USER MOD reduce.3.24.130724 H: found=0, std=0, add=1132, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1135 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 54 SER OG : rot 101:sc= 1.25 USER MOD Set 1.2: B 548 GLN :FLIP amide:sc= 0.344 F(o=-1.5!,f=1.6) USER MOD Set 2.1: A 93 ASN : amide:sc= -1.13 K(o=-1.4,f=-13!) USER MOD Set 2.2: A 95 THR OG1 : rot 180:sc= -0.318 USER MOD Set 3.1: A 59 MET CE :methyl -137:sc= -0.0645 (180deg=-0.834) USER MOD Set 3.2: A 88 MET CE :methyl -176:sc= -0.9 (180deg=-1.13) USER MOD Set 4.1: A 51 THR OG1 : rot 36:sc= 1.12 USER MOD Set 4.2: A 58 MET CE :methyl 136:sc= -0.0938 (180deg=-0.768) USER MOD Set 4.3: A 97 MET CE :methyl 151:sc= -0.0221 (180deg=-0.461) USER MOD Set 5.1: A 19 ASN :FLIP amide:sc= 0.513 F(o=-0.67,f=1.7) USER MOD Set 5.2: A 28 THR OG1 : rot 148:sc= 1.18 USER MOD Set 5.3: A 39 THR OG1 : rot -73:sc= 0.00652 USER MOD Set 6.1: A 2 SER OG : rot 11:sc= 0.528 USER MOD Set 6.2: A 99 ASN : amide:sc= 0.905 X(o=1.4,f=1.4) USER MOD Set 6.3: A 102 MET CE :methyl 168:sc=-0.00776 (180deg=-0.184) USER MOD Single : A 3 HIS :FLIP no HD1:sc= -0.615 F(o=-1.7,f=-0.62) USER MOD Single : A 4 SER OG : rot 46:sc= 0.279 USER MOD Single : A 11 LYS NZ :NH3+ -168:sc=-0.00548 (180deg=-0.131) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 133:sc= 1.91 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 165:sc= 0.0288 (180deg=-0.113) USER MOD Single : A 38 HIS :FLIP no HE2:sc= -1.96 F(o=-4.3!,f=-2) USER MOD Single : A 43 SER OG : rot 170:sc= 0 USER MOD Single : A 44 THR OG1 : rot -70:sc= 1.13 USER MOD Single : A 47 LYS NZ :NH3+ 172:sc= 1.19 (180deg=1.18) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 55 SER OG : rot -166:sc= -1.57 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0786) USER MOD Single : A 69 SER OG : rot -99:sc= 0.629 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 175:sc= 0.00967 (180deg=-0.0278) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 78 ASN : amide:sc= -0.304 X(o=-0.3,f=-0.012) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0.0426 X(o=0.043,f=0) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= -0.23 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 80:sc= -2.51! USER MOD Single : A 105 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 106 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.17) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot -30:sc= -0.299 USER MOD Single : A 112 LYS NZ :NH3+ -121:sc= 0.0243 (180deg=-0.0852) USER MOD Single : B 520 SER OG : rot 180:sc= 0 USER MOD Single : B 523 TYR OH : rot 180:sc= 0 USER