USER MOD reduce.3.24.130724 H: found=0, std=0, add=1494, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1496 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 76 CYS SG : rot 70:sc= 0.96 USER MOD Set 1.2: B 80 SER OG : rot -115:sc= 0.971 USER MOD Set 2.1: A 80 SER OG : rot -117:sc= 1.09 USER MOD Set 2.2: B 76 CYS SG : rot 69:sc= 1.03 USER MOD Set 3.1: B 64 SER OG : rot 180:sc=-0.00381 USER MOD Set 3.2: B 65 ASN : amide:sc= -3.27! C(o=-3.3!,f=-3.9!) USER MOD Set 4.1: A 64 SER OG : rot 180:sc=-0.00526 USER MOD Set 4.2: A 65 ASN : amide:sc= -3.41! C(o=-3.4!,f=-4.1!) USER MOD Single : A 3 CYS SG : rot 151:sc= -0.823 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl 158:sc= -0.167 (180deg=-1.29) USER MOD Single : A 14 SER OG : rot 44:sc= 1.04 USER MOD Single : A 15 THR OG1 : rot 140:sc= -0.0473 USER MOD Single : A 17 HIS : no HD1:sc=-0.00294 X(o=-0.0029,f=-0.01) USER MOD Single : A 18 LYS NZ :NH3+ 151:sc= -0.279 (180deg=-1.3!) USER MOD Single : A 19 TYR OH : rot -83:sc= 0.174 USER MOD Single : A 20 SER OG : rot -39:sc= 1 USER MOD Single : A 22 LYS NZ :NH3+ -177:sc= -5.1! (180deg=-5.36!) USER MOD Single : A 26 LYS NZ :NH3+ -126:sc= 0.948 (180deg=-1.63!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.02 K(o=-0.02,f=-1.8!) USER MOD Single : A 31 LYS NZ :NH3+ 178:sc= 1.28 (180deg=1.24) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.0204) USER MOD Single : A 39 THR OG1 : rot 81:sc= 1.02 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -160:sc= -0.0508 (180deg=-0.466) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.106 K(o=-0.11,f=-2.5!) USER MOD Single : A 57 LYS NZ :NH3+ -178:sc= -1.67 (180deg=-1.78) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 67:sc= 0.539 USER MOD Single : A 61 ASN : amide:sc= -1.29 K(o=-1.3,f=-4!) USER MOD Single : A 68 ASN : amide:sc= -1.54! C(o=-1.5!,f=-5.8!) USER MOD Single : A 73 GLN : amide:sc= -0.51 K(o=-0.51,f=-1.8!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl 168:sc= -2.04 (180deg=-3.01!) USER MOD Single : A 85 MET CE :methyl 153:sc= -0.48 (180deg=-1.64!) USER MOD Single : A 86 CYS SG : rot -47:sc= 0.179! USER MOD Single : A 87 ASN : amide:sc= -6.78! C(o=-6.8!,f=-2!) USER MOD Single : A 96 LYS NZ :NH3+ 162:sc= -0.0353 (180deg=-0.353) USER MOD Single : B 3 CYS SG : rot 157:sc= -1.9! USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl 159:sc= -0.241 (180deg=-1.39) USER MOD Single : B 14 SER OG : rot 39:sc= 1.1 USER MOD Single : B 15 THR OG1 : rot 140:sc= 0.0103 USER MOD Single : B 17 HIS : no HD1:sc= -0.0138 X(o=-0.014,f=-0.034) USER MOD Single : B 18 LYS NZ :NH3+ 139:sc= -0.175 (180deg=-1.28!) USER MOD Single : B 19 TYR OH : rot -86:sc= 0.186 USER MOD Single : B 20 SER OG : rot -44:sc= 0.993 USER MOD Single : B 22 LYS NZ :NH3+ 176:sc= -4.96! (180deg=-5.46!) USER MOD Single : B 26 LYS NZ :NH3+ -129:sc= 1.04 (180deg=-1.55!) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 ASN : amide:sc= -0.027 K(o=-0.027,f=-1.9!) USER MOD Single : B 31 LYS NZ :NH3+ 178:sc= 1.27 (180deg=1.24) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 149:sc= 0 (180deg=-0.0102) USER MOD Single : B 39 THR OG1 : rot 81:sc= 1.04 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ -133:sc= -0.0453 (180deg=-0.511) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= -0.146 K(o=-0.15,f=-2.5!) USER MOD Single : B 57 LYS NZ :NH3+ 176:sc= -1.75 (180deg=-1.84) USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 72:sc= 0.596 USER MOD Single : B 61 ASN : amide:sc= -1.25 K(o=-1.3,f=-3.6!) USER MOD Single : B 68 ASN : amide:sc= -1.56! C(o=-1.6!,f=-5.9!) USER MOD Single : B 73 GLN : amide:sc= -0.412 K(o=-0.41,f=-1.7!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 81 CYS SG : rot -18:sc= 0.0689 USER MOD Single : B 84 MET CE :methyl 169:sc= -1.6 (180deg=-2.55) USER MOD Single : B 85 MET CE :methyl 149:sc= -0.44 (180deg=-1.68!) USER MOD Single : B 86 CYS SG : rot -51:sc= 0.227! USER MOD Single : B 87 ASN : amide:sc= -6.1! C(o=-6.1!,f=-1.6!) USER MOD Single : B 96 LYS NZ :NH3+ 165:sc= -0.0239 (180deg=-0.292) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 76.487 1.893 -19.404 1.00 0.00 N ATOM 21 CA ALA A 2 75.552 2.764 -18.641 1.00 0.00 C ATOM 22 C ALA A 2 75.708 2.492 -17.143 1.00 0.00 C ATOM 23 O ALA A 2 75.884 1.367 -16.720 1.00 0.00 O ATOM 24 CB ALA A 2 74.113 2.466 -19.068 1.00 0.00 C ATOM 0 HA ALA A 2 75.782 3.810 -18.845 1.00 0.00 H new ATOM 0 HB1 ALA A 2 73.428 3.104 -18.509 1.00 0.00 H new ATOM 0 HB2 ALA A 2 74.002 2.661 -20.135 1.00 0.00 H new ATOM 0 HB3 ALA A 2 73.882 1.420 -18.865 1.00 0.00 H new ATOM 30 N CYS A 3 75.645 3.517 -16.339 1.00 0.00 N ATOM 31 CA CYS A 3 75.787 3.325 -14.868 1.00 0.00 C ATOM 32 C CYS A 3 77.070 2.537 -14.556 1.00 0.00 C ATOM 33 O CYS A 3 77.013 1.459 -13.998 1.00 0.00 O ATOM 34 CB CYS A 3 74.576 2.550 -14.345 1.00 0.00 C ATOM 35 SG CYS A 3 74.500 2.694 -12.543 1.00 0.00 S ATOM 0 H CYS A 3 75.501 4.482 -16.638 1.00 0.00 H new ATOM 0 HA CYS A 3 75.844 4.300 -14.384 1.00 0.00 H new ATOM 0 HB2 CYS A 3 73.661 2.940 -14.791 1.00 0.00 H new ATOM 0 HB3 CYS A 3 74.649 1.502 -14.634 1.00 0.00 H new ATOM 0 HG CYS A 3 73.263 2.607 -12.153 1.00 0.00 H new ATOM 41 N PRO A 4 78.226 3.068 -14.900 1.00 0.00 N ATOM 42 CA PRO A 4 79.517 2.370 -14.620 1.00 0.00 C ATOM 43 C PRO A 4 79.638 1.922 -13.152 1.00 0.00 C ATOM 44 O PRO A 4 80.614 1.317 -12.756 1.00 0.00 O ATOM 45 CB PRO A 4 80.564 3.444 -14.972 1.00 0.00 C ATOM 46 CG PRO A 4 79.850 4.592 -15.716 1.00 0.00 C ATOM 47 CD PRO A 4 78.327 4.389 -15.586 1.00 0.00 C ATOM 0 HA PRO A 4 79.629 1.447 -15.188 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.043 3.818 -14.067 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.350 3.018 -15.596 1.00 0.00 H new ATOM 0 HG2 PRO A 4 80.141 5.554 -15.295 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.142 4.602 -16.766 1.00 0.00 H new ATOM 0 HD2 PRO A 4 77.861 5.184 -15.003 1.00 0.00 H new ATOM 0 HD3 PRO A 4 77.836 4.378 -16.559 1.00 0.00 H new ATOM 55 N LEU A 5 78.654 2.217 -12.351 1.00 0.00 N ATOM 56 CA LEU A 5 78.706 1.818 -10.917 1.00 0.00 C ATOM 57 C LEU A 5 78.818 0.296 -10.823 1.00 0.00 C ATOM 58 O LEU A 5 79.513 -0.234 -9.980 1.00 0.00 O ATOM 59 CB LEU A 5 77.423 2.288 -10.221 1.00 0.00 C ATOM 60 CG LEU A 5 77.434 1.896 -8.735 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.634 2.538 -8.018 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.129 2.375 -8.086 1.00 0.00 C ATOM 0 H LEU A 5 77.811 2.720 -12.629 1.00 0.00 H new ATOM 0 HA LEU A 5 79.570 2.274 -10.433 1.00 0.00 H new ATOM 0 HB2 LEU A 5 77.328 3.370 -10.316 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.555 1.847 -10.712 1.00 0.00 H new ATOM 0 HG LEU A 5 77.519 0.813 -8.649 1.00 0.00 H new ATOM 0 HD11 LEU A 5 78.626 2.250 -6.967 1.00 0.00 H new ATOM 0 HD12 LEU A 5 79.560 2.197 -8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 5 78.567 3.623 -8.097 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.126 2.102 -7.031 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.052 3.458 -8.181 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.281 1.906 -8.585 1.00 0.00 H new ATOM 74 N GLU A 6 78.132 -0.409 -11.673 1.00 0.00 N ATOM 75 CA GLU A 6 78.186 -1.894 -11.626 1.00 0.00 C ATOM 76 C GLU A 6 79.630 -2.368 -11.842 1.00 0.00 C ATOM 77 O GLU A 6 80.119 -3.229 -11.139 1.00 0.00 O ATOM 78 CB GLU A 6 77.299 -2.447 -12.739 1.00 0.00 C ATOM 79 CG GLU A 6 75.831 -2.183 -12.395 1.00 0.00 C ATOM 80 CD GLU A 6 74.945 -2.622 -13.562 1.00 0.00 C ATOM 81 OE1 GLU A 6 75.486 -3.100 -14.543 1.00 0.00 O ATOM 82 OE2 GLU A 6 73.739 -2.474 -13.451 1.00 0.00 O ATOM 0 H GLU A 6 77.533 -0.020 -12.402 1.00 0.00 H new ATOM 0 HA GLU A 6 77.838 -2.247 -10.655 1.00 0.00 H new ATOM 0 HB2 GLU A 6 77.552 -1.976 -13.689 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.470 -3.517 -12.858 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.555 -2.726 -11.491 1.00 0.00 H new ATOM 0 HG3 GLU A 6 75.680 -1.123 -12.189 1.00 0.00 H new ATOM 89 N LYS A 7 80.322 -1.808 -12.796 1.00 0.00 N ATOM 90 CA LYS A 7 81.731 -2.228 -13.028 1.00 0.00 C ATOM 91 C LYS A 7 82.574 -1.758 -11.850 1.00 0.00 C ATOM 92 O LYS A 7 83.324 -2.512 -11.265 1.00 0.00 O ATOM 93 CB LYS A 7 82.248 -1.599 -14.327 1.00 0.00 C ATOM 94 CG LYS A 7 83.666 -2.102 -14.617 1.00 0.00 C ATOM 95 CD LYS A 7 84.222 -1.427 -15.879 1.00 0.00 C ATOM 96 CE LYS A 7 83.363 -1.782 -17.099 1.00 0.00 C ATOM 97 NZ LYS A 7 84.171 -1.606 -18.340 1.00 0.00 N ATOM 0 H LYS A 7 79.974 -1.081 -13.422 1.00 0.00 H new ATOM 0 HA LYS A 7 81.792 -3.313 -13.117 1.00 0.00 H new ATOM 0 HB2 LYS A 7 81.585 -1.854 -15.154 1.00 0.00 H new ATOM 0 HB3 LYS A 7 82.248 -0.512 -14.241 1.00 0.00 H new ATOM 0 HG2 LYS A 7 84.315 -1.891 -13.767 1.00 0.00 H new ATOM 0 HG3 LYS A 7 83.656 -3.184 -14.749 1.00 0.00 H new ATOM 0 HD2 LYS A 7 84.241 -0.346 -15.742 1.00 0.00 H new ATOM 0 HD3 LYS A 7 85.251 -1.745 -16.046 1.00 0.00 H new ATOM 0 HE2 LYS A 7 83.011 -2.811 -17.023 1.00 0.00 H new ATOM 0 HE3 LYS A 7 82.479 -1.145 -17.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 83.591 -1.846 -19.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 84.486 -0.617 -18.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 85.001 -2.232 -18.305 1.00 0.00 H new ATOM 111 N ALA A 8 82.430 -0.523 -11.475 1.00 0.00 N ATOM 112 CA ALA A 8 83.192 -0.019 -10.311 1.00 0.00 C ATOM 113 C ALA A 8 82.781 -0.867 -9.115 1.00 0.00 C ATOM 114 O ALA A 8 83.590 -1.258 -8.301 1.00 0.00 O ATOM 115 CB ALA A 8 82.878 1.460 -10.078 1.00 0.00 C ATOM 0 H ALA A 8 81.818 0.158 -11.925 1.00 0.00 H new ATOM 0 HA ALA A 8 84.267 -0.094 -10.475 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.444 1.821 -9.219 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.154 2.034 -10.962 1.00 0.00 H new ATOM 0 HB3 ALA A 8 81.812 1.580 -9.886 1.00 0.00 H new ATOM 121 N LEU A 9 81.523 -1.193 -9.029 1.00 0.00 N ATOM 122 CA LEU A 9 81.079 -2.061 -7.916 1.00 0.00 C ATOM 123 C LEU A 9 81.854 -3.363 -8.058 1.00 0.00 C ATOM 124 O LEU A 9 82.327 -3.930 -7.093 1.00 0.00 O ATOM 125 CB LEU A 9 79.569 -2.322 -8.020 1.00 0.00 C ATOM 126 CG LEU A 9 79.102 -3.222 -6.866 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.311 -2.513 -5.516 1.00 0.00 C ATOM 128 CD2 LEU A 9 77.613 -3.541 -7.056 1.00 0.00 C ATOM 0 H LEU A 9 80.792 -0.897 -9.676 1.00 0.00 H new ATOM 0 HA LEU A 9 81.263 -1.596 -6.948 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.027 -1.377 -7.995 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.340 -2.795 -8.975 1.00 0.00 H new ATOM 0 HG LEU A 9 79.685 -4.143 -6.868 1.00 0.00 H new ATOM 0 HD11 LEU A 9 78.975 -3.163 -4.708 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.369 -2.286 -5.384 1.00 0.00 H new ATOM 0 HD13 LEU A 9 78.737 -1.587 -5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 9 77.271 -4.180 -6.242 1.00 0.00 H new ATOM 0 HD22 LEU A 9 77.039 -2.614 -7.056 1.00 0.00 H new ATOM 0 HD23 LEU A 9 77.470 -4.056 -8.006 1.00 0.00 H new ATOM 140 N ASP A 10 82.021 -3.820 -9.272 1.00 0.00 N ATOM 141 CA ASP A 10 82.806 -5.063 -9.488 1.00 0.00 C ATOM 142 C ASP A 10 84.269 -4.780 -9.154 1.00 0.00 C ATOM 143 O ASP A 10 84.972 -5.633 -8.650 1.00 0.00 O ATOM 144 CB ASP A 10 82.679 -5.520 -10.945 1.00 0.00 C ATOM 145 CG ASP A 10 83.314 -6.902 -11.103 1.00 0.00 C ATOM 146 OD1 ASP A 10 83.978 -7.336 -10.175 1.00 0.00 O ATOM 147 OD2 ASP A 10 83.125 -7.502 -12.148 1.00 0.00 O ATOM 0 H ASP A 10 81.648 -3.386 -10.117 1.00 0.00 H new ATOM 0 HA ASP A 10 82.426 -5.856 -8.845 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.629 -5.555 -11.236 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.169 -4.805 -11.606 1.00 0.00 H new ATOM 152 N VAL A 11 84.742 -3.589 -9.421 1.00 0.00 N ATOM 153 CA VAL A 11 86.167 -3.284 -9.097 1.00 0.00 C ATOM 154 C VAL A 11 86.370 -3.466 -7.593 1.00 0.00 C ATOM 155 O VAL A 11 87.365 -4.002 -7.149 1.00 0.00 O ATOM 156 CB VAL A 11 86.492 -1.838 -9.487 1.00 0.00 C ATOM 157 CG1 VAL A 11 87.867 -1.440 -8.943 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.489 -1.709 -11.009 1.00 0.00 C ATOM 0 H VAL A 11 84.212 -2.826 -9.843 1.00 0.00 H new ATOM 0 HA VAL A 11 86.825 -3.954 -9.650 1.00 0.00 H new ATOM 0 HB VAL A 11 85.738 -1.177 -9.060 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.086 -0.411 -9.227 1.00 0.00 H new ATOM 0 HG12 VAL A 11 87.867 -1.525 -7.856 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.628 -2.101 -9.358 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.720 -0.681 -11.287 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.239 -2.377 -11.432 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.506 -1.977 -11.395 1.00 0.00 H new ATOM 168 N MET A 12 85.423 -3.033 -6.805 1.00 0.00 N ATOM 169 CA MET A 12 85.551 -3.193 -5.331 1.00 0.00 C ATOM 170 C MET A 12 85.664 -4.683 -5.012 1.00 0.00 C ATOM 171 O MET A 12 86.473 -5.106 -4.219 1.00 0.00 O ATOM 172 CB MET A 12 84.303 -2.623 -4.660 1.00 0.00 C ATOM 173 CG MET A 12 84.293 -1.096 -4.791 1.00 0.00 C ATOM 174 SD MET A 12 82.622 -0.469 -4.477 1.00 0.00 S ATOM 175 CE MET A 12 82.309 -1.380 -2.946 1.00 0.00 C ATOM 0 H MET A 12 84.567 -2.576 -7.120 1.00 0.00 H new ATOM 0 HA MET A 12 86.433 -2.667 -4.967 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.408 -3.042 -5.120 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.283 -2.907 -3.608 1.00 0.00 H new ATOM 0 HG2 MET A 12 84.996 -0.656 -4.084 1.00 0.00 H new ATOM 0 HG3 MET A 12 84.620 -0.805 -5.789 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.529 -0.875 -2.375 1.00 0.00 H new ATOM 0 HE2 MET A 12 81.986 -2.393 -3.185 1.00 0.00 H new ATOM 0 HE3 MET A 12 83.223 -1.421 -2.354 1.00 0.00 H new ATOM 185 N VAL A 13 84.845 -5.479 -5.631 1.00 0.00 N ATOM 186 CA VAL A 13 84.888 -6.948 -5.391 1.00 0.00 C ATOM 187 C VAL A 13 86.088 -7.561 -6.112 1.00 0.00 C ATOM 188 O VAL A 13 86.743 -8.445 -5.601 1.00 0.00 O ATOM 189 CB VAL A 13 83.591 -7.570 -5.898 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.653 -9.099 -5.790 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.448 -7.038 -5.043 1.00 0.00 C ATOM 0 H VAL A 13 84.139 -5.174 -6.301 1.00 0.00 H new ATOM 0 HA VAL A 13 84.992 -7.144 -4.324 1.00 0.00 H new ATOM 0 HB VAL A 13 83.438 -7.310 -6.945 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.720 -9.528 -6.156 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.483 -9.473 -6.389 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.800 -9.385 -4.748 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.507 -7.468 -5.385 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.615 -7.312 -4.001 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.404 -5.952 -5.130 1.00 0.00 H new ATOM 201 N SER A 14 86.373 -7.117 -7.307 1.00 0.00 N ATOM 202 CA SER A 14 87.522 -7.710 -8.050 1.00 0.00 C ATOM 203 C SER A 14 88.812 -7.502 -7.250 1.00 0.00 C ATOM 204 O SER A 14 89.575 -8.425 -7.049 1.00 0.00 O ATOM 205 CB SER A 14 87.659 -7.026 -9.410 1.00 0.00 C ATOM 206 OG SER A 14 86.427 -7.124 -10.113 1.00 0.00 O ATOM 0 H SER A 14 85.867 -6.379 -7.796 1.00 0.00 H new ATOM 0 HA SER A 14 87.347 -8.776 -8.192 1.00 0.00 H new ATOM 0 HB2 SER A 14 87.933 -5.979 -9.277 1.00 0.00 H new ATOM 0 HB3 SER A 14 88.458 -7.494 -9.986 1.00 0.00 H new ATOM 0 HG SER A 14 85.686 -6.927 -9.503 1.00 0.00 H new ATOM 212 N THR A 15 89.059 -6.310 -6.776 1.00 0.00 N ATOM 213 CA THR A 15 90.300 -6.084 -5.974 1.00 0.00 C ATOM 214 C THR A 15 90.265 -6.995 -4.740 1.00 0.00 C ATOM 215 O THR A 15 91.257 -7.563 -4.341 1.00 0.00 O ATOM 216 CB THR A 15 90.391 -4.597 -5.569 1.00 0.00 C ATOM 217 OG1 THR A 15 91.756 -4.224 -5.459 1.00 0.00 O ATOM 218 CG2 THR A 15 89.685 -4.332 -4.231 1.00 0.00 C ATOM 0 H THR A 15 88.465 -5.491 -6.906 1.00 0.00 H new ATOM 0 HA THR A 15 91.184 -6.327 -6.564 1.00 0.00 H new ATOM 0 HB THR A 15 89.894 -4.005 -6.338 1.00 0.00 H new ATOM 0 HG1 THR A 15 91.880 -3.324 -5.827 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.770 -3.275 -3.978 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.632 -4.602 -4.315 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.151 -4.931 -3.449 1.00 0.00 H new ATOM 226 N PHE A 16 89.112 -7.124 -4.148 1.00 0.00 N ATOM 227 CA PHE A 16 88.956 -7.978 -2.934 1.00 0.00 C ATOM 228 C PHE A 16 89.349 -9.415 -3.283 1.00 0.00 C ATOM 229 O PHE A 16 89.985 -10.104 -2.510 1.00 0.00 O ATOM 230 CB PHE A 16 87.477 -7.941 -2.521 1.00 0.00 C ATOM 231 CG PHE A 16 87.271 -8.598 -1.173 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.294 -9.994 -1.055 1.00 0.00 C ATOM 233 CD2 PHE A 16 87.027 -7.807 -0.042 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.075 -10.596 0.191 1.00 0.00 C ATOM 235 CE2 PHE A 16 86.811 -8.410 1.202 1.00 0.00 C ATOM 236 CZ PHE A 16 86.835 -9.804 1.319 1.00 0.00 C ATOM 0 H PHE A 16 88.255 -6.666 -4.458 1.00 0.00 H new ATOM 0 HA PHE A 16 89.588 -7.618 -2.122 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.133 -6.907 -2.482 1.00 0.00 H new ATOM 0 HB3 PHE A 16 86.873 -8.449 -3.273 1.00 0.00 H new ATOM 0 HD1 PHE A 16 87.481 -10.606 -1.925 1.00 0.00 H new ATOM 0 HD2 PHE A 16 87.006 -6.731 -0.131 1.00 0.00 H new ATOM 0 HE1 PHE A 16 87.091 -11.672 0.281 1.00 0.00 H new ATOM 0 HE2 PHE A 16 86.626 -7.799 2.073 1.00 0.00 H new ATOM 0 HZ PHE A 16 86.668 -10.268 2.280 1.00 0.00 H new ATOM 246 N HIS A 17 88.970 -9.865 -4.446 1.00 0.00 N ATOM 247 CA HIS A 17 89.308 -11.251 -4.874 1.00 0.00 C ATOM 248 C HIS A 17 90.804 -11.359 -5.159 1.00 0.00 C ATOM 249 O HIS A 17 91.386 -12.421 -5.054 1.00 0.00 O ATOM 250 CB HIS A 17 88.521 -11.597 -6.138 1.00 0.00 C ATOM 251 CG HIS A 17 88.864 -12.993 -6.582 1.00 0.00 C ATOM 252 ND1 HIS A 17 88.617 -14.104 -5.790 1.00 0.00 N ATOM 253 CD2 HIS A 17 89.432 -13.474 -7.737 1.00 0.00 C ATOM 254 CE1 HIS A 17 89.031 -15.190 -6.471 1.00 0.00 C ATOM 255 NE2 HIS A 17 89.534 -14.858 -7.661 1.00 0.00 N ATOM 0 H HIS A 17 88.434 -9.325 -5.126 1.00 0.00 H new ATOM 0 HA HIS A 17 89.047 -11.947 -4.077 1.00 0.00 H new ATOM 0 HB2 HIS A 17 87.451 -11.519 -5.945 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.755 -10.885 -6.930 1.00 0.00 H new ATOM 0 HD2 HIS A 17 89.750 -12.870 -8.574 1.00 0.00 H new ATOM 0 HE1 HIS A 17 88.964 -16.202 -6.100 1.00 0.00 H new ATOM 0 HE2 HIS A 17 89.914 -15.488 -8.367 1.00 0.00 H new ATOM 264 N LYS A 18 91.437 -10.278 -5.522 1.00 0.00 N ATOM 265 CA LYS A 18 92.893 -10.355 -5.808 1.00 0.00 C ATOM 266 C LYS A 18 93.580 -10.832 -4.535 1.00 0.00 C ATOM 267 O LYS A 18 94.446 -11.685 -4.559 1.00 0.00 O ATOM 268 CB LYS A 18 93.410 -8.969 -6.204 1.00 0.00 C ATOM 269 CG LYS A 18 94.912 -9.043 -6.507 1.00 0.00 C ATOM 270 CD LYS A 18 95.383 -7.746 -7.183 1.00 0.00 C ATOM 271 CE LYS A 18 95.507 -6.623 -6.150 1.00 0.00 C ATOM 272 NZ LYS A 18 96.453 -7.039 -5.078 1.00 0.00 N ATOM 0 H LYS A 18 91.014 -9.356 -5.631 1.00 0.00 H new ATOM 0 HA LYS A 18 93.097 -11.042 -6.629 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.871 -8.606 -7.079 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.227 -8.258 -5.398 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.469 -9.203 -5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 18 95.118 -9.895 -7.155 1.00 0.00 H new ATOM 0 HD2 LYS A 18 96.345 -7.910 -7.669 1.00 0.00 H new ATOM 0 HD3 LYS A 18 94.677 -7.457 -7.962 1.00 0.00 H new ATOM 0 HE2 LYS A 18 95.862 -5.711 -6.629 1.00 0.00 H new ATOM 0 HE3 LYS A 18 94.530 -6.399 -5.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 96.916 -6.198 -4.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 95.931 -7.536 -4.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 97.173 -7.674 -5.478 1.00 0.00 H new ATOM 286 N TYR A 19 93.155 -10.326 -3.412 1.00 0.00 N ATOM 287 CA TYR A 19 93.732 -10.791 -2.124 1.00 0.00 C ATOM 288 C TYR A 19 93.230 -12.205 -1.869 1.00 0.00 C ATOM 289 O TYR A 19 93.942 -13.048 -1.362 1.00 0.00 O ATOM 290 CB TYR A 19 93.305 -9.855 -0.988 1.00 0.00 C ATOM 291 CG TYR A 19 94.008 -8.532 -1.165 1.00 0.00 C ATOM 292 CD1 TYR A 19 95.269 -8.326 -0.592 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.412 -7.520 -1.922 1.00 0.00 C ATOM 294 CE1 TYR A 19 95.932 -7.107 -0.774 1.00 0.00 C ATOM 295 CE2 TYR A 19 94.072 -6.302 -2.111 1.00 0.00 C ATOM 296 CZ TYR A 19 95.335 -6.094 -1.537 1.00 0.00 C ATOM 297 OH TYR A 19 95.988 -4.893 -1.723 1.00 0.00 O ATOM 0 H TYR A 19 92.433 -9.610 -3.332 1.00 0.00 H new ATOM 0 HA TYR A 19 94.821 -10.785 -2.170 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.224 -9.714 -1.000 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.559 -10.292 -0.022 1.00 0.00 H new ATOM 0 HD1 TYR A 19 95.731 -9.109 -0.009 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.439 -7.679 -2.362 1.00 0.00 H new ATOM 0 HE1 TYR A 19 96.902 -6.947 -0.327 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.610 -5.522 -2.698 1.00 0.00 H new ATOM 0 HH TYR A 19 95.833 -4.313 -0.948 1.00 0.00 H new ATOM 307 N SER A 20 91.996 -12.473 -2.208 1.00 0.00 N ATOM 308 CA SER A 20 91.441 -13.835 -1.972 1.00 0.00 C ATOM 309 C SER A 20 91.732 -14.224 -0.527 1.00 0.00 C ATOM 310 O SER A 20 91.626 -15.371 -0.139 1.00 0.00 O ATOM 311 CB SER A 20 92.117 -14.829 -2.916 1.00 0.00 C ATOM 312 OG SER A 20 91.588 -16.129 -2.691 1.00 0.00 O ATOM 0 H SER A 20 91.352 -11.809 -2.637 1.00 0.00 H new ATOM 0 HA SER A 20 90.367 -13.844 -2.156 1.00 0.00 H new ATOM 0 HB2 SER A 20 91.954 -14.532 -3.952 1.00 0.00 H new ATOM 0 HB3 SER A 20 93.194 -14.829 -2.751 1.00 0.00 H new ATOM 0 HG SER A 20 91.441 -16.261 -1.731 1.00 0.00 H new ATOM 318 N GLY A 21 92.115 -13.264 0.265 1.00 0.00 N ATOM 319 CA GLY A 21 92.437 -13.555 1.689 1.00 0.00 C ATOM 320 C GLY A 21 93.710 -14.397 1.735 1.00 0.00 C ATOM 321 O GLY A 21 93.685 -15.568 2.058 1.00 0.00 O ATOM 0 H GLY A 21 92.219 -12.288 -0.012 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.576 -12.627 2.243 1.00 0.00 H new ATOM 0 HA3 GLY A 21 91.613 -14.088 2.163 1.00 0.00 H new ATOM 325 N LYS A 22 94.820 -13.810 1.389 1.00 0.00 N ATOM 326 CA LYS A 22 96.099 -14.570 1.384 1.00 0.00 C ATOM 327 C LYS A 22 96.391 -15.099 2.790 1.00 0.00 C ATOM 328 O LYS A 22 96.849 -16.213 2.956 1.00 0.00 O ATOM 329 CB LYS A 22 97.230 -13.644 0.932 1.00 0.00 C ATOM 330 CG LYS A 22 96.987 -13.238 -0.525 1.00 0.00 C ATOM 331 CD LYS A 22 98.167 -12.417 -1.057 1.00 0.00 C ATOM 332 CE LYS A 22 98.344 -11.143 -0.225 1.00 0.00 C ATOM 333 NZ LYS A 22 99.110 -10.140 -1.019 1.00 0.00 N ATOM 0 H LYS A 22 94.897 -12.832 1.108 1.00 0.00 H new ATOM 0 HA LYS A 22 96.022 -15.413 0.698 1.00 0.00 H new ATOM 0 HB2 LYS A 22 97.270 -12.760 1.568 1.00 0.00 H new ATOM 0 HB3 LYS A 22 98.191 -14.149 1.027 1.00 0.00 H new ATOM 0 HG2 LYS A 22 96.850 -14.128 -1.139 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.069 -12.656 -0.598 1.00 0.00 H new ATOM 0 HD2 LYS A 22 99.079 -13.013 -1.021 1.00 0.00 H new ATOM 0 HD3 LYS A 22 97.997 -12.157 -2.102 1.00 0.00 H new ATOM 0 HE2 LYS A 22 97.371 -10.738 0.053 1.00 0.00 H new ATOM 0 HE3 LYS A 22 98.871 -11.370 0.