USER MOD reduce.3.24.130724 H: found=0, std=0, add=1239, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1239 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 13 GLN : amide:sc= 0.388 K(o=0.96,f=-0.24) USER MOD Set 1.2: A 160 SER OG : rot -103:sc= 0.571 USER MOD Set 2.1: A 8 GLN : amide:sc= 2.09 K(o=4.4,f=-4.8!) USER MOD Set 2.2: A 154 LYS NZ :NH3+ -151:sc= 1.52 (180deg=1.17) USER MOD Set 2.3: A 158 TYR OH : rot -119:sc= 0.848 USER MOD Set 3.1: A 143 ASN : amide:sc= 1.71 K(o=2.9,f=-8.5!) USER MOD Set 3.2: A 150 THR OG1 : rot 143:sc= 1.23 USER MOD Set 4.1: A 92 SER OG : rot 110:sc= 0.799 USER MOD Set 4.2: A 93 ASN : amide:sc= 2.28 K(o=4,f=-5.1!) USER MOD Set 4.3: A 129 LYS NZ :NH3+ -154:sc= 0.881 (180deg=-0.546) USER MOD Set 5.1: A 73 HIS :FLIP no HE2:sc= 0.263 F(o=-2.3,f=0.49) USER MOD Set 5.2: A 74 SER OG : rot 120:sc= 0.227 USER MOD Set 6.1: A 63 TYR OH : rot 180:sc= 0.573 USER MOD Set 6.2: A 135 SER OG : rot -168:sc= 0.569 USER MOD Set 7.1: A 7 SER OG : rot -118:sc= 0.268 USER MOD Set 7.2: A 42 GLN : amide:sc= -0.0825 K(o=0.19,f=-0.67) USER MOD Single : A 1 SER N :NH3+ -150:sc= 0.0379 (180deg=0) USER MOD Single : A 1 SER OG : rot 41:sc= 0.364 USER MOD Single : A 2 SER OG : rot 170:sc= -0.916! USER MOD Single : A 5 SER OG : rot -8:sc= 1.02 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 CYS SG : rot 29:sc= 1.46 USER MOD Single : A 29 ASN : amide:sc= -3.95! C(o=-4!,f=-11!) USER MOD Single : A 30 GLN : amide:sc= -0.936! C(o=-0.94!,f=-5.6!) USER MOD Single : A 31 SER OG : rot 180:sc= 0.0773 USER MOD Single : A 32 SER OG : rot 120:sc= 0.691 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -0.0881 X(o=-0.088,f=-0.11) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 ASN : amide:sc= -2.85! C(o=-2.8!,f=-4.9!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0.634 K(o=0.63,f=-2.9!) USER MOD Single : A 54 SER OG : rot 36:sc= 0.362 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 67 ASN : amide:sc= -0.672! K(o=-0.67!,f=-1.3) USER MOD Single : A 68 GLN : amide:sc= -0.254 X(o=-0.25,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 169:sc= 1.28 (180deg=0.907) USER MOD Single : A 78 LYS NZ :NH3+ 162:sc= 0.699 (180deg=0.353) USER MOD Single : A 86 LYS NZ :NH3+ -163:sc= 1 (180deg=0.77) USER MOD Single : A 87 THR OG1 : rot -158:sc= -0.993 USER MOD Single : A 89 LYS NZ :NH3+ 144:sc= 1.29 (180deg=0.834) USER MOD Single : A 94 LYS NZ :NH3+ 158:sc= 1.27 (180deg=1.07) USER MOD Single : A 96 HIS : no HE2:sc= -0.146 K(o=-0.15,f=-5.4!) USER MOD Single : A 97 MET CE :methyl -111:sc= -0.805 (180deg=-2.07) USER MOD Single : A 98 CYS SG : rot 180:sc= -0.873 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 ASN : amide:sc= 0.854 K(o=0.85,f=0) USER MOD Single : A 108 SER OG : rot -50:sc= -0.145 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0217 USER MOD Single : A 117 ASN :FLIP amide:sc= -1.74 F(o=-2.4!,f=-1.7) USER MOD Single : A 119 LYS NZ :NH3+ -163:sc= -0.0363 (180deg=-0.305) USER MOD Single : A 121 LYS NZ :NH3+ 167:sc= 1.12 (180deg=0.738) USER MOD Single : A 126 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0191) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= -0.278 X(o=-0.28,f=-0.14) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 117:sc= 1.3 USER MOD Single : A 144 GLN : amide:sc= -1.62! X(o=-1.6!,f=-1.8) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot -33:sc= 0.707 USER MOD Single : A 151 LYS NZ :NH3+ 171:sc= 1.28 (180deg=0.895) USER MOD Single : A 153 GLN : amide:sc= 0.619 K(o=0.62,f=-0.49) USER MOD Single : A 161 THR OG1 : rot 53:sc= 0.538 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -8.059 -14.104 -14.062 1.00 0.00 N ATOM 2 CA SER A 1 -7.897 -12.705 -13.739 1.00 0.00 C ATOM 3 C SER A 1 -8.743 -12.337 -12.516 1.00 0.00 C ATOM 4 O SER A 1 -9.967 -12.275 -12.585 1.00 0.00 O ATOM 5 CB SER A 1 -8.269 -11.857 -14.960 1.00 0.00 C ATOM 6 OG SER A 1 -9.572 -12.186 -15.427 1.00 0.00 O ATOM 0 H1 SER A 1 -7.186 -14.463 -14.498 1.00 0.00 H new ATOM 0 H2 SER A 1 -8.258 -14.640 -13.193 1.00 0.00 H new ATOM 0 H3 SER A 1 -8.850 -14.217 -14.727 1.00 0.00 H new ATOM 0 HA SER A 1 -6.856 -12.505 -13.484 1.00 0.00 H new ATOM 0 HB2 SER A 1 -8.228 -10.799 -14.700 1.00 0.00 H new ATOM 0 HB3 SER A 1 -7.541 -12.018 -15.755 1.00 0.00 H new ATOM 0 HG SER A 1 -10.170 -12.319 -14.662 1.00 0.00 H new ATOM 14 N SER A 2 -8.082 -12.155 -11.397 1.00 0.00 N ATOM 15 CA SER A 2 -8.722 -11.789 -10.150 1.00 0.00 C ATOM 16 C SER A 2 -9.260 -10.340 -10.228 1.00 0.00 C ATOM 17 O SER A 2 -10.474 -10.103 -10.215 1.00 0.00 O ATOM 18 CB SER A 2 -7.692 -11.951 -9.008 1.00 0.00 C ATOM 19 OG SER A 2 -8.222 -11.607 -7.746 1.00 0.00 O ATOM 0 H SER A 2 -7.070 -12.258 -11.324 1.00 0.00 H new ATOM 0 HA SER A 2 -9.575 -12.439 -9.956 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.343 -12.983 -8.982 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.823 -11.326 -9.216 1.00 0.00 H new ATOM 0 HG SER A 2 -7.592 -11.871 -7.044 1.00 0.00 H new ATOM 25 N ALA A 3 -8.348 -9.405 -10.298 1.00 0.00 N ATOM 26 CA ALA A 3 -8.619 -7.974 -10.437 1.00 0.00 C ATOM 27 C ALA A 3 -7.361 -7.394 -11.000 1.00 0.00 C ATOM 28 O ALA A 3 -7.001 -6.243 -10.782 1.00 0.00 O ATOM 29 CB ALA A 3 -8.941 -7.361 -9.085 1.00 0.00 C ATOM 0 H ALA A 3 -7.351 -9.616 -10.259 1.00 0.00 H new ATOM 0 HA ALA A 3 -9.478 -7.777 -11.079 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -9.140 -6.296 -9.206 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -9.820 -7.849 -8.664 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -8.094 -7.497 -8.413 1.00 0.00 H new ATOM 35 N GLU A 4 -6.757 -8.220 -11.798 1.00 0.00 N ATOM 36 CA GLU A 4 -5.449 -8.043 -12.324 1.00 0.00 C ATOM 37 C GLU A 4 -5.457 -7.133 -13.534 1.00 0.00 C ATOM 38 O GLU A 4 -5.852 -7.537 -14.636 1.00 0.00 O ATOM 39 CB GLU A 4 -4.915 -9.416 -12.680 1.00 0.00 C ATOM 40 CG GLU A 4 -4.960 -10.369 -11.502 1.00 0.00 C ATOM 41 CD GLU A 4 -4.609 -11.790 -11.859 1.00 0.00 C ATOM 42 OE1 GLU A 4 -3.462 -12.064 -12.230 1.00 0.00 O ATOM 43 OE2 GLU A 4 -5.494 -12.657 -11.760 1.00 0.00 O ATOM 0 H GLU A 4 -7.195 -9.085 -12.115 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.809 -7.564 -11.583 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.499 -9.829 -13.502 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.888 -9.325 -13.033 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.272 -10.016 -10.734 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.960 -10.349 -11.068 1.00 0.00 H new ATOM 50 N SER A 5 -5.095 -5.902 -13.307 1.00 0.00 N ATOM 51 CA SER A 5 -4.967 -4.892 -14.325 1.00 0.00 C ATOM 52 C SER A 5 -4.055 -3.798 -13.781 1.00 0.00 C ATOM 53 O SER A 5 -4.012 -3.576 -12.567 1.00 0.00 O ATOM 54 CB SER A 5 -6.350 -4.319 -14.712 1.00 0.00 C ATOM 55 OG SER A 5 -7.189 -5.315 -15.290 1.00 0.00 O ATOM 0 H SER A 5 -4.872 -5.559 -12.373 1.00 0.00 H new ATOM 0 HA SER A 5 -4.538 -5.322 -15.230 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.833 -3.905 -13.827 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.220 -3.498 -15.418 1.00 0.00 H new ATOM 0 HG SER A 5 -6.670 -6.133 -15.440 1.00 0.00 H new ATOM 61 N ALA A 6 -3.325 -3.142 -14.648 1.00 0.00 N ATOM 62 CA ALA A 6 -2.378 -2.131 -14.234 1.00 0.00 C ATOM 63 C ALA A 6 -2.790 -0.757 -14.748 1.00 0.00 C ATOM 64 O ALA A 6 -2.659 -0.464 -15.948 1.00 0.00 O ATOM 65 CB ALA A 6 -0.983 -2.500 -14.722 1.00 0.00 C ATOM 0 H ALA A 6 -3.368 -3.291 -15.656 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.367 -2.085 -13.145 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.273 -1.735 -14.407 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -0.692 -3.461 -14.299 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.984 -2.568 -15.810 1.00 0.00 H new ATOM 71 N SER A 7 -3.294 0.071 -13.860 1.00 0.00 N ATOM 72 CA SER A 7 -3.766 1.391 -14.223 1.00 0.00 C ATOM 73 C SER A 7 -2.877 2.473 -13.607 1.00 0.00 C ATOM 74 O SER A 7 -2.385 2.308 -12.490 1.00 0.00 O ATOM 75 CB SER A 7 -5.195 1.574 -13.749 1.00 0.00 C ATOM 76 OG SER A 7 -6.037 0.528 -14.224 1.00 0.00 O ATOM 0 H SER A 7 -3.389 -0.150 -12.869 1.00 0.00 H new ATOM 0 HA SER A 7 -3.726 1.485 -15.308 1.00 0.00 H new ATOM 0 HB2 SER A 7 -5.219 1.596 -12.659 1.00 0.00 H new ATOM 0 HB3 SER A 7 -5.575 2.535 -14.096 1.00 0.00 H new ATOM 0 HG SER A 7 -6.736 0.906 -14.798 1.00 0.00 H new ATOM 82 N GLN A 8 -2.726 3.578 -14.330 1.00 0.00 N ATOM 83 CA GLN A 8 -1.857 4.692 -13.961 1.00 0.00 C ATOM 84 C GLN A 8 -0.431 4.272 -14.000 1.00 0.00 C ATOM 85 O GLN A 8 0.204 3.993 -12.979 1.00 0.00 O ATOM 86 CB GLN A 8 -2.228 5.352 -12.629 1.00 0.00 C ATOM 87 CG GLN A 8 -1.345 6.529 -12.231 1.00 0.00 C ATOM 88 CD GLN A 8 -1.812 7.219 -10.962 1.00 0.00 C ATOM 89 OE1 GLN A 8 -2.409 6.592 -10.071 1.00 0.00 O ATOM 90 NE2 GLN A 8 -1.547 8.492 -10.863 1.00 0.00 N ATOM 0 H GLN A 8 -3.217 3.728 -15.211 1.00 0.00 H new ATOM 0 HA GLN A 8 -2.011 5.470 -14.709 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -3.262 5.694 -12.684 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -2.183 4.599 -11.842 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.322 6.178 -12.092 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -1.325 7.253 -13.046 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -1.055 8.971 -11.617 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -1.832 9.009 -10.031 1.00 0.00 H new ATOM 99 N ILE A 9 0.049 4.135 -15.184 1.00 0.00 N ATOM 100 CA ILE A 9 1.389 3.719 -15.367 1.00 0.00 C ATOM 101 C ILE A 9 2.219 4.875 -15.912 1.00 0.00 C ATOM 102 O ILE A 9 1.983 5.341 -17.023 1.00 0.00 O ATOM 103 CB ILE A 9 1.496 2.484 -16.313 1.00 0.00 C ATOM 104 CG1 ILE A 9 0.598 1.347 -15.819 1.00 0.00 C ATOM 105 CG2 ILE A 9 2.941 1.999 -16.436 1.00 0.00 C ATOM 106 CD1 ILE A 9 0.899 0.895 -14.417 1.00 0.00 C ATOM 0 H ILE A 9 -0.471 4.307 -16.044 1.00 0.00 H new ATOM 0 HA ILE A 9 1.778 3.416 -14.395 1.00 0.00 H new ATOM 0 HB ILE A 9 1.159 2.796 -17.301 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.442 1.671 -15.870 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.701 0.497 -16.494 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.980 1.137 -17.102 1.00 0.00 H new ATOM 0 HG22 ILE A 9 3.560 2.799 -16.841 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.314 1.714 -15.452 1.00 0.00 H new ATOM 0 HD11 ILE A 9 0.220 0.088 -14.141 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.928 0.539 -14.363 1.00 0.00 H new ATOM 0 HD13 ILE A 9 0.767 1.730 -13.729 1.00 0.00 H new ATOM 118 N PRO A 10 3.207 5.345 -15.143 1.00 0.00 N ATOM 119 CA PRO A 10 4.081 6.459 -15.544 1.00 0.00 C ATOM 120 C PRO A 10 5.242 5.975 -16.422 1.00 0.00 C ATOM 121 O PRO A 10 6.250 6.659 -16.574 1.00 0.00 O ATOM 122 CB PRO A 10 4.611 6.948 -14.206 1.00 0.00 C ATOM 123 CG PRO A 10 4.714 5.712 -13.389 1.00 0.00 C ATOM 124 CD PRO A 10 3.550 4.844 -13.793 1.00 0.00 C ATOM 0 HA PRO A 10 3.564 7.218 -16.131 1.00 0.00 H new ATOM 0 HB2 PRO A 10 5.579 7.437 -14.314 1.00 0.00 H new ATOM 0 HB3 PRO A 10 3.937 7.673 -13.750 1.00 0.00 H new ATOM 0 HG2 PRO A 10 5.661 5.203 -13.570 1.00 0.00 H new ATOM 0 HG3 PRO A 10 4.676 5.944 -12.325 1.00 0.00 H new ATOM 0 HD2 PRO A 10 3.822 3.789 -13.812 1.00 0.00 H new ATOM 0 HD3 PRO A 10 2.713 4.945 -13.102 1.00 0.00 H new ATOM 132 N LYS A 11 5.077 4.774 -16.975 1.00 0.00 N ATOM 133 CA LYS A 11 6.035 4.117 -17.849 1.00 0.00 C ATOM 134 C LYS A 11 7.356 3.776 -17.143 1.00 0.00 C ATOM 135 O LYS A 11 8.332 3.401 -17.790 1.00 0.00 O ATOM 136 CB LYS A 11 6.270 4.926 -19.117 1.00 0.00 C ATOM 137 CG LYS A 11 5.039 5.194 -20.030 1.00 0.00 C ATOM 138 CD LYS A 11 4.506 3.957 -20.814 1.00 0.00 C ATOM 139 CE LYS A 11 3.765 2.915 -19.964 1.00 0.00 C ATOM 140 NZ LYS A 11 3.252 1.794 -20.788 1.00 0.00 N ATOM 0 H LYS A 11 4.239 4.215 -16.817 1.00 0.00 H new ATOM 0 HA LYS A 11 5.590 3.164 -18.134 1.00 0.00 H new ATOM 0 HB2 LYS A 11 6.693 5.889 -18.830 1.00 0.00 H new ATOM 0 HB3 LYS A 11 7.025 4.411 -19.711 1.00 0.00 H new ATOM 0 HG2 LYS A 11 4.231 5.589 -19.414 1.00 0.00 H new ATOM 0 HG3 LYS A 11 5.302 5.971 -20.747 1.00 0.00 H new ATOM 0 HD2 LYS A 11 3.835 4.306 -21.599 1.00 0.00 H new ATOM 0 HD3 LYS A 11 5.347 3.469 -21.307 1.00 0.00 H new ATOM 0 HE2 LYS A 11 4.437 2.526 -19.199 1.00 0.00 H new ATOM 0 HE3 LYS A 11 2.935 3.394 -19.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 2.758 1.112 -20.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.591 2.162 -21.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 4.047 1.321 -21.264 1.00 0.00 H new ATOM 154 N GLY A 12 7.370 3.873 -15.830 1.00 0.00 N ATOM 155 CA GLY A 12 8.543 3.504 -15.080 1.00 0.00 C ATOM 156 C GLY A 12 8.484 2.046 -14.714 1.00 0.00 C ATOM 157 O GLY A 12 9.052 1.199 -15.405 1.00 0.00 O ATOM 0 H GLY A 12 6.586 4.202 -15.267 1.00 0.00 H new ATOM 0 HA2 GLY A 12 9.438 3.703 -15.669 1.00 0.00 H new ATOM 0 HA3 GLY A 12 8.613 4.111 -14.177 1.00 0.00 H new ATOM 161 N GLN A 13 7.797 1.750 -13.649 1.00 0.00 N ATOM 162 CA GLN A 13 7.577 0.386 -13.236 1.00 0.00 C ATOM 163 C GLN A 13 6.154 0.009 -13.599 1.00 0.00 C ATOM 164 O GLN A 13 5.437 0.807 -14.218 1.00 0.00 O ATOM 165 CB GLN A 13 7.811 0.218 -11.727 1.00 0.00 C ATOM 166 CG GLN A 13 9.215 0.572 -11.261 1.00 0.00 C ATOM 167 CD GLN A 13 10.287 -0.306 -11.884 1.00 0.00 C ATOM 168 OE1 GLN A 13 10.639 -1.361 -11.347 1.00 0.00 O ATOM 169 NE2 GLN A 13 10.812 0.116 -13.002 1.00 0.00 N ATOM 0 H GLN A 13 7.371 2.446 -13.038 1.00 0.00 H new ATOM 0 HA GLN A 13 8.284 -0.270 -13.745 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.096 0.841 -11.190 1.00 0.00 H new ATOM 0 HB3 GLN A 13 7.601 -0.816 -11.453 1.00 0.00 H new ATOM 0 HG2 GLN A 13 9.420 1.614 -11.504 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.265 0.482 -10.176 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.495 0.993 -13.415 1.00 0.00 H new ATOM 0 HE22 GLN A 13 11.539 -0.431 -13.462 1.00 0.00 H new ATOM 178 N VAL A 14 5.739 -1.170 -13.230 1.00 0.00 N ATOM 179 CA VAL A 14 4.399 -1.621 -13.551 1.00 0.00 C ATOM 180 C VAL A 14 3.568 -1.605 -12.313 1.00 0.00 C ATOM 181 O VAL A 14 4.117 -1.637 -11.197 1.00 0.00 O ATOM 182 CB VAL A 14 4.402 -3.046 -14.149 1.00 0.00 C ATOM 183 CG1 VAL A 14 5.336 -3.091 -15.286 1.00 0.00 C ATOM 184 CG2 VAL A 14 4.784 -4.099 -13.136 1.00 0.00 C ATOM 0 H VAL A 14 6.302 -1.841 -12.707 1.00 0.00 H new ATOM 0 HA VAL A 14 3.984 -0.945 -14.299 1.00 0.00 H new ATOM 0 HB VAL A 14 3.386 -3.269 -14.476 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.342 -4.094 -15.712 1.00 0.00 H new ATOM 0 HG12 VAL A 14 5.019 -2.376 -16.046 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.339 -2.836 -14.943 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.770 -5.081 -13.609 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.785 -3.893 -12.757 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.073 -4.084 -12.310 1.00 0.00 H new ATOM 194 N ASP A 15 2.267 -1.551 -12.474 1.00 0.00 N ATOM 195 CA ASP A 15 1.414 -1.534 -11.323 1.00 0.00 C ATOM 196 C ASP A 15 1.202 -2.951 -10.871 1.00 0.00 C ATOM 197 O ASP A 15 0.507 -3.745 -11.519 1.00 0.00 O ATOM 198 CB ASP A 15 0.065 -0.848 -11.584 1.00 0.00 C ATOM 199 CG ASP A 15 -0.665 -0.481 -10.292 1.00 0.00 C ATOM 200 OD1 ASP A 15 -0.654 -1.283 -9.355 1.00 0.00 O ATOM 201 OD2 ASP A 15 -1.261 0.635 -10.226 1.00 0.00 O ATOM 0 H ASP A 15 1.789 -1.519 -13.374 1.00 0.00 H new ATOM 0 HA ASP A 15 1.904 -0.947 -10.546 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.228 0.054 -12.174 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -0.566 -1.509 -12.179 1.00 0.00 H new ATOM 206 N LEU A 16 1.856 -3.267 -9.809 1.00 0.00 N ATOM 207 CA LEU A 16 1.781 -4.549 -9.120 1.00 0.00 C ATOM 208 C LEU A 16 0.400 -4.902 -8.614 1.00 0.00 C ATOM 209 O LEU A 16 0.230 -5.966 -8.062 1.00 0.00 O ATOM 210 CB LEU A 16 2.811 -4.625 -7.995 1.00 0.00 C ATOM 211 CG LEU A 16 4.235 -5.060 -8.369 1.00 0.00 C ATOM 212 CD1 LEU A 16 4.680 -4.468 -9.675 1.00 0.00 C ATOM 213 CD2 LEU A 16 5.198 -4.627 -7.293 1.00 0.00 C ATOM 0 H LEU A 16 2.498 -2.616 -9.357 1.00 0.00 H new ATOM 0 HA LEU A 16 2.017 -5.300 -9.874 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.871 -3.643 -7.526 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.435 -5.316 -7.240 1.00 0.00 H new ATOM 0 HG LEU A 16 4.226 -6.146 -8.467 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.693 -4.803 -9.900 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.007 -4.791 -10.469 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.664 -3.380 -9.606 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.208 -4.937 -7.562 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.167 -3.542 -7.192 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.917 -5.088 -6.346 1.00 0.00 H new ATOM 225 N LEU A 17 -0.580 -4.018 -8.797 1.00 0.00 N ATOM 226 CA LEU A 17 -1.995 -4.346 -8.522 1.00 0.00 C ATOM 227 C LEU A 17 -2.325 -5.591 -9.364 1.00 0.00 C ATOM 228 O LEU A 17 -3.019 -6.525 -8.930 1.00 0.00 O ATOM 229 CB LEU A 17 -2.865 -3.150 -8.989 1.00 0.00 C ATOM 230 CG LEU A 17 -4.368 -3.100 -8.651 1.00 0.00 C ATOM 231 CD1 LEU A 17 -4.938 -1.809 -9.167 1.00 0.00 C ATOM 232 CD2 LEU A 17 -5.136 -4.248 -9.260 1.00 0.00 C ATOM 0 H LEU A 17 -0.429 -3.067 -9.134 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.181 -4.534 -7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.413 -2.245 -8.583 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.777 -3.091 -10.074 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.466 -3.174 -7.568 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.002 -1.762 -8.934 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.426 -0.971 -8.695 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -4.801 -1.757 -10.247 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.189 -4.165 -8.991 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -5.035 -4.218 -10.345 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -4.739 -5.191 -8.884 1.00 0.00 H new ATOM 244 N ASP A 18 -1.773 -5.580 -10.558 1.00 0.00 N ATOM 245 CA ASP A 18 -1.894 -6.639 -11.544 1.00 0.00 C ATOM 246 C ASP A 18 -1.221 -7.936 -11.050 1.00 0.00 C ATOM 247 O ASP A 18 -1.500 -9.025 -11.537 1.00 0.00 O ATOM 248 CB ASP A 18 -1.247 -6.131 -12.836 1.00 0.00 C ATOM 249 CG ASP A 18 -1.223 -7.118 -13.972 1.00 0.00 C ATOM 250 OD1 ASP A 18 -2.259 -7.306 -14.627 1.00 0.00 O ATOM 251 OD2 ASP A 18 -0.144 -7.662 -14.259 1.00 0.00 O ATOM 0 H ASP A 18 -1.202 -4.800 -10.885 1.00 0.00 H new ATOM 0 HA ASP A 18 -2.942 -6.884 -11.717 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -1.779 -5.238 -13.163 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -0.223 -5.829 -12.616 1.00 0.00 H new ATOM 256 N PHE A 19 -0.365 -7.804 -10.048 1.00 0.00 N ATOM 257 CA PHE A 19 0.340 -8.932 -9.474 1.00 0.00 C ATOM 258 C PHE A 19 -0.038 -9.145 -8.012 1.00 0.00 C ATOM 259 O PHE A 19 0.717 -9.770 -7.250 1.00 0.00 O ATOM 260 CB PHE A 19 1.849 -8.770 -9.589 1.00 0.00 C ATOM 261 CG PHE A 19 2.362 -8.713 -10.992 