MOD Single : B 525 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 529 SER OG : rot 180:sc= 0 USER MOD Single : B 535 SER OG : rot -108:sc= 0.043 USER MOD Single : B 536 SER OG : rot -74:sc= 0.0434 USER MOD Single : B 540 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 543 SER OG : rot 180:sc= 0 USER MOD Single : B 547 SER OG : rot 180:sc= 0 USER MOD Single : B 550 SER OG : rot 180:sc= 0 USER MOD Single : B 551 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 21.572 0.169 -3.450 1.00 25.00 N ATOM 2 CA PRO A 1 20.271 0.834 -3.716 1.00 25.00 C ATOM 3 C PRO A 1 19.140 -0.184 -3.855 1.00 25.00 C ATOM 4 O PRO A 1 19.386 -1.372 -4.076 1.00 25.00 O ATOM 5 CB PRO A 1 20.396 1.655 -5.001 1.00 25.00 C ATOM 6 CG PRO A 1 21.857 1.964 -5.083 1.00 25.00 C ATOM 7 CD PRO A 1 22.559 0.884 -4.280 1.00 25.00 C ATOM 0 H2 PRO A 1 21.535 -0.821 -3.695 1.00 25.00 H new ATOM 0 H3 PRO A 1 21.816 0.223 -2.461 1.00 25.00 H new ATOM 0 HA PRO A 1 20.027 1.481 -2.873 1.00 25.00 H new ATOM 0 HB2 PRO A 1 20.056 1.092 -5.870 1.00 25.00 H new ATOM 0 HB3 PRO A 1 19.796 2.564 -4.955 1.00 25.00 H new ATOM 0 HG2 PRO A 1 22.198 1.964 -6.118 1.00 25.00 H new ATOM 0 HG3 PRO A 1 22.070 2.953 -4.677 1.00 25.00 H new ATOM 0 HD2 PRO A 1 23.061 0.186 -4.950 1.00 25.00 H new ATOM 0 HD3 PRO A 1 23.328 1.328 -3.648 1.00 25.00 H new ATOM 17 N SER A 2 17.890 0.310 -3.707 1.00 25.00 N ATOM 18 CA SER A 2 16.647 -0.464 -3.941 1.00 25.00 C ATOM 19 C SER A 2 16.506 -1.704 -3.039 1.00 25.00 C ATOM 20 O SER A 2 17.465 -2.147 -2.402 1.00 25.00 O ATOM 21 CB SER A 2 16.501 -0.856 -5.431 1.00 25.00 C ATOM 22 OG SER A 2 16.464 0.278 -6.281 1.00 25.00 O ATOM 0 H SER A 2 17.712 1.272 -3.417 1.00 25.00 H new ATOM 0 HA SER A 2 15.832 0.206 -3.667 1.00 25.00 H new ATOM 0 HB2 SER A 2 17.334 -1.497 -5.720 1.00 25.00 H new ATOM 0 HB3 SER A 2 15.589 -1.438 -5.564 1.00 25.00 H new ATOM 0 HG SER A 2 16.716 1.077 -5.772 1.00 25.00 H new ATOM 28 N HIS A 3 15.266 -2.239 -3.004 1.00 25.00 N ATOM 29 CA HIS A 3 14.877 -3.454 -2.242 1.00 25.00 C ATOM 30 C HIS A 3 14.782 -3.209 -0.735 1.00 25.00 C ATOM 31 O HIS A 3 13.751 -3.512 -0.127 1.00 25.00 O ATOM 32 CB HIS A 3 15.783 -4.671 -2.526 1.00 25.00 C ATOM 33 CG HIS A 3 15.777 -5.141 -3.951 1.00 25.00 C ATOM 34 ND1 HIS A 3 16.325 -4.606 -5.067 1.00 25.00 N flip ATOM 35 CD2 HIS A 3 15.133 -6.292 -4.358 1.00 25.00 C flip ATOM 36 CE1 HIS A 3 16.003 -5.437 -6.114 1.00 25.00 C flip ATOM 37 NE2 HIS A 3 15.285 -6.444 -5.660 1.00 25.00 N flip ATOM 0 H HIS A 3 14.485 -1.830 -3.517 1.00 25.00 H new ATOM 0 HA HIS A 3 13.879 -3.694 -2.608 1.00 25.00 H new