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 99.277 -9.293 -0.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 100.023 -10.548 -1.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 98.566 -9.879 -1.866 1.00 0.00 H new ATOM 347 N GLU A 23 96.130 -14.313 3.805 1.00 0.00 N ATOM 348 CA GLU A 23 96.394 -14.767 5.208 1.00 0.00 C ATOM 349 C GLU A 23 95.066 -15.090 5.895 1.00 0.00 C ATOM 350 O GLU A 23 94.082 -14.396 5.729 1.00 0.00 O ATOM 351 CB GLU A 23 97.094 -13.648 5.976 1.00 0.00 C ATOM 352 CG GLU A 23 97.606 -14.178 7.317 1.00 0.00 C ATOM 353 CD GLU A 23 98.769 -15.142 7.072 1.00 0.00 C ATOM 354 OE1 GLU A 23 99.350 -15.076 6.000 1.00 0.00 O ATOM 355 OE2 GLU A 23 99.056 -15.932 7.956 1.00 0.00 O ATOM 0 H GLU A 23 95.744 -13.372 3.723 1.00 0.00 H new ATOM 0 HA GLU A 23 97.025 -15.655 5.191 1.00 0.00 H new ATOM 0 HB2 GLU A 23 97.925 -13.256 5.389 1.00 0.00 H new ATOM 0 HB3 GLU A 23 96.403 -12.821 6.142 1.00 0.00 H new ATOM 0 HG2 GLU A 23 97.932 -13.350 7.947 1.00 0.00 H new ATOM 0 HG3 GLU A 23 96.803 -14.687 7.850 1.00 0.00 H new ATOM 362 N GLY A 24 95.031 -16.139 6.665 1.00 0.00 N ATOM 363 CA GLY A 24 93.767 -16.511 7.368 1.00 0.00 C ATOM 364 C GLY A 24 92.817 -17.199 6.386 1.00 0.00 C ATOM 365 O GLY A 24 93.198 -17.567 5.294 1.00 0.00 O ATOM 0 H GLY A 24 95.823 -16.758 6.840 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.986 -17.175 8.204 1.00 0.00 H new ATOM 0 HA3 GLY A 24 93.295 -15.621 7.784 1.00 0.00 H new ATOM 369 N ASP A 25 91.577 -17.374 6.764 1.00 0.00 N ATOM 370 CA ASP A 25 90.607 -18.033 5.846 1.00 0.00 C ATOM 371 C ASP A 25 90.494 -17.218 4.561 1.00 0.00 C ATOM 372 O ASP A 25 90.426 -16.005 4.587 1.00 0.00 O ATOM 373 CB ASP A 25 89.236 -18.117 6.520 1.00 0.00 C ATOM 374 CG ASP A 25 88.295 -18.958 5.655 1.00 0.00 C ATOM 375 OD1 ASP A 25 88.584 -19.117 4.481 1.00 0.00 O ATOM 376 OD2 ASP A 25 87.300 -19.427 6.182 1.00 0.00 O ATOM 0 H ASP A 25 91.197 -17.089 7.667 1.00 0.00 H new ATOM 0 HA ASP A 25 90.955 -19.039 5.612 1.00 0.00 H new ATOM 0 HB2 ASP A 25 89.332 -18.562 7.510 1.00 0.00 H new ATOM 0 HB3 ASP A 25 88.825 -17.117 6.658 1.00 0.00 H new ATOM 381 N LYS A 26 90.472 -17.874 3.437 1.00 0.00 N ATOM 382 CA LYS A 26 90.361 -17.136 2.154 1.00 0.00 C ATOM 383 C LYS A 26 88.949 -16.570 2.018 1.00 0.00 C ATOM 384 O LYS A 26 88.667 -15.773 1.145 1.00 0.00 O ATOM 385 CB LYS A 26 90.679 -18.075 0.986 1.00 0.00 C ATOM 386 CG LYS A 26 89.658 -19.212 0.937 1.00 0.00 C ATOM 387 CD LYS A 26 90.127 -20.267 -0.066 1.00 0.00 C ATOM 388 CE LYS A 26 89.012 -21.286 -0.300 1.00 0.00 C ATOM 389 NZ LYS A 26 88.731 -22.009 0.973 1.00 0.00 N ATOM 0 H LYS A 26 90.526 -18.889 3.353 1.00 0.00 H new ATOM 0 HA LYS A 26 91.076 -16.313 2.140 1.00 0.00 H new ATOM 0 HB2 LYS A 26 90.663 -17.520 0.048 1.00 0.00 H new ATOM 0 HB3 LYS A 26 91.684 -18.482 1.099 1.00 0.00 H new ATOM 0 HG2 LYS A 26 89.545 -19.658 1.925 1.00 0.00 H new ATOM 0 HG3 LYS A 26 88.680 -18.827 0.647 1.00 0.00 H new ATOM 0 HD2 LYS A 26 90.402 -19.791 -1.007 1.00 0.00 H new ATOM 0 HD3 LYS A 26 91.019 -20.769 0.309 1.00 0.00 H new ATOM 0 HE2 LYS A 26 88.112 -20.783 -0.652 1.00 0.00 H new ATOM 0 HE3 LYS A 26 89.306 -21.993 -1.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 88.799 -23.034 0.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 89.425 -21.725 1.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 87.773 -21.773 1.302 1.00 0.00 H new ATOM 403 N PHE A 27 88.058 -16.972 2.886 1.00 0.00 N ATOM 404 CA PHE A 27 86.656 -16.451 2.820 1.00 0.00 C ATOM 405 C PHE A 27 86.510 -15.248 3.754 1.00 0.00 C ATOM 406 O PHE A 27 85.443 -14.683 3.884 1.00 0.00 O ATOM 407 CB PHE A 27 85.682 -17.536 3.288 1.00 0.00 C ATOM 408 CG PHE A 27 85.784 -18.756 2.399 1.00 0.00 C ATOM 409 CD1 PHE A 27 85.461 -18.660 1.039 1.00 0.00 C ATOM 410 CD2 PHE A 27 86.188 -19.987 2.936 1.00 0.00 C ATOM 411 CE1 PHE A 27 85.540 -19.791 0.219 1.00 0.00 C ATOM 412 CE2 PHE A 27 86.270 -21.117 2.114 1.00 0.00 C ATOM 413 CZ PHE A 27 85.945 -21.019 0.756 1.00 0.00 C ATOM 0 H PHE A 27 88.238 -17.638 3.638 1.00 0.00 H new ATOM 0 HA PHE A 27 86.437 -16.162 1.792 1.00 0.00 H new ATOM 0 HB2 PHE A 27 85.902 -17.811 4.320 1.00 0.00 H new ATOM 0 HB3 PHE A 27 84.663 -17.150 3.271 1.00 0.00 H new ATOM 0 HD1 PHE A 27 85.151 -17.713 0.623 1.00 0.00 H new ATOM 0 HD2 PHE A 27 86.436 -20.063 3.984 1.00 0.00 H new ATOM 0 HE1 PHE A 27 85.288 -19.717 -0.829 1.00 0.00 H new ATOM 0 HE2 PHE A 27 86.584 -22.064 2.527 1.00 0.00 H new ATOM 0 HZ PHE A 27 86.007 -21.891 0.122 1.00 0.00 H new ATOM 423 N LYS A 28 87.563 -14.871 4.433 1.00 0.00 N ATOM 424 CA LYS A 28 87.470 -13.724 5.393 1.00 0.00 C ATOM 425 C LYS A 28 88.758 -12.897 5.321 1.00 0.00 C ATOM 426 O LYS A 28 89.782 -13.382 4.879 1.00 0.00 O ATOM 427 CB LYS A 28 87.329 -14.291 6.809 1.00 0.00 C ATOM 428 CG LYS A 28 86.072 -15.160 6.896 1.00 0.00 C ATOM 429 CD LYS A 28 85.934 -15.726 8.309 1.00 0.00 C ATOM 430 CE LYS A 28 84.689 -16.612 8.375 1.00 0.00 C ATOM 431 NZ LYS A 28 84.651 -17.319 9.685 1.00 0.00 N ATOM 0 H LYS A 28 88.483 -15.306 4.366 1.00 0.00 H new ATOM 0 HA LYS A 28 86.615 -13.096 5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 28 88.209 -14.882 7.064 1.00 0.00 H new ATOM 0 HB3 LYS A 28 87.271 -13.478 7.532 1.00 0.00 H new ATOM 0 HG2 LYS A 28 85.192 -14.569 6.643 1.00 0.00 H new ATOM 0 HG3 LYS A 28 86.129 -15.973 6.172 1.00 0.00 H new ATOM 0 HD2 LYS A 28 86.821 -16.304 8.571 1.00 0.00 H new ATOM 0 HD3 LYS A 28 85.857 -14.915 9.033 1.00 0.00 H new ATOM 0 HE2 LYS A 28 83.792 -16.006 8.251 1.00 0.00 H new ATOM 0 HE3 LYS A 28 84.701 -17.335 7.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 83.804 -17.921 9.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 85.502 -17.909 9.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 84.620 -16.621 10.455 1.00 0.00 H new ATOM 445 N LEU A 29 88.728 -11.660 5.775 1.00 0.00 N ATOM 446 CA LEU A 29 89.966 -10.809 5.760 1.00 0.00 C ATOM 447 C LEU A 29 90.218 -10.328 7.190 1.00 0.00 C ATOM 448 O LEU A 29 89.309 -9.960 7.902 1.00 0.00 O ATOM 449 CB LEU A 29 89.776 -9.609 4.799 1.00 0.00 C ATOM 450 CG LEU A 29 90.462 -9.853 3.441 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.088 -8.702 2.503 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.995 -9.886 3.612 1.00 0.00 C ATOM 0 H LEU A 29 87.898 -11.204 6.155 1.00 0.00 H new ATOM 0 HA LEU A 29 90.823 -11.382 5.405 1.00 0.00 H new ATOM 0 HB2 LEU A 29 88.712 -9.433 4.643 1.00 0.00 H new ATOM 0 HB3 LEU A 29 90.185 -8.708 5.257 1.00 0.00 H new ATOM 0 HG LEU A 29 90.135 -10.809 3.033 1.00 0.00 H new ATOM 0 HD11 LEU A 29 90.563 -8.853 1.534 1.00 0.00 H new ATOM 0 HD12 LEU A 29 89.006 -8.673 2.376 1.00 0.00 H new ATOM 0 HD13 LEU A 29 90.429 -7.759 2.931 1.00 0.00 H new ATOM 0 HD21 LEU A 29 92.465 -10.059 2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 29 92.337 -8.933 4.016 1.00 0.00 H new ATOM 0 HD23 LEU A 29 92.268 -10.689 4.297 1.00 0.00 H new ATOM 464 N ASN A 30 91.450 -10.355 7.621 1.00 0.00 N ATOM 465 CA ASN A 30 91.771 -9.924 9.013 1.00 0.00 C ATOM 466 C ASN A 30 92.148 -8.439 9.030 1.00 0.00 C ATOM 467 O ASN A 30 92.855 -7.951 8.177 1.00 0.00 O ATOM 468 CB ASN A 30 92.942 -10.760 9.535 1.00 0.00 C ATOM 469 CG ASN A 30 92.472 -12.198 9.765 1.00 0.00 C ATOM 470 OD1 ASN A 30 91.296 -12.441 9.952 1.00 0.00 O ATOM 471 ND2 ASN A 30 93.344 -13.168 9.754 1.00 0.00 N ATOM 0 H ASN A 30 92.251 -10.658 7.067 1.00 0.00 H new ATOM 0 HA ASN A 30 90.898 -10.071 9.650 1.00 0.00 H new ATOM 0 HB2 ASN A 30 93.764 -10.744 8.819 1.00 0.00 H new ATOM 0 HB3 ASN A 30 93.321 -10.336 10.465 1.00 0.00 H new ATOM 0 HD21 ASN A 30 93.039 -14.130 9.902 1.00 0.00 H new ATOM 0 HD22 ASN A 30 94.331 -12.965 9.597 1.00 0.00 H new ATOM 478 N LYS A 31 91.673 -7.727 10.005 1.00 0.00 N ATOM 479 CA LYS A 31 91.973 -6.271 10.116 1.00 0.00 C ATOM 480 C LYS A 31 93.456 -5.998 9.868 1.00 0.00 C ATOM 481 O LYS A 31 93.819 -4.976 9.339 1.00 0.00 O ATOM 482 CB LYS A 31 91.591 -5.792 11.517 1.00 0.00 C ATOM 483 CG LYS A 31 92.321 -6.632 12.568 1.00 0.00 C ATOM 484 CD LYS A 31 91.932 -6.146 13.965 1.00 0.00 C ATOM 485 CE LYS A 31 92.672 -6.963 15.024 1.00 0.00 C ATOM 486 NZ LYS A 31 92.040 -6.738 16.354 1.00 0.00 N ATOM 0 H LYS A 31 91.077 -8.096 10.746 1.00 0.00 H new ATOM 0 HA LYS A 31 91.397 -5.733 9.363 1.00 0.00 H new ATOM 0 HB2 LYS A 31 91.850 -4.740 11.635 1.00 0.00 H new ATOM 0 HB3 LYS A 31 90.513 -5.873 11.658 1.00 0.00 H new ATOM 0 HG2 LYS A 31 92.063 -7.685 12.452 1.00 0.00 H new ATOM 0 HG3 LYS A 31 93.399 -6.551 12.430 1.00 0.00 H new ATOM 0 HD2 LYS A 31 92.175 -5.089 14.073 1.00 0.00 H new ATOM 0 HD3 LYS A 31 90.855 -6.241 14.106 1.00 0.00 H new ATOM 0 HE2 LYS A 31 92.641 -8.022 14.769 1.00 0.00 H new ATOM 0 HE3 LYS A 31 93.722 -6.673 15.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 92.521 -7.319 17.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 92.122 -5.734 16.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 91.035 -7.004 16.310 1.00 0.00 H new ATOM 500 N SER A 32 94.325 -6.887 10.213 1.00 0.00 N ATOM 501 CA SER A 32 95.759 -6.603 9.947 1.00 0.00 C ATOM 502 C SER A 32 95.909 -6.416 8.449 1.00 0.00 C ATOM 503 O SER A 32 96.640 -5.568 7.978 1.00 0.00 O ATOM 504 CB SER A 32 96.646 -7.747 10.405 1.00 0.00 C ATOM 505 OG SER A 32 96.175 -8.967 9.849 1.00 0.00 O ATOM 0 H SER A 32 94.119 -7.781 10.658 1.00 0.00 H new ATOM 0 HA SER A 32 96.065 -5.713 10.496 1.00 0.00 H new ATOM 0 HB2 SER A 32 97.676 -7.568 10.096 1.00 0.00 H new ATOM 0 HB3 SER A 32 96.646 -7.808 11.493 1.00 0.00 H new ATOM 0 HG SER A 32 96.749 -9.704 10.144 1.00 0.00 H new ATOM 511 N GLU A 33 95.178 -7.185 7.700 1.00 0.00 N ATOM 512 CA GLU A 33 95.221 -7.041 6.228 1.00 0.00 C ATOM 513 C GLU A 33 94.783 -5.641 5.908 1.00 0.00 C ATOM 514 O GLU A 33 95.092 -5.116 4.874 1.00 0.00 O ATOM 515 CB GLU A 33 94.296 -8.057 5.573 1.00 0.00 C ATOM 516 CG GLU A 33 94.765 -9.470 5.934 1.00 0.00 C ATOM 517 CD GLU A 33 96.149 -9.717 5.330 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.475 -9.060 4.355 1.00 0.00 O ATOM 519 OE2 GLU A 33 96.860 -10.560 5.853 1.00 0.00 O ATOM 0 H GLU A 33 94.550 -7.910 8.047 1.00 0.00 H new ATOM 0 HA GLU A 33 96.226 -7.223 5.848 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.271 -7.904 5.910 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.299 -7.925 4.491 1.00 0.00 H new ATOM 0 HG2 GLU A 33 94.803 -9.587 7.017 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.056 -10.207 5.559 1.00 0.00 H new ATOM 526 N LEU A 34 94.087 -4.999 6.798 1.00 0.00 N ATOM 527 CA LEU A 34 93.697 -3.603 6.485 1.00 0.00 C ATOM 528 C LEU A 34 94.993 -2.839 6.285 1.00 0.00 C ATOM 529 O LEU A 34 95.131 -2.048 5.373 1.00 0.00 O ATOM 530 CB LEU A 34 92.888 -3.007 7.655 1.00 0.00 C ATOM 531 CG LEU A 34 92.448 -1.551 7.395 1.00 0.00 C ATOM 532 CD1 LEU A 34 93.655 -0.579 7.477 1.00 0.00 C ATOM 533 CD2 LEU A 34 91.767 -1.440 6.027 1.00 0.00 C ATOM 0 H LEU A 34 93.780 -5.365 7.699 1.00 0.00 H new ATOM 0 HA LEU A 34 93.069 -3.548 5.596 1.00 0.00 H new ATOM 0 HB2 LEU A 34 92.006 -3.623 7.832 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.490 -3.044 8.563 1.00 0.00 H new ATOM 0 HG LEU A 34 91.735 -1.269 8.169 1.00 0.00 H new ATOM 0 HD11 LEU A 34 93.315 0.440 7.290 1.00 0.00 H new ATOM 0 HD12 LEU A 34 94.101 -0.636 8.470 1.00 0.00 H new ATOM 0 HD13 LEU A 34 94.398 -0.857 6.729 1.00 0.00 H new ATOM 0 HD21 LEU A 34 91.461 -0.408 5.855 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.465 -1.746 5.247 1.00 0.00 H new ATOM 0 HD23 LEU A 34 90.890 -2.087 6.004 1.00 0.00 H new ATOM 545 N LYS A 35 95.973 -3.110 7.099 1.00 0.00 N ATOM 546 CA LYS A 35 97.275 -2.416 6.904 1.00 0.00 C ATOM 547 C LYS A 35 97.957 -2.924 5.630 1.00 0.00 C ATOM 548 O LYS A 35 98.370 -2.151 4.790 1.00 0.00 O ATOM 549 CB LYS A 35 98.166 -2.654 8.134 1.00 0.00 C ATOM 550 CG LYS A 35 99.601 -2.169 7.877 1.00 0.00 C ATOM 551 CD LYS A 35 99.585 -0.712 7.409 1.00 0.00 C ATOM 552 CE LYS A 35 100.988 -0.106 7.538 1.00 0.00 C ATOM 553 NZ LYS A 35 101.231 0.293 8.953 1.00 0.00 N ATOM 0 H LYS A 35 95.932 -3.769 7.877 1.00 0.00 H new ATOM 0 HA LYS A 35 97.106 -1.345 6.792 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.750 -2.131 8.995 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.176 -3.716 8.380 1.00 0.00 H new ATOM 0 HG2 LYS A 35 100.193 -2.261 8.787 1.00 0.00 H new ATOM 0 HG3 LYS A 35 100.076 -2.797 7.123 1.00 0.00 H new ATOM 0 HD2 LYS A 35 99.250 -0.657 6.373 1.00 0.00 H new ATOM 0 HD3 LYS A 35 98.875 -0.138 8.004 1.00 0.00 H new ATOM 0 HE2 LYS A 35 101.738 -0.829 7.219 1.00 0.00 H new ATOM 0 HE3 LYS A 35 101.083 0.761 6.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 102.238 0.168 9.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 100.968 1.291 9.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 100.657 -0.301 9.585 1.00 0.00 H new ATOM 567 N GLU A 36 98.092 -4.211 5.476 1.00 0.00 N ATOM 568 CA GLU A 36 98.763 -4.733 4.251 1.00 0.00 C ATOM 569 C GLU A 36 97.895 -4.519 3.016 1.00 0.00 C ATOM 570 O GLU A 36 98.387 -4.189 1.955 1.00 0.00 O ATOM 571 CB GLU A 36 99.051 -6.227 4.410 1.00 0.00 C ATOM 572 CG GLU A 36 99.739 -6.748 3.145 1.00 0.00 C ATOM 573 CD GLU A 36 100.188 -8.193 3.369 1.00 0.00 C ATOM 574 OE1 GLU A 36 99.993 -8.691 4.465 1.00 0.00 O ATOM 575 OE2 GLU A 36 100.722 -8.776 2.440 1.00 0.00 O ATOM 0 H GLU A 36 97.771 -4.919 6.137 1.00 0.00 H new ATOM 0 HA GLU A 36 99.697 -4.187 4.121 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.687 -6.396 5.279 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.123 -6.771 4.583 1.00 0.00 H new ATOM 0 HG2 GLU A 36 99.055 -6.695 2.298 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.598 -6.122 2.901 1.00 0.00 H new ATOM 582 N LEU A 37 96.614 -4.712 3.127 1.00 0.00 N ATOM 583 CA LEU A 37 95.743 -4.529 1.944 1.00 0.00 C ATOM 584 C LEU A 37 95.806 -3.085 1.497 1.00 0.00 C ATOM 585 O LEU A 37 95.791 -2.792 0.319 1.00 0.00 O ATOM 586 CB LEU A 37 94.286 -4.900 2.283 1.00 0.00 C ATOM 587 CG LEU A 37 93.367 -4.708 1.037 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.344 -5.851 0.946 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.602 -3.379 1.132 1.00 0.00 C ATOM 0 H LEU A 37 96.135 -4.988 3.985 1.00 0.00 H new ATOM 0 HA LEU A 37 96.092 -5.182 1.144 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.238 -5.935 2.621 1.00 0.00 H new ATOM 0 HB3 LEU A 37 93.929 -4.279 3.105 1.00 0.00 H new ATOM 0 HG LEU A 37 94.002 -4.706 0.151 1.00 0.00 H new ATOM 0 HD11 LEU A 37 91.710 -5.703 0.072 1.00 0.00 H new ATOM 0 HD12 LEU A 37 92.868 -6.802 0.857 1.00 0.00 H new ATOM 0 HD13 LEU A 37 91.727 -5.859 1.844 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.966 -3.262 0.255 1.00 0.00 H new ATOM 0 HD22 LEU A 37 91.985 -3.378 2.030 1.00 0.00 H new ATOM 0 HD23 LEU A 37 93.312 -2.553 1.179 1.00 0.00 H new ATOM 601 N LEU A 38 95.840 -2.165 2.418 1.00 0.00 N ATOM 602 CA LEU A 38 95.861 -0.732 1.976 1.00 0.00 C ATOM 603 C LEU A 38 97.208 -0.353 1.370 1.00 0.00 C ATOM 604 O LEU A 38 97.269 0.364 0.391 1.00 0.00 O ATOM 605 CB LEU A 38 95.530 0.214 3.148 1.00 0.00 C ATOM 606 CG LEU A 38 94.008 0.448 3.252 1.00 0.00 C ATOM 607 CD1 LEU A 38 93.707 1.384 4.449 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.464 1.069 1.935 1.00 0.00 C ATOM 0 H LEU A 38 95.854 -2.327 3.425 1.00 0.00 H new ATOM 0 HA LEU A 38 95.096 -0.623 1.208 1.00 0.00 H new ATOM 0 HB2 LEU A 38 95.901 -0.211 4.080 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.040 1.167 3.007 1.00 0.00 H new ATOM 0 HG LEU A 38 93.512 -0.509 3.411 1.00 0.00 H new ATOM 0 HD11 LEU A 38 92.632 1.548 4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 38 94.066 0.924 5.370 1.00 0.00 H new ATOM 0 HD13 LEU A 38 94.211 2.339 4.300 1.00 0.00 H new ATOM 0 HD21 LEU A 38 92.389 1.228 2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 38 93.958 2.023 1.752 1.00 0.00 H new ATOM 0 HD23 LEU A 38 93.663 0.392 1.104 1.00 0.00 H new ATOM 620 N THR A 39 98.282 -0.790 1.935 1.00 0.00 N ATOM 621 CA THR A 39 99.592 -0.401 1.368 1.00 0.00 C ATOM 622 C THR A 39 99.817 -1.115 0.036 1.00 0.00 C ATOM 623 O THR A 39 100.593 -0.674 -0.787 1.00 0.00 O ATOM 624 CB THR A 39 100.709 -0.759 2.350 1.00 0.00 C ATOM 625 OG1 THR A 39 100.269 -0.507 3.676 1.00 0.00 O ATOM 626 CG2 THR A 39 101.928 0.110 2.050 1.00 0.00 C ATOM 0 H THR A 39 98.315 -1.394 2.757 1.00 0.00 H new ATOM 0 HA THR A 39 99.601 0.675 1.197 1.00 0.00 H new ATOM 0 HB THR A 39 100.969 -1.813 2.247 1.00 0.00 H new ATOM 0 HG1 THR A 39 99.719 -1.257 3.986 1.00 0.00 H new ATOM 0 HG21 THR A 39 102.731 -0.137 2.745 1.00 0.00 H new ATOM 0 HG22 THR A 39 102.263 -0.073 1.029 1.00 0.00 H new ATOM 0 HG23 THR A 39 101.662 1.161 2.162 1.00 0.00 H new ATOM 634 N ARG A 40 99.158 -2.223 -0.179 1.00 0.00 N ATOM 635 CA ARG A 40 99.354 -2.969 -1.459 1.00 0.00 C ATOM 636 C ARG A 40 98.297 -2.539 -2.473 1.00 0.00 C ATOM 637 O ARG A 40 98.438 -2.778 -3.657 1.00 0.00 O ATOM 638 CB ARG A 40 99.260 -4.474 -1.197 1.00 0.00 C ATOM 639 CG ARG A 40 100.488 -4.919 -0.393 1.00 0.00 C ATOM 640 CD ARG A 40 100.527 -6.445 -0.300 1.00 0.00 C ATOM 641 NE ARG A 40 100.845 -7.012 -1.641 1.00 0.00 N ATOM 642 CZ ARG A 40 101.225 -8.256 -1.749 1.00 0.00 C ATOM 643 NH1 ARG A 40 101.313 -9.005 -0.685 1.00 0.00 N ATOM 644 NH2 ARG A 40 101.519 -8.750 -2.922 1.00 0.00 N ATOM 0 H ARG A 40 98.495 -2.643 0.473 1.00 0.00 H new ATOM 0 HA ARG A 40 100.340 -2.743 -1.864 1.00 0.00 H new ATOM 0 HB2 ARG A 40 98.347 -4.704 -0.648 1.00 0.00 H new ATOM 0 HB3 ARG A 40 99.210 -5.018 -2.140 1.00 0.00 H new ATOM 0 HG2 ARG A 40 101.397 -4.552 -0.869 1.00 0.00 H new ATOM 0 HG3 ARG A 40 100.455 -4.486 0.607 1.00 0.00 H new ATOM 0 HD2 ARG A 40 101.277 -6.757 0.427 1.00 0.00 H new ATOM 0 HD3 ARG A 40 99.567 -6.824 0.050 1.00 0.00 H new ATOM 0 HE ARG A 40 100.766 -6.428 -2.474 1.00 0.00 H new ATOM 0 HH11 ARG A 40 101.085 -8.619 0.231 1.00 0.00 H new ATOM 0 HH12 ARG A 40 101.610 -9.977 -0.769 1.00 0.00 H new ATOM 0 HH21 ARG A 40 101.452 -8.164 -3.754 1.00 0.00 H new ATOM 0 HH22 ARG A 40 101.816 -9.722 -3.006 1.00 0.00 H new ATOM 658 N GLU A 41 97.244 -1.895 -2.026 1.00 0.00 N ATOM 659 CA GLU A 41 96.182 -1.435 -2.978 1.00 0.00 C ATOM 660 C GLU A 41 96.243 0.072 -3.089 1.00 0.00 C ATOM 661 O GLU A 41 95.936 0.635 -4.120 1.00 0.00 O ATOM 662 CB GLU A 41 94.804 -1.863 -2.464 1.00 0.00 C ATOM 663 CG GLU A 41 93.727 -1.506 -3.497 1.00 0.00 C ATOM 664 CD GLU A 41 93.926 -2.347 -4.761 1.00 0.00 C ATOM 665 OE1 GLU A 41 94.576 -3.375 -4.669 1.00 0.00 O ATOM 666 OE2 GLU A 41 93.419 -1.951 -5.798 1.00 0.00 O ATOM 0 H GLU A 41 97.074 -1.669 -1.046 1.00 0.00 H new ATOM 0 HA GLU A 41 96.346 -1.883 -3.958 1.00 0.00 H new ATOM 0 HB2 GLU A 41 94.795 -2.936 -2.272 1.00 0.00 H new ATOM 0 HB3 GLU A 41 94.590 -1.368 -1.517 1.00 0.00 H new ATOM 0 HG2 GLU A 41 92.736 -1.686 -3.081 1.00 0.00 H new ATOM 0 HG3 GLU A 41 93.782 -0.445 -3.742 1.00 0.00 H new ATOM 673 N LEU A 42 96.652 0.737 -2.046 1.00 0.00 N ATOM 674 CA LEU A 42 96.752 2.226 -2.105 1.00 0.00 C ATOM 675 C LEU A 42 97.998 2.668 -1.310 1.00 0.00 C ATOM 676 O LEU A 42 97.911 2.898 -0.121 1.00 0.00 O ATOM 677 CB LEU A 42 95.505 2.881 -1.476 1.00 0.00 C ATOM 678 CG LEU A 42 94.208 2.419 -2.166 1.00 0.00 C ATOM 679 CD1 LEU A 42 93.008 2.824 -1.302 1.00 0.00 C ATOM 680 CD2 LEU A 42 94.072 3.084 -3.542 1.00 0.00 C ATOM 0 H LEU A 42 96.921 0.318 -1.156 1.00 0.00 H new ATOM 0 HA LEU A 42 96.825 2.536 -3.148 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.460 2.634 -0.415 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.589 3.965 -1.548 1.00 0.00 H new ATOM 0 HG LEU A 42 94.240 1.337 -2.291 1.00 0.00 H new ATOM 0 HD11 LEU A 42 92.086 2.500 -1.785 1.00 0.00 H new ATOM 0 HD12 LEU A 42 93.090 2.353 -0.322 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.994 3.907 -1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 42 93.151 2.749 -4.019 1.00 0.00 H new ATOM 0 HD22 LEU A 42 94.045 4.167 -3.422 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.924 2.809 -4.165 1.00 0.00 H new ATOM 692 N PRO A 43 99.158 2.767 -1.931 1.00 0.00 N ATOM 693 CA PRO A 43 100.391 3.169 -1.191 1.00 0.00 C ATOM 694 C PRO A 43 100.492 4.695 -0.950 1.00 0.00 C ATOM 695 O PRO A 43 99.898 5.221 -0.030 1.00 0.00 O ATOM 696 CB PRO A 43 101.492 2.653 -2.133 1.00 0.00 C ATOM 697 CG PRO A 43 100.874 2.510 -3.537 1.00 0.00 C ATOM 698 CD PRO A 43 99.339 2.479 -3.383 1.00 0.00 C ATOM 0 HA PRO A 43 100.438 2.765 -0.180 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.334 3.345 -2.154 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.876 1.694 -1.784 1.00 0.00 H new ATOM 0 HG2 PRO A 43 101.176 3.342 -4.173 1.00 0.00 H new ATOM 0 HG3 PRO A 43 101.227 1.597 -4.017 1.00 0.00 H new ATOM 0 HD2 PRO A 43 98.853 3.227 -4.009 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.922 1.511 -3.660 1.00 0.00 H new ATOM 706 N SER A 44 101.255 5.402 -1.748 1.00 0.00 N ATOM 707 CA SER A 44 101.404 6.876 -1.535 1.00 0.00 C ATOM 708 C SER A 44 100.066 7.589 -1.742 1.00 0.00 C ATOM 709 O SER A 44 99.706 8.467 -0.991 1.00 0.00 O ATOM 710 CB SER A 44 102.427 7.429 -2.528 1.00 