USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 513 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 46 THR OG1 : rot 180:sc= -0.2 USER MOD Set 1.2: A 48 SER OG : rot -83:sc= 0.0841 USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= -0.112 USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.0005) USER MOD Single : A 9 HIS :FLIP no HD1:sc= -0.692 F(o=-2,f=-0.69) USER MOD Single : A 10 MET CE :methyl 138:sc= -0.959 (180deg=-2.61!) USER MOD Single : A 11 ASN : amide:sc= -0.149 X(o=-0.15,f=-0.44) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN :FLIP amide:sc= -2.73! C(o=-3.5!,f=-2.7!) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.817 K(o=-0.82,f=-2.5) USER MOD Single : A 21 TYR OH : rot 30:sc= 0 USER MOD Single : A 23 TYR OH : rot -17:sc= 0.85 USER MOD Single : A 24 SER OG : rot 118:sc= 1.19 USER MOD Single : A 25 HIS : no HD1:sc= -0.0536 X(o=-0.054,f=-0.025) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -141:sc= -1.27 (180deg=-3.71!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 CYS SG : rot 79:sc= -3.43! USER MOD Single : A 49 GLN : amide:sc= -2.02 K(o=-2,f=-5.4!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= 0.574 K(o=0.57,f=-1) USER MOD Single : A 56 ASN : amide:sc= -1.07 K(o=-1.1,f=-3.6!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 180:sc= -0.103 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 160:sc= -0.0397 (180deg=-0.278) USER MOD Single : A 64 ASN : amide:sc= -1.33 K(o=-1.3,f=-4.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 19.796 6.866 -16.272 1.00 15.00 N ATOM 2 CA SER A 1 21.012 6.846 -15.418 1.00 15.00 C ATOM 3 C SER A 1 21.373 5.423 -15.005 1.00 15.00 C ATOM 4 O SER A 1 22.494 4.967 -15.227 1.00 15.00 O ATOM 5 CB SER A 1 20.750 7.705 -14.179 1.00 15.00 C ATOM 6 OG SER A 1 21.255 9.018 -14.353 1.00 15.00 O ATOM 0 H1 SER A 1 19.574 7.847 -16.538 1.00 15.00 H new ATOM 0 H2 SER A 1 19.966 6.305 -17.131 1.00 15.00 H new ATOM 0 H3 SER A 1 18.996 6.461 -15.746 1.00 15.00 H new ATOM 0 HA SER A 1 21.853 7.246 -15.983 1.00 15.00 H new ATOM 0 HB2 SER A 1 19.679 7.747 -13.982 1.00 15.00 H new ATOM 0 HB3 SER A 1 21.217 7.245 -13.308 1.00 15.00 H new ATOM 0 HG SER A 1 21.074 9.548 -13.549 1.00 15.00 H new ATOM 14 N SER A 2 20.414 4.726 -14.403 1.00 15.00 N ATOM 15 CA SER A 2 20.631 3.355 -13.958 1.00 15.00 C ATOM 16 C SER A 2 19.309 2.598 -13.865 1.00 15.00 C ATOM 17 O SER A 2 19.029 1.716 -14.678 1.00 15.00 O ATOM 18 CB SER A 2 21.336 3.341 -12.601 1.00 15.00 C ATOM 19 OG SER A 2 22.609 3.959 -12.681 1.00 15.00 O ATOM 0 H SER A 2 19.480 5.089 -14.213 1.00 15.00 H new ATOM 0 HA SER A 2 21.264 2.857 -14.693 1.00 15.00 H new ATOM 0 HB2 SER A 2 20.723 3.859 -11.864 1.00 15.00 H new ATOM 0 HB3 SER A 2 21.448 2.313 -12.257 1.00 15.00 H new ATOM 0 HG SER A 2 23.038 3.939 -11.800 1.00 15.00 H new ATOM 25 N GLY A 3 18.501 2.948 -12.870 1.00 15.00 N ATOM 26 CA GLY A 3 17.220 2.293 -12.689 1.00 15.00 C ATOM 27 C GLY A 3 16.212 2.687 -13.750 1.00 15.00 C ATOM 28 O GLY A 3 16.535 3.429 -14.678 1.00 15.00 O ATOM 0 H GLY A 3 18.711 3.674 -12.185 1.00 15.00 H new ATOM 0 HA2 GLY A 3 17.362 1.212 -12.710 1.00 15.00 H new ATOM 0 HA3 GLY A 3 16.823 2.543 -11.705 1.00 15.00 H new ATOM 32 N HIS A 4 14.987 2.191 -13.613 1.00 15.00 N ATOM 33 CA HIS A 4 13.927 2.496 -14.566 1.00 15.00 C ATOM 34 C HIS A 4 13.022 3.604 -14.038 1.00 15.00 C ATOM 35 O HIS A 4 13.236 4.125 -12.943 1.00 15.00 O ATOM 36 CB HIS A 4 13.101 1.242 -14.861 1.00 15.00 C ATOM 37 CG HIS A 4 13.477 0.564 -16.142 1.00 15.00 C ATOM 38 ND1 HIS A 4 14.118 -0.656 -16.188 1.00 15.00 N ATOM 39 CD2 HIS A 4 13.299 0.943 -17.430 1.00 15.00 C ATOM 40 CE1 HIS A 4 14.318 -0.999 -17.449 1.00 15.00 C ATOM 41 NE2 HIS A 4 13.830 -0.046 -18.221 1.00 15.00 N ATOM 0 H HIS A 4 14.704 1.576 -12.850 1.00 15.00 H new ATOM 0 HA HIS A 4 14.392 2.842 -15.490 1.00 15.00 H new ATOM 0 HB2 HIS A 4 13.220 0.537 -14.038 1.00 15.00 H new ATOM 0 HB3 HIS A 4 12.046 1.513 -14.899 1.00 15.00 H new ATOM 0 HD2 HIS A 4 12.828 1.853 -17.771 1.00 15.00 H new ATOM 0 HE1 HIS A 4 14.799 -1.904 -17.789 1.00 15.00 H new ATOM 0 HE2 HIS A 4 13.845 -0.044 -19.241 1.00 15.00 H new ATOM 50 N ILE A 5 12.011 3.960 -14.824 1.00 15.00 N ATOM 51 CA ILE A 5 11.073 5.005 -14.435 1.00 15.00 C ATOM 52 C ILE A 5 11.794 6.329 -14.197 1.00 15.00 C ATOM 53 O ILE A 5 11.740 6.892 -13.104 1.00 15.00 O ATOM 54 CB ILE A 5 10.296 4.618 -13.162 1.00 15.00 C ATOM 55 CG1 ILE A 5 9.755 3.191 -13.281 1.00 15.00 C ATOM 56 CG2 ILE A 5 9.161 5.602 -12.913 1.00 15.00 C ATOM 57 CD1 ILE A 5 10.546 2.178 -12.481 1.00 15.00 C ATOM 0 H ILE A 5 11.821 3.540 -15.734 1.00 15.00 H new ATOM 0 HA ILE A 5 10.368 5.121 -15.259 1.00 15.00 H new ATOM 0 HB ILE A 5 10.978 4.658 -12.313 1.00 15.00 H new ATOM 0 HG12 ILE A 5 8.717 3.175 -12.948 1.00 15.00 H new ATOM 0 HG13 ILE A 5 9.758 2.896 -14.330 1.00 15.00 H new ATOM 0 HG21 ILE A 5 8.622 5.315 -12.010 1.00 15.00 H new ATOM 0 HG22 ILE A 5 9.570 6.605 -12.788 1.00 15.00 H new ATOM 0 HG23 ILE A 5 8.478 5.592 -13.762 1.00 15.00 H new ATOM 0 HD11 ILE A 5 10.107 1.189 -12.611 1.00 15.00 H new ATOM 0 HD12 ILE A 5 11.579 2.166 -12.829 1.00 15.00 H new ATOM 0 HD13 ILE A 5 10.522 2.449 -11.426 1.00 15.00 H new ATOM 69 N GLU A 6 12.467 6.822 -15.232 1.00 15.00 N ATOM 70 CA GLU A 6 13.198 8.080 -15.137 1.00 15.00 C ATOM 71 C GLU A 6 12.273 9.268 -15.379 1.00 15.00 C ATOM 72 O GLU A 6 12.183 9.781 -16.495 1.00 15.00 O ATOM 73 CB GLU A 6 14.349 8.103 -16.146 1.00 15.00 C ATOM 74 CG GLU A 6 13.908 7.843 -17.578 1.00 15.00 C ATOM 75 CD GLU A 6 14.254 6.445 -18.049 1.00 15.00 C ATOM 76 OE1 GLU A 6 15.460 6.130 -18.140 1.00 15.00 O ATOM 77 OE2 GLU A 6 13.321 5.664 -18.328 1.00 15.00 O ATOM 0 H GLU A 6 12.521 6.370 -16.145 1.00 15.00 H new ATOM 0 HA GLU A 6 13.605 8.158 -14.129 1.00 15.00 H new ATOM 0 HB2 GLU A 6 14.844 9.073 -16.098 1.00 15.00 H new ATOM 0 HB3 GLU A 6 15.087 7.353 -15.860 1.00 15.00 H new ATOM 0 HG2 GLU A 6 12.831 7.992 -17.656 1.00 15.00 H new ATOM 0 HG3 GLU A 6 14.379 8.572 -18.237 1.00 15.00 H new ATOM 84 N GLY A 7 11.585 9.699 -14.327 1.00 15.00 N ATOM 85 CA GLY A 7 10.675 10.822 -14.445 1.00 15.00 C ATOM 86 C GLY A 7 9.845 11.031 -13.194 1.00 15.00 C ATOM 87 O GLY A 7 10.204 11.830 -12.329 1.00 15.00 O ATOM 0 H GLY A 7 11.642 9.290 -13.394 1.00 15.00 H new ATOM 0 HA2 GLY A 7 11.245 11.727 -14.654 1.00 15.00 H new ATOM 0 HA3 GLY A 7 10.011 10.660 -15.294 1.00 15.00 H new ATOM 91 N ARG A 8 8.731 10.313 -13.098 1.00 15.00 N ATOM 92 CA ARG A 8 7.848 10.423 -11.945 1.00 15.00 C ATOM 93 C ARG A 8 8.407 9.650 -10.754 1.00 15.00 C ATOM 94 O ARG A 8 8.932 8.547 -10.908 1.00 15.00 O ATOM 95 CB ARG A 8 6.451 9.907 -12.295 1.00 15.00 C ATOM 96 CG ARG A 8 5.744 10.742 -13.351 1.00 15.00 C ATOM 97 CD ARG A 8 4.492 10.051 -13.866 1.00 15.00 C ATOM 98 NE ARG A 8 4.644 9.601 -15.248 1.00 15.00 N ATOM 99 CZ ARG A 8 3.623 9.367 -16.069 1.00 15.00 C ATOM 100 NH1 ARG A 8 2.374 9.535 -15.652 1.00 15.00 N ATOM 101 NH2 ARG A 8 3.851 8.963 -17.311 1.00 15.00 N ATOM 0 H ARG A 8 8.419 9.648 -13.806 1.00 15.00 H new ATOM 0 HA ARG A 8 7.780 11.476 -11.670 1.00 15.00 H new ATOM 0 HB2 ARG A 8 6.530 8.879 -12.649 1.00 15.00 H new ATOM 0 HB3 ARG A 8 5.842 9.887 -11.391 1.00 15.00 H new ATOM 0 HG2 ARG A 8 5.478 11.712 -12.931 1.00 15.00 H new ATOM 0 HG3 ARG A 8 6.424 10.930 -14.182 1.00 15.00 H new ATOM 0 HD2 ARG A 8 4.262 9.196 -13.230 1.00 15.00 H new ATOM 0 HD3 ARG A 8 3.646 10.735 -13.799 1.00 15.00 H new ATOM 0 HE ARG A 8 5.589 9.458 -15.605 1.00 