ATOM 0 HB2 HIS A 3 16.806 -4.418 -2.246 1.00 25.00 H new ATOM 0 HB3 HIS A 3 15.471 -5.496 -1.885 1.00 25.00 H new ATOM 0 HD2 HIS A 3 14.589 -6.964 -3.711 1.00 25.00 H new ATOM 0 HE1 HIS A 3 16.292 -5.288 -7.144 1.00 25.00 H new ATOM 0 HE2 HIS A 3 14.911 -7.210 -6.219 1.00 25.00 H new ATOM 46 N SER A 4 15.844 -2.662 -0.139 1.00 25.00 N ATOM 47 CA SER A 4 15.883 -2.449 1.310 1.00 25.00 C ATOM 48 C SER A 4 16.309 -1.035 1.684 1.00 25.00 C ATOM 49 O SER A 4 17.174 -0.435 1.037 1.00 25.00 O ATOM 50 CB SER A 4 16.802 -3.476 1.983 1.00 25.00 C ATOM 51 OG SER A 4 16.892 -3.258 3.382 1.00 25.00 O ATOM 0 H SER A 4 16.684 -2.360 -0.633 1.00 25.00 H new ATOM 0 HA SER A 4 14.865 -2.584 1.674 1.00 25.00 H new ATOM 0 HB2 SER A 4 16.425 -4.481 1.794 1.00 25.00 H new ATOM 0 HB3 SER A 4 17.797 -3.420 1.541 1.00 25.00 H new ATOM 0 HG SER A 4 15.995 -3.111 3.748 1.00 25.00 H new ATOM 57 N GLY A 5 15.679 -0.524 2.746 1.00 25.00 N ATOM 58 CA GLY A 5 15.982 0.799 3.262 1.00 25.00 C ATOM 59 C GLY A 5 15.556 0.947 4.710 1.00 25.00 C ATOM 60 O GLY A 5 16.137 0.319 5.599 1.00 25.00 O ATOM 0 H GLY A 5 14.951 -1.017 3.263 1.00 25.00 H new ATOM 0 HA2 GLY A 5 17.052 0.987 3.176 1.00 25.00 H new ATOM 0 HA3 GLY A 5 15.477 1.551 2.655 1.00 25.00 H new ATOM 64 N ALA A 6 14.540 1.790 4.941 1.00 25.00 N ATOM 65 CA ALA A 6 13.940 1.968 6.270 1.00 25.00 C ATOM 66 C ALA A 6 12.481 2.407 6.140 1.00 25.00 C ATOM 67 O ALA A 6 12.184 3.375 5.430 1.00 25.00 O ATOM 68 CB ALA A 6 14.717 2.987 7.092 1.00 25.00 C ATOM 0 H ALA A 6 14.113 2.365 4.215 1.00 25.00 H new ATOM 0 HA ALA A 6 13.981 1.009 6.786 1.00 25.00 H new ATOM 0 HB1 ALA A 6 14.250 3.098 8.070 1.00 25.00 H new ATOM 0 HB2 ALA A 6 15.745 2.646 7.217 1.00 25.00 H new ATOM 0 HB3 ALA A 6 14.714 3.948 6.578 1.00 25.00 H new ATOM 74 N ALA A 7 11.570 1.694 6.822 1.00 25.00 N ATOM 75 CA ALA A 7 10.132 1.985 6.731 1.00 25.00 C ATOM 76 C ALA A 7 9.397 1.727 8.053 1.00 25.00 C ATOM 77 O ALA A 7 9.838 0.922 8.876 1.00 25.00 O ATOM 78 CB ALA A 7 9.500 1.164 5.617 1.00 25.00 C ATOM 0 H ALA A 7 11.803 0.916 7.439 1.00 25.00 H new ATOM 0 HA ALA A 7 10.034 3.047 6.507 1.00 25.00 H new ATOM 0 HB1 ALA A 7 8.435 1.388 5.559 1.00 25.00 H new ATOM 0 HB2 ALA A 7 9.975 1.412 4.668 1.00 25.00 H new ATOM 0 HB3 ALA A 7 9.637 0.103 5.825 1.00 25.00 H new ATOM 84 N ILE A 8 8.267 2.427 8.233 1.00 25.00 N ATOM 85 CA ILE A 8 7.384 2.243 9.395 1.00 25.00 C ATOM 86 C ILE A 8 6.059 1.616 8.932 1.00 25.00 C ATOM 87 O ILE A 8 5.538 1.964 7.869 1.00 25.00 O ATOM 88 CB ILE A 8 7.110 3.601 10.136 1.00 25.00 C ATOM 89 CG1 ILE A 8 8.419 4.174 10.722 1.00 