0.00 C ATOM 711 OG SER A 44 102.546 8.834 -2.347 1.00 0.00 O ATOM 0 H SER A 44 101.780 5.023 -2.536 1.00 0.00 H new ATOM 0 HA SER A 44 101.740 7.049 -0.513 1.00 0.00 H new ATOM 0 HB2 SER A 44 103.394 6.948 -2.377 1.00 0.00 H new ATOM 0 HB3 SER A 44 102.116 7.207 -3.549 1.00 0.00 H new ATOM 0 HG SER A 44 103.202 9.191 -2.981 1.00 0.00 H new ATOM 717 N PHE A 45 99.332 7.212 -2.751 1.00 0.00 N ATOM 718 CA PHE A 45 98.010 7.860 -3.026 1.00 0.00 C ATOM 719 C PHE A 45 97.116 7.790 -1.788 1.00 0.00 C ATOM 720 O PHE A 45 96.017 8.307 -1.763 1.00 0.00 O ATOM 721 CB PHE A 45 97.332 7.094 -4.147 1.00 0.00 C ATOM 722 CG PHE A 45 98.069 7.338 -5.442 1.00 0.00 C ATOM 723 CD1 PHE A 45 97.711 8.417 -6.258 1.00 0.00 C ATOM 724 CD2 PHE A 45 99.119 6.492 -5.820 1.00 0.00 C ATOM 725 CE1 PHE A 45 98.400 8.649 -7.454 1.00 0.00 C ATOM 726 CE2 PHE A 45 99.809 6.725 -7.016 1.00 0.00 C ATOM 727 CZ PHE A 45 99.449 7.803 -7.833 1.00 0.00 C ATOM 0 H PHE A 45 99.591 6.475 -3.407 1.00 0.00 H new ATOM 0 HA PHE A 45 98.168 8.904 -3.297 1.00 0.00 H new ATOM 0 HB2 PHE A 45 97.320 6.028 -3.918 1.00 0.00 H new ATOM 0 HB3 PHE A 45 96.293 7.411 -4.242 1.00 0.00 H new ATOM 0 HD1 PHE A 45 96.903 9.071 -5.965 1.00 0.00 H new ATOM 0 HD2 PHE A 45 99.396 5.660 -5.189 1.00 0.00 H new ATOM 0 HE1 PHE A 45 98.122 9.481 -8.085 1.00 0.00 H new ATOM 0 HE2 PHE A 45 100.619 6.073 -7.308 1.00 0.00 H new ATOM 0 HZ PHE A 45 99.981 7.982 -8.756 1.00 0.00 H new ATOM 737 N LEU A 46 97.582 7.133 -0.774 1.00 0.00 N ATOM 738 CA LEU A 46 96.789 6.975 0.488 1.00 0.00 C ATOM 739 C LEU A 46 97.373 7.897 1.543 1.00 0.00 C ATOM 740 O LEU A 46 96.734 8.811 2.028 1.00 0.00 O ATOM 741 CB LEU A 46 96.929 5.527 0.954 1.00 0.00 C ATOM 742 CG LEU A 46 95.954 5.218 2.097 1.00 0.00 C ATOM 743 CD1 LEU A 46 94.493 5.273 1.594 1.00 0.00 C ATOM 744 CD2 LEU A 46 96.266 3.814 2.635 1.00 0.00 C ATOM 0 H LEU A 46 98.498 6.685 -0.756 1.00 0.00 H new ATOM 0 HA LEU A 46 95.740 7.220 0.323 1.00 0.00 H new ATOM 0 HB2 LEU A 46 96.740 4.853 0.118 1.00 0.00 H new ATOM 0 HB3 LEU A 46 97.952 5.345 1.285 1.00 0.00 H new ATOM 0 HG LEU A 46 96.070 5.960 2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.816 5.051 2.419 1.00 0.00 H new ATOM 0 HD12 LEU A 46 94.279 6.269 1.206 1.00 0.00 H new ATOM 0 HD13 LEU A 46 94.353 4.538 0.802 1.00 0.00 H new ATOM 0 HD21 LEU A 46 95.582 3.576 3.450 1.00 0.00 H new ATOM 0 HD22 LEU A 46 96.146 3.083 1.835 1.00 0.00 H new ATOM 0 HD23 LEU A 46 97.292 3.785 3.002 1.00 0.00 H new ATOM 756 N GLY A 47 98.610 7.676 1.861 1.00 0.00 N ATOM 757 CA GLY A 47 99.309 8.542 2.842 1.00 0.00 C ATOM 758 C GLY A 47 99.902 9.671 2.029 1.00 0.00 C ATOM 759 O GLY A 47 100.899 10.272 2.375 1.00 0.00 O ATOM 0 H GLY A 47 99.177 6.920 1.477 1.00 0.00 H new ATOM 0 HA2 GLY A 47 98.618 8.921 3.595 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.085 7.989 3.371 1.00 0.00 H new ATOM 763 N LYS A 48 99.293 9.915 0.904 1.00 0.00 N ATOM 764 CA LYS A 48 99.793 10.954 -0.018 1.00 0.00 C ATOM 765 C LYS A 48 100.040 12.262 0.741 1.00 0.00 C ATOM 766 O LYS A 48 101.085 12.871 0.625 1.00 0.00 O ATOM 767 CB LYS A 48 98.739 11.210 -1.087 1.00 0.00 C ATOM 768 CG LYS A 48 99.329 12.085 -2.182 1.00 0.00 C ATOM 769 CD LYS A 48 98.309 12.198 -3.305 1.00 0.00 C ATOM 770 CE LYS A 48 98.873 13.074 -4.426 1.00 0.00 C ATOM 771 NZ LYS A 48 99.087 14.459 -3.918 1.00 0.00 N ATOM 0 H LYS A 48 98.456 9.427 0.585 1.00 0.00 H new ATOM 0 HA LYS A 48 100.726 10.613 -0.466 1.00 0.00 H new ATOM 0 HB2 LYS A 48 98.395 10.265 -1.508 1.00 0.00 H new ATOM 0 HB3 LYS A 48 97.870 11.698 -0.646 1.00 0.00 H new ATOM 0 HG2 LYS A 48 99.572 13.072 -1.789 1.00 0.00 H new ATOM 0 HG3 LYS A 48 100.258 11.653 -2.555 1.00 0.00 H new ATOM 0 HD2 LYS A 48 98.067 11.208 -3.691 1.00 0.00 H new ATOM 0 HD3 LYS A 48 97.382 12.628 -2.926 1.00 0.00 H new ATOM 0 HE2 LYS A 48 99.814 12.659 -4.787 1.00 0.00 H new ATOM 0 HE3 LYS A 48 98.185 13.088 -5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 99.138 15.119 -4.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 98.296 14.728 -3.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 99.976 14.498 -3.380 1.00 0.00 H new ATOM 785 N ARG A 49 99.079 12.701 1.509 1.00 0.00 N ATOM 786 CA ARG A 49 99.247 13.975 2.267 1.00 0.00 C ATOM 787 C ARG A 49 100.119 13.746 3.502 1.00 0.00 C ATOM 788 O ARG A 49 100.284 12.635 3.967 1.00 0.00 O ATOM 789 CB ARG A 49 97.875 14.501 2.699 1.00 0.00 C ATOM 790 CG ARG A 49 97.108 15.011 1.477 1.00 0.00 C ATOM 791 CD ARG A 49 95.738 15.536 1.923 1.00 0.00 C ATOM 792 NE ARG A 49 94.884 15.835 0.724 1.00 0.00 N ATOM 793 CZ ARG A 49 95.265 16.676 -0.201 1.00 0.00 C ATOM 794 NH1 ARG A 49 96.326 17.415 -0.027 1.00 0.00 N ATOM 795 NH2 ARG A 49 94.548 16.819 -1.283 1.00 0.00 N ATOM 0 H ARG A 49 98.184 12.232 1.644 1.00 0.00 H new ATOM 0 HA ARG A 49 99.733 14.707 1.622 1.00 0.00 H new ATOM 0 HB2 ARG A 49 97.310 13.709 3.190 1.00 0.00 H new ATOM 0 HB3 ARG A 49 97.996 15.304 3.426 1.00 0.00 H new ATOM 0 HG2 ARG A 49 97.671 15.803 0.984 1.00 0.00 H new ATOM 0 HG3 ARG A 49 96.984 14.208 0.750 1.00 0.00 H new ATOM 0 HD2 ARG A 49 95.245 14.797 2.555 1.00 0.00 H new ATOM 0 HD3 ARG A 49 95.863 16.437 2.524 1.00 0.00 H new ATOM 0 HE ARG A 49 93.982 15.369 0.629 1.00 0.00 H new ATOM 0 HH11 ARG A 49 96.865 17.339 0.836 1.00 0.00 H new ATOM 0 HH12 ARG A 49 96.617 18.069 -0.754 1.00 0.00 H new ATOM 0 HH21 ARG A 49 93.694 16.275 -1.404 1.00 0.00 H new ATOM 0 HH22 ARG A 49 94.842 17.474 -2.007 1.00 0.00 H new ATOM 809 N THR A 50 100.681 14.799 4.030 1.00 0.00 N ATOM 810 CA THR A 50 101.552 14.665 5.231 1.00 0.00 C ATOM 811 C THR A 50 100.699 14.297 6.448 1.00 0.00 C ATOM 812 O THR A 50 101.208 13.940 7.490 1.00 0.00 O ATOM 813 CB THR A 50 102.264 15.997 5.490 1.00 0.00 C ATOM 814 OG1 THR A 50 102.981 16.382 4.325 1.00 0.00 O ATOM 815 CG2 THR A 50 103.236 15.847 6.664 1.00 0.00 C ATOM 0 H THR A 50 100.573 15.751 3.679 1.00 0.00 H new ATOM 0 HA THR A 50 102.290 13.882 5.059 1.00 0.00 H new ATOM 0 HB THR A 50 101.525 16.760 5.734 1.00 0.00 H new ATOM 0 HG1 THR A 50 103.436 17.235 4.488 1.00 0.00 H new ATOM 0 HG21 THR A 50 103.739 16.797 6.843 1.00 0.00 H new ATOM 0 HG22 THR A 50 102.685 15.554 7.558 1.00 0.00 H new ATOM 0 HG23 THR A 50 103.977 15.083 6.428 1.00 0.00 H new ATOM 823 N ASP A 51 99.403 14.378 6.321 1.00 0.00 N ATOM 824 CA ASP A 51 98.518 14.030 7.468 1.00 0.00 C ATOM 825 C ASP A 51 98.513 12.511 7.659 1.00 0.00 C ATOM 826 O ASP A 51 97.503 11.918 7.986 1.00 0.00 O ATOM 827 CB ASP A 51 97.097 14.515 7.174 1.00 0.00 C ATOM 828 CG ASP A 51 96.535 13.742 5.981 1.00 0.00 C ATOM 829 OD1 ASP A 51 97.283 12.982 5.390 1.00 0.00 O ATOM 830 OD2 ASP A 51 95.364 13.916 5.684 1.00 0.00 O ATOM 0 H ASP A 51 98.919 14.670 5.472 1.00 0.00 H new ATOM 0 HA ASP A 51 98.885 14.509 8.376 1.00 0.00 H new ATOM 0 HB2 ASP A 51 96.463 14.369 8.048 1.00 0.00 H new ATOM 0 HB3 ASP A 51 97.102 15.584 6.959 1.00 0.00 H new ATOM 835 N GLU A 52 99.634 11.877 7.446 1.00 0.00 N ATOM 836 CA GLU A 52 99.702 10.395 7.604 1.00 0.00 C ATOM 837 C GLU A 52 99.247 9.993 9.006 1.00 0.00 C ATOM 838 O GLU A 52 98.882 8.862 9.253 1.00 0.00 O ATOM 839 CB GLU A 52 101.140 9.926 7.373 1.00 0.00 C ATOM 840 CG GLU A 52 102.078 10.545 8.415 1.00 0.00 C ATOM 841 CD GLU A 52 103.504 10.058 8.158 1.00 0.00 C ATOM 842 OE1 GLU A 52 103.653 9.071 7.456 1.00 0.00 O ATOM 843 OE2 GLU A 52 104.423 10.680 8.664 1.00 0.00 O ATOM 0 H GLU A 52 100.509 12.322 7.169 1.00 0.00 H new ATOM 0 HA GLU A 52 99.043 9.927 6.873 1.00 0.00 H new ATOM 0 HB2 GLU A 52 101.188 8.839 7.431 1.00 0.00 H new ATOM 0 HB3 GLU A 52 101.464 10.206 6.371 1.00 0.00 H new ATOM 0 HG2 GLU A 52 102.037 11.633 8.359 1.00 0.00 H new ATOM 0 HG3 GLU A 52 101.761 10.265 9.420 1.00 0.00 H new ATOM 850 N ALA A 53 99.270 10.909 9.926 1.00 0.00 N ATOM 851 CA ALA A 53 98.842 10.578 11.314 1.00 0.00 C ATOM 852 C ALA A 53 97.439 9.964 11.276 1.00 0.00 C ATOM 853 O ALA A 53 97.133 9.047 12.012 1.00 0.00 O ATOM 854 CB ALA A 53 98.814 11.853 12.159 1.00 0.00 C ATOM 0 H ALA A 53 99.566 11.874 9.780 1.00 0.00 H new ATOM 0 HA ALA A 53 99.543 9.868 11.752 1.00 0.00 H new ATOM 0 HB1 ALA A 53 98.501 11.610 13.174 1.00 0.00 H new ATOM 0 HB2 ALA A 53 99.810 12.296 12.183 1.00 0.00 H new ATOM 0 HB3 ALA A 53 98.111 12.563 11.723 1.00 0.00 H new ATOM 860 N ALA A 54 96.584 10.456 10.424 1.00 0.00 N ATOM 861 CA ALA A 54 95.206 9.891 10.342 1.00 0.00 C ATOM 862 C ALA A 54 95.290 8.415 9.975 1.00 0.00 C ATOM 863 O ALA A 54 94.592 7.584 10.519 1.00 0.00 O ATOM 864 CB ALA A 54 94.429 10.625 9.259 1.00 0.00 C ATOM 0 H ALA A 54 96.778 11.224 9.781 1.00 0.00 H new ATOM 0 HA ALA A 54 94.705 10.006 11.303 1.00 0.00 H new ATOM 0 HB1 ALA A 54 93.421 10.216 9.194 1.00 0.00 H new ATOM 0 HB2 ALA A 54 94.376 11.686 9.505 1.00 0.00 H new ATOM 0 HB3 ALA A 54 94.933 10.500 8.301 1.00 0.00 H new ATOM 870 N PHE A 55 96.147 8.079 9.062 1.00 0.00 N ATOM 871 CA PHE A 55 96.288 6.655 8.671 1.00 0.00 C ATOM 872 C PHE A 55 96.699 5.852 9.895 1.00 0.00 C ATOM 873 O PHE A 55 96.225 4.759 10.130 1.00 0.00 O ATOM 874 CB PHE A 55 97.383 6.540 7.626 1.00 0.00 C ATOM 875 CG PHE A 55 97.595 5.089 7.273 1.00 0.00 C ATOM 876 CD1 PHE A 55 96.845 4.494 6.252 1.00 0.00 C ATOM 877 CD2 PHE A 55 98.540 4.334 7.979 1.00 0.00 C ATOM 878 CE1 PHE A 55 97.045 3.145 5.937 1.00 0.00 C ATOM 879 CE2 PHE A 55 98.737 2.986 7.663 1.00 0.00 C ATOM 880 CZ PHE A 55 97.990 2.394 6.641 1.00 0.00 C ATOM 0 H PHE A 55 96.758 8.729 8.568 1.00 0.00 H new ATOM 0 HA PHE A 55 95.346 6.281 8.271 1.00 0.00 H new ATOM 0 HB2 PHE A 55 97.110 7.105 6.735 1.00 0.00 H new ATOM 0 HB3 PHE A 55 98.309 6.971 8.006 1.00 0.00 H new ATOM 0 HD1 PHE A 55 96.114 5.074 5.709 1.00 0.00 H new ATOM 0 HD2 PHE A 55 99.117 4.793 8.768 1.00 0.00 H new ATOM 0 HE1 PHE A 55 96.468 2.684 5.149 1.00 0.00 H new ATOM 0 HE2 PHE A 55 99.465 2.404 8.208 1.00 0.00 H new ATOM 0 HZ PHE A 55 98.143 1.354 6.395 1.00 0.00 H new ATOM 890 N GLN A 56 97.576 6.403 10.679 1.00 0.00 N ATOM 891 CA GLN A 56 98.025 5.690 11.902 1.00 0.00 C ATOM 892 C GLN A 56 96.822 5.497 12.800 1.00 0.00 C ATOM 893 O GLN A 56 96.689 4.502 13.484 1.00 0.00 O ATOM 894 CB GLN A 56 99.092 6.511 12.629 1.00 0.00 C ATOM 895 CG GLN A 56 100.385 6.516 11.811 1.00 0.00 C ATOM 896 CD GLN A 56 101.362 7.529 12.410 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.967 8.400 13.159 1.00 0.00 O ATOM 898 NE2 GLN A 56 102.630 7.455 12.110 1.00 0.00 N ATOM 0 H GLN A 56 98.002 7.317 10.526 1.00 0.00 H new ATOM 0 HA GLN A 56 98.459 4.726 11.636 1.00 0.00 H new ATOM 0 HB2 GLN A 56 98.740 7.532 12.778 1.00 0.00 H new ATOM 0 HB3 GLN A 56 99.277 6.091 13.617 1.00 0.00 H new ATOM 0 HG2 GLN A 56 100.831 5.521 11.809 1.00 0.00 H new ATOM 0 HG3 GLN A 56 100.171 6.771 10.773 1.00 0.00 H new ATOM 0 HE21 GLN A 56 102.964 6.724 11.481 1.00 0.00 H new ATOM 0 HE22 GLN A 56 103.287 8.128 12.504 1.00 0.00 H new ATOM 907 N LYS A 57 95.929 6.435 12.780 1.00 0.00 N ATOM 908 CA LYS A 57 94.709 6.301 13.614 1.00 0.00 C ATOM 909 C LYS A 57 93.875 5.198 12.995 1.00 0.00 C ATOM 910 O LYS A 57 93.323 4.356 13.674 1.00 0.00 O ATOM 911 CB LYS A 57 93.916 7.617 13.650 1.00 0.00 C ATOM 912 CG LYS A 57 94.733 8.699 14.379 1.00 0.00 C ATOM 913 CD LYS A 57 93.817 9.845 14.851 1.00 0.00 C ATOM 914 CE LYS A 57 93.400 10.725 13.669 1.00 0.00 C ATOM 915 NZ LYS A 57 94.581 11.479 13.165 1.00 0.00 N ATOM 0 H LYS A 57 95.988 7.288 12.224 1.00 0.00 H new ATOM 0 HA LYS A 57 94.975 6.063 14.644 1.00 0.00 H new ATOM 0 HB2 LYS A 57 93.688 7.943 12.635 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.963 7.464 14.157 1.00 0.00 H new ATOM 0 HG2 LYS A 57 95.246 8.260 15.235 1.00 0.00 H new ATOM 0 HG3 LYS A 57 95.502 9.092 13.714 1.00 0.00 H new ATOM 0 HD2 LYS A 57 92.931 9.434 15.335 1.00 0.00 H new ATOM 0 HD3 LYS A 57 94.336 10.449 15.596 1.00 0.00 H new ATOM 0 HE2 LYS A 57 92.983 10.108 12.873 1.00 0.00 H new ATOM 0 HE3 LYS A 57 92.618 11.419 13.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 94.288 12.101 12.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 94.980 12.053 13.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 95.300 10.810 12.823 1.00 0.00 H new ATOM 929 N LEU A 58 93.825 5.167 11.698 1.00 0.00 N ATOM 930 CA LEU A 58 93.081 4.081 11.030 1.00 0.00 C ATOM 931 C LEU A 58 93.834 2.806 11.358 1.00 0.00 C ATOM 932 O LEU A 58 93.270 1.804 11.729 1.00 0.00 O ATOM 933 CB LEU A 58 93.046 4.319 9.517 1.00 0.00 C ATOM 934 CG LEU A 58 92.284 3.184 8.822 1.00 0.00 C ATOM 935 CD1 LEU A 58 90.819 3.153 9.287 1.00 0.00 C ATOM 936 CD2 LEU A 58 92.341 3.398 7.305 1.00 0.00 C ATOM 0 H LEU A 58 94.266 5.845 11.077 1.00 0.00 H new ATOM 0 HA LEU A 58 92.046 4.028 11.368 1.00 0.00 H new ATOM 0 HB2 LEU A 58 92.567 5.274 9.302 1.00 0.00 H new ATOM 0 HB3 LEU A 58 94.062 4.378 9.127 1.00 0.00 H new ATOM 0 HG LEU A 58 92.748 2.232 9.081 1.00 0.00 H new ATOM 0 HD11 LEU A 58 90.294 2.341 8.783 1.00 0.00 H new ATOM 0 HD12 LEU A 58 90.783 2.995 10.365 1.00 0.00 H new ATOM 0 HD13 LEU A 58 90.340 4.101 9.043 1.00 0.00 H new ATOM 0 HD21 LEU A 58 91.801 2.595 6.804 1.00 0.00 H new ATOM 0 HD22 LEU A 58 91.882 4.355 7.055 1.00 0.00 H new ATOM 0 HD23 LEU A 58 93.380 3.397 6.976 1.00 0.00 H new ATOM 948 N MET A 59 95.132 2.865 11.272 1.00 0.00 N ATOM 949 CA MET A 59 95.942 1.680 11.637 1.00 0.00 C ATOM 950 C MET A 59 95.658 1.379 13.098 1.00 0.00 C ATOM 951 O MET A 59 95.505 0.249 13.499 1.00 0.00 O ATOM 952 CB MET A 59 97.430 1.991 11.450 1.00 0.00 C ATOM 953 CG MET A 59 98.242 0.697 11.442 1.00 0.00 C ATOM 954 SD MET A 59 98.332 0.020 13.118 1.00 0.00 S ATOM 955 CE MET A 59 99.842 0.877 13.630 1.00 0.00 C ATOM 0 H MET A 59 95.662 3.681 10.966 1.00 0.00 H new ATOM 0 HA MET A 59 95.690 0.827 11.008 1.00 0.00 H new ATOM 0 HB2 MET A 59 97.582 2.530 10.515 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.777 2.642 12.253 1.00 0.00 H new ATOM 0 HG2 MET A 59 97.781 -0.028 10.771 1.00 0.00 H new ATOM 0 HG3 MET A 59 99.246 0.889 11.063 1.00 0.00 H new ATOM 0 HE1 MET A 59 100.088 0.600 14.655 1.00 0.00 H new ATOM 0 HE2 MET A 59 100.662 0.594 12.971 1.00 0.00 H new ATOM 0 HE3 MET A 59 99.686 1.954 13.573 1.00 0.00 H new ATOM 965 N SER A 60 95.552 2.400 13.891 1.00 0.00 N ATOM 966 CA SER A 60 95.236 2.176 15.331 1.00 0.00 C ATOM 967 C SER A 60 93.871 1.506 15.414 1.00 0.00 C ATOM 968 O SER A 60 93.549 0.848 16.383 1.00 0.00 O ATOM 969 CB SER A 60 95.196 3.507 16.079 1.00 0.00 C ATOM 970 OG SER A 60 96.382 4.238 15.805 1.00 0.00 O ATOM 0 H SER A 60 95.668 3.374 13.613 1.00 0.00 H new ATOM 0 HA SER A 60 96.003 1.548 15.786 1.00 0.00 H new ATOM 0 HB2 SER A 60 94.322 4.082 15.773 1.00 0.00 H new ATOM 0 HB3 SER A 60 95.103 3.332 17.151 1.00 0.00 H new ATOM 0 HG SER A 60 96.394 4.500 14.861 1.00 0.00 H new ATOM 976 N ASN A 61 93.064 1.662 14.399 1.00 0.00 N ATOM 977 CA ASN A 61 91.724 1.016 14.434 1.00 0.00 C ATOM 978 C ASN A 61 91.943 -0.487 14.457 1.00 0.00 C ATOM 979 O ASN A 61 91.210 -1.228 15.073 1.00 0.00 O ATOM 980 CB ASN A 61 90.895 1.400 13.206 1.00 0.00 C ATOM 981 CG ASN A 61 89.437 0.989 13.425 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.157 0.081 14.182 1.00 0.00 O ATOM 983 ND2 ASN A 61 88.489 1.623 12.791 1.00 0.00 N ATOM 0 H ASN A 61 93.272 2.201 13.559 1.00 0.00 H new ATOM 0 HA ASN A 61 91.176 1.347 15.316 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.959 2.474 13.032 1.00 0.00 H new ATOM 0 HB3 ASN A 61 91.293 0.909 12.318 1.00 0.00 H new ATOM 0 HD21 ASN A 61 87.515 1.356 12.931 1.00 0.00 H new ATOM 0 HD22 ASN A 61 88.722 2.386 12.155 1.00 0.00 H new ATOM 990 N LEU A 62 92.977 -0.942 13.815 1.00 0.00 N ATOM 991 CA LEU A 62 93.264 -2.392 13.840 1.00 0.00 C ATOM 992 C LEU A 62 93.469 -2.746 15.307 1.00 0.00 C ATOM 993 O LEU A 62 93.062 -3.784 15.789 1.00 0.00 O ATOM 994 CB LEU A 62 94.531 -2.702 13.032 1.00 0.00 C ATOM 995 CG LEU A 62 94.256 -2.593 11.518 1.00 0.00 C ATOM 996 CD1 LEU A 62 93.401 -1.363 11.184 1.00 0.00 C ATOM 997 CD2 LEU A 62 95.591 -2.497 10.775 1.00 0.00 C ATOM 0 H LEU A 62 93.631 -0.374 13.277 1.00 0.00 H new ATOM 0 HA LEU A 62 92.453 -2.970 13.396 1.00 0.00 H new ATOM 0 HB2 LEU A 62 95.325 -2.010 13.313 1.00 0.00 H new ATOM 0 HB3 LEU A 62 94.884 -3.705 13.271 1.00 0.00 H new ATOM 0 HG LEU A 62 93.705 -3.480 11.207 1.00 0.00 H new ATOM 0 HD11 LEU A 62 93.229 -1.321 10.109 1.00 0.00 H new ATOM 0 HD12 LEU A 62 92.445 -1.433 11.702 1.00 0.00 H new ATOM 0 HD13 LEU A 62 93.922 -0.460 11.504 1.00 0.00 H new ATOM 0 HD21 LEU A 62 95.406 -2.420 9.704 1.00 0.00 H new ATOM 0 HD22 LEU A 62 96.134 -1.615 11.114 1.00 0.00 H new ATOM 0 HD23 LEU A 62 96.185 -3.388 10.977 1.00 0.00 H new ATOM 1009 N ASP A 63 94.075 -1.839 16.023 1.00 0.00 N ATOM 1010 CA ASP A 63 94.299 -2.037 17.478 1.00 0.00 C ATOM 1011 C ASP A 63 93.038 -1.583 18.224 1.00 0.00 C ATOM 1012 O ASP A 63 93.055 -1.361 19.418 1.00 0.00 O ATOM 1013 CB ASP A 63 95.492 -1.189 17.933 1.00 0.00 C ATOM 1014 CG ASP A 63 96.785 -1.769 17.356 1.00 0.00 C ATOM 1015 OD1 ASP A 63 96.920 -2.981 17.357 1.00 0.00 O ATOM 1016 OD2 ASP A 63 97.616 -0.989 16.920 1.00 0.00 O ATOM 0 H ASP A 63 94.429 -0.957 15.653 1.00 0.00 H new ATOM 0 HA ASP A 63 94.507 -3.086 17.688 1.00 0.00 H new ATOM 0 HB2 ASP A 63 95.365 -0.158 17.603 1.00 0.00 H new ATOM 0 HB3 ASP A 63 95.544 -1.171 19.022 1.00 0.00 H new ATOM 1021 N SER A 64 91.950 -1.407 17.511 1.00 0.00 N ATOM 1022 CA SER A 64 90.691 -0.920 18.156 1.00 0.00 C ATOM 1023 C SER A 64 90.233 -1.853 19.282 1.00 0.00 C ATOM 1024 O SER A 64 90.156 -1.455 20.427 1.00 0.00 O ATOM 1025 CB SER A 64 89.568 -0.859 17.122 1.00 0.00 C ATOM 1026 OG SER A 64 88.332 -0.639 17.791 1.00 0.00 O ATOM 0 H SER A 64 91.881 -1.580 16.508 1.00 0.00 H new ATOM 0 HA SER A 64 90.903 0.067 18.568 1.00 0.00 H new ATOM 0 HB2 SER A 64 89.757 -0.057 16.408 1.00 0.00 H new ATOM 0 HB3 SER A 64 89.528 -1.789 16.554 1.00 0.00 H new ATOM 0 HG SER A 64 87.607 -0.597 17.133 1.00 0.00 H new ATOM 1032 N ASN A 65 89.890 -3.079 18.969 1.00 0.00 N ATOM 1033 CA ASN A 65 89.394 -4.000 20.036 1.00 0.00 C ATOM 1034 C ASN A 65 89.576 -5.471 19.629 1.00 0.00 C ATOM 1035 O ASN A 65 90.365 -5.802 18.766 1.00 0.00 O ATOM 1036 CB ASN A 65 87.907 -3.719 20.278 1.00 0.00 C ATOM 1037 CG ASN A 65 87.746 -2.332 20.905 1.00 0.00 C ATOM 1038 OD1 ASN A 65 88.285 -2.062 21.960 1.00 0.00 O ATOM 1039 ND2 ASN A 65 87.027 -1.431 20.291 1.00 0.00 N ATOM 0 H ASN A 65 89.932 -3.478 18.031 1.00 0.00 H new ATOM 0 HA ASN A 65 89.970 -3.826 20.945 1.00 0.00 H new ATOM 0 HB2 ASN A 65 87.358 -3.771 19.338 1.00 0.00 H new ATOM 0 HB3 ASN A 65 87.485 -4.479 20.936 1.00 0.00 H new ATOM 0 HD21 ASN A 65 86.918 -0.502 20.697 1.00 0.00 H new ATOM 0 HD22 ASN A 65 86.574 -1.657 19.405 1.00 0.00 H new ATOM 1046 N ARG A 66 88.857 -6.351 20.280 1.00 0.00 N ATOM 1047 CA ARG A 66 88.967 -7.812 19.996 1.00 0.00 C ATOM 1048 C ARG A 66 88.611 -8.132 18.538 1.00 0.00 C ATOM 1049 O ARG A 66 89.212 -8.999 17.937 1.00 0.00 O ATOM 1050 CB ARG A 66 88.023 -8.575 20.928 1.00 0.00 C ATOM 1051 CG ARG A 66 88.172 -10.080 20.693 1.00 0.00 C ATOM 1052 CD ARG A 66 87.345 -10.842 21.730 1.00 0.00 C ATOM 1053 NE ARG A 66 85.895 -10.626 21.467 1.00 0.00 N ATOM 1054 CZ ARG A 66 85.010 -11.422 22.000 1.00 0.00 C ATOM 1055 NH1 ARG A 66 85.398 -12.408 22.763 1.00 0.00 N ATOM 1056 NH2 ARG A 66 83.739 -11.234 21.768 1.00 0.00 N ATOM 0 H ARG A 66 88.186 -6.112 21.010 1.00 0.00 H new ATOM 0 HA ARG A 66 90.000 -8.116 20.165 1.00 0.00 H new ATOM 0 HB2 ARG A 66 88.250 -8.335 21.967 1.00 0.00 H new ATOM 0 HB3 ARG A 66 86.992 -8.269 20.748 1.00 0.00 H new ATOM 0 HG2 ARG A 66 87.840 -10.337 19.687 1.00 0.00 H new ATOM 0 HG3 ARG A 66 89.221 -10.368 20.765 1.00 0.00 H new ATOM 0 HD2 ARG A 66 87.579 -11.906 21.686 1.00 0.00 H new ATOM 0 HD3 ARG A 66 87.598 -10.501 22.734 1.00 0.00 H new ATOM 0 HE ARG A 66 85.594 -9.856 20.870 1.00 0.00 H new ATOM 0 HH11 ARG A 66 86.392 -12.554 22.941 1.00 0.00 H new ATOM 0 HH12 ARG A 66 84.708 -13.032 23.181 1.00 0.00 H new ATOM 0 HH21 ARG A 66 83.438 -10.465 21.170 1.00 0.00 H new ATOM 0 HH22 ARG A 66 83.047 -11.857 22.185 1.00 0.00 H new ATOM 1070 N ASP A 67 87.629 -7.468 17.970 1.00 0.00 N ATOM 1071 CA ASP A 67 87.235 -7.771 16.552 1.00 0.00 C ATOM 1072 C ASP A 67 88.489 -7.982 15.697 1.00 0.00 C ATOM 1073 O ASP A 67 89.381 -7.158 15.676 1.00 0.00 O ATOM 1074 CB ASP A 67 86.433 -6.598 15.983 1.00 0.00 C ATOM 1075 CG ASP A 67 85.885 -6.973 14.604 1.00 0.00 C ATOM 1076 OD1 ASP A 67 86.415 -7.897 14.009 1.00 0.00 O ATOM 1077 OD2 ASP A 67 84.945 -6.330 14.165 1.00 0.00 O ATOM 0 H ASP A 67 87.086 -6.733 18.423 1.00 0.00 H new ATOM 0 HA ASP A 67 86.628 -8.676 16.537 1.00 0.00 H new ATOM 0 HB2 ASP A 67 85.613 -6.345 16.655 1.00 0.00 H new ATOM 0 HB3 ASP A 67 87.066 -5.714 15.906 1.00 0.00 H new ATOM 1082 N ASN A 68 88.572 -9.100 15.012 1.00 0.00 N ATOM 1083 CA ASN A 68 89.777 -9.400 14.173 1.00 0.00 C ATOM 1084 C ASN A 68 89.354 -9.886 12.782 1.00 0.00 C ATOM 1085 O ASN A 68 90.136 -10.486 12.073 1.00 0.00 O ATOM 1086 CB ASN A 68 90.597 -10.495 14.863 1.00 0.00 C ATOM 1087 CG ASN A 68 91.835 -10.821 14.024 1.00 0.00 C ATOM 1088 OD1 ASN A 68 92.443 -9.942 13.445 1.00 0.00 O ATOM 1089 ND2 ASN A 68 92.238 -12.060 13.933 1.00 0.00 N ATOM 0 H ASN A 68 87.851 -9.822 14.999 1.00 0.00 H new ATOM 0 HA ASN A 68 90.371 -8.493 14.061 1.00 0.00 H new ATOM 0 HB2 ASN A 68 90.897 -10.165 15.858 1.00 0.00 H new ATOM 0 HB3 ASN A 68 89.989 -11.390 14.994 1.00 0.00 H new ATOM 0 HD21 ASN A 68 93.062 -12.289 13.377 1.00 0.00 H new ATOM 0 HD22 ASN A 68 91.729 -12.799 14.418 1.00 0.00 H new ATOM 1096 N GLU A 69 88.125 -9.640 12.383 1.00 0.00 N ATOM 1097 CA GLU A 69 87.660 -10.101 11.030 1.00 0.00 C ATOM 1098 C GLU A 69 87.145 -8.926 10.205 1.00 0.00 C ATOM 1099 O GLU A 69 86.563 -7.987 10.709 1.00 0.00 O ATOM 1100 CB GLU A 69 86.540 -11.133 11.185 1.00 0.00 C ATOM 1101 CG GLU A 69 86.073 -11.611 9.807 1.00 0.00 C ATOM 1102 CD GLU A 69 84.967 -12.653 9.978 1.00 0.00 C ATOM 1103 OE1 GLU A 69 84.751 -13.079 11.102 1.00 0.00 O ATOM 1104 OE2 GLU A 69 84.351 -13.005 8.986 1.00 0.00 O ATOM 