1.00 0.00 C ATOM 262 CD1 PHE A 19 2.137 -9.758 -11.872 1.00 0.00 C ATOM 263 CD2 PHE A 19 3.088 -7.627 -11.423 1.00 0.00 C ATOM 264 CE1 PHE A 19 2.628 -9.712 -13.158 1.00 0.00 C ATOM 265 CE2 PHE A 19 3.581 -7.573 -12.702 1.00 0.00 C ATOM 266 CZ PHE A 19 3.352 -8.615 -13.576 1.00 0.00 C ATOM 0 H PHE A 19 -0.142 -6.909 -9.612 1.00 0.00 H new ATOM 0 HA PHE A 19 0.038 -9.809 -10.047 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.144 -7.858 -9.070 1.00 0.00 H new ATOM 0 HB3 PHE A 19 2.331 -9.600 -9.073 1.00 0.00 H new ATOM 0 HD1 PHE A 19 1.571 -10.618 -11.547 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.272 -6.806 -10.746 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.447 -10.532 -13.837 1.00 0.00 H new ATOM 0 HE2 PHE A 19 4.149 -6.713 -13.025 1.00 0.00 H new ATOM 0 HZ PHE A 19 3.738 -8.572 -14.584 1.00 0.00 H new ATOM 276 N ILE A 20 -1.194 -8.671 -7.624 1.00 0.00 N ATOM 277 CA ILE A 20 -1.699 -8.938 -6.294 1.00 0.00 C ATOM 278 C ILE A 20 -2.769 -10.022 -6.388 1.00 0.00 C ATOM 279 O ILE A 20 -3.504 -10.086 -7.373 1.00 0.00 O ATOM 280 CB ILE A 20 -2.243 -7.652 -5.590 1.00 0.00 C ATOM 281 CG1 ILE A 20 -1.115 -6.630 -5.457 1.00 0.00 C ATOM 282 CG2 ILE A 20 -2.828 -7.976 -4.210 1.00 0.00 C ATOM 283 CD1 ILE A 20 -1.494 -5.332 -4.768 1.00 0.00 C ATOM 0 H ILE A 20 -1.806 -8.099 -8.206 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.876 -9.287 -5.671 1.00 0.00 H new ATOM 0 HB ILE A 20 -3.045 -7.237 -6.201 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -0.294 -7.089 -4.905 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -0.739 -6.397 -6.453 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -3.197 -7.061 -3.747 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.649 -8.684 -4.320 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.054 -8.414 -3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -0.625 -4.676 -4.724 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -2.291 -4.842 -5.328 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -1.839 -5.544 -3.756 1.00 0.00 H new ATOM 295 N ASP A 21 -2.800 -10.902 -5.401 1.00 0.00 N ATOM 296 CA ASP A 21 -3.742 -12.028 -5.360 1.00 0.00 C ATOM 297 C ASP A 21 -5.232 -11.599 -5.303 1.00 0.00 C ATOM 298 O ASP A 21 -6.066 -12.125 -6.047 1.00 0.00 O ATOM 299 CB ASP A 21 -3.398 -12.915 -4.180 1.00 0.00 C ATOM 300 CG ASP A 21 -4.355 -14.051 -3.999 1.00 0.00 C ATOM 301 OD1 ASP A 21 -4.219 -15.070 -4.707 1.00 0.00 O ATOM 302 OD2 ASP A 21 -5.236 -13.947 -3.122 1.00 0.00 O ATOM 0 H ASP A 21 -2.173 -10.862 -4.598 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.633 -12.573 -6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -2.392 -13.313 -4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.384 -12.312 -3.272 1.00 0.00 H new ATOM 307 N TRP A 22 -5.549 -10.672 -4.392 1.00 0.00 N ATOM 308 CA TRP A 22 -6.928 -10.110 -4.184 1.00 0.00 C ATOM 309 C TRP A 22 -7.925 -11.093 -3.550 1.00 0.00 C ATOM 310 O TRP A 22 -8.865 -10.669 -2.866 1.00 0.00 O ATOM 311 CB TRP A 22 -7.529 -9.474 -5.459 1.00 0.00 C ATOM 312 CG TRP A 22 -6.675 -8.405 -6.026 1.00 0.00 C ATOM 313 CD1 TRP A 22 -6.136 -8.367 -7.268 1.00 0.00 C ATOM 314 CD2 TRP A 22 -6.227 -7.239 -5.356 1.00 0.00 C ATOM 315 NE1 TRP A 22 -5.362 -7.246 -7.406 1.00 0.00 N ATOM 316 CE2 TRP A 22 -5.411 -6.537 -6.250 1.00 0.00 C ATOM 317 CE3 TRP A 22 -6.436 -6.721 -4.086 1.00 0.00 C ATOM 318 CZ2 TRP A 22 -4.801 -5.349 -5.916 1.00 0.00 C ATOM 319 CZ3 TRP A 22 -5.829 -5.541 -3.754 1.00 0.00 C ATOM 320 CH2 TRP A 22 -5.018 -4.863 -4.672 1.00 0.00 C ATOM 0 H TRP A 22 -4.857 -10.272 -3.758 1.00 0.00 H new ATOM 0 HA TRP A 22 -6.769 -9.314 -3.456 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -7.679 -10.250 -6.210 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -8.511 -9.062 -5.226 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -6.293 -9.110 -8.035 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -4.835 -6.987 -8.240 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -7.064 -7.238 -3.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -4.173 -4.824 -6.621 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -5.978 -5.126 -2.768 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -4.555 -3.932 -4.381 1.00 0.00 H new ATOM 331 N SER A 23 -7.726 -12.375 -3.761 1.00 0.00 N ATOM 332 CA SER A 23 -8.604 -13.383 -3.217 1.00 0.00 C ATOM 333 C SER A 23 -8.426 -13.435 -1.697 1.00 0.00 C ATOM 334 O SER A 23 -9.386 -13.655 -0.941 1.00 0.00 O ATOM 335 CB SER A 23 -8.306 -14.749 -3.868 1.00 0.00 C ATOM 336 OG SER A 23 -9.219 -15.750 -3.434 1.00 0.00 O ATOM 0 H SER A 23 -6.953 -12.746 -4.313 1.00 0.00 H new ATOM 0 HA SER A 23 -9.642 -13.133 -3.436 1.00 0.00 H new ATOM 0 HB2 SER A 23 -8.359 -14.654 -4.953 1.00 0.00 H new ATOM 0 HB3 SER A 23 -7.289 -15.054 -3.624 1.00 0.00 H new ATOM 0 HG SER A 23 -9.001 -16.601 -3.868 1.00 0.00 H new ATOM 342 N GLY A 24 -7.200 -13.226 -1.257 1.00 0.00 N ATOM 343 CA GLY A 24 -6.920 -13.163 0.151 1.00 0.00 C ATOM 344 C GLY A 24 -7.131 -11.766 0.709 1.00 0.00 C ATOM 345 O GLY A 24 -8.204 -11.468 1.224 1.00 0.00 O ATOM 0 H GLY A 24 -6.387 -13.098 -1.860 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.563 -13.866 0.681 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -5.891 -13.474 0.331 1.00 0.00 H new ATOM 349 N VAL A 25 -6.095 -10.908 0.559 1.00 0.00 N ATOM 350 CA VAL A 25 -6.051 -9.508 1.084 1.00 0.00 C ATOM 351 C VAL A 25 -6.578 -9.326 2.512 1.00 0.00 C ATOM 352 O VAL A 25 -7.791 -9.295 2.777 1.00 0.00 O ATOM 353 CB VAL A 25 -6.554 -8.403 0.106 1.00 0.00 C ATOM 354 CG1 VAL A 25 -5.639 -8.343 -1.099 1.00 0.00 C ATOM 355 CG2 VAL A 25 -8.000 -8.622 -0.332 1.00 0.00 C ATOM 0 H VAL A 25 -5.244 -11.168 0.060 1.00 0.00 H new ATOM 0 HA VAL A 25 -4.976 -9.341 1.156 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.530 -7.452 0.639 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.989 -7.571 -1.784 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.625 -8.108 -0.775 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.643 -9.307 -1.607 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.299 -7.824 -1.012 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.085 -9.583 -0.840 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.650 -8.616 0.543 1.00 0.00 H new ATOM 365 N GLU A 26 -5.659 -9.177 3.414 1.00 0.00 N ATOM 366 CA GLU A 26 -5.951 -9.087 4.815 1.00 0.00 C ATOM 367 C GLU A 26 -5.629 -7.698 5.332 1.00 0.00 C ATOM 368 O GLU A 26 -4.619 -7.123 4.973 1.00 0.00 O ATOM 369 CB GLU A 26 -5.128 -10.152 5.535 1.00 0.00 C ATOM 370 CG GLU A 26 -5.152 -10.098 7.045 1.00 0.00 C ATOM 371 CD GLU A 26 -4.370 -11.232 7.642 1.00 0.00 C ATOM 372 OE1 GLU A 26 -3.126 -11.145 7.697 1.00 0.00 O ATOM 373 OE2 GLU A 26 -4.984 -12.222 8.063 1.00 0.00 O ATOM 0 H GLU A 26 -4.665 -9.113 3.195 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.012 -9.260 4.998 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.485 -11.133 5.220 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.093 -10.068 5.204 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.737 -9.149 7.384 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -6.183 -10.139 7.397 1.00 0.00 H new ATOM 380 N CYS A 27 -6.493 -7.153 6.140 1.00 0.00 N ATOM 381 CA CYS A 27 -6.256 -5.866 6.720 1.00 0.00 C ATOM 382 C CYS A 27 -6.610 -5.883 8.187 1.00 0.00 C ATOM 383 O CYS A 27 -7.625 -6.454 8.591 1.00 0.00 O ATOM 384 CB CYS A 27 -7.016 -4.765 5.967 1.00 0.00 C ATOM 385 SG CYS A 27 -6.774 -3.095 6.620 1.00 0.00 S ATOM 0 H CYS A 27 -7.375 -7.586 6.413 1.00 0.00 H new ATOM 0 HA CYS A 27 -5.194 -5.637 6.629 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -6.708 -4.780 4.922 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -8.081 -4.998 5.988 1.00 0.00 H new ATOM 0 HG CYS A 27 -5.603 -3.013 7.179 1.00 0.00 H new ATOM 391 N LEU A 28 -5.764 -5.270 8.974 1.00 0.00 N ATOM 392 CA LEU A 28 -5.944 -5.191 10.406 1.00 0.00 C ATOM 393 C LEU A 28 -7.108 -4.270 10.751 1.00 0.00 C ATOM 394 O LEU A 28 -7.799 -4.462 11.753 1.00 0.00 O ATOM 395 CB LEU A 28 -4.658 -4.688 11.054 1.00 0.00 C ATOM 396 CG LEU A 28 -4.674 -4.544 12.569 1.00 0.00 C ATOM 397 CD1 LEU A 28 -4.964 -5.880 13.231 1.00 0.00 C ATOM 398 CD2 LEU A 28 -3.353 -3.984 13.049 1.00 0.00 C ATOM 0 H LEU A 28 -4.920 -4.806 8.638 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.174 -6.185 10.790 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.851 -5.369 10.784 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.414 -3.718 10.621 1.00 0.00 H new ATOM 0 HG LEU A 28 -5.468 -3.851 12.847 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.971 -5.756 14.314 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.936 -6.246 12.901 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.193 -6.599 12.953 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.373 -3.884 14.134 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.546 -4.658 12.761 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.187 -3.006 12.598 1.00 0.00 H new ATOM 410 N ASN A 29 -7.324 -3.283 9.921 1.00 0.00 N ATOM 411 CA ASN A 29 -8.403 -2.358 10.135 1.00 0.00 C ATOM 412 C ASN A 29 -9.663 -2.914 9.569 1.00 0.00 C ATOM 413 O ASN A 29 -10.328 -3.694 10.249 1.00 0.00 O ATOM 414 CB ASN A 29 -8.090 -0.991 9.568 1.00 0.00 C ATOM 415 CG ASN A 29 -6.879 -0.393 10.211 1.00 0.00 C ATOM 416 OD1 ASN A 29 -5.767 -0.669 9.794 1.00 0.00 O ATOM 417 ND2 ASN A 29 -7.073 0.424 11.212 1.00 0.00 N ATOM 0 H ASN A 29 -6.764 -3.100 9.088 1.00 0.00 H new ATOM 0 HA ASN A 29 -8.535 -2.223 11.209 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.930 -1.070 8.493 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.945 -0.331 9.715 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -6.276 0.859 11.677 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.021 0.627 11.528 1.00 0.00 H new ATOM 424 N GLN A 30 -9.989 -2.555 8.285 1.00 0.00 N ATOM 425 CA GLN A 30 -11.185 -3.086 7.587 1.00 0.00 C ATOM 426 C GLN A 30 -12.429 -2.867 8.515 1.00 0.00 C ATOM 427 O GLN A 30 -13.409 -3.604 8.462 1.00 0.00 O ATOM 428 CB GLN A 30 -10.923 -4.599 7.399 1.00 0.00 C ATOM 429 CG GLN A 30 -11.841 -5.338 6.460 1.00 0.00 C ATOM 430 CD GLN A 30 -11.527 -5.072 5.012 1.00 0.00 C ATOM 431 OE1 GLN A 30 -12.057 -4.150 4.396 1.00 0.00 O ATOM 432 NE2 GLN A 30 -10.630 -5.867 4.463 1.00 0.00 N ATOM 0 H GLN A 30 -9.438 -1.904 7.726 1.00 0.00 H new ATOM 0 HA GLN A 30 -11.370 -2.598 6.630 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.901 -4.725 7.043 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -10.981 -5.077 8.377 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -11.767 -6.408 6.653 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -12.872 -5.048 6.663 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -10.214 -6.621 5.010 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -10.352 -5.728 3.492 1.00 0.00 H new ATOM 441 N SER A 31 -12.370 -1.811 9.314 1.00 0.00 N ATOM 442 CA SER A 31 -13.258 -1.671 10.447 1.00 0.00 C ATOM 443 C SER A 31 -14.383 -0.633 10.327 1.00 0.00 C ATOM 444 O SER A 31 -15.544 -0.992 10.086 1.00 0.00 O ATOM 445 CB SER A 31 -12.390 -1.374 11.662 1.00 0.00 C ATOM 446 OG SER A 31 -11.518 -0.268 11.379 1.00 0.00 O ATOM 0 H SER A 31 -11.713 -1.040 9.194 1.00 0.00 H new ATOM 0 HA SER A 31 -13.806 -2.610 10.524 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.019 -1.142 12.522 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.803 -2.254 11.925 1.00 0.00 H new ATOM 0 HG SER A 31 -10.963 -0.080 12.164 1.00 0.00 H new ATOM 452 N SER A 32 -14.015 0.648 10.452 1.00 0.00 N ATOM 453 CA SER A 32 -14.957 1.745 10.634 1.00 0.00 C ATOM 454 C SER A 32 -16.157 1.802 9.670 1.00 0.00 C ATOM 455 O SER A 32 -17.283 2.010 10.125 1.00 0.00 O ATOM 456 CB SER A 32 -14.202 3.067 10.739 1.00 0.00 C ATOM 457 OG SER A 32 -13.183 3.162 9.739 1.00 0.00 O ATOM 0 H SER A 32 -13.041 0.949 10.428 1.00 0.00 H new ATOM 0 HA SER A 32 -15.459 1.536 11.579 1.00 0.00 H new ATOM 0 HB2 SER A 32 -14.900 3.897 10.631 1.00 0.00 H new ATOM 0 HB3 SER A 32 -13.753 3.155 11.729 1.00 0.00 H new ATOM 0 HG SER A 32 -13.357 3.939 9.167 1.00 0.00 H new ATOM 463 N SER A 33 -15.942 1.604 8.386 1.00 0.00 N ATOM 464 CA SER A 33 -17.042 1.603 7.424 1.00 0.00 C ATOM 465 C SER A 33 -16.512 1.269 6.059 1.00 0.00 C ATOM 466 O SER A 33 -16.866 0.251 5.463 1.00 0.00 O ATOM 467 CB SER A 33 -17.773 2.973 7.386 1.00 0.00 C ATOM 468 OG SER A 33 -18.910 2.940 6.529 1.00 0.00 O ATOM 0 H SER A 33 -15.021 1.442 7.978 1.00 0.00 H new ATOM 0 HA SER A 33 -17.766 0.851 7.737 1.00 0.00 H new ATOM 0 HB2 SER A 33 -18.085 3.247 8.394 1.00 0.00 H new ATOM 0 HB3 SER A 33 -17.083 3.744 7.045 1.00 0.00 H new ATOM 0 HG SER A 33 -19.346 3.817 6.531 1.00 0.00 H new ATOM 474 N HIS A 34 -15.639 2.117 5.576 1.00 0.00 N ATOM 475 CA HIS A 34 -15.069 1.948 4.269 1.00 0.00 C ATOM 476 C HIS A 34 -14.080 0.787 4.279 1.00 0.00 C ATOM 477 O HIS A 34 -13.382 0.576 5.273 1.00 0.00 O ATOM 478 CB HIS A 34 -14.455 3.247 3.784 1.00 0.00 C ATOM 479 CG HIS A 34 -15.455 4.351 3.543 1.00 0.00 C ATOM 480 ND1 HIS A 34 -16.110 4.533 2.352 1.00 0.00 N ATOM 481 CD2 HIS A 34 -15.906 5.322 4.351 1.00 0.00 C ATOM 482 CE1 HIS A 34 -16.911 5.565 2.447 1.00 0.00 C ATOM 483 NE2 HIS A 34 -16.806 6.060 3.648 1.00 0.00 N ATOM 0 H HIS A 34 -15.306 2.940 6.078 1.00 0.00 H new ATOM 0 HA HIS A 34 -15.853 1.693 3.556 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -13.725 3.587 4.518 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -13.911 3.056 2.859 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -15.608 5.488 5.376 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -17.550 5.942 1.663 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -17.316 6.869 4.003 1.00 0.00 H new ATOM 492 N SER A 35 -14.024 0.037 3.190 1.00 0.00 N ATOM 493 CA SER A 35 -13.293 -1.217 3.194 1.00 0.00 C ATOM 494 C SER A 35 -11.971 -1.180 2.398 1.00 0.00 C ATOM 495 O SER A 35 -11.736 -0.286 1.592 1.00 0.00 O ATOM 496 CB SER A 35 -14.217 -2.311 2.685 1.00 0.00 C ATOM 497 OG SER A 35 -15.428 -2.308 3.444 1.00 0.00 O ATOM 0 H SER A 35 -14.470 0.272 2.303 1.00 0.00 H new ATOM 0 HA SER A 35 -12.986 -1.419 4.220 1.00 0.00 H new ATOM 0 HB2 SER A 35 -14.437 -2.153 1.629 1.00 0.00 H new ATOM 0 HB3 SER A 35 -13.727 -3.281 2.766 1.00 0.00 H new ATOM 0 HG SER A 35 -16.023 -3.013 3.113 1.00 0.00 H new ATOM 503 N LEU A 36 -11.138 -2.190 2.653 1.00 0.00 N ATOM 504 CA LEU A 36 -9.796 -2.354 2.067 1.00 0.00 C ATOM 505 C LEU A 36 -9.797 -2.459 0.522 1.00 0.00 C ATOM 506 O LEU A 36 -9.190 -1.613 -0.140 1.00 0.00 O ATOM 507 CB LEU A 36 -9.061 -3.553 2.783 1.00 0.00 C ATOM 508 CG LEU A 36 -7.634 -3.998 2.332 1.00 0.00 C ATOM 509 CD1 LEU A 36 -7.624 -4.721 0.991 1.00 0.00 C ATOM 510 CD2 LEU A 36 -6.699 -2.823 2.303 1.00 0.00 C ATOM 0 H LEU A 36 -11.382 -2.945 3.294 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.229 -1.442 2.253 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.999 -3.304 3.842 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.710 -4.424 2.697 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.288 -4.718 3.074 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -6.602 -5.003 0.737 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -8.242 -5.617 1.056 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -8.021 -4.062 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.710 -3.153 1.986 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.074 -2.077 1.603 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.634 -2.385 3.299 1.00 0.00 H new ATOM 522 N PRO A 37 -10.482 -3.481 -0.087 1.00 0.00 N ATOM 523 CA PRO A 37 -10.449 -3.690 -1.552 1.00 0.00 C ATOM 524 C PRO A 37 -10.940 -2.475 -2.339 1.00 0.00 C ATOM 525 O PRO A 37 -10.573 -2.289 -3.506 1.00 0.00 O ATOM 526 CB PRO A 37 -11.377 -4.890 -1.773 1.00 0.00 C ATOM 527 CG PRO A 37 -12.192 -4.993 -0.526 1.00 0.00 C ATOM 528 CD PRO A 37 -11.324 -4.503 0.578 1.00 0.00 C ATOM 0 HA PRO A 37 -9.431 -3.854 -1.907 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -12.012 -4.741 -2.646 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -10.806 -5.802 -1.946 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.099 -4.394 -0.603 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -12.504 -6.022 -0.349 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -11.909 -4.076 1.392 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -10.723 -5.306 1.005 1.00 0.00 H new ATOM 536 N ASN A 38 -11.716 -1.644 -1.669 1.00 0.00 N ATOM 537 CA ASN A 38 -12.313 -0.433 -2.226 1.00 0.00 C ATOM 538 C ASN A 38 -11.246 0.536 -2.723 1.00 0.00 C ATOM 539 O ASN A 38 -11.473 1.292 -3.649 1.00 0.00 O ATOM 540 CB ASN A 38 -13.183 0.270 -1.162 1.00 0.00 C ATOM 541 CG ASN A 38 -14.351 -0.576 -0.652 1.00 0.00 C ATOM 542 OD1 ASN A 38 -14.293 -1.805 -0.639 1.00 0.00 O ATOM 543 ND2 ASN A 38 -15.395 0.066 -0.199 1.00 0.00 N ATOM 0 H ASN A 38 -11.959 -1.793 -0.690 1.00 0.00 H new ATOM 0 HA ASN A 38 -12.932 -0.731 -3.072 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -12.552 0.546 -0.317 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -13.575 1.196 -1.583 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -16.189 -0.452 0.178 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -15.416 1.086 -0.222 1.00 0.00 H new ATOM 550 N ALA A 39 -10.086 0.502 -2.115 1.00 0.00 N ATOM 551 CA ALA A 39 -9.022 1.405 -2.500 1.00 0.00 C ATOM 552 C ALA A 39 -7.843 0.654 -3.082 1.00 0.00 C ATOM 553 O ALA A 39 -6.800 1.221 -3.340 1.00 0.00 O ATOM 554 CB ALA A 39 -8.578 2.217 -1.306 1.00 0.00 C ATOM 0 H ALA A 39 -9.852 -0.137 -1.355 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.409 2.072 -3.270 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.777 2.894 -1.604 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -9.420 2.796 -0.926 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -8.216 1.548 -0.525 1.00 0.00 H new ATOM 560 N LEU A 40 -7.997 -0.608 -3.299 1.00 0.00 N ATOM 561 CA LEU A 40 -6.879 -1.389 -3.783 1.00 0.00 C ATOM 562 C LEU A 40 -7.107 -2.050 -5.126 1.00 0.00 C ATOM 563 O LEU A 40 -6.326 -1.854 -6.052 1.00 0.00 O ATOM 564 CB LEU A 40 -6.365 -2.402 -2.744 1.00 0.00 C ATOM 565 CG LEU A 40 -5.368 -1.906 -1.677 1.00 0.00 C ATOM 566 CD1 LEU A 40 -5.960 -0.849 -0.764 1.00 0.00 C ATOM 567 CD2 LEU A 40 -4.826 -3.072 -0.873 1.00 0.00 C ATOM 0 H LEU A 40 -8.864 -1.126 -3.156 1.00 0.00 H new ATOM 0 HA LEU A 40 -6.094 -0.650 -3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.230 -2.816 -2.225 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.894 -3.224 -3.284 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.545 -1.429 -2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.212 -0.539 -0.034 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.268 0.012 -1.357 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -6.825 -1.260 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.124 -2.703 -0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.649 -3.585 -0.376 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.314 -3.767 -1.539 1.00 0.00 H new ATOM 579 N LYS A 41 -8.173 -2.801 -5.263 1.00 0.00 N ATOM 580 CA LYS A 41 -8.351 -3.570 -6.473 1.00 0.00 C ATOM 581 C LYS A 41 -8.886 -2.691 -7.612 1.00 0.00 C ATOM 582 O LYS A 41 -9.697 -1.767 -7.387 1.00 0.00 O ATOM 583 CB LYS A 41 -9.202 -4.831 -6.215 1.00 0.00 C ATOM 584 CG LYS A 41 -10.647 -4.570 -5.858 1.00 0.00 C ATOM 585 CD LYS A 41 -11.372 -5.830 -5.374 1.00 0.00 C ATOM 586 CE LYS A 41 -11.218 -7.020 -6.324 1.00 0.00 C ATOM 587 NZ LYS A 41 -12.057 -8.166 -5.896 1.00 0.00 N ATOM 0 H LYS A 41 -8.915 -2.897 -4.570 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.377 -3.931 -6.803 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.172 -5.459 -7.106 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.742 -5.401 -5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.693 -3.808 -5.080 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -11.166 -4.169 -6.729 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.989 -6.106 -4.392 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -12.432 -5.607 -5.252 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.497 -6.720 -7.334 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -10.172 -7.326 -6.