25.00 C ATOM 90 CG2 ILE A 8 6.058 3.435 11.248 1.00 25.00 C ATOM 91 CD1 ILE A 8 8.305 5.577 11.294 1.00 25.00 C ATOM 0 H ILE A 8 7.939 3.136 7.577 1.00 25.00 H new ATOM 0 HA ILE A 8 7.882 1.579 10.102 1.00 25.00 H new ATOM 0 HB ILE A 8 6.715 4.302 9.401 1.00 25.00 H new ATOM 0 HG12 ILE A 8 8.772 3.505 11.507 1.00 25.00 H new ATOM 0 HG13 ILE A 8 9.179 4.177 9.941 1.00 25.00 H new ATOM 0 HG21 ILE A 8 5.893 4.394 11.739 1.00 25.00 H new ATOM 0 HG22 ILE A 8 5.122 3.084 10.814 1.00 25.00 H new ATOM 0 HG23 ILE A 8 6.413 2.709 11.979 1.00 25.00 H new ATOM 0 HD11 ILE A 8 9.274 5.892 11.681 1.00 25.00 H new ATOM 0 HD12 ILE A 8 7.986 6.265 10.511 1.00 25.00 H new ATOM 0 HD13 ILE A 8 7.573 5.582 12.101 1.00 25.00 H new ATOM 103 N PHE A 9 5.529 0.692 9.742 1.00 25.00 N ATOM 104 CA PHE A 9 4.275 0.001 9.436 1.00 25.00 C ATOM 105 C PHE A 9 3.488 -0.228 10.722 1.00 25.00 C ATOM 106 O PHE A 9 3.980 -0.871 11.648 1.00 25.00 O ATOM 107 CB PHE A 9 4.557 -1.336 8.719 1.00 25.00 C ATOM 108 CG PHE A 9 3.328 -2.093 8.266 1.00 25.00 C ATOM 109 CD1 PHE A 9 2.651 -1.723 7.113 1.00 25.00 C ATOM 110 CD2 PHE A 9 2.862 -3.181 8.991 1.00 25.00 C ATOM 111 CE1 PHE A 9 1.533 -2.418 6.694 1.00 25.00 C ATOM 112 CE2 PHE A 9 1.743 -3.879 8.576 1.00 25.00 C ATOM 113 CZ PHE A 9 1.079 -3.499 7.427 1.00 25.00 C ATOM 0 H PHE A 9 5.956 0.405 10.623 1.00 25.00 H new ATOM 0 HA PHE A 9 3.679 0.621 8.767 1.00 25.00 H new ATOM 0 HB2 PHE A 9 5.184 -1.139 7.850 1.00 25.00 H new ATOM 0 HB3 PHE A 9 5.132 -1.975 9.389 1.00 25.00 H new ATOM 0 HD1 PHE A 9 3.003 -0.881 6.536 1.00 25.00 H new ATOM 0 HD2 PHE A 9 3.379 -3.486 9.889 1.00 25.00 H new ATOM 0 HE1 PHE A 9 1.015 -2.118 5.796 1.00 25.00 H new ATOM 0 HE2 PHE A 9 1.388 -4.722 9.151 1.00 25.00 H new ATOM 0 HZ PHE A 9 0.206 -4.045 7.101 1.00 25.00 H new ATOM 123 N GLU A 10 2.256 0.307 10.763 1.00 25.00 N ATOM 124 CA GLU A 10 1.355 0.218 11.942 1.00 25.00 C ATOM 125 C GLU A 10 1.959 0.906 13.183 1.00 25.00 C ATOM 126 O GLU A 10 1.858 0.409 14.313 1.00 25.00 O ATOM 127 CB GLU A 10 0.975 -1.243 12.251 1.00 25.00 C ATOM 128 CG GLU A 10 0.206 -1.922 11.130 1.00 25.00 C ATOM 129 CD GLU A 10 -0.058 -3.391 11.403 1.00 25.00 C ATOM 130 OE1 GLU A 10 0.382 -3.886 12.462 1.00 25.00 O ATOM 131 OE2 GLU A 10 -0.705 -4.046 10.558 1.00 25.00 O ATOM 0 H GLU A 10 1.848 0.817 9.980 1.00 25.00 H new ATOM 0 HA GLU A 10 0.442 0.755 11.684 1.00 25.00 H new ATOM 0 HB2 GLU A 10 1.883 -1.811 12.453 1.00 25.00 H new ATOM 0 HB3 GLU A 10 0.374 -1.269 13.160 1.00 25.00 H new ATOM 0 HG2 GLU A 10 -0.744 -1.408 10.984 1.00 25.00 H new ATOM 0 HG3 GLU A 10 0.767 -1.825 