00 0.00 C ATOM 1621 O ALA B 10 -4.982 5.700 5.905 1.00 0.00 O ATOM 1622 CB ALA B 10 -5.333 8.577 3.962 1.00 0.00 C ATOM 0 H ALA B 10 -2.985 8.114 4.456 1.00 0.00 H new ATOM 0 HA ALA B 10 -5.167 8.732 6.094 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -6.415 8.709 3.955 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -4.849 9.539 3.790 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -5.047 7.881 3.173 1.00 0.00 H new ATOM 1628 N PRO B 11 -6.974 6.712 5.562 1.00 0.00 N ATOM 1629 CA PRO B 11 -7.785 5.517 5.836 1.00 0.00 C ATOM 1630 C PRO B 11 -7.318 4.299 5.046 1.00 0.00 C ATOM 1631 O PRO B 11 -6.198 4.269 4.542 1.00 0.00 O ATOM 1632 CB PRO B 11 -9.190 5.935 5.400 1.00 0.00 C ATOM 1633 CG PRO B 11 -9.206 7.414 5.572 1.00 0.00 C ATOM 1634 CD PRO B 11 -7.817 7.881 5.237 1.00 0.00 C ATOM 0 HA PRO B 11 -7.721 5.213 6.881 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -9.385 5.653 4.365 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -9.955 5.456 6.011 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -9.943 7.876 4.915 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -9.474 7.686 6.593 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -7.729 8.160 4.187 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -7.535 8.755 5.824 1.00 0.00 H new ATOM 1642 N GLU B 12 -8.188 3.304 4.904 1.00 0.00 N ATOM 1643 CA GLU B 12 -7.856 2.109 4.138 1.00 0.00 C ATOM 1644 C GLU B 12 -8.077 2.325 2.640 1.00 0.00 C ATOM 1645 O GLU B 12 -8.329 3.440 2.184 1.00 0.00 O ATOM 1646 CB GLU B 12 -8.682 0.916 4.629 1.00 0.00 C ATOM 1647 CG GLU B 12 -7.866 -0.099 5.415 1.00 0.00 C ATOM 1648 CD GLU B 12 -8.181 -0.086 6.898 1.00 0.00 C ATOM 1649 OE1 GLU B 12 -8.826 0.877 7.361 1.00 0.00 O ATOM 1650 OE2 GLU B 12 -7.776 -1.039 7.599 1.00 0.00 O ATOM 0 H GLU B 12 -9.125 3.302 5.308 1.00 0.00 H new ATOM 0 HA GLU B 12 -6.798 1.898 4.293 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -9.496 1.280 5.255 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -9.137 0.420 3.771 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -8.055 -1.096 5.017 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -6.805 0.106 5.272 1.00 0.00 H new ATOM 1657 N PHE B 13 -7.984 1.230 1.894 1.00 0.00 N ATOM 1658 CA PHE B 13 -8.176 1.266 0.447 1.00 0.00 C ATOM 1659 C PHE B 13 -9.556 0.716 0.096 1.00 0.00 C ATOM 1660 O PHE B 13 -9.866 -0.445 0.356 1.00 0.00 O ATOM 1661 CB PHE B 13 -7.066 0.491 -0.272 1.00 0.00 C ATOM 1662 CG PHE B 13 -7.140 -1.001 -0.125 1.00 0.00 C ATOM 1663 CD1 PHE B 13 -6.879 -1.617 1.091 1.00 0.00 C ATOM 1664 CD2 PHE B 13 -7.460 -1.789 -1.215 1.00 0.00 C ATOM 1665 CE1 PHE B 13 -6.941 -2.993 1.208 1.00 0.00 C ATOM 1666 CE2 PHE B 13 -7.522 -3.162 -1.100 1.00 0.00 C ATOM 1667 CZ PHE B 13 -7.263 -3.763 0.108 1.00 0.00 C ATOM 0 H PHE B 13 -7.776 0.304 2.267 1.00 0.00 H new ATOM 0 HA PHE B 13 -8.120 2.300 0.108 1.00 0.00 H new ATOM 0 HB2 PHE B 13 -7.098 0.739 -1.333 1.00 0.00 H new ATOM 0 HB3 PHE B 13 -6.102 0.831 0.106 1.00 0.00 H new ATOM 0 HD1 PHE B 13 -6.626 -1.017 1.952 1.00 0.00 H new ATOM 0 HD2 PHE B 13 -7.664 -1.324 -2.168 1.00 0.00 H new ATOM 0 HE1 PHE B 13 -6.738 -3.465 2.158 1.00 0.00 H new ATOM 0 HE2 PHE B 13 -7.774 -3.765 -1.960 1.00 0.00 H new ATOM 0 HZ PHE B 13 -7.311 -4.838 0.197 1.00 0.00 H new ATOM 1677 N TYR B 14 -10.379 1.576 -0.506 1.00 0.00 N ATOM 1678 CA TYR B 14 -11.733 1.216 -0.911 1.00 0.00 C ATOM 1679 C TYR B 14 -11.914 1.336 -2.426 1.00 0.00 C ATOM 1680 O TYR B 14 -11.035 1.849 -3.121 1.00 0.00 O ATOM 1681 CB TYR B 14 -12.729 2.105 -0.169 1.00 0.00 C ATOM 1682 CG TYR B 14 -13.052 1.592 1.216 1.00 0.00 C ATOM 1683 CD1 TYR B 14 -14.040 0.636 1.414 1.00 0.00 C ATOM 1684 CD2 TYR B 14 -12.352 2.053 2.323 1.00 0.00 C ATOM 1685 CE1 TYR B 14 -14.322 0.154 2.678 1.00 0.00 C ATOM 1686 CE2 TYR B 14 -12.631 1.577 3.590 1.00 0.00 C ATOM 1687 CZ TYR B 14 -13.616 0.629 3.762 1.00 0.00 C ATOM 1688 OH TYR B 14 -13.893 0.149 5.022 1.00 0.00 O ATOM 0 H TYR B 14 -10.124 2.539 -0.725 1.00 0.00 H new ATOM 0 HA TYR B 14 -11.915 0.173 -0.651 1.00 0.00 H new ATOM 0 HB2 TYR B 14 -12.322 3.113 -0.092 1.00 0.00 H new ATOM 0 HB3 TYR B 14 -13.649 2.175 -0.749 1.00 0.00 H new ATOM 0 HD1 TYR B 14 -14.597 0.264 0.567 1.00 0.00 H new ATOM 0 HD2 TYR B 14 -11.578 2.795 2.192 1.00 0.00 H new ATOM 0 HE1 TYR B 14 -15.092 -0.591 2.816 1.00 0.00 H new ATOM 0 HE2 TYR B 14 -12.079 1.946 4.442 1.00 0.00 H new ATOM 0 HH TYR B 14 -13.306 0.585 5.675 1.00 0.00 H new ATOM 1698 N PRO B 15 -13.065 0.885 -2.967 1.00 0.00 N ATOM 1699 CA PRO B 15 -13.350 0.977 -4.406 1.00 0.00 C ATOM 1700 C PRO B 15 -13.350 2.414 -4.905 1.00 0.00 C ATOM 1701 O PRO B 15 -14.382 3.090 -4.894 1.00 0.00 O ATOM 1702 CB PRO B 15 -14.751 0.397 -4.544 1.00 0.00 C ATOM 1703 CG PRO B 15 -15.336 0.466 -3.175 1.00 0.00 C ATOM 1704 CD PRO B 15 -14.184 0.265 -2.237 1.00 0.00 C ATOM 0 HA PRO B 15 -12.593 0.454 -4.990 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -15.346 0.969 -5.256 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -14.719 -0.630 -4.908 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -15.819 1.428 -3.003 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -16.096 -0.303 -3.034 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -14.356 0.746 -1.274 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -14.003 -0.791 -2.038 1.00 0.00 H new ATOM 1712 N SER B 16 -12.199 2.876 -5.360 1.00 