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.930 -8.956 -6.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.773 -8.467 -4.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -13.057 -7.880 -5.886 1.00 0.00 H new ATOM 601 N GLN A 42 -8.393 -2.960 -8.816 1.00 0.00 N ATOM 602 CA GLN A 42 -8.660 -2.202 -9.987 1.00 0.00 C ATOM 603 C GLN A 42 -10.164 -2.125 -10.248 1.00 0.00 C ATOM 604 O GLN A 42 -10.885 -3.134 -10.171 1.00 0.00 O ATOM 605 CB GLN A 42 -7.882 -2.852 -11.147 1.00 0.00 C ATOM 606 CG GLN A 42 -7.598 -1.937 -12.304 1.00 0.00 C ATOM 607 CD GLN A 42 -8.790 -1.565 -13.107 1.00 0.00 C ATOM 608 OE1 GLN A 42 -9.738 -2.330 -13.262 1.00 0.00 O ATOM 609 NE2 GLN A 42 -8.767 -0.389 -13.558 1.00 0.00 N ATOM 0 H GLN A 42 -7.772 -3.751 -8.987 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.328 -1.170 -9.874 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.936 -3.234 -10.763 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -8.448 -3.710 -11.510 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.134 -1.027 -11.924 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -6.871 -2.417 -12.959 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.951 0.203 -13.398 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -9.564 -0.028 -14.083 1.00 0.00 H new ATOM 618 N GLY A 43 -10.618 -0.929 -10.523 1.00 0.00 N ATOM 619 CA GLY A 43 -12.011 -0.674 -10.724 1.00 0.00 C ATOM 620 C GLY A 43 -12.552 0.131 -9.577 1.00 0.00 C ATOM 621 O GLY A 43 -13.292 1.091 -9.765 1.00 0.00 O ATOM 0 H GLY A 43 -10.024 -0.104 -10.613 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -12.160 -0.136 -11.660 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -12.554 -1.615 -10.808 1.00 0.00 H new ATOM 625 N TYR A 44 -12.147 -0.241 -8.388 1.00 0.00 N ATOM 626 CA TYR A 44 -12.585 0.417 -7.178 1.00 0.00 C ATOM 627 C TYR A 44 -11.657 1.579 -6.840 1.00 0.00 C ATOM 628 O TYR A 44 -12.117 2.694 -6.630 1.00 0.00 O ATOM 629 CB TYR A 44 -12.598 -0.576 -6.008 1.00 0.00 C ATOM 630 CG TYR A 44 -13.543 -1.757 -6.150 1.00 0.00 C ATOM 631 CD1 TYR A 44 -13.261 -2.799 -7.019 1.00 0.00 C ATOM 632 CD2 TYR A 44 -14.697 -1.842 -5.385 1.00 0.00 C ATOM 633 CE1 TYR A 44 -14.097 -3.887 -7.125 1.00 0.00 C ATOM 634 CE2 TYR A 44 -15.544 -2.929 -5.490 1.00 0.00 C ATOM 635 CZ TYR A 44 -15.234 -3.949 -6.364 1.00 0.00 C ATOM 636 OH TYR A 44 -16.062 -5.045 -6.469 1.00 0.00 O ATOM 0 H TYR A 44 -11.500 -1.014 -8.230 1.00 0.00 H new ATOM 0 HA TYR A 44 -13.593 0.797 -7.342 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -11.587 -0.959 -5.871 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -12.859 -0.034 -5.099 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -12.368 -2.756 -7.625 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -14.938 -1.046 -4.696 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -13.857 -4.690 -7.806 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -16.442 -2.979 -4.892 1.00 0.00 H new ATOM 0 HH TYR A 44 -16.825 -4.938 -5.863 1.00 0.00 H new ATOM 646 N ARG A 45 -10.343 1.293 -6.841 1.00 0.00 N ATOM 647 CA ARG A 45 -9.275 2.254 -6.444 1.00 0.00 C ATOM 648 C ARG A 45 -9.350 3.659 -7.056 1.00 0.00 C ATOM 649 O ARG A 45 -8.807 3.901 -8.155 1.00 0.00 O ATOM 650 CB ARG A 45 -7.865 1.692 -6.686 1.00 0.00 C ATOM 651 CG ARG A 45 -7.677 1.044 -8.049 1.00 0.00 C ATOM 652 CD ARG A 45 -6.252 1.180 -8.569 1.00 0.00 C ATOM 653 NE ARG A 45 -5.985 2.533 -9.098 1.00 0.00 N ATOM 654 CZ ARG A 45 -4.971 2.850 -9.943 1.00 0.00 C ATOM 655 NH1 ARG A 45 -3.963 1.979 -10.167 1.00 0.00 N ATOM 656 NH2 ARG A 45 -4.951 4.053 -10.528 1.00 0.00 N ATOM 0 H ARG A 45 -9.979 0.381 -7.119 1.00 0.00 H new ATOM 0 HA ARG A 45 -9.472 2.377 -5.379 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -7.141 2.499 -6.577 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -7.642 0.957 -5.913 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -7.937 -0.013 -7.984 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.365 1.499 -8.762 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.550 0.960 -7.765 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -6.080 0.443 -9.354 1.00 0.00 H new ATOM 0 HE ARG A 45 -6.609 3.285 -8.807 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -3.959 1.073 -9.699 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -3.206 2.228 -10.804 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -5.694 4.725 -10.338 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -4.192 4.298 -11.164 1.00 0.00 H new ATOM 670 N GLU A 46 -10.034 4.555 -6.353 1.00 0.00 N ATOM 671 CA GLU A 46 -10.081 5.987 -6.642 1.00 0.00 C ATOM 672 C GLU A 46 -11.145 6.596 -5.740 1.00 0.00 C ATOM 673 O GLU A 46 -12.170 5.953 -5.479 1.00 0.00 O ATOM 674 CB GLU A 46 -10.419 6.299 -8.114 1.00 0.00 C ATOM 675 CG GLU A 46 -10.090 7.731 -8.508 1.00 0.00 C ATOM 676 CD GLU A 46 -8.589 8.012 -8.420 1.00 0.00 C ATOM 677 OE1 GLU A 46 -8.026 8.029 -7.304 1.00 0.00 O ATOM 678 OE2 GLU A 46 -7.941 8.171 -9.462 1.00 0.00 O ATOM 0 H GLU A 46 -10.591 4.297 -5.538 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.092 6.408 -6.459 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.869 5.615 -8.760 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.480 6.116 -8.284 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.436 7.917 -9.525 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.628 8.420 -7.857 1.00 0.00 H new ATOM 685 N ASP A 47 -10.925 7.808 -5.255 1.00 0.00 N ATOM 686 CA ASP A 47 -11.899 8.425 -4.357 1.00 0.00 C ATOM 687 C ASP A 47 -13.105 8.887 -5.120 1.00 0.00 C ATOM 688 O ASP A 47 -12.989 9.556 -6.162 1.00 0.00 O ATOM 689 CB ASP A 47 -11.316 9.579 -3.545 1.00 0.00 C ATOM 690 CG ASP A 47 -12.316 10.151 -2.562 1.00 0.00 C ATOM 691 OD1 ASP A 47 -12.608 9.489 -1.541 1.00 0.00 O ATOM 692 OD2 ASP A 47 -12.842 11.251 -2.808 1.00 0.00 O ATOM 0 H ASP A 47 -10.103 8.376 -5.459 1.00 0.00 H new ATOM 0 HA ASP A 47 -12.193 7.653 -3.646 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.436 9.232 -3.004 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -10.984 10.366 -4.222 1.00 0.00 H new ATOM 697 N GLU A 48 -14.243 8.527 -4.615 1.00 0.00 N ATOM 698 CA GLU A 48 -15.512 8.814 -5.227 1.00 0.00 C ATOM 699 C GLU A 48 -16.565 8.698 -4.156 1.00 0.00 C ATOM 700 O GLU A 48 -17.361 9.604 -3.925 1.00 0.00 O ATOM 701 CB GLU A 48 -15.767 7.788 -6.329 1.00 0.00 C ATOM 702 CG GLU A 48 -17.078 7.945 -7.050 1.00 0.00 C ATOM 703 CD GLU A 48 -17.255 6.890 -8.094 1.00 0.00 C ATOM 704 OE1 GLU A 48 -17.752 5.796 -7.767 1.00 0.00 O ATOM 705 OE2 GLU A 48 -16.887 7.135 -9.265 1.00 0.00 O ATOM 0 H GLU A 48 -14.322 8.010 -3.740 1.00 0.00 H new ATOM 0 HA GLU A 48 -15.529 9.812 -5.664 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -14.959 7.851 -7.058 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -15.726 6.790 -5.893 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -17.898 7.892 -6.334 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -17.124 8.930 -7.514 1.00 0.00 H new ATOM 712 N GLY A 49 -16.540 7.583 -3.511 1.00 0.00 N ATOM 713 CA GLY A 49 -17.398 7.303 -2.413 1.00 0.00 C ATOM 714 C GLY A 49 -16.748 6.249 -1.613 1.00 0.00 C ATOM 715 O GLY A 49 -16.465 6.423 -0.428 1.00 0.00 O ATOM 0 H GLY A 49 -15.904 6.819 -3.740 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -17.560 8.198 -1.812 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -18.376 6.973 -2.763 1.00 0.00 H new ATOM 719 N LEU A 50 -16.459 5.150 -2.268 1.00 0.00 N ATOM 720 CA LEU A 50 -15.733 4.107 -1.641 1.00 0.00 C ATOM 721 C LEU A 50 -14.243 4.411 -1.652 1.00 0.00 C ATOM 722 O LEU A 50 -13.705 4.921 -2.633 1.00 0.00 O ATOM 723 CB LEU A 50 -16.096 2.697 -2.207 1.00 0.00 C ATOM 724 CG LEU A 50 -15.909 2.397 -3.718 1.00 0.00 C ATOM 725 CD1 LEU A 50 -14.455 2.383 -4.128 1.00 0.00 C ATOM 726 CD2 LEU A 50 -16.546 1.072 -4.061 1.00 0.00 C ATOM 0 H LEU A 50 -16.722 4.968 -3.237 1.00 0.00 H new ATOM 0 HA LEU A 50 -16.036 4.064 -0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -15.507 1.965 -1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -17.143 2.510 -1.966 1.00 0.00 H new ATOM 0 HG LEU A 50 -16.396 3.201 -4.269 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -14.380 2.169 -5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -14.009 3.356 -3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -13.926 1.614 -3.565 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -16.411 0.868 -5.123 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -16.077 0.281 -3.477 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -17.611 1.110 -3.831 1.00 0.00 H new ATOM 738 N ASN A 51 -13.630 4.183 -0.540 1.00 0.00 N ATOM 739 CA ASN A 51 -12.216 4.360 -0.329 1.00 0.00 C ATOM 740 C ASN A 51 -11.882 3.577 0.898 1.00 0.00 C ATOM 741 O ASN A 51 -12.788 3.057 1.518 1.00 0.00 O ATOM 742 CB ASN A 51 -11.807 5.861 -0.193 1.00 0.00 C ATOM 743 CG ASN A 51 -12.506 6.631 0.933 1.00 0.00 C ATOM 744 OD1 ASN A 51 -12.896 6.073 1.953 1.00 0.00 O ATOM 745 ND2 ASN A 51 -12.671 7.920 0.745 1.00 0.00 N ATOM 0 H ASN A 51 -14.117 3.852 0.293 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.654 4.004 -1.193 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -10.730 5.914 -0.033 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -12.014 6.364 -1.138 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -13.134 8.484 1.458 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -12.336 8.357 -0.114 1.00 0.00 H new ATOM 752 N LEU A 52 -10.647 3.395 1.201 1.00 0.00 N ATOM 753 CA LEU A 52 -10.291 2.765 2.449 1.00 0.00 C ATOM 754 C LEU A 52 -9.942 3.829 3.452 1.00 0.00 C ATOM 755 O LEU A 52 -8.940 4.488 3.318 1.00 0.00 O ATOM 756 CB LEU A 52 -9.113 1.803 2.287 1.00 0.00 C ATOM 757 CG LEU A 52 -8.528 1.237 3.594 1.00 0.00 C ATOM 758 CD1 LEU A 52 -9.556 0.446 4.398 1.00 0.00 C ATOM 759 CD2 LEU A 52 -7.297 0.412 3.316 1.00 0.00 C ATOM 0 H LEU A 52 -9.859 3.667 0.614 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.145 2.182 2.793 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -9.432 0.969 1.662 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.318 2.319 1.748 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.239 2.088 4.211 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -9.093 0.069 5.310 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.392 1.095 4.658 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -9.918 -0.391 3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.901 0.022 4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.556 -0.418 2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -6.543 1.034 2.834 1.00 0.00 H new ATOM 771 N GLU A 53 -10.765 4.023 4.433 1.00 0.00 N ATOM 772 CA GLU A 53 -10.450 4.998 5.434 1.00 0.00 C ATOM 773 C GLU A 53 -10.619 4.426 6.821 1.00 0.00 C ATOM 774 O GLU A 53 -11.633 3.785 7.134 1.00 0.00 O ATOM 775 CB GLU A 53 -11.244 6.310 5.266 1.00 0.00 C ATOM 776 CG GLU A 53 -12.749 6.167 5.334 1.00 0.00 C ATOM 777 CD GLU A 53 -13.471 7.500 5.327 1.00 0.00 C ATOM 778 OE1 GLU A 53 -13.643 8.078 6.410 1.00 0.00 O ATOM 779 OE2 GLU A 53 -13.898 7.976 4.251 1.00 0.00 O ATOM 0 H GLU A 53 -11.648 3.529 4.564 1.00 0.00 H new ATOM 0 HA GLU A 53 -9.400 5.257 5.296 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -10.926 7.009 6.039 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -10.981 6.755 4.306 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.090 5.571 4.488 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.016 5.620 6.238 1.00 0.00 H new ATOM 786 N SER A 54 -9.628 4.621 7.628 1.00 0.00 N ATOM 787 CA SER A 54 -9.654 4.175 8.975 1.00 0.00 C ATOM 788 C SER A 54 -10.072 5.325 9.873 1.00 0.00 C ATOM 789 O SER A 54 -9.351 6.327 9.993 1.00 0.00 O ATOM 790 CB SER A 54 -8.274 3.661 9.353 1.00 0.00 C ATOM 791 OG SER A 54 -7.293 4.664 9.123 1.00 0.00 O ATOM 0 H SER A 54 -8.768 5.101 7.363 1.00 0.00 H new ATOM 0 HA SER A 54 -10.373 3.364 9.095 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.263 3.366 10.402 1.00 0.00 H new ATOM 0 HB3 SER A 54 -8.038 2.771 8.770 1.00 0.00 H new ATOM 0 HG SER A 54 -7.668 5.544 9.339 1.00 0.00 H new ATOM 797 N ASP A 55 -11.238 5.212 10.460 1.00 0.00 N ATOM 798 CA ASP A 55 -11.739 6.254 11.351 1.00 0.00 C ATOM 799 C ASP A 55 -11.581 5.861 12.814 1.00 0.00 C ATOM 800 O ASP A 55 -11.298 6.704 13.663 1.00 0.00 O ATOM 801 CB ASP A 55 -13.192 6.576 11.030 1.00 0.00 C ATOM 802 CG ASP A 55 -13.777 7.617 11.948 1.00 0.00 C ATOM 803 OD1 ASP A 55 -13.489 8.811 11.767 1.00 0.00 O ATOM 804 OD2 ASP A 55 -14.551 7.255 12.848 1.00 0.00 O ATOM 0 H ASP A 55 -11.864 4.415 10.344 1.00 0.00 H new ATOM 0 HA ASP A 55 -11.141 7.150 11.187 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -13.263 6.926 10.000 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -13.785 5.664 11.098 1.00 0.00 H new ATOM 809 N ALA A 56 -11.754 4.571 13.099 1.00 0.00 N ATOM 810 CA ALA A 56 -11.598 4.045 14.462 1.00 0.00 C ATOM 811 C ALA A 56 -10.170 4.284 14.933 1.00 0.00 C ATOM 812 O ALA A 56 -9.924 4.789 16.036 1.00 0.00 O ATOM 813 CB ALA A 56 -11.930 2.558 14.493 1.00 0.00 C ATOM 0 H ALA A 56 -12.003 3.866 12.405 1.00 0.00 H new ATOM 0 HA ALA A 56 -12.286 4.561 15.132 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -11.811 2.180 15.508 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -12.960 2.408 14.169 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -11.257 2.021 13.824 1.00 0.00 H new ATOM 819 N ASP A 57 -9.247 3.929 14.081 1.00 0.00 N ATOM 820 CA ASP A 57 -7.831 4.175 14.297 1.00 0.00 C ATOM 821 C ASP A 57 -7.355 4.953 13.112 1.00 0.00 C ATOM 822 O ASP A 57 -7.919 4.808 12.053 1.00 0.00 O ATOM 823 CB ASP A 57 -7.028 2.854 14.363 1.00 0.00 C ATOM 824 CG ASP A 57 -7.420 1.938 15.499 1.00 0.00 C ATOM 825 OD1 ASP A 57 -6.923 2.122 16.618 1.00 0.00 O ATOM 826 OD2 ASP A 57 -8.219 1.003 15.283 1.00 0.00 O ATOM 0 H ASP A 57 -9.451 3.453 13.202 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.687 4.703 15.240 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -7.155 2.319 13.422 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.968 3.092 14.454 1.00 0.00 H new ATOM 831 N GLU A 58 -6.348 5.780 13.261 1.00 0.00 N ATOM 832 CA GLU A 58 -5.818 6.492 12.099 1.00 0.00 C ATOM 833 C GLU A 58 -4.563 5.795 11.617 1.00 0.00 C ATOM 834 O GLU A 58 -3.865 6.260 10.715 1.00 0.00 O ATOM 835 CB GLU A 58 -5.567 7.977 12.388 1.00 0.00 C ATOM 836 CG GLU A 58 -4.487 8.280 13.402 1.00 0.00 C ATOM 837 CD GLU A 58 -4.380 9.759 13.680 1.00 0.00 C ATOM 838 OE1 GLU A 58 -4.074 10.538 12.751 1.00 0.00 O ATOM 839 OE2 GLU A 58 -4.622 10.165 14.822 1.00 0.00 O ATOM 0 H GLU A 58 -5.882 5.981 14.146 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.568 6.467 11.308 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.308 8.471 11.451 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.499 8.422 12.735 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -4.701 7.750 14.330 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -3.530 7.909 13.036 1.00 0.00 H new ATOM 846 N GLN A 59 -4.319 4.662 12.217 1.00 0.00 N ATOM 847 CA GLN A 59 -3.217 3.818 11.896 1.00 0.00 C ATOM 848 C GLN A 59 -3.804 2.671 11.146 1.00 0.00 C ATOM 849 O GLN A 59 -4.769 2.053 11.621 1.00 0.00 O ATOM 850 CB GLN A 59 -2.541 3.310 13.166 1.00 0.00 C ATOM 851 CG GLN A 59 -2.022 4.396 14.077 1.00 0.00 C ATOM 852 CD GLN A 59 -1.326 3.844 15.299 1.00 0.00 C ATOM 853 OE1 GLN A 59 -0.114 3.618 15.294 1.00 0.00 O ATOM 854 NE2 GLN A 59 -2.074 3.612 16.342 1.00 0.00 N ATOM 0 H GLN A 59 -4.905 4.295 12.967 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.462 4.350 11.317 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -3.252 2.697 13.720 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.711 2.661 12.886 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.329 5.029 13.523 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.852 5.030 14.391 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -3.074 3.812 16.307 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -1.659 3.230 17.192 1.00 0.00 H new ATOM 863 N LEU A 60 -3.271 2.374 10.015 1.00 0.00 N ATOM 864 CA LEU A 60 -3.882 1.406 9.184 1.00 0.00 C ATOM 865 C LEU A 60 -2.821 0.438 8.678 1.00 0.00 C ATOM 866 O LEU A 60 -1.753 0.849 8.220 1.00 0.00 O ATOM 867 CB LEU A 60 -4.650 2.144 8.062 1.00 0.00 C ATOM 868 CG LEU A 60 -5.851 1.430 7.426 1.00 0.00 C ATOM 869 CD1 LEU A 60 -6.630 2.406 6.588 1.00 0.00 C ATOM 870 CD2 LEU A 60 -5.427 0.269 6.572 1.00 0.00 C ATOM 0 H LEU A 60 -2.415 2.788 9.646 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.610 0.801 9.725 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -5.001 3.094 8.465 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -3.940 2.377 7.268 1.00 0.00 H new ATOM 0 HG LEU A 60 -6.472 1.042 8.234 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -7.483 1.899 6.137 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.985 3.223 7.216 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.988 2.805 5.803 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.308 -0.207 6.142 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.779 0.624 5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.886 -0.454 7.183 1.00 0.00 H new ATOM 882 N LEU A 61 -3.109 -0.835 8.791 1.00 0.00 N ATOM 883 CA LEU A 61 -2.155 -1.868 8.465 1.00 0.00 C ATOM 884 C LEU A 61 -2.809 -2.922 7.548 1.00 0.00 C ATOM 885 O LEU A 61 -3.939 -3.382 7.809 1.00 0.00 O ATOM 886 CB LEU A 61 -1.627 -2.456 9.805 1.00 0.00 C ATOM 887 CG LEU A 61 -0.461 -3.465 9.779 1.00 0.00 C ATOM 888 CD1 LEU A 61 0.119 -3.591 11.166 1.00 0.00 C ATOM 889 CD2 