15.00 H new ATOM 0 HH11 ARG A 8 2.192 9.845 -14.697 1.00 15.00 H new ATOM 0 HH12 ARG A 8 1.596 9.354 -16.286 1.00 15.00 H new ATOM 0 HH21 ARG A 8 4.809 8.832 -17.637 1.00 15.00 H new ATOM 0 HH22 ARG A 8 3.069 8.784 -17.941 1.00 15.00 H new ATOM 115 N HIS A 9 8.296 10.240 -9.568 1.00 15.00 N ATOM 116 CA HIS A 9 8.793 9.611 -8.350 1.00 15.00 C ATOM 117 C HIS A 9 7.794 8.589 -7.813 1.00 15.00 C ATOM 118 O HIS A 9 7.229 8.767 -6.734 1.00 15.00 O ATOM 119 CB HIS A 9 9.078 10.672 -7.287 1.00 15.00 C ATOM 120 CG HIS A 9 7.914 11.576 -7.019 1.00 15.00 C ATOM 121 ND1 HIS A 9 6.596 11.427 -7.293 1.00 15.00 N flip ATOM 122 CD2 HIS A 9 8.040 12.802 -6.401 1.00 15.00 C flip ATOM 123 CE1 HIS A 9 5.957 12.554 -6.839 1.00 15.00 C flip ATOM 124 NE2 HIS A 9 6.849 13.367 -6.305 1.00 15.00 N flip ATOM 0 H HIS A 9 7.866 11.154 -9.425 1.00 15.00 H new ATOM 0 HA HIS A 9 9.719 9.089 -8.592 1.00 15.00 H new ATOM 0 HB2 HIS A 9 9.365 10.177 -6.359 1.00 15.00 H new ATOM 0 HB3 HIS A 9 9.930 11.274 -7.604 1.00 15.00 H new ATOM 0 HD2 HIS A 9 8.966 13.233 -6.050 1.00 15.00 H new ATOM 0 HE1 HIS A 9 4.896 12.744 -6.908 1.00 15.00 H new ATOM 0 HE2 HIS A 9 6.653 14.277 -5.889 1.00 15.00 H new ATOM 133 N MET A 10 7.590 7.514 -8.566 1.00 15.00 N ATOM 134 CA MET A 10 6.675 6.460 -8.162 1.00 15.00 C ATOM 135 C MET A 10 7.352 5.554 -7.143 1.00 15.00 C ATOM 136 O MET A 10 8.296 5.968 -6.469 1.00 15.00 O ATOM 137 CB MET A 10 6.223 5.654 -9.382 1.00 15.00 C ATOM 138 CG MET A 10 5.847 6.517 -10.576 1.00 15.00 C ATOM 139 SD MET A 10 4.920 5.606 -11.826 1.00 15.00 S ATOM 140 CE MET A 10 3.576 4.951 -10.841 1.00 15.00 C ATOM 0 H MET A 10 8.049 7.352 -9.462 1.00 15.00 H new ATOM 0 HA MET A 10 5.794 6.908 -7.703 1.00 15.00 H new ATOM 0 HB2 MET A 10 7.023 4.973 -9.674 1.00 15.00 H new ATOM 0 HB3 MET A 10 5.367 5.040 -9.104 1.00 15.00 H new ATOM 0 HG2 MET A 10 5.253 7.364 -10.234 1.00 15.00 H new ATOM 0 HG3 MET A 10 6.753 6.924 -11.025 1.00 15.00 H new ATOM 0 HE1 MET A 10 2.641 5.041 -11.395 1.00 15.00 H new ATOM 0 HE2 MET A 10 3.766 3.901 -10.619 1.00 15.00 H new ATOM 0 HE3 MET A 10 3.501 5.511 -9.909 1.00 15.00 H new ATOM 150 N ASN A 11 6.887 4.317 -7.039 1.00 15.00 N ATOM 151 CA ASN A 11 7.479 3.376 -6.106 1.00 15.00 C ATOM 152 C ASN A 11 7.369 1.947 -6.628 1.00 15.00 C ATOM 153 O ASN A 11 6.403 1.596 -7.305 1.00 15.00 O ATOM 154 CB ASN A 11 6.818 3.491 -4.732 1.00 15.00 C ATOM 155 CG ASN A 11 7.563 2.712 -3.666 1.00 15.00 C ATOM 156 OD1 ASN A 11 8.792 2.746 -3.602 1.00 15.00 O ATOM 157 ND2 ASN A 11 6.821 2.005 -2.822 1.00 15.00 N ATOM 0 H ASN A 11 6.109 3.946 -7.585 1.00 15.00 H new ATOM 0 HA ASN A 11 8.536 3.623 -6.006 1.00 15.00 H new ATOM 0 HB2 ASN A 11 6.768 4.541 -4.443 1.00 15.00 H new ATOM 0 HB3 ASN A 11 5.792 3.128 -4.794 1.00 15.00 H new ATOM 0 HD21 ASN A 11 7.267 1.461 -2.083 1.00 15.00 H new ATOM 0 HD22 ASN A 11 5.805 2.006 -2.912 1.00 15.00 H new ATOM 164 N LYS A 12 8.369 1.131 -6.316 1.00 15.00 N ATOM 165 CA LYS A 12 8.393 -0.258 -6.759 1.00 15.00 C ATOM 166 C LYS A 12 7.291 -1.076 -6.092 1.00 15.00 C ATOM 167 O LYS A 12 6.439 -1.654 -6.768 1.00 15.00 O ATOM 168 CB LYS A 12 9.757 -0.883 -6.461 1.00 15.00 C ATOM 169 CG LYS A 12 10.299 -1.732 -7.599 1.00 15.00 C ATOM 170 CD LYS A 12 11.818 -1.746 -7.610 1.00 15.00 C ATOM 171 CE LYS A 12 12.383 -0.415 -8.082 1.00 15.00 C ATOM 172 NZ LYS A 12 12.395 -0.312 -9.567 1.00 15.00 N ATOM 0 H LYS A 12 9.176 1.408 -5.757 1.00 15.00 H new ATOM 0 HA LYS A 12 8.217 -0.267 -7.835 1.00 15.00 H new ATOM 0 HB2 LYS A 12 10.470 -0.089 -6.239 1.00 15.00 H new ATOM 0 HB3 LYS A 12 9.677 -1.499 -5.565 1.00 15.00 H new ATOM 0 HG2 LYS A 12 9.926 -2.752 -7.503 1.00 15.00 H new ATOM 0 HG3 LYS A 12 9.931 -1.346 -8.549 1.00 15.00 H new ATOM 0 HD2 LYS A 12 12.188 -1.965 -6.609 1.00 15.00 H new ATOM 0 HD3 LYS A 12 12.171 -2.545 -8.262 1.00 15.00 H new ATOM 0 HE2 LYS A 12 11.789 0.399 -7.666 1.00 15.00 H new ATOM 0 HE3 LYS A 12 13.398 -0.296 -7.702 1.00 15.00 H new ATOM 0 HZ1 LYS A 12 12.787 0.609 -9.848 1.00 15.00 H new ATOM 0 HZ2 LYS A 12 12.982 -1.073 -9.963 1.00 15.00 H new ATOM 0 HZ3 LYS A 12 11.424 -0.400 -9.929 1.00 15.00 H new ATOM 186 N GLN A 13 7.320 -1.135 -4.763 1.00 15.00 N ATOM 187 CA GLN A 13 6.332 -1.896 -4.007 1.00 15.00 C ATOM 188 C GLN A 13 4.911 -1.496 -4.381 1.00 15.00 C ATOM 189 O GLN A 13 4.106 -2.343 -4.765 1.00 15.00 O ATOM 190 CB GLN A 13 6.564 -1.709 -2.509 1.00 15.00 C ATOM 191 CG GLN A 13 7.835 -2.374 -1.989 1.00 15.00 C ATOM 192 CD GLN A 13 8.881 -2.621 -3.065 1.00 15.00 C ATOM 193 OE1 GLN A 13 8.634 -3.607 -3.922 1.00 15.00 O flip ATOM 194 NE2 GLN A 13 9.898 -1.931 -3.125 1.00 15.00 N flip ATOM 0 H GLN A 13 8.018 -0.664 -4.188 1.00 15.00 H new ATOM 0 HA GLN A 13 6.453 -2.950 -4.259 1.00 15.00 H new ATOM 0 HB2 GLN A 13 6.609 -0.642 -2.289 1.00 15.00 H new ATOM 0 HB3 GLN A 13 5.708 -2.111 -1.966 1.00 15.00 H new ATOM 0 HG2 GLN A 13 8.269 -1.748 -1.210 1.00 15.00 H new ATOM 0 HG3 GLN A 13 7.573 -3.325 -1.525 1.00 15.00 H new ATOM 0 HE21 GLN A 13 10.048 -1.184 -2.447 1.00 15.00 H new ATOM 0 HE22 GLN A 13 10.591 -2.106 -3.853 1.00 15.00 H new ATOM 203 N ALA A 14 4.602 -0.208 -4.283 1.00 15.00 N ATOM 204 CA ALA A 14 3.270 0.271 -4.633 1.00 15.00 C ATOM 205 C ALA A 14 2.878 -0.248 -6.010 1.00 15.00 C ATOM 206 O ALA A 14 1.778 -0.754 -6.207 1.00 15.00 O ATOM 207 CB ALA A 14 3.222 1.790 -4.599 1.00 15.00 C ATOM 0 H ALA A 14 5.247 0.516 -3.968 1.00 15.00 H new ATOM 0 HA ALA A 14 2.557 -0.106 -3.900 1.00 15.00 H new ATOM 0 HB1 ALA A 14 2.220 2.128 -4.863 1.00 15.00 H new ATOM 0 HB2 ALA A 14 3.471 2.140 -3.597 1.00 15.00 H new ATOM 0 HB3 ALA A 14 3.941 2.193 -5.313 1.00 15.00 H new ATOM 213 N THR A 15 3.806 -0.147 -6.950 1.00 15.00 N ATOM 214 CA THR A 15 3.585 -0.633 -8.307 1.00 15.00 C ATOM 215 C THR A 15 3.211 -2.109 -8.267 1.00 15.00 C ATOM 216 O THR A 15 2.436 -2.590 -9.092 1.00 15.00 O ATOM 217 CB THR A 15 4.862 -0.426 -9.127 1.00 15.00 C ATOM 218 OG1 THR A 15 4.724 0.677 -10.005 1.00 15.00 O ATOM 219 CG2 THR A 15 5.274 -1.627 -9.957 1.00 15.00 C ATOM 0 H THR A 15 4.725 0.269 -6.798 1.00 15.00 H new ATOM 0 HA THR A 15 2.769 -0.081 -8.772 1.00 15.00 H new ATOM 0 HB THR A 15 5.639 -0.251 -8.383 1.00 15.00 H new ATOM 0 HG1 THR A 15 5.551 0.792 -10.518 1.00 15.00 H new ATOM 0 HG21 THR A 15 6.187 -1.394 -10.505 1.00 15.00 H new ATOM 0 HG22 THR A 15 5.452 -2.479 -9.301 1.00 15.00 H new ATOM 0 HG23 THR A 15 4.480 -1.872 -10.662 1.00 15.00 H new ATOM 227 N GLU A 16 3.755 -2.808 -7.280 1.00 15.00 N ATOM 228 CA GLU A 16 3.468 -4.225 -7.099 1.00 15.00 C ATOM 229 C GLU A 16 2.119 -4.365 -6.420 1.00 15.00 C ATOM 230 O GLU A 16 1.385 -5.326 -6.640 1.00 15.00 O ATOM 231 CB GLU A 16 4.558 -4.899 -6.266 1.00 15.00 C ATOM 232 CG GLU A 16 5.928 -4.878 -6.925 1.00 15.00 C ATOM 233 CD GLU A 16 6.105 -5.995 -7.935 1.00 15.00 C ATOM 234 OE1 GLU A 16 5.395 -5.983 -8.962 1.00 15.00 O ATOM 235 OE2 GLU A 16 6.954 -6.880 -7.698 1.00 15.00 O ATOM 0 H GLU A 16 4.398 -2.417 -6.592 1.00 15.00 H new ATOM 0 HA GLU A 16 3.445 -4.717 -8.071 1.00 15.00 H new ATOM 0 HB2 GLU A 16 4.622 -4.403 -5.297 1.00 15.00 H new ATOM 0 HB3 GLU A 16 4.271 -5.933 -6.076 1.00 15.00 H new ATOM 0 HG2 GLU A 16 6.074 -3.918 -7.421 1.00 15.00 H new ATOM 0 HG3 GLU A 16 6.698 -4.961 -6.158 1.00 15.00 H new ATOM 242 N ILE A 17 1.799 -3.360 -5.617 1.00 15.00 N ATOM 243 CA ILE A 17 0.537 -3.296 -4.914 1.00 15.00 C ATOM 244 C ILE A 17 -0.570 -3.018 -5.918 1.00 15.00 C ATOM 245 O ILE A 17 -1.631 -3.642 -5.900 1.00 15.00 O ATOM 246 CB ILE A 17 0.581 -2.163 -3.867 1.00 15.00 C ATOM 247 CG1 ILE A 17 1.406 -2.569 -2.642 1.00 15.00 C ATOM 248 CG2 ILE A 17 -0.823 -1.746 -3.456 1.00 15.00 C ATOM 249 CD1 ILE A 17 1.216 -4.008 -2.223 1.00 15.00 C ATOM 0 H ILE A 17 2.414 -2.566 -5.438 1.00 15.00 H new ATOM 0 HA ILE A 17 0.349 -4.242 -4.406 1.00 15.00 H new ATOM 0 HB ILE A 17 1.069 -1.306 -4.330 1.00 15.00 H new ATOM 0 HG12 ILE A 17 2.461 -2.400 -2.855 1.00 15.00 H new ATOM 0 HG13 ILE A 17 1.141 -1.920 -1.807 1.00 15.00 H new ATOM 0 HG21 ILE A 17 -0.764 -0.946 -2.718 1.00 15.00 H new ATOM 0 HG22 ILE A 17 -1.368 -1.392 -4.331 1.00 15.00 H new ATOM 0 HG23 ILE A 17 -1.345 -2.600 -3.025 1.00 15.00 H new ATOM 0 HD11 ILE A 17 1.834 -4.217 -1.349 1.00 15.00 H new ATOM 0 HD12 ILE A 17 0.168 -4.180 -1.976 1.00 15.00 H new ATOM 0 HD13 ILE A 17 1.509 -4.667 -3.041 1.00 15.00 H new ATOM 261 N LEU A 18 -0.281 -2.076 -6.802 1.00 15.00 N ATOM 262 CA LEU A 18 -1.195 -1.675 -7.853 1.00 15.00 C ATOM 263 C LEU A 18 -1.365 -2.805 -8.854 1.00 15.00 C ATOM 264 O LEU A 18 -2.468 -3.074 -9.332 1.00 15.00 O ATOM 265 CB LEU A 18 -0.627 -0.448 -8.552 1.00 15.00 C ATOM 266 CG LEU A 18 -0.438 0.781 -7.658 1.00 15.00 C ATOM 267 CD1 LEU A 18 0.153 1.933 -8.451 1.00 15.00 C ATOM 268 CD2 LEU A 18 -1.758 1.189 -7.020 1.00 15.00 C ATOM 0 H LEU A 18 0.602 -1.566 -6.808 1.00 15.00 H new ATOM 0 HA LEU A 18 -2.169 -1.441 -7.424 1.00 15.00 H new ATOM 0 HB2 LEU A 18 0.336 -0.712 -8.989 1.00 15.00 H new ATOM 0 HB3 LEU A 18 -1.288 -0.180 -9.376 1.00 15.00 H new ATOM 0 HG LEU A 18 0.259 0.521 -6.862 1.00 15.00 H new ATOM 0 HD11 LEU A 18 0.280 2.797 -7.798 1.00 15.00 H new ATOM 0 HD12 LEU A 18 1.122 1.638 -8.854 1.00 15.00 H new ATOM 0 HD13 LEU A 18 -0.517 2.193 -9.270 1.00 15.00 H new ATOM 0 HD21 LEU A 18 -1.602 2.064 -6.389 1.00 15.00 H new ATOM 0 HD22 LEU A 18 -2.481 1.429 -7.800 1.00 15.00 H new ATOM 0 HD23 LEU A 18 -2.138 0.367 -6.413 1.00 15.00 H new ATOM 280 N ASN A 19 -0.256 -3.472 -9.157 1.00 15.00 N ATOM 281 CA ASN A 19 -0.268 -4.588 -10.092 1.00 15.00 C ATOM 282 C ASN A 19 -1.100 -5.721 -9.518 1.00 15.00 C ATOM 283 O ASN A 19 -2.005 -6.239 -10.171 1.00 15.00 O ATOM 284 CB ASN A 19 1.157 -5.069 -10.374 1.00 15.00 C ATOM 285 CG ASN A 19 1.276 -5.780 -11.708 1.00 15.00 C ATOM 286 OD1 ASN A 19 1.192 -7.005 -11.781 1.00 15.00 O ATOM 287 ND2 ASN A 19 1.477 -5.010 -12.771 1.00 15.00 N ATOM 0 H ASN A 19 0.662 -3.258 -8.768 1.00 15.00 H new ATOM 0 HA ASN A 19 -0.709 -4.257 -11.033 1.00 15.00 H new ATOM 0 HB2 ASN A 19 1.835 -4.216 -10.359 1.00 15.00 H new ATOM 0 HB3 ASN A 19 1.474 -5.742 -9.577 1.00 15.00 H new ATOM 0 HD21 ASN A 19 1.568 -5.431 -13.696 1.00 15.00 H new ATOM 0 HD22 ASN A 19 1.540 -3.998 -12.663 1.00 15.00 H new ATOM 294 N GLU A 20 -0.795 -6.084 -8.279 1.00 15.00 N ATOM 295 CA GLU A 20 -1.525 -7.138 -7.596 1.00 15.00 C ATOM 296 C GLU A 20 -2.937 -6.672 -7.270 1.00 15.00 C ATOM 297 O GLU A 20 -3.849 -7.486 -7.124 1.00 15.00 O ATOM 298 CB GLU A 20 -0.800 -7.553 -6.314 1.00 15.00 C ATOM 299 CG GLU A 20 0.026 -8.819 -6.464 1.00 15.00 C ATOM 300 CD GLU A 20 -0.827 -10.073 -6.485 1.00 15.00 C ATOM 301 OE1 GLU A 20 -1.828 -10.122 -5.739 1.00 15.00 O ATOM 302 OE2 GLU A 20 -0.496 -11.004 -7.249 1.00 15.00 O ATOM 0 H GLU A 20 -0.047 -5.663 -7.728 1.00 15.00 H new ATOM 0 HA GLU A 20 -1.580 -8.003 -8.257 1.00 15.00 H new ATOM 0 HB2 GLU A 20 -0.148 -6.740 -5.996 1.00 15.00 H new ATOM 0 HB3 GLU A 20 -1.535 -7.700 -5.523 1.00 15.00 H new ATOM 0 HG2 GLU A 20 0.606 -8.763 -7.385 1.00 15.00 H new ATOM 0 HG3 GLU A 20 0.739 -8.883 -5.642 1.00 15.00 H new ATOM 309 N TYR A 21 -3.119 -5.355 -7.157 1.00 15.00 N ATOM 310 CA TYR A 21 -4.434 -4.805 -6.847 1.00 15.00 C ATOM 311 C TYR A 21 -5.315 -4.749 -8.091 1.00 15.00 C ATOM 312 O TYR A 21 -6.507 -5.049 -8.029 1.00 15.00 O ATOM 313 CB TYR A 21 -4.315 -3.404 -6.242 1.00 15.00 C ATOM 314 CG TYR A 21 -5.647 -2.690 -6.143 1.00 15.00 C ATOM 315 CD1 TYR A 21 -6.699 -3.250 -5.429 1.00 15.00 C ATOM 316 CD2 TYR A 21 -5.857 -1.471 -6.776 1.00 15.00 C ATOM 317 CE1 TYR A 21 -7.922 -2.617 -5.348 1.00 15.00 C ATOM 318 CE2 TYR A 21 -7.080 -0.829 -6.697 1.00 15.00 C ATOM 319 CZ TYR A 21 -8.108 -1.406 -5.981 1.00 15.00 C ATOM 320 OH TYR A 21 -9.327 -0.772 -5.901 1.00 15.00 O ATOM 0 H TYR A 21 -2.382 -4.660 -7.274 1.00 15.00 H new ATOM 0 HA TYR A 21 -4.897 -5.468 -6.117 1.00 15.00 H new ATOM 0 HB2 TYR A 21 -3.874 -3.479 -5.248 1.00 15.00 H new ATOM 0 HB3 TYR A 21 -3.633 -2.808 -6.849 1.00 15.00 H new ATOM 0 HD1 TYR A 21 -6.557 -4.197 -4.929 1.00 15.00 H new ATOM 0 HD2 TYR A 21 -5.054 -1.018 -7.338 1.00 15.00 H new ATOM 0 HE1 TYR A 21 -8.730 -3.068 -4.791 1.00 15.00 H new ATOM 0 HE2 TYR A 21 -7.229 0.119 -7.193 1.00 15.00 H new ATOM 0 HH TYR A 21 -9.759 -1.000 -5.052 1.00 15.00 H new ATOM 330 N PHE A 22 -4.730 -4.349 -9.213 1.00 15.00 N ATOM 331 CA PHE A 22 -5.476 -4.240 -10.458 1.00 15.00 C ATOM 332 C PHE A 22 -5.785 -5.615 -11.043 1.00 15.00 C ATOM 333 O PHE A 22 -6.946 -5.994 -11.191 1.00 15.00 O ATOM 334 CB PHE A 22 -4.700 -3.410 -11.487 1.00 15.00 C ATOM 335 CG PHE A 22 -5.061 -3.766 -12.898 1.00 15.00 C ATOM 336 CD1 PHE A 22 -6.378 -3.683 -13.317 1.00 15.00 C ATOM 337 CD2 PHE A 22 -4.101 -4.213 -13.789 1.00 15.00 C ATOM 338 CE1 PHE A 22 -6.734 -4.036 -14.602 1.00 15.00 C ATOM 339 CE2 PHE A 22 -4.452 -4.573 -15.077 1.00 15.00 C ATOM 340 CZ PHE A 22 -5.770 -4.484 -15.482 1.00 15.00 C ATOM 0 H PHE A 22 -3.745 -4.096 -9.286 1.00 15.00 H new ATOM 0 HA PHE A 22 -6.417 -3.739 -10.228 1.00 15.00 H new ATOM 0 HB2 PHE A 22 -4.899 -2.351 -11.320 1.00 15.00 H new ATOM 0 HB3 PHE A 22 -3.631 -3.561 -11.339 1.00 15.00 H new ATOM 0 HD1 PHE A 22 -7.136 -3.338 -12.629 1.00 15.00 H new ATOM 0 HD2 PHE A 22 -3.070 -4.281 -13.476 1.00 15.00 H new ATOM 0 HE1 PHE A 22 -7.764 -3.962 -14.918 1.00 15.00 H new ATOM 0 HE2 PHE A 22 -3.697 -4.923 -15.765 1.00 15.00 H new ATOM 0 HZ PHE A 22 -6.046 -4.765 -16.488 1.00 15.00 H new ATOM 350 N TYR A 23 -4.732 -6.347 -11.390 1.00 15.00 N ATOM 351 CA TYR A 23 -4.878 -7.671 -11.980 1.00 15.00 C ATOM 352 C TYR A 23 -5.853 -8.521 -11.171 1.00 15.00 C ATOM 353 O TYR A 23 -6.902 -8.918 -11.672 1.00 15.00 O ATOM 354 CB TYR A 23 -3.518 -8.362 -12.040 1.00 15.00 C ATOM 355 CG TYR A 23 -2.691 -7.976 -13.245 1.00 15.00 C ATOM 356 CD1 TYR A 23 -3.250 -7.950 -14.517 1.00 15.00 C ATOM 357 CD2 TYR A 23 -1.351 -7.638 -13.110 1.00 15.00 C ATOM 358 CE1 TYR A 23 -2.495 -7.597 -15.620 1.00 15.00 C ATOM 359 CE2 TYR A 23 -0.591 -7.283 -14.208 1.00 15.00 C ATOM 360 CZ TYR A 23 -1.166 -7.266 -15.459 1.00 15.00 C ATOM 361 OH TYR A 23 -0.412 -6.915 -16.554 1.00 15.00 O ATOM 0 H TYR A 23 -3.765 -6.044 -11.272 1.00 15.00 H new ATOM 0 HA TYR A 23 -5.274 -7.557 -12.989 1.00 15.00 H new ATOM 0 HB2 TYR A 23 -2.959 -8.123 -11.135 1.00 15.00 H new ATOM 0 HB3 TYR A 23 -3.669 -9.441 -12.045 1.00 15.00 H new ATOM 0 HD1 TYR A 23 -4.290 -8.210 -14.646 1.00 15.00 H new ATOM 0 HD2 TYR A 23 -0.895 -7.653 -12.131 1.00 15.00 H new ATOM 0 HE1 TYR A 23 -2.944 -7.581 -16.602 1.00 15.00 H new ATOM 0 HE2 TYR A 23 0.449 -7.020 -14.086 1.00 15.00 H new ATOM 0 HH TYR A 23 -0.867 -7.206 -17.372 1.00 15.00 H new ATOM 371 N SER A 24 -5.508 -8.775 -9.908 1.00 15.00 N ATOM 372 CA SER A 24 -6.358 -9.539 -8.999 1.00 15.00 C ATOM 373 C SER A 24 -7.812 -9.180 -9.227 1.00 15.00 C ATOM 374 O SER A 24 -8.714 -10.015 -9.153 1.00 15.00 O ATOM 375 CB SER A 24 -5.972 -9.265 -7.544 1.00 15.00 C ATOM 376 OG SER A 24 -4.699 -9.809 -7.244 1.00 15.00 O ATOM 0 H SER A 24 -4.634 -8.457 -9.489 1.00 15.00 H new ATOM 0 HA SER A 24 -6.216 -10.601 -9.200 1.00 15.00 H new ATOM 0 HB2 SER A 24 -5.964 -8.190 -7.363 1.00 15.00 H new ATOM 0 HB3 SER A 24 -6.721 -9.695 -6.879 1.00 15.00 H new ATOM 0 HG SER A 24 -4.084 -9.086 -6.999 1.00 15.00 H new ATOM 382 N HIS A 25 -8.002 -7.895 -9.469 1.00 15.00 N ATOM 383 CA HIS A 25 -9.304 -7.312 -9.679 1.00 15.00 C ATOM 384 C HIS A 25 -9.511 -6.900 -11.133 1.00 15.00 C ATOM 385 O HIS A 25 -10.183 -5.908 -11.416 1.00 15.00 O ATOM 386 CB HIS A 25 -9.404 -6.098 -8.777 1.00 15.00 C ATOM 387 CG HIS A 25 -9.579 -6.449 -7.335 1.00 15.00 C ATOM 388 ND1 HIS A 25 -10.632 -7.204 -6.869 1.00 15.00 N ATOM 389 CD2 HIS A 25 -8.813 -6.167 -6.256 1.00 15.00 C ATOM 390 CE1 HIS A 25 -10.506 -7.372 -5.566 1.00 15.00 C ATOM 391 NE2 HIS A 25 -9.411 -6.752 -5.170 1.00 15.00 N ATOM 0 H HIS A 25 -7.239 -7.221 -9.525 1.00 15.00 H new ATOM 0 HA HIS A 25 -10.076 -8.046 -9.445 1.00 15.00 H new ATOM 0 HB2 HIS A 25 -8.504 -5.494 -8.891 1.00 15.00 H new ATOM 0 HB3 HIS A 25 -10.244 -5.482 -9.099 1.00 15.00 H new ATOM 0 HD2 HIS A 25 -7.901 -5.589 -6.251 1.00 15.00 H new ATOM 0 HE1 HIS A 25 -11.184 -7.923 -4.932 1.00 15.00 H new ATOM 0 HE2 HIS A 25 -9.065 -6.714 -4.211 1.00 15.00 H new ATOM 400 N LEU A 26 -8.928 -7.659 -12.048 1.00 15.00 N ATOM 401 CA LEU A 26 -9.043 -7.371 -13.471 1.00 15.00 C ATOM 402 C LEU A 26 -10.463 -7.628 -13.973 1.00 15.00 C ATOM 403 O LEU A 26 -10.846 -7.157 -15.042 1.00 15.00 O ATOM 404 CB LEU A 26 -8.036 -8.214 -14.258 1.00 15.00 C ATOM 405 CG LEU A 26 -8.191 -8.171 -15.779 1.00 15.00 C ATOM 406 CD1 LEU A 26 -8.254 -6.732 -16.269 1.00 15.00 C ATOM 407 CD2 LEU A 26 -7.045 -8.914 -16.447 1.00 15.00 C ATOM 0 H LEU A 26 -8.368 -8.483 -11.830 1.00 15.00 H new ATOM 0 HA LEU A 26 -8.821 -6.315 -13.626 1.00 15.00 H new ATOM 0 HB2 LEU A 26 -7.030 -7.880 -14.003 1.00 15.00 H new ATOM 0 HB3 LEU A 26 -8.121 -9.250 -13.930 1.00 15.00 H new ATOM 0 HG LEU A 26 -9.126 -8.664 -16.047 1.00 15.00 H new ATOM 0 HD11 LEU A 26 -8.364 -6.721 -17.353 1.00 15.00 H new ATOM 0 HD12 LEU A 26 -9.107 -6.229 -15.813 1.00 15.00 H new ATOM 0 HD13 LEU A 26 -7.336 -6.213 -15.993 1.00 15.00 H new ATOM 0 HD21 LEU A 26 -7.168 -8.875 -17.529 1.00 15.00 H new ATOM 0 HD22 LEU A 26 -6.099 -8.447 -16.172 1.00 15.00 H new ATOM 0 HD23 LEU A 26 -7.045 -9.953 -16.119 1.00 15.00 H new ATOM 419 N SER A 27 -11.241 -8.374 -13.193 1.00 15.00 N ATOM 420 CA SER A 27 -12.617 -8.681 -13.560 1.00 15.00 C ATOM 421 C SER A 27 -13.518 -7.466 -13.351 1.00 15.00 C ATOM 422 O SER A 27 -14.537 -7.311 -14.024 1.00 15.00 O ATOM 423 CB SER A 27 -13.136 -9.862 -12.739 1.00 15.00 C ATOM 424 OG SER A 27 -12.941 -9.644 -11.352 1.00 15.00 O ATOM 0 H SER A 27 -10.941 -8.776 -12.305 1.00 15.00 H new ATOM 0 HA SER A 27 -12.634 -8.948 -14.617 1.00 15.00 H new ATOM 0 HB2 SER A 27 -14.197 -10.011 -12.941 1.00 15.00 H new ATOM 0 HB3 SER A 27 -12.622 -10.774 -13.043 1.00 15.00 H new ATOM 0 HG SER A 27 -13.283 -10.412 -10.849 1.00 15.00 H new ATOM 430 N ASN A 28 -13.133 -6.605 -12.412 1.00 15.00 N ATOM 431 CA ASN A 28 -13.902 -5.403 -12.113 1.00 15.00 C ATOM 432 C ASN A 28 -13.057 -4.400 -11.326 1.00 15.00 C ATOM 433 O ASN A 28 -13.400 -4.032 -10.203 1.00 15.00 O ATOM 434 CB ASN A 28 -15.161 -5.762 -11.322 1.00 15.00 C ATOM 435 CG ASN A 28 -16.362 -4.933 -11.737 1.00 15.00 C ATOM 436 OD1 ASN A 28 -16.360 -3.709 -11.604 1.00 15.00 O ATOM 437 ND2 ASN A 28 -17.394 -5.597 -12.242 1.00 15.00 N ATOM 0 H ASN A 28 -12.292 -6.719 -11.846 1.00 15.00 H new ATOM 0 HA ASN A 28 -14.195 -4.943 -13.056 1.00 15.00 H new ATOM 0 HB2 ASN A 28 -15.386 -6.819 -11.464 1.00 15.00 H new ATOM 0 HB3 ASN A 28 -14.972 -5.616 -10.258 1.00 15.00 H new ATOM 0 HD21 ASN A 28 -18.229 -5.092 -12.538 1.00 15.00 H new ATOM 0 HD22 ASN A 28 -17.352 -6.612 -12.334 1.00 15.00 H new ATOM 444 N PRO A 29 -11.935 -3.945 -11.910 1.00 15.00 N ATOM 445 CA PRO A 29 -11.043 -2.987 -11.258 1.00 15.00 C ATOM 446 C PRO A 29 -11.593 -1.557 -11.304 1.00 15.00 C ATOM 447 O PRO A 29 -12.355 -1.158 -10.423 1.00 15.00 O ATOM 448 CB PRO A 29 -9.746 -3.118 -12.059 1.00 15.00 C ATOM 449 CG PRO A 29 -10.172 -3.558 -13.420 1.00 15.00 C ATOM 450 CD PRO A 29 -11.452 -4.336 -13.248 1.00 15.00 C ATOM 0 HA PRO A 29 -10.914 -3.191 -10.195 1.00 15.00 H new ATOM 0 HB2 PRO A 29 -9.211 -2.169 -12.101 1.00 15.00 H new ATOM 0 HB3 PRO A 29 -9.073 -3.844 -11.603 1.00 15.00 H new ATOM 0 HG2 PRO A 29 -10.327 -2.699 -14.073 1.00 15.00 H new ATOM 0 HG3 PRO A 29 -9.404 -4.176 -13.884 1.00 15.00 H new ATOM 0 HD2 PRO A 29 -12.177 -4.086 -14.022 1.00 15.00 H new ATOM 0 HD3 PRO A 29 -11.277 -5.410 -13.310 1.00 15.00 H new ATOM 458 N TYR A 30 -11.216 -0.794 -12.332 1.00 15.00 N ATOM 459 CA TYR A 30 -11.680 0.581 -12.490 1.00 15.00 C ATOM 460 C TYR A 30 -11.708 1.323 -11.152 1.00 15.00 C ATOM 461 O TYR A 30 -12.758 1.793 -10.713 1.00 15.00 O ATOM 462 CB TYR A 30 -13.067 0.585 -13.126 1.00 15.00 C ATOM 463 CG TYR A 30 -13.041 0.419 -14.630 1.00 15.00 C ATOM 464 CD1 TYR A 30 -12.309 -0.604 -15.219 1.00 15.00 C ATOM 465 CD2 TYR A 30 -13.746 1.283 -15.457 1.00 15.00 C ATOM 466 CE1 TYR A 30 -12.279 -0.761 -16.591 1.00 15.00 C ATOM 467 CE2 TYR A 30 -13.722 1.132 -16.832 1.00 15.00 C ATOM 468 CZ TYR A 30 -12.987 0.108 -17.393 1.00 15.00 C ATOM 469 OH TYR A 30 -12.960 -0.045 -18.760 1.00 15.00 O ATOM 0 H TYR A 30 -10.587 -1.110 -13.070 1.00 15.00 H new ATOM 0 HA TYR A 30 -10.979 1.104 -13.141 1.00 15.00 H new ATOM 0 HB2 TYR A 30 -13.661 -0.218 -12.690 1.00 15.00 H new ATOM 0 HB3 TYR A 30 -13.568 1.521 -12.880 1.00 15.00 H new ATOM 0 HD1 TYR A 30 -11.754 -1.288 -14.594 1.00 15.00 H new ATOM 0 HD2 TYR A 30 -14.322 2.085 -15.020 1.00 15.00 H new ATOM 0 HE1 TYR A 30 -11.704 -1.561 -17.033 1.00 15.00 H new ATOM 0 HE2 TYR A 30 -14.276 1.812 -17.463 1.00 15.00 H new ATOM 0 HH TYR A 30 -13.512 0.649 -19.178 1.00 15.00 H new ATOM 479 N PRO A 31 -10.546 1.434 -10.483 1.00 15.00 N ATOM 480 CA PRO A 31 -10.439 2.119 -9.192 1.00 15.00 C ATOM 481 C PRO A 31 -11.104 3.490 -9.201 1.00 15.00 C ATOM 482 O PRO A 31 -10.541 4.459 -9.711 1.00 15.00 O ATOM 483 CB PRO A 31 -8.931 2.262 -8.994 1.00 15.00 C ATOM 484 CG PRO A 31 -8.345 1.124 -9.752 1.00 15.00 C ATOM 485 CD PRO A 31 -9.248 0.900 -10.934 1.00 15.00 C ATOM 0 HA PRO A 31 -10.940 1.567 -8.397 1.00 15.00 H new ATOM 0 HB2 PRO A 31 -8.570 3.218 -9.372 1.00 15.00 H new ATOM 0 HB3 PRO A 31 -8.663 2.215 -7.938 1.00 15.00 H new ATOM 0 HG2 PRO A 31 -7.330 1.353 -10.075 1.00 15.00 H new ATOM 0 HG3 PRO A 31 -8.288 0.230 -9.131 1.00 15.00 H new ATOM 0 HD2 PRO A 31 -8.886 1.421 -11.820 1.00 15.00 H new ATOM 0 HD3 PRO A 31 -9.317 -0.157 -11.192 1.00 15.00 H new ATOM 493 N SER A 32 -12.302 3.568 -8.632 1.00 15.00 N ATOM 494 CA SER A 32 -13.036 4.826 -8.573 1.00 15.00 C ATOM 495 C SER A 32 -12.334 5.815 -7.648 1.00 15.00 C ATOM 496 O SER A 32 -11.199 5.589 -7.229 1.00 15.00 O ATOM 497 CB SER A 32 -14.468 4.583 -8.092 1.00 15.00 C ATOM 498 OG SER A 32 -15.402 5.287 -8.892 1.00 15.00 O ATOM 0 H SER A 32 -12.784 2.777 -8.206 1.00 15.00 H new ATOM 0 HA SER A 32 -13.068 5.251 -9.576 1.00 15.00 H new ATOM 0 HB2 SER A 32 -14.689 3.516 -8.123 1.00 15.00 H new ATOM 0 HB3 SER A 32 -14.564 4.898 -7.053 1.00 15.00 H new ATOM 0 HG SER A 32 -16.309 5.113 -8.565 1.00 15.00 H new ATOM 504 N GLU A 33 -13.015 6.912 -7.332 1.00 15.00 N ATOM 505 CA GLU A 33 -12.453 7.932 -6.455 1.00 15.00 C ATOM 506 C GLU A 33 -12.075 7.337 -5.102 1.00 15.00 C ATOM 507 O GLU A 33 -11.081 7.732 -4.495 1.00 15.00 O ATOM 508 CB GLU A 33 -13.450 9.076 -6.263 1.00 15.00 C ATOM 509 CG GLU A 33 -13.292 10.198 -7.277 1.00 15.00 C ATOM 510 CD GLU A 33 -14.592 10.932 -7.542 1.00 15.00 C ATOM 511 OE1 GLU A 33 -14.972 11.784 -6.712 1.00 15.00 O ATOM 512 OE2 GLU A 33 -15.229 10.655 -8.579 1.00 15.00 O ATOM 0 H GLU A 33 -13.955 7.117 -7.670 1.00 15.00 H new ATOM 0 HA GLU A 33 -11.550 8.323 -6.925 1.00 15.00 H new ATOM 0 HB2 GLU A 33 -14.463 8.679 -6.328 1.00 15.00 H new ATOM 0 HB3 GLU A 33 -13.332 9.485 -5.260 1.00 15.00 H new ATOM 0 HG2 GLU A 33 -12.546 10.906 -6.916 1.00 15.00 H new ATOM 0 HG3 GLU A 33 -12.914 9.786 -8.213 1.00 15.00 H new ATOM 519 N GLU A 34 -12.878 6.386 -4.637 1.00 15.00 N ATOM 520 CA GLU A 34 -12.629 5.735 -3.355 1.00 15.00 C ATOM 521 C GLU A 34 -11.412 4.819 -3.431 1.00 15.00 C ATOM 522 O GLU A 34 -10.737 4.582 -2.429 1.00 15.00 O ATOM 523 CB GLU A 34 -13.857 4.934 -2.921 1.00 15.00 C ATOM 524 CG GLU A 34 -13.960 4.746 -1.416 1.00 15.00 C ATOM 525 CD GLU A 34 -15.305 5.179 -0.864 1.00 15.00 C ATOM 526 OE1 GLU A 34 -15.648 6.372 -1.005 1.00 15.00 O ATOM 527 OE2 GLU A 34 -16.014 4.326 -0.292 1.00 15.00 O ATOM 0 H GLU A 34 -13.706 6.049 -5.128 1.00 15.00 H new ATOM 0 HA GLU A 34 -12.428 6.512 -2.617 1.00 15.00 H new ATOM 0 HB2 GLU A 34 -14.755 5.439 -3.278 1.00 15.00 H new ATOM 0 HB3 GLU A 34 -13.830 3.955 -3.400 1.00 15.00 H new ATOM 0 HG2 GLU A 34 -13.792 3.697 -1.172 1.00 15.00 H new ATOM 0 HG3 GLU A 34 -13.170 5.317 -0.928 1.00 15.00 H new ATOM 534 N ALA A 35 -11.136 4.303 -4.625 1.00 15.00 N ATOM 535 CA ALA A 35 -10.003 3.410 -4.830 1.00 15.00 C ATOM 536 C ALA A 35 -8.706 4.194 -5.000 1.00 15.00 C ATOM 537 O ALA A 35 -7.732 3.960 -4.285 1.00 15.00 O ATOM 538 CB ALA A 35 -10.247 2.520 -6.038 1.00 15.00 C ATOM 0 H ALA A 35 -11.683 4.489 -5.466 1.00 15.00 H new ATOM 0 HA ALA A 35 -9.902 2.783 -3.944 1.00 15.00 H new ATOM 0 HB1 ALA A 35 -9.393 1.858 -6.180 1.00 15.00 H new ATOM 0 HB2 ALA A 35 -11.145 1.924 -5.876 1.00 15.00 H new ATOM 0 HB3 ALA A 35 -10.378 3.139 -6.926 1.00 15.00 H new ATOM 544 N LYS A 36 -8.700 5.128 -5.948 1.00 15.00 N ATOM 545 CA LYS A 36 -7.518 5.946 -6.203 1.00 15.00 C ATOM 546 C LYS A 36 -7.023 6.587 -4.914 1.00 15.00 C ATOM 547 O LYS A 36 -5.824 6.608 -4.639 1.00 15.00 O ATOM 548 CB LYS A 36 -7.828 7.023 -7.247 1.00 15.00 C ATOM 549 CG LYS A 36 -8.966 7.950 -6.851 1.00 15.00 C ATOM 550 CD LYS A 36 -8.446 9.241 -6.238 1.00 15.00 C ATOM 551 CE LYS A 36 -9.585 10.172 -5.852 1.00 15.00 C ATOM 552 NZ LYS A 36 -9.217 11.058 -4.712 1.00 15.00 N ATOM 0 H LYS A 36 -9.497 5.336 -6.550 1.00 15.00 H new ATOM 0 HA LYS A 36 -6.731 5.300 -6.592 1.00 15.00 H new ATOM 0 HB2 LYS A 36 -6.931 7.617 -7.420 1.00 15.00 H new ATOM 0 HB3 LYS A 36 -8.077 6.540 -8.192 1.00 15.00 H new ATOM 0 HG2 LYS A 36 -9.571 8.180 -7.728 1.00 15.00 H new ATOM 0 HG3 LYS A 36 -9.617 7.444 -6.138 1.00 15.00 H new ATOM 0 HD2 LYS A 36 -7.848 9.011 -5.356 1.00 15.00 H new ATOM 0 HD3 LYS A 36 -7.789 9.743 -6.948 1.00 15.00 H new ATOM 0 HE2 LYS A 36 -9.862 10.783 -6.711 1.00 15.00 H new ATOM 0 HE3 LYS A 36 -10.462 9.582 -5.585 1.00 15.00 H new ATOM 0 HZ1 LYS A 36 -10.033 11.162 -4.076 1.00 15.00 H new ATOM 0 HZ2 LYS A 36 -8.422 10.639 -4.189 1.00 15.00 H new ATOM 0 HZ3 LYS A 36 -8.939 11.992 -5.074 1.00 15.00 H new ATOM 566 N GLU A 37 -7.957 7.092 -4.117 1.00 15.00 N ATOM 567 CA GLU A 37 -7.615 7.714 -2.847 1.00 15.00 C ATOM 568 C GLU A 37 -7.035 6.674 -1.899 1.00 15.00 C ATOM 569 O GLU A 37 -6.044 6.924 -1.216 1.00 15.00 O ATOM 570 CB GLU A 37 -8.848 8.371 -2.222 1.00 15.00 C ATOM 571 CG GLU A 37 -8.612 9.804 -1.776 1.00 15.00 C ATOM 572 CD GLU A 37 -8.961 10.028 -0.317 1.00 15.00 C ATOM 573 OE1 GLU A 37 -10.135 9.816 0.052 1.00 15.00 O ATOM 574 OE2 GLU A 37 -8.060 10.414 0.455 1.00 15.00 O ATOM 0 H GLU A 37 -8.955 7.082 -4.328 1.00 15.00 H new ATOM 0 HA GLU A 37 -6.867 8.487 -3.026 1.00 15.00 H new ATOM 0 HB2 GLU A 37 -9.664 8.354 -2.944 1.00 15.00 H new ATOM 0 HB3 GLU A 37 -9.169 7.780 -1.364 1.00 15.00 H new ATOM 0 HG2 GLU A 37 -7.566 10.063 -1.939 1.00 15.00 H new ATOM 0 HG3 GLU A 37 -9.207 10.476 -2.395 1.00 15.00 H new ATOM 581 N GLU A 38 -7.658 5.497 -1.874 1.00 15.00 N ATOM 582 CA GLU A 38 -7.203 4.405 -1.021 1.00 15.00 C ATOM 583 C GLU A 38 -5.741 4.078 -1.300 1.00 15.00 C ATOM 584 O GLU A 38 -4.897 4.154 -0.409 1.00 15.00 O ATOM 585 CB GLU A 38 -8.069 3.163 -1.240 1.00 15.00 C ATOM 586 CG GLU A 38 -9.315 3.127 -0.370 1.00 15.00 C ATOM 587 CD GLU A 38 -10.277 2.029 -0.777 1.00 15.00 C ATOM 588 OE1 GLU A 38 -10.057 0.868 -0.375 1.00 15.00 O ATOM 589 OE2 GLU A 38 -11.253 2.331 -1.497 1.00 15.00 O ATOM 0 H GLU A 38 -8.480 5.277 -2.436 1.00 15.00 H new ATOM 0 HA GLU A 38 -7.296 4.722 0.018 1.00 15.00 H new ATOM 0 HB2 GLU A 38 -8.366 3.118 -2.288 1.00 15.00 H new ATOM 0 HB3 GLU A 38 -7.471 2.274 -1.040 1.00 15.00 H new ATOM 0 HG2 GLU A 38 -9.023 2.983 0.670 1.00 15.00 H new ATOM 0 HG3 GLU A 38 -9.822 4.090 -0.428 1.00 15.00 H new ATOM 596 N LEU A 39 -5.445 3.724 -2.549 1.00 15.00 N ATOM 597 CA LEU A 39 -4.080 3.400 -2.943 1.00 15.00 C ATOM 598 C LEU A 39 -3.158 4.579 -2.668 1.00 15.00 C ATOM 599 O LEU A 39 -2.008 4.404 -2.262 1.00 15.00 O ATOM 600 CB LEU A 39 -4.024 3.029 -4.426 1.00 15.00 C ATOM 601 CG LEU A 39 -5.118 2.070 -4.898 1.00 15.00 C ATOM 602 CD1 LEU A 39 -4.890 1.674 -6.348 1.00 15.00 C ATOM 603 CD2 LEU A 39 -5.164 0.836 -4.009 1.00 15.00 C ATOM 0 H LEU A 39 -6.131 3.655 -3.301 1.00 15.00 H new ATOM 0 HA LEU A 39 -3.746 2.545 -2.355 1.00 15.00 H new ATOM 0 HB2 LEU A 39 -4.085 3.944 -5.016 1.00 15.00 H new ATOM 0 HB3 LEU A 39 -3.053 2.579 -4.635 1.00 15.00 H new ATOM 0 HG LEU A 39 -6.078 2.581 -4.828 1.00 15.00 H new ATOM 0 HD11 LEU A 39 -5.678 0.991 -6.667 1.00 15.00 H new ATOM 0 HD12 LEU A 39 -4.906 2.565 -6.975 1.00 15.00 H new ATOM 0 HD13 LEU A 39 -3.922 1.181 -6.443 1.00 15.00 H new ATOM 0 HD21 LEU A 39 -5.948 0.164 -4.359 1.00 15.00 H new ATOM 0 HD22 LEU A 39 -4.203 0.323 -4.048 1.00 15.00 H new ATOM 0 HD23 LEU A 39 -5.374 1.135 -2.982 1.00 15.00 H new ATOM 615 N ALA A 40 -3.675 5.784 -2.891 1.00 15.00 N ATOM 616 CA ALA A 40 -2.906 7.001 -2.668 1.00 15.00 C ATOM 617 C ALA A 40 -2.337 7.044 -1.250 1.00 15.00 C ATOM 618 O ALA A 40 -1.193 7.448 -1.042 1.00 15.00 O ATOM 619 CB ALA A 40 -3.772 8.225 -2.929 1.00 15.00 C ATOM 0 H ALA A 40 -4.625 5.942 -3.227 1.00 15.00 H new ATOM 0 HA ALA A 40 -2.068 7.005 -3.365 1.00 15.00 H new ATOM 0 HB1 ALA A 40 -3.186 9.128 -2.759 1.00 15.00 H new ATOM 0 HB2 ALA A 40 -4.123 8.209 -3.961 1.00 15.00 H new ATOM 0 HB3 ALA A 40 -4.628 8.216 -2.254 1.00 15.00 H new ATOM 625 N LYS A 41 -3.146 6.630 -0.277 1.00 15.00 N ATOM 626 CA LYS A 41 -2.725 6.626 1.121 1.00 15.00 C ATOM 627 C LYS A 41 -1.580 5.644 1.351 1.00 15.00 C ATOM 628 O LYS A 41 -0.489 6.036 1.766 1.00 15.00 O ATOM 629 CB LYS A 41 -3.899 6.270 2.037 1.00 15.00 C ATOM 630 CG LYS A 41 -5.165 7.068 1.764 1.00 15.00 C ATOM 631 CD LYS A 41 -4.871 8.548 1.571 1.00 15.00 C ATOM 632 CE LYS A 41 -4.199 9.147 2.796 1.00 15.00 C ATOM 633 NZ LYS A 41 -5.184 9.482 3.861 1.00 15.00 N ATOM 0 H LYS A 41 -4.096 6.293 -0.432 1.00 15.00 H new ATOM 0 HA LYS A 41 -2.375 7.630 1.361 1.00 15.00 H new ATOM 0 HB2 LYS A 41 -4.121 5.208 1.929 1.00 15.00 H new ATOM 0 HB3 LYS A 41 -3.599 6.429 3.073 1.00 15.00 H new ATOM 0 HG2 LYS A 41 -5.656 6.676 0.873 1.00 15.00 H new ATOM 0 HG3 LYS A 41 -5.860 6.941 2.594 1.00 15.00 H new ATOM 0 HD2 LYS A 41 -4.229 8.682 0.700 1.00 15.00 H new ATOM 0 HD3 LYS A 41 -5.800 9.081 1.367 1.00 15.00 H new ATOM 0 HE2 LYS A 41 -3.465 8.443 3.188 1.00 15.00 H new ATOM 0 HE3 LYS A 41 -3.655 