0 H GLU A 69 87.426 -9.142 12.933 1.00 0.00 H new ATOM 0 HA GLU A 69 88.509 -10.551 10.516 1.00 0.00 H new ATOM 0 HB2 GLU A 69 86.894 -11.980 11.772 1.00 0.00 H new ATOM 0 HB3 GLU A 69 85.704 -10.695 11.730 1.00 0.00 H new ATOM 0 HG2 GLU A 69 85.706 -10.767 9.223 1.00 0.00 H new ATOM 0 HG3 GLU A 69 86.910 -12.040 9.256 1.00 0.00 H new ATOM 1111 N VAL A 70 87.352 -9.011 8.926 1.00 0.00 N ATOM 1112 CA VAL A 70 86.892 -7.960 7.980 1.00 0.00 C ATOM 1113 C VAL A 70 85.902 -8.594 7.024 1.00 0.00 C ATOM 1114 O VAL A 70 86.273 -9.296 6.103 1.00 0.00 O ATOM 1115 CB VAL A 70 88.080 -7.483 7.161 1.00 0.00 C ATOM 1116 CG1 VAL A 70 87.663 -6.314 6.288 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.240 -7.069 8.060 1.00 0.00 C ATOM 0 H VAL A 70 87.837 -9.791 8.481 1.00 0.00 H new ATOM 0 HA VAL A 70 86.444 -7.130 8.526 1.00 0.00 H new ATOM 0 HB VAL A 70 88.416 -8.309 6.534 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.517 -5.974 5.702 1.00 0.00 H new ATOM 0 HG12 VAL A 70 86.864 -6.628 5.616 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.308 -5.498 6.918 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.075 -6.733 7.445 1.00 0.00 H new ATOM 0 HG22 VAL A 70 88.921 -6.258 8.715 1.00 0.00 H new ATOM 0 HG23 VAL A 70 89.554 -7.920 8.664 1.00 0.00 H new ATOM 1127 N ASP A 71 84.657 -8.327 7.201 1.00 0.00 N ATOM 1128 CA ASP A 71 83.658 -8.883 6.264 1.00 0.00 C ATOM 1129 C ASP A 71 83.658 -7.952 5.066 1.00 0.00 C ATOM 1130 O ASP A 71 84.250 -6.891 5.114 1.00 0.00 O ATOM 1131 CB ASP A 71 82.278 -8.894 6.924 1.00 0.00 C ATOM 1132 CG ASP A 71 82.255 -9.945 8.034 1.00 0.00 C ATOM 1133 OD1 ASP A 71 83.097 -10.826 8.006 1.00 0.00 O ATOM 1134 OD2 ASP A 71 81.398 -9.849 8.898 1.00 0.00 O ATOM 0 H ASP A 71 84.281 -7.748 7.952 1.00 0.00 H new ATOM 0 HA ASP A 71 83.894 -9.908 5.976 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.051 -7.910 7.335 1.00 0.00 H new ATOM 0 HB3 ASP A 71 81.510 -9.115 6.183 1.00 0.00 H new ATOM 1139 N PHE A 72 83.019 -8.294 3.995 1.00 0.00 N ATOM 1140 CA PHE A 72 83.030 -7.367 2.850 1.00 0.00 C ATOM 1141 C PHE A 72 82.441 -6.046 3.342 1.00 0.00 C ATOM 1142 O PHE A 72 82.908 -4.974 3.014 1.00 0.00 O ATOM 1143 CB PHE A 72 82.174 -7.932 1.726 1.00 0.00 C ATOM 1144 CG PHE A 72 82.258 -7.011 0.544 1.00 0.00 C ATOM 1145 CD1 PHE A 72 81.358 -5.952 0.415 1.00 0.00 C ATOM 1146 CD2 PHE A 72 83.252 -7.211 -0.417 1.00 0.00 C ATOM 1147 CE1 PHE A 72 81.447 -5.092 -0.681 1.00 0.00 C ATOM 1148 CE2 PHE A 72 83.344 -6.352 -1.512 1.00 0.00 C ATOM 1149 CZ PHE A 72 82.441 -5.290 -1.648 1.00 0.00 C ATOM 0 H PHE A 72 82.498 -9.161 3.864 1.00 0.00 H new ATOM 0 HA PHE A 72 84.041 -7.223 2.469 1.00 0.00 H new ATOM 0 HB2 PHE A 72 82.520 -8.929 1.453 1.00 0.00 H new ATOM 0 HB3 PHE A 72 81.139 -8.032 2.054 1.00 0.00 H new ATOM 0 HD1 PHE A 72 80.594 -5.798 1.162 1.00 0.00 H new ATOM 0 HD2 PHE A 72 83.948 -8.030 -0.312 1.00 0.00 H new ATOM 0 HE1 PHE A 72 80.749 -4.274 -0.783 1.00 0.00 H new ATOM 0 HE2 PHE A 72 84.112 -6.506 -2.256 1.00 0.00 H new ATOM 0 HZ PHE A 72 82.511 -4.625 -2.496 1.00 0.00 H new ATOM 1159 N GLN A 73 81.419 -6.131 4.146 1.00 0.00 N ATOM 1160 CA GLN A 73 80.783 -4.905 4.697 1.00 0.00 C ATOM 1161 C GLN A 73 81.771 -4.121 5.574 1.00 0.00 C ATOM 1162 O GLN A 73 81.796 -2.907 5.531 1.00 0.00 O ATOM 1163 CB GLN A 73 79.568 -5.306 5.540 1.00 0.00 C ATOM 1164 CG GLN A 73 78.896 -4.057 6.118 1.00 0.00 C ATOM 1165 CD GLN A 73 77.629 -4.466 6.868 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.192 -5.596 6.774 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.023 -3.594 7.626 1.00 0.00 N ATOM 0 H GLN A 73 80.993 -7.008 4.447 1.00 0.00 H new ATOM 0 HA GLN A 73 80.476 -4.268 3.867 1.00 0.00 H new ATOM 0 HB2 GLN A 73 78.857 -5.861 4.928 1.00 0.00 H new ATOM 0 HB3 GLN A 73 79.878 -5.969 6.348 1.00 0.00 H new ATOM 0 HG2 GLN A 73 79.580 -3.541 6.791 1.00 0.00 H new ATOM 0 HG3 GLN A 73 78.649 -3.359 5.318 1.00 0.00 H new ATOM 0 HE21 GLN A 73 77.389 -2.645 7.705 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.183 -3.861 8.139 1.00 0.00 H new ATOM 1176 N GLU A 74 82.582 -4.772 6.380 1.00 0.00 N ATOM 1177 CA GLU A 74 83.519 -3.997 7.228 1.00 0.00 C ATOM 1178 C GLU A 74 84.572 -3.349 6.347 1.00 0.00 C ATOM 1179 O GLU A 74 84.961 -2.222 6.559 1.00 0.00 O ATOM 1180 CB GLU A 74 84.183 -4.910 8.254 1.00 0.00 C ATOM 1181 CG GLU A 74 85.068 -4.070 9.177 1.00 0.00 C ATOM 1182 CD GLU A 74 85.653 -4.961 10.273 1.00 0.00 C ATOM 1183 OE1 GLU A 74 85.212 -6.091 10.386 1.00 0.00 O ATOM 1184 OE2 GLU A 74 86.528 -4.496 10.985 1.00 0.00 O ATOM 0 H GLU A 74 82.629 -5.786 6.480 1.00 0.00 H new ATOM 0 HA GLU A 74 82.966 -3.224 7.762 1.00 0.00 H new ATOM 0 HB2 GLU A 74 83.425 -5.435 8.836 1.00 0.00 H new ATOM 0 HB3 GLU A 74 84.780 -5.670 7.750 1.00 0.00 H new ATOM 0 HG2 GLU A 74 85.871 -3.605 8.605 1.00 0.00 H new ATOM 0 HG3 GLU A 74 84.485 -3.263 9.622 1.00 0.00 H new ATOM 1191 N TYR A 75 85.039 -4.043 5.352 1.00 0.00 N ATOM 1192 CA TYR A 75 86.067 -3.430 4.479 1.00 0.00 C ATOM 1193 C TYR A 75 85.489 -2.130 3.909 1.00 0.00 C ATOM 1194 O TYR A 75 86.163 -1.125 3.811 1.00 0.00 O ATOM 1195 CB TYR A 75 86.420 -4.388 3.333 1.00 0.00 C ATOM 1196 CG TYR A 75 87.266 -3.671 2.297 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.476 -3.070 2.670 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.839 -3.609 0.962 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.255 -2.409 1.712 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.621 -2.950 0.006 1.00 0.00 C ATOM 1201 CZ TYR A 75 88.828 -2.349 0.382 1.00 0.00 C ATOM 1202 OH TYR A 75 89.596 -1.696 -0.561 1.00 0.00 O ATOM 0 H TYR A 75 84.758 -4.993 5.109 1.00 0.00 H new ATOM 0 HA TYR A 75 86.973 -3.226 5.049 1.00 0.00 H new ATOM 0 HB2 TYR A 75 86.961 -5.250 3.723 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.508 -4.766 2.871 1.00 0.00 H new ATOM 0 HD1 TYR A 75 88.808 -3.117 3.697 1.00 0.00 H new ATOM 0 HD2 TYR A 75 85.906 -4.070 0.672 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.187 -1.945 2.001 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.293 -2.905 -1.022 1.00 0.00 H new ATOM 0 HH TYR A 75 89.156 -1.749 -1.435 1.00 0.00 H new ATOM 1212 N CYS A 76 84.233 -2.151 3.548 1.00 0.00 N ATOM 1213 CA CYS A 76 83.581 -0.932 2.997 1.00 0.00 C ATOM 1214 C CYS A 76 83.454 0.110 4.101 1.00 0.00 C ATOM 1215 O CYS A 76 83.667 1.285 3.879 1.00 0.00 O ATOM 1216 CB CYS A 76 82.187 -1.288 2.477 1.00 0.00 C ATOM 1217 SG CYS A 76 82.321 -2.594 1.230 1.00 0.00 S ATOM 0 H CYS A 76 83.628 -2.969 3.613 1.00 0.00 H new ATOM 0 HA CYS A 76 84.183 -0.534 2.180 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.554 -1.620 3.300 1.00 0.00 H new ATOM 0 HB3 CYS A 76 81.712 -0.407 2.046 1.00 0.00 H new ATOM 0 HG CYS A 76 82.663 -3.709 1.804 1.00 0.00 H new ATOM 1223 N VAL A 77 83.123 -0.301 5.297 1.00 0.00 N ATOM 1224 CA VAL A 77 83.011 0.697 6.388 1.00 0.00 C ATOM 1225 C VAL A 77 84.374 1.358 6.530 1.00 0.00 C ATOM 1226 O VAL A 77 84.488 2.559 6.671 1.00 0.00 O ATOM 1227 CB VAL A 77 82.630 -0.006 7.695 1.00 0.00 C ATOM 1228 CG1 VAL A 77 82.745 0.977 8.867 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.190 -0.525 7.596 1.00 0.00 C ATOM 0 H VAL A 77 82.929 -1.268 5.558 1.00 0.00 H new ATOM 0 HA VAL A 77 82.243 1.438 6.164 1.00 0.00 H new ATOM 0 HB VAL A 77 83.307 -0.844 7.864 1.00 0.00 H new ATOM 0 HG11 VAL A 77 82.473 0.472 9.794 1.00 0.00 H new ATOM 0 HG12 VAL A 77 83.771 1.339 8.939 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.073 1.820 8.702 1.00 0.00 H new ATOM 0 HG21 VAL A 77 80.919 -1.025 8.526 1.00 0.00 H new ATOM 0 HG22 VAL A 77 80.513 0.311 7.423 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.114 -1.231 6.769 1.00 0.00 H new ATOM 1239 N PHE A 78 85.415 0.576 6.455 1.00 0.00 N ATOM 1240 CA PHE A 78 86.779 1.150 6.544 1.00 0.00 C ATOM 1241 C PHE A 78 87.057 1.952 5.268 1.00 0.00 C ATOM 1242 O PHE A 78 87.647 3.012 5.311 1.00 0.00 O ATOM 1243 CB PHE A 78 87.806 0.014 6.692 1.00 0.00 C ATOM 1244 CG PHE A 78 87.946 -0.374 8.153 1.00 0.00 C ATOM 1245 CD1 PHE A 78 86.862 -0.939 8.836 1.00 0.00 C ATOM 1246 CD2 PHE A 78 89.161 -0.168 8.821 1.00 0.00 C ATOM 1247 CE1 PHE A 78 86.992 -1.298 10.182 1.00 0.00 C ATOM 1248 CE2 PHE A 78 89.289 -0.528 10.168 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.205 -1.094 10.848 1.00 0.00 C ATOM 0 H PHE A 78 85.376 -0.436 6.336 1.00 0.00 H new ATOM 0 HA PHE A 78 86.856 1.806 7.411 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.491 -0.850 6.107 1.00 0.00 H new ATOM 0 HB3 PHE A 78 88.771 0.332 6.298 1.00 0.00 H new ATOM 0 HD1 PHE A 78 85.925 -1.098 8.323 1.00 0.00 H new ATOM 0 HD2 PHE A 78 89.998 0.268 8.297 1.00 0.00 H new ATOM 0 HE1 PHE A 78 86.155 -1.733 10.707 1.00 0.00 H new ATOM 0 HE2 PHE A 78 90.225 -0.369 10.683 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.305 -1.373 11.886 1.00 0.00 H new ATOM 1259 N LEU A 79 86.640 1.457 4.126 1.00 0.00 N ATOM 1260 CA LEU A 79 86.896 2.211 2.864 1.00 0.00 C ATOM 1261 C LEU A 79 86.120 3.531 2.904 1.00 0.00 C ATOM 1262 O LEU A 79 86.608 4.568 2.500 1.00 0.00 O ATOM 1263 CB LEU A 79 86.443 1.355 1.655 1.00 0.00 C ATOM 1264 CG LEU A 79 87.479 1.409 0.521 1.00 0.00 C ATOM 1265 CD1 LEU A 79 86.963 0.589 -0.667 1.00 0.00 C ATOM 1266 CD2 LEU A 79 87.721 2.866 0.080 1.00 0.00 C ATOM 0 H LEU A 79 86.140 0.575 4.017 1.00 0.00 H new ATOM 0 HA LEU A 79 87.960 2.426 2.764 1.00 0.00 H new ATOM 0 HB2 LEU A 79 86.298 0.322 1.971 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.481 1.715 1.290 1.00 0.00 H new ATOM 0 HG LEU A 79 88.422 0.995 0.878 1.00 0.00 H new ATOM 0 HD11 LEU A 79 87.692 0.622 -1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 79 86.812 -0.445 -0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 79 86.017 1.006 -1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 79 88.457 2.885 -0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.786 3.299 -0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 79 88.092 3.445 0.926 1.00 0.00 H new ATOM 1278 N SER A 80 84.919 3.492 3.405 1.00 0.00 N ATOM 1279 CA SER A 80 84.106 4.735 3.495 1.00 0.00 C ATOM 1280 C SER A 80 84.765 5.649 4.510 1.00 0.00 C ATOM 1281 O SER A 80 84.866 6.842 4.324 1.00 0.00 O ATOM 1282 CB SER A 80 82.680 4.415 3.947 1.00 0.00 C ATOM 1283 OG SER A 80 82.040 3.613 2.963 1.00 0.00 O ATOM 0 H SER A 80 84.464 2.650 3.757 1.00 0.00 H new ATOM 0 HA SER A 80 84.053 5.213 2.517 1.00 0.00 H new ATOM 0 HB2 SER A 80 82.699 3.891 4.903 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.120 5.337 4.100 1.00 0.00 H new ATOM 0 HG SER A 80 81.268 4.095 2.600 1.00 0.00 H new ATOM 1289 N CYS A 81 85.243 5.080 5.579 1.00 0.00 N ATOM 1290 CA CYS A 81 85.923 5.900 6.602 1.00 0.00 C ATOM 1291 C CYS A 81 87.096 6.579 5.920 1.00 0.00 C ATOM 1292 O CYS A 81 87.421 7.716 6.201 1.00 0.00 O ATOM 1293 CB CYS A 81 86.436 5.006 7.731 1.00 0.00 C ATOM 1294 SG CYS A 81 87.445 5.988 8.868 1.00 0.00 S ATOM 0 H CYS A 81 85.190 4.082 5.784 1.00 0.00 H new ATOM 0 HA CYS A 81 85.238 6.632 7.029 1.00 0.00 H new ATOM 0 HB2 CYS A 81 85.597 4.560 8.265 1.00 0.00 H new ATOM 0 HB3 CYS A 81 87.025 4.186 7.321 1.00 0.00 H new ATOM 0 HG CYS A 81 87.880 5.228 9.829 1.00 0.00 H new ATOM 1300 N ILE A 82 87.727 5.899 4.997 1.00 0.00 N ATOM 1301 CA ILE A 82 88.864 6.547 4.289 1.00 0.00 C ATOM 1302 C ILE A 82 88.305 7.645 3.389 1.00 0.00 C ATOM 1303 O ILE A 82 88.865 8.714 3.274 1.00 0.00 O ATOM 1304 CB ILE A 82 89.628 5.525 3.441 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.361 4.551 4.369 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.652 6.247 2.552 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.942 3.401 3.550 1.00 0.00 C ATOM 0 H ILE A 82 87.509 4.945 4.710 1.00 0.00 H new ATOM 0 HA ILE A 82 89.556 6.966 5.020 1.00 0.00 H new ATOM 0 HB ILE A 82 88.926 4.980 2.810 1.00 0.00 H new ATOM 0 HG12 ILE A 82 91.158 5.070 4.901 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.674 4.164 5.122 1.00 0.00 H new ATOM 0 HG21 ILE A 82 91.192 5.515 1.951 1.00 0.00 H new ATOM 0 HG22 ILE A 82 90.134 6.945 1.894 1.00 0.00 H new ATOM 0 HG23 ILE A 82 91.357 6.793 3.179 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.463 2.710 4.212 1.00 0.00 H new ATOM 0 HD12 ILE A 82 90.136 2.875 3.038 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.643 3.796 2.814 1.00 0.00 H new ATOM 1319 N ALA A 83 87.201 7.393 2.748 1.00 0.00 N ATOM 1320 CA ALA A 83 86.623 8.438 1.865 1.00 0.00 C ATOM 1321 C ALA A 83 86.250 9.655 2.710 1.00 0.00 C ATOM 1322 O ALA A 83 86.543 10.781 2.359 1.00 0.00 O ATOM 1323 CB ALA A 83 85.376 7.899 1.172 1.00 0.00 C ATOM 0 H ALA A 83 86.679 6.518 2.796 1.00 0.00 H new ATOM 0 HA ALA A 83 87.356 8.722 1.110 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.957 8.670 0.526 1.00 0.00 H new ATOM 0 HB2 ALA A 83 85.641 7.028 0.573 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.638 7.613 1.922 1.00 0.00 H new ATOM 1329 N MET A 84 85.611 9.437 3.828 1.00 0.00 N ATOM 1330 CA MET A 84 85.232 10.583 4.693 1.00 0.00 C ATOM 1331 C MET A 84 86.505 11.310 5.104 1.00 0.00 C ATOM 1332 O MET A 84 86.509 12.503 5.327 1.00 0.00 O ATOM 1333 CB MET A 84 84.489 10.097 5.946 1.00 0.00 C ATOM 1334 CG MET A 84 83.184 9.394 5.550 1.00 0.00 C ATOM 1335 SD MET A 84 82.102 10.551 4.665 1.00 0.00 S ATOM 1336 CE MET A 84 82.287 9.847 3.005 1.00 0.00 C ATOM 0 H MET A 84 85.338 8.518 4.176 1.00 0.00 H new ATOM 0 HA MET A 84 84.568 11.250 4.143 1.00 0.00 H new ATOM 0 HB2 MET A 84 85.122 9.413 6.510 1.00 0.00 H new ATOM 0 HB3 MET A 84 84.271 10.942 6.599 1.00 0.00 H new ATOM 0 HG2 MET A 84 83.402 8.532 4.920 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.679 9.018 6.440 1.00 0.00 H new ATOM 0 HE1 MET A 84 81.538 10.279 2.341 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.283 10.072 2.623 1.00 0.00 H new ATOM 0 HE3 MET A 84 82.152 8.766 3.051 1.00 0.00 H new ATOM 1346 N MET A 85 87.594 10.601 5.207 1.00 0.00 N ATOM 1347 CA MET A 85 88.855 11.269 5.603 1.00 0.00 C ATOM 1348 C MET A 85 89.172 12.343 4.565 1.00 0.00 C ATOM 1349 O MET A 85 89.582 13.430 4.909 1.00 0.00 O ATOM 1350 CB MET A 85 90.000 10.252 5.646 1.00 0.00 C ATOM 1351 CG MET A 85 91.228 10.892 6.297 1.00 0.00 C ATOM 1352 SD MET A 85 90.931 11.116 8.070 1.00 0.00 S ATOM 1353 CE MET A 85 90.910 9.366 8.544 1.00 0.00 C ATOM 0 H MET A 85 87.662 9.598 5.035 1.00 0.00 H new ATOM 0 HA MET A 85 88.744 11.712 6.593 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.696 9.369 6.209 1.00 0.00 H new ATOM 0 HB3 MET A 85 90.242 9.919 4.637 1.00 0.00 H new ATOM 0 HG2 MET A 85 92.104 10.262 6.142 1.00 0.00 H new ATOM 0 HG3 MET A 85 91.440 11.854 5.829 1.00 0.00 H new ATOM 0 HE1 MET A 85 91.216 9.267 9.586 1.00 0.00 H new ATOM 0 HE2 MET A 85 89.902 8.968 8.422 1.00 0.00 H new ATOM 0 HE3 MET A 85 91.599 8.809 7.909 1.00 0.00 H new ATOM 1363 N CYS A 86 88.954 12.058 3.295 1.00 0.00 N ATOM 1364 CA CYS A 86 89.225 13.090 2.244 1.00 0.00 C ATOM 1365 C CYS A 86 89.007 12.487 0.852 1.00 0.00 C ATOM 1366 O CYS A 86 89.950 12.155 0.161 1.00 0.00 O ATOM 1367 CB CYS A 86 90.676 13.596 2.352 1.00 0.00 C ATOM 1368 SG CYS A 86 91.138 14.481 0.838 1.00 0.00 S ATOM 0 H CYS A 86 88.604 11.165 2.949 1.00 0.00 H new ATOM 0 HA CYS A 86 88.540 13.925 2.395 1.00 0.00 H new ATOM 0 HB2 CYS A 86 90.777 14.256 3.214 1.00 0.00 H new ATOM 0 HB3 CYS A 86 91.352 12.756 2.513 1.00 0.00 H new ATOM 0 HG CYS A 86 90.786 13.780 -0.199 1.00 0.00 H new ATOM 1374 N ASN A 87 87.779 12.356 0.425 1.00 0.00 N ATOM 1375 CA ASN A 87 87.515 11.786 -0.936 1.00 0.00 C ATOM 1376 C ASN A 87 87.324 12.928 -1.941 1.00 0.00 C ATOM 1377 O ASN A 87 87.530 12.764 -3.128 1.00 0.00 O ATOM 1378 CB ASN A 87 86.245 10.926 -0.896 1.00 0.00 C ATOM 1379 CG ASN A 87 86.259 9.929 -2.059 1.00 0.00 C ATOM 1380 OD1 ASN A 87 86.742 10.236 -3.131 1.00 0.00 O ATOM 1381 ND2 ASN A 87 85.752 8.738 -1.892 1.00 0.00 N ATOM 0 H ASN A 87 86.948 12.617 0.955 1.00 0.00 H new ATOM 0 HA ASN A 87 88.362 11.170 -1.240 1.00 0.00 H new ATOM 0 HB2 ASN A 87 86.186 10.392 0.052 1.00 0.00 H new ATOM 0 HB3 ASN A 87 85.362 11.562 -0.960 1.00 0.00 H new ATOM 0 HD21 ASN A 87 85.762 8.067 -2.660 1.00 0.00 H new ATOM 0 HD22 ASN A 87 85.346 8.478 -0.993 1.00 0.00 H new ATOM 1388 N GLU A 88 86.923 14.081 -1.479 1.00 0.00 N ATOM 1389 CA GLU A 88 86.711 15.227 -2.411 1.00 0.00 C ATOM 1390 C GLU A 88 88.029 15.565 -3.113 1.00 0.00 C ATOM 1391 O GLU A 88 89.062 15.687 -2.485 1.00 0.00 O ATOM 1392 CB GLU A 88 86.232 16.445 -1.621 1.00 0.00 C ATOM 1393 CG GLU A 88 85.762 17.528 -2.593 1.00 0.00 C ATOM 1394 CD GLU A 88 84.426 17.108 -3.208 1.00 0.00 C ATOM 1395 OE1 GLU A 88 83.909 16.080 -2.802 1.00 0.00 O ATOM 1396 OE2 GLU A 88 83.939 17.819 -4.070 1.00 0.00 O ATOM 0 H GLU A 88 86.733 14.280 -0.497 1.00 0.00 H new ATOM 0 HA GLU A 88 85.961 14.956 -3.154 1.00 0.00 H new ATOM 0 HB2 GLU A 88 85.418 16.162 -0.953 1.00 0.00 H new ATOM 0 HB3 GLU A 88 87.039 16.827 -0.996 1.00 0.00 H new ATOM 0 HG2 GLU A 88 85.653 18.479 -2.071 1.00 0.00 H new ATOM 0 HG3 GLU A 88 86.505 17.678 -3.376 1.00 0.00 H new ATOM 1403 N PHE A 89 88.005 15.716 -4.415 1.00 0.00 N ATOM 1404 CA PHE A 89 89.266 16.045 -5.153 1.00 0.00 C ATOM 1405 C PHE A 89 89.424 17.565 -5.291 1.00 0.00 C ATOM 1406 O PHE A 89 90.161 18.186 -4.551 1.00 0.00 O ATOM 1407 CB PHE A 89 89.215 15.410 -6.543 1.00 0.00 C ATOM 1408 CG PHE A 89 89.205 13.907 -6.405 1.00 0.00 C ATOM 1409 CD1 PHE A 89 87.990 13.219 -6.300 1.00 0.00 C ATOM 1410 CD2 PHE A 89 90.415 13.201 -6.376 1.00 0.00 C ATOM 1411 CE1 PHE A 89 87.984 11.825 -6.167 1.00 0.00 C ATOM 1412 CE2 PHE A 89 90.408 11.807 -6.243 1.00 0.00 C ATOM 1413 CZ PHE A 89 89.193 11.120 -6.139 1.00 0.00 C ATOM 0 H PHE A 89 87.172 15.626 -4.997 1.00 0.00 H new ATOM 0 HA PHE A 89 90.117 15.653 -4.595 1.00 0.00 H new ATOM 0 HB2 PHE A 89 88.324 15.744 -7.075 1.00 0.00 H new ATOM 0 HB3 PHE A 89 90.076 15.727 -7.132 1.00 0.00 H new ATOM 0 HD1 PHE A 89 87.058 13.763 -6.322 1.00 0.00 H new ATOM 0 HD2 PHE A 89 91.352 13.732 -6.456 1.00 0.00 H new ATOM 0 HE1 PHE A 89 87.047 11.294 -6.086 1.00 0.00 H new ATOM 0 HE2 PHE A 89 91.340 11.262 -6.221 1.00 0.00 H new ATOM 0 HZ PHE A 89 89.188 10.045 -6.037 1.00 0.00 H new ATOM 1423 N PHE A 90 88.742 18.166 -6.237 1.00 0.00 N ATOM 1424 CA PHE A 90 88.847 19.653 -6.441 1.00 0.00 C ATOM 1425 C PHE A 90 87.476 20.299 -6.257 1.00 0.00 C ATOM 1426 O PHE A 90 87.361 21.461 -5.923 1.00 0.00 O ATOM 1427 CB PHE A 90 89.326 19.924 -7.866 1.00 0.00 C ATOM 1428 CG PHE A 90 90.681 19.299 -8.057 1.00 0.00 C ATOM 1429 CD1 PHE A 90 90.777 17.979 -8.506 1.00 0.00 C ATOM 1430 CD2 PHE A 90 91.839 20.037 -7.788 1.00 0.00 C ATOM 1431 CE1 PHE A 90 92.032 17.393 -8.684 1.00 0.00 C ATOM 1432 CE2 PHE A 90 93.096 19.450 -7.967 1.00 0.00 C ATOM 1433 CZ PHE A 90 93.194 18.127 -8.415 1.00 0.00 C ATOM 0 H PHE A 90 88.112 17.690 -6.883 1.00 0.00 H new ATOM 0 HA PHE A 90 89.547 20.068 -5.716 1.00 0.00 H new ATOM 0 HB2 PHE A 90 88.618 19.513 -8.585 1.00 0.00 H new ATOM 0 HB3 PHE A 90 89.378 20.998 -8.047 1.00 0.00 H new ATOM 0 HD1 PHE A 90 89.881 17.413 -8.715 1.00 0.00 H new ATOM 0 HD2 PHE A 90 91.762 21.058 -7.443 1.00 0.00 H new ATOM 0 HE1 PHE A 90 92.107 16.372 -9.030 1.00 0.00 H new ATOM 0 HE2 PHE A 90 93.991 20.017 -7.760 1.00 0.00 H new ATOM 0 HZ PHE A 90 94.164 17.673 -8.553 1.00 0.00 H new ATOM 1443 N GLU A 91 86.437 19.553 -6.481 1.00 0.00 N ATOM 1444 CA GLU A 91 85.065 20.114 -6.331 1.00 0.00 C ATOM 1445 C GLU A 91 84.780 20.366 -4.849 1.00 0.00 C ATOM 1446 O GLU A 91 85.328 19.713 -3.988 1.00 0.00 O ATOM 1447 CB GLU A 91 84.050 19.116 -6.890 1.00 0.00 C ATOM 1448 CG GLU A 91 84.286 18.937 -8.393 1.00 0.00 C ATOM 1449 CD GLU A 91 83.960 20.241 -9.126 1.00 0.00 C ATOM 1450 OE1 GLU A 91 82.826 20.680 -9.036 1.00 0.00 O ATOM 1451 OE2 GLU A 91 84.852 20.777 -9.763 1.00 0.00 O ATOM 0 H GLU A 91 86.475 18.574 -6.763 1.00 0.00 H new ATOM 0 HA GLU A 91 84.988 21.054 -6.877 1.00 0.00 H new ATOM 0 HB2 GLU A 91 84.146 18.158 -6.379 1.00 0.00 H new ATOM 0 HB3 GLU A 91 83.036 19.473 -6.710 1.00 0.00 H new ATOM 0 HG2 GLU A 91 85.323 18.655 -8.577 1.00 0.00 H new ATOM 0 HG3 GLU A 91 83.663 18.128 -8.775 1.00 0.00 H new ATOM 1458 N GLY A 92 83.937 21.315 -4.542 1.00 0.00 N ATOM 1459 CA GLY A 92 83.632 21.602 -3.109 1.00 0.00 C ATOM 1460 C GLY A 92 83.175 20.314 -2.418 1.00 0.00 C ATOM 1461 O GLY A 92 82.574 19.453 -3.029 1.00 0.00 O ATOM 0 H GLY A 92 83.448 21.902 -5.218 1.00 0.00 H new ATOM 0 HA2 GLY A 92 84.515 22.001 -2.611 1.00 0.00 H new ATOM 0 HA3 GLY A 92 82.854 22.362 -3.037 1.00 0.00 H new ATOM 1465 N PHE A 93 83.464 20.169 -1.148 1.00 0.00 N ATOM 1466 CA PHE A 93 83.056 18.926 -0.419 1.00 0.00 C ATOM 1467 C PHE A 93 81.709 19.159 0.301 1.00 0.00 C ATOM 1468 O PHE A 93 81.537 20.176 0.943 1.00 0.00 O ATOM 1469 CB PHE A 93 84.112 18.602 0.639 1.00 0.00 C ATOM 1470 CG PHE A 93 84.372 19.828 1.482 1.00 0.00 C ATOM 1471 CD1 PHE A 93 85.303 20.784 1.061 1.00 0.00 C ATOM 1472 CD2 PHE A 93 83.679 20.007 2.687 1.00 0.00 C ATOM 1473 CE1 PHE A 93 85.542 21.921 1.843 1.00 0.00 C ATOM 1474 CE2 PHE A 93 83.918 21.143 3.469 1.00 0.00 C ATOM 1475 CZ PHE A 93 84.849 22.100 3.048 1.00 0.00 C ATOM 0 H PHE A 93 83.964 20.856 -0.584 1.00 0.00 H new ATOM 0 HA PHE A 93 82.959 18.108 -1.133 1.00 0.00 H new ATOM 0 HB2 PHE A 93 83.771 17.780 1.269 1.00 0.00 H new ATOM 0 HB3 PHE A 93 85.035 18.275 0.159 1.00 0.00 H new ATOM 0 HD1 PHE A 93 85.837 20.645 0.133 1.00 0.00 H new ATOM 0 HD2 PHE A 93 82.961 19.269 3.012 1.00 0.00 H new ATOM 0 HE1 PHE A 93 86.260 22.659 1.518 1.00 0.00 H new ATOM 0 HE2 PHE A 93 83.384 21.281 4.398 1.00 0.00 H new ATOM 0 HZ PHE A 93 85.033 22.976 3.652 1.00 0.00 H new ATOM 1485 N PRO A 94 80.759 18.237 0.235 1.00 0.00 N ATOM 1486 CA PRO A 94 79.465 18.433 0.951 1.00 0.00 C ATOM 1487 C PRO A 94 79.638 18.275 2.471 1.00 0.00 C ATOM 1488 O PRO A 94 79.823 19.238 3.188 1.00 0.00 O ATOM 1489 CB PRO A 94 78.599 17.306 0.367 1.00 0.00 C ATOM 1490 CG PRO A 94 79.547 16.263 -0.241 1.00 0.00 C ATOM 1491 CD PRO A 94 80.884 16.963 -0.538 1.00 0.00 C ATOM 0 HA PRO A 94 79.037 19.427 0.819 1.00 0.00 H new ATOM 0 HB2 PRO A 94 77.981 16.856 1.144 1.00 0.00 H new ATOM 0 HB3 PRO A 94 77.922 17.697 -0.392 1.00 0.00 H new ATOM 0 HG2 PRO A 94 79.695 15.433 0.449 1.00 0.00 H new ATOM 0 HG3 PRO A 94 79.122 15.846 -1.154 1.00 0.00 H new ATOM 0 HD2 PRO A 94 81.736 16.369 -0.207 1.00 0.00 H new ATOM 0 HD3 PRO A 94 81.018 17.146 -1.604 1.00 0.00 H new ATOM 1499 N ASP A 95 79.587 17.062 2.959 1.00 0.00 N ATOM 1500 CA ASP A 95 79.759 16.829 4.426 1.00 0.00 C ATOM 1501 C ASP A 95 80.401 15.454 4.649 1.00 0.00 C ATOM 1502 O ASP A 95 79.723 14.453 4.766 1.00 0.00 O ATOM 1503 CB ASP A 95 78.393 16.876 5.115 1.00 0.00 C ATOM 1504 CG ASP A 95 77.492 15.784 4.540 1.00 0.00 C ATOM 1505 OD1 ASP A 95 77.773 15.327 3.444 1.00 0.00 O ATOM 1506 OD2 ASP A 95 76.536 15.423 5.206 1.00 0.00 O ATOM 0 H ASP A 95 79.433 16.220 2.404 1.00 0.00 H new ATOM 0 HA ASP A 95 80.401 17.603 4.846 1.00 0.00 H new ATOM 0 HB2 ASP A 95 78.511 16.736 6.189 1.00 0.00 H new ATOM 0 HB3 ASP A 95 77.934 17.854 4.970 1.00 0.00 H new ATOM 1511 N LYS A 96 81.706 15.397 4.707 1.00 0.00 N ATOM 1512 CA LYS A 96 82.396 14.084 4.917 1.00 0.00 C ATOM 1513 C LYS A 96 82.581 13.828 6.422 1.00 0.00 C ATOM 1514 O LYS A 96 81.827 13.096 7.032 1.00 0.00 O ATOM 1515 CB LYS A 96 83.764 14.107 4.203 1.00 0.00 C ATOM 1516 CG LYS A 96 84.297 15.542 4.117 1.00 0.00 C ATOM 1517 CD LYS A 96 85.736 15.518 3.598 1.00 0.00 C ATOM 1518 CE LYS A 96 86.264 16.948 3.491 1.00 0.00 C ATOM 1519 NZ LYS A 96 86.394 17.533 4.857 1.00 0.00 N ATOM 0 H LYS A 96 82.326 16.202 4.618 1.00 0.00 H new ATOM 0 HA LYS A 96 81.790 13.280 4.500 1.00 0.00 H new ATOM 0 HB2 LYS A 96 84.474 13.480 4.743 1.00 0.00 H new ATOM 0 HB3 LYS A 96 83.666 13.688 3.202 1.00 0.00 H new ATOM 0 HG2 LYS A 96 83.669 16.136 3.453 1.00 0.00 H new ATOM 0 HG3 LYS A 96 84.260 16.015 5.098 1.00 0.00 H new ATOM 0 HD2 LYS A 96 86.366 14.936 4.270 1.00 0.00 H new ATOM 0 HD3 LYS A 96 85.774 15.031 2.623 1.00 0.00 H new ATOM 0 HE2 LYS A 96 87.231 16.953 2.988 1.00 0.00 H new ATOM 0 HE3 LYS A 96 85.587 17.553 2.