LEU A 61 -0.939 -4.824 9.364 1.00 0.00 C ATOM 0 H LEU A 61 -4.012 -1.185 9.112 1.00 0.00 H new ATOM 0 HA LEU A 61 -1.307 -1.475 7.904 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.322 -1.619 10.432 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.467 -2.939 10.304 1.00 0.00 H new ATOM 0 HG LEU A 61 0.283 -3.103 9.069 1.00 0.00 H new ATOM 0 HD11 LEU A 61 0.944 -4.304 11.152 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.485 -2.619 11.497 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.652 -3.942 11.852 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.098 -5.518 9.353 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.691 -5.176 10.070 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.375 -4.767 8.367 1.00 0.00 H new ATOM 901 N ILE A 62 -2.111 -3.285 6.473 1.00 0.00 N ATOM 902 CA ILE A 62 -2.632 -4.232 5.480 1.00 0.00 C ATOM 903 C ILE A 62 -1.579 -5.310 5.203 1.00 0.00 C ATOM 904 O ILE A 62 -0.392 -5.025 5.220 1.00 0.00 O ATOM 905 CB ILE A 62 -2.951 -3.558 4.082 1.00 0.00 C ATOM 906 CG1 ILE A 62 -3.723 -2.229 4.192 1.00 0.00 C ATOM 907 CG2 ILE A 62 -3.715 -4.516 3.177 1.00 0.00 C ATOM 908 CD1 ILE A 62 -2.854 -1.027 4.542 1.00 0.00 C ATOM 0 H ILE A 62 -1.176 -2.936 6.264 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.553 -4.634 5.903 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.979 -3.325 3.646 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -4.227 -2.035 3.245 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.499 -2.335 4.950 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.922 -4.029 2.224 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -3.116 -5.410 3.005 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.655 -4.795 3.653 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.475 -0.133 4.600 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.370 -1.195 5.504 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.094 -0.891 3.773 1.00 0.00 H new ATOM 920 N TYR A 63 -2.022 -6.518 4.951 1.00 0.00 N ATOM 921 CA TYR A 63 -1.160 -7.614 4.559 1.00 0.00 C ATOM 922 C TYR A 63 -1.519 -8.003 3.126 1.00 0.00 C ATOM 923 O TYR A 63 -2.680 -8.358 2.835 1.00 0.00 O ATOM 924 CB TYR A 63 -1.348 -8.827 5.499 1.00 0.00 C ATOM 925 CG TYR A 63 -0.492 -10.041 5.140 1.00 0.00 C ATOM 926 CD1 TYR A 63 -0.863 -10.900 4.104 1.00 0.00 C ATOM 927 CD2 TYR A 63 0.680 -10.317 5.823 1.00 0.00 C ATOM 928 CE1 TYR A 63 -0.094 -11.986 3.766 1.00 0.00 C ATOM 929 CE2 TYR A 63 1.459 -11.409 5.487 1.00 0.00 C ATOM 930 CZ TYR A 63 1.065 -12.239 4.460 1.00 0.00 C ATOM 931 OH TYR A 63 1.844 -13.327 4.121 1.00 0.00 O ATOM 0 H TYR A 63 -3.007 -6.774 5.013 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.117 -7.304 4.624 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -1.114 -8.521 6.519 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.397 -9.121 5.488 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -1.774 -10.706 3.557 1.00 0.00 H new ATOM 0 HD2 TYR A 63 0.991 -9.670 6.630 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -0.398 -12.637 2.960 1.00 0.00 H new ATOM 0 HE2 TYR A 63 2.372 -11.610 6.027 1.00 0.00 H new ATOM 0 HH TYR A 63 2.628 -13.363 4.707 1.00 0.00 H new ATOM 941 N ILE A 64 -0.560 -7.938 2.238 1.00 0.00 N ATOM 942 CA ILE A 64 -0.805 -8.246 0.852 1.00 0.00 C ATOM 943 C ILE A 64 -0.072 -9.510 0.376 1.00 0.00 C ATOM 944 O ILE A 64 1.157 -9.605 0.479 1.00 0.00 O ATOM 945 CB ILE A 64 -0.450 -7.049 -0.065 1.00 0.00 C ATOM 946 CG1 ILE A 64 -1.383 -5.864 0.246 1.00 0.00 C ATOM 947 CG2 ILE A 64 -0.530 -7.453 -1.532 1.00 0.00 C ATOM 948 CD1 ILE A 64 -1.147 -4.640 -0.604 1.00 0.00 C ATOM 0 H ILE A 64 0.402 -7.673 2.451 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.874 -8.446 0.778 1.00 0.00 H new ATOM 0 HB ILE A 64 0.576 -6.739 0.130 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.416 -6.187 0.115 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.265 -5.591 1.295 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.277 -6.598 -2.159 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.172 -8.265 -1.725 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.542 -7.786 -1.763 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.848 -3.857 -0.316 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -0.127 -4.286 -0.457 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -1.296 -4.892 -1.654 1.00 0.00 H new ATOM 960 N PRO A 65 -0.837 -10.512 -0.120 1.00 0.00 N ATOM 961 CA PRO A 65 -0.284 -11.706 -0.740 1.00 0.00 C ATOM 962 C PRO A 65 -0.124 -11.532 -2.275 1.00 0.00 C ATOM 963 O PRO A 65 -0.977 -10.914 -2.949 1.00 0.00 O ATOM 964 CB PRO A 65 -1.333 -12.772 -0.426 1.00 0.00 C ATOM 965 CG PRO A 65 -2.635 -12.028 -0.291 1.00 0.00 C ATOM 966 CD PRO A 65 -2.306 -10.563 -0.073 1.00 0.00 C ATOM 0 HA PRO A 65 0.712 -11.949 -0.371 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -1.387 -13.516 -1.221 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -1.088 -13.305 0.493 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.243 -12.155 -1.187 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.214 -12.419 0.545 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -2.751 -9.936 -0.845 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -2.686 -10.208 0.885 1.00 0.00 H new ATOM 974 N PHE A 66 0.954 -12.072 -2.805 1.00 0.00 N ATOM 975 CA PHE A 66 1.293 -11.956 -4.227 1.00 0.00 C ATOM 976 C PHE A 66 0.482 -12.825 -5.109 1.00 0.00 C ATOM 977 O PHE A 66 -0.205 -13.765 -4.681 1.00 0.00 O ATOM 978 CB PHE A 66 2.737 -12.316 -4.513 1.00 0.00 C ATOM 979 CG PHE A 66 3.069 -13.807 -4.404 1.00 0.00 C ATOM 980 CD1 PHE A 66 2.687 -14.565 -3.305 1.00 0.00 C ATOM 981 CD2 PHE A 66 3.727 -14.440 -5.434 1.00 0.00 C ATOM 982 CE1 PHE A 66 2.969 -15.908 -3.239 1.00 0.00 C ATOM 983 CE2 PHE A 66 4.008 -15.786 -5.378 1.00 0.00 C ATOM 984 CZ PHE A 66 3.630 -16.520 -4.278 1.00 0.00 C ATOM 0 H PHE A 66 1.632 -12.610 -2.265 1.00 0.00 H new ATOM 0 HA PHE A 66 1.091 -10.907 -4.442 1.00 0.00 H new ATOM 0 HB2 PHE A 66 2.988 -11.976 -5.518 1.00 0.00 H new ATOM 0 HB3 PHE A 66 3.376 -11.766 -3.822 1.00 0.00 H new ATOM 0 HD1 PHE A 66 2.160 -14.092 -2.490 1.00 0.00 H new ATOM 0 HD2 PHE A 66 4.028 -13.871 -6.301 1.00 0.00 H new ATOM 0 HE1 PHE A 66 2.672 -16.482 -2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 66 4.525 -16.265 -6.197 1.00 0.00 H new ATOM 0 HZ PHE A 66 3.852 -17.576 -4.230 1.00 0.00 H new ATOM 994 N ASN A 67 0.561 -12.490 -6.327 1.00 0.00 N ATOM 995 CA ASN A 67 0.037 -13.243 -7.378 1.00 0.00 C ATOM 996 C ASN A 67 1.216 -13.925 -8.071 1.00 0.00 C ATOM 997 O ASN A 67 1.196 -15.124 -8.349 1.00 0.00 O ATOM 998 CB ASN A 67 -0.542 -12.263 -8.278 1.00 0.00 C ATOM 999 CG ASN A 67 -1.392 -12.796 -9.379 1.00 0.00 C ATOM 1000 OD1 ASN A 67 -1.223 -13.911 -9.854 1.00 0.00 O ATOM 1001 ND2 ASN A 67 -2.287 -11.984 -9.806 1.00 0.00 N ATOM 0 H ASN A 67 1.020 -11.633 -6.635 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.691 -13.992 -7.066 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -1.142 -11.570 -7.688 1.00 0.00 H new ATOM 0 HB3 ASN A 67 0.269 -11.685 -8.721 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -2.898 -12.257 -10.576 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -2.388 -11.065 -9.376 1.00 0.00 H new ATOM 1008 N GLN A 68 2.257 -13.129 -8.309 1.00 0.00 N ATOM 1009 CA GLN A 68 3.469 -13.566 -8.965 1.00 0.00 C ATOM 1010 C GLN A 68 4.646 -12.851 -8.326 1.00 0.00 C ATOM 1011 O GLN A 68 4.501 -11.708 -7.884 1.00 0.00 O ATOM 1012 CB GLN A 68 3.415 -13.234 -10.466 1.00 0.00 C ATOM 1013 CG GLN A 68 4.674 -13.630 -11.233 1.00 0.00 C ATOM 1014 CD GLN A 68 4.619 -13.264 -12.695 1.00 0.00 C ATOM 1015 OE1 GLN A 68 4.183 -14.050 -13.529 1.00 0.00 O ATOM 1016 NE2 GLN A 68 5.057 -12.083 -13.016 1.00 0.00 N ATOM 0 H GLN A 68 2.273 -12.145 -8.043 1.00 0.00 H new ATOM 0 HA GLN A 68 3.576 -14.645 -8.855 1.00 0.00 H new ATOM 0 HB2 GLN A 68 2.557 -13.740 -10.909 1.00 0.00 H new ATOM 0 HB3 GLN A 68 3.250 -12.163 -10.586 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.537 -13.146 -10.776 1.00 0.00 H new ATOM 0 HG3 GLN A 68 4.825 -14.705 -11.140 1.00 0.00 H new ATOM 0 HE21 GLN A 68 5.412 -11.457 -12.293 1.00 0.00 H new ATOM 0 HE22 GLN A 68 5.045 -11.782 -13.991 1.00 0.00 H new ATOM 1025 N VAL A 69 5.786 -13.516 -8.250 1.00 0.00 N ATOM 1026 CA VAL A 69 6.971 -12.909 -7.686 1.00 0.00 C ATOM 1027 C VAL A 69 7.602 -11.908 -8.647 1.00 0.00 C ATOM 1028 O VAL A 69 8.016 -12.240 -9.771 1.00 0.00 O ATOM 1029 CB VAL A 69 8.020 -13.940 -7.173 1.00 0.00 C ATOM 1030 CG1 VAL A 69 7.434 -14.750 -6.055 1.00 0.00 C ATOM 1031 CG2 VAL A 69 8.515 -14.864 -8.277 1.00 0.00 C ATOM 0 H VAL A 69 5.912 -14.475 -8.572 1.00 0.00 H new ATOM 0 HA VAL A 69 6.629 -12.367 -6.804 1.00 0.00 H new ATOM 0 HB VAL A 69 8.880 -13.375 -6.813 1.00 0.00 H new ATOM 0 HG11 VAL A 69 8.173 -15.469 -5.701 1.00 0.00 H new ATOM 0 HG12 VAL A 69 7.150 -14.089 -5.237 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.553 -15.282 -6.414 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.244 -15.563 -7.867 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.673 -15.419 -8.692 1.00 0.00 H new ATOM 0 HG23 VAL A 69 8.983 -14.272 -9.064 1.00 0.00 H new ATOM 1041 N ILE A 70 7.632 -10.686 -8.218 1.00 0.00 N ATOM 1042 CA ILE A 70 8.184 -9.600 -8.986 1.00 0.00 C ATOM 1043 C ILE A 70 9.039 -8.804 -8.026 1.00 0.00 C ATOM 1044 O ILE A 70 9.061 -9.127 -6.834 1.00 0.00 O ATOM 1045 CB ILE A 70 7.070 -8.665 -9.606 1.00 0.00 C ATOM 1046 CG1 ILE A 70 6.505 -7.643 -8.602 1.00 0.00 C ATOM 1047 CG2 ILE A 70 5.922 -9.483 -10.188 1.00 0.00 C ATOM 1048 CD1 ILE A 70 5.848 -8.202 -7.332 1.00 0.00 C ATOM 0 H ILE A 70 7.268 -10.403 -7.308 1.00 0.00 H new ATOM 0 HA ILE A 70 8.751 -9.995 -9.829 1.00 0.00 H new ATOM 0 HB ILE A 70 7.568 -8.109 -10.400 1.00 0.00 H new ATOM 0 HG12 ILE A 70 7.317 -6.981 -8.300 1.00 0.00 H new ATOM 0 HG13 ILE A 70 5.769 -7.029 -9.122 1.00 0.00 H new ATOM 0 HG21 ILE A 70 5.172 -8.811 -10.607 1.00 0.00 H new ATOM 0 HG22 ILE A 70 6.302 -10.137 -10.973 1.00 0.00 H new ATOM 0 HG23 ILE A 70 5.470 -10.086 -9.401 1.00 0.00 H new ATOM 0 HD11 ILE A 70 5.494 -7.378 -6.713 1.00 0.00 H new ATOM 0 HD12 ILE A 70 5.006 -8.837 -7.607 1.00 0.00 H new ATOM 0 HD13 ILE A 70 6.577 -8.788 -6.773 1.00 0.00 H new ATOM 1060 N LYS A 71 9.757 -7.827 -8.485 1.00 0.00 N ATOM 1061 CA LYS A 71 10.502 -7.029 -7.553 1.00 0.00 C ATOM 1062 C LYS A 71 9.767 -5.764 -7.218 1.00 0.00 C ATOM 1063 O LYS A 71 9.214 -5.128 -8.094 1.00 0.00 O ATOM 1064 CB LYS A 71 11.927 -6.748 -8.000 1.00 0.00 C ATOM 1065 CG LYS A 71 12.850 -7.953 -7.940 1.00 0.00 C ATOM 1066 CD LYS A 71 12.609 -8.998 -9.027 1.00 0.00 C ATOM 1067 CE LYS A 71 12.892 -8.444 -10.413 1.00 0.00 C ATOM 1068 NZ LYS A 71 12.748 -9.473 -11.459 1.00 0.00 N ATOM 0 H LYS A 71 9.845 -7.565 -9.467 1.00 0.00 H new ATOM 0 HA LYS A 71 10.592 -7.624 -6.644 1.00 0.00 H new ATOM 0 HB2 LYS A 71 11.907 -6.371 -9.023 1.00 0.00 H new ATOM 0 HB3 LYS A 71 12.342 -5.956 -7.376 1.00 0.00 H new ATOM 0 HG2 LYS A 71 13.881 -7.607 -8.010 1.00 0.00 H new ATOM 0 HG3 LYS A 71 12.739 -8.430 -6.966 1.00 0.00 H new ATOM 0 HD2 LYS A 71 13.244 -9.865 -8.845 1.00 0.00 H new ATOM 0 HD3 LYS A 71 11.576 -9.343 -8.977 1.00 0.00 H new ATOM 0 HE2 LYS A 71 12.210 -7.619 -10.620 1.00 0.00 H new ATOM 0 HE3 LYS A 71 13.903 -8.037 -10.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 12.765 -9.021 -12.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 13.533 -10.152 -11.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 11.845 -9.973 -11.332 1.00 0.00 H new ATOM 1082 N LEU A 72 9.749 -5.421 -5.950 1.00 0.00 N ATOM 1083 CA LEU A 72 9.057 -4.240 -5.475 1.00 0.00 C ATOM 1084 C LEU A 72 10.055 -3.084 -5.527 1.00 0.00 C ATOM 1085 O LEU A 72 11.061 -3.087 -4.825 1.00 0.00 O ATOM 1086 CB LEU A 72 8.532 -4.510 -4.029 1.00 0.00 C ATOM 1087 CG LEU A 72 7.505 -3.537 -3.391 1.00 0.00 C ATOM 1088 CD1 LEU A 72 8.046 -2.163 -3.184 1.00 0.00 C ATOM 1089 CD2 LEU A 72 6.240 -3.484 -4.195 1.00 0.00 C ATOM 0 H LEU A 72 10.215 -5.954 -5.215 1.00 0.00 H new ATOM 0 HA LEU A 72 8.192 -3.988 -6.089 1.00 0.00 H new ATOM 0 HB2 LEU A 72 8.085 -5.504 -4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 72 9.399 -4.547 -3.369 1.00 0.00 H new ATOM 0 HG LEU A 72 7.284 -3.940 -2.403 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.278 -1.533 -2.735 1.00 0.00 H new ATOM 0 HD12 LEU A 72 8.911 -2.208 -2.522 1.00 0.00 H new ATOM 0 HD13 LEU A 72 8.346 -1.742 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.539 -2.795 -3.725 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.465 -3.140 -5.205 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.796 -4.478 -4.241 1.00 0.00 H new ATOM 1101 N HIS A 73 9.787 -2.132 -6.379 1.00 0.00 N ATOM 1102 CA HIS A 73 10.729 -1.023 -6.600 1.00 0.00 C ATOM 1103 C HIS A 73 10.191 0.289 -6.044 1.00 0.00 C ATOM 1104 O HIS A 73 10.946 1.101 -5.493 1.00 0.00 O ATOM 1105 CB HIS A 73 11.022 -0.884 -8.115 1.00 0.00 C ATOM 1106 CG HIS A 73 12.087 0.134 -8.505 1.00 0.00 C ATOM 1107 ND1 HIS A 73 12.107 1.491 -8.438 1.00 0.00 N flip ATOM 1108 CD2 HIS A 73 13.281 -0.221 -9.099 1.00 0.00 C flip ATOM 1109 CE1 HIS A 73 13.292 1.907 -8.980 1.00 0.00 C flip ATOM 1110 NE2 HIS A 73 13.980 0.858 -9.368 1.00 0.00 N flip ATOM 0 H HIS A 73 8.935 -2.085 -6.937 1.00 0.00 H new ATOM 0 HA HIS A 73 11.653 -1.250 -6.068 1.00 0.00 H new ATOM 0 HB2 HIS A 73 11.325 -1.859 -8.496 1.00 0.00 H new ATOM 0 HB3 HIS A 73 10.093 -0.619 -8.620 1.00 0.00 H new ATOM 0 HD1 HIS A 73 11.374 2.088 -8.055 1.00 0.00 H new ATOM 0 HD2 HIS A 73 13.593 -1.233 -9.311 1.00 0.00 H new ATOM 0 HE1 HIS A 73 13.611 2.935 -9.074 1.00 0.00 H new ATOM 1119 N SER A 74 8.915 0.492 -6.183 1.00 0.00 N ATOM 1120 CA SER A 74 8.307 1.728 -5.794 1.00 0.00 C ATOM 1121 C SER A 74 6.924 1.473 -5.210 1.00 0.00 C ATOM 1122 O SER A 74 6.405 0.354 -5.274 1.00 0.00 O ATOM 1123 CB SER A 74 8.208 2.648 -7.018 1.00 0.00 C ATOM 1124 OG SER A 74 9.487 2.901 -7.585 1.00 0.00 O ATOM 0 H SER A 74 8.267 -0.194 -6.569 1.00 0.00 H new ATOM 0 HA SER A 74 8.918 2.209 -5.030 1.00 0.00 H new ATOM 0 HB2 SER A 74 7.561 2.191 -7.767 1.00 0.00 H new ATOM 0 HB3 SER A 74 7.744 3.591 -6.729 1.00 0.00 H new ATOM 0 HG SER A 74 9.502 2.584 -8.512 1.00 0.00 H new ATOM 1130 N PHE A 75 6.332 2.489 -4.655 1.00 0.00 N ATOM 1131 CA PHE A 75 5.028 2.366 -4.061 1.00 0.00 C ATOM 1132 C PHE A 75 4.239 3.642 -4.340 1.00 0.00 C ATOM 1133 O PHE A 75 4.832 4.690 -4.623 1.00 0.00 O ATOM 1134 CB PHE A 75 5.180 2.155 -2.539 1.00 0.00 C ATOM 1135 CG PHE A 75 5.734 3.358 -1.809 1.00 0.00 C ATOM 1136 CD1 PHE A 75 7.092 3.586 -1.763 1.00 0.00 C ATOM 1137 CD2 PHE A 75 4.886 4.263 -1.186 1.00 0.00 C ATOM 1138 CE1 PHE A 75 7.607 4.677 -1.118 1.00 0.00 C ATOM 1139 CE2 PHE A 75 5.390 5.366 -0.539 1.00 0.00 C ATOM 1140 CZ PHE A 75 6.756 5.574 -0.503 1.00 0.00 C ATOM 0 H PHE A 75 6.735 3.424 -4.600 1.00 0.00 H new ATOM 0 HA PHE A 75 4.498 1.513 -4.485 1.00 0.00 H new ATOM 0 HB2 PHE A 75 4.207 1.902 -2.118 1.00 0.00 H new ATOM 0 HB3 PHE A 75 5.835 1.302 -2.363 1.00 0.00 H new ATOM 0 HD1 PHE A 75 7.763 2.890 -2.245 1.00 0.00 H new ATOM 0 HD2 PHE A 75 3.819 4.099 -1.210 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.675 4.836 -1.090 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.722 6.067 -0.061 1.00 0.00 H new ATOM 0 HZ PHE A 75 7.158 6.438 0.006 1.00 0.00 H new ATOM 1150 N ALA A 76 2.932 3.559 -4.289 1.00 0.00 N ATOM 1151 CA ALA A 76 2.084 4.717 -4.448 1.00 0.00 C ATOM 1152 C ALA A 76 0.821 4.550 -3.661 1.00 0.00 C ATOM 1153 O ALA A 76 0.271 3.452 -3.576 1.00 0.00 O ATOM 1154 CB ALA A 76 1.744 4.977 -5.892 1.00 0.00 C ATOM 0 H ALA A 76 2.425 2.687 -4.136 1.00 0.00 H new ATOM 0 HA ALA A 76 2.642 5.575 -4.074 1.00 0.00 H new ATOM 0 HB1 ALA A 76 1.105 5.857 -5.963 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.661 5.148 -6.457 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.220 4.114 -6.303 1.00 0.00 H new ATOM 1160 N ILE A 77 0.356 5.615 -3.118 1.00 0.00 N ATOM 1161 CA ILE A 77 -0.815 5.634 -2.299 1.00 0.00 C ATOM 1162 C ILE A 77 -1.488 6.945 -2.561 1.00 0.00 C ATOM 1163 O ILE A 77 -0.821 7.957 -2.685 1.00 0.00 O ATOM 1164 CB ILE A 77 -0.474 5.560 -0.758 1.00 0.00 C ATOM 1165 CG1 ILE A 77 0.382 4.321 -0.427 1.00 0.00 C ATOM 1166 CG2 ILE A 77 -1.755 5.550 0.074 1.00 0.00 C ATOM 1167 CD1 ILE A 77 0.764 4.200 1.033 1.00 0.00 C ATOM 0 H ILE A 77 0.789 6.531 -3.231 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.435 4.770 -2.540 1.00 0.00 H new ATOM 0 HB ILE A 77 0.107 6.448 -0.507 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.165 3.426 -0.723 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.291 4.351 -1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.501 5.499 1.133 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -2.322 6.461 -0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.358 4.683 -0.197 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.365 3.302 1.179 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.341 5.075 1.332 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.138 4.136 1.641 1.00 0.00 H new ATOM 1179 N LYS A 78 -2.766 6.938 -2.694 1.00 0.00 N ATOM 1180 CA LYS A 78 -3.468 8.173 -2.835 1.00 0.00 C ATOM 1181 C LYS A 78 -4.318 8.399 -1.631 1.00 0.00 C ATOM 1182 O LYS A 78 -4.707 7.449 -0.937 1.00 0.00 O ATOM 1183 CB LYS A 78 -4.361 8.261 -4.057 1.00 0.00 C ATOM 1184 CG LYS A 78 -3.725 8.259 -5.414 1.00 0.00 C ATOM 1185 CD LYS A 78 -4.783 8.675 -6.428 1.00 0.00 C ATOM 1186 CE LYS A 78 -4.353 8.495 -7.863 1.00 0.00 C ATOM 1187 NZ LYS A 78 -5.409 8.937 -8.807 1.00 0.00 N ATOM 0 H LYS A 78 -3.348 6.100 -2.709 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.695 8.932 -2.951 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -5.059 7.424 -4.018 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -4.952 9.173 -3.970 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.880 8.947 -5.440 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -3.337 7.269 -5.652 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -5.689 8.094 -6.254 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -5.039 9.722 -6.264 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -3.441 9.063 -8.044 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -4.117 7.446 -8.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -4.992 9.091 -9.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -6.146 8.206 -8.