10.200 1.00 25.00 H new ATOM 138 N LYS A 11 2.591 2.070 12.939 1.00 25.00 N ATOM 139 CA LYS A 11 3.178 2.950 13.990 1.00 25.00 C ATOM 140 C LYS A 11 4.427 2.352 14.664 1.00 25.00 C ATOM 141 O LYS A 11 5.076 3.020 15.478 1.00 25.00 O ATOM 142 CB LYS A 11 2.137 3.351 15.054 1.00 25.00 C ATOM 143 CG LYS A 11 0.994 4.201 14.498 1.00 25.00 C ATOM 144 CD LYS A 11 -0.009 4.615 15.572 1.00 25.00 C ATOM 145 CE LYS A 11 -0.866 3.447 16.054 1.00 25.00 C ATOM 146 NZ LYS A 11 -1.784 2.940 14.993 1.00 25.00 N ATOM 0 H LYS A 11 2.714 2.438 11.996 1.00 25.00 H new ATOM 0 HA LYS A 11 3.500 3.847 13.462 1.00 25.00 H new ATOM 0 HB2 LYS A 11 1.723 2.449 15.504 1.00 25.00 H new ATOM 0 HB3 LYS A 11 2.637 3.904 15.850 1.00 25.00 H new ATOM 0 HG2 LYS A 11 1.406 5.094 14.028 1.00 25.00 H new ATOM 0 HG3 LYS A 11 0.476 3.641 13.719 1.00 25.00 H new ATOM 0 HD2 LYS A 11 0.527 5.042 16.420 1.00 25.00 H new ATOM 0 HD3 LYS A 11 -0.657 5.398 15.177 1.00 25.00 H new ATOM 0 HE2 LYS A 11 -0.217 2.637 16.387 1.00 25.00 H new ATOM 0 HE3 LYS A 11 -1.452 3.762 16.918 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 -2.480 2.294 15.416 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 -2.279 3.741 14.550 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 -1.234 2.432 14.272 1.00 25.00 H new ATOM 160 N VAL A 12 4.764 1.105 14.315 1.00 25.00 N ATOM 161 CA VAL A 12 6.000 0.467 14.775 1.00 25.00 C ATOM 162 C VAL A 12 7.075 0.611 13.685 1.00 25.00 C ATOM 163 O VAL A 12 6.867 0.196 12.541 1.00 25.00 O ATOM 164 CB VAL A 12 5.760 -1.031 15.200 1.00 25.00 C ATOM 165 CG1 VAL A 12 7.043 -1.716 15.643 1.00 25.00 C ATOM 166 CG2 VAL A 12 4.690 -1.173 16.286 1.00 25.00 C ATOM 0 H VAL A 12 4.192 0.515 13.711 1.00 25.00 H new ATOM 0 HA VAL A 12 6.355 0.971 15.674 1.00 25.00 H new ATOM 0 HB VAL A 12 5.395 -1.531 14.303 1.00 25.00 H new ATOM 0 HG11 VAL A 12 6.826 -2.746 15.926 1.00 25.00 H new ATOM 0 HG12 VAL A 12 7.761 -1.708 14.823 1.00 25.00 H new ATOM 0 HG13 VAL A 12 7.462 -1.185 16.498 1.00 25.00 H new ATOM 0 HG21 VAL A 12 4.566 -2.226 16.540 1.00 25.00 H new ATOM 0 HG22 VAL A 12 4.997 -0.620 17.174 1.00 25.00 H new ATOM 0 HG23 VAL A 12 3.744 -0.775 15.919 1.00 25.00 H new ATOM 176 N SER A 13 8.208 1.219 14.054 1.00 25.00 N ATOM 177 CA SER A 13 9.271 1.529 13.095 1.00 25.00 C ATOM 178 C SER A 13 10.174 0.328 12.853 1.00 25.00 C ATOM 179 O SER A 13 10.487 -0.429 13.779 1.00 25.00 O ATOM 180 CB SER A 13 10.099 2.727 13.571 1.00 25.00 C ATOM 181 OG SER A 13 11.158 3.009 12.672 1.00 25.00 O ATOM 0 H SER A 13 8.411 1.506 15.011 1.00 25.00 H new ATOM 0 HA SER A 13 8.793 1.786 