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 87.021 18.362 4.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 85.456 17.823 5.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 86.795 16.823 5.502 1.00 0.00 H new ATOM 1653 N ALA B 2 96.665 2.760 -12.715 1.00 0.00 N ATOM 1654 CA ALA B 2 97.029 1.711 -11.724 1.00 0.00 C ATOM 1655 C ALA B 2 96.014 1.716 -10.579 1.00 0.00 C ATOM 1656 O ALA B 2 95.559 2.755 -10.142 1.00 0.00 O ATOM 1657 CB ALA B 2 98.430 1.994 -11.173 1.00 0.00 C ATOM 0 HA ALA B 2 97.022 0.734 -12.208 1.00 0.00 H new ATOM 0 HB1 ALA B 2 98.697 1.226 -10.447 1.00 0.00 H new ATOM 0 HB2 ALA B 2 99.151 1.987 -11.991 1.00 0.00 H new ATOM 0 HB3 ALA B 2 98.440 2.970 -10.689 1.00 0.00 H new ATOM 1663 N CYS B 3 95.655 0.560 -10.092 1.00 0.00 N ATOM 1664 CA CYS B 3 94.670 0.489 -8.977 1.00 0.00 C ATOM 1665 C CYS B 3 93.404 1.286 -9.332 1.00 0.00 C ATOM 1666 O CYS B 3 93.069 2.244 -8.663 1.00 0.00 O ATOM 1667 CB CYS B 3 95.299 1.079 -7.713 1.00 0.00 C ATOM 1668 SG CYS B 3 94.304 0.618 -6.273 1.00 0.00 S ATOM 0 H CYS B 3 96.003 -0.341 -10.420 1.00 0.00 H new ATOM 0 HA CYS B 3 94.397 -0.553 -8.809 1.00 0.00 H new ATOM 0 HB2 CYS B 3 96.319 0.712 -7.596 1.00 0.00 H new ATOM 0 HB3 CYS B 3 95.358 2.164 -7.796 1.00 0.00 H new ATOM 0 HG CYS B 3 95.039 0.673 -5.202 1.00 0.00 H new ATOM 1674 N PRO B 4 92.695 0.896 -10.371 1.00 0.00 N ATOM 1675 CA PRO B 4 91.449 1.614 -10.774 1.00 0.00 C ATOM 1676 C PRO B 4 90.470 1.798 -9.601 1.00 0.00 C ATOM 1677 O PRO B 4 89.414 2.382 -9.745 1.00 0.00 O ATOM 1678 CB PRO B 4 90.865 0.694 -11.863 1.00 0.00 C ATOM 1679 CG PRO B 4 91.939 -0.345 -12.246 1.00 0.00 C ATOM 1680 CD PRO B 4 93.080 -0.277 -11.211 1.00 0.00 C ATOM 0 HA PRO B 4 91.641 2.630 -11.119 1.00 0.00 H new ATOM 0 HB2 PRO B 4 89.967 0.195 -11.497 1.00 0.00 H new ATOM 0 HB3 PRO B 4 90.572 1.277 -12.736 1.00 0.00 H new ATOM 0 HG2 PRO B 4 91.507 -1.345 -12.268 1.00 0.00 H new ATOM 0 HG3 PRO B 4 92.323 -0.142 -13.246 1.00 0.00 H new ATOM 0 HD2 PRO B 4 93.147 -1.192 -10.622 1.00 0.00 H new ATOM 0 HD3 PRO B 4 94.050 -0.133 -11.687 1.00 0.00 H new ATOM 1688 N LEU B 5 90.815 1.300 -8.448 1.00 0.00 N ATOM 1689 CA LEU B 5 89.914 1.435 -7.267 1.00 0.00 C ATOM 1690 C LEU B 5 89.684 2.919 -6.979 1.00 0.00 C ATOM 1691 O LEU B 5 88.600 3.331 -6.616 1.00 0.00 O ATOM 1692 CB LEU B 5 90.578 0.766 -6.055 1.00 0.00 C ATOM 1693 CG LEU B 5 89.685 0.889 -4.810 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.327 0.211 -5.049 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.393 0.220 -3.627 1.00 0.00 C ATOM 0 H LEU B 5 91.687 0.802 -8.270 1.00 0.00 H new ATOM 0 HA LEU B 5 88.956 0.955 -7.468 1.00 0.00 H new ATOM 0 HB2 LEU B 5 90.766 -0.286 -6.271 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.545 1.230 -5.862 1.00 0.00 H new ATOM 0 HG LEU B 5 89.510 1.944 -4.597 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.709 0.309 -4.156 1.00 0.00 H new ATOM 0 HD12 LEU B 5 87.826 0.688 -5.891 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.481 -0.845 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.769 0.301 -2.737 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.567 -0.832 -3.854 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.347 0.715 -3.447 1.00 0.00 H new ATOM 1707 N GLU B 6 90.697 3.722 -7.127 1.00 0.00 N ATOM 1708 CA GLU B 6 90.543 5.176 -6.854 1.00 0.00 C ATOM 1709 C GLU B 6 89.472 5.772 -7.775 1.00 0.00 C ATOM 1710 O GLU B 6 88.626 6.531 -7.347 1.00 0.00 O ATOM 1711 CB GLU B 6 91.881 5.866 -7.120 1.00 0.00 C ATOM 1712 CG GLU B 6 92.892 5.437 -6.056 1.00 0.00 C ATOM 1713 CD GLU B 6 94.259 6.047 -6.371 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.359 6.740 -7.370 1.00 0.00 O ATOM 1715 OE2 GLU B 6 95.182 5.807 -5.611 1.00 0.00 O ATOM 0 H GLU B 6 91.628 3.434 -7.426 1.00 0.00 H new ATOM 0 HA GLU B 6 90.240 5.325 -5.818 1.00 0.00 H new ATOM 0 HB2 GLU B 6 92.247 5.604 -8.113 1.00 0.00 H new ATOM 0 HB3 GLU B 6 91.755 6.949 -7.102 1.00 0.00 H new ATOM 0 HG2 GLU B 6 92.557 5.760 -5.070 1.00 0.00 H new ATOM 0 HG3 GLU B 6 92.966 4.350 -6.027 1.00 0.00 H new ATOM 1722 N LYS B 7 89.490 5.427 -9.036 1.00 0.00 N ATOM 1723 CA LYS B 7 88.460 5.971 -9.964 1.00 0.00 C ATOM 1724 C LYS B 7 87.119 5.351 -9.607 1.00 0.00 C ATOM 1725 O LYS B 7 86.129 6.032 -9.443 1.00 0.00 O ATOM 1726 CB LYS B 7 88.829 5.618 -11.410 1.00 0.00 C ATOM 1727 CG LYS B 7 87.834 6.272 -12.374 1.00 0.00 C ATOM 1728 CD LYS B 7 88.149 5.851 -13.817 1.00 0.00 C ATOM 1729 CE LYS B 7 89.530 6.375 -14.232 1.00 0.00 C ATOM 1730 NZ LYS B 7 89.604 6.455 -15.720 1.00 0.00 N ATOM 0 H LYS B 7 90.170 4.796 -9.460 1.00 0.00 H new ATOM 0 HA LYS B 7 88.406 7.056 -9.872 1.00 0.00 H new ATOM 0 HB2 LYS B 7 89.841 5.959 -11.630 1.00 0.00 H new ATOM 0 HB3 LYS B 7 88.821 4.536 -11.543 1.00 0.00 H new ATOM 0 HG2 LYS B 7 86.817 5.979 -12.114 1.00 0.00 H new ATOM 0 HG3 LYS B 7 87.886 7.357 -12.283 1.00 0.00 H new ATOM 0 HD2 LYS B 7 88.124 4.764 -13.900 1.00 0.00 H new ATOM 0 HD3 LYS B 7 87.386 6.240 -14.492 1.00 0.00 H new ATOM 0 HE2 LYS B 7 89.704 7.358 -13.795 1.00 0.00 H new ATOM 0 HE3 LYS B 7 90.310 5.715 -13.853 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 90.540 6.810 -16.002 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 89.455 5.509 -16.126 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 88.868 7.102 -16.070 1.00 0.00 H new ATOM 1744 N ALA B 8 87.088 4.062 -9.450 1.00 0.00 N ATOM 1745 CA ALA B 8 85.821 3.406 -9.064 1.00 0.00 C ATOM 1746 C ALA B 8 85.410 3.993 -7.725 1.00 0.00 C ATOM 1747 O ALA B 8 84.258 4.283 -7.479 1.00 0.00 O ATOM 1748 CB ALA B 8 86.011 1.897 -8.961 1.00 0.00 C ATOM 0 H ALA B 8 87.885 3.437 -9.573 1.00 0.00 H new ATOM 0 HA ALA B 8 85.048 3.579 -9.812 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.068 1.430 -8.676 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.333 1.504 -9.925 1.00 0.00 H new ATOM 0 HB3 ALA B 8 86.768 1.676 -8.208 1.00 0.00 H new ATOM 1754 N LEU B 9 86.360 4.220 -6.865 1.00 0.00 N ATOM 1755 CA LEU B 9 86.022 4.845 -5.569 1.00 0.00 C ATOM 1756 C LEU B 9 85.404 6.198 -5.896 1.00 0.00 C ATOM 1757 O LEU B 9 84.427 6.609 -5.304 1.00 0.00 O ATOM 1758 CB LEU B 9 87.288 5.024 -4.720 1.00 0.00 C ATOM 1759 CG LEU B 9 86.943 5.677 -3.372 1.00 0.00 C ATOM 1760 CD1 LEU B 9 86.039 4.751 -2.543 1.00 0.00 C ATOM 1761 CD2 LEU B 9 88.243 5.948 -2.605 1.00 0.00 C ATOM 0 H LEU B 9 87.346 4.001 -7.005 1.00 0.00 H new ATOM 0 HA LEU B 9 85.332 4.225 -4.996 1.00 0.00 H new ATOM 0 HB2 LEU B 9 87.760 4.056 -4.552 1.00 0.00 H new ATOM 0 HB3 LEU B 9 88.009 5.641 -5.256 1.00 0.00 H new ATOM 0 HG LEU B 9 86.411 6.612 -3.551 1.00 0.00 H new ATOM 0 HD11 LEU B 9 85.804 5.228 -1.592 1.00 0.00 H new ATOM 0 HD12 LEU B 9 85.116 4.558 -3.090 1.00 0.00 H new ATOM 0 HD13 LEU B 9 86.555 3.809 -2.359 1.00 0.00 H new ATOM 0 HD21 LEU B 9 88.010 6.412 -1.646 1.00 0.00 H new ATOM 0 HD22 LEU B 9 88.768 5.008 -2.435 1.00 0.00 H new ATOM 0 HD23 LEU B 9 88.876 6.617 -3.187 1.00 0.00 H new ATOM 1773 N ASP B 10 85.951 6.879 -6.871 1.00 0.00 N ATOM 1774 CA ASP B 10 85.369 8.186 -7.271 1.00 0.00 C ATOM 1775 C ASP B 10 84.003 7.938 -7.909 1.00 0.00 C ATOM 1776 O ASP B 10 83.091 8.727 -7.764 1.00 0.00 O ATOM 1777 CB ASP B 10 86.292 8.889 -8.268 1.00 0.00 C ATOM 1778 CG ASP B 10 85.790 10.312 -8.512 1.00 0.00 C ATOM 1779 OD1 ASP B 10 84.687 10.613 -8.084 1.00 0.00 O ATOM 1780 OD2 ASP B 10 86.517 11.080 -9.122 1.00 0.00 O ATOM 0 H ASP B 10 86.771 6.585 -7.402 1.00 0.00 H new ATOM 0 HA ASP B 10 85.258 8.824 -6.394 1.00 0.00 H new ATOM 0 HB2 ASP B 10 87.311 8.913 -7.882 1.00 0.00 H new ATOM 0 HB3 ASP B 10 86.320 8.336 -9.207 1.00 0.00 H new ATOM 1785 N VAL B 11 83.844 6.846 -8.613 1.00 0.00 N ATOM 1786 CA VAL B 11 82.517 6.574 -9.242 1.00 0.00 C ATOM 1787 C VAL B 11 81.468 6.491 -8.133 1.00 0.00 C ATOM 1788 O VAL B 11 80.372 6.997 -8.261 1.00 0.00 O ATOM 1789 CB VAL B 11 82.565 5.242 -10.003 1.00 0.00 C ATOM 1790 CG1 VAL B 11 81.158 4.835 -10.450 1.00 0.00 C ATOM 1791 CG2 VAL B 11 83.468 5.386 -11.229 1.00 0.00 C ATOM 0 H VAL B 11 84.563 6.142 -8.778 1.00 0.00 H new ATOM 0 HA VAL B 11 82.266 7.370 -9.942 1.00 0.00 H new ATOM 0 HB VAL B 11 82.963 4.472 -9.342 1.00 0.00 H new ATOM 0 HG11 VAL B 11 81.207 3.889 -10.989 1.00 0.00 H new ATOM 0 HG12 VAL B 11 80.517 4.722 -9.576 1.00 0.00 H new ATOM 0 HG13 VAL B 11 80.747 5.604 -11.104 1.00 0.00 H new ATOM 0 HG21 VAL B 11 83.502 4.440 -11.769 1.00 0.00 H new ATOM 0 HG22 VAL B 11 83.072 6.163 -11.883 1.00 0.00 H new ATOM 0 HG23 VAL B 11 84.474 5.658 -10.910 1.00 0.00 H new ATOM 1801 N MET B 12 81.803 5.866 -7.038 1.00 0.00 N ATOM 1802 CA MET B 12 80.831 5.765 -5.918 1.00 0.00 C ATOM 1803 C MET B 12 80.468 7.177 -5.459 1.00 0.00 C ATOM 1804 O MET B 12 79.324 7.499 -5.227 1.00 0.00 O ATOM 1805 CB MET B 12 81.482 5.011 -4.761 1.00 0.00 C ATOM 1806 CG MET B 12 81.656 3.536 -5.137 1.00 0.00 C ATOM 1807 SD MET B 12 82.863 2.766 -4.026 1.00 0.00 S ATOM 1808 CE MET B 12 82.149 3.345 -2.469 1.00 0.00 C ATOM 0 H MET B 12 82.706 5.422 -6.872 1.00 0.00 H new ATOM 0 HA MET B 12 79.935 5.236 -6.242 1.00 0.00 H new ATOM 0 HB2 MET B 12 82.450 5.453 -4.526 1.00 0.00 H new ATOM 0 HB3 MET B 12 80.866 5.098 -3.866 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.700 3.017 -5.068 1.00 0.00 H new ATOM 0 HG3 MET B 12 81.991 3.450 -6.171 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.490 2.708 -1.653 1.00 0.00 H new ATOM 0 HE2 MET B 12 82.464 4.372 -2.284 1.00 0.00 H new ATOM 0 HE3 MET B 12 81.061 3.305 -2.530 1.00 0.00 H new ATOM 1818 N VAL B 13 81.448 8.017 -5.326 1.00 0.00 N ATOM 1819 CA VAL B 13 81.187 9.419 -4.893 1.00 0.00 C ATOM 1820 C VAL B 13 80.600 10.224 -6.053 1.00 0.00 C ATOM 1821 O VAL B 13 79.721 11.042 -5.868 1.00 0.00 O ATOM 1822 CB VAL B 13 82.498 10.045 -4.422 1.00 0.00 C ATOM 1823 CG1 VAL B 13 82.287 11.526 -4.078 1.00 0.00 C ATOM 1824 CG2 VAL B 13 82.979 9.290 -3.183 1.00 0.00 C ATOM 0 H VAL B 13 82.428 7.795 -5.499 1.00 0.00 H new ATOM 0 HA VAL B 13 80.468 9.424 -4.074 1.00 0.00 H new ATOM 0 HB VAL B 13 83.242 9.978 -5.216 1.00 0.00 H new ATOM 0 HG11 VAL B 13 83.229 11.960 -3.744 1.00 0.00 H new ATOM 0 HG12 VAL B 13 81.936 12.058 -4.962 1.00 0.00 H new ATOM 0 HG13 VAL B 13 81.546 11.613 -3.284 1.00 0.00 H new ATOM 0 HG21 VAL B 13 83.915 9.724 -2.833 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.228 9.365 -2.397 1.00 0.00 H new ATOM 0 HG23 VAL B 13 83.137 8.241 -3.435 1.00 0.00 H new ATOM 1834 N SER B 14 81.090 10.024 -7.247 1.00 0.00 N ATOM 1835 CA SER B 14 80.555 10.812 -8.397 1.00 0.00 C ATOM 1836 C SER B 14 79.056 10.540 -8.550 1.00 0.00 C ATOM 1837 O SER B 14 78.265 11.455 -8.666 1.00 0.00 O ATOM 1838 CB SER B 14 81.277 10.402 -9.683 1.00 0.00 C ATOM 1839 OG SER B 14 82.680 10.544 -9.504 1.00 0.00 O ATOM 0 H SER B 14 81.828 9.358 -7.475 1.00 0.00 H new ATOM 0 HA SER B 14 80.718 11.874 -8.212 1.00 0.00 H new ATOM 0 HB2 SER B 14 81.034 9.370 -9.936 1.00 0.00 H new ATOM 0 HB3 SER B 14 80.941 11.021 -10.515 1.00 0.00 H new ATOM 0 HG SER B 14 82.925 10.259 -8.599 1.00 0.00 H new ATOM 1845 N THR B 15 78.649 9.299 -8.537 1.00 0.00 N ATOM 1846 CA THR B 15 77.190 9.007 -8.665 1.00 0.00 C ATOM 1847 C THR B 15 76.448 9.673 -7.499 1.00 0.00 C ATOM 1848 O THR B 15 75.376 10.219 -7.656 1.00 0.00 O ATOM 1849 CB THR B 15 76.965 7.480 -8.669 1.00 0.00 C ATOM 1850 OG1 THR B 15 75.812 7.180 -9.442 1.00 0.00 O ATOM 1851 CG2 THR B 15 76.775 6.933 -7.247 1.00 0.00 C ATOM 0 H THR B 15 79.254 8.483 -8.445 1.00 0.00 H new ATOM 0 HA THR B 15 76.804 9.407 -9.602 1.00 0.00 H new ATOM 0 HB THR B 15 77.848 7.008 -9.099 1.00 0.00 H new ATOM 0 HG1 THR B 15 75.975 6.372 -9.972 1.00 0.00 H new ATOM 0 HG21 THR B 15 76.619 5.855 -7.290 1.00 0.00 H new ATOM 0 HG22 THR B 15 77.663 7.148 -6.653 1.00 0.00 H new ATOM 0 HG23 THR B 15 75.908 7.407 -6.788 1.00 0.00 H new ATOM 1859 N PHE B 16 77.029 9.623 -6.335 1.00 0.00 N ATOM 1860 CA PHE B 16 76.397 10.231 -5.127 1.00 0.00 C ATOM 1861 C PHE B 16 76.199 11.731 -5.368 1.00 0.00 C ATOM 1862 O PHE B 16 75.192 12.306 -5.005 1.00 0.00 O ATOM 1863 CB PHE B 16 77.357 10.031 -3.944 1.00 0.00 C ATOM 1864 CG PHE B 16 76.701 10.422 -2.636 1.00 0.00 C ATOM 1865 CD1 PHE B 16 76.537 11.774 -2.303 1.00 0.00 C ATOM 1866 CD2 PHE B 16 76.281 9.427 -1.743 1.00 0.00 C ATOM 1867 CE1 PHE B 16 75.950 12.127 -1.081 1.00 0.00 C ATOM 1868 CE2 PHE B 16 75.694 9.782 -0.524 1.00 0.00 C ATOM 1869 CZ PHE B 16 75.529 11.131 -0.192 1.00 0.00 C ATOM 0 H PHE B 16 77.931 9.179 -6.164 1.00 0.00 H new ATOM 0 HA PHE B 16 75.432 9.767 -4.921 1.00 0.00 H new ATOM 0 HB2 PHE B 16 77.671 8.988 -3.899 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.256 10.628 -4.096 1.00 0.00 H new ATOM 0 HD1 PHE B 16 76.863 12.543 -2.988 1.00 0.00 H new ATOM 0 HD2 PHE B 16 76.411 8.385 -1.996 1.00 0.00 H new ATOM 0 HE1 PHE B 16 75.822 13.168 -0.825 1.00 0.00 H new ATOM 0 HE2 PHE B 16 75.368 9.014 0.162 1.00 0.00 H new ATOM 0 HZ PHE B 16 75.077 11.404 0.750 1.00 0.00 H new ATOM 1879 N HIS B 17 77.158 12.360 -5.986 1.00 0.00 N ATOM 1880 CA HIS B 17 77.054 13.819 -6.272 1.00 0.00 C ATOM 1881 C HIS B 17 76.001 14.068 -7.349 1.00 0.00 C ATOM 1882 O HIS B 17 75.406 15.126 -7.409 1.00 0.00 O ATOM 1883 CB HIS B 17 78.410 14.337 -6.753 1.00 0.00 C ATOM 1884 CG HIS B 17 78.311 15.808 -7.050 1.00 0.00 C ATOM 1885 ND1 HIS B 17 77.992 16.743 -6.075 1.00 0.00 N ATOM 1886 CD2 HIS B 17 78.489 16.521 -8.210 1.00 0.00 C ATOM 1887 CE1 HIS B 17 77.991 17.954 -6.661 1.00 0.00 C ATOM 1888 NE2 HIS B 17 78.287 17.872 -7.959 1.00 0.00 N ATOM 0 H HIS B 17 78.020 11.921 -6.309 1.00 0.00 H new ATOM 0 HA HIS B 17 76.761 14.343 -5.362 1.00 0.00 H new ATOM 0 HB2 HIS B 17 79.169 14.160 -5.991 1.00 0.00 H new ATOM 0 HB3 HIS B 17 78.722 13.795 -7.646 1.00 0.00 H new ATOM 0 HD2 HIS B 17 78.746 16.097 -9.169 1.00 0.00 H new ATOM 0 HE1 HIS B 17 77.777 18.878 -6.144 1.00 0.00 H new ATOM 0 HE2 HIS B 17 78.351 18.640 -8.627 1.00 0.00 H new ATOM 1897 N LYS B 18 75.761 13.114 -8.205 1.00 0.00 N ATOM 1898 CA LYS B 18 74.742 13.329 -9.263 1.00 0.00 C ATOM 1899 C LYS B 18 73.416 13.606 -8.567 1.00 0.00 C ATOM 1900 O LYS B 18 72.680 14.500 -8.934 1.00 0.00 O ATOM 1901 CB LYS B 18 74.638 12.073 -10.132 1.00 0.00 C ATOM 1902 CG LYS B 18 73.587 12.287 -11.230 1.00 0.00 C ATOM 1903 CD LYS B 18 73.674 11.164 -12.274 1.00 0.00 C ATOM 1904 CE LYS B 18 73.031 9.883 -11.733 1.00 0.00 C ATOM 1905 NZ LYS B 18 71.614 10.155 -11.361 1.00 0.00 N ATOM 0 H LYS B 18 76.222 12.204 -8.216 1.00 0.00 H new ATOM 0 HA LYS B 18 75.012 14.166 -9.907 1.00 0.00 H new ATOM 0 HB2 LYS B 18 75.606 11.849 -10.581 1.00 0.00 H new ATOM 0 HB3 LYS B 18 74.365 11.215 -9.517 1.00 0.00 H new ATOM 0 HG2 LYS B 18 72.590 12.308 -10.790 1.00 0.00 H new ATOM 0 HG3 LYS B 18 73.744 13.253 -11.710 1.00 0.00 H new ATOM 0 HD2 LYS B 18 73.172 11.471 -13.191 1.00 0.00 H new ATOM 0 HD3 LYS B 18 74.717 10.976 -12.529 1.00 0.00 H new ATOM 0 HE2 LYS B 18 73.076 9.096 -12.485 1.00 0.00 H new ATOM 0 HE3 LYS B 18 73.584 9.525 -10.864 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 71.018 9.356 -11.658 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 71.543 10.276 -10.331 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 71.291 11.023 -11.835 1.00 0.00 H new ATOM 1919 N TYR B 19 73.137 12.880 -7.523 1.00 0.00 N ATOM 1920 CA TYR B 19 71.892 13.139 -6.754 1.00 0.00 C ATOM 1921 C TYR B 19 72.070 14.452 -6.003 1.00 0.00 C ATOM 1922 O TYR B 19 71.153 15.232 -5.860 1.00 0.00 O ATOM 1923 CB TYR B 19 71.631 11.992 -5.774 1.00 0.00 C ATOM 1924 CG TYR B 19 71.239 10.766 -6.564 1.00 0.00 C ATOM 1925 CD1 TYR B 19 69.896 10.540 -6.884 1.00 0.00 C ATOM 1926 CD2 TYR B 19 72.223 9.873 -7.000 1.00 0.00 C ATOM 1927 CE1 TYR B 19 69.534 9.417 -7.638 1.00 0.00 C ATOM 1928 CE2 TYR B 19 71.866 8.752 -7.757 1.00 0.00 C ATOM 1929 CZ TYR B 19 70.520 8.523 -8.077 1.00 0.00 C ATOM 1930 OH TYR B 19 70.166 7.419 -8.827 1.00 0.00 O ATOM 0 H TYR B 19 73.717 12.119 -7.169 1.00 0.00 H new ATOM 0 HA TYR B 19 71.036 13.206 -7.426 1.00 0.00 H new ATOM 0 HB2 TYR B 19 72.523 11.791 -5.180 1.00 0.00 H new ATOM 0 HB3 TYR B 19 70.838 12.263 -5.077 1.00 0.00 H new ATOM 0 HD1 TYR B 19 69.138 11.232 -6.549 1.00 0.00 H new ATOM 0 HD2 TYR B 19 73.259 10.049 -6.752 1.00 0.00 H new ATOM 0 HE1 TYR B 19 68.497 9.240 -7.881 1.00 0.00 H new ATOM 0 HE2 TYR B 19 72.626 8.063 -8.095 1.00 0.00 H new ATOM 0 HH TYR B 19 69.918 6.683 -8.229 1.00 0.00 H new ATOM 1940 N SER B 20 73.254 14.700 -5.506 1.00 0.00 N ATOM 1941 CA SER B 20 73.491 15.958 -4.748 1.00 0.00 C ATOM 1942 C SER B 20 72.393 16.096 -3.700 1.00 0.00 C ATOM 1943 O SER B 20 72.191 17.145 -3.120 1.00 0.00 O ATOM 1944 CB SER B 20 73.432 17.146 -5.706 1.00 0.00 C ATOM 1945 OG SER B 20 73.659 18.347 -4.980 1.00 0.00 O ATOM 0 H SER B 20 74.063 14.086 -5.593 1.00 0.00 H new ATOM 0 HA SER B 20 74.470 15.934 -4.269 1.00 0.00 H new ATOM 0 HB2 SER B 20 74.182 17.034 -6.489 1.00 0.00 H new ATOM 0 HB3 SER B 20 72.460 17.183 -6.198 1.00 0.00 H new ATOM 0 HG SER B 20 73.149 18.325 -4.144 1.00 0.00 H new ATOM 1951 N GLY B 21 71.674 15.034 -3.471 1.00 0.00 N ATOM 1952 CA GLY B 21 70.567 15.081 -2.477 1.00 0.00 C ATOM 1953 C GLY B 21 69.461 15.979 -3.027 1.00 0.00 C ATOM 1954 O GLY B 21 69.229 17.069 -2.543 1.00 0.00 O ATOM 0 H GLY B 21 71.806 14.133 -3.931 1.00 0.00 H new ATOM 0 HA2 GLY B 21 70.183 14.078 -2.290 1.00 0.00 H new ATOM 0 HA3 GLY B 21 70.929 15.467 -1.524 1.00 0.00 H new ATOM 1958 N LYS B 22 68.793 15.535 -4.054 1.00 0.00 N ATOM 1959 CA LYS B 22 67.717 16.362 -4.663 1.00 0.00 C ATOM 1960 C LYS B 22 66.630 16.647 -3.622 1.00 0.00 C ATOM 1961 O LYS B 22 66.100 17.739 -3.555 1.00 0.00 O ATOM 1962 CB LYS B 22 67.116 15.605 -5.851 1.00 0.00 C ATOM 1963 CG LYS B 22 68.188 15.449 -6.935 1.00 0.00 C ATOM 1964 CD LYS B 22 67.589 14.810 -8.194 1.00 0.00 C ATOM 1965 CE LYS B 22 67.027 13.424 -7.868 1.00 0.00 C ATOM 1966 NZ LYS B 22 66.922 12.627 -9.123 1.00 0.00 N ATOM 0 H LYS B 22 68.947 14.630 -4.499 1.00 0.00 H new ATOM 0 HA LYS B 22 68.132 17.309 -5.007 1.00 0.00 H new ATOM 0 HB2 LYS B 22 66.758 14.626 -5.532 1.00 0.00 H new ATOM 0 HB3 LYS B 22 66.256 16.146 -6.246 1.00 0.00 H new ATOM 0 HG2 LYS B 22 68.610 16.424 -7.180 1.00 0.00 H new ATOM 0 HG3 LYS B 22 69.005 14.833 -6.561 1.00 0.00 H new ATOM 0 HD2 LYS B 22 66.799 15.446 -8.593 1.00 0.00 H new ATOM 0 HD3 LYS B 22 68.353 14.728 -8.967 1.00 0.00 H new ATOM 0 HE2 LYS B 22 67.674 12.915 -7.154 1.00 0.00 H new ATOM 0 HE3 LYS B 22 66.047 13.517 -7.400 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 66.605 11.663 -8.896 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 66.236 13.076 -9.763 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 67.852 12.585 -9.587 1.00 0.00 H new ATOM 1980 N GLU B 23 66.294 15.675 -2.809 1.00 0.00 N ATOM 1981 CA GLU B 23 65.237 15.883 -1.768 1.00 0.00 C ATOM 1982 C GLU B 23 65.896 15.996 -0.392 1.00 0.00 C ATOM 1983 O GLU B 23 66.829 15.285 -0.078 1.00 0.00 O ATOM 1984 CB GLU B 23 64.287 14.686 -1.770 1.00 0.00 C ATOM 1985 CG GLU B 23 63.059 14.995 -0.910 1.00 0.00 C ATOM 1986 CD GLU B 23 62.206 16.058 -1.605 1.00 0.00 C ATOM 1987 OE1 GLU B 23 62.360 16.222 -2.804 1.00 0.00 O ATOM 1988 OE2 GLU B 23 61.413 16.690 -0.926 1.00 0.00 O ATOM 0 H GLU B 23 66.708 14.743 -2.821 1.00 0.00 H new ATOM 0 HA GLU B 23 64.683 16.796 -1.987 1.00 0.00 H new ATOM 0 HB2 GLU B 23 63.979 14.457 -2.790 1.00 0.00 H new ATOM 0 HB3 GLU B 23 64.799 13.804 -1.385 1.00 0.00 H new ATOM 0 HG2 GLU B 23 62.474 14.089 -0.753 1.00 0.00 H new ATOM 0 HG3 GLU B 23 63.370 15.348 0.073 1.00 0.00 H new ATOM 1995 N GLY B 24 65.414 16.883 0.431 1.00 0.00 N ATOM 1996 CA GLY B 24 66.008 17.045 1.791 1.00 0.00 C ATOM 1997 C GLY B 24 67.311 17.842 1.692 1.00 0.00 C ATOM 1998 O GLY B 24 67.614 18.430 0.673 1.00 0.00 O ATOM 0 H GLY B 24 64.633 17.505 0.223 1.00 0.00 H new ATOM 0 HA2 GLY B 24 65.305 17.559 2.447 1.00 0.00 H new ATOM 0 HA3 GLY B 24 66.201 16.068 2.233 1.00 0.00 H new ATOM 2002 N ASP B 25 68.088 17.865 2.742 1.00 0.00 N ATOM 2003 CA ASP B 25 69.372 18.620 2.698 1.00 0.00 C ATOM 2004 C ASP B 25 70.257 18.043 1.598 1.00 0.00 C ATOM 2005 O ASP B 25 70.364 16.844 1.437 1.00 0.00 O ATOM 2006 CB ASP B 25 70.085 18.499 4.047 1.00 0.00 C ATOM 2007 CG ASP B 25 71.305 19.420 4.061 1.00 0.00 C ATOM 2008 OD1 ASP B 25 71.744 19.807 2.991 1.00 0.00 O ATOM 2009 OD2 ASP B 25 71.780 19.724 5.143 1.00 0.00 O ATOM 0 H ASP B 25 67.889 17.395 3.625 1.00 0.00 H new ATOM 0 HA ASP B 25 69.171 19.671 2.491 1.00 0.00 H new ATOM 0 HB2 ASP B 25 69.405 18.766 4.856 1.00 0.00 H new ATOM 0 HB3 ASP B 25 70.393 17.467 4.217 1.00 0.00 H new ATOM 2014 N LYS B 26 70.894 18.888 0.839 1.00 0.00 N ATOM 2015 CA LYS B 26 71.771 18.388 -0.250 1.00 0.00 C ATOM 2016 C LYS B 26 73.027 17.773 0.361 1.00 0.00 C ATOM 2017 O LYS B 26 73.807 17.127 -0.309 1.00 0.00 O ATOM 2018 CB LYS B 26 72.136 19.543 -1.186 1.00 0.00 C ATOM 2019 CG LYS B 26 72.941 20.600 -0.426 1.00 0.00 C ATOM 2020 CD LYS B 26 73.079 21.849 -1.301 1.00 0.00 C ATOM 2021 CE LYS B 26 74.053 22.832 -0.651 1.00 0.00 C ATOM 2022 NZ LYS B 26 73.503 23.280 0.661 1.00 0.00 N ATOM 0 H LYS B 26 70.844 19.903 0.927 1.00 0.00 H new ATOM 0 HA LYS B 26 71.249 17.626 -0.829 1.00 0.00 H new ATOM 0 HB2 LYS B 26 72.717 19.169 -2.029 1.00 0.00 H new ATOM 0 HB3 LYS B 26 71.230 19.990 -1.596 1.00 0.00 H new ATOM 0 HG2 LYS B 26 72.443 20.850 0.511 1.00 0.00 H new ATOM 0 HG3 LYS B 26 73.926 20.210 -0.169 1.00 0.00 H new ATOM 0 HD2 LYS B 26 73.436 21.572 -2.293 1.00 0.00 H new ATOM 0 HD3 LYS B 26 72.105 22.321 -1.433 1.00 0.00 H new ATOM 0 HE2 LYS B 26 75.024 22.358 -0.508 1.00 0.00 H new ATOM 0 HE3 LYS B 26 74.210 23.690 -1.