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -5.830 9.825 -8.466 1.00 0.00 H new ATOM 1201 N GLY A 79 -4.633 9.613 -1.410 1.00 0.00 N ATOM 1202 CA GLY A 79 -5.449 9.996 -0.326 1.00 0.00 C ATOM 1203 C GLY A 79 -5.996 11.344 -0.602 1.00 0.00 C ATOM 1204 O GLY A 79 -5.680 11.916 -1.644 1.00 0.00 O ATOM 0 H GLY A 79 -4.323 10.391 -1.992 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.259 9.279 -0.190 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.872 10.004 0.598 1.00 0.00 H new ATOM 1208 N PRO A 80 -6.814 11.892 0.267 1.00 0.00 N ATOM 1209 CA PRO A 80 -7.315 13.222 0.088 1.00 0.00 C ATOM 1210 C PRO A 80 -6.235 14.230 0.410 1.00 0.00 C ATOM 1211 O PRO A 80 -5.267 13.913 1.120 1.00 0.00 O ATOM 1212 CB PRO A 80 -8.461 13.338 1.098 1.00 0.00 C ATOM 1213 CG PRO A 80 -8.650 11.965 1.627 1.00 0.00 C ATOM 1214 CD PRO A 80 -7.337 11.274 1.468 1.00 0.00 C ATOM 0 HA PRO A 80 -7.639 13.413 -0.935 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.214 14.038 1.896 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.370 13.706 0.622 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -8.953 11.989 2.674 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.434 11.442 1.080 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.685 11.435 2.327 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.454 10.196 1.354 1.00 0.00 H new ATOM 1222 N GLU A 81 -6.418 15.426 -0.090 1.00 0.00 N ATOM 1223 CA GLU A 81 -5.497 16.547 0.086 1.00 0.00 C ATOM 1224 C GLU A 81 -5.163 16.793 1.566 1.00 0.00 C ATOM 1225 O GLU A 81 -4.062 17.249 1.905 1.00 0.00 O ATOM 1226 CB GLU A 81 -6.134 17.796 -0.538 1.00 0.00 C ATOM 1227 CG GLU A 81 -7.505 18.126 0.042 1.00 0.00 C ATOM 1228 CD GLU A 81 -8.183 19.271 -0.646 1.00 0.00 C ATOM 1229 OE1 GLU A 81 -7.964 20.432 -0.243 1.00 0.00 O ATOM 1230 OE2 GLU A 81 -8.956 19.032 -1.587 1.00 0.00 O ATOM 0 H GLU A 81 -7.236 15.666 -0.651 1.00 0.00 H new ATOM 0 HA GLU A 81 -4.555 16.312 -0.410 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.470 18.647 -0.389 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.228 17.649 -1.614 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -8.141 17.244 -0.025 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -7.396 18.361 1.101 1.00 0.00 H new ATOM 1237 N GLU A 82 -6.101 16.469 2.430 1.00 0.00 N ATOM 1238 CA GLU A 82 -5.942 16.680 3.836 1.00 0.00 C ATOM 1239 C GLU A 82 -5.391 15.489 4.595 1.00 0.00 C ATOM 1240 O GLU A 82 -4.360 15.603 5.264 1.00 0.00 O ATOM 1241 CB GLU A 82 -7.246 17.046 4.441 1.00 0.00 C ATOM 1242 CG GLU A 82 -7.737 18.441 4.126 1.00 0.00 C ATOM 1243 CD GLU A 82 -6.752 19.507 4.545 1.00 0.00 C ATOM 1244 OE1 GLU A 82 -6.729 19.876 5.738 1.00 0.00 O ATOM 1245 OE2 GLU A 82 -5.997 20.008 3.686 1.00 0.00 O ATOM 0 H GLU A 82 -6.994 16.052 2.167 1.00 0.00 H new ATOM 0 HA GLU A 82 -5.209 17.482 3.923 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.997 16.330 4.106 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.167 16.942 5.523 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.924 18.524 3.055 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.688 18.611 4.630 1.00 0.00 H new ATOM 1252 N GLU A 83 -6.068 14.356 4.501 1.00 0.00 N ATOM 1253 CA GLU A 83 -5.673 13.196 5.283 1.00 0.00 C ATOM 1254 C GLU A 83 -4.359 12.621 4.837 1.00 0.00 C ATOM 1255 O GLU A 83 -3.479 12.467 5.648 1.00 0.00 O ATOM 1256 CB GLU A 83 -6.750 12.087 5.341 1.00 0.00 C ATOM 1257 CG GLU A 83 -8.044 12.437 6.084 1.00 0.00 C ATOM 1258 CD GLU A 83 -8.917 13.442 5.381 1.00 0.00 C ATOM 1259 OE1 GLU A 83 -9.757 13.031 4.586 1.00 0.00 O ATOM 1260 OE2 GLU A 83 -8.795 14.645 5.633 1.00 0.00 O ATOM 0 H GLU A 83 -6.881 14.215 3.901 1.00 0.00 H new ATOM 0 HA GLU A 83 -5.555 13.579 6.296 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.007 11.806 4.320 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.311 11.208 5.813 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -8.617 11.523 6.239 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.788 12.824 7.070 1.00 0.00 H new ATOM 1267 N GLY A 84 -4.264 12.350 3.531 1.00 0.00 N ATOM 1268 CA GLY A 84 -3.087 11.692 2.866 1.00 0.00 C ATOM 1269 C GLY A 84 -2.226 10.740 3.754 1.00 0.00 C ATOM 1270 O GLY A 84 -1.482 11.212 4.610 1.00 0.00 O ATOM 0 H GLY A 84 -5.010 12.579 2.874 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -3.453 11.123 2.011 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -2.436 12.474 2.474 1.00 0.00 H new ATOM 1274 N PRO A 85 -2.263 9.396 3.539 1.00 0.00 N ATOM 1275 CA PRO A 85 -1.488 8.437 4.374 1.00 0.00 C ATOM 1276 C PRO A 85 0.005 8.711 4.242 1.00 0.00 C ATOM 1277 O PRO A 85 0.593 8.429 3.225 1.00 0.00 O ATOM 1278 CB PRO A 85 -1.839 7.068 3.772 1.00 0.00 C ATOM 1279 CG PRO A 85 -3.082 7.312 2.984 1.00 0.00 C ATOM 1280 CD PRO A 85 -2.974 8.709 2.464 1.00 0.00 C ATOM 0 HA PRO A 85 -1.724 8.506 5.436 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.034 6.695 3.138 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -2.003 6.323 4.550 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -3.172 6.597 2.166 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -3.968 7.195 3.608 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -2.424 8.750 1.524 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -3.954 9.150 2.280 1.00 0.00 H new ATOM 1288 N LYS A 86 0.602 9.250 5.280 1.00 0.00 N ATOM 1289 CA LYS A 86 1.933 9.785 5.159 1.00 0.00 C ATOM 1290 C LYS A 86 3.032 8.867 5.655 1.00 0.00 C ATOM 1291 O LYS A 86 3.872 8.451 4.878 1.00 0.00 O ATOM 1292 CB LYS A 86 2.016 11.151 5.833 1.00 0.00 C ATOM 1293 CG LYS A 86 3.362 11.827 5.694 1.00 0.00 C ATOM 1294 CD LYS A 86 3.409 13.180 6.400 1.00 0.00 C ATOM 1295 CE LYS A 86 3.164 13.075 7.899 1.00 0.00 C ATOM 1296 NZ LYS A 86 3.136 14.406 8.549 1.00 0.00 N ATOM 0 H LYS A 86 0.189 9.328 6.209 1.00 0.00 H new ATOM 0 HA LYS A 86 2.115 9.888 4.089 1.00 0.00 H new ATOM 0 HB2 LYS A 86 1.250 11.800 5.410 1.00 0.00 H new ATOM 0 HB3 LYS A 86 1.787 11.036 6.892 1.00 0.00 H new ATOM 0 HG2 LYS A 86 4.136 11.178 6.105 1.00 0.00 H new ATOM 0 HG3 LYS A 86 3.590 11.964 4.637 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.382 13.641 6.227 1.00 0.00 H new ATOM 0 HD3 LYS A 86 2.661 13.840 5.960 1.00 0.00 H new ATOM 0 HE2 LYS A 86 2.218 12.564 8.077 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.946 12.466 8.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 3.257 14.293 9.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 3.907 14.993 8.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 2.224 14.867 8.356 1.00 0.00 H new ATOM 1310 N THR A 87 3.033 8.571 6.928 1.00 0.00 N ATOM 1311 CA THR A 87 4.104 7.808 7.521 1.00 0.00 C ATOM 1312 C THR A 87 3.934 6.319 7.213 1.00 0.00 C ATOM 1313 O THR A 87 3.170 5.609 7.895 1.00 0.00 O ATOM 1314 CB THR A 87 4.139 8.049 9.041 1.00 0.00 C ATOM 1315 OG1 THR A 87 4.112 9.472 9.278 1.00 0.00 O ATOM 1316 CG2 THR A 87 5.407 7.468 9.660 1.00 0.00 C ATOM 0 H THR A 87 2.299 8.848 7.580 1.00 0.00 H new ATOM 0 HA THR A 87 5.051 8.136 7.093 1.00 0.00 H new ATOM 0 HB THR A 87 3.278 7.559 9.496 1.00 0.00 H new ATOM 0 HG1 THR A 87 4.476 9.662 10.168 1.00 0.00 H new ATOM 0 HG21 THR A 87 5.405 7.653 10.734 1.00 0.00 H new ATOM 0 HG22 THR A 87 5.442 6.394 9.477 1.00 0.00 H new ATOM 0 HG23 THR A 87 6.281 7.942 9.212 1.00 0.00 H new ATOM 1324 N VAL A 88 4.597 5.871 6.156 1.00 0.00 N ATOM 1325 CA VAL A 88 4.500 4.500 5.721 1.00 0.00 C ATOM 1326 C VAL A 88 5.712 3.679 6.167 1.00 0.00 C ATOM 1327 O VAL A 88 6.866 4.149 6.129 1.00 0.00 O ATOM 1328 CB VAL A 88 4.331 4.384 4.160 1.00 0.00 C ATOM 1329 CG1 VAL A 88 3.151 5.198 3.675 1.00 0.00 C ATOM 1330 CG2 VAL A 88 5.589 4.793 3.406 1.00 0.00 C ATOM 0 H VAL A 88 5.212 6.450 5.584 1.00 0.00 H new ATOM 0 HA VAL A 88 3.606 4.095 6.195 1.00 0.00 H new ATOM 0 HB VAL A 88 4.147 3.330 3.950 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.060 5.098 2.593 1.00 0.00 H new ATOM 0 HG12 VAL A 88 2.239 4.837 4.151 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.303 6.247 3.931 1.00 0.00 H new ATOM 0 HG21 VAL A 88 5.419 4.695 2.334 1.00 0.00 H new ATOM 0 HG22 VAL A 88 5.833 5.829 3.641 1.00 0.00 H new ATOM 0 HG23 VAL A 88 6.417 4.149 3.703 1.00 0.00 H new ATOM 1340 N LYS A 89 5.443 2.485 6.621 1.00 0.00 N ATOM 1341 CA LYS A 89 6.462 1.529 6.958 1.00 0.00 C ATOM 1342 C LYS A 89 6.163 0.238 6.267 1.00 0.00 C ATOM 1343 O LYS A 89 4.995 -0.162 6.140 1.00 0.00 O ATOM 1344 CB LYS A 89 6.585 1.314 8.458 1.00 0.00 C ATOM 1345 CG LYS A 89 7.113 2.511 9.213 1.00 0.00 C ATOM 1346 CD LYS A 89 7.172 2.217 10.682 1.00 0.00 C ATOM 1347 CE LYS A 89 7.697 3.413 11.470 1.00 0.00 C ATOM 1348 NZ LYS A 89 7.625 3.191 12.929 1.00 0.00 N ATOM 0 H LYS A 89 4.493 2.144 6.770 1.00 0.00 H new ATOM 0 HA LYS A 89 7.421 1.923 6.622 1.00 0.00 H new ATOM 0 HB2 LYS A 89 5.606 1.049 8.857 1.00 0.00 H new ATOM 0 HB3 LYS A 89 7.244 0.465 8.639 1.00 0.00 H new ATOM 0 HG2 LYS A 89 8.106 2.771 8.847 1.00 0.00 H new ATOM 0 HG3 LYS A 89 6.472 3.374 9.034 1.00 0.00 H new ATOM 0 HD2 LYS A 89 6.178 1.951 11.041 1.00 0.00 H new ATOM 0 HD3 LYS A 89 7.815 1.354 10.856 1.00 0.00 H new ATOM 0 HE2 LYS A 89 8.730 3.610 11.184 1.00 0.00 H new ATOM 0 HE3 LYS A 89 7.120 4.300 11.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 8.448 3.631 13.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 6.752 3.616 13.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 7.624 2.170 13.125 1.00 0.00 H new ATOM 1362 N PHE A 90 7.185 -0.401 5.810 1.00 0.00 N ATOM 1363 CA PHE A 90 7.016 -1.627 5.032 1.00 0.00 C ATOM 1364 C PHE A 90 7.638 -2.838 5.705 1.00 0.00 C ATOM 1365 O PHE A 90 8.648 -2.726 6.416 1.00 0.00 O ATOM 1366 CB PHE A 90 7.628 -1.468 3.644 1.00 0.00 C ATOM 1367 CG PHE A 90 7.095 -0.317 2.861 1.00 0.00 C ATOM 1368 CD1 PHE A 90 5.893 -0.411 2.183 1.00 0.00 C ATOM 1369 CD2 PHE A 90 7.804 0.862 2.800 1.00 0.00 C ATOM 1370 CE1 PHE A 90 5.412 0.656 1.460 1.00 0.00 C ATOM 1371 CE2 PHE A 90 7.335 1.928 2.085 1.00 0.00 C ATOM 1372 CZ PHE A 90 6.134 1.830 1.410 1.00 0.00 C ATOM 0 H PHE A 90 8.154 -0.113 5.950 1.00 0.00 H new ATOM 0 HA PHE A 90 5.942 -1.796 4.956 1.00 0.00 H new ATOM 0 HB2 PHE A 90 8.707 -1.352 3.748 1.00 0.00 H new ATOM 0 HB3 PHE A 90 7.459 -2.385 3.079 1.00 0.00 H new ATOM 0 HD1 PHE A 90 5.327 -1.330 2.222 1.00 0.00 H new ATOM 0 HD2 PHE A 90 8.744 0.945 3.325 1.00 0.00 H new ATOM 0 HE1 PHE A 90 4.473 0.575 0.934 1.00 0.00 H new ATOM 0 HE2 PHE A 90 7.903 2.846 2.048 1.00 0.00 H new ATOM 0 HZ PHE A 90 5.761 2.671 0.844 1.00 0.00 H new ATOM 1382 N PHE A 91 7.020 -3.980 5.476 1.00 0.00 N ATOM 1383 CA PHE A 91 7.503 -5.273 5.933 1.00 0.00 C ATOM 1384 C PHE A 91 7.866 -6.111 4.725 1.00 0.00 C ATOM 1385 O PHE A 91 7.035 -6.304 3.828 1.00 0.00 O ATOM 1386 CB PHE A 91 6.408 -6.031 6.659 1.00 0.00 C ATOM 1387 CG PHE A 91 5.920 -5.455 7.951 1.00 0.00 C ATOM 1388 CD1 PHE A 91 5.091 -4.349 7.979 1.00 0.00 C ATOM 1389 CD2 PHE A 91 6.252 -6.060 9.134 1.00 0.00 C ATOM 1390 CE1 PHE A 91 4.607 -3.863 9.165 1.00 0.00 C ATOM 1391 CE2 PHE A 91 5.783 -5.578 10.323 1.00 0.00 C ATOM 1392 CZ PHE A 91 4.953 -4.478 10.343 1.00 0.00 C ATOM 0 H PHE A 91 6.146 -4.038 4.954 1.00 0.00 H new ATOM 0 HA PHE A 91 8.353 -5.102 6.594 1.00 0.00 H new ATOM 0 HB2 PHE A 91 5.556 -6.121 5.986 1.00 0.00 H new ATOM 0 HB3 PHE A 91 6.768 -7.041 6.854 1.00 0.00 H new ATOM 0 HD1 PHE A 91 4.821 -3.862 7.054 1.00 0.00 H new ATOM 0 HD2 PHE A 91 6.893 -6.929 9.127 1.00 0.00 H new ATOM 0 HE1 PHE A 91 3.957 -3.001 9.173 1.00 0.00 H new ATOM 0 HE2 PHE A 91 6.063 -6.059 11.248 1.00 0.00 H new ATOM 0 HZ PHE A 91 4.576 -4.101 11.282 1.00 0.00 H new ATOM 1402 N SER A 92 9.054 -6.624 4.696 1.00 0.00 N ATOM 1403 CA SER A 92 9.472 -7.449 3.605 1.00 0.00 C ATOM 1404 C SER A 92 9.185 -8.916 3.908 1.00 0.00 C ATOM 1405 O SER A 92 9.933 -9.577 4.635 1.00 0.00 O ATOM 1406 CB SER A 92 10.950 -7.215 3.299 1.00 0.00 C ATOM 1407 OG SER A 92 11.414 -8.007 2.209 1.00 0.00 O ATOM 0 H SER A 92 9.758 -6.486 5.421 1.00 0.00 H new ATOM 0 HA SER A 92 8.903 -7.178 2.716 1.00 0.00 H new ATOM 0 HB2 SER A 92 11.108 -6.161 3.071 1.00 0.00 H new ATOM 0 HB3 SER A 92 11.542 -7.441 4.186 1.00 0.00 H new ATOM 0 HG SER A 92 11.593 -7.429 1.438 1.00 0.00 H new ATOM 1413 N ASN A 93 8.045 -9.389 3.401 1.00 0.00 N ATOM 1414 CA ASN A 93 7.585 -10.794 3.529 1.00 0.00 C ATOM 1415 C ASN A 93 7.288 -11.189 4.968 1.00 0.00 C ATOM 1416 O ASN A 93 7.047 -12.352 5.258 1.00 0.00 O ATOM 1417 CB ASN A 93 8.571 -11.804 2.893 1.00 0.00 C ATOM 1418 CG ASN A 93 8.808 -11.566 1.412 1.00 0.00 C ATOM 1419 OD1 ASN A 93 8.051 -12.042 0.565 1.00 0.00 O ATOM 1420 ND2 ASN A 93 9.873 -10.872 1.084 1.00 0.00 N ATOM 0 H ASN A 93 7.395 -8.803 2.877 1.00 0.00 H new ATOM 0 HA ASN A 93 6.650 -10.837 2.971 1.00 0.00 H new ATOM 0 HB2 ASN A 93 9.524 -11.750 3.419 1.00 0.00 H new ATOM 0 HB3 ASN A 93 8.186 -12.814 3.034 1.00 0.00 H new ATOM 0 HD21 ASN A 93 10.095 -10.713 0.101 1.00 0.00 H new ATOM 0 HD22 ASN A 93 10.478 -10.492 1.812 1.00 0.00 H new ATOM 1427 N LYS A 94 7.281 -10.223 5.853 1.00 0.00 N ATOM 1428 CA LYS A 94 7.025 -10.477 7.247 1.00 0.00 C ATOM 1429 C LYS A 94 5.527 -10.409 7.534 1.00 0.00 C ATOM 1430 O LYS A 94 4.818 -9.568 6.974 1.00 0.00 O ATOM 1431 CB LYS A 94 7.832 -9.503 8.137 1.00 0.00 C ATOM 1432 CG LYS A 94 7.613 -9.667 9.640 1.00 0.00 C ATOM 1433 CD LYS A 94 7.962 -11.072 10.112 1.00 0.00 C ATOM 1434 CE LYS A 94 7.680 -11.245 11.592 1.00 0.00 C ATOM 1435 NZ LYS A 94 7.912 -12.628 12.033 1.00 0.00 N ATOM 0 H LYS A 94 7.452 -9.243 5.628 1.00 0.00 H new ATOM 0 HA LYS A 94 7.359 -11.486 7.490 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.893 -9.634 7.924 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.575 -8.481 7.857 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.223 -8.941 10.178 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.572 -9.450 9.882 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.387 -11.802 9.543 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.015 -11.272 9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.315 -10.569 12.165 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.647 -10.965 11.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.077 -12.642 13.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 7.079 -13.208 11.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.745 -13.013 11.543 1.00 0.00 H new ATOM 1449 N GLU A 95 5.076 -11.330 8.375 1.00 0.00 N ATOM 1450 CA GLU A 95 3.680 -11.486 8.801 1.00 0.00 C ATOM 1451 C GLU A 95 3.111 -10.196 9.406 1.00 0.00 C ATOM 1452 O GLU A 95 3.848 -9.248 9.705 1.00 0.00 O ATOM 1453 CB GLU A 95 3.542 -12.610 9.872 1.00 0.00 C ATOM 1454 CG GLU A 95 4.135 -13.982 9.514 1.00 0.00 C ATOM 1455 CD GLU A 95 5.648 -13.989 9.519 1.00 0.00 C ATOM 1456 OE1 GLU A 95 6.245 -14.154 10.602 1.00 0.00 O ATOM 1457 OE2 GLU A 95 6.255 -13.799 8.458 1.00 0.00 O ATOM 0 H GLU A 95 5.694 -12.021 8.800 1.00 0.00 H new ATOM 0 HA GLU A 95 3.121 -11.743 7.901 1.00 0.00 H new ATOM 0 HB2 GLU A 95 4.015 -12.264 10.791 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.482 -12.744 10.090 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.771 -14.726 10.223 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.779 -14.280 8.528 1.00 0.00 H new ATOM 1464 N HIS A 96 1.798 -10.189 9.606 1.00 0.00 N ATOM 1465 CA HIS A 96 1.102 -9.056 10.199 1.00 0.00 C ATOM 1466 C HIS A 96 1.572 -8.753 11.633 1.00 0.00 C ATOM 1467 O HIS A 96 1.166 -9.400 12.591 1.00 0.00 O ATOM 1468 CB HIS A 96 -0.471 -9.185 10.105 1.00 0.00 C ATOM 1469 CG HIS A 96 -1.111 -10.452 10.700 1.00 0.00 C ATOM 1470 ND1 HIS A 96 -1.927 -11.288 9.978 1.00 0.00 N ATOM 1471 CD2 HIS A 96 -1.085 -10.983 11.953 1.00 0.00 C ATOM 1472 CE1 HIS A 96 -2.361 -12.262 10.741 1.00 0.00 C ATOM 1473 NE2 HIS A 96 -1.865 -12.099 11.942 1.00 0.00 N ATOM 0 H HIS A 96 1.187 -10.969 9.361 1.00 0.00 H new ATOM 0 HA HIS A 96 1.377 -8.193 9.593 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.911 -8.320 10.601 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -0.752 -9.127 9.054 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -2.161 -11.169 8.992 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -0.544 -10.591 12.801 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -3.016 -13.063 10.432 1.00 0.00 H new ATOM 1482 N MET A 97 2.459 -7.811 11.761 1.00 0.00 N ATOM 1483 CA MET A 97 2.895 -7.374 13.062 1.00 0.00 C ATOM 1484 C MET A 97 2.130 -6.127 13.385 1.00 0.00 C ATOM 1485 O MET A 97 2.367 -5.082 12.799 1.00 0.00 O ATOM 1486 CB MET A 97 4.401 -7.119 13.094 1.00 0.00 C ATOM 1487 CG MET A 97 5.239 -8.333 12.700 1.00 0.00 C ATOM 1488 SD MET A 97 7.023 -8.033 12.751 1.00 0.00 S ATOM 1489 CE MET A 97 7.277 -7.734 14.493 1.00 0.00 C ATOM 0 H MET A 97 2.899 -7.326 10.979 1.00 0.00 H new ATOM 0 HA MET A 97 2.703 -8.149 13.804 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.635 -6.294 12.421 1.00 0.00 H new ATOM 0 HB3 MET A 97 4.686 -6.803 14.098 1.00 0.00 H new ATOM 0 HG2 MET A 97 4.999 -9.161 13.367 1.00 0.00 H new ATOM 0 HG3 MET A 97 4.960 -8.644 11.693 1.00 0.00 H new ATOM 0 HE1 MET A 97 7.535 -6.686 14.649 1.00 0.00 H new ATOM 0 HE2 MET A 97 6.363 -7.968 15.039 1.00 0.00 H new ATOM 0 HE3 MET A 97 8.088 -8.365 14.856 1.00 0.00 H new ATOM 1499 N CYS A 98 1.196 -6.254 14.281 1.00 0.00 N ATOM 1500 CA CYS A 98 0.266 -5.201 14.591 1.00 0.00 C ATOM 1501 C CYS A 98 0.873 -4.068 15.451 1.00 0.00 C ATOM 1502 O CYS A 98 2.081 -4.018 15.669 1.00 0.00 O ATOM 1503 CB CYS A 98 -0.968 -5.813 15.219 1.00 0.00 C ATOM 1504 SG CYS A 98 -1.796 -7.013 14.149 1.00 0.00 S ATOM 0 H CYS A 98 1.054 -7.104 14.827 1.00 0.00 H new ATOM 0 HA CYS A 98 -0.010 -4.704 13.661 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -0.688 -6.302 16.152 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -1.670 -5.019 15.473 1.00 0.00 H new ATOM 0 HG CYS A 98 -2.839 -7.491 14.759 1.00 0.00 H new ATOM 1510 N PHE A 99 -0.004 -3.193 15.952 1.00 0.00 N ATOM 1511 CA PHE A 99 0.352 -1.927 16.636 1.00 0.00 C ATOM 1512 C PHE A 99 1.457 -2.059 17.692 1.00 0.00 C ATOM 1513 O PHE A 99 2.360 -1.234 17.744 1.00 0.00 O ATOM 1514 CB PHE A 99 -0.891 -1.301 17.277 1.00 0.00 C ATOM 1515 CG PHE A 99 -2.034 -1.091 16.322 1.00 0.00 C ATOM 1516 CD1 PHE A 99 -1.970 -0.119 15.341 1.00 0.00 C ATOM 1517 CD2 PHE A 99 -3.171 -1.877 16.405 1.00 0.00 C ATOM 1518 CE1 PHE A 99 -3.020 0.063 14.460 1.00 0.00 C ATOM 1519 CE2 PHE A 99 -4.221 -1.698 15.531 1.00 0.00 C ATOM 1520 CZ PHE A 99 -4.146 -0.726 14.556 1.00 0.00 C ATOM 0 H PHE A 99 -1.012 -3.342 15.896 1.00 0.00 H new ATOM 0 HA PHE A 99 0.753 -1.283 15.854 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.227 -1.940 18.094 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.617 -0.341 17.715 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.091 0.504 15.262 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.236 -2.641 17.166 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -2.958 0.824 13.696 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -5.102 -2.318 15.610 1.00 0.00 H new ATOM 0 HZ PHE A 99 -4.967 -0.583 13.869 1.00 0.00 H new ATOM 1530 N SER A 100 1.394 -3.063 18.520 1.00 0.00 N ATOM 1531 CA SER A 100 2.411 -3.238 19.542 1.00 0.00 C ATOM 1532 C SER A 100 3.666 -3.912 18.965 1.00 0.00 C ATOM 1533 O SER A 100 4.799 -3.612 19.362 1.00 0.00 O ATOM 1534 CB SER A 100 1.849 -4.070 20.687 1.00 0.00 C ATOM 1535 OG SER A 100 0.681 -3.460 21.234 1.00 0.00 O ATOM 0 H SER A 100 0.660 -3.772 