12.150 1.00 25.00 H new ATOM 0 HB2 SER A 13 9.456 3.602 13.665 1.00 25.00 H new ATOM 0 HB3 SER A 13 10.505 2.521 14.562 1.00 25.00 H new ATOM 0 HG SER A 13 11.669 3.779 12.999 1.00 25.00 H new ATOM 187 N GLY A 14 10.581 0.169 11.594 1.00 25.00 N ATOM 188 CA GLY A 14 11.394 -0.965 11.201 1.00 25.00 C ATOM 189 C GLY A 14 12.175 -0.720 9.930 1.00 25.00 C ATOM 190 O GLY A 14 12.457 0.427 9.570 1.00 25.00 O ATOM 0 H GLY A 14 10.358 0.813 10.835 1.00 25.00 H new ATOM 0 HA2 GLY A 14 12.088 -1.204 12.007 1.00 25.00 H new ATOM 0 HA3 GLY A 14 10.752 -1.835 11.064 1.00 25.00 H new ATOM 194 N ILE A 15 12.520 -1.816 9.260 1.00 25.00 N ATOM 195 CA ILE A 15 13.268 -1.778 8.006 1.00 25.00 C ATOM 196 C ILE A 15 12.517 -2.589 6.934 1.00 25.00 C ATOM 197 O ILE A 15 11.958 -3.650 7.226 1.00 25.00 O ATOM 198 CB ILE A 15 14.726 -2.328 8.216 1.00 25.00 C ATOM 199 CG1 ILE A 15 15.595 -1.369 9.083 1.00 25.00 C ATOM 200 CG2 ILE A 15 15.437 -2.656 6.894 1.00 25.00 C ATOM 201 CD1 ILE A 15 16.933 -1.914 9.581 1.00 25.00 C ATOM 0 H ILE A 15 12.288 -2.759 9.572 1.00 25.00 H new ATOM 0 HA ILE A 15 13.351 -0.745 7.667 1.00 25.00 H new ATOM 0 HB ILE A 15 14.610 -3.265 8.761 1.00 25.00 H new ATOM 0 HG12 ILE A 15 15.790 -0.468 8.501 1.00 25.00 H new ATOM 0 HG13 ILE A 15 15.007 -1.068 9.950 1.00 25.00 H new ATOM 0 HG21 ILE A 15 16.439 -3.031 7.103 1.00 25.00 H new ATOM 0 HG22 ILE A 15 14.870 -3.415 6.355 1.00 25.00 H new ATOM 0 HG23 ILE A 15 15.507 -1.755 6.285 1.00 25.00 H new ATOM 0 HD11 ILE A 15 17.440 -1.151 10.171 1.00 25.00 H new ATOM 0 HD12 ILE A 15 16.760 -2.795 10.199 1.00 25.00 H new ATOM 0 HD13 ILE A 15 17.555 -2.186 8.728 1.00 25.00 H new ATOM 213 N ILE A 16 12.520 -2.074 5.697 1.00 25.00 N ATOM 214 CA ILE A 16 11.826 -2.720 4.580 1.00 25.00 C ATOM 215 C ILE A 16 12.829 -3.475 3.682 1.00 25.00 C ATOM 216 O ILE A 16 13.916 -2.969 3.399 1.00 25.00 O ATOM 217 CB ILE A 16 10.962 -1.661 3.797 1.00 25.00 C ATOM 218 CG1 ILE A 16 9.459 -1.977 3.991 1.00 25.00 C ATOM 219 CG2 ILE A 16 11.328 -1.540 2.301 1.00 25.00 C ATOM 220 CD1 ILE A 16 8.580 -1.732 2.767 1.00 25.00 C ATOM 0 H ILE A 16 12.998 -1.208 5.446 1.00 25.00 H new ATOM 0 HA ILE A 16 11.134 -3.471 4.961 1.00 25.00 H new ATOM 0 HB ILE A 16 11.189 -0.683 4.221 1.00 25.00 H new ATOM 0 HG12 ILE A 16 9.359 -3.021 4.287 1.00 25.00 H new ATOM 0 HG13 ILE A 16 9.081 -1.374 4.817 1.00 25.00 H new ATOM 0 HG21 ILE A 16 10.691 -0.792 1.830 1.00 25.00 H new ATOM 0 HG22 ILE A 16 12.372 -1.240 2.205 1.00 25.00 H new ATOM 0 HG23 ILE A 16 11.181 -2.503 1.811 1.00 25.00 H new ATOM 0 HD11 ILE A 16 7.546 -1.983 3.005 1.00 