0.00 N ATOM 1713 CA SER B 16 -12.077 4.232 -5.866 1.00 0.00 C ATOM 1714 C SER B 16 -13.101 4.495 -6.963 1.00 0.00 C ATOM 1715 O SER B 16 -13.971 5.354 -6.819 1.00 0.00 O ATOM 1716 CB SER B 16 -10.668 4.468 -6.393 1.00 0.00 C ATOM 1717 OG SER B 16 -9.981 5.425 -5.608 1.00 0.00 O ATOM 0 H SER B 16 -11.336 2.333 -5.390 1.00 0.00 H new ATOM 0 HA SER B 16 -12.270 4.924 -5.046 1.00 0.00 H new ATOM 0 HB2 SER B 16 -10.115 3.529 -6.393 1.00 0.00 H new ATOM 0 HB3 SER B 16 -10.716 4.809 -7.427 1.00 0.00 H new ATOM 0 HG SER B 16 -9.780 5.043 -4.728 1.00 0.00 H new ATOM 1723 N GLY B 17 -12.997 3.747 -8.055 1.00 0.00 N ATOM 1724 CA GLY B 17 -13.929 3.912 -9.151 1.00 0.00 C ATOM 1725 C GLY B 17 -15.192 3.097 -8.957 1.00 0.00 C ATOM 1726 O GLY B 17 -15.564 2.304 -9.822 1.00 0.00 O ATOM 0 H GLY B 17 -12.285 3.031 -8.200 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -14.190 4.966 -9.248 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -13.447 3.616 -10.083 1.00 0.00 H new ATOM 1730 N TYR B 18 -15.859 3.292 -7.821 1.00 0.00 N ATOM 1731 CA TYR B 18 -17.092 2.569 -7.523 1.00 0.00 C ATOM 1732 C TYR B 18 -18.200 2.948 -8.504 1.00 0.00 C ATOM 1733 O TYR B 18 -19.059 3.772 -8.190 1.00 0.00 O ATOM 1734 CB TYR B 18 -17.548 2.866 -6.093 1.00 0.00 C ATOM 1735 CG TYR B 18 -18.350 1.749 -5.459 1.00 0.00 C ATOM 1736 CD1 TYR B 18 -17.752 0.540 -5.137 1.00 0.00 C ATOM 1737 CD2 TYR B 18 -19.700 1.910 -5.170 1.00 0.00 C ATOM 1738 CE1 TYR B 18 -18.474 -0.482 -4.547 1.00 0.00 C ATOM 1739 CE2 TYR B 18 -20.432 0.894 -4.583 1.00 0.00 C ATOM 1740 CZ TYR B 18 -19.814 -0.300 -4.271 1.00 0.00 C ATOM 1741 OH TYR B 18 -20.536 -1.315 -3.682 1.00 0.00 O ATOM 0 H TYR B 18 -15.566 3.944 -7.093 1.00 0.00 H new ATOM 0 HA TYR B 18 -16.889 1.503 -7.623 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -16.671 3.065 -5.477 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -18.149 3.775 -6.095 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -16.704 0.394 -5.351 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -20.186 2.845 -5.408 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -17.992 -1.417 -4.304 1.00 0.00 H new ATOM 0 HE2 TYR B 18 -21.481 1.034 -4.370 1.00 0.00 H new ATOM 0 HH TYR B 18 -21.464 -1.025 -3.555 1.00 0.00 H new ATOM 1751 N SER B 19 -18.180 2.345 -9.688 1.00 0.00 N ATOM 1752 CA SER B 19 -19.191 2.629 -10.702 1.00 0.00 C ATOM 1753 C SER B 19 -20.494 1.896 -10.391 1.00 0.00 C ATOM 1754 O SER B 19 -20.536 0.667 -10.374 1.00 0.00 O ATOM 1755 CB SER B 19 -18.684 2.231 -12.089 1.00 0.00 C ATOM 1756 OG SER B 19 -19.017 3.212 -13.054 1.00 0.00 O ATOM 0 H SER B 19 -17.479 1.660 -9.969 1.00 0.00 H new ATOM 0 HA SER B 19 -19.387 3.701 -10.692 1.00 0.00 