18.516 1.00 0.00 H new ATOM 0 HA SER A 100 2.698 -2.255 19.914 1.00 0.00 H new ATOM 0 HB2 SER A 100 1.608 -5.071 20.330 1.00 0.00 H new ATOM 0 HB3 SER A 100 2.604 -4.182 21.465 1.00 0.00 H new ATOM 0 HG SER A 100 0.336 -4.012 21.967 1.00 0.00 H new ATOM 1541 N ASN A 101 3.456 -4.761 17.985 1.00 0.00 N ATOM 1542 CA ASN A 101 4.512 -5.593 17.419 1.00 0.00 C ATOM 1543 C ASN A 101 5.409 -4.807 16.463 1.00 0.00 C ATOM 1544 O ASN A 101 6.542 -5.205 16.205 1.00 0.00 O ATOM 1545 CB ASN A 101 3.901 -6.799 16.691 1.00 0.00 C ATOM 1546 CG ASN A 101 2.989 -7.631 17.579 1.00 0.00 C ATOM 1547 OD1 ASN A 101 1.794 -7.363 17.667 1.00 0.00 O ATOM 1548 ND2 ASN A 101 3.528 -8.631 18.228 1.00 0.00 N ATOM 0 H ASN A 101 2.544 -4.900 17.550 1.00 0.00 H new ATOM 0 HA ASN A 101 5.133 -5.940 18.245 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.336 -6.447 15.828 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.703 -7.431 16.310 1.00 0.00 H new ATOM 0 HD21 ASN A 101 2.951 -9.218 18.831 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.525 -8.824 18.131 1.00 0.00 H new ATOM 1555 N VAL A 102 4.919 -3.670 15.962 1.00 0.00 N ATOM 1556 CA VAL A 102 5.691 -2.828 15.010 1.00 0.00 C ATOM 1557 C VAL A 102 6.972 -2.240 15.631 1.00 0.00 C ATOM 1558 O VAL A 102 7.779 -1.621 14.944 1.00 0.00 O ATOM 1559 CB VAL A 102 4.851 -1.671 14.397 1.00 0.00 C ATOM 1560 CG1 VAL A 102 3.669 -2.202 13.619 1.00 0.00 C ATOM 1561 CG2 VAL A 102 4.400 -0.691 15.465 1.00 0.00 C ATOM 0 H VAL A 102 3.996 -3.302 16.191 1.00 0.00 H new ATOM 0 HA VAL A 102 5.971 -3.516 14.212 1.00 0.00 H new ATOM 0 HB VAL A 102 5.495 -1.134 13.701 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.103 -1.368 13.204 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.023 -2.839 12.809 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.027 -2.782 14.283 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.815 0.105 15.004 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.787 -1.212 16.201 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.273 -0.262 15.957 1.00 0.00 H new ATOM 1571 N ASN A 103 7.155 -2.448 16.906 1.00 0.00 N ATOM 1572 CA ASN A 103 8.316 -1.931 17.599 1.00 0.00 C ATOM 1573 C ASN A 103 9.452 -2.949 17.592 1.00 0.00 C ATOM 1574 O ASN A 103 10.535 -2.680 18.104 1.00 0.00 O ATOM 1575 CB ASN A 103 7.969 -1.551 19.053 1.00 0.00 C ATOM 1576 CG ASN A 103 6.918 -0.455 19.165 1.00 0.00 C ATOM 1577 OD1 ASN A 103 7.240 0.725 19.175 1.00 0.00 O ATOM 1578 ND2 ASN A 103 5.667 -0.837 19.296 1.00 0.00 N ATOM 0 H ASN A 103 6.512 -2.976 17.496 1.00 0.00 H new ATOM 0 HA ASN A 103 8.641 -1.035 17.070 1.00 0.00 H new ATOM 0 HB2 ASN A 103 7.613 -2.439 19.576 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.877 -1.225 19.560 1.00 0.00 H new ATOM 0 HD21 ASN A 103 4.930 -0.141 19.410 1.00 0.00 H new ATOM 0 HD22 ASN A 103 5.433 -1.830 19.283 1.00 0.00 H new ATOM 1585 N ASP A 104 9.214 -4.113 17.005 1.00 0.00 N ATOM 1586 CA ASP A 104 10.220 -5.185 17.007 1.00 0.00 C ATOM 1587 C ASP A 104 10.979 -5.303 15.685 1.00 0.00 C ATOM 1588 O ASP A 104 12.174 -5.630 15.672 1.00 0.00 O ATOM 1589 CB ASP A 104 9.577 -6.540 17.349 1.00 0.00 C ATOM 1590 CG ASP A 104 10.580 -7.692 17.374 1.00 0.00 C ATOM 1591 OD1 ASP A 104 10.819 -8.325 16.321 1.00 0.00 O ATOM 1592 OD2 ASP A 104 11.138 -7.990 18.454 1.00 0.00 O ATOM 0 H ASP A 104 8.345 -4.346 16.524 1.00 0.00 H new ATOM 0 HA ASP A 104 10.943 -4.912 17.775 1.00 0.00 H new ATOM 0 HB2 ASP A 104 9.091 -6.469 18.322 1.00 0.00 H new ATOM 0 HB3 ASP A 104 8.798 -6.760 16.619 1.00 0.00 H new ATOM 1597 N PHE A 105 10.330 -4.995 14.590 1.00 0.00 N ATOM 1598 CA PHE A 105 10.936 -5.253 13.288 1.00 0.00 C ATOM 1599 C PHE A 105 11.617 -3.991 12.764 1.00 0.00 C ATOM 1600 O PHE A 105 11.236 -2.881 13.139 1.00 0.00 O ATOM 1601 CB PHE A 105 9.852 -5.687 12.259 1.00 0.00 C ATOM 1602 CG PHE A 105 9.025 -4.537 11.707 1.00 0.00 C ATOM 1603 CD1 PHE A 105 8.152 -3.830 12.507 1.00 0.00 C ATOM 1604 CD2 PHE A 105 9.153 -4.160 10.376 1.00 0.00 C ATOM 1605 CE1 PHE A 105 7.429 -2.770 11.994 1.00 0.00 C ATOM 1606 CE2 PHE A 105 8.425 -3.106 9.864 1.00 0.00 C ATOM 1607 CZ PHE A 105 7.565 -2.410 10.674 1.00 0.00 C ATOM 0 H PHE A 105 9.401 -4.574 14.562 1.00 0.00 H new ATOM 0 HA PHE A 105 11.669 -6.050 13.411 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.338 -6.201 11.430 1.00 0.00 H new ATOM 0 HB3 PHE A 105 9.184 -6.406 12.733 1.00 0.00 H new ATOM 0 HD1 PHE A 105 8.032 -4.107 13.544 1.00 0.00 H new ATOM 0 HD2 PHE A 105 9.832 -4.700 9.733 1.00 0.00 H new ATOM 0 HE1 PHE A 105 6.753 -2.221 12.633 1.00 0.00 H new ATOM 0 HE2 PHE A 105 8.532 -2.829 8.826 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.997 -1.582 10.277 1.00 0.00 H new ATOM 1617 N PRO A 106 12.648 -4.133 11.930 1.00 0.00 N ATOM 1618 CA PRO A 106 13.221 -3.015 11.227 1.00 0.00 C ATOM 1619 C PRO A 106 12.477 -2.838 9.889 1.00 0.00 C ATOM 1620 O PRO A 106 12.445 -3.770 9.075 1.00 0.00 O ATOM 1621 CB PRO A 106 14.682 -3.447 10.976 1.00 0.00 C ATOM 1622 CG PRO A 106 14.766 -4.903 11.369 1.00 0.00 C ATOM 1623 CD PRO A 106 13.359 -5.378 11.627 1.00 0.00 C ATOM 0 HA PRO A 106 13.155 -2.072 11.770 1.00 0.00 H new ATOM 0 HB2 PRO A 106 14.954 -3.310 9.929 1.00 0.00 H new ATOM 0 HB3 PRO A 106 15.373 -2.844 11.566 1.00 0.00 H new ATOM 0 HG2 PRO A 106 15.230 -5.489 10.576 1.00 0.00 H new ATOM 0 HG3 PRO A 106 15.383 -5.026 12.259 1.00 0.00 H new ATOM 0 HD2 PRO A 106 12.937 -5.884 10.759 1.00 0.00 H new ATOM 0 HD3 PRO A 106 13.315 -6.082 12.458 1.00 0.00 H new ATOM 1631 N PRO A 107 11.846 -1.676 9.651 1.00 0.00 N ATOM 1632 CA PRO A 107 11.081 -1.440 8.420 1.00 0.00 C ATOM 1633 C PRO A 107 11.939 -1.582 7.163 1.00 0.00 C ATOM 1634 O PRO A 107 13.120 -1.206 7.161 1.00 0.00 O ATOM 1635 CB PRO A 107 10.563 0.000 8.569 1.00 0.00 C ATOM 1636 CG PRO A 107 11.409 0.614 9.635 1.00 0.00 C ATOM 1637 CD PRO A 107 11.825 -0.507 10.546 1.00 0.00 C ATOM 0 HA PRO A 107 10.282 -2.172 8.299 1.00 0.00 H new ATOM 0 HB2 PRO A 107 10.652 0.549 7.631 1.00 0.00 H new ATOM 0 HB3 PRO A 107 9.509 0.012 8.847 1.00 0.00 H new ATOM 0 HG2 PRO A 107 12.280 1.107 9.203 1.00 0.00 H new ATOM 0 HG3 PRO A 107 10.852 1.374 10.183 1.00 0.00 H new ATOM 0 HD2 PRO A 107 12.803 -0.323 10.991 1.00 0.00 H new ATOM 0 HD3 PRO A 107 11.121 -0.641 11.367 1.00 0.00 H new ATOM 1645 N SER A 108 11.352 -2.148 6.107 1.00 0.00 N ATOM 1646 CA SER A 108 12.049 -2.325 4.829 1.00 0.00 C ATOM 1647 C SER A 108 12.484 -0.975 4.290 1.00 0.00 C ATOM 1648 O SER A 108 13.592 -0.813 3.785 1.00 0.00 O ATOM 1649 CB SER A 108 11.115 -2.972 3.835 1.00 0.00 C ATOM 1650 OG SER A 108 10.571 -4.156 4.368 1.00 0.00 O ATOM 0 H SER A 108 10.392 -2.493 6.111 1.00 0.00 H new ATOM 0 HA SER A 108 12.924 -2.956 4.983 1.00 0.00 H new ATOM 0 HB2 SER A 108 10.313 -2.280 3.577 1.00 0.00 H new ATOM 0 HB3 SER A 108 11.653 -3.195 2.913 1.00 0.00 H new ATOM 0 HG SER A 108 11.292 -4.716 4.724 1.00 0.00 H new ATOM 1656 N ASP A 109 11.597 -0.029 4.405 1.00 0.00 N ATOM 1657 CA ASP A 109 11.833 1.326 4.018 1.00 0.00 C ATOM 1658 C ASP A 109 10.816 2.131 4.804 1.00 0.00 C ATOM 1659 O ASP A 109 9.896 1.538 5.408 1.00 0.00 O ATOM 1660 CB ASP A 109 11.620 1.508 2.489 1.00 0.00 C ATOM 1661 CG ASP A 109 12.191 2.818 1.934 1.00 0.00 C ATOM 1662 OD1 ASP A 109 11.620 3.892 2.172 1.00 0.00 O ATOM 1663 OD2 ASP A 109 13.237 2.770 1.250 1.00 0.00 O ATOM 0 H ASP A 109 10.663 -0.187 4.782 1.00 0.00 H new ATOM 0 HA ASP A 109 12.856 1.642 4.223 1.00 0.00 H new ATOM 0 HB2 ASP A 109 12.082 0.671 1.966 1.00 0.00 H new ATOM 0 HB3 ASP A 109 10.552 1.468 2.274 1.00 0.00 H new ATOM 1668 N THR A 110 10.950 3.407 4.809 1.00 0.00 N ATOM 1669 CA THR A 110 10.078 4.273 5.535 1.00 0.00 C ATOM 1670 C THR A 110 10.036 5.626 4.831 1.00 0.00 C ATOM 1671 O THR A 110 11.054 6.330 4.715 1.00 0.00 O ATOM 1672 CB THR A 110 10.507 4.397 7.046 1.00 0.00 C ATOM 1673 OG1 THR A 110 9.657 5.308 7.766 1.00 0.00 O ATOM 1674 CG2 THR A 110 11.966 4.822 7.192 1.00 0.00 C ATOM 0 H THR A 110 11.685 3.896 4.298 1.00 0.00 H new ATOM 0 HA THR A 110 9.073 3.852 5.548 1.00 0.00 H new ATOM 0 HB THR A 110 10.396 3.403 7.479 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.950 5.360 8.700 1.00 0.00 H new ATOM 0 HG21 THR A 110 12.220 4.895 8.250 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.610 4.083 6.715 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.112 5.792 6.716 1.00 0.00 H new ATOM 1682 N ALA A 111 8.891 5.969 4.331 1.00 0.00 N ATOM 1683 CA ALA A 111 8.751 7.201 3.586 1.00 0.00 C ATOM 1684 C ALA A 111 7.536 7.973 4.027 1.00 0.00 C ATOM 1685 O ALA A 111 6.637 7.423 4.676 1.00 0.00 O ATOM 1686 CB ALA A 111 8.682 6.912 2.099 1.00 0.00 C ATOM 0 H ALA A 111 8.035 5.421 4.419 1.00 0.00 H new ATOM 0 HA ALA A 111 9.628 7.816 3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 111 8.577 7.848 1.551 1.00 0.00 H new ATOM 0 HB2 ALA A 111 9.595 6.408 1.784 1.00 0.00 H new ATOM 0 HB3 ALA A 111 7.824 6.272 1.892 1.00 0.00 H new ATOM 1692 N GLU A 112 7.520 9.234 3.701 1.00 0.00 N ATOM 1693 CA GLU A 112 6.417 10.086 4.011 1.00 0.00 C ATOM 1694 C GLU A 112 5.781 10.535 2.712 1.00 0.00 C ATOM 1695 O GLU A 112 6.482 11.013 1.805 1.00 0.00 O ATOM 1696 CB GLU A 112 6.827 11.327 4.850 1.00 0.00 C ATOM 1697 CG GLU A 112 7.446 11.056 6.236 1.00 0.00 C ATOM 1698 CD GLU A 112 8.873 10.541 6.195 1.00 0.00 C ATOM 1699 OE1 GLU A 112 9.795 11.355 5.997 1.00 0.00 O ATOM 1700 OE2 GLU A 112 9.101 9.335 6.387 1.00 0.00 O ATOM 0 H GLU A 112 8.282 9.700 3.208 1.00 0.00 H new ATOM 0 HA GLU A 112 5.714 9.518 4.620 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.540 11.910 4.268 1.00 0.00 H new ATOM 0 HB3 GLU A 112 5.944 11.950 4.989 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.422 11.977 6.818 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.826 10.330 6.762 1.00 0.00 H new ATOM 1707 N LEU A 113 4.483 10.367 2.610 1.00 0.00 N ATOM 1708 CA LEU A 113 3.747 10.736 1.418 1.00 0.00 C ATOM 1709 C LEU A 113 3.756 12.230 1.199 1.00 0.00 C ATOM 1710 O LEU A 113 3.563 13.027 2.137 1.00 0.00 O ATOM 1711 CB LEU A 113 2.324 10.120 1.429 1.00 0.00 C ATOM 1712 CG LEU A 113 1.305 10.496 0.323 1.00 0.00 C ATOM 1713 CD1 LEU A 113 0.256 9.405 0.208 1.00 0.00 C ATOM 1714 CD2 LEU A 113 0.578 11.787 0.693 1.00 0.00 C ATOM 0 H LEU A 113 3.905 9.970 3.351 1.00 0.00 H new ATOM 0 HA LEU A 113 4.256 10.310 0.554 1.00 0.00 H new ATOM 0 HB2 LEU A 113 2.440 9.036 1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.870 10.372 2.387 1.00 0.00 H new ATOM 0 HG LEU A 113 1.848 10.619 -0.614 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.460 9.670 -0.570 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.739 8.462 -0.049 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.264 9.299 1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.135 12.041 -0.091 1.00 0.00 H new ATOM 0 HD22 LEU A 113 0.047 11.649 1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 113 1.302 12.595 0.800 1.00 0.00 H new ATOM 1726 N THR A 114 4.008 12.598 -0.014 1.00 0.00 N ATOM 1727 CA THR A 114 4.065 13.958 -0.398 1.00 0.00 C ATOM 1728 C THR A 114 3.025 14.192 -1.492 1.00 0.00 C ATOM 1729 O THR A 114 2.353 13.243 -1.917 1.00 0.00 O ATOM 1730 CB THR A 114 5.503 14.334 -0.882 1.00 0.00 C ATOM 1731 OG1 THR A 114 5.589 15.740 -1.177 1.00 0.00 O ATOM 1732 CG2 THR A 114 5.901 13.515 -2.113 1.00 0.00 C ATOM 0 H THR A 114 4.183 11.944 -0.777 1.00 0.00 H new ATOM 0 HA THR A 114 3.840 14.599 0.454 1.00 0.00 H new ATOM 0 HB THR A 114 6.197 14.101 -0.074 1.00 0.00 H new ATOM 0 HG1 THR A 114 6.497 15.956 -1.477 1.00 0.00 H new ATOM 0 HG21 THR A 114 6.906 13.797 -2.428 1.00 0.00 H new ATOM 0 HG22 THR A 114 5.883 12.454 -1.865 1.00 0.00 H new ATOM 0 HG23 THR A 114 5.198 13.711 -2.923 1.00 0.00 H new ATOM 1740 N GLU A 115 2.933 15.413 -1.957 1.00 0.00 N ATOM 1741 CA GLU A 115 1.937 15.836 -2.931 1.00 0.00 C ATOM 1742 C GLU A 115 1.945 14.983 -4.204 1.00 0.00 C ATOM 1743 O GLU A 115 0.899 14.547 -4.659 1.00 0.00 O ATOM 1744 CB GLU A 115 2.168 17.295 -3.282 1.00 0.00 C ATOM 1745 CG GLU A 115 2.026 18.242 -2.109 1.00 0.00 C ATOM 1746 CD GLU A 115 2.383 19.651 -2.476 1.00 0.00 C ATOM 1747 OE1 GLU A 115 1.580 20.319 -3.155 1.00 0.00 O ATOM 1748 OE2 GLU A 115 3.480 20.110 -2.090 1.00 0.00 O ATOM 0 H GLU A 115 3.560 16.164 -1.667 1.00 0.00 H new ATOM 0 HA GLU A 115 0.957 15.703 -2.473 1.00 0.00 H new ATOM 0 HB2 GLU A 115 3.168 17.403 -3.703 1.00 0.00 H new ATOM 0 HB3 GLU A 115 1.461 17.587 -4.059 1.00 0.00 H new ATOM 0 HG2 GLU A 115 1.000 18.212 -1.742 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.667 17.907 -1.293 1.00 0.00 H new ATOM 1755 N GLU A 116 3.121 14.722 -4.745 1.00 0.00 N ATOM 1756 CA GLU A 116 3.238 13.971 -5.991 1.00 0.00 C ATOM 1757 C GLU A 116 2.874 12.494 -5.743 1.00 0.00 C ATOM 1758 O GLU A 116 2.265 11.833 -6.591 1.00 0.00 O ATOM 1759 CB GLU A 116 4.666 14.079 -6.531 1.00 0.00 C ATOM 1760 CG GLU A 116 4.815 13.715 -7.995 1.00 0.00 C ATOM 1761 CD GLU A 116 4.080 14.686 -8.914 1.00 0.00 C ATOM 1762 OE1 GLU A 116 2.888 14.480 -9.197 1.00 0.00 O ATOM 1763 OE2 GLU A 116 4.692 15.659 -9.387 1.00 0.00 O ATOM 0 H GLU A 116 4.011 15.017 -4.344 1.00 0.00 H new ATOM 0 HA GLU A 116 2.551 14.387 -6.728 1.00 0.00 H new ATOM 0 HB2 GLU A 116 5.019 15.100 -6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 116 5.314 13.431 -5.941 1.00 0.00 H new ATOM 0 HG2 GLU A 116 5.873 13.701 -8.257 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.433 12.707 -8.156 1.00 0.00 H new ATOM 1770 N ASN A 117 3.232 11.990 -4.555 1.00 0.00 N ATOM 1771 CA ASN A 117 2.917 10.605 -4.174 1.00 0.00 C ATOM 1772 C ASN A 117 1.411 10.453 -4.069 1.00 0.00 C ATOM 1773 O ASN A 117 0.844 9.469 -4.522 1.00 0.00 O ATOM 1774 CB ASN A 117 3.533 10.250 -2.806 1.00 0.00 C ATOM 1775 CG ASN A 117 3.391 8.766 -2.427 1.00 0.00 C ATOM 1776 OD1 ASN A 117 3.399 7.874 -3.400 1.00 0.00 O flip ATOM 1777 ND2 ASN A 117 3.305 8.436 -1.267 1.00 0.00 N flip ATOM 0 H ASN A 117 3.738 12.517 -3.843 1.00 0.00 H new ATOM 0 HA ASN A 117 3.329 9.940 -4.933 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.591 10.513 -2.815 1.00 0.00 H new ATOM 0 HB3 ASN A 117 3.059 10.859 -2.036 1.00 0.00 H new ATOM 0 HD21 ASN A 117 3.301 9.145 -0.534 1.00 0.00 H new ATOM 0 HD22 ASN A 117 3.236 7.448 -1.021 1.00 0.00 H new ATOM 1784 N LEU A 118 0.783 11.487 -3.507 1.00 0.00 N ATOM 1785 CA LEU A 118 -0.660 11.555 -3.263 1.00 0.00 C ATOM 1786 C LEU A 118 -1.446 11.462 -4.573 1.00 0.00 C ATOM 1787 O LEU A 118 -2.602 11.055 -4.594 1.00 0.00 O ATOM 1788 CB LEU A 118 -0.985 12.891 -2.626 1.00 0.00 C ATOM 1789 CG LEU A 118 -2.403 13.062 -2.137 1.00 0.00 C ATOM 1790 CD1 LEU A 118 -2.639 12.279 -0.864 1.00 0.00 C ATOM 1791 CD2 LEU A 118 -2.731 14.510 -1.966 1.00 0.00 C ATOM 0 H LEU A 118 1.278 12.324 -3.200 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.936 10.723 -2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.310 13.044 -1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.774 13.678 -3.350 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.077 12.658 -2.892 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.668 12.421 -0.535 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.460 11.220 -1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -1.959 12.631 -0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.757 14.611 -1.613 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.051 14.954 -1.238 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.624 15.023 -2.922 1.00 0.00 H new ATOM 1803 N LYS A 119 -0.797 11.838 -5.659 1.00 0.00 N ATOM 1804 CA LYS A 119 -1.386 11.830 -6.989 1.00 0.00 C ATOM 1805 C LYS A 119 -1.370 10.423 -7.532 1.00 0.00 C ATOM 1806 O LYS A 119 -1.876 10.145 -8.617 1.00 0.00 O ATOM 1807 CB LYS A 119 -0.592 12.760 -7.910 1.00 0.00 C ATOM 1808 CG LYS A 119 -0.466 14.179 -7.375 1.00 0.00 C ATOM 1809 CD LYS A 119 -1.815 14.867 -7.219 1.00 0.00 C ATOM 1810 CE LYS A 119 -2.442 15.179 -8.565 1.00 0.00 C ATOM 1811 NZ LYS A 119 -1.652 16.189 -9.311 1.00 0.00 N ATOM 0 H LYS A 119 0.170 12.163 -5.644 1.00 0.00 H new ATOM 0 HA LYS A 119 -2.416 12.183 -6.937 1.00 0.00 H new ATOM 0 HB2 LYS A 119 0.405 12.346 -8.059 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.074 12.790 -8.887 1.00 0.00 H new ATOM 0 HG2 LYS A 119 0.040 14.156 -6.410 1.00 0.00 H new ATOM 0 HG3 LYS A 119 0.160 14.763 -8.049 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -2.485 14.228 -6.644 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -1.690 15.790 -6.653 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -2.515 14.265 -9.154 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -3.458 15.546 -8.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -2.234 16.591 -10.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -1.358 16.948 -8.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -0.809 15.737 -9.720 1.00 0.00 H new ATOM 1825 N GLY A 120 -0.789 9.540 -6.761 1.00 0.00 N ATOM 1826 CA GLY A 120 -0.747 8.157 -7.105 1.00 0.00 C ATOM 1827 C GLY A 120 0.459 7.759 -7.889 1.00 0.00 C ATOM 1828 O GLY A 120 0.473 6.682 -8.496 1.00 0.00 O ATOM 0 H GLY A 120 -0.333 9.768 -5.877 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.784 7.565 -6.190 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.639 7.910 -7.681 1.00 0.00 H new ATOM 1832 N LYS A 121 1.460 8.581 -7.875 1.00 0.00 N ATOM 1833 CA LYS A 121 2.658 8.305 -8.611 1.00 0.00 C ATOM 1834 C LYS A 121 3.633 7.479 -7.777 1.00 0.00 C ATOM 1835 O LYS A 121 3.751 7.687 -6.556 1.00 0.00 O ATOM 1836 CB LYS A 121 3.285 9.596 -9.099 1.00 0.00 C ATOM 1837 CG LYS A 121 2.398 10.350 -10.071 1.00 0.00 C ATOM 1838 CD LYS A 121 3.027 11.650 -10.470 1.00 0.00 C ATOM 1839 CE LYS A 121 2.177 12.412 -11.459 1.00 0.00 C ATOM 1840 NZ LYS A 121 2.784 13.711 -11.782 1.00 0.00 N ATOM 0 H LYS A 121 1.473 9.459 -7.356 1.00 0.00 H new ATOM 0 HA LYS A 121 2.401 7.709 -9.486 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.503 10.235 -8.243 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.237 9.373 -9.581 1.00 0.00 H new ATOM 0 HG2 LYS A 121 2.221 9.740 -10.957 1.00 0.00 H new ATOM 0 HG3 LYS A 121 1.426 10.537 -9.613 1.00 0.00 H new ATOM 0 HD2 LYS A 121 3.187 12.262 -9.583 1.00 0.00 H new ATOM 0 HD3 LYS A 121 4.007 11.459 -10.907 1.00 0.00 H new ATOM 0 HE2 LYS A 121 2.058 11.825 -12.370 1.00 0.00 H new ATOM 0 HE3 LYS A 121 1.180 12.565 -11.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 2.311 14.118 -12.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 2.676 14.356 -10.