25.00 H new ATOM 0 HD12 ILE A 16 8.641 -0.683 2.479 1.00 25.00 H new ATOM 0 HD13 ILE A 16 8.924 -2.355 1.942 1.00 25.00 H new ATOM 232 N ALA A 17 12.452 -4.691 3.268 1.00 25.00 N ATOM 233 CA ALA A 17 13.283 -5.518 2.382 1.00 25.00 C ATOM 234 C ALA A 17 12.438 -6.190 1.298 1.00 25.00 C ATOM 235 O ALA A 17 11.287 -6.547 1.542 1.00 25.00 O ATOM 236 CB ALA A 17 14.042 -6.565 3.190 1.00 25.00 C ATOM 0 H ALA A 17 11.570 -5.127 3.535 1.00 25.00 H new ATOM 0 HA ALA A 17 14.003 -4.864 1.889 1.00 25.00 H new ATOM 0 HB1 ALA A 17 14.653 -7.169 2.520 1.00 25.00 H new ATOM 0 HB2 ALA A 17 14.684 -6.068 3.917 1.00 25.00 H new ATOM 0 HB3 ALA A 17 13.332 -7.207 3.712 1.00 25.00 H new ATOM 242 N ILE A 18 13.017 -6.358 0.101 1.00 25.00 N ATOM 243 CA ILE A 18 12.327 -7.024 -1.015 1.00 25.00 C ATOM 244 C ILE A 18 12.906 -8.433 -1.249 1.00 25.00 C ATOM 245 O ILE A 18 14.125 -8.616 -1.335 1.00 25.00 O ATOM 246 CB ILE A 18 12.387 -6.166 -2.325 1.00 25.00 C ATOM 247 CG1 ILE A 18 11.476 -4.930 -2.176 1.00 25.00 C ATOM 248 CG2 ILE A 18 11.988 -6.988 -3.560 1.00 25.00 C ATOM 249 CD1 ILE A 18 11.425 -4.003 -3.380 1.00 25.00 C ATOM 0 H ILE A 18 13.961 -6.042 -0.120 1.00 25.00 H new ATOM 0 HA ILE A 18 11.277 -7.126 -0.742 1.00 25.00 H new ATOM 0 HB ILE A 18 13.416 -5.840 -2.474 1.00 25.00 H new ATOM 0 HG12 ILE A 18 10.464 -5.271 -1.959 1.00 25.00 H new ATOM 0 HG13 ILE A 18 11.811 -4.356 -1.312 1.00 25.00 H new ATOM 0 HG21 ILE A 18 12.042 -6.359 -4.449 1.00 25.00 H new ATOM 0 HG22 ILE A 18 12.669 -7.832 -3.671 1.00 25.00 H new ATOM 0 HG23 ILE A 18 10.970 -7.357 -3.438 1.00 25.00 H new ATOM 0 HD11 ILE A 18 10.757 -3.168 -3.169 1.00 25.00 H new ATOM 0 HD12 ILE A 18 12.425 -3.623 -3.589 1.00 25.00 H new ATOM 0 HD13 ILE A 18 11.057 -4.552 -4.247 1.00 25.00 H new ATOM 261 N ASN A 19 11.996 -9.406 -1.346 1.00 25.00 N ATOM 262 CA ASN A 19 12.330 -10.805 -1.616 1.00 25.00 C ATOM 263 C ASN A 19 12.140 -11.143 -3.105 1.00 25.00 C ATOM 264 O ASN A 19 11.010 -11.219 -3.597 1.00 25.00 O ATOM 265 CB ASN A 19 11.436 -11.712 -0.749 1.00 25.00 C ATOM 266 CG ASN A 19 11.605 -11.496 0.753 1.00 25.00 C ATOM 267 OD1 ASN A 19 10.583 -11.830 1.540 1.00 25.00 O flip ATOM 268 ND2 ASN A 19 12.661 -11.055 1.205 1.00 25.00 N flip ATOM 0 H ASN A 19 10.995 -9.241 -1.238 1.00 25.00 H new ATOM 0 HA ASN A 19 13.378 -10.971 -1.368 1.00 25.00 H new ATOM 0 HB2 ASN A 19 10.393 -11.539 -1.016 1.00 25.00 H new ATOM 0 HB3 ASN A 19 11.657 -12.753 -0.983 1.00 25.00 H new ATOM 0 HD21 ASN A 19 13.423 -10.809 0.573 1.00 25.00 H new ATOM 0 HD22 ASN A 19 12.774 -10.935 2.212 1.00 25.00 H new ATOM 275 N GLU