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 73.518 24.319 0.707 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 72.524 22.943 0.760 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 74.083 22.891 1.432 1.00 0.00 H new ATOM 2036 N PHE B 27 73.222 17.958 1.639 1.00 0.00 N ATOM 2037 CA PHE B 27 74.426 17.374 2.307 1.00 0.00 C ATOM 2038 C PHE B 27 74.066 16.017 2.914 1.00 0.00 C ATOM 2039 O PHE B 27 74.886 15.372 3.535 1.00 0.00 O ATOM 2040 CB PHE B 27 74.880 18.293 3.443 1.00 0.00 C ATOM 2041 CG PHE B 27 75.247 19.657 2.903 1.00 0.00 C ATOM 2042 CD1 PHE B 27 76.308 19.789 1.999 1.00 0.00 C ATOM 2043 CD2 PHE B 27 74.536 20.793 3.316 1.00 0.00 C ATOM 2044 CE1 PHE B 27 76.657 21.053 1.508 1.00 0.00 C ATOM 2045 CE2 PHE B 27 74.885 22.055 2.824 1.00 0.00 C ATOM 2046 CZ PHE B 27 75.945 22.186 1.920 1.00 0.00 C ATOM 0 H PHE B 27 72.601 18.488 2.251 1.00 0.00 H new ATOM 0 HA PHE B 27 75.219 17.263 1.568 1.00 0.00 H new ATOM 0 HB2 PHE B 27 74.084 18.389 4.181 1.00 0.00 H new ATOM 0 HB3 PHE B 27 75.737 17.854 3.954 1.00 0.00 H new ATOM 0 HD1 PHE B 27 76.857 18.916 1.680 1.00 0.00 H new ATOM 0 HD2 PHE B 27 73.718 20.693 4.014 1.00 0.00 H new ATOM 0 HE1 PHE B 27 77.476 21.154 0.811 1.00 0.00 H new ATOM 0 HE2 PHE B 27 74.336 22.929 3.142 1.00 0.00 H new ATOM 0 HZ PHE B 27 76.214 23.161 1.540 1.00 0.00 H new ATOM 2056 N LYS B 28 72.838 15.589 2.773 1.00 0.00 N ATOM 2057 CA LYS B 28 72.420 14.284 3.380 1.00 0.00 C ATOM 2058 C LYS B 28 71.465 13.563 2.422 1.00 0.00 C ATOM 2059 O LYS B 28 70.863 14.180 1.566 1.00 0.00 O ATOM 2060 CB LYS B 28 71.678 14.577 4.688 1.00 0.00 C ATOM 2061 CG LYS B 28 72.598 15.336 5.646 1.00 0.00 C ATOM 2062 CD LYS B 28 71.856 15.628 6.952 1.00 0.00 C ATOM 2063 CE LYS B 28 72.780 16.402 7.894 1.00 0.00 C ATOM 2064 NZ LYS B 28 72.006 16.867 9.079 1.00 0.00 N ATOM 0 H LYS B 28 72.105 16.084 2.265 1.00 0.00 H new ATOM 0 HA LYS B 28 73.294 13.660 3.566 1.00 0.00 H new ATOM 0 HB2 LYS B 28 70.783 15.166 4.485 1.00 0.00 H new ATOM 0 HB3 LYS B 28 71.349 13.645 5.147 1.00 0.00 H new ATOM 0 HG2 LYS B 28 73.493 14.747 5.849 1.00 0.00 H new ATOM 0 HG3 LYS B 28 72.927 16.268 5.187 1.00 0.00 H new ATOM 0 HD2 LYS B 28 70.955 16.207 6.750 1.00 0.00 H new ATOM 0 HD3 LYS B 28 71.538 14.696 7.420 1.00 0.00 H new ATOM 0 HE2 LYS B 28 73.607 15.767 8.213 1.00 0.00 H new ATOM 0 HE3 LYS B 28 73.216 17.255 7.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 72.634 17.393 9.719 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 71.232 17.487 8.766 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 71.611 16.046 9.580 1.00 0.00 H new ATOM 2078 N LEU B 29 71.299 12.266 2.575 1.00 0.00 N ATOM 2079 CA LEU B 29 70.354 11.506 1.689 1.00 0.00 C ATOM 2080 C LEU B 29 69.344 10.792 2.588 1.00 0.00 C ATOM 2081 O LEU B 29 69.688 10.254 3.618 1.00 0.00 O ATOM 2082 CB LEU B 29 71.138 10.489 0.823 1.00 0.00 C ATOM 2083 CG LEU B 29 71.362 11.011 -0.609 1.00 0.00 C ATOM 2084 CD1 LEU B 29 72.272 10.023 -1.343 1.00 0.00 C ATOM 2085 CD2 LEU B 29 70.018 11.110 -1.362 1.00 0.00 C ATOM 0 H LEU B 29 71.778 11.701 3.276 1.00 0.00 H new ATOM 0 HA LEU B 29 69.834 12.183 1.011 1.00 0.00 H new ATOM 0 HB2 LEU B 29 72.101 10.281 1.289 1.00 0.00 H new ATOM 0 HB3 LEU B 29 70.592 9.546 0.785 1.00 0.00 H new ATOM 0 HG LEU B 29 71.816 12.001 -0.568 1.00 0.00 H new ATOM 0 HD11 LEU B 29 72.444 10.374 -2.361 1.00 0.00 H new ATOM 0 HD12 LEU B 29 73.225 9.948 -0.819 1.00 0.00 H new ATOM 0 HD13 LEU B 29 71.796 9.043 -1.373 1.00 0.00 H new ATOM 0 HD21 LEU B 29 70.193 11.480 -2.372 1.00 0.00 H new ATOM 0 HD22 LEU B 29 69.556 10.124 -1.412 1.00 0.00 H new ATOM 0 HD23 LEU B 29 69.355 11.795 -0.834 1.00 0.00 H new ATOM 2097 N ASN B 30 68.093 10.810 2.217 1.00 0.00 N ATOM 2098 CA ASN B 30 67.047 10.157 3.055 1.00 0.00 C ATOM 2099 C ASN B 30 66.816 8.720 2.579 1.00 0.00 C ATOM 2100 O ASN B 30 66.772 8.436 1.404 1.00 0.00 O ATOM 2101 CB ASN B 30 65.747 10.955 2.940 1.00 0.00 C ATOM 2102 CG ASN B 30 65.914 12.297 3.657 1.00 0.00 C ATOM 2103 OD1 ASN B 30 66.745 12.431 4.532 1.00 0.00 O ATOM 2104 ND2 ASN B 30 65.155 13.304 3.318 1.00 0.00 N ATOM 0 H ASN B 30 67.748 11.252 1.365 1.00 0.00 H new ATOM 0 HA ASN B 30 67.375 10.134 4.094 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.498 11.118 1.891 1.00 0.00 H new ATOM 0 HB3 ASN B 30 64.922 10.394 3.380 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.260 14.203 3.788 1.00 0.00 H new ATOM 0 HD22 ASN B 30 64.457 13.192 2.583 1.00 0.00 H new ATOM 2111 N LYS B 31 66.670 7.817 3.501 1.00 0.00 N ATOM 2112 CA LYS B 31 66.447 6.384 3.149 1.00 0.00 C ATOM 2113 C LYS B 31 65.406 6.250 2.042 1.00 0.00 C ATOM 2114 O LYS B 31 65.477 5.363 1.225 1.00 0.00 O ATOM 2115 CB LYS B 31 65.970 5.637 4.397 1.00 0.00 C ATOM 2116 CG LYS B 31 64.717 6.317 4.957 1.00 0.00 C ATOM 2117 CD LYS B 31 64.246 5.564 6.202 1.00 0.00 C ATOM 2118 CE LYS B 31 62.993 6.231 6.766 1.00 0.00 C ATOM 2119 NZ LYS B 31 62.731 5.706 8.135 1.00 0.00 N ATOM 0 H LYS B 31 66.696 8.010 4.502 1.00 0.00 H new ATOM 0 HA LYS B 31 67.383 5.958 2.788 1.00 0.00 H new ATOM 0 HB2 LYS B 31 65.752 4.598 4.150 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.758 5.627 5.150 1.00 0.00 H new ATOM 0 HG2 LYS B 31 64.934 7.356 5.207 1.00 0.00 H new ATOM 0 HG3 LYS B 31 63.928 6.328 4.205 1.00 0.00 H new ATOM 0 HD2 LYS B 31 64.034 4.525 5.951 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.035 5.556 6.954 1.00 0.00 H new ATOM 0 HE2 LYS B 31 63.125 7.312 6.798 1.00 0.00 H new ATOM 0 HE3 LYS B 31 62.139 6.033 6.118 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 61.898 6.182 8.536 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 62.554 4.682 8.086 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 63.558 5.886 8.740 1.00 0.00 H new ATOM 2133 N SER B 32 64.450 7.114 1.971 1.00 0.00 N ATOM 2134 CA SER B 32 63.459 6.969 0.873 1.00 0.00 C ATOM 2135 C SER B 32 64.219 7.063 -0.435 1.00 0.00 C ATOM 2136 O SER B 32 63.949 6.358 -1.387 1.00 0.00 O ATOM 2137 CB SER B 32 62.410 8.065 0.926 1.00 0.00 C ATOM 2138 OG SER B 32 63.049 9.334 0.965 1.00 0.00 O ATOM 0 H SER B 32 64.306 7.899 2.606 1.00 0.00 H new ATOM 0 HA SER B 32 62.942 6.014 0.970 1.00 0.00 H new ATOM 0 HB2 SER B 32 61.758 8.001 0.055 1.00 0.00 H new ATOM 0 HB3 SER B 32 61.779 7.937 1.806 1.00 0.00 H new ATOM 0 HG SER B 32 62.371 10.041 0.997 1.00 0.00 H new ATOM 2144 N GLU B 33 65.203 7.912 -0.465 1.00 0.00 N ATOM 2145 CA GLU B 33 66.033 8.039 -1.682 1.00 0.00 C ATOM 2146 C GLU B 33 66.656 6.695 -1.934 1.00 0.00 C ATOM 2147 O GLU B 33 67.037 6.385 -3.030 1.00 0.00 O ATOM 2148 CB GLU B 33 67.107 9.100 -1.481 1.00 0.00 C ATOM 2149 CG GLU B 33 66.433 10.450 -1.214 1.00 0.00 C ATOM 2150 CD GLU B 33 65.648 10.883 -2.453 1.00 0.00 C ATOM 2151 OE1 GLU B 33 65.985 10.425 -3.533 1.00 0.00 O ATOM 2152 OE2 GLU B 33 64.722 11.663 -2.302 1.00 0.00 O ATOM 0 H GLU B 33 65.467 8.525 0.306 1.00 0.00 H new ATOM 0 HA GLU B 33 65.428 8.346 -2.535 1.00 0.00 H new ATOM 0 HB2 GLU B 33 67.751 8.829 -0.645 1.00 0.00 H new ATOM 0 HB3 GLU B 33 67.742 9.165 -2.365 1.00 0.00 H new ATOM 0 HG2 GLU B 33 65.765 10.371 -0.356 1.00 0.00 H new ATOM 0 HG3 GLU B 33 67.184 11.200 -0.966 1.00 0.00 H new ATOM 2159 N LEU B 34 66.740 5.862 -0.942 1.00 0.00 N ATOM 2160 CA LEU B 34 67.320 4.524 -1.216 1.00 0.00 C ATOM 2161 C LEU B 34 66.427 3.889 -2.267 1.00 0.00 C ATOM 2162 O LEU B 34 66.892 3.287 -3.215 1.00 0.00 O ATOM 2163 CB LEU B 34 67.323 3.677 0.075 1.00 0.00 C ATOM 2164 CG LEU B 34 67.915 2.268 -0.141 1.00 0.00 C ATOM 2165 CD1 LEU B 34 66.949 1.379 -0.966 1.00 0.00 C ATOM 2166 CD2 LEU B 34 69.276 2.368 -0.842 1.00 0.00 C ATOM 0 H LEU B 34 66.443 6.039 0.018 1.00 0.00 H new ATOM 0 HA LEU B 34 68.351 4.593 -1.563 1.00 0.00 H new ATOM 0 HB2 LEU B 34 67.897 4.195 0.843 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.303 3.585 0.447 1.00 0.00 H new ATOM 0 HG LEU B 34 68.052 1.803 0.835 1.00 0.00 H new ATOM 0 HD11 LEU B 34 67.391 0.392 -1.103 1.00 0.00 H new ATOM 0 HD12 LEU B 34 66.002 1.282 -0.436 1.00 0.00 H new ATOM 0 HD13 LEU B 34 66.775 1.837 -1.940 1.00 0.00 H new ATOM 0 HD21 LEU B 34 69.684 1.368 -0.989 1.00 0.00 H new ATOM 0 HD22 LEU B 34 69.152 2.855 -1.809 1.00 0.00 H new ATOM 0 HD23 LEU B 34 69.960 2.952 -0.227 1.00 0.00 H new ATOM 2178 N LYS B 35 65.143 4.066 -2.143 1.00 0.00 N ATOM 2179 CA LYS B 35 64.241 3.500 -3.182 1.00 0.00 C ATOM 2180 C LYS B 35 64.399 4.271 -4.497 1.00 0.00 C ATOM 2181 O LYS B 35 64.595 3.688 -5.545 1.00 0.00 O ATOM 2182 CB LYS B 35 62.789 3.568 -2.683 1.00 0.00 C ATOM 2183 CG LYS B 35 61.804 3.227 -3.811 1.00 0.00 C ATOM 2184 CD LYS B 35 62.167 1.878 -4.433 1.00 0.00 C ATOM 2185 CE LYS B 35 60.989 1.349 -5.259 1.00 0.00 C ATOM 2186 NZ LYS B 35 59.992 0.708 -4.355 1.00 0.00 N ATOM 0 H LYS B 35 64.685 4.568 -1.382 1.00 0.00 H new ATOM 0 HA LYS B 35 64.505 2.459 -3.367 1.00 0.00 H new ATOM 0 HB2 LYS B 35 62.653 2.874 -1.854 1.00 0.00 H new ATOM 0 HB3 LYS B 35 62.578 4.567 -2.301 1.00 0.00 H new ATOM 0 HG2 LYS B 35 60.787 3.194 -3.419 1.00 0.00 H new ATOM 0 HG3 LYS B 35 61.827 4.006 -4.573 1.00 0.00 H new ATOM 0 HD2 LYS B 35 63.047 1.985 -5.067 1.00 0.00 H new ATOM 0 HD3 LYS B 35 62.423 1.164 -3.650 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.523 2.165 -5.810 1.00 0.00 H new ATOM 0 HE3 LYS B 35 61.343 0.628 -5.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 59.038 0.823 -4.753 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 60.209 -0.305 -4.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 60.032 1.158 -3.419 1.00 0.00 H new ATOM 2200 N GLU B 36 64.306 5.571 -4.462 1.00 0.00 N ATOM 2201 CA GLU B 36 64.445 6.349 -5.727 1.00 0.00 C ATOM 2202 C GLU B 36 65.881 6.309 -6.241 1.00 0.00 C ATOM 2203 O GLU B 36 66.117 6.207 -7.427 1.00 0.00 O ATOM 2204 CB GLU B 36 64.033 7.806 -5.496 1.00 0.00 C ATOM 2205 CG GLU B 36 64.184 8.588 -6.805 1.00 0.00 C ATOM 2206 CD GLU B 36 63.603 9.992 -6.634 1.00 0.00 C ATOM 2207 OE1 GLU B 36 63.091 10.273 -5.563 1.00 0.00 O ATOM 2208 OE2 GLU B 36 63.681 10.762 -7.576 1.00 0.00 O ATOM 0 H GLU B 36 64.141 6.125 -3.622 1.00 0.00 H new ATOM 0 HA GLU B 36 63.793 5.895 -6.473 1.00 0.00 H new ATOM 0 HB2 GLU B 36 63.001 7.853 -5.147 1.00 0.00 H new ATOM 0 HB3 GLU B 36 64.653 8.252 -4.719 1.00 0.00 H new ATOM 0 HG2 GLU B 36 65.236 8.650 -7.084 1.00 0.00 H new ATOM 0 HG3 GLU B 36 63.670 8.067 -7.613 1.00 0.00 H new ATOM 2215 N LEU B 37 66.842 6.400 -5.373 1.00 0.00 N ATOM 2216 CA LEU B 37 68.248 6.379 -5.839 1.00 0.00 C ATOM 2217 C LEU B 37 68.537 5.048 -6.492 1.00 0.00 C ATOM 2218 O LEU B 37 69.252 4.972 -7.471 1.00 0.00 O ATOM 2219 CB LEU B 37 69.212 6.600 -4.657 1.00 0.00 C ATOM 2220 CG LEU B 37 70.692 6.579 -5.144 1.00 0.00 C ATOM 2221 CD1 LEU B 37 71.510 7.658 -4.420 1.00 0.00 C ATOM 2222 CD2 LEU B 37 71.329 5.213 -4.850 1.00 0.00 C ATOM 0 H LEU B 37 66.715 6.488 -4.365 1.00 0.00 H new ATOM 0 HA LEU B 37 68.395 7.183 -6.560 1.00 0.00 H new ATOM 0 HB2 LEU B 37 68.995 7.554 -4.177 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.060 5.824 -3.907 1.00 0.00 H new ATOM 0 HG LEU B 37 70.694 6.770 -6.217 1.00 0.00 H new ATOM 0 HD11 LEU B 37 72.541 7.630 -4.772 1.00 0.00 H new ATOM 0 HD12 LEU B 37 71.083 8.639 -4.627 1.00 0.00 H new ATOM 0 HD13 LEU B 37 71.488 7.472 -3.346 1.00 0.00 H new ATOM 0 HD21 LEU B 37 72.363 5.212 -5.195 1.00 0.00 H new ATOM 0 HD22 LEU B 37 71.305 5.024 -3.777 1.00 0.00 H new ATOM 0 HD23 LEU B 37 70.772 4.433 -5.369 1.00 0.00 H new ATOM 2234 N LEU B 38 68.024 3.980 -5.950 1.00 0.00 N ATOM 2235 CA LEU B 38 68.348 2.656 -6.576 1.00 0.00 C ATOM 2236 C LEU B 38 67.631 2.474 -7.907 1.00 0.00 C ATOM 2237 O LEU B 38 68.191 1.947 -8.847 1.00 0.00 O ATOM 2238 CB LEU B 38 67.990 1.494 -5.625 1.00 0.00 C ATOM 2239 CG LEU B 38 69.178 1.158 -4.699 1.00 0.00 C ATOM 2240 CD1 LEU B 38 68.780 0.007 -3.741 1.00 0.00 C ATOM 2241 CD2 LEU B 38 70.419 0.753 -5.541 1.00 0.00 C ATOM 0 H LEU B 38 67.416 3.956 -5.131 1.00 0.00 H new ATOM 0 HA LEU B 38 69.422 2.644 -6.762 1.00 0.00 H new ATOM 0 HB2 LEU B 38 67.121 1.764 -5.025 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.716 0.614 -6.206 1.00 0.00 H new ATOM 0 HG LEU B 38 69.434 2.040 -4.111 1.00 0.00 H new ATOM 0 HD11 LEU B 38 69.620 -0.229 -3.088 1.00 0.00 H new ATOM 0 HD12 LEU B 38 67.926 0.315 -3.137 1.00 0.00 H new ATOM 0 HD13 LEU B 38 68.514 -0.875 -4.323 1.00 0.00 H new ATOM 0 HD21 LEU B 38 71.250 0.519 -4.875 1.00 0.00 H new ATOM 0 HD22 LEU B 38 70.179 -0.123 -6.144 1.00 0.00 H new ATOM 0 HD23 LEU B 38 70.700 1.578 -6.195 1.00 0.00 H new ATOM 2253 N THR B 39 66.407 2.867 -8.004 1.00 0.00 N ATOM 2254 CA THR B 39 65.696 2.665 -9.287 1.00 0.00 C ATOM 2255 C THR B 39 66.248 3.621 -10.343 1.00 0.00 C ATOM 2256 O THR B 39 66.125 3.383 -11.527 1.00 0.00 O ATOM 2257 CB THR B 39 64.196 2.907 -9.094 1.00 0.00 C ATOM 2258 OG1 THR B 39 63.797 2.395 -7.831 1.00 0.00 O ATOM 2259 CG2 THR B 39 63.433 2.181 -10.198 1.00 0.00 C ATOM 0 H THR B 39 65.868 3.315 -7.263 1.00 0.00 H new ATOM 0 HA THR B 39 65.850 1.639 -9.623 1.00 0.00 H new ATOM 0 HB THR B 39 63.983 3.975 -9.137 1.00 0.00 H new ATOM 0 HG1 THR B 39 64.021 3.042 -7.130 1.00 0.00 H new ATOM 0 HG21 THR B 39 62.363 2.347 -10.070 1.00 0.00 H new ATOM 0 HG22 THR B 39 63.746 2.564 -11.169 1.00 0.00 H new ATOM 0 HG23 THR B 39 63.644 1.113 -10.144 1.00 0.00 H new ATOM 2267 N ARG B 40 66.848 4.706 -9.928 1.00 0.00 N ATOM 2268 CA ARG B 40 67.392 5.679 -10.920 1.00 0.00 C ATOM 2269 C ARG B 40 68.864 5.380 -11.187 1.00 0.00 C ATOM 2270 O ARG B 40 69.425 5.836 -12.163 1.00 0.00 O ATOM 2271 CB ARG B 40 67.231 7.105 -10.384 1.00 0.00 C ATOM 2272 CG ARG B 40 65.741 7.472 -10.378 1.00 0.00 C ATOM 2273 CD ARG B 40 65.571 8.956 -10.051 1.00 0.00 C ATOM 2274 NE ARG B 40 66.058 9.774 -11.197 1.00 0.00 N ATOM 2275 CZ ARG B 40 65.742 11.037 -11.280 1.00 0.00 C ATOM 2276 NH1 ARG B 40 65.006 11.588 -10.354 1.00 0.00 N ATOM 2277 NH2 ARG B 40 66.161 11.749 -12.292 1.00 0.00 N ATOM 0 H ARG B 40 66.984 4.959 -8.949 1.00 0.00 H new ATOM 0 HA ARG B 40 66.840 5.587 -11.856 1.00 0.00 H new ATOM 0 HB2 ARG B 40 67.640 7.177 -9.376 1.00 0.00 H new ATOM 0 HB3 ARG B 40 67.789 7.806 -11.005 1.00 0.00 H new ATOM 0 HG2 ARG B 40 65.300 7.252 -11.350 1.00 0.00 H new ATOM 0 HG3 ARG B 40 65.211 6.866 -9.643 1.00 0.00 H new ATOM 0 HD2 ARG B 40 64.523 9.178 -9.851 1.00 0.00 H new ATOM 0 HD3 ARG B 40 66.128 9.207 -9.148 1.00 0.00 H new ATOM 0 HE ARG B 40 66.639 9.346 -11.918 1.00 0.00 H new ATOM 0 HH11 ARG B 40 64.678 11.031 -9.565 1.00 0.00 H new ATOM 0 HH12 ARG B 40 64.759 12.576 -10.419 1.00 0.00 H new ATOM 0 HH21 ARG B 40 66.735 11.317 -13.016 1.00 0.00 H new ATOM 0 HH22 ARG B 40 65.914 12.737 -12.358 1.00 0.00 H new ATOM 2291 N GLU B 41 69.496 4.602 -10.337 1.00 0.00 N ATOM 2292 CA GLU B 41 70.939 4.261 -10.558 1.00 0.00 C ATOM 2293 C GLU B 41 71.040 2.805 -10.956 1.00 0.00 C ATOM 2294 O GLU B 41 71.923 2.421 -11.697 1.00 0.00 O ATOM 2295 CB GLU B 41 71.735 4.502 -9.269 1.00 0.00 C ATOM 2296 CG GLU B 41 73.230 4.276 -9.527 1.00 0.00 C ATOM 2297 CD GLU B 41 73.755 5.341 -10.494 1.00 0.00 C ATOM 2298 OE1 GLU B 41 73.112 6.370 -10.615 1.00 0.00 O ATOM 2299 OE2 GLU B 41 74.792 5.109 -11.093 1.00 0.00 O ATOM 0 H GLU B 41 69.076 4.190 -9.503 1.00 0.00 H new ATOM 0 HA GLU B 41 71.350 4.891 -11.347 1.00 0.00 H new ATOM 0 HB2 GLU B 41 71.568 5.519 -8.913 1.00 0.00 H new ATOM 0 HB3 GLU B 41 71.387 3.829 -8.485 1.00 0.00 H new ATOM 0 HG2 GLU B 41 73.782 4.321 -8.588 1.00 0.00 H new ATOM 0 HG3 GLU B 41 73.390 3.282 -9.944 1.00 0.00 H new ATOM 2306 N LEU B 42 70.138 1.988 -10.490 1.00 0.00 N ATOM 2307 CA LEU B 42 70.176 0.543 -10.866 1.00 0.00 C ATOM 2308 C LEU B 42 68.727 0.039 -11.039 1.00 0.00 C ATOM 2309 O LEU B 42 68.121 -0.407 -10.087 1.00 0.00 O ATOM 2310 CB LEU B 42 70.859 -0.289 -9.760 1.00 0.00 C ATOM 2311 CG LEU B 42 72.285 0.209 -9.466 1.00 0.00 C ATOM 2312 CD1 LEU B 42 72.780 -0.424 -8.163 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.235 -0.199 -10.602 1.00 0.00 C ATOM 0 H LEU B 42 69.377 2.255 -9.866 1.00 0.00 H new ATOM 0 HA LEU B 42 70.740 0.433 -11.792 1.00 0.00 H new ATOM 0 HB2 LEU B 42 70.263 -0.241 -8.849 1.00 0.00 H new ATOM 0 HB3 LEU B 42 70.895 -1.335 -10.063 1.00 0.00 H new ATOM 0 HG LEU B 42 72.269 1.295 -9.380 1.00 0.00 H new ATOM 0 HD11 LEU B 42 73.790 -0.075 -7.950 1.00 0.00 H new ATOM 0 HD12 LEU B 42 72.117 -0.139 -7.346 1.00 0.00 H new ATOM 0 HD13 LEU B 42 72.785 -1.509 -8.265 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.241 0.159 -10.382 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.249 -1.285 -10.693 1.00 0.00 H new ATOM 0 HD23 LEU B 42 72.891 0.239 -11.539 1.00 0.00 H new ATOM 2325 N PRO B 43 68.151 0.125 -12.223 1.00 0.00 N ATOM 2326 CA PRO B 43 66.744 -0.330 -12.427 1.00 0.00 C ATOM 2327 C PRO B 43 66.609 -1.864 -12.572 1.00 0.00 C ATOM 2328 O PRO B 43 66.590 -2.582 -11.591 1.00 0.00 O ATOM 2329 CB PRO B 43 66.370 0.414 -13.722 1.00 0.00 C ATOM 2330 CG PRO B 43 67.681 0.768 -14.449 1.00 0.00 C ATOM 2331 CD PRO B 43 68.833 0.678 -13.428 1.00 0.00 C ATOM 0 HA PRO B 43 66.094 -0.114 -11.579 1.00 0.00 H new ATOM 0 HB2 PRO B 43 65.738 -0.210 -14.354 1.00 0.00 H new ATOM 0 HB3 PRO B 43 65.802 1.316 -13.495 1.00 0.00 H new ATOM 0 HG2 PRO B 43 67.853 0.083 -15.279 1.00 0.00 H new ATOM 0 HG3 PRO B 43 67.624 1.771 -14.871 1.00 0.00 H new ATOM 0 HD2 PRO B 43 69.634 0.026 -13.776 1.00 0.00 H new ATOM 0 HD3 PRO B 43 69.278 1.653 -13.231 1.00 0.00 H new ATOM 2339 N SER B 44 66.493 -2.369 -13.776 1.00 0.00 N ATOM 2340 CA SER B 44 66.335 -3.845 -13.964 1.00 0.00 C ATOM 2341 C SER B 44 67.580 -4.588 -13.478 1.00 0.00 C ATOM 2342 O SER B 44 67.485 -5.608 -12.832 1.00 0.00 O ATOM 2343 CB SER B 44 66.117 -4.147 -15.447 1.00 0.00 C ATOM 2344 OG SER B 44 65.985 -5.551 -15.624 1.00 0.00 O ATOM 0 H SER B 44 66.501 -1.822 -14.637 1.00 0.00 H new ATOM 0 HA SER B 44 65.476 -4.180 -13.382 1.00 0.00 H new ATOM 0 HB2 SER B 44 65.223 -3.638 -15.806 1.00 0.00 H new ATOM 0 HB3 SER B 44 66.955 -3.772 -16.034 1.00 0.00 H new ATOM 0 HG SER B 44 65.844 -5.749 -16.573 1.00 0.00 H new ATOM 2350 N PHE B 45 68.742 -4.081 -13.783 1.00 0.00 N ATOM 2351 CA PHE B 45 70.010 -4.748 -13.351 1.00 0.00 C ATOM 2352 C PHE B 45 70.011 -4.958 -11.835 1.00 0.00 C ATOM 2353 O PHE B 45 70.918 -5.535 -11.270 1.00 0.00 O ATOM 2354 CB PHE B 45 71.171 -3.836 -13.703 1.00 0.00 C ATOM 2355 CG PHE B 45 71.340 -3.797 -15.203 1.00 0.00 C ATOM 2356 CD1 PHE B 45 72.168 -4.730 -15.839 1.00 0.00 C ATOM 2357 CD2 PHE B 45 70.660 -2.835 -15.960 1.00 0.00 C ATOM 2358 CE1 PHE B 45 72.319 -4.699 -17.229 1.00 0.00 C ATOM 2359 CE2 PHE B 45 70.811 -2.804 -17.352 1.00 0.00 C ATOM 2360 CZ PHE B 45 71.640 -3.737 -17.987 1.00 0.00 C ATOM 0 H PHE B 45 68.872 -3.223 -14.319 1.00 0.00 H new ATOM 0 HA PHE B 45 70.097 -5.713 -13.850 1.00 0.00 H new ATOM 0 HB2 PHE B 45 70.988 -2.832 -13.320 1.00 0.00 H new ATOM 0 HB3 PHE B 45 72.086 -4.195 -13.232 1.00 0.00 H new ATOM 0 HD1 PHE B 45 72.690 -5.474 -15.256 1.00 0.00 H new ATOM 0 HD2 PHE B 45 70.019 -2.117 -15.470 1.00 0.00 H new ATOM 0 HE1 PHE B 45 72.960 -5.418 -17.718 1.00 0.00 H new ATOM 0 HE2 PHE B 45 70.288 -2.061 -17.936 1.00 0.00 H new ATOM 0 HZ PHE B 45 71.756 -3.715 -19.061 1.00 0.00 H new ATOM 2370 N LEU B 46 69.004 -4.470 -11.184 1.00 0.00 N ATOM 2371 CA LEU B 46 68.906 -4.591 -9.693 1.00 0.00 C ATOM 2372 C LEU B 46 67.867 -5.648 -9.363 1.00 0.00 C ATOM 2373 O LEU B 46 68.154 -6.672 -8.774 1.00 0.00 O ATOM 2374 CB LEU B 46 68.448 -3.243 -9.140 1.00 0.00 C ATOM 2375 CG LEU B 46 68.544 -3.205 -7.609 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.019 -3.237 -7.156 1.00 0.00 C ATOM 2377 CD2 LEU B 46 67.876 -1.912 -7.113 1.00 0.00 C ATOM 0 H LEU B 46 68.223 -3.981 -11.622 1.00 0.00 H new ATOM 0 HA LEU B 46 69.866 -4.870 -9.259 1.00 0.00 H new ATOM 0 HB2 LEU B 46 69.060 -2.447 -9.564 1.00 0.00 H new ATOM 0 HB3 LEU B 46 67.419 -3.053 -9.447 1.00 0.00 H new ATOM 0 HG LEU B 46 68.041 -4.077 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.066 -3.209 -6.067 1.00 0.00 H new ATOM 0 HD12 LEU B 46 70.491 -4.151 -7.516 1.00 0.00 H new ATOM 0 HD13 LEU B 46 70.544 -2.373 -7.564 1.00 0.00 H new ATOM 0 HD21 LEU B 46 67.934 -1.867 -6.025 1.00 0.00 H new ATOM 0 HD22 LEU B 46 68.389 -1.050 -7.540 1.00 0.00 H new ATOM 0 HD23 LEU B 46 66.831 -1.901 -7.421 1.00 0.00 H new ATOM 2389 N GLY B 47 66.667 -5.414 -9.793 1.00 0.00 N ATOM 2390 CA GLY B 47 65.577 -6.399 -9.579 1.00 0.00 C ATOM 2391 C GLY B 47 65.636 -7.323 -10.774 1.00 0.00 C ATOM 2392 O GLY B 47 64.659 -7.914 -11.191 1.00 0.00 O ATOM 0 H GLY B 47 66.388 -4.569 -10.292 1.00 0.00 H new ATOM 0 HA2 GLY B 47 65.720 -6.949 -8.649 1.00 0.00 H new ATOM 0 HA3 GLY B 47 64.608 -5.905 -9.511 1.00 0.00 H new ATOM 2396 N LYS B 48 66.799 -7.398 -11.353 1.00 0.00 N ATOM 2397 CA LYS B 48 66.992 -8.220 -12.563 1.00 0.00 C ATOM 2398 C LYS B 48 66.424 -9.626 -12.344 1.00 0.00 C ATOM 2399 O LYS B 48 65.680 -10.139 -13.156 1.00 0.00 O ATOM 2400 CB LYS B 48 68.485 -8.342 -12.840 1.00 0.00 C ATOM 2401 CG LYS B 48 68.696 -8.969 -14.211 1.00 0.00 C ATOM 2402 CD LYS B 48 70.183 -8.933 -14.536 1.00 0.00 C ATOM 2403 CE LYS B 48 70.423 -9.558 -15.912 1.00 0.00 C ATOM 2404 NZ LYS B 48 70.031 -10.996 -15.878 1.00 0.00 N ATOM 0 H LYS B 48 67.636 -6.913 -11.028 1.00 0.00 H new ATOM 0 HA LYS B 48 66.479 -7.748 -13.401 1.00 0.00 H new ATOM 0 HB2 LYS B 48 68.955 -7.359 -12.801 1.00 0.00 H new ATOM 0 HB3 LYS B 48 68.960 -8.952 -12.072 1.00 0.00 H new ATOM 0 HG2 LYS B 48 68.332 -9.996 -14.218 1.00 0.00 H new ATOM 0 HG3 LYS B 48 68.130 -8.425 -14.967 1.00 0.00 H new ATOM 0 HD2 LYS B 48 70.543 -7.904 -14.525 1.00 0.00 H new ATOM 0 HD3 LYS B 48 70.745 -9.476 -13.776 1.00 0.00 H new ATOM 0 HE2 LYS B 48 69.844 -9.030 -16.670 1.00 0.00 H new ATOM 0 HE3 LYS B 48 71.473 -9.462 -16.189 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 70.779 -11.570 -16.316 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 69.897 -11.296 -14.