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 3.795 13.580 -11.988 1.00 0.00 H new ATOM 1854 N PRO A 122 4.327 6.512 -8.416 1.00 0.00 N ATOM 1855 CA PRO A 122 5.260 5.621 -7.735 1.00 0.00 C ATOM 1856 C PRO A 122 6.484 6.345 -7.217 1.00 0.00 C ATOM 1857 O PRO A 122 7.240 6.952 -7.986 1.00 0.00 O ATOM 1858 CB PRO A 122 5.689 4.625 -8.824 1.00 0.00 C ATOM 1859 CG PRO A 122 4.719 4.803 -9.929 1.00 0.00 C ATOM 1860 CD PRO A 122 4.265 6.221 -9.855 1.00 0.00 C ATOM 0 HA PRO A 122 4.792 5.160 -6.865 1.00 0.00 H new ATOM 0 HB2 PRO A 122 6.707 4.825 -9.159 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.672 3.602 -8.448 1.00 0.00 H new ATOM 0 HG2 PRO A 122 5.183 4.592 -10.893 1.00 0.00 H new ATOM 0 HG3 PRO A 122 3.878 4.118 -9.823 1.00 0.00 H new ATOM 0 HD2 PRO A 122 4.913 6.883 -10.429 1.00 0.00 H new ATOM 0 HD3 PRO A 122 3.256 6.343 -10.249 1.00 0.00 H new ATOM 1868 N VAL A 123 6.665 6.295 -5.934 1.00 0.00 N ATOM 1869 CA VAL A 123 7.837 6.846 -5.297 1.00 0.00 C ATOM 1870 C VAL A 123 8.766 5.683 -4.982 1.00 0.00 C ATOM 1871 O VAL A 123 8.306 4.638 -4.515 1.00 0.00 O ATOM 1872 CB VAL A 123 7.471 7.626 -4.000 1.00 0.00 C ATOM 1873 CG1 VAL A 123 8.706 8.207 -3.331 1.00 0.00 C ATOM 1874 CG2 VAL A 123 6.495 8.739 -4.319 1.00 0.00 C ATOM 0 H VAL A 123 6.002 5.868 -5.287 1.00 0.00 H new ATOM 0 HA VAL A 123 8.321 7.562 -5.961 1.00 0.00 H new ATOM 0 HB VAL A 123 7.010 6.920 -3.309 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.413 8.744 -2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.390 7.401 -3.066 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.203 8.893 -4.017 1.00 0.00 H new ATOM 0 HG21 VAL A 123 6.246 9.278 -3.405 1.00 0.00 H new ATOM 0 HG22 VAL A 123 6.948 9.426 -5.033 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.587 8.315 -4.749 1.00 0.00 H new ATOM 1884 N VAL A 124 10.034 5.844 -5.280 1.00 0.00 N ATOM 1885 CA VAL A 124 11.017 4.786 -5.116 1.00 0.00 C ATOM 1886 C VAL A 124 11.296 4.473 -3.636 1.00 0.00 C ATOM 1887 O VAL A 124 11.276 5.366 -2.773 1.00 0.00 O ATOM 1888 CB VAL A 124 12.354 5.144 -5.848 1.00 0.00 C ATOM 1889 CG1 VAL A 124 13.018 6.372 -5.237 1.00 0.00 C ATOM 1890 CG2 VAL A 124 13.315 3.961 -5.876 1.00 0.00 C ATOM 0 H VAL A 124 10.420 6.715 -5.645 1.00 0.00 H new ATOM 0 HA VAL A 124 10.591 3.891 -5.570 1.00 0.00 H new ATOM 0 HB VAL A 124 12.097 5.385 -6.879 1.00 0.00 H new ATOM 0 HG11 VAL A 124 13.943 6.589 -5.771 1.00 0.00 H new ATOM 0 HG12 VAL A 124 12.345 7.226 -5.314 1.00 0.00 H new ATOM 0 HG13 VAL A 124 13.242 6.180 -4.188 1.00 0.00 H new ATOM 0 HG21 VAL A 124 14.231 4.248 -6.392 1.00 0.00 H new ATOM 0 HG22 VAL A 124 13.552 3.661 -4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 124 12.850 3.127 -6.401 1.00 0.00 H new ATOM 1900 N LEU A 125 11.519 3.213 -3.361 1.00 0.00 N ATOM 1901 CA LEU A 125 11.919 2.754 -2.055 1.00 0.00 C ATOM 1902 C LEU A 125 13.121 1.802 -2.174 1.00 0.00 C ATOM 1903 O LEU A 125 13.730 1.707 -3.253 1.00 0.00 O ATOM 1904 CB LEU A 125 10.725 2.155 -1.252 1.00 0.00 C ATOM 1905 CG LEU A 125 9.808 1.134 -1.950 1.00 0.00 C ATOM 1906 CD1 LEU A 125 10.566 -0.049 -2.451 1.00 0.00 C ATOM 1907 CD2 LEU A 125 8.726 0.669 -1.001 1.00 0.00 C ATOM 0 H LEU A 125 11.426 2.466 -4.049 1.00 0.00 H new ATOM 0 HA LEU A 125 12.247 3.612 -1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 125 11.131 1.679 -0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 125 10.102 2.984 -0.916 1.00 0.00 H new ATOM 0 HG LEU A 125 9.361 1.637 -2.807 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.879 -0.743 -2.936 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.318 0.278 -3.169 1.00 0.00 H new ATOM 0 HD13 LEU A 125 11.055 -0.548 -1.615 1.00 0.00 H new ATOM 0 HD21 LEU A 125 8.084 -0.053 -1.506 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.183 0.200 -0.130 1.00 0.00 H new ATOM 0 HD23 LEU A 125 8.130 1.524 -0.682 1.00 0.00 H new ATOM 1919 N LYS A 126 13.487 1.152 -1.084 1.00 0.00 N ATOM 1920 CA LYS A 126 14.614 0.229 -1.062 1.00 0.00 C ATOM 1921 C LYS A 126 14.355 -1.051 -1.897 1.00 0.00 C ATOM 1922 O LYS A 126 13.841 -2.055 -1.394 1.00 0.00 O ATOM 1923 CB LYS A 126 15.003 -0.117 0.393 1.00 0.00 C ATOM 1924 CG LYS A 126 16.224 -1.032 0.551 1.00 0.00 C ATOM 1925 CD LYS A 126 17.492 -0.433 -0.055 1.00 0.00 C ATOM 1926 CE LYS A 126 17.884 0.899 0.581 1.00 0.00 C ATOM 1927 NZ LYS A 126 18.192 0.780 2.026 1.00 0.00 N ATOM 0 H LYS A 126 13.012 1.247 -0.186 1.00 0.00 H new ATOM 0 HA LYS A 126 15.455 0.737 -1.535 1.00 0.00 H new ATOM 0 HB2 LYS A 126 15.195 0.812 0.930 1.00 0.00 H new ATOM 0 HB3 LYS A 126 14.149 -0.593 0.875 1.00 0.00 H new ATOM 0 HG2 LYS A 126 16.390 -1.229 1.610 1.00 0.00 H new ATOM 0 HG3 LYS A 126 16.018 -1.991 0.077 1.00 0.00 H new ATOM 0 HD2 LYS A 126 18.313 -1.141 0.061 1.00 0.00 H new ATOM 0 HD3 LYS A 126 17.344 -0.289 -1.125 1.00 0.00 H new ATOM 0 HE2 LYS A 126 18.753 1.302 0.061 1.00 0.00 H new ATOM 0 HE3 LYS A 126 17.072 1.613 0.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.500 1.703 2.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.341 0.471 2.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 18.951 0.082 2.163 1.00 0.00 H new ATOM 1941 N TYR A 127 14.709 -0.978 -3.169 1.00 0.00 N ATOM 1942 CA TYR A 127 14.584 -2.087 -4.116 1.00 0.00 C ATOM 1943 C TYR A 127 15.576 -3.186 -3.768 1.00 0.00 C ATOM 1944 O TYR A 127 15.313 -4.368 -3.965 1.00 0.00 O ATOM 1945 CB TYR A 127 14.854 -1.571 -5.548 1.00 0.00 C ATOM 1946 CG TYR A 127 14.877 -2.644 -6.625 1.00 0.00 C ATOM 1947 CD1 TYR A 127 13.717 -3.053 -7.247 1.00 0.00 C ATOM 1948 CD2 TYR A 127 16.073 -3.246 -7.013 1.00 0.00 C ATOM 1949 CE1 TYR A 127 13.734 -4.024 -8.219 1.00 0.00 C ATOM 1950 CE2 TYR A 127 16.098 -4.222 -7.984 1.00 0.00 C ATOM 1951 CZ TYR A 127 14.923 -4.608 -8.583 1.00 0.00 C ATOM 1952 OH TYR A 127 14.933 -5.589 -9.554 1.00 0.00 O ATOM 0 H TYR A 127 15.099 -0.133 -3.586 1.00 0.00 H new ATOM 0 HA TYR A 127 13.575 -2.495 -4.060 1.00 0.00 H new ATOM 0 HB2 TYR A 127 14.089 -0.837 -5.804 1.00 0.00 H new ATOM 0 HB3 TYR A 127 15.811 -1.050 -5.556 1.00 0.00 H new ATOM 0 HD1 TYR A 127 12.777 -2.602 -6.965 1.00 0.00 H new ATOM 0 HD2 TYR A 127 16.997 -2.941 -6.544 1.00 0.00 H new ATOM 0 HE1 TYR A 127 12.814 -4.328 -8.696 1.00 0.00 H new ATOM 0 HE2 TYR A 127 17.033 -4.680 -8.272 1.00 0.00 H new ATOM 0 HH TYR A 127 15.852 -5.899 -9.697 1.00 0.00 H new ATOM 1962 N VAL A 128 16.711 -2.774 -3.234 1.00 0.00 N ATOM 1963 CA VAL A 128 17.789 -3.686 -2.860 1.00 0.00 C ATOM 1964 C VAL A 128 17.326 -4.729 -1.823 1.00 0.00 C ATOM 1965 O VAL A 128 17.846 -5.856 -1.779 1.00 0.00 O ATOM 1966 CB VAL A 128 19.023 -2.893 -2.335 1.00 0.00 C ATOM 1967 CG1 VAL A 128 20.137 -3.818 -1.875 1.00 0.00 C ATOM 1968 CG2 VAL A 128 19.542 -1.960 -3.415 1.00 0.00 C ATOM 0 H VAL A 128 16.917 -1.793 -3.044 1.00 0.00 H new ATOM 0 HA VAL A 128 18.082 -4.230 -3.758 1.00 0.00 H new ATOM 0 HB VAL A 128 18.696 -2.311 -1.473 1.00 0.00 H new ATOM 0 HG11 VAL A 128 20.978 -3.224 -1.517 1.00 0.00 H new ATOM 0 HG12 VAL A 128 19.772 -4.454 -1.069 1.00 0.00 H new ATOM 0 HG13 VAL A 128 20.461 -4.440 -2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 128 20.404 -1.411 -3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 128 19.836 -2.542 -4.288 1.00 0.00 H new ATOM 0 HG23 VAL A 128 18.758 -1.257 -3.696 1.00 0.00 H new ATOM 1978 N LYS A 129 16.337 -4.377 -1.024 1.00 0.00 N ATOM 1979 CA LYS A 129 15.860 -5.297 -0.026 1.00 0.00 C ATOM 1980 C LYS A 129 14.824 -6.222 -0.683 1.00 0.00 C ATOM 1981 O LYS A 129 14.871 -7.437 -0.515 1.00 0.00 O ATOM 1982 CB LYS A 129 15.248 -4.535 1.188 1.00 0.00 C ATOM 1983 CG LYS A 129 15.206 -5.329 2.520 1.00 0.00 C ATOM 1984 CD LYS A 129 14.429 -6.627 2.420 1.00 0.00 C ATOM 1985 CE LYS A 129 14.498 -7.438 3.703 1.00 0.00 C ATOM 1986 NZ LYS A 129 13.831 -8.752 3.550 1.00 0.00 N ATOM 0 H LYS A 129 15.859 -3.476 -1.049 1.00 0.00 H new ATOM 0 HA LYS A 129 16.689 -5.890 0.360 1.00 0.00 H new ATOM 0 HB2 LYS A 129 15.820 -3.621 1.347 1.00 0.00 H new ATOM 0 HB3 LYS A 129 14.232 -4.234 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 129 16.226 -5.548 2.837 1.00 0.00 H new ATOM 0 HG3 LYS A 129 14.759 -4.704 3.293 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.387 -6.408 2.187 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.822 -7.221 1.595 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.540 -7.588 3.984 1.00 0.00 H new ATOM 0 HE3 LYS A 129 14.026 -6.881 4.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 13.502 -9.085 4.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 13.018 -8.656 2.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.504 -9.439 3.155 1.00 0.00 H new ATOM 2000 N PHE A 130 13.919 -5.643 -1.457 1.00 0.00 N ATOM 2001 CA PHE A 130 12.863 -6.414 -2.098 1.00 0.00 C ATOM 2002 C PHE A 130 13.348 -7.162 -3.332 1.00 0.00 C ATOM 2003 O PHE A 130 13.353 -6.630 -4.442 1.00 0.00 O ATOM 2004 CB PHE A 130 11.647 -5.554 -2.453 1.00 0.00 C ATOM 2005 CG PHE A 130 10.920 -4.971 -1.278 1.00 0.00 C ATOM 2006 CD1 PHE A 130 9.970 -5.719 -0.602 1.00 0.00 C ATOM 2007 CD2 PHE A 130 11.172 -3.678 -0.856 1.00 0.00 C ATOM 2008 CE1 PHE A 130 9.287 -5.189 0.472 1.00 0.00 C ATOM 2009 CE2 PHE A 130 10.491 -3.142 0.216 1.00 0.00 C ATOM 2010 CZ PHE A 130 9.547 -3.898 0.882 1.00 0.00 C ATOM 0 H PHE A 130 13.894 -4.643 -1.657 1.00 0.00 H new ATOM 0 HA PHE A 130 12.556 -7.152 -1.357 1.00 0.00 H new ATOM 0 HB2 PHE A 130 11.973 -4.740 -3.100 1.00 0.00 H new ATOM 0 HB3 PHE A 130 10.948 -6.160 -3.030 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.762 -6.730 -0.920 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.910 -3.082 -1.372 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.550 -5.784 0.991 1.00 0.00 H new ATOM 0 HE2 PHE A 130 10.696 -2.131 0.535 1.00 0.00 H new ATOM 0 HZ PHE A 130 9.013 -3.479 1.722 1.00 0.00 H new ATOM 2020 N GLN A 131 13.794 -8.368 -3.123 1.00 0.00 N ATOM 2021 CA GLN A 131 14.205 -9.229 -4.208 1.00 0.00 C ATOM 2022 C GLN A 131 13.165 -10.302 -4.410 1.00 0.00 C ATOM 2023 O GLN A 131 12.821 -10.659 -5.545 1.00 0.00 O ATOM 2024 CB GLN A 131 15.578 -9.830 -3.929 1.00 0.00 C ATOM 2025 CG GLN A 131 16.695 -8.796 -3.893 1.00 0.00 C ATOM 2026 CD GLN A 131 16.895 -8.106 -5.233 1.00 0.00 C ATOM 2027 OE1 GLN A 131 17.673 -8.567 -6.066 1.00 0.00 O ATOM 2028 NE2 GLN A 131 16.206 -7.009 -5.459 1.00 0.00 N ATOM 0 H GLN A 131 13.885 -8.787 -2.198 1.00 0.00 H new ATOM 0 HA GLN A 131 14.289 -8.645 -5.124 1.00 0.00 H new ATOM 0 HB2 GLN A 131 15.549 -10.356 -2.975 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.804 -10.572 -4.695 1.00 0.00 H new ATOM 0 HG2 GLN A 131 16.468 -8.048 -3.133 1.00 0.00 H new ATOM 0 HG3 GLN A 131 17.625 -9.281 -3.596 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.568 -6.652 -4.748 1.00 0.00 H new ATOM 0 HE22 GLN A 131 16.309 -6.516 -6.346 1.00 0.00 H new ATOM 2037 N ASN A 132 12.656 -10.798 -3.315 1.00 0.00 N ATOM 2038 CA ASN A 132 11.596 -11.771 -3.316 1.00 0.00 C ATOM 2039 C ASN A 132 10.373 -11.162 -2.745 1.00 0.00 C ATOM 2040 O ASN A 132 10.385 -10.692 -1.608 1.00 0.00 O ATOM 2041 CB ASN A 132 11.958 -13.001 -2.492 1.00 0.00 C ATOM 2042 CG ASN A 132 12.973 -13.881 -3.149 1.00 0.00 C ATOM 2043 OD1 ASN A 132 14.173 -13.689 -3.015 1.00 0.00 O ATOM 2044 ND2 ASN A 132 12.494 -14.879 -3.818 1.00 0.00 N ATOM 0 H ASN A 132 12.971 -10.533 -2.382 1.00 0.00 H new ATOM 0 HA ASN A 132 11.431 -12.083 -4.347 1.00 0.00 H new ATOM 0 HB2 ASN A 132 12.340 -12.680 -1.523 1.00 0.00 H new ATOM 0 HB3 ASN A 132 11.054 -13.580 -2.302 1.00 0.00 H new ATOM 0 HD21 ASN A 132 13.126 -15.546 -4.261 1.00 0.00 H new ATOM 0 HD22 ASN A 132 11.485 -14.999 -3.903 1.00 0.00 H new ATOM 2051 N VAL A 133 9.324 -11.120 -3.508 1.00 0.00 N ATOM 2052 CA VAL A 133 8.101 -10.605 -2.986 1.00 0.00 C ATOM 2053 C VAL A 133 7.039 -11.675 -3.024 1.00 0.00 C ATOM 2054 O VAL A 133 6.507 -12.013 -4.076 1.00 0.00 O ATOM 2055 CB VAL A 133 7.613 -9.341 -3.753 1.00 0.00 C ATOM 2056 CG1 VAL A 133 6.310 -8.808 -3.159 1.00 0.00 C ATOM 2057 CG2 VAL A 133 8.681 -8.256 -3.731 1.00 0.00 C ATOM 0 H VAL A 133 9.291 -11.431 -4.479 1.00 0.00 H new ATOM 0 HA VAL A 133 8.288 -10.303 -1.955 1.00 0.00 H new ATOM 0 HB VAL A 133 7.426 -9.629 -4.787 1.00 0.00 H new ATOM 0 HG11 VAL A 133 5.992 -7.925 -3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.539 -9.576 -3.225 1.00 0.00 H new ATOM 0 HG13 VAL A 133 6.468 -8.542 -2.114 1.00 0.00 H new ATOM 0 HG21 VAL A 133 8.322 -7.381 -4.272 1.00 0.00 H new ATOM 0 HG22 VAL A 133 8.899 -7.981 -2.699 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.588 -8.629 -4.206 1.00 0.00 H new ATOM 2067 N ARG A 134 6.800 -12.247 -1.883 1.00 0.00 N ATOM 2068 CA ARG A 134 5.704 -13.170 -1.692 1.00 0.00 C ATOM 2069 C ARG A 134 4.583 -12.450 -0.962 1.00 0.00 C ATOM 2070 O ARG A 134 3.399 -12.653 -1.225 1.00 0.00 O ATOM 2071 CB ARG A 134 6.150 -14.367 -0.852 1.00 0.00 C ATOM 2072 CG ARG A 134 7.266 -15.181 -1.456 1.00 0.00 C ATOM 2073 CD ARG A 134 6.812 -15.883 -2.709 1.00 0.00 C ATOM 2074 NE ARG A 134 7.906 -16.592 -3.362 1.00 0.00 N ATOM 2075 CZ ARG A 134 7.784 -17.712 -4.072 1.00 0.00 C ATOM 2076 NH1 ARG A 134 6.636 -18.378 -4.079 1.00 0.00 N ATOM 2077 NH2 ARG A 134 8.826 -18.180 -4.736 1.00 0.00 N ATOM 0 H ARG A 134 7.361 -12.090 -1.046 1.00 0.00 H new ATOM 0 HA ARG A 134 5.366 -13.527 -2.665 1.00 0.00 H new ATOM 0 HB2 ARG A 134 6.469 -14.008 0.126 1.00 0.00 H new ATOM 0 HB3 ARG A 134 5.291 -15.018 -0.688 1.00 0.00 H new ATOM 0 HG2 ARG A 134 8.110 -14.531 -1.686 1.00 0.00 H new ATOM 0 HG3 ARG A 134 7.617 -15.916 -0.731 1.00 0.00 H new ATOM 0 HD2 ARG A 134 6.018 -16.588 -2.463 1.00 0.00 H new ATOM 0 HD3 ARG A 134 6.388 -15.154 -3.400 1.00 0.00 H new ATOM 0 HE ARG A 134 8.842 -16.198 -3.267 1.00 0.00 H new ATOM 0 HH11 ARG A 134 5.843 -18.032 -3.539 1.00 0.00 H new ATOM 0 HH12 ARG A 134 6.547 -19.235 -4.624 1.00 0.00 H new ATOM 0 HH21 ARG A 134 9.717 -17.684 -4.703 1.00 0.00 H new ATOM 0 HH22 ARG A 134 8.740 -19.037 -5.282 1.00 0.00 H new ATOM 2091 N SER A 135 4.953 -11.633 -0.028 1.00 0.00 N ATOM 2092 CA SER A 135 4.007 -10.884 0.735 1.00 0.00 C ATOM 2093 C SER A 135 4.646 -9.611 1.215 1.00 0.00 C ATOM 2094 O SER A 135 5.871 -9.536 1.345 1.00 0.00 O ATOM 2095 CB SER A 135 3.498 -11.712 1.923 1.00 0.00 C ATOM 2096 OG SER A 135 2.844 -12.906 1.479 1.00 0.00 O ATOM 0 H SER A 135 5.926 -11.466 0.228 1.00 0.00 H new ATOM 0 HA SER A 135 3.153 -10.639 0.104 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.333 -11.972 2.573 1.00 0.00 H new ATOM 0 HB3 SER A 135 2.806 -11.114 2.517 1.00 0.00 H new ATOM 0 HG SER A 135 2.370 -13.319 2.231 1.00 0.00 H new ATOM 2102 N LEU A 136 3.852 -8.624 1.452 1.00 0.00 N ATOM 2103 CA LEU A 136 4.338 -7.375 1.931 1.00 0.00 C ATOM 2104 C LEU A 136 3.282 -6.839 2.870 1.00 0.00 C ATOM 2105 O LEU A 136 2.090 -6.840 2.535 1.00 0.00 O ATOM 2106 CB LEU A 136 4.564 -6.418 0.726 1.00 0.00 C ATOM 2107 CG LEU A 136 5.417 -5.135 0.937 1.00 0.00 C ATOM 2108 CD1 LEU A 136 5.557 -4.405 -0.365 1.00 0.00 C ATOM 2109 CD2 LEU A 136 4.828 -4.194 1.961 1.00 0.00 C ATOM 0 H LEU A 136 2.841 -8.660 1.318 1.00 0.00 H new ATOM 0 HA LEU A 136 5.290 -7.473 2.452 1.00 0.00 H new ATOM 0 HB2 LEU A 136 5.030 -6.996 -0.072 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.584 -6.107 0.364 1.00 0.00 H new ATOM 0 HG LEU A 136 6.387 -5.462 1.311 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.155 -3.506 -0.216 1.00 0.00 H new ATOM 0 HD12 LEU A 136 6.048 -5.051 -1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.570 -4.127 -0.734 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.470 -3.319 2.062 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.835 -3.881 1.639 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.754 -4.703 2.922 1.00 0.00 H new ATOM 2121 N THR A 137 3.690 -6.437 4.030 1.00 0.00 N ATOM 2122 CA THR A 137 2.774 -5.883 4.970 1.00 0.00 C ATOM 2123 C THR A 137 2.998 -4.368 5.029 1.00 0.00 C ATOM 2124 O THR A 137 4.141 -3.899 5.114 1.00 0.00 O ATOM 2125 CB THR A 137 2.915 -6.553 6.364 1.00 0.00 C ATOM 2126 OG1 THR A 137 2.773 -7.973 6.215 1.00 0.00 O ATOM 2127 CG2 THR A 137 1.842 -6.059 7.322 1.00 0.00 C ATOM 0 H THR A 137 4.658 -6.483 4.349 1.00 0.00 H new ATOM 0 HA THR A 137 1.751 -6.079 4.649 1.00 0.00 H new ATOM 0 HB THR A 137 3.894 -6.298 6.770 1.00 0.00 H new ATOM 0 HG1 THR A 137 3.606 -8.415 6.483 1.00 0.00 H new ATOM 0 HG21 THR A 137 1.966 -6.545 8.289 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.932 -4.980 7.444 1.00 0.00 H new ATOM 0 HG23 THR A 137 0.857 -6.297 6.920 1.00 0.00 H new ATOM 2135 N ILE A 138 1.931 -3.629 4.939 1.00 0.00 N ATOM 2136 CA ILE A 138 1.987 -2.192 4.892 1.00 0.00 C ATOM 2137 C ILE A 138 1.413 -1.627 6.173 1.00 0.00 C ATOM 2138 O ILE A 138 0.275 -1.919 6.524 1.00 0.00 O ATOM 2139 CB ILE A 138 1.170 -1.659 3.681 1.00 0.00 C ATOM 2140 CG1 ILE A 138 1.720 -2.254 2.373 1.00 0.00 C ATOM 2141 CG2 ILE A 138 1.196 -0.127 3.632 1.00 0.00 C ATOM 2142 CD1 ILE A 138 0.947 -1.860 1.134 1.00 0.00 C ATOM 0 H ILE A 138 0.985 -4.009 4.896 1.00 0.00 H new ATOM 0 HA ILE A 138 3.026 -1.881 4.781 1.00 0.00 H new ATOM 0 HB ILE A 138 0.132 -1.970 3.800 1.00 0.00 H new ATOM 0 HG12 ILE A 138 2.757 -1.942 2.254 1.00 0.00 H new ATOM 0 HG13 ILE A 138 1.722 -3.341 2.455 1.00 0.00 H new ATOM 0 HG21 ILE A 138 0.617 0.220 2.776 1.00 0.00 H new ATOM 0 HG22 ILE A 138 0.763 0.274 4.549 1.00 0.00 H new ATOM 0 HG23 ILE A 138 2.226 0.217 3.537 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.402 -2.323 0.259 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -0.085 -2.197 1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 138 0.966 -0.776 1.023 1.00 0.00 H new ATOM 2154 N PHE A 139 2.196 -0.856 6.867 1.00 0.00 N ATOM 2155 CA PHE A 139 1.768 -0.247 8.096 1.00 0.00 C ATOM 2156 C PHE A 139 1.903 1.245 8.024 1.00 0.00 C ATOM 2157 O PHE A 139 2.990 1.764 7.768 1.00 0.00 O ATOM 2158 CB PHE A 139 2.570 -0.800 9.287 1.00 0.00 C ATOM 2159 CG PHE A 139 2.311 -0.094 10.602 1.00 0.00 C ATOM 2160 CD1 PHE A 139 1.077 -0.174 11.219 1.00 0.00 C ATOM 2161 CD2 PHE A 139 3.307 0.659 11.208 1.00 0.00 C ATOM 2162 CE1 PHE A 139 0.835 0.472 12.415 1.00 0.00 C ATOM 2163 CE2 PHE A 139 3.072 1.308 12.404 1.00 0.00 C ATOM 2164 CZ PHE A 139 1.834 1.213 13.008 1.00 0.00 C ATOM 0 H PHE A 139 3.153 -0.629 6.598 1.00 0.00 H new ATOM 0 HA PHE A 139 0.716 -0.492 8.246 1.00 0.00 H new ATOM 0 HB2 PHE A 139 2.337 -1.858 9.405 1.00 0.00 H new ATOM 0 HB3 PHE A 139 3.633 -0.732 9.056 1.00 0.00 H new ATOM 0 HD1 PHE A 139 0.289 -0.751 10.758 1.00 0.00 H new ATOM 0 HD2 PHE A 139 4.277 0.738 10.739 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -0.135 0.397 12.884 1.00 0.00 H new ATOM 0 HE2 PHE A 139 3.856 1.889 12.867 1.00 0.00 H new ATOM 0 HZ PHE A 139 1.649 1.719 13.944 1.00 0.00 H new ATOM 2174 N ILE A 140 0.817 1.936 8.215 1.00 0.00 N ATOM 2175 CA ILE A 140 0.882 3.369 8.304 1.00 0.00 C ATOM 2176 C ILE A 140 0.461 3.784 9.693 1.00 0.00 C ATOM 2177 O ILE A 140 -0.556 3.315 10.206 1.00 0.00 O ATOM 2178 CB ILE A 140 0.109 4.144 7.140 1.00 0.00 C ATOM 2179 CG1 ILE A 140 -1.432 3.992 7.147 1.00 0.00 C ATOM 2180 CG2 ILE A 140 0.646 3.736 5.794 1.00 0.00 C ATOM 2181 CD1 ILE A 140 -2.160 4.885 8.137 1.00 0.00 C ATOM 0 H ILE A 140 -0.117 1.537 8.312 1.00 0.00 H new ATOM 0 HA ILE A 140 1.916 3.672 8.138 1.00 0.00 H new ATOM 0 HB ILE A 140 0.300 5.199 7.339 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -1.808 