H new ATOM 0 HB2 SER B 19 -17.603 2.097 -12.060 1.00 0.00 H new ATOM 0 HB3 SER B 19 -19.116 1.272 -12.376 1.00 0.00 H new ATOM 0 HG SER B 19 -18.680 2.935 -13.932 1.00 0.00 H new ATOM 1762 N SER B 20 -21.553 2.661 -10.143 1.00 0.00 N ATOM 1763 CA SER B 20 -22.856 2.083 -9.831 1.00 0.00 C ATOM 1764 C SER B 20 -23.800 2.186 -11.026 1.00 0.00 C ATOM 1765 O SER B 20 -24.036 1.204 -11.730 1.00 0.00 O ATOM 1766 CB SER B 20 -23.469 2.780 -8.612 1.00 0.00 C ATOM 1767 OG SER B 20 -22.599 3.774 -8.100 1.00 0.00 O ATOM 0 H SER B 20 -21.535 3.681 -10.152 1.00 0.00 H new ATOM 0 HA SER B 20 -22.712 1.028 -9.600 1.00 0.00 H new ATOM 0 HB2 SER B 20 -24.421 3.233 -8.889 1.00 0.00 H new ATOM 0 HB3 SER B 20 -23.681 2.044 -7.837 1.00 0.00 H new ATOM 0 HG SER B 20 -23.015 4.204 -7.324 1.00 0.00 H new ATOM 1773 N SER B 21 -24.340 3.380 -11.250 1.00 0.00 N ATOM 1774 CA SER B 21 -25.259 3.608 -12.358 1.00 0.00 C ATOM 1775 C SER B 21 -24.600 4.448 -13.448 1.00 0.00 C ATOM 1776 O SER B 21 -25.247 5.285 -14.079 1.00 0.00 O ATOM 1777 CB SER B 21 -26.531 4.300 -11.863 1.00 0.00 C ATOM 1778 OG SER B 21 -26.238 5.579 -11.327 1.00 0.00 O ATOM 0 H SER B 21 -24.156 4.204 -10.678 1.00 0.00 H new ATOM 0 HA SER B 21 -25.524 2.639 -12.781 1.00 0.00 H new ATOM 0 HB2 SER B 21 -27.239 4.400 -12.686 1.00 0.00 H new ATOM 0 HB3 SER B 21 -27.012 3.685 -11.103 1.00 0.00 H new ATOM 0 HG SER B 21 -27.066 6.002 -11.019 1.00 0.00 H new ATOM 1784 N TYR B 22 -23.310 4.217 -13.665 1.00 0.00 N ATOM 1785 CA TYR B 22 -22.561 4.950 -14.679 1.00 0.00 C ATOM 1786 C TYR B 22 -22.608 4.222 -16.020 1.00 0.00 C ATOM 1787 O TYR B 22 -21.541 4.066 -16.653 1.00 0.00 O ATOM 1788 CB TYR B 22 -21.111 5.143 -14.226 1.00 0.00 C ATOM 1789 CG TYR B 22 -20.863 6.461 -13.529 1.00 0.00 C ATOM 1790 CD1 TYR B 22 -21.263 6.658 -12.212 1.00 0.00 C ATOM 1791 CD2 TYR B 22 -20.229 7.508 -14.185 1.00 0.00 C ATOM 1792 CE1 TYR B 22 -21.038 7.863 -11.572 1.00 0.00 C ATOM 1793 CE2 TYR B 22 -20.001 8.714 -13.551 1.00 0.00 C ATOM 1794 CZ TYR B 22 -20.407 8.887 -12.244 1.00 0.00 C ATOM 1795 OH TYR B 22 -20.182 10.087 -11.610 1.00 0.00 O ATOM 1796 OXT TYR B 22 -23.715 3.810 -16.428 1.00 0.00 O ATOM 0 H TYR B 22 -22.761 3.527 -13.152 1.00 0.00 H new ATOM 0 HA TYR B 22 -23.023 5.929 -14.808 1.00 0.00 H new ATOM 0 HB2 TYR B 22 -20.838 4.330 -13.554 1.00 0.00 H new ATOM 0 HB3 TYR B 22 -20.456 5.072 -15.094 1.00 0.00 H new ATOM 0 HD1 TYR B 22 -21.757 5.858 -11.681 1.00 0.00 H new ATOM 0 HD2 TYR B 22 -19.909 7.377 -15.208 1.00 0.00 H new ATOM 0 HE1 TYR B 22 -21.356 8.001 -10.549 1.00 0.00 H new ATOM 0 HE2 TYR B 22 -19.507 9.518 -14.076 1.00 0.00 H new ATOM 0 HH TYR B 22 -19.726 10.701 -12.223 1.00 0.00 H new TER 1806 TYR B 22