10.047 2.508 1.00 15.00 H new ATOM 0 HZ1 LYS A 41 -4.686 9.888 4.679 1.00 15.00 H new ATOM 0 HZ2 LYS A 41 -5.869 10.173 3.495 1.00 15.00 H new ATOM 0 HZ3 LYS A 41 -5.685 8.619 4.154 1.00 15.00 H new ATOM 647 N LYS A 42 -1.835 4.366 1.081 1.00 15.00 N ATOM 648 CA LYS A 42 -0.825 3.326 1.262 1.00 15.00 C ATOM 649 C LYS A 42 0.501 3.740 0.640 1.00 15.00 C ATOM 650 O LYS A 42 1.523 3.828 1.321 1.00 15.00 O ATOM 651 CB LYS A 42 -1.301 2.019 0.628 1.00 15.00 C ATOM 652 CG LYS A 42 -1.785 0.992 1.638 1.00 15.00 C ATOM 653 CD LYS A 42 -3.162 0.463 1.274 1.00 15.00 C ATOM 654 CE LYS A 42 -3.994 0.173 2.513 1.00 15.00 C ATOM 655 NZ LYS A 42 -5.096 1.158 2.684 1.00 15.00 N ATOM 0 H LYS A 42 -2.732 4.026 0.736 1.00 15.00 H new ATOM 0 HA LYS A 42 -0.676 3.180 2.332 1.00 15.00 H new ATOM 0 HB2 LYS A 42 -2.109 2.237 -0.071 1.00 15.00 H new ATOM 0 HB3 LYS A 42 -0.485 1.588 0.048 1.00 15.00 H new ATOM 0 HG2 LYS A 42 -1.077 0.165 1.686 1.00 15.00 H new ATOM 0 HG3 LYS A 42 -1.817 1.442 2.630 1.00 15.00 H new ATOM 0 HD2 LYS A 42 -3.679 1.192 0.650 1.00 15.00 H new ATOM 0 HD3 LYS A 42 -3.059 -0.447 0.683 1.00 15.00 H new ATOM 0 HE2 LYS A 42 -4.412 -0.831 2.443 1.00 15.00 H new ATOM 0 HE3 LYS A 42 -3.352 0.190 3.394 1.00 15.00 H new ATOM 0 HZ1 LYS A 42 -5.640 0.926 3.540 1.00 15.00 H new ATOM 0 HZ2 LYS A 42 -4.696 2.114 2.777 1.00 15.00 H new ATOM 0 HZ3 LYS A 42 -5.724 1.124 1.855 1.00 15.00 H new ATOM 669 N CYS A 43 0.470 3.989 -0.660 1.00 15.00 N ATOM 670 CA CYS A 43 1.661 4.393 -1.394 1.00 15.00 C ATOM 671 C CYS A 43 2.138 5.774 -0.950 1.00 15.00 C ATOM 672 O CYS A 43 3.293 6.140 -1.172 1.00 15.00 O ATOM 673 CB CYS A 43 1.372 4.393 -2.894 1.00 15.00 C ATOM 674 SG CYS A 43 0.502 2.918 -3.477 1.00 15.00 S ATOM 0 H CYS A 43 -0.372 3.918 -1.232 1.00 15.00 H new ATOM 0 HA CYS A 43 2.455 3.677 -1.180 1.00 15.00 H new ATOM 0 HB2 CYS A 43 0.778 5.273 -3.139 1.00 15.00 H new ATOM 0 HB3 CYS A 43 2.314 4.484 -3.435 1.00 15.00 H new ATOM 0 HG CYS A 43 -0.762 3.018 -3.190 1.00 15.00 H new ATOM 680 N GLY A 44 1.245 6.538 -0.325 1.00 15.00 N ATOM 681 CA GLY A 44 1.601 7.869 0.135 1.00 15.00 C ATOM 682 C GLY A 44 2.141 8.739 -0.983 1.00 15.00 C ATOM 683 O GLY A 44 2.969 9.619 -0.751 1.00 15.00 O ATOM 0 H GLY A 44 0.283 6.259 -0.129 1.00 15.00 H new ATOM 0 HA2 GLY A 44 0.724 8.346 0.573 1.00 15.00 H new ATOM 0 HA3 GLY A 44 2.348 7.790 0.924 1.00 15.00 H new ATOM 687 N ILE A 45 1.673 8.485 -2.199 1.00 15.00 N ATOM 688 CA ILE A 45 2.112 9.241 -3.364 1.00 15.00 C ATOM 689 C ILE A 45 1.034 10.234 -3.812 1.00 15.00 C ATOM 690 O ILE A 45 0.464 10.956 -2.994 1.00 15.00 O ATOM 691 CB ILE A 45 2.490 8.277 -4.517 1.00 15.00 C ATOM 692 CG1 ILE A 45 1.305 7.376 -4.881 1.00 15.00 C ATOM 693 CG2 ILE A 45 3.688 7.431 -4.122 1.00 15.00 C ATOM 694 CD1 ILE A 45 1.607 6.410 -6.006 1.00 15.00 C ATOM 0 H ILE A 45 0.987 7.758 -2.404 1.00 15.00 H new ATOM 0 HA ILE A 45 2.997 9.815 -3.089 1.00 15.00 H new ATOM 0 HB ILE A 45 2.751 8.873 -5.391 1.00 15.00 H new ATOM 0 HG12 ILE A 45 1.003 6.812 -3.999 1.00 15.00 H new ATOM 0 HG13 ILE A 45 0.458 8.000 -5.166 1.00 15.00 H new ATOM 0 HG21 ILE A 45 3.944 6.758 -4.940 1.00 15.00 H new ATOM 0 HG22 ILE A 45 4.537 8.080 -3.907 1.00 15.00 H new ATOM 0 HG23 ILE A 45 3.444 6.847 -3.235 1.00 15.00 H new ATOM 0 HD11 ILE A 45 0.725 5.804 -6.211 1.00 15.00 H new ATOM 0 HD12 ILE A 45 1.880 6.968 -6.901 1.00 15.00 H new ATOM 0 HD13 ILE A 45 2.434 5.761 -5.717 1.00 15.00 H new ATOM 706 N THR A 46 0.742 10.234 -5.098 1.00 15.00 N ATOM 707 CA THR A 46 -0.268 11.073 -5.680 1.00 15.00 C ATOM 708 C THR A 46 -0.981 10.235 -6.698 1.00 15.00 C ATOM 709 O THR A 46 -0.358 9.528 -7.490 1.00 15.00 O ATOM 710 CB THR A 46 0.313 12.315 -6.338 1.00 15.00 C ATOM 711 OG1 THR A 46 1.274 11.966 -7.318 1.00 15.00 O ATOM 712 CG2 THR A 46 0.968 13.265 -5.360 1.00 15.00 C ATOM 0 H THR A 46 1.215 9.635 -5.775 1.00 15.00 H new ATOM 0 HA THR A 46 -0.940 11.433 -4.901 1.00 15.00 H new ATOM 0 HB THR A 46 -0.539 12.823 -6.790 1.00 15.00 H new ATOM 0 HG1 THR A 46 1.633 12.780 -7.729 1.00 15.00 H new ATOM 0 HG21 THR A 46 1.360 14.128 -5.898 1.00 15.00 H new ATOM 0 HG22 THR A 46 0.232 13.598 -4.628 1.00 15.00 H new ATOM 0 HG23 THR A 46 1.784 12.755 -4.848 1.00 15.00 H new ATOM 720 N VAL A 47 -2.276 10.260 -6.633 1.00 15.00 N ATOM 721 CA VAL A 47 -3.079 9.459 -7.488 1.00 15.00 C ATOM 722 C VAL A 47 -2.709 9.553 -8.941 1.00 15.00 C ATOM 723 O VAL A 47 -2.855 8.581 -9.660 1.00 15.00 O ATOM 724 CB VAL A 47 -4.542 9.763 -7.245 1.00 15.00 C ATOM 725 CG1 VAL A 47 -5.343 9.821 -8.526 1.00 15.00 C ATOM 726 CG2 VAL A 47 -5.017 8.698 -6.323 1.00 15.00 C ATOM 0 H VAL A 47 -2.803 10.841 -5.981 1.00 15.00 H new ATOM 0 HA VAL A 47 -2.884 8.418 -7.230 1.00 15.00 H new ATOM 0 HB VAL A 47 -4.674 10.753 -6.808 1.00 15.00 H new ATOM 0 HG11 VAL A 47 -6.385 10.042 -8.294 1.00 15.00 H new ATOM 0 HG12 VAL A 47 -4.941 10.602 -9.171 1.00 15.00 H new ATOM 0 HG13 VAL A 47 -5.281 8.861 -9.038 1.00 15.00 H new ATOM 0 HG21 VAL A 47 -6.073 8.853 -6.101 1.00 15.00 H new ATOM 0 HG22 VAL A 47 -4.884 7.724 -6.793 1.00 15.00 H new ATOM 0 HG23 VAL A 47 -4.442 8.735 -5.397 1.00 15.00 H new ATOM 736 N SER A 48 -2.209 10.677 -9.390 1.00 15.00 N ATOM 737 CA SER A 48 -1.824 10.756 -10.789 1.00 15.00 C ATOM 738 C SER A 48 -0.829 9.641 -11.085 1.00 15.00 C ATOM 739 O SER A 48 -0.806 9.094 -12.187 1.00 15.00 O ATOM 740 CB SER A 48 -1.245 12.127 -11.140 1.00 15.00 C ATOM 741 OG SER A 48 -0.865 12.836 -9.973 1.00 15.00 O ATOM 0 H SER A 48 -2.060 11.522 -8.839 1.00 15.00 H new ATOM 0 HA SER A 48 -2.710 10.629 -11.411 1.00 15.00 H new ATOM 0 HB2 SER A 48 -0.380 12.004 -11.792 1.00 15.00 H new ATOM 0 HB3 SER A 48 -1.983 12.705 -11.696 1.00 15.00 H new ATOM 0 HG SER A 48 -1.650 13.282 -9.591 1.00 15.00 H new ATOM 747 N GLN A 49 -0.063 9.249 -10.065 1.00 15.00 N ATOM 748 CA GLN A 49 0.858 8.132 -10.206 1.00 15.00 C ATOM 749 C GLN A 49 0.007 6.897 -10.454 1.00 15.00 C ATOM 750 O GLN A 49 0.299 6.070 -11.316 1.00 15.00 O ATOM 751 CB GLN A 49 1.709 7.955 -8.945 1.00 15.00 C ATOM 752 CG GLN A 49 2.290 9.254 -8.412 1.00 15.00 C ATOM 753 CD GLN A 49 3.744 9.446 -8.799 1.00 15.00 C ATOM 754 OE1 GLN A 49 4.603 8.639 -8.445 1.00 15.00 O ATOM 755 NE2 GLN A 49 4.025 10.518 -9.529 1.00 15.00 N ATOM 0 H GLN A 49 -0.065 9.686 -9.144 1.00 15.00 H new ATOM 0 HA GLN A 49 1.551 8.306 -11.029 1.00 15.00 H new ATOM 0 HB2 GLN A 49 1.099 7.494 -8.168 1.00 15.00 H new ATOM 0 HB3 GLN A 49 2.524 7.265 -9.162 1.00 15.00 H new ATOM 0 HG2 GLN A 49 1.704 10.092 -8.790 1.00 15.00 H new ATOM 0 HG3 GLN A 49 2.202 9.268 -7.326 1.00 15.00 H new ATOM 0 HE21 GLN A 49 3.280 11.160 -9.800 1.00 15.00 H new ATOM 0 HE22 GLN A 49 4.986 10.700 -9.820 1.00 15.00 H new ATOM 764 N VAL A 50 -1.097 6.841 -9.710 1.00 15.00 N ATOM 765 CA VAL A 50 -2.085 5.790 -9.836 1.00 15.00 C ATOM 766 C VAL A 50 -2.944 6.102 -11.057 1.00 15.00 C ATOM 767 O VAL A 50 -2.985 5.333 -12.016 1.00 15.00 O ATOM 768 CB VAL A 50 -2.971 5.727 -8.569 1.00 15.00 C ATOM 769 CG1 VAL A 50 -4.130 4.756 -8.741 1.00 15.00 C ATOM 770 CG2 VAL A 50 -2.133 5.357 -7.351 1.00 15.00 C ATOM 0 H VAL A 50 -1.326 7.535 -8.998 1.00 15.00 H new ATOM 0 HA VAL A 50 -1.593 4.824 -9.950 1.00 15.00 H new ATOM 0 HB VAL A 50 -3.397 6.718 -8.412 1.00 15.00 H new ATOM 0 HG11 VAL A 50 -4.729 4.740 -7.831 1.00 15.00 H new ATOM 0 HG12 VAL A 50 -4.751 5.075 -9.578 1.00 15.00 H new ATOM 0 HG13 VAL A 50 -3.741 3.757 -8.938 1.00 15.00 H new ATOM 0 HG21 VAL A 50 -2.772 5.317 -6.469 1.00 15.00 H new ATOM 0 HG22 VAL A 50 -1.671 4.382 -7.509 1.00 15.00 H new ATOM 0 HG23 VAL A 50 -1.356 6.107 -7.203 1.00 15.00 H new ATOM 780 N SER A 51 -3.599 7.266 -11.020 1.00 15.00 N ATOM 781 CA SER A 51 -4.438 7.731 -12.120 1.00 15.00 C ATOM 782 C SER A 51 -3.838 7.348 -13.472 1.00 15.00 C ATOM 783 O SER A 51 -4.532 6.830 -14.350 1.00 15.00 O ATOM 784 CB SER A 51 -4.611 9.248 -12.047 1.00 15.00 C ATOM 785 OG SER A 51 -5.926 9.629 -12.411 1.00 15.00 O ATOM 0 H SER A 51 -3.561 7.908 -10.228 1.00 15.00 H new ATOM 0 HA SER A 51 -5.411 7.249 -12.025 1.00 15.00 H new ATOM 0 HB2 SER A 51 -4.396 9.594 -11.036 1.00 15.00 H new ATOM 0 HB3 SER A 51 -3.893 9.731 -12.709 1.00 15.00 H new ATOM 0 HG SER A 51 -6.012 10.604 -12.355 1.00 15.00 H new ATOM 791 N ASN A 52 -2.544 7.598 -13.625 1.00 15.00 N ATOM 792 CA ASN A 52 -1.842 7.271 -14.864 1.00 15.00 C ATOM 793 C ASN A 52 -1.571 5.772 -14.962 1.00 15.00 C ATOM 794 O ASN A 52 -1.745 5.167 -16.019 1.00 15.00 O ATOM 795 CB ASN A 52 -0.526 8.046 -14.952 1.00 15.00 C ATOM 796 CG ASN A 52 -0.726 9.477 -15.412 1.00 15.00 C ATOM 797 OD1 ASN A 52 -0.763 9.757 -16.610 1.00 15.00 O ATOM 798 ND2 ASN A 52 -0.856 10.392 -14.459 1.00 15.00 N ATOM 0 H ASN A 52 -1.958 8.026 -12.908 1.00 15.00 H new ATOM 0 HA ASN A 52 -2.482 7.560 -15.698 1.00 15.00 H new ATOM 0 HB2 ASN A 52 -0.042 8.046 -13.976 1.00 15.00 H new ATOM 0 HB3 ASN A 52 0.147 7.536 -15.642 1.00 15.00 H new ATOM 0 HD21 ASN A 52 -0.993 11.372 -14.708 1.00 15.00 H new ATOM 0 HD22 ASN A 52 -0.819 10.115 -13.478 1.00 15.00 H new ATOM 805 N TRP A 53 -1.138 5.181 -13.850 1.00 15.00 N ATOM 806 CA TRP A 53 -0.834 3.750 -13.800 1.00 15.00 C ATOM 807 C TRP A 53 -1.953 2.918 -14.406 1.00 15.00 C ATOM 808 O TRP A 53 -1.715 2.051 -15.243 1.00 15.00 O ATOM 809 CB TRP A 53 -0.633 3.299 -12.356 1.00 15.00 C ATOM 810 CG TRP A 53 -0.099 1.903 -12.231 1.00 15.00 C ATOM 811 CD1 TRP A 53 1.180 1.535 -11.923 1.00 15.00 C ATOM 812 CD2 TRP A 53 -0.834 0.686 -12.407 1.00 15.00 C ATOM 813 NE1 TRP A 53 1.284 0.163 -11.898 1.00 15.00 N ATOM 814 CE2 TRP A 53 0.059 -0.380 -12.193 1.00 15.00 C ATOM 815 CE3 TRP A 53 -2.163 0.394 -12.725 1.00 15.00 C ATOM 816 CZ2 TRP A 53 -0.337 -1.714 -12.288 1.00 15.00 C ATOM 817 CZ3 TRP A 53 -2.553 -0.927 -12.817 1.00 15.00 C ATOM 818 CH2 TRP A 53 -1.643 -1.966 -12.600 1.00 15.00 C ATOM 0 H TRP A 53 -0.989 5.672 -12.968 1.00 15.00 H new ATOM 0 HA TRP A 53 0.078 3.598 -14.377 1.00 15.00 H new ATOM 0 HB2 TRP A 53 0.053 3.987 -11.862 1.00 15.00 H new ATOM 0 HB3 TRP A 53 -1.585 3.364 -11.828 1.00 15.00 H new ATOM 0 HD1 TRP A 53 1.991 2.221 -11.728 1.00 15.00 H new ATOM 0 HE1 TRP A 53 2.133 -0.364 -11.694 1.00 15.00 H new ATOM 0 HE3 TRP A 53 -2.874 1.189 -12.896 1.00 15.00 H new ATOM 0 HZ2 TRP A 53 0.364 -2.519 -12.121 1.00 15.00 H new ATOM 0 HZ3 TRP A 53 -3.579 -1.162 -13.061 1.00 15.00 H new ATOM 0 HH2 TRP A 53 -1.979 -2.989 -12.681 1.00 15.00 H new ATOM 829 N PHE A 54 -3.172 3.172 -13.956 1.00 15.00 N ATOM 830 CA PHE A 54 -4.318 2.421 -14.431 1.00 15.00 C ATOM 831 C PHE A 54 -4.781 2.914 -15.786 1.00 15.00 C ATOM 832 O PHE A 54 -5.501 2.222 -16.498 1.00 15.00 O ATOM 833 CB PHE A 54 -5.454 2.478 -13.420 1.00 15.00 C ATOM 834 CG PHE A 54 -5.038 1.963 -12.079 1.00 15.00 C ATOM 835 CD1 PHE A 54 -4.105 2.656 -11.337 1.00 15.00 C ATOM 836 CD2 PHE A 54 -5.556 0.785 -11.571 1.00 15.00 C ATOM 837 CE1 PHE A 54 -3.688 2.195 -10.111 1.00 15.00 C ATOM 838 CE2 PHE A 54 -5.148 0.313 -10.337 1.00 15.00 C ATOM 839 CZ PHE A 54 -4.210 1.020 -9.605 1.00 15.00 C ATOM 0 H PHE A 54 -3.390 3.890 -13.265 1.00 15.00 H new ATOM 0 HA PHE A 54 -4.009 1.382 -14.546 1.00 15.00 H new ATOM 0 HB2 PHE A 54 -5.800 3.507 -13.322 1.00 15.00 H new ATOM 0 HB3 PHE A 54 -6.296 1.892 -13.788 1.00 15.00 H new ATOM 0 HD1 PHE A 54 -3.695 3.576 -11.726 1.00 15.00 H new ATOM 0 HD2 PHE A 54 -6.285 0.230 -12.143 1.00 15.00 H new ATOM 0 HE1 PHE A 54 -2.954 2.750 -9.545 1.00 15.00 H new ATOM 0 HE2 PHE A 54 -5.560 -0.605 -9.945 1.00 15.00 H new ATOM 0 HZ PHE A 54 -3.887 0.654 -8.641 1.00 15.00 H new ATOM 849 N GLY A 55 -4.355 4.104 -16.155 1.00 15.00 N ATOM 850 CA GLY A 55 -4.735 4.620 -17.448 1.00 15.00 C ATOM 851 C GLY A 55 -4.211 3.728 -18.558 1.00 15.00 C ATOM 852 O GLY A 55 -4.977 3.205 -19.368 1.00 15.00 O ATOM 0 H GLY A 55 -3.762 4.716 -15.594 1.00 15.00 H new ATOM 0 HA2 GLY A 55 -5.821 4.689 -17.512 1.00 15.00 H new ATOM 0 HA3 GLY A 55 -4.344 5.630 -17.571 1.00 15.00 H new ATOM 856 N ASN A 56 -2.894 3.553 -18.578 1.00 15.00 N ATOM 857 CA ASN A 56 -2.230 2.716 -19.574 1.00 15.00 C ATOM 858 C ASN A 56 -1.893 1.326 -19.031 1.00 15.00 C ATOM 859 O ASN A 56 -2.296 0.309 -19.597 1.00 15.00 O ATOM 860 CB ASN A 56 -0.962 3.407 -20.076 1.00 15.00 C ATOM 861 CG ASN A 56 -0.097 3.935 -18.948 1.00 15.00 C ATOM 862 OD1 ASN A 56 -0.439 4.920 -18.295 1.00 15.00 O ATOM 863 ND2 ASN A 56 1.033 3.276 -18.712 1.00 15.00 N ATOM 0 H ASN A 56 -2.258 3.985 -17.908 1.00 15.00 H new ATOM 0 HA ASN A 56 -2.926 2.580 -20.402 1.00 15.00 H new ATOM 0 HB2 ASN A 56 -0.382 2.704 -20.674 1.00 15.00 H new ATOM 0 HB3 ASN A 56 -1.238 4.232 -20.733 1.00 15.00 H new ATOM 0 HD21 ASN A 56 1.656 3.583 -17.964 1.00 15.00 H new ATOM 0 HD22 ASN A 56 1.278 2.464 -19.278 1.00 15.00 H new ATOM 870 N LYS A 57 -1.113 1.298 -17.950 1.00 15.00 N ATOM 871 CA LYS A 57 -0.667 0.049 -17.340 1.00 15.00 C ATOM 872 C LYS A 57 -1.822 -0.878 -16.979 1.00 15.00 C ATOM 873 O LYS A 57 -1.618 -2.079 -16.806 1.00 15.00 O ATOM 874 CB LYS A 57 0.174 0.337 -16.098 1.00 15.00 C ATOM 875 CG LYS A 57 1.329 -0.635 -15.915 1.00 15.00 C ATOM 876 CD LYS A 57 2.341 -0.120 -14.907 1.00 15.00 C ATOM 877 CE LYS A 57 3.748 -0.589 -15.243 1.00 15.00 C ATOM 878 NZ LYS A 57 4.750 -0.087 -14.263 1.00 15.00 N ATOM 0 H LYS A 57 -0.775 2.136 -17.476 1.00 15.00 H new ATOM 0 HA LYS A 57 -0.062 -0.466 -18.086 1.00 15.00 H new ATOM 0 HB2 LYS A 57 0.568 1.351 -16.162 1.00 15.00 H new ATOM 0 HB3 LYS A 57 -0.467 0.299 -15.217 1.00 15.00 H new ATOM 0 HG2 LYS A 57 0.944 -1.600 -15.584 1.00 15.00 H new ATOM 0 HG3 LYS A 57 1.821 -0.800 -16.873 1.00 15.00 H new ATOM 0 HD2 LYS A 57 2.314 0.969 -14.887 1.00 15.00 H new ATOM 0 HD3 LYS A 57 2.070 -0.464 -13.909 1.00 15.00 H new ATOM 0 HE2 LYS A 57 3.773 -1.679 -15.261 1.00 15.00 H new ATOM 0 HE3 LYS A 57 4.015 -0.247 -16.243 1.00 15.00 H new ATOM 0 HZ1 LYS A 57 5.696 -0.429 -14.528 1.00 15.00 H new ATOM 0 HZ2 LYS A 57 4.745 0.953 -14.263 1.00 15.00 H new ATOM 0 HZ3 LYS A 57 4.510 -0.434 -13.312 1.00 15.00 H new ATOM 892 N ARG A 58 -3.033 -0.342 -16.883 1.00 15.00 N ATOM 893 CA ARG A 58 -4.179 -1.174 -16.564 1.00 15.00 C ATOM 894 C ARG A 58 -4.418 -2.125 -17.710 1.00 15.00 C ATOM 895 O ARG A 58 -4.772 -3.281 -17.514 1.00 15.00 O ATOM 896 CB ARG A 58 -5.429 -0.331 -16.327 1.00 15.00 C ATOM 897 CG ARG A 58 -6.674 -1.157 -16.049 1.00 15.00 C ATOM 898 CD ARG A 58 -7.807 -0.802 -16.999 1.00 15.00 C ATOM 899 NE ARG A 58 -8.757 -1.902 -17.152 1.00 15.00 N ATOM 900 CZ ARG A 58 -9.568 -2.042 -18.197 1.00 15.00 C ATOM 901 NH1 ARG A 58 -9.556 -1.151 -19.181 1.00 15.00 N ATOM 902 NH2 ARG A 58 -10.398 -3.074 -18.256 1.00 15.00 N ATOM 0 H ARG A 58 -3.242 0.647 -17.019 1.00 15.00 H new ATOM 0 HA ARG A 58 -3.970 -1.725 -15.647 1.00 15.00 H new ATOM 0 HB2 ARG A 58 -5.252 0.339 -15.485 1.00 15.00 H new ATOM 0 HB3 ARG A 58 -5.606 0.296 -17.201 1.00 15.00 H new ATOM 0 HG2 ARG A 58 -6.437 -2.217 -16.145 1.00 15.00 H new ATOM 0 HG3 ARG A 58 -6.997 -0.994 -15.021 1.00 15.00 H new ATOM 0 HD2 ARG A 58 -8.329 0.079 -16.627 1.00 15.00 H new ATOM 0 HD3 ARG A 58 -7.395 -0.541 -17.974 1.00 15.00 H new ATOM 0 HE ARG A 58 -8.801 -2.604 -16.413 1.00 15.00 H new ATOM 0 HH11 ARG A 58 -8.922 -0.353 -19.139 1.00 15.00 H new ATOM 0 HH12 ARG A 58 -10.181 -1.264 -19.979 1.00 15.00 H new ATOM 0 HH21 ARG A 58 -10.414 -3.759 -17.501 1.00 15.00 H new ATOM 0 HH22 ARG A 58 -11.021 -3.183 -19.057 1.00 15.00 H new ATOM 916 N ILE A 59 -4.197 -1.628 -18.918 1.00 15.00 N ATOM 917 CA ILE A 59 -4.379 -2.437 -20.107 1.00 15.00 C ATOM 918 C ILE A 59 -3.164 -3.302 -20.383 1.00 15.00 C ATOM 919 O ILE A 59 -2.904 -3.713 -21.512 1.00 15.00 O ATOM 920 CB ILE A 59 -4.689 -1.562 -21.316 1.00 15.00 C ATOM 921 CG1 ILE A 59 -5.578 -2.312 -22.323 1.00 15.00 C ATOM 922 CG2 ILE A 59 -3.419 -1.032 -21.978 1.00 15.00 C ATOM 923 CD1 ILE A 59 -5.307 -3.810 -22.427 1.00 15.00 C ATOM 0 H ILE A 59 -3.892 -0.671 -19.097 1.00 15.00 H new ATOM 0 HA ILE A 59 -5.228 -3.096 -19.925 1.00 15.00 H new ATOM 0 HB ILE A 59 -5.244 -0.695 -20.958 1.00 15.00 H new ATOM 0 HG12 ILE A 59 -6.622 -2.165 -22.045 1.00 15.00 H new ATOM 0 HG13 ILE A 59 -5.444 -1.864 -23.308 1.00 15.00 H new ATOM 0 HG21 ILE A 59 -3.686 -0.414 -22.835 1.00 15.00 H new ATOM 0 HG22 ILE A 59 -2.857 -0.434 -21.260 1.00 15.00 H new ATOM 0 HG23 ILE A 59 -2.806 -1.869 -22.312 1.00 15.00 H new ATOM 0 HD11 ILE A 59 -5.981 -4.252 -23.161 1.00 15.00 H new ATOM 0 HD12 ILE A 59 -4.275 -3.972 -22.739 1.00 15.00 H new ATOM 0 HD13 ILE A 59 -5.471 -4.278 -21.456 1.00 15.00 H new ATOM 935 N ARG A 60 -2.422 -3.557 -19.339 1.00 15.00 N ATOM 936 CA ARG A 60 -1.222 -4.365 -19.436 1.00 15.00 C ATOM 937 C ARG A 60 -1.536 -5.858 -19.366 1.00 15.00 C ATOM 938 O ARG A 60 -0.671 -6.653 -19.000 1.00 15.00 O ATOM 939 CB ARG A 60 -0.238 -3.985 -18.328 1.00 15.00 C ATOM 940 CG ARG A 60 1.116 -4.665 -18.458 1.00 15.00 C ATOM 941 CD ARG A 60 2.228 -3.810 -17.873 1.00 15.00 C ATOM 942 NE ARG A 60 3.153 -4.597 -17.061 1.00 15.00 N ATOM 943 CZ ARG A 60 4.386 -4.205 -16.750 1.00 15.00 C ATOM 944 NH1 ARG A 60 4.846 -3.036 -17.180 1.00 15.00 N ATOM 945 NH2 ARG A 60 5.161 -4.981 -16.006 1.00 15.00 N ATOM 0 H ARG A 60 -2.625 -3.216 -18.399 1.00 15.00 H new ATOM 0 HA ARG A 60 -0.769 -4.166 -20.407 1.00 15.00 H new ATOM 0 HB2 ARG A 60 -0.095 -2.904 -18.335 1.00 15.00 H new ATOM 0 HB3 ARG A 60 -0.674 -4.242 -17.363 1.00 15.00 H new ATOM 0 HG2 ARG A 60 1.091 -5.629 -17.949 1.00 15.00 H new ATOM 0 HG3 ARG A 60 1.324 -4.865 -19.509 1.00 15.00 H new ATOM 0 HD2 ARG A 60 2.776 -3.326 -18.681 1.00 15.00 H new ATOM 0 HD3 ARG A 60 1.794 -3.018 -17.263 1.00 15.00 H new ATOM 0 HE ARG A 60 2.835 -5.501 -16.712 1.00 15.00 H new ATOM 0 HH11 ARG A 60 4.253 -2.434 -17.752 1.00 15.00 H new ATOM 0 HH12 ARG A 60 5.792 -2.740 -16.939 1.00 15.00 H new ATOM 0 HH21 ARG A 60 4.812 -5.879 -15.671 1.00 15.00 H new ATOM 0 HH22 ARG A 60 6.106 -4.680 -15.768 1.00 15.00 H new ATOM 959 N TYR A 61 -2.758 -6.257 -19.738 1.00 15.00 N ATOM 960 CA TYR A 61 -3.098 -7.668 -19.717 1.00 15.00 C ATOM 961 C TYR A 61 -2.653 -8.333 -21.003 1.00 15.00 C ATOM 962 O TYR A 61 -1.517 -8.787 -21.139 1.00 15.00 O ATOM 963 CB TYR A 61 -4.585 -7.936 -19.474 1.00 15.00 C ATOM 964 CG TYR A 61 -5.497 -6.785 -19.715 1.00 15.00 C ATOM 965 CD1 TYR A 61 -5.628 -5.818 -18.753 1.00 15.00 C ATOM 966 CD2 TYR A 61 -6.247 -6.689 -20.873 1.00 15.00 C ATOM 967 CE1 TYR A 61 -6.496 -4.754 -18.933 1.00 15.00 C ATOM 968 CE2 TYR A 61 -7.107 -5.637 -21.073 1.00 15.00 C ATOM 969 CZ TYR A 61 -7.232 -4.667 -20.099 1.00 15.00 C ATOM 970 OH TYR A 61 -8.096 -3.613 -20.288 1.00 15.00 O ATOM 0 H TYR A 61 -3.504 -5.635 -20.048 1.00 15.00 H new ATOM 0 HA TYR A 61 -2.565 -8.098 -18.869 1.00 15.00 H new ATOM 0 HB2 TYR A 61 -4.896 -8.762 -20.114 1.00 15.00 H new ATOM 0 HB3 TYR A 61 -4.712 -8.266 -18.443 1.00 15.00 H new ATOM 0 HD1 TYR A 61 -5.048 -5.886 -17.845 1.00 15.00 H new ATOM 0 HD2 TYR A 61 -6.155 -7.453 -21.631 1.00 15.00 H new ATOM 0 HE1 TYR A 61 -6.597 -3.998 -18.168 1.00 15.00 H new ATOM 0 HE2 TYR A 61 -7.681 -5.569 -21.985 1.00 15.00 H new ATOM 0 HH TYR A 61 -8.535 -3.702 -21.160 1.00 15.00 H new ATOM 980 N LYS A 62 -3.567 -8.360 -21.935 1.00 15.00 N ATOM 981 CA LYS A 62 -3.337 -8.938 -23.249 1.00 15.00 C ATOM 982 C LYS A 62 -4.389 -8.466 -24.251 1.00 15.00 C ATOM 983 O LYS A 62 -5.253 -9.235 -24.669 1.00 15.00 O ATOM 984 CB LYS A 62 -3.323 -10.467 -23.167 1.00 15.00 C ATOM 985 CG LYS A 62 -2.059 -11.094 -23.731 1.00 15.00 C ATOM 986 CD LYS A 62 -1.570 -12.243 -22.863 1.00 15.00 C ATOM 987 CE LYS A 62 -0.401 -11.821 -21.987 1.00 15.00 C ATOM 988 NZ LYS A 62 -0.573 -12.269 -20.578 1.00 15.00 N ATOM 0 H LYS A 62 -4.505 -7.980 -21.811 1.00 15.00 H new ATOM 0 HA LYS A 62 -2.362 -8.598 -23.600 1.00 15.00 H new ATOM 0 HB2 LYS A 62 -3.434 -10.768 -22.125 1.00 15.00 H new ATOM 0 HB3 LYS A 62 -4.185 -10.860 -23.706 1.00 15.00 H new ATOM 0 HG2 LYS A 62 -2.251 -11.456 -24.741 1.00 15.00 H new ATOM 0 HG3 LYS A 62 -1.279 -10.337 -23.807 1.00 15.00 H new ATOM 0 HD2 LYS A 62 -2.387 -12.599 -22.235 1.00 15.00 H new ATOM 0 HD3 LYS A 62 -1.269 -13.077 -23.497 1.00 15.00 H new ATOM 0 HE2 LYS A 62 0.523 -12.236 -22.390 1.00 15.00 H new ATOM 0 HE3 LYS A 62 -0.301 -10.736 -22.013 1.00 15.00 H new ATOM 0 HZ1 LYS A 62 0.245 -11.962 -20.014 1.00 15.00 H new ATOM 0 HZ2 LYS A 62 -1.441 -11.853 -20.185 1.00 15.00 H new ATOM 0 HZ3 LYS A 62 -0.643 -13.306 -20.550 1.00 15.00 H new ATOM 1002 N LYS A 63 -4.312 -7.193 -24.628 1.00 15.00 N ATOM 1003 CA LYS A 63 -5.244 -6.619 -25.563 1.00 15.00 C ATOM 1004 C LYS A 63 -4.653 -5.354 -26.191 1.00 15.00 C ATOM 1005 O LYS A 63 -3.442 -5.264 -26.392 1.00 15.00 O ATOM 1006 CB LYS A 63 -6.554 -6.311 -24.848 1.00 15.00 C ATOM 1007 CG LYS A 63 -7.755 -6.535 -25.732 1.00 15.00 C ATOM 1008 CD LYS A 63 -8.576 -7.728 -25.274 1.00 15.00 C ATOM 1009 CE LYS A 63 -9.388 -8.315 -26.417 1.00 15.00 C ATOM 1010 NZ LYS A 63 -8.525 -9.006 -27.414 1.00 15.00 N ATOM 0 H LYS A 63 -3.602 -6.543 -24.290 1.00 15.00 H new ATOM 0 HA LYS A 63 -5.441 -7.331 -26.364 1.00 15.00 H new ATOM 0 HB2 LYS A 63 -6.637 -6.938 -23.960 1.00 15.00 H new ATOM 0 HB3 LYS A 63 -6.545 -5.276 -24.507 1.00 15.00 H new ATOM 0 HG2 LYS A 63 -8.379 -5.642 -25.731 1.00 15.00 H new ATOM 0 HG3 LYS A 63 -7.426 -6.692 -26.759 1.00 15.00 H new ATOM 0 HD2 LYS A 63 -7.914 -8.492 -24.866 1.00 15.00 H new ATOM 0 HD3 LYS A 63 -9.245 -7.424 -24.469 1.00 15.00 H new ATOM 0 HE2 LYS A 63 -10.118 -9.019 -26.019 1.00 15.00 H new ATOM 0 HE3 LYS A 63 -9.948 -7.520 -26.910 1.00 15.00 H new ATOM 0 HZ1 LYS A 63 -9.102 -9.665 -27.974 1.00 15.00 H new ATOM 0 HZ2 LYS A 63 -8.092 -8.302 -28.045 1.00 15.00 H new ATOM 0 HZ3 LYS A 63 -7.778 -9.534 -26.920 1.00 15.00 H new ATOM 1024 N ASN A 64 -5.505 -4.385 -26.496 1.00 15.00 N ATOM 1025 CA ASN A 64 -5.060 -3.134 -27.097 1.00 15.00 C ATOM 1026 C ASN A 64 -4.381 -3.388 -28.439 1.00 15.00 C ATOM 1027 O ASN A 64 -5.090 -3.398 -29.468 1.00 15.00 O ATOM 1028 CB ASN A 64 -4.097 -2.405 -26.156 1.00 15.00 C ATOM 1029 CG ASN A 64 -3.806 -0.988 -26.610 1.00 15.00 C ATOM 1030 OD1 ASN A 64 -3.809 -0.694 -27.806 1.00 15.00 O ATOM 1031 ND2 ASN A 64 -3.554 -0.101 -25.656 1.00 15.00 N ATOM 1032 OXT ASN A 64 -3.146 -3.573 -28.451 1.00 15.00 O ATOM 0 H ASN A 64 -6.511 -4.441 -26.337 1.00 15.00 H new ATOM 0 HA ASN A 64 -5.937 -2.508 -27.265 1.00 15.00 H new ATOM 0 HB2 ASN A 64 -4.522 -2.382 -25.153 1.00 15.00 H new ATOM 0 HB3 ASN A 64 -3.163 -2.963 -26.094 1.00 15.00 H new ATOM 0 HD21 ASN A 64 -3.352 0.868 -25.901 1.00 15.00 H new ATOM 0 HD22 ASN A 64 -3.562 -0.388 -24.677 1.00 15.00 H new TER 1039 ASN A 64