4.203 6.146 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -1.679 2.953 7.368 1.00 0.00 H new ATOM 0 HG21 ILE A 140 0.110 4.272 5.011 1.00 0.00 H new ATOM 0 HG22 ILE A 140 1.708 3.977 5.737 1.00 0.00 H new ATOM 0 HG23 ILE A 140 0.510 2.663 5.658 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.233 4.706 8.067 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -1.820 4.661 9.148 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -1.950 5.930 7.907 1.00 0.00 H new ATOM 2193 N GLU A 141 1.257 4.592 10.329 1.00 0.00 N ATOM 2194 CA GLU A 141 0.954 4.997 11.687 1.00 0.00 C ATOM 2195 C GLU A 141 0.480 6.429 11.769 1.00 0.00 C ATOM 2196 O GLU A 141 -0.190 6.816 12.733 1.00 0.00 O ATOM 2197 CB GLU A 141 2.142 4.757 12.626 1.00 0.00 C ATOM 2198 CG GLU A 141 3.440 5.424 12.205 1.00 0.00 C ATOM 2199 CD GLU A 141 4.544 5.206 13.214 1.00 0.00 C ATOM 2200 OE1 GLU A 141 5.125 4.100 13.256 1.00 0.00 O ATOM 2201 OE2 GLU A 141 4.838 6.135 13.995 1.00 0.00 O ATOM 0 H GLU A 141 2.115 4.985 9.942 1.00 0.00 H new ATOM 0 HA GLU A 141 0.129 4.367 12.020 1.00 0.00 H new ATOM 0 HB2 GLU A 141 1.876 5.111 13.622 1.00 0.00 H new ATOM 0 HB3 GLU A 141 2.312 3.683 12.705 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.751 5.032 11.237 1.00 0.00 H new ATOM 0 HG3 GLU A 141 3.273 6.493 12.077 1.00 0.00 H new ATOM 2208 N ALA A 142 0.794 7.209 10.765 1.00 0.00 N ATOM 2209 CA ALA A 142 0.443 8.597 10.793 1.00 0.00 C ATOM 2210 C ALA A 142 0.090 9.091 9.423 1.00 0.00 C ATOM 2211 O ALA A 142 0.656 8.644 8.413 1.00 0.00 O ATOM 2212 CB ALA A 142 1.578 9.423 11.378 1.00 0.00 C ATOM 0 H ALA A 142 1.288 6.905 9.926 1.00 0.00 H new ATOM 0 HA ALA A 142 -0.434 8.709 11.430 1.00 0.00 H new ATOM 0 HB1 ALA A 142 1.293 10.475 11.391 1.00 0.00 H new ATOM 0 HB2 ALA A 142 1.784 9.090 12.395 1.00 0.00 H new ATOM 0 HB3 ALA A 142 2.472 9.297 10.767 1.00 0.00 H new ATOM 2218 N ASN A 143 -0.836 9.992 9.374 1.00 0.00 N ATOM 2219 CA ASN A 143 -1.239 10.594 8.134 1.00 0.00 C ATOM 2220 C ASN A 143 -0.638 11.983 8.011 1.00 0.00 C ATOM 2221 O ASN A 143 0.041 12.448 8.934 1.00 0.00 O ATOM 2222 CB ASN A 143 -2.777 10.591 7.950 1.00 0.00 C ATOM 2223 CG ASN A 143 -3.524 11.247 9.080 1.00 0.00 C ATOM 2224 OD1 ASN A 143 -3.772 12.454 9.071 1.00 0.00 O ATOM 2225 ND2 ASN A 143 -3.917 10.456 10.033 1.00 0.00 N ATOM 0 H ASN A 143 -1.339 10.336 10.192 1.00 0.00 H new ATOM 0 HA ASN A 143 -0.849 9.986 7.317 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -3.023 11.101 7.019 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -3.120 9.561 7.849 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -4.454 10.828 10.816 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -3.688 9.463 9.998 1.00 0.00 H new ATOM 2232 N GLN A 144 -0.859 12.606 6.866 1.00 0.00 N ATOM 2233 CA GLN A 144 -0.312 13.909 6.485 1.00 0.00 C ATOM 2234 C GLN A 144 -0.430 14.930 7.627 1.00 0.00 C ATOM 2235 O GLN A 144 0.552 15.567 7.993 1.00 0.00 O ATOM 2236 CB GLN A 144 -1.087 14.445 5.276 1.00 0.00 C ATOM 2237 CG GLN A 144 -0.351 15.470 4.427 1.00 0.00 C ATOM 2238 CD GLN A 144 0.673 14.824 3.503 1.00 0.00 C ATOM 2239 OE1 GLN A 144 0.350 14.468 2.385 1.00 0.00 O ATOM 2240 NE2 GLN A 144 1.891 14.686 3.936 1.00 0.00 N ATOM 0 H GLN A 144 -1.451 12.204 6.139 1.00 0.00 H new ATOM 0 HA GLN A 144 0.743 13.772 6.248 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -1.362 13.603 4.641 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -2.015 14.893 5.631 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -1.072 16.031 3.832 1.00 0.00 H new ATOM 0 HG3 GLN A 144 0.151 16.186 5.078 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.135 14.993 4.878 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.602 14.271 3.334 1.00 0.00 H new ATOM 2249 N SER A 145 -1.622 15.047 8.193 1.00 0.00 N ATOM 2250 CA SER A 145 -1.886 16.041 9.224 1.00 0.00 C ATOM 2251 C SER A 145 -2.028 15.405 10.627 1.00 0.00 C ATOM 2252 O SER A 145 -1.560 15.958 11.620 1.00 0.00 O ATOM 2253 CB SER A 145 -3.172 16.820 8.858 1.00 0.00 C ATOM 2254 OG SER A 145 -3.463 17.866 9.786 1.00 0.00 O ATOM 0 H SER A 145 -2.424 14.464 7.955 1.00 0.00 H new ATOM 0 HA SER A 145 -1.034 16.719 9.267 1.00 0.00 H new ATOM 0 HB2 SER A 145 -3.064 17.244 7.860 1.00 0.00 H new ATOM 0 HB3 SER A 145 -4.013 16.128 8.820 1.00 0.00 H new ATOM 0 HG SER A 145 -4.282 18.329 9.511 1.00 0.00 H new ATOM 2260 N GLY A 146 -2.641 14.247 10.691 1.00 0.00 N ATOM 2261 CA GLY A 146 -2.952 13.632 11.967 1.00 0.00 C ATOM 2262 C GLY A 146 -4.383 13.939 12.330 1.00 0.00 C ATOM 2263 O GLY A 146 -4.695 14.314 13.458 1.00 0.00 O ATOM 0 H GLY A 146 -2.936 13.709 9.876 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -2.802 12.554 11.911 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -2.280 14.008 12.739 1.00 0.00 H new ATOM 2267 N SER A 147 -5.255 13.755 11.361 1.00 0.00 N ATOM 2268 CA SER A 147 -6.653 14.143 11.459 1.00 0.00 C ATOM 2269 C SER A 147 -7.528 13.066 12.154 1.00 0.00 C ATOM 2270 O SER A 147 -8.762 13.153 12.113 1.00 0.00 O ATOM 2271 CB SER A 147 -7.170 14.430 10.026 1.00 0.00 C ATOM 2272 OG SER A 147 -8.511 14.899 10.011 1.00 0.00 O ATOM 0 H SER A 147 -5.012 13.325 10.468 1.00 0.00 H new ATOM 0 HA SER A 147 -6.727 15.033 12.083 1.00 0.00 H new ATOM 0 HB2 SER A 147 -6.525 15.171 9.553 1.00 0.00 H new ATOM 0 HB3 SER A 147 -7.101 13.520 9.430 1.00 0.00 H new ATOM 0 HG SER A 147 -9.009 14.489 10.749 1.00 0.00 H new ATOM 2278 N GLU A 148 -6.888 12.071 12.795 1.00 0.00 N ATOM 2279 CA GLU A 148 -7.580 10.953 13.490 1.00 0.00 C ATOM 2280 C GLU A 148 -8.274 10.001 12.522 1.00 0.00 C ATOM 2281 O GLU A 148 -8.913 9.029 12.935 1.00 0.00 O ATOM 2282 CB GLU A 148 -8.556 11.421 14.583 1.00 0.00 C ATOM 2283 CG GLU A 148 -7.906 12.148 15.738 1.00 0.00 C ATOM 2284 CD GLU A 148 -8.886 12.443 16.841 1.00 0.00 C ATOM 2285 OE1 GLU A 148 -9.152 11.547 17.662 1.00 0.00 O ATOM 2286 OE2 GLU A 148 -9.417 13.573 16.910 1.00 0.00 O ATOM 0 H GLU A 148 -5.871 12.013 12.850 1.00 0.00 H new ATOM 0 HA GLU A 148 -6.783 10.402 13.990 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -9.300 12.077 14.131 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -9.090 10.553 14.971 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -7.088 11.545 16.132 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -7.471 13.081 15.380 1.00 0.00 H new ATOM 2293 N VAL A 149 -8.134 10.269 11.264 1.00 0.00 N ATOM 2294 CA VAL A 149 -8.684 9.453 10.233 1.00 0.00 C ATOM 2295 C VAL A 149 -7.774 9.511 9.032 1.00 0.00 C ATOM 2296 O VAL A 149 -7.290 10.582 8.658 1.00 0.00 O ATOM 2297 CB VAL A 149 -10.150 9.871 9.859 1.00 0.00 C ATOM 2298 CG1 VAL A 149 -10.237 11.335 9.432 1.00 0.00 C ATOM 2299 CG2 VAL A 149 -10.723 8.965 8.772 1.00 0.00 C ATOM 0 H VAL A 149 -7.622 11.080 10.918 1.00 0.00 H new ATOM 0 HA VAL A 149 -8.749 8.428 10.597 1.00 0.00 H new ATOM 0 HB VAL A 149 -10.751 9.753 10.761 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -11.269 11.580 9.182 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -9.900 11.973 10.249 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -9.604 11.498 8.560 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -11.739 9.280 8.535 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -10.104 9.033 7.878 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -10.736 7.934 9.127 1.00 0.00 H new ATOM 2309 N THR A 150 -7.508 8.382 8.471 1.00 0.00 N ATOM 2310 CA THR A 150 -6.666 8.300 7.332 1.00 0.00 C ATOM 2311 C THR A 150 -7.456 7.730 6.168 1.00 0.00 C ATOM 2312 O THR A 150 -7.864 6.570 6.204 1.00 0.00 O ATOM 2313 CB THR A 150 -5.439 7.403 7.628 1.00 0.00 C ATOM 2314 OG1 THR A 150 -4.724 7.923 8.767 1.00 0.00 O ATOM 2315 CG2 THR A 150 -4.501 7.360 6.434 1.00 0.00 C ATOM 0 H THR A 150 -7.872 7.485 8.793 1.00 0.00 H new ATOM 0 HA THR A 150 -6.308 9.298 7.079 1.00 0.00 H new ATOM 0 HB THR A 150 -5.794 6.394 7.835 1.00 0.00 H new ATOM 0 HG1 THR A 150 -4.381 7.179 9.305 1.00 0.00 H new ATOM 0 HG21 THR A 150 -3.647 6.724 6.665 1.00 0.00 H new ATOM 0 HG22 THR A 150 -5.030 6.957 5.570 1.00 0.00 H new ATOM 0 HG23 THR A 150 -4.153 8.368 6.209 1.00 0.00 H new ATOM 2323 N LYS A 151 -7.716 8.555 5.163 1.00 0.00 N ATOM 2324 CA LYS A 151 -8.402 8.076 3.986 1.00 0.00 C ATOM 2325 C LYS A 151 -7.392 7.682 2.945 1.00 0.00 C ATOM 2326 O LYS A 151 -6.423 8.403 2.694 1.00 0.00 O ATOM 2327 CB LYS A 151 -9.343 9.114 3.371 1.00 0.00 C ATOM 2328 CG LYS A 151 -10.472 9.624 4.242 1.00 0.00 C ATOM 2329 CD LYS A 151 -11.393 10.523 3.415 1.00 0.00 C ATOM 2330 CE LYS A 151 -12.543 11.103 4.220 1.00 0.00 C ATOM 2331 NZ LYS A 151 -12.072 11.926 5.350 1.00 0.00 N ATOM 0 H LYS A 151 -7.464 9.543 5.144 1.00 0.00 H new ATOM 0 HA LYS A 151 -9.006 7.226 4.304 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -8.745 9.969 3.058 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -9.779 8.683 2.470 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -11.036 8.786 4.651 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -10.069 10.180 5.089 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -10.808 11.338 2.990 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -11.795 9.950 2.580 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -13.171 11.710 3.568 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -13.165 10.292 4.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -12.879 12.423 5.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -11.625 11.314 6.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -11.379 12.622 5.008 1.00 0.00 H new ATOM 2345 N VAL A 152 -7.614 6.563 2.360 1.00 0.00 N ATOM 2346 CA VAL A 152 -6.786 6.036 1.327 1.00 0.00 C ATOM 2347 C VAL A 152 -7.654 5.817 0.098 1.00 0.00 C ATOM 2348 O VAL A 152 -8.640 5.089 0.165 1.00 0.00 O ATOM 2349 CB VAL A 152 -6.208 4.664 1.754 1.00 0.00 C ATOM 2350 CG1 VAL A 152 -5.287 4.123 0.708 1.00 0.00 C ATOM 2351 CG2 VAL A 152 -5.511 4.728 3.107 1.00 0.00 C ATOM 0 H VAL A 152 -8.405 5.963 2.592 1.00 0.00 H new ATOM 0 HA VAL A 152 -5.969 6.729 1.125 1.00 0.00 H new ATOM 0 HB VAL A 152 -7.052 3.982 1.859 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -4.895 3.159 1.032 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -5.833 3.997 -0.227 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -4.461 4.818 0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -5.122 3.742 3.363 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -4.688 5.441 3.059 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -6.223 5.046 3.868 1.00 0.00 H new ATOM 2361 N GLN A 153 -7.325 6.450 -1.005 1.00 0.00 N ATOM 2362 CA GLN A 153 -8.108 6.238 -2.206 1.00 0.00 C ATOM 2363 C GLN A 153 -7.466 5.214 -3.147 1.00 0.00 C ATOM 2364 O GLN A 153 -8.103 4.738 -4.073 1.00 0.00 O ATOM 2365 CB GLN A 153 -8.553 7.542 -2.895 1.00 0.00 C ATOM 2366 CG GLN A 153 -7.453 8.458 -3.353 1.00 0.00 C ATOM 2367 CD GLN A 153 -7.966 9.748 -3.984 1.00 0.00 C ATOM 2368 OE1 GLN A 153 -8.181 10.741 -3.302 1.00 0.00 O ATOM 2369 NE2 GLN A 153 -8.154 9.749 -5.285 1.00 0.00 N ATOM 0 H GLN A 153 -6.544 7.099 -1.099 1.00 0.00 H new ATOM 0 HA GLN A 153 -9.045 5.785 -1.881 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -9.164 7.282 -3.759 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -9.193 8.093 -2.206 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -6.818 8.705 -2.502 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -6.828 7.932 -4.075 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -7.966 8.906 -5.828 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -8.487 10.593 -5.751 1.00 0.00 H new ATOM 2378 N LYS A 154 -6.192 4.880 -2.894 1.00 0.00 N ATOM 2379 CA LYS A 154 -5.551 3.737 -3.559 1.00 0.00 C ATOM 2380 C LYS A 154 -4.247 3.396 -2.909 1.00 0.00 C ATOM 2381 O LYS A 154 -3.573 4.268 -2.365 1.00 0.00 O ATOM 2382 CB LYS A 154 -5.265 3.876 -5.080 1.00 0.00 C ATOM 2383 CG LYS A 154 -4.116 4.811 -5.447 1.00 0.00 C ATOM 2384 CD LYS A 154 -3.356 4.287 -6.675 1.00 0.00 C ATOM 2385 CE LYS A 154 -2.223 5.193 -7.090 1.00 0.00 C ATOM 2386 NZ LYS A 154 -1.509 4.716 -8.313 1.00 0.00 N ATOM 0 H LYS A 154 -5.590 5.380 -2.240 1.00 0.00 H new ATOM 0 HA LYS A 154 -6.305 2.958 -3.447 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -5.049 2.887 -5.484 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -6.171 4.230 -5.572 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -4.505 5.808 -5.653 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -3.433 4.903 -4.603 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -2.961 3.295 -6.456 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -4.051 4.177 -7.507 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -2.614 6.194 -7.272 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -1.511 5.274 -6.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -0.519 5.032 -8.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -1.540 3.677 -8.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -1.971 5.107 -9.159 1.00 0.00 H new ATOM 2400 N ILE A 155 -3.903 2.140 -2.971 1.00 0.00 N ATOM 2401 CA ILE A 155 -2.596 1.658 -2.607 1.00 0.00 C ATOM 2402 C ILE A 155 -2.129 0.773 -3.729 1.00 0.00 C ATOM 2403 O ILE A 155 -2.715 -0.273 -3.985 1.00 0.00 O ATOM 2404 CB ILE A 155 -2.560 0.862 -1.267 1.00 0.00 C ATOM 2405 CG1 ILE A 155 -3.012 1.752 -0.117 1.00 0.00 C ATOM 2406 CG2 ILE A 155 -1.146 0.337 -1.005 1.00 0.00 C ATOM 2407 CD1 ILE A 155 -3.025 1.080 1.238 1.00 0.00 C ATOM 0 H ILE A 155 -4.537 1.404 -3.283 1.00 0.00 H new ATOM 0 HA ILE A 155 -1.948 2.520 -2.450 1.00 0.00 H new ATOM 0 HB ILE A 155 -3.241 0.014 -1.342 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -2.356 2.621 -0.069 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -4.015 2.121 -0.334 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.132 -0.217 -0.067 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -0.845 -0.321 -1.820 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -0.453 1.176 -0.941 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -3.360 1.791 1.993 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -3.704 0.228 1.215 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -2.020 0.736 1.483 1.00 0.00 H new ATOM 2419 N ALA A 156 -1.120 1.205 -4.416 1.00 0.00 N ATOM 2420 CA ALA A 156 -0.612 0.477 -5.533 1.00 0.00 C ATOM 2421 C ALA A 156 0.871 0.282 -5.379 1.00 0.00 C ATOM 2422 O ALA A 156 1.593 1.192 -4.953 1.00 0.00 O ATOM 2423 CB ALA A 156 -0.939 1.199 -6.825 1.00 0.00 C ATOM 0 H ALA A 156 -0.625 2.074 -4.217 1.00 0.00 H new ATOM 0 HA ALA A 156 -1.086 -0.504 -5.571 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -0.545 0.632 -7.668 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -2.020 1.294 -6.925 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -0.487 2.191 -6.812 1.00 0.00 H new ATOM 2429 N LEU A 157 1.315 -0.884 -5.693 1.00 0.00 N ATOM 2430 CA LEU A 157 2.699 -1.239 -5.575 1.00 0.00 C ATOM 2431 C LEU A 157 3.309 -1.216 -6.950 1.00 0.00 C ATOM 2432 O LEU A 157 2.664 -1.576 -7.904 1.00 0.00 O ATOM 2433 CB LEU A 157 2.860 -2.644 -4.930 1.00 0.00 C ATOM 2434 CG LEU A 157 2.496 -2.811 -3.423 1.00 0.00 C ATOM 2435 CD1 LEU A 157 1.042 -2.483 -3.136 1.00 0.00 C ATOM 2436 CD2 LEU A 157 2.811 -4.222 -2.956 1.00 0.00 C ATOM 0 H LEU A 157 0.723 -1.636 -6.046 1.00 0.00 H new ATOM 0 HA LEU A 157 3.207 -0.525 -4.927 1.00 0.00 H new ATOM 0 HB2 LEU A 157 2.248 -3.343 -5.499 1.00 0.00 H new ATOM 0 HB3 LEU A 157 3.898 -2.952 -5.058 1.00 0.00 H new ATOM 0 HG LEU A 157 3.106 -2.097 -2.869 1.00 0.00 H new ATOM 0 HD11 LEU A 157 0.842 -2.616 -2.073 1.00 0.00 H new ATOM 0 HD12 LEU A 157 0.840 -1.449 -3.417 1.00 0.00 H new ATOM 0 HD13 LEU A 157 0.398 -3.148 -3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 157 2.551 -4.323 -1.902 1.00 0.00 H new ATOM 0 HD22 LEU A 157 2.233 -4.937 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 157 3.875 -4.420 -3.088 1.00 0.00 H new ATOM 2448 N TYR A 158 4.508 -0.746 -7.069 1.00 0.00 N ATOM 2449 CA TYR A 158 5.153 -0.703 -8.364 1.00 0.00 C ATOM 2450 C TYR A 158 6.483 -1.405 -8.335 1.00 0.00 C ATOM 2451 O TYR A 158 7.233 -1.317 -7.368 1.00 0.00 O ATOM 2452 CB TYR A 158 5.251 0.733 -8.884 1.00 0.00 C ATOM 2453 CG TYR A 158 3.888 1.359 -9.097 1.00 0.00 C ATOM 2454 CD1 TYR A 158 3.252 2.037 -8.080 1.00 0.00 C ATOM 2455 CD2 TYR A 158 3.229 1.240 -10.309 1.00 0.00 C ATOM 2456 CE1 TYR A 158 2.003 2.570 -8.262 1.00 0.00 C ATOM 2457 CE2 TYR A 158 1.980 1.783 -10.498 1.00 0.00 C ATOM 2458 CZ TYR A 158 1.370 2.445 -9.470 1.00 0.00 C ATOM 2459 OH TYR A 158 0.096 2.960 -9.639 1.00 0.00 O ATOM 0 H TYR A 158 5.068 -0.385 -6.296 1.00 0.00 H new ATOM 0 HA TYR A 158 4.532 -1.249 -9.074 1.00 0.00 H new ATOM 0 HB2 TYR A 158 5.819 1.336 -8.176 1.00 0.00 H new ATOM 0 HB3 TYR A 158 5.803 0.740 -9.824 1.00 0.00 H new ATOM 0 HD1 TYR A 158 3.745 2.150 -7.126 1.00 0.00 H new ATOM 0 HD2 TYR A 158 3.705 0.711 -11.121 1.00 0.00 H new ATOM 0 HE1 TYR A 158 1.516 3.090 -7.450 1.00 0.00 H new ATOM 0 HE2 TYR A 158 1.484 1.687 -11.453 1.00 0.00 H new ATOM 0 HH TYR A 158 -0.524 2.234 -9.860 1.00 0.00 H new ATOM 2469 N GLY A 159 6.759 -2.115 -9.366 1.00 0.00 N ATOM 2470 CA GLY A 159 7.965 -2.874 -9.440 1.00 0.00 C ATOM 2471 C GLY A 159 8.114 -3.475 -10.787 1.00 0.00 C ATOM 2472 O GLY A 159 7.521 -2.958 -11.746 1.00 0.00 O ATOM 0 H GLY A 159 6.158 -2.191 -10.187 1.00 0.00 H new ATOM 0 HA2 GLY A 159 8.820 -2.233 -9.224 1.00 0.00 H new ATOM 0 HA3 GLY A 159 7.956 -3.659 -8.683 1.00 0.00 H new ATOM 2476 N SER A 160 8.846 -4.572 -10.900 1.00 0.00 N ATOM 2477 CA SER A 160 9.087 -5.124 -12.196 1.00 0.00 C ATOM 2478 C SER A 160 9.533 -6.568 -12.147 1.00 0.00 C ATOM 2479 O SER A 160 10.058 -7.047 -11.129 1.00 0.00 O ATOM 2480 CB SER A 160 10.122 -4.262 -12.911 1.00 0.00 C ATOM 2481 OG SER A 160 11.292 -4.096 -12.112 1.00 0.00 O ATOM 0 H SER A 160 9.269 -5.078 -10.122 1.00 0.00 H new ATOM 0 HA SER A 160 8.146 -5.120 -12.746 1.00 0.00 H new ATOM 0 HB2 SER A 160 10.390 -4.723 -13.862 1.00 0.00 H new ATOM 0 HB3 SER A 160 9.692 -3.287 -13.139 1.00 0.00 H new ATOM 0 HG SER A 160 11.290 -3.202 -11.712 1.00 0.00 H new ATOM 2487 N THR A 161 9.274 -7.256 -13.214 1.00 0.00 N ATOM 2488 CA THR A 161 9.738 -8.583 -13.413 1.00 0.00 C ATOM 2489 C THR A 161 11.002 -8.539 -14.270 1.00 0.00 C ATOM 2490 O THR A 161 12.092 -8.291 -13.719 1.00 0.00 O ATOM 2491 CB THR A 161 8.649 -9.426 -14.107 1.00 0.00 C ATOM 2492 OG1 THR A 161 8.194 -8.749 -15.296 1.00 0.00 O ATOM 2493 CG2 THR A 161 7.489 -9.632 -13.183 1.00 0.00 C ATOM 2494 OXT THR A 161 10.907 -8.722 -15.497 1.00 0.00 O ATOM 0 H THR A 161 8.718 -6.895 -13.989 1.00 0.00 H new ATOM 0 HA THR A 161 9.965 -9.043 -12.451 1.00 0.00 H new ATOM 0 HB THR A 161 9.072 -10.394 -14.374 1.00 0.00 H new ATOM 0 HG1 THR A 161 8.963 -8.529 -15.862 1.00 0.00 H new ATOM 0 HG21 THR A 161 6.726 -10.228 -13.684 1.00 0.00 H new ATOM 0 HG22 THR A 161 7.826 -10.152 -12.286 1.00 0.00 H new ATOM 0 HG23 THR A 161 7.069 -8.665 -12.905 1.00 0.00 H new TER 2502 THR A 161