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 69.143 -11.126 -16.403 1.00 0.00 H new ATOM 2418 N ARG B 49 66.778 -10.253 -11.255 1.00 0.00 N ATOM 2419 CA ARG B 49 66.273 -11.631 -10.982 1.00 0.00 C ATOM 2420 C ARG B 49 64.834 -11.577 -10.470 1.00 0.00 C ATOM 2421 O ARG B 49 64.364 -10.559 -10.002 1.00 0.00 O ATOM 2422 CB ARG B 49 67.164 -12.314 -9.942 1.00 0.00 C ATOM 2423 CG ARG B 49 68.531 -12.626 -10.552 1.00 0.00 C ATOM 2424 CD ARG B 49 69.407 -13.313 -9.500 1.00 0.00 C ATOM 2425 NE ARG B 49 70.814 -13.448 -10.005 1.00 0.00 N ATOM 2426 CZ ARG B 49 71.092 -14.080 -11.116 1.00 0.00 C ATOM 2427 NH1 ARG B 49 70.175 -14.768 -11.738 1.00 0.00 N ATOM 2428 NH2 ARG B 49 72.313 -14.070 -11.577 1.00 0.00 N ATOM 0 H ARG B 49 67.397 -9.870 -10.540 1.00 0.00 H new ATOM 0 HA ARG B 49 66.296 -12.202 -11.910 1.00 0.00 H new ATOM 0 HB2 ARG B 49 67.283 -11.668 -9.072 1.00 0.00 H new ATOM 0 HB3 ARG B 49 66.693 -13.233 -9.594 1.00 0.00 H new ATOM 0 HG2 ARG B 49 68.415 -13.271 -11.423 1.00 0.00 H new ATOM 0 HG3 ARG B 49 69.007 -11.708 -10.896 1.00 0.00 H new ATOM 0 HD2 ARG B 49 69.399 -12.735 -8.576 1.00 0.00 H new ATOM 0 HD3 ARG B 49 69.001 -14.297 -9.265 1.00 0.00 H new ATOM 0 HE ARG B 49 71.575 -13.035 -9.466 1.00 0.00 H new ATOM 0 HH11 ARG B 49 69.229 -14.817 -11.359 1.00 0.00 H new ATOM 0 HH12 ARG B 49 70.403 -15.257 -12.604 1.00 0.00 H new ATOM 0 HH21 ARG B 49 73.045 -13.571 -11.071 1.00 0.00 H new ATOM 0 HH22 ARG B 49 72.535 -14.561 -12.443 1.00 0.00 H new ATOM 2442 N THR B 50 64.129 -12.673 -10.568 1.00 0.00 N ATOM 2443 CA THR B 50 62.715 -12.703 -10.101 1.00 0.00 C ATOM 2444 C THR B 50 62.679 -12.618 -8.573 1.00 0.00 C ATOM 2445 O THR B 50 61.637 -12.430 -7.978 1.00 0.00 O ATOM 2446 CB THR B 50 62.058 -14.011 -10.560 1.00 0.00 C ATOM 2447 OG1 THR B 50 62.190 -14.136 -11.970 1.00 0.00 O ATOM 2448 CG2 THR B 50 60.571 -14.011 -10.183 1.00 0.00 C ATOM 0 H THR B 50 64.475 -13.552 -10.953 1.00 0.00 H new ATOM 0 HA THR B 50 62.173 -11.856 -10.521 1.00 0.00 H new ATOM 0 HB THR B 50 62.550 -14.851 -10.069 1.00 0.00 H new ATOM 0 HG1 THR B 50 61.772 -14.972 -12.265 1.00 0.00 H new ATOM 0 HG21 THR B 50 60.112 -14.943 -10.513 1.00 0.00 H new ATOM 0 HG22 THR B 50 60.470 -13.919 -9.102 1.00 0.00 H new ATOM 0 HG23 THR B 50 60.073 -13.171 -10.667 1.00 0.00 H new ATOM 2456 N ASP B 51 63.808 -12.748 -7.935 1.00 0.00 N ATOM 2457 CA ASP B 51 63.840 -12.667 -6.447 1.00 0.00 C ATOM 2458 C ASP B 51 63.647 -11.211 -6.017 1.00 0.00 C ATOM 2459 O ASP B 51 64.242 -10.749 -5.063 1.00 0.00 O ATOM 2460 CB ASP B 51 65.191 -13.176 -5.941 1.00 0.00 C ATOM 2461 CG ASP B 51 66.298 -12.235 -6.421 1.00 0.00 C ATOM 2462 OD1 ASP B 51 65.990 -11.338 -7.187 1.00 0.00 O ATOM 2463 OD2 ASP B 51 67.431 -12.423 -6.010 1.00 0.00 O ATOM 0 H ASP B 51 64.712 -12.907 -8.380 1.00 0.00 H new ATOM 0 HA ASP B 51 63.042 -13.279 -6.028 1.00 0.00 H new ATOM 0 HB2 ASP B 51 65.189 -13.228 -4.852 1.00 0.00 H new ATOM 0 HB3 ASP B 51 65.372 -14.186 -6.308 1.00 0.00 H new ATOM 2468 N GLU B 52 62.825 -10.484 -6.723 1.00 0.00 N ATOM 2469 CA GLU B 52 62.595 -9.052 -6.371 1.00 0.00 C ATOM 2470 C GLU B 52 62.124 -8.939 -4.921 1.00 0.00 C ATOM 2471 O GLU B 52 62.212 -7.896 -4.307 1.00 0.00 O ATOM 2472 CB GLU B 52 61.532 -8.462 -7.301 1.00 0.00 C ATOM 2473 CG GLU B 52 60.204 -9.209 -7.141 1.00 0.00 C ATOM 2474 CD GLU B 52 59.168 -8.594 -8.084 1.00 0.00 C ATOM 2475 OE1 GLU B 52 59.396 -7.485 -8.541 1.00 0.00 O ATOM 2476 OE2 GLU B 52 58.164 -9.240 -8.334 1.00 0.00 O ATOM 0 H GLU B 52 62.301 -10.820 -7.531 1.00 0.00 H new ATOM 0 HA GLU B 52 63.529 -8.502 -6.487 1.00 0.00 H new ATOM 0 HB2 GLU B 52 61.391 -7.405 -7.077 1.00 0.00 H new ATOM 0 HB3 GLU B 52 61.870 -8.526 -8.335 1.00 0.00 H new ATOM 0 HG2 GLU B 52 60.338 -10.267 -7.367 1.00 0.00 H new ATOM 0 HG3 GLU B 52 59.858 -9.145 -6.109 1.00 0.00 H new ATOM 2483 N ALA B 53 61.621 -10.003 -4.372 1.00 0.00 N ATOM 2484 CA ALA B 53 61.142 -9.957 -2.962 1.00 0.00 C ATOM 2485 C ALA B 53 62.264 -9.430 -2.065 1.00 0.00 C ATOM 2486 O ALA B 53 62.032 -8.680 -1.139 1.00 0.00 O ATOM 2487 CB ALA B 53 60.748 -11.363 -2.509 1.00 0.00 C ATOM 0 H ALA B 53 61.519 -10.905 -4.836 1.00 0.00 H new ATOM 0 HA ALA B 53 60.276 -9.299 -2.893 1.00 0.00 H new ATOM 0 HB1 ALA B 53 60.398 -11.328 -1.477 1.00 0.00 H new ATOM 0 HB2 ALA B 53 59.952 -11.742 -3.150 1.00 0.00 H new ATOM 0 HB3 ALA B 53 61.613 -12.023 -2.576 1.00 0.00 H new ATOM 2493 N ALA B 54 63.480 -9.813 -2.330 1.00 0.00 N ATOM 2494 CA ALA B 54 64.610 -9.327 -1.490 1.00 0.00 C ATOM 2495 C ALA B 54 64.676 -7.805 -1.562 1.00 0.00 C ATOM 2496 O ALA B 54 64.875 -7.130 -0.573 1.00 0.00 O ATOM 2497 CB ALA B 54 65.913 -9.897 -2.030 1.00 0.00 C ATOM 0 H ALA B 54 63.741 -10.441 -3.090 1.00 0.00 H new ATOM 0 HA ALA B 54 64.459 -9.644 -0.458 1.00 0.00 H new ATOM 0 HB1 ALA B 54 66.745 -9.545 -1.420 1.00 0.00 H new ATOM 0 HB2 ALA B 54 65.875 -10.986 -1.998 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.055 -9.569 -3.060 1.00 0.00 H new ATOM 2503 N PHE B 55 64.493 -7.258 -2.724 1.00 0.00 N ATOM 2504 CA PHE B 55 64.524 -5.781 -2.856 1.00 0.00 C ATOM 2505 C PHE B 55 63.434 -5.188 -1.980 1.00 0.00 C ATOM 2506 O PHE B 55 63.617 -4.183 -1.321 1.00 0.00 O ATOM 2507 CB PHE B 55 64.239 -5.414 -4.300 1.00 0.00 C ATOM 2508 CG PHE B 55 64.190 -3.915 -4.440 1.00 0.00 C ATOM 2509 CD1 PHE B 55 65.357 -3.193 -4.702 1.00 0.00 C ATOM 2510 CD2 PHE B 55 62.969 -3.246 -4.295 1.00 0.00 C ATOM 2511 CE1 PHE B 55 65.304 -1.799 -4.823 1.00 0.00 C ATOM 2512 CE2 PHE B 55 62.917 -1.853 -4.415 1.00 0.00 C ATOM 2513 CZ PHE B 55 64.084 -1.132 -4.678 1.00 0.00 C ATOM 0 H PHE B 55 64.323 -7.770 -3.590 1.00 0.00 H new ATOM 0 HA PHE B 55 65.499 -5.398 -2.555 1.00 0.00 H new ATOM 0 HB2 PHE B 55 65.012 -5.825 -4.950 1.00 0.00 H new ATOM 0 HB3 PHE B 55 63.292 -5.850 -4.616 1.00 0.00 H new ATOM 0 HD1 PHE B 55 66.299 -3.710 -4.811 1.00 0.00 H new ATOM 0 HD2 PHE B 55 62.068 -3.805 -4.091 1.00 0.00 H new ATOM 0 HE1 PHE B 55 66.205 -1.240 -5.028 1.00 0.00 H new ATOM 0 HE2 PHE B 55 61.975 -1.336 -4.304 1.00 0.00 H new ATOM 0 HZ PHE B 55 64.044 -0.057 -4.770 1.00 0.00 H new ATOM 2523 N GLN B 56 62.298 -5.817 -1.967 1.00 0.00 N ATOM 2524 CA GLN B 56 61.179 -5.312 -1.132 1.00 0.00 C ATOM 2525 C GLN B 56 61.619 -5.356 0.316 1.00 0.00 C ATOM 2526 O GLN B 56 61.271 -4.511 1.115 1.00 0.00 O ATOM 2527 CB GLN B 56 59.937 -6.186 -1.327 1.00 0.00 C ATOM 2528 CG GLN B 56 59.368 -5.963 -2.729 1.00 0.00 C ATOM 2529 CD GLN B 56 58.287 -7.010 -3.009 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.222 -8.026 -2.346 1.00 0.00 O ATOM 2531 NE2 GLN B 56 57.434 -6.805 -3.974 1.00 0.00 N ATOM 0 H GLN B 56 62.095 -6.662 -2.500 1.00 0.00 H new ATOM 0 HA GLN B 56 60.926 -4.292 -1.421 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.194 -7.236 -1.191 1.00 0.00 H new ATOM 0 HB3 GLN B 56 59.186 -5.941 -0.576 1.00 0.00 H new ATOM 0 HG2 GLN B 56 58.948 -4.960 -2.808 1.00 0.00 H new ATOM 0 HG3 GLN B 56 60.162 -6.036 -3.472 1.00 0.00 H new ATOM 0 HE21 GLN B 56 57.489 -5.952 -4.530 1.00 0.00 H new ATOM 0 HE22 GLN B 56 56.712 -7.498 -4.172 1.00 0.00 H new ATOM 2540 N LYS B 57 62.409 -6.328 0.649 1.00 0.00 N ATOM 2541 CA LYS B 57 62.908 -6.421 2.045 1.00 0.00 C ATOM 2542 C LYS B 57 63.881 -5.276 2.241 1.00 0.00 C ATOM 2543 O LYS B 57 63.887 -4.609 3.255 1.00 0.00 O ATOM 2544 CB LYS B 57 63.605 -7.767 2.299 1.00 0.00 C ATOM 2545 CG LYS B 57 62.580 -8.913 2.206 1.00 0.00 C ATOM 2546 CD LYS B 57 63.112 -10.180 2.903 1.00 0.00 C ATOM 2547 CE LYS B 57 64.190 -10.856 2.046 1.00 0.00 C ATOM 2548 NZ LYS B 57 63.566 -11.434 0.822 1.00 0.00 N ATOM 0 H LYS B 57 62.732 -7.062 0.019 1.00 0.00 H new ATOM 0 HA LYS B 57 62.079 -6.358 2.749 1.00 0.00 H new ATOM 0 HB2 LYS B 57 64.400 -7.918 1.569 1.00 0.00 H new ATOM 0 HB3 LYS B 57 64.073 -7.764 3.284 1.00 0.00 H new ATOM 0 HG2 LYS B 57 61.641 -8.606 2.667 1.00 0.00 H new ATOM 0 HG3 LYS B 57 62.365 -9.131 1.160 1.00 0.00 H new ATOM 0 HD2 LYS B 57 63.525 -9.919 3.877 1.00 0.00 H new ATOM 0 HD3 LYS B 57 62.292 -10.876 3.080 1.00 0.00 H new ATOM 0 HE2 LYS B 57 64.956 -10.131 1.769 1.00 0.00 H new ATOM 0 HE3 LYS B 57 64.686 -11.640 2.619 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 64.306 -11.832 0.210 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 62.900 -12.185 1.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 63.055 -10.688 0.307 1.00 0.00 H new ATOM 2562 N LEU B 58 64.674 -5.012 1.246 1.00 0.00 N ATOM 2563 CA LEU B 58 65.606 -3.871 1.346 1.00 0.00 C ATOM 2564 C LEU B 58 64.730 -2.634 1.402 1.00 0.00 C ATOM 2565 O LEU B 58 64.914 -1.754 2.210 1.00 0.00 O ATOM 2566 CB LEU B 58 66.520 -3.831 0.118 1.00 0.00 C ATOM 2567 CG LEU B 58 67.488 -2.646 0.222 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.391 -2.794 1.460 1.00 0.00 C ATOM 2569 CD2 LEU B 58 68.347 -2.587 -1.047 1.00 0.00 C ATOM 0 H LEU B 58 64.715 -5.537 0.372 1.00 0.00 H new ATOM 0 HA LEU B 58 66.250 -3.944 2.222 1.00 0.00 H new ATOM 0 HB2 LEU B 58 67.080 -4.763 0.041 1.00 0.00 H new ATOM 0 HB3 LEU B 58 65.921 -3.743 -0.788 1.00 0.00 H new ATOM 0 HG LEU B 58 66.916 -1.724 0.323 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.071 -1.944 1.518 1.00 0.00 H new ATOM 0 HD12 LEU B 58 67.774 -2.827 2.358 1.00 0.00 H new ATOM 0 HD13 LEU B 58 68.968 -3.716 1.382 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.038 -1.747 -0.980 1.00 0.00 H new ATOM 0 HD22 LEU B 58 68.912 -3.514 -1.147 1.00 0.00 H new ATOM 0 HD23 LEU B 58 67.703 -2.459 -1.917 1.00 0.00 H new ATOM 2581 N MET B 59 63.732 -2.598 0.568 1.00 0.00 N ATOM 2582 CA MET B 59 62.794 -1.452 0.602 1.00 0.00 C ATOM 2583 C MET B 59 62.156 -1.440 1.978 1.00 0.00 C ATOM 2584 O MET B 59 61.980 -0.412 2.591 1.00 0.00 O ATOM 2585 CB MET B 59 61.716 -1.629 -0.474 1.00 0.00 C ATOM 2586 CG MET B 59 60.992 -0.306 -0.717 1.00 0.00 C ATOM 2587 SD MET B 59 59.901 0.056 0.682 1.00 0.00 S ATOM 2588 CE MET B 59 58.433 -0.793 0.049 1.00 0.00 C ATOM 0 H MET B 59 63.528 -3.311 -0.132 1.00 0.00 H new ATOM 0 HA MET B 59 63.316 -0.515 0.408 1.00 0.00 H new ATOM 0 HB2 MET B 59 62.171 -1.979 -1.401 1.00 0.00 H new ATOM 0 HB3 MET B 59 61.002 -2.391 -0.162 1.00 0.00 H new ATOM 0 HG2 MET B 59 61.716 0.499 -0.844 1.00 0.00 H new ATOM 0 HG3 MET B 59 60.412 -0.361 -1.638 1.00 0.00 H new ATOM 0 HE1 MET B 59 57.619 -0.696 0.767 1.00 0.00 H new ATOM 0 HE2 MET B 59 58.135 -0.347 -0.900 1.00 0.00 H new ATOM 0 HE3 MET B 59 58.660 -1.848 -0.102 1.00 0.00 H new ATOM 2598 N SER B 60 61.840 -2.591 2.481 1.00 0.00 N ATOM 2599 CA SER B 60 61.244 -2.652 3.846 1.00 0.00 C ATOM 2600 C SER B 60 62.263 -2.093 4.831 1.00 0.00 C ATOM 2601 O SER B 60 61.921 -1.643 5.906 1.00 0.00 O ATOM 2602 CB SER B 60 60.913 -4.096 4.218 1.00 0.00 C ATOM 2603 OG SER B 60 60.149 -4.690 3.177 1.00 0.00 O ATOM 0 H SER B 60 61.965 -3.490 2.015 1.00 0.00 H new ATOM 0 HA SER B 60 60.322 -2.071 3.874 1.00 0.00 H new ATOM 0 HB2 SER B 60 61.831 -4.661 4.378 1.00 0.00 H new ATOM 0 HB3 SER B 60 60.355 -4.123 5.154 1.00 0.00 H new ATOM 0 HG SER B 60 60.724 -4.851 2.400 1.00 0.00 H new ATOM 2609 N ASN B 61 63.518 -2.108 4.468 1.00 0.00 N ATOM 2610 CA ASN B 61 64.549 -1.563 5.395 1.00 0.00 C ATOM 2611 C ASN B 61 64.274 -0.078 5.558 1.00 0.00 C ATOM 2612 O ASN B 61 64.470 0.496 6.608 1.00 0.00 O ATOM 2613 CB ASN B 61 65.957 -1.769 4.831 1.00 0.00 C ATOM 2614 CG ASN B 61 66.988 -1.493 5.928 1.00 0.00 C ATOM 2615 OD1 ASN B 61 66.727 -0.752 6.851 1.00 0.00 O ATOM 2616 ND2 ASN B 61 68.162 -2.061 5.860 1.00 0.00 N ATOM 0 H ASN B 61 63.870 -2.469 3.581 1.00 0.00 H new ATOM 0 HA ASN B 61 64.498 -2.080 6.353 1.00 0.00 H new ATOM 0 HB2 ASN B 61 66.067 -2.788 4.461 1.00 0.00 H new ATOM 0 HB3 ASN B 61 66.123 -1.103 3.984 1.00 0.00 H new ATOM 0 HD21 ASN B 61 68.858 -1.881 6.583 1.00 0.00 H new ATOM 0 HD22 ASN B 61 68.383 -2.685 5.084 1.00 0.00 H new ATOM 2623 N LEU B 62 63.781 0.545 4.530 1.00 0.00 N ATOM 2624 CA LEU B 62 63.452 1.982 4.647 1.00 0.00 C ATOM 2625 C LEU B 62 62.413 2.077 5.756 1.00 0.00 C ATOM 2626 O LEU B 62 62.402 2.985 6.562 1.00 0.00 O ATOM 2627 CB LEU B 62 62.876 2.512 3.328 1.00 0.00 C ATOM 2628 CG LEU B 62 63.985 2.658 2.265 1.00 0.00 C ATOM 2629 CD1 LEU B 62 64.941 1.459 2.272 1.00 0.00 C ATOM 2630 CD2 LEU B 62 63.341 2.779 0.881 1.00 0.00 C ATOM 0 H LEU B 62 63.593 0.123 3.621 1.00 0.00 H new ATOM 0 HA LEU B 62 64.336 2.579 4.870 1.00 0.00 H new ATOM 0 HB2 LEU B 62 62.104 1.833 2.964 1.00 0.00 H new ATOM 0 HB3 LEU B 62 62.398 3.477 3.496 1.00 0.00 H new ATOM 0 HG LEU B 62 64.563 3.552 2.501 1.00 0.00 H new ATOM 0 HD11 LEU B 62 65.707 1.600 1.510 1.00 0.00 H new ATOM 0 HD12 LEU B 62 65.414 1.376 3.251 1.00 0.00 H new ATOM 0 HD13 LEU B 62 64.382 0.547 2.061 1.00 0.00 H new ATOM 0 HD21 LEU B 62 64.120 2.883 0.125 1.00 0.00 H new ATOM 0 HD22 LEU B 62 62.751 1.886 0.675 1.00 0.00 H new ATOM 0 HD23 LEU B 62 62.693 3.655 0.857 1.00 0.00 H new ATOM 2642 N ASP B 63 61.556 1.094 5.806 1.00 0.00 N ATOM 2643 CA ASP B 63 60.515 1.039 6.863 1.00 0.00 C ATOM 2644 C ASP B 63 61.128 0.381 8.106 1.00 0.00 C ATOM 2645 O ASP B 63 60.431 -0.050 9.002 1.00 0.00 O ATOM 2646 CB ASP B 63 59.332 0.197 6.377 1.00 0.00 C ATOM 2647 CG ASP B 63 58.584 0.947 5.272 1.00 0.00 C ATOM 2648 OD1 ASP B 63 58.401 2.144 5.413 1.00 0.00 O ATOM 2649 OD2 ASP B 63 58.210 0.309 4.300 1.00 0.00 O ATOM 0 H ASP B 63 61.536 0.316 5.147 1.00 0.00 H new ATOM 0 HA ASP B 63 60.165 2.044 7.097 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.686 -0.763 6.002 1.00 0.00 H new ATOM 0 HB3 ASP B 63 58.658 -0.014 7.207 1.00 0.00 H new ATOM 2654 N SER B 64 62.435 0.270 8.142 1.00 0.00 N ATOM 2655 CA SER B 64 63.109 -0.398 9.298 1.00 0.00 C ATOM 2656 C SER B 64 62.772 0.288 10.625 1.00 0.00 C ATOM 2657 O SER B 64 62.186 -0.311 11.504 1.00 0.00 O ATOM 2658 CB SER B 64 64.626 -0.342 9.123 1.00 0.00 C ATOM 2659 OG SER B 64 65.249 -0.766 10.327 1.00 0.00 O ATOM 0 H SER B 64 63.065 0.615 7.417 1.00 0.00 H new ATOM 0 HA SER B 64 62.753 -1.428 9.321 1.00 0.00 H new ATOM 0 HB2 SER B 64 64.933 -0.982 8.295 1.00 0.00 H new ATOM 0 HB3 SER B 64 64.939 0.672 8.875 1.00 0.00 H new ATOM 0 HG SER B 64 66.223 -0.734 10.221 1.00 0.00 H new ATOM 2665 N ASN B 65 63.164 1.529 10.799 1.00 0.00 N ATOM 2666 CA ASN B 65 62.888 2.211 12.101 1.00 0.00 C ATOM 2667 C ASN B 65 62.894 3.738 11.940 1.00 0.00 C ATOM 2668 O ASN B 65 62.736 4.268 10.858 1.00 0.00 O ATOM 2669 CB ASN B 65 63.967 1.801 13.110 1.00 0.00 C ATOM 2670 CG ASN B 65 63.814 0.317 13.447 1.00 0.00 C ATOM 2671 OD1 ASN B 65 62.779 -0.105 13.922 1.00 0.00 O ATOM 2672 ND2 ASN B 65 64.804 -0.501 13.213 1.00 0.00 N ATOM 0 H ASN B 65 63.656 2.091 10.105 1.00 0.00 H new ATOM 0 HA ASN B 65 61.901 1.911 12.452 1.00 0.00 H new ATOM 0 HB2 ASN B 65 64.957 1.990 12.696 1.00 0.00 H new ATOM 0 HB3 ASN B 65 63.880 2.401 14.016 1.00 0.00 H new ATOM 0 HD21 ASN B 65 64.708 -1.493 13.429 1.00 0.00 H new ATOM 0 HD22 ASN B 65 65.674 -0.148 12.814 1.00 0.00 H new ATOM 2679 N ARG B 66 63.052 4.440 13.034 1.00 0.00 N ATOM 2680 CA ARG B 66 63.044 5.933 13.012 1.00 0.00 C ATOM 2681 C ARG B 66 64.161 6.488 12.119 1.00 0.00 C ATOM 2682 O ARG B 66 63.973 7.485 11.452 1.00 0.00 O ATOM 2683 CB ARG B 66 63.237 6.454 14.437 1.00 0.00 C ATOM 2684 CG ARG B 66 63.132 7.981 14.442 1.00 0.00 C ATOM 2685 CD ARG B 66 63.171 8.494 15.883 1.00 0.00 C ATOM 2686 NE ARG B 66 64.516 8.240 16.472 1.00 0.00 N ATOM 2687 CZ ARG B 66 64.879 8.872 17.554 1.00 0.00 C ATOM 2688 NH1 ARG B 66 64.066 9.725 18.115 1.00 0.00 N ATOM 2689 NH2 ARG B 66 66.055 8.652 18.074 1.00 0.00 N ATOM 0 H ARG B 66 63.189 4.032 13.959 1.00 0.00 H new ATOM 0 HA ARG B 66 62.088 6.264 12.607 1.00 0.00 H new ATOM 0 HB2 ARG B 66 62.483 6.025 15.097 1.00 0.00 H new ATOM 0 HB3 ARG B 66 64.210 6.145 14.820 1.00 0.00 H new ATOM 0 HG2 ARG B 66 63.952 8.414 13.869 1.00 0.00 H new ATOM 0 HG3 ARG B 66 62.206 8.293 13.959 1.00 0.00 H new ATOM 0 HD2 ARG B 66 62.950 9.561 15.905 1.00 0.00 H new ATOM 0 HD3 ARG B 66 62.404 7.997 16.477 1.00 0.00 H new ATOM 0 HE ARG B 66 65.151 7.574 16.031 1.00 0.00 H new ATOM 0 HH11 ARG B 66 63.147 9.897 17.707 1.00 0.00 H new ATOM 0 HH12 ARG B 66 64.350 10.219 18.961 1.00 0.00 H new ATOM 0 HH21 ARG B 66 66.690 7.986 17.635 1.00 0.00 H new ATOM 0 HH22 ARG B 66 66.339 9.146 18.920 1.00 0.00 H new ATOM 2703 N ASP B 67 65.324 5.880 12.119 1.00 0.00 N ATOM 2704 CA ASP B 67 66.453 6.408 11.280 1.00 0.00 C ATOM 2705 C ASP B 67 65.923 6.846 9.910 1.00 0.00 C ATOM 2706 O ASP B 67 65.262 6.095 9.224 1.00 0.00 O ATOM 2707 CB ASP B 67 67.502 5.310 11.088 1.00 0.00 C ATOM 2708 CG ASP B 67 68.727 5.892 10.379 1.00 0.00 C ATOM 2709 OD1 ASP B 67 68.592 6.937 9.764 1.00 0.00 O ATOM 2710 OD2 ASP B 67 69.781 5.282 10.461 1.00 0.00 O ATOM 0 H ASP B 67 65.542 5.044 12.661 1.00 0.00 H new ATOM 0 HA ASP B 67 66.903 7.264 11.783 1.00 0.00 H new ATOM 0 HB2 ASP B 67 67.791 4.895 12.054 1.00 0.00 H new ATOM 0 HB3 ASP B 67 67.084 4.492 10.502 1.00 0.00 H new ATOM 2715 N ASN B 68 66.191 8.073 9.524 1.00 0.00 N ATOM 2716 CA ASN B 68 65.687 8.591 8.211 1.00 0.00 C ATOM 2717 C ASN B 68 66.811 9.295 7.444 1.00 0.00 C ATOM 2718 O ASN B 68 66.554 10.063 6.539 1.00 0.00 O ATOM 2719 CB ASN B 68 64.553 9.589 8.480 1.00 0.00 C ATOM 2720 CG ASN B 68 64.018 10.139 7.155 1.00 0.00 C ATOM 2721 OD1 ASN B 68 63.908 9.419 6.183 1.00 0.00 O ATOM 2722 ND2 ASN B 68 63.678 11.398 7.075 1.00 0.00 N ATOM 0 H ASN B 68 66.740 8.741 10.066 1.00 0.00 H new ATOM 0 HA ASN B 68 65.326 7.757 7.610 1.00 0.00 H new ATOM 0 HB2 ASN B 68 63.750 9.100 9.032 1.00 0.00 H new ATOM 0 HB3 ASN B 68 64.916 10.406 9.103 1.00 0.00 H new ATOM 0 HD21 ASN B 68 63.321 11.775 6.197 1.00 0.00 H new ATOM 0 HD22 ASN B 68 63.770 12.004 7.890 1.00 0.00 H new ATOM 2729 N GLU B 69 68.054 9.050 7.795 1.00 0.00 N ATOM 2730 CA GLU B 69 69.192 9.720 7.077 1.00 0.00 C ATOM 2731 C GLU B 69 70.158 8.685 6.510 1.00 0.00 C ATOM 2732 O GLU B 69 70.388 7.636 7.076 1.00 0.00 O ATOM 2733 CB GLU B 69 69.951 10.636 8.042 1.00 0.00 C ATOM 2734 CG GLU B 69 71.104 11.330 7.311 1.00 0.00 C ATOM 2735 CD GLU B 69 71.845 12.248 8.284 1.00 0.00 C ATOM 2736 OE1 GLU B 69 71.344 12.448 9.378 1.00 0.00 O ATOM 2737 OE2 GLU B 69 72.903 12.735 7.919 1.00 0.00 O ATOM 0 H GLU B 69 68.330 8.417 8.546 1.00 0.00 H new ATOM 0 HA GLU B 69 68.778 10.307 6.257 1.00 0.00 H new ATOM 0 HB2 GLU B 69 69.273 11.381 8.458 1.00 0.00 H new ATOM 0 HB3 GLU B 69 70.338 10.055 8.879 1.00 0.00 H new ATOM 0 HG2 GLU B 69 71.789 10.587 6.902 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.720 11.907 6.470 1.00 0.00 H new ATOM 2744 N VAL B 70 70.731 9.010 5.390 1.00 0.00 N ATOM 2745 CA VAL B 70 71.715 8.119 4.720 1.00 0.00 C ATOM 2746 C VAL B 70 73.036 8.855 4.655 1.00 0.00 C ATOM 2747 O VAL B 70 73.231 9.735 3.840 1.00 0.00 O ATOM 2748 CB VAL B 70 71.254 7.869 3.293 1.00 0.00 C ATOM 2749 CG1 VAL B 70 72.164 6.849 2.636 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.816 7.367 3.260 1.00 0.00 C ATOM 0 H VAL B 70 70.553 9.884 4.895 1.00 0.00 H new ATOM 0 HA VAL B 70 71.809 7.178 5.262 1.00 0.00 H new ATOM 0 HB VAL B 70 71.300 8.812 2.748 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.832 6.671 1.613 1.00 0.00 H new ATOM 0 HG12 VAL B 70 73.186 7.227 2.625 1.00 0.00 H new ATOM 0 HG13 VAL B 70 72.128 5.915 3.197 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.514 7.197 2.227 1.00 0.00 H new ATOM 0 HG22 VAL B 70 69.744 6.433 3.818 1.00 0.00 H new ATOM 0 HG23 VAL B 70 69.160 8.111 3.712 1.00 0.00 H new ATOM 2760 N ASP B 71 73.959 8.482 5.469 1.00 0.00 N ATOM 2761 CA ASP B 71 75.282 9.136 5.410 1.00 0.00 C ATOM 2762 C ASP B 71 76.033 8.438 4.292 1.00 0.00 C ATOM 2763 O ASP B 71 75.585 7.424 3.794 1.00 0.00 O ATOM 2764 CB ASP B 71 76.019 8.945 6.737 1.00 0.00 C ATOM 2765 CG ASP B 71 75.330 9.776 7.822 1.00 0.00 C ATOM 2766 OD1 ASP B 71 74.612 10.697 7.468 1.00 0.00 O ATOM 2767 OD2 ASP B 71 75.529 9.475 8.987 1.00 0.00 O ATOM 0 H ASP B 71 73.860 7.753 6.175 1.00 0.00 H new ATOM 0 HA ASP B 71 75.197 10.208 5.232 1.00 0.00 H new ATOM 0 HB2 ASP B 71 76.022 7.891 7.016 1.00 0.00 H new ATOM 0 HB3 ASP B 71 77.060 9.250 6.635 1.00 0.00 H new ATOM 2772 N PHE B 72 77.157 8.927 3.879 1.00 0.00 N ATOM 2773 CA PHE B 72 77.867 8.223 2.796 1.00 0.00 C ATOM 2774 C PHE B 72 78.136 6.804 3.290 1.00 0.00 C ATOM 2775 O PHE B 72 78.008 5.839 2.565 1.00 0.00 O ATOM 2776 CB PHE B 72 79.184 8.932 2.506 1.00 0.00 C ATOM 2777 CG PHE B 72 79.855 8.246 1.352 1.00 0.00 C ATOM 2778 CD1 PHE B 72 80.721 7.174 1.579 1.00 0.00 C ATOM 2779 CD2 PHE B 72 79.597 8.677 0.050 1.00 0.00 C ATOM 2780 CE1 PHE B 72 81.335 6.533 0.500 1.00 0.00 C ATOM 2781 CE2 PHE B 72 80.208 8.039 -1.030 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.079 6.966 -0.807 1.00 0.00 C ATOM 0 H PHE B 72 77.608 9.769 4.237 1.00 0.00 H new ATOM 0 HA PHE B 72 77.277 8.209 1.880 1.00 0.00 H new ATOM 0 HB2 PHE B 72 79.005 9.981 2.270 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.827 8.909 3.386 1.00 0.00 H new ATOM 0 HD1 PHE B 72 80.916 6.841 2.588 1.00 0.00 H new ATOM 0 HD2 PHE B 72 78.924 9.504 -0.122 1.00 0.00 H new ATOM 0 HE1 PHE B 72 82.006 5.705 0.674 1.00 0.00 H new ATOM 0 HE2 PHE B 72 80.009 8.373 -2.038 1.00 0.00 H new ATOM 0 HZ PHE B 72 81.553 6.472 -1.642 1.00 0.00 H new ATOM 2792 N GLN B 73 78.492 6.682 4.538 1.00 0.00 N ATOM 2793 CA GLN B 73 78.759 5.343 5.120 1.00 0.00 C ATOM 2794 C GLN B 73 77.491 4.475 5.097 1.00 0.00 C ATOM 2795 O GLN B 73 77.564 3.293 4.828 1.00 0.00 O ATOM 2796 CB GLN B 73 79.232 5.511 6.568 1.00 0.00 C ATOM 2797 CG GLN B 73 79.513 4.139 7.189 1.00 0.00 C ATOM 2798 CD GLN B 73 80.075 4.329 8.599 1.00 0.00 C ATOM 2799 OE1 GLN B 73 80.419 5.427 8.984 1.00 0.00 O ATOM 2800 NE2 GLN B 73 80.169 3.298 9.394 1.00 0.00 N ATOM 0 H GLN B 73 78.610 7.463 5.184 1.00 0.00 H new ATOM 0 HA GLN B 73 79.528 4.849 4.526 1.00 0.00 H new ATOM 0 HB2 GLN B 73 80.133 6.124 6.596 1.00 0.00 H new ATOM 0 HB3 GLN B 73 78.472 6.034 7.149 1.00 0.00 H new ATOM 0 HG2 GLN B 73 78.597 3.549 7.226 1.00 0.00 H new ATOM 0 HG3 GLN B 73 80.223 3.587 6.573 1.00 0.00 H new ATOM 0 HE21 GLN B 73 79.879 2.375 9.069 1.00 0.00 H new ATOM 0 HE22 GLN B 73 80.532 3.415 10.340 1.00 0.00 H new ATOM 2809 N GLU B 74 76.327 5.020 5.381 1.00 0.00 N ATOM 2810 CA GLU B 74 75.116 4.164 5.369 1.00 0.00 C ATOM 2811 C GLU B 74 74.812 3.751 3.940 1.00 0.00 C ATOM 2812 O GLU B 74 74.440 2.627 3.678 1.00 0.00 O ATOM 2813 CB GLU B 74 73.930 4.918 5.963 1.00 0.00 C ATOM 2814 CG GLU B 74 72.716 3.988 6.011 1.00 0.00 C ATOM 2815 CD GLU B 74 71.555 4.697 6.710 1.00 0.00 C ATOM 2816 OE1 GLU B 74 71.784 5.759 7.262 1.00 0.00 O ATOM 2817 OE2 GLU B 74 70.458 4.164 6.684 1.00 0.00 O ATOM 0 H GLU B 74 76.175 6.001 5.615 1.00 0.00 H new ATOM 0 HA GLU B 74 75.295 3.275 5.974 1.00 0.00 H new ATOM 0 HB2 GLU B 74 74.173 5.271 6.965 1.00 0.00 H new ATOM 0 HB3 GLU B 74 73.705 5.799 5.361 1.00 0.00 H new ATOM 0 HG2 GLU B 74 72.425 3.701 5.001 1.00 0.00 H new ATOM 0 HG3 GLU B 74 72.969 3.071 6.543 1.00 0.00 H new ATOM 2824 N TYR B 75 74.972 4.637 3.005 1.00 0.00 N ATOM 2825 CA TYR B 75 74.681 4.255 1.605 1.00 0.00 C ATOM 2826 C TYR B 75 75.557 3.048 1.254 1.00 0.00 C ATOM 2827 O TYR B 75 75.126 2.119 0.602 1.00 0.00 O ATOM 2828 CB TYR B 75 75.003 5.424 0.666 1.00 0.00 C ATOM 2829 CG TYR B 75 74.961 4.960 -0.779 1.00 0.00 C ATOM 2830 CD1 TYR B 75 73.798 4.372 -1.297 1.00 0.00 C ATOM 2831 CD2 TYR B 75 76.088 5.117 -1.601 1.00 0.00 C ATOM 2832 CE1 TYR B 75 73.764 3.943 -2.631 1.00 0.00 C ATOM 2833 CE2 TYR B 75 76.049 4.688 -2.934 1.00 0.00 C ATOM 2834 CZ TYR B 75 74.889 4.101 -3.448 1.00 0.00 C ATOM 2835 OH TYR B 75 74.851 3.679 -4.761 1.00 0.00 O ATOM 0 H TYR B 75 75.287 5.597 3.147 1.00 0.00 H new ATOM 0 HA TYR B 75 73.626 4.004 1.492 1.00 0.00 H new ATOM 0 HB2 TYR B 75 74.286 6.231 0.818 1.00 0.00 H new ATOM 0 HB3 TYR B 75 75.989 5.826 0.898 1.00 0.00 H new ATOM 0 HD1 TYR B 75 72.929 4.250 -0.668 1.00 0.00 H new ATOM 0 HD2 TYR B 75 76.986 5.569 -1.206 1.00 0.00 H new ATOM 0 HE1 TYR B 75 72.868 3.490 -3.029 1.00 0.00 H new ATOM 0 HE2 TYR B 75 76.916 4.811 -3.566 1.00 0.00 H new ATOM 0 HH TYR B 75 75.713 3.863 -5.189 1.00 0.00 H new ATOM 2845 N CYS B 76 76.784 3.059 1.701 1.00 0.00 N ATOM 2846 CA CYS B 76 77.702 1.923 1.423 1.00 0.00 C ATOM 2847 C CYS B 76 77.222 0.692 2.182 1.00 0.00 C ATOM 2848 O CYS B 76 77.244 -0.407 1.667 1.00 0.00 O ATOM 2849 CB CYS B 76 79.114 2.284 1.888 1.00 0.00 C ATOM 2850 SG CYS B 76 79.658 3.790 1.045 1.00 0.00 S ATOM 0 H CYS B 76 77.191 3.815 2.252 1.00 0.00 H new ATOM 0 HA CYS B 76 77.712 1.715 0.353 1.00 0.00 H new ATOM 0 HB2 CYS B 76 79.126 2.434 2.968 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.800 1.465 1.672 1.00 0.00 H new ATOM 0 HG CYS B 76 78.960 4.801 1.469 1.00 0.00 H new ATOM 2856 N VAL B 77 76.771 0.858 3.396 1.00 0.00 N ATOM 2857 CA VAL B 77 76.284 -0.327 4.145 1.00 0.00 C ATOM 2858 C VAL B 77 75.132 -0.919 3.341 1.00 0.00 C ATOM 2859 O VAL B 77 75.026 -2.117 3.167 1.00 0.00 O ATOM 2860 CB VAL B 77 75.790 0.101 5.530 1.00 0.00 C ATOM 2861 CG1 VAL B 77 75.071 -1.069 6.210 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.983 0.538 6.385 1.00 0.00 C ATOM 0 H VAL B 77 76.720 1.748 3.892 1.00 0.00 H new ATOM 0 HA VAL B 77 77.080 -1.059 4.281 1.00 0.00 H new ATOM 0 HB VAL B 77 75.095 0.934 5.423 1.00 0.00 H new ATOM 0 HG11 VAL B 77 74.722 -0.759 7.195 1.00 0.00 H new ATOM 0 HG12 VAL B 77 74.219 -1.375 5.603 1.00 0.00 H new ATOM 0 HG13 VAL B 77 75.760 -1.907 6.317 1.00 0.00 H new ATOM 0 HG21 VAL B 77 76.632 0.843 7.371 1.00 0.00 H new ATOM 0 HG22 VAL B 77 77.680 -0.294 6.489 1.00 0.00 H new ATOM 0 HG23 VAL B 77 77.487 1.376 5.904 1.00 0.00 H new ATOM 2872 N PHE B 78 74.287 -0.076 2.820 1.00 0.00 N ATOM 2873 CA PHE B 78 73.162 -0.571 1.993 1.00 0.00 C ATOM 2874 C PHE B 78 73.726 -1.110 0.673 1.00 0.00 C ATOM 2875 O PHE B 78 73.281 -2.123 0.171 1.00 0.00 O ATOM 2876 CB PHE B 78 72.178 0.578 1.718 1.00 0.00 C ATOM 2877 CG PHE B 78 71.192 0.704 2.866 1.00 0.00 C ATOM 2878 CD1 PHE B 78 71.641 1.071 4.141 1.00 0.00 C ATOM 2879 CD2 PHE B 78 69.830 0.457 2.651 1.00 0.00 C ATOM 2880 CE1 PHE B 78 70.731 1.190 5.197 1.00 0.00 C ATOM 2881 CE2 PHE B 78 68.920 0.579 3.708 1.00 0.00 C ATOM 2882 CZ PHE B 78 69.370 0.946 4.980 1.00 0.00 C ATOM 0 H PHE B 78 74.330 0.937 2.934 1.00 0.00 H new ATOM 0 HA PHE B 78 72.631 -1.366 2.517 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.724 1.513 1.593 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.643 0.394 0.787 1.00 0.00 H new ATOM 0 HD1 PHE B 78 72.691 1.262 4.309 1.00 0.00 H new ATOM 0 HD2 PHE B 78 69.482 0.172 1.669 1.00 0.00 H new ATOM 0 HE1 PHE B 78 71.079 1.470 6.180 1.00 0.00 H new ATOM 0 HE2 PHE B 78 67.870 0.390 3.541 1.00 0.00 H new ATOM 0 HZ PHE B 78 68.668 1.041 5.795 1.00 0.00 H new ATOM 2892 N LEU B 79 74.701 -0.444 0.103 1.00 0.00 N ATOM 2893 CA LEU B 79 75.270 -0.942 -1.184 1.00 0.00 C ATOM 2894 C LEU B 79 75.951 -2.292 -0.938 1.00 0.00 C ATOM 2895 O LEU B 79 75.850 -3.208 -1.730 1.00 0.00 O ATOM 2896 CB LEU B 79 76.295 0.086 -1.724 1.00 0.00 C ATOM 2897 CG LEU B 79 76.114 0.310 -3.234 1.00 0.00 C ATOM 2898 CD1 LEU B 79 77.177 1.300 -3.723 1.00 0.00 C ATOM 2899 CD2 LEU B 79 76.257 -1.020 -3.996 1.00 0.00 C ATOM 0 H LEU B 79 75.121 0.411 0.468 1.00 0.00 H new ATOM 0 HA LEU B 79 74.477 -1.069 -1.921 1.00 0.00 H new ATOM 0 HB2 LEU B 79 76.177 1.033 -1.196 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.307 -0.266 -1.525 1.00 0.00 H new ATOM 0 HG LEU B 79 75.118 0.711 -3.419 1.00 0.00 H new ATOM 0 HD11 LEU B 79 77.056 1.465 -4.794 1.00 0.00 H new ATOM 0 HD12 LEU B 79 77.063 2.247 -3.195 1.00 0.00 H new ATOM 0 HD13 LEU B 79 78.170 0.894 -3.529 1.00 0.00 H new ATOM 0 HD21 LEU B 79 76.126 -0.844 -5.064 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.248 -1.438 -3.816 1.00 0.00 H new ATOM 0 HD23 LEU B 79 75.499 -1.722 -3.649 1.00 0.00 H new ATOM 2911 N SER B 80 76.631 -2.415 0.164 1.00 0.00 N ATOM 2912 CA SER B 80 77.309 -3.700 0.484 1.00 0.00 C ATOM 2913 C SER B 80 76.235 -4.739 0.740 1.00 0.00 C ATOM 2914 O SER B 80 76.330 -5.871 0.314 1.00 0.00 O ATOM 2915 CB SER B 80 78.189 -3.551 1.724 1.00 0.00 C ATOM 2916 OG SER B 80 79.229 -2.619 1.457 1.00 0.00 O ATOM 0 H SER B 80 76.747 -1.679 0.860 1.00 0.00 H new ATOM 0 HA SER B 80 77.948 -4.000 -0.347 1.00 0.00 H new ATOM 0 HB2 SER B 80 77.590 -3.212 2.569 1.00 0.00 H new ATOM 0 HB3 SER B 80 78.613 -4.516 2.000 1.00 0.00 H new ATOM 0 HG SER B 80 80.095 -3.077 1.491 1.00 0.00 H new ATOM 2922 N CYS B 81 75.191 -4.347 1.414 1.00 0.00 N ATOM 2923 CA CYS B 81 74.090 -5.299 1.677 1.00 0.00 C ATOM 2924 C CYS B 81 73.576 -5.770 0.330 1.00 0.00 C ATOM 2925 O CYS B 81 73.215 -6.917 0.155 1.00 0.00 O ATOM 2926 CB CYS B 81 72.963 -4.596 2.437 1.00 0.00 C ATOM 2927 SG CYS B 81 71.536 -5.703 2.561 1.00 0.00 S ATOM 0 H CYS B 81 75.057 -3.409 1.792 1.00 0.00 H new ATOM 0 HA CYS B 81 74.440 -6.137 2.279 1.00 0.00 H new ATOM 0 HB2 CYS B 81 73.304 -4.312 3.433 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.681 -3.678 1.922 1.00 0.00 H new ATOM 0 HG CYS B 81 71.647 -6.655 1.682 1.00 0.00 H new ATOM 2933 N ILE B 82 73.563 -4.896 -0.643 1.00 0.00 N ATOM 2934 CA ILE B 82 73.090 -5.335 -1.987 1.00 0.00 C ATOM 2935 C ILE B 82 74.130 -6.283 -2.577 1.00 0.00 C ATOM 2936 O ILE B 82 73.805 -7.278 -3.185 1.00 0.00 O ATOM 2937 CB ILE B 82 72.910 -4.129 -2.913 1.00 0.00 C ATOM 2938 CG1 ILE B 82 71.714 -3.302 -2.433 1.00 0.00 C ATOM 2939 CG2 ILE B 82 72.652 -4.613 -4.348 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.652 -1.985 -3.205 1.00 0.00 C ATOM 0 H ILE B 82 73.852 -3.921 -0.569 1.00 0.00 H new ATOM 0 HA ILE B 82 72.128 -5.838 -1.889 1.00 0.00 H new ATOM 0 HB ILE B 82 73.813 -3.518 -2.896 1.00 0.00 H new ATOM 0 HG12 ILE B 82 70.791 -3.863 -2.578 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.802 -3.104 -1.365 1.00 0.00 H new ATOM 0 HG21 ILE B 82 72.524 -3.753 -5.005 1.00 0.00 H new ATOM 0 HG22 ILE B 82 73.499 -5.207 -4.689 1.00 0.00 H new ATOM 0 HG23 ILE B 82 71.749 -5.223 -4.369 1.00 0.00 H new ATOM 0 HD11 ILE B 82 70.799 -1.401 -2.860 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.570 -1.422 -3.038 1.00 0.00 H new ATOM 0 HD13 ILE B 82 71.543 -2.192 -4.270 1.00 0.00 H new ATOM 2952 N ALA B 83 75.384 -5.986 -2.398 1.00 0.00 N ATOM 2953 CA ALA B 83 76.427 -6.889 -2.949 1.00 0.00 C ATOM 2954 C ALA B 83 76.308 -8.259 -2.282 1.00 0.00 C ATOM 2955 O ALA B 83 76.339 -9.284 -2.935 1.00 0.00 O ATOM 2956 CB ALA B 83 77.808 -6.309 -2.672 1.00 0.00 C ATOM 0 H ALA B 83 75.729 -5.166 -1.899 1.00 0.00 H new ATOM 0 HA ALA B 83 76.289 -6.989 -4.026 1.00 0.00 H new ATOM 0 HB1 ALA B 83 78.570 -6.974 -3.078 1.00 0.00 H new ATOM 0 HB2 ALA B 83 77.893 -5.330 -3.144 1.00 0.00 H new ATOM 0 HB3 ALA B 83 77.951 -6.207 -1.596 1.00 0.00 H new ATOM 2962 N MET B 84 76.162 -8.286 -0.985 1.00 0.00 N ATOM 2963 CA MET B 84 76.031 -9.591 -0.288 1.00 0.00 C ATOM 2964 C MET B 84 74.800 -10.301 -0.834 1.00 0.00 C ATOM 2965 O MET B 84 74.737 -11.513 -0.878 1.00 0.00 O ATOM 2966 CB MET B 84 75.877 -9.381 1.227 1.00 0.00 C ATOM 2967 CG MET B 84 77.124 -8.697 1.799 1.00 0.00 C ATOM 2968 SD MET B 84 78.586 -9.734 1.517 1.00 0.00 S ATOM 2969 CE MET B 84 79.354 -8.737 0.211 1.00 0.00 C ATOM 0 H MET B 84 76.128 -7.463 -0.383 1.00 0.00 H new ATOM 0 HA MET B 84 76.926 -10.189 -0.460 1.00 0.00 H new ATOM 0 HB2 MET B 84 74.995 -8.773 1.429 1.00 0.00 H new ATOM 0 HB3 MET B 84 75.722 -10.341 1.720 1.00 0.00 H new ATOM 0 HG2 MET B 84 77.263 -7.723 1.329 1.00 0.00 H new ATOM 0 HG3 MET B 84 76.994 -8.520 2.867 1.00 0.00 H new ATOM 0 HE1 MET B 84 80.367 -9.095 0.028 1.00 0.00 H new ATOM 0 HE2 MET B 84 78.768 -8.823 -0.704 1.00 0.00 H new ATOM 0 HE3 MET B 84 79.389 -7.693 0.523 1.00 0.00 H new ATOM 2979 N MET B 85 73.818 -9.557 -1.259 1.00 0.00 N ATOM 2980 CA MET B 85 72.603 -10.207 -1.803 1.00 0.00 C ATOM 2981 C MET B 85 73.014 -11.053 -3.006 1.00 0.00 C ATOM 2982 O MET B 85 72.540 -12.157 -3.169 1.00 0.00 O ATOM 2983 CB MET B 85 71.590 -9.147 -2.245 1.00 0.00 C ATOM 2984 CG MET B 85 70.254 -9.820 -2.561 1.00 0.00 C ATOM 2985 SD MET B 85 69.470 -10.370 -1.022 1.00 0.00 S ATOM 2986 CE MET B 85 69.124 -8.734 -0.322 1.00 0.00 C ATOM 0 H MET B 85 73.807 -8.537 -1.252 1.00 0.00 H new ATOM 0 HA MET B 85 72.141 -10.830 -1.037 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.458 -8.404 -1.458 1.00 0.00 H new ATOM 0 HB3 MET B 85 71.960 -8.619 -3.124 1.00 0.00 H new ATOM 0 HG2 MET B 85 69.600 -9.124 -3.085 1.00 0.00 H new ATOM 0 HG3 MET B 85 70.412 -10.670 -3.225 1.00 0.00 H new ATOM 0 HE1 MET B 85 68.221 -8.782 0.287 1.00 0.00 H new ATOM 0 HE2 MET B 85 69.963 -8.418 0.298 1.00 0.00 H new ATOM 0 HE3 MET B 85 68.979 -8.016 -1.129 1.00 0.00 H new ATOM 2996 N CYS B 86 73.915 -10.560 -3.833 1.00 0.00 N ATOM 2997 CA CYS B 86 74.366 -11.369 -5.012 1.00 0.00 C ATOM 2998 C CYS B 86 75.318 -10.540 -5.882 1.00 0.00 C ATOM 2999 O CYS B 86 74.938 -10.033 -6.919 1.00 0.00 O ATOM 3000 CB CYS B 86 73.154 -11.803 -5.861 1.00 0.00 C ATOM 3001 SG CYS B 86 73.709 -12.365 -7.492 1.00 0.00 S ATOM 0 H CYS B 86 74.351 -9.643 -3.741 1.00 0.00 H new ATOM 0 HA CYS B 86 74.883 -12.255 -4.644 1.00 0.00 H new ATOM 0 HB2 CYS B 86 72.614 -12.604 -5.356 1.00 0.00 H new ATOM 0 HB3 CYS B 86 72.460 -10.970 -5.971 1.00 0.00 H new ATOM 0 HG CYS B 86 74.491 -11.469 -8.017 1.00 0.00 H new ATOM 3007 N ASN B 87 76.554 -10.405 -5.480 1.00 0.00 N ATOM 3008 CA ASN B 87 77.529 -9.617 -6.301 1.00 0.00 C ATOM 3009 C ASN B 87 78.333 -10.569 -7.194 1.00 0.00 C ATOM 3010 O ASN B 87 78.845 -10.181 -8.226 1.00 0.00 O ATOM 3011 CB ASN B 87 78.490 -8.861 -5.373 1.00 0.00 C ATOM 3012 CG ASN B 87 79.097 -7.670 -6.121 1.00 0.00 C ATOM 3013 OD1 ASN B 87 79.355 -7.749 -7.306 1.00 0.00 O ATOM 3014 ND2 ASN B 87 79.335 -6.561 -5.477 1.00 0.00 N ATOM 0 H ASN B 87 76.933 -10.804 -4.621 1.00 0.00 H new ATOM 0 HA ASN B 87 76.985 -8.905 -6.921 1.00 0.00 H new ATOM 0 HB2 ASN B 87 77.958 -8.514 -4.487 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.280 -9.529 -5.029 1.00 0.00 H new ATOM 0 HD21 ASN B 87 79.737 -5.762 -5.968 1.00 0.00 H new ATOM 0 HD22 ASN B 87 79.119 -6.492 -4.482 1.00 0.00 H new ATOM 3021 N GLU B 88 78.455 -11.808 -6.802 1.00 0.00 N ATOM 3022 CA GLU B 88 79.234 -12.778 -7.625 1.00 0.00 C ATOM 3023 C GLU B 88 78.593 -12.903 -9.009 1.00 0.00 C ATOM 3024 O GLU B 88 77.396 -13.073 -9.134 1.00 0.00 O ATOM 3025 CB GLU B 88 79.233 -14.144 -6.939 1.00 0.00 C ATOM 3026 CG GLU B 88 80.242 -15.059 -7.631 1.00 0.00 C ATOM 3027 CD GLU B 88 81.660 -14.614 -7.267 1.00 0.00 C ATOM 3028 OE1 GLU B 88 81.785 -13.707 -6.459 1.00 0.00 O ATOM 3029 OE2 GLU B 88 82.598 -15.187 -7.795 1.00 0.00 O ATOM 0 H GLU B 88 78.049 -12.191 -5.948 1.00 0.00 H new ATOM 0 HA GLU B 88 80.260 -12.424 -7.730 1.00 0.00 H new ATOM 0 HB2 GLU B 88 79.488 -14.034 -5.885 1.00 0.00 H new ATOM 0 HB3 GLU B 88 78.237 -14.584 -6.982 1.00 0.00 H new ATOM 0 HG2 GLU B 88 80.083 -16.093 -7.324 1.00 0.00 H new ATOM 0 HG3 GLU B 88 80.103 -15.022 -8.711 1.00 0.00 H new ATOM 3036 N PHE B 89 79.377 -12.820 -10.054 1.00 0.00 N ATOM 3037 CA PHE B 89 78.806 -12.930 -11.432 1.00 0.00 C ATOM 3038 C PHE B 89 78.844 -14.388 -11.910 1.00 0.00 C ATOM 3039 O PHE B 89 77.850 -15.086 -11.867 1.00 0.00 O ATOM 3040 CB PHE B 89 79.624 -12.058 -12.386 1.00 0.00 C ATOM 3041 CG PHE B 89 79.462 -10.608 -11.999 1.00 0.00 C ATOM 3042 CD1 PHE B 89 78.426 -9.848 -12.556 1.00 0.00 C ATOM 3043 CD2 PHE B 89 80.344 -10.024 -11.081 1.00 0.00 C ATOM 3044 CE1 PHE B 89 78.273 -8.503 -12.195 1.00 0.00 C ATOM 3045 CE2 PHE B 89 80.191 -8.680 -10.721 1.00 0.00 C ATOM 3046 CZ PHE B 89 79.155 -7.920 -11.278 1.00 0.00 C ATOM 0 H PHE B 89 80.387 -12.681 -10.013 1.00 0.00 H new ATOM 0 HA PHE B 89 77.770 -12.593 -11.417 1.00 0.00 H new ATOM 0 HB2 PHE B 89 80.676 -12.342 -12.345 1.00 0.00 H new ATOM 0 HB3 PHE B 89 79.292 -12.212 -13.413 1.00 0.00 H new ATOM 0 HD1 PHE B 89 77.745 -10.298 -13.263 1.00 0.00 H new ATOM 0 HD2 PHE B 89 81.142 -10.611 -10.651 1.00 0.00 H new ATOM 0 HE1 PHE B 89 77.474 -7.916 -12.624 1.00 0.00 H new ATOM 0 HE2 PHE B 89 80.872 -8.229 -10.014 1.00 0.00 H new ATOM 0 HZ PHE B 89 79.037 -6.883 -11.000 1.00 0.00 H new ATOM 3056 N PHE B 90 79.984 -14.848 -12.369 1.00 0.00 N ATOM 3057 CA PHE B 90 80.104 -16.264 -12.864 1.00 0.00 C ATOM 3058 C PHE B 90 81.145 -17.012 -12.037 1.00 0.00 C ATOM 3059 O PHE B 90 81.110 -18.220 -11.916 1.00 0.00 O ATOM 3060 CB PHE B 90 80.561 -16.242 -14.321 1.00 0.00 C ATOM 3061 CG PHE B 90 79.538 -15.514 -15.148 1.00 0.00 C ATOM 3062 CD1 PHE B 90 79.646 -14.132 -15.320 1.00 0.00 C ATOM 3063 CD2 PHE B 90 78.482 -16.216 -15.738 1.00 0.00 C ATOM 3064 CE1 PHE B 90 78.698 -13.447 -16.082 1.00 0.00 C ATOM 3065 CE2 PHE B 90 77.532 -15.532 -16.504 1.00 0.00 C ATOM 3066 CZ PHE B 90 77.639 -14.146 -16.676 1.00 0.00 C ATOM 0 H PHE B 90 80.844 -14.302 -12.424 1.00 0.00 H new ATOM 0 HA PHE B 90 79.138 -16.762 -12.775 1.00 0.00 H new ATOM 0 HB2 PHE B 90 81.530 -15.750 -14.403 1.00 0.00 H new ATOM 0 HB3 PHE B 90 80.688 -17.260 -14.690 1.00 0.00 H new ATOM 0 HD1 PHE B 90 80.463 -13.593 -14.863 1.00 0.00 H new ATOM 0 HD2 PHE B 90 78.400 -17.284 -15.602 1.00 0.00 H new ATOM 0 HE1 PHE B 90 78.781 -12.378 -16.214 1.00 0.00 H new ATOM 0 HE2 PHE B 90 76.717 -16.072 -16.962 1.00 0.00 H new ATOM 0 HZ PHE B 90 76.906 -13.617 -17.266 1.00 0.00 H new ATOM 3076 N GLU B 91 82.075 -16.301 -11.474 1.00 0.00 N ATOM 3077 CA GLU B 91 83.132 -16.962 -10.658 1.00 0.00 C ATOM 3078 C GLU B 91 82.515 -17.496 -9.364 1.00 0.00 C ATOM 3079 O GLU B 91 81.533 -16.977 -8.879 1.00 0.00 O ATOM 3080 CB GLU B 91 84.227 -15.944 -10.330 1.00 0.00 C ATOM 3081 CG GLU B 91 84.898 -15.483 -11.626 1.00 0.00 C ATOM 3082 CD GLU B 91 85.662 -16.651 -12.255 1.00 0.00 C ATOM 3083 OE1 GLU B 91 86.556 -17.167 -11.605 1.00 0.00 O ATOM 3084 OE2 GLU B 91 85.339 -17.009 -13.376 1.00 0.00 O ATOM 0 H GLU B 91 82.152 -15.286 -11.542 1.00 0.00 H new ATOM 0 HA GLU B 91 83.566 -17.791 -11.217 1.00 0.00 H new ATOM 0 HB2 GLU B 91 83.799 -15.090 -9.805 1.00 0.00 H new ATOM 0 HB3 GLU B 91 84.966 -16.390 -9.664 1.00 0.00 H new ATOM 0 HG2 GLU B 91 84.147 -15.110 -12.323 1.00 0.00 H new ATOM 0 HG3 GLU B 91 85.580 -14.658 -11.420 1.00 0.00 H new ATOM 3091 N GLY B 92 83.073 -18.536 -8.805 1.00 0.00 N ATOM 3092 CA GLY B 92 82.502 -19.097 -7.544 1.00 0.00 C ATOM 3093 C GLY B 92 82.397 -17.984 -6.495 1.00 0.00 C ATOM 3094 O GLY B 92 83.194 -17.066 -6.470 1.00 0.00 O ATOM 0 H GLY B 92 83.896 -19.020 -9.164 1.00 0.00 H new ATOM 0 HA2 GLY B 92 81.518 -19.525 -7.736 1.00 0.00 H new ATOM 0 HA3 GLY B 92 83.134 -19.904 -7.173 1.00 0.00 H new ATOM 3098 N PHE B 93 81.414 -18.052 -5.632 1.00 0.00 N ATOM 3099 CA PHE B 93 81.248 -16.988 -4.590 1.00 0.00 C ATOM 3100 C PHE B 93 81.935 -17.430 -3.277 1.00 0.00 C ATOM 3101 O PHE B 93 81.758 -18.554 -2.854 1.00 0.00 O ATOM 3102 CB PHE B 93 79.756 -16.795 -4.305 1.00 0.00 C ATOM 3103 CG PHE B 93 79.126 -18.135 -4.011 1.00 0.00 C ATOM 3104 CD1 PHE B 93 78.672 -18.941 -5.061 1.00 0.00 C ATOM 3105 CD2 PHE B 93 78.997 -18.571 -2.687 1.00 0.00 C ATOM 3106 CE1 PHE B 93 78.089 -20.184 -4.788 1.00 0.00 C ATOM 3107 CE2 PHE B 93 78.414 -19.814 -2.413 1.00 0.00 C ATOM 3108 CZ PHE B 93 77.960 -20.620 -3.464 1.00 0.00 C ATOM 0 H PHE B 93 80.719 -18.798 -5.603 1.00 0.00 H new ATOM 0 HA PHE B 93 81.695 -16.062 -4.952 1.00 0.00 H new ATOM 0 HB2 PHE B 93 79.620 -16.123 -3.458 1.00 0.00 H new ATOM 0 HB3 PHE B 93 79.268 -16.331 -5.162 1.00 0.00 H new ATOM 0 HD1 PHE B 93 78.771 -18.604 -6.082 1.00 0.00 H new ATOM 0 HD2 PHE B 93 79.347 -17.948 -1.877 1.00 0.00 H new ATOM 0 HE1 PHE B 93 77.739 -20.806 -5.598 1.00 0.00 H new ATOM 0 HE2 PHE B 93 78.315 -20.151 -1.392 1.00 0.00 H new ATOM 0 HZ PHE B 93 77.510 -21.579 -3.253 1.00 0.00 H new ATOM 3118 N PRO B 94 82.691 -16.570 -2.609 1.00 0.00 N ATOM 3119 CA PRO B 94 83.335 -16.971 -1.322 1.00 0.00 C ATOM 3120 C PRO B 94 82.300 -17.079 -0.189 1.00 0.00 C ATOM 3121 O PRO B 94 81.790 -18.143 0.101 1.00 0.00 O ATOM 3122 CB PRO B 94 84.315 -15.811 -1.076 1.00 0.00 C ATOM 3123 CG PRO B 94 83.852 -14.621 -1.930 1.00 0.00 C ATOM 3124 CD PRO B 94 82.969 -15.172 -3.063 1.00 0.00 C ATOM 0 HA PRO B 94 83.815 -17.949 -1.358 1.00 0.00 H new ATOM 0 HB2 PRO B 94 84.331 -15.541 -0.020 1.00 0.00 H new ATOM 0 HB3 PRO B 94 85.330 -16.104 -1.346 1.00 0.00 H new ATOM 0 HG2 PRO B 94 83.294 -13.909 -1.322 1.00 0.00 H new ATOM 0 HG3 PRO B 94 84.710 -14.087 -2.339 1.00 0.00 H new ATOM 0 HD2 PRO B 94 82.052 -14.594 -3.180 1.00 0.00 H new ATOM 0 HD3 PRO B 94 83.483 -15.152 -4.024 1.00 0.00 H new ATOM 3132 N ASP B 95 81.984 -15.978 0.446 1.00 0.00 N ATOM 3133 CA ASP B 95 80.978 -16.004 1.552 1.00 0.00 C ATOM 3134 C ASP B 95 80.253 -14.654 1.607 1.00 0.00 C ATOM 3135 O ASP B 95 80.678 -13.734 2.279 1.00 0.00 O ATOM 3136 CB ASP B 95 81.688 -16.257 2.885 1.00 0.00 C ATOM 3137 CG ASP B 95 82.696 -15.138 3.150 1.00 0.00 C ATOM 3138 OD1 ASP B 95 83.074 -14.471 2.201 1.00 0.00 O ATOM 3139 OD2 ASP B 95 83.074 -14.966 4.297 1.00 0.00 O ATOM 0 H ASP B 95 82.380 -15.060 0.245 1.00 0.00 H new ATOM 0 HA ASP B 95 80.256 -16.801 1.371 1.00 0.00 H new ATOM 0 HB2 ASP B 95 80.959 -16.302 3.694 1.00 0.00 H new ATOM 0 HB3 ASP B 95 82.197 -17.220 2.860 1.00 0.00 H new ATOM 3144 N LYS B 96 79.159 -14.528 0.902 1.00 0.00 N ATOM 3145 CA LYS B 96 78.402 -13.237 0.907 1.00 0.00 C ATOM 3146 C LYS B 96 77.358 -13.247 2.035 1.00 0.00 C ATOM 3147 O LYS B 96 77.571 -12.685 3.092 1.00 0.00 O ATOM 3148 CB LYS B 96 77.715 -13.048 -0.463 1.00 0.00 C ATOM 3149 CG LYS B 96 77.415 -14.409 -1.102 1.00 0.00 C ATOM 3150 CD LYS B 96 76.523 -14.204 -2.327 1.00 0.00 C ATOM 3151 CE LYS B 96 76.255 -15.552 -2.997 1.00 0.00 C ATOM 3152 NZ LYS B 96 75.401 -16.389 -2.107 1.00 0.00 N ATOM 0 H LYS B 96 78.755 -15.263 0.322 1.00 0.00 H new ATOM 0 HA LYS B 96 79.088 -12.408 1.081 1.00 0.00 H new ATOM 0 HB2 LYS B 96 76.790 -12.486 -0.339 1.00 0.00 H new ATOM 0 HB3 LYS B 96 78.357 -12.463 -1.122 1.00 0.00 H new ATOM 0 HG2 LYS B 96 78.344 -14.901 -1.392 1.00 0.00 H new ATOM 0 HG3 LYS B 96 76.920 -15.061 -0.382 1.00 0.00 H new ATOM 0 HD2 LYS B 96 75.582 -13.740 -2.031 1.00 0.00 H new ATOM 0 HD3 LYS B 96 77.005 -13.526 -3.031 1.00 0.00 H new ATOM 0 HE2 LYS B 96 75.760 -15.401 -3.956 1.00 0.00 H new ATOM 0 HE3 LYS B 96 77.196 -16.062 -3.200 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 75.010 -17.186 -2.650 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 75.974 -16.754 -1.320 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 74.622 -15.812 -1.730 1.00 0.00 H new