A 20 13.263 -11.324 -3.813 1.00 25.00 N ATOM 276 CA GLU A 20 13.259 -11.779 -5.210 1.00 25.00 C ATOM 277 C GLU A 20 14.072 -13.075 -5.324 1.00 25.00 C ATOM 278 O GLU A 20 14.769 -13.451 -4.375 1.00 25.00 O ATOM 279 CB GLU A 20 13.824 -10.705 -6.165 1.00 25.00 C ATOM 280 CG GLU A 20 13.044 -9.395 -6.215 1.00 25.00 C ATOM 281 CD GLU A 20 13.103 -8.741 -7.581 1.00 25.00 C ATOM 282 OE1 GLU A 20 12.776 -9.420 -8.577 1.00 25.00 O ATOM 283 OE2 GLU A 20 13.479 -7.556 -7.657 1.00 25.00 O ATOM 0 H GLU A 20 14.196 -11.160 -3.435 1.00 25.00 H new ATOM 0 HA GLU A 20 12.226 -11.963 -5.507 1.00 25.00 H new ATOM 0 HB2 GLU A 20 14.850 -10.486 -5.870 1.00 25.00 H new ATOM 0 HB3 GLU A 20 13.863 -11.123 -7.171 1.00 25.00 H new ATOM 0 HG2 GLU A 20 12.004 -9.584 -5.950 1.00 25.00 H new ATOM 0 HG3 GLU A 20 13.443 -8.708 -5.469 1.00 25.00 H new ATOM 290 N ASP A 21 13.975 -13.765 -6.489 1.00 25.00 N ATOM 291 CA ASP A 21 14.573 -15.117 -6.704 1.00 25.00 C ATOM 292 C ASP A 21 13.820 -16.204 -5.916 1.00 25.00 C ATOM 293 O ASP A 21 14.194 -17.382 -5.917 1.00 25.00 O ATOM 294 CB ASP A 21 16.064 -15.152 -6.356 1.00 25.00 C ATOM 295 CG ASP A 21 16.915 -14.351 -7.323 1.00 25.00 C ATOM 296 OD1 ASP A 21 16.700 -14.476 -8.547 1.00 25.00 O ATOM 297 OD2 ASP A 21 17.796 -13.599 -6.857 1.00 25.00 O ATOM 0 H ASP A 21 13.482 -13.405 -7.306 1.00 25.00 H new ATOM 0 HA ASP A 21 14.472 -15.329 -7.768 1.00 25.00 H new ATOM 0 HB2 ASP A 21 16.206 -14.763 -5.348 1.00 25.00 H new ATOM 0 HB3 ASP A 21 16.406 -16.187 -6.350 1.00 25.00 H new ATOM 302 N VAL A 22 12.750 -15.765 -5.268 1.00 25.00 N ATOM 303 CA VAL A 22 11.832 -16.616 -4.509 1.00 25.00 C ATOM 304 C VAL A 22 10.558 -16.886 -5.331 1.00 25.00 C ATOM 305 O VAL A 22 10.490 -16.522 -6.510 1.00 25.00 O ATOM 306 CB VAL A 22 11.463 -15.978 -3.122 1.00 25.00 C ATOM 307 CG1 VAL A 22 12.695 -15.893 -2.231 1.00 25.00 C ATOM 308 CG2 VAL A 22 10.814 -14.585 -3.255 1.00 25.00 C ATOM 0 H VAL A 22 12.485 -14.780 -5.253 1.00 25.00 H new ATOM 0 HA VAL A 22 12.338 -17.561 -4.312 1.00 25.00 H new ATOM 0 HB VAL A 22 10.722 -16.635 -2.665 1.00 25.00 H new ATOM 0 HG11 VAL A 22 12.422 -15.449 -1.274 1.00 25.00 H new ATOM 0 HG12 VAL A 22 13.094 -16.894 -2.066 1.00 25.00 H new ATOM 0 HG13 VAL A 22 13.452 -15.276 -2.715 1.00 25.00 H new ATOM 0 HG21 VAL A 22 10.582 -14.196 -2.264 1.00 25.00 H new ATOM 0 HG22 VAL A 22 11.505 -13.908 -3.758 1.00 25.00 H new ATOM 0 HG23 VAL A 22 9.896 -14.665 -3.838 1.00 25.00 H new ATOM 318 N SER A 23 9.560 -17.531 -4.706 1.00 25.00 N ATOM 319 CA SER A 23 8.236 -17.683 -5.325 1.00 25.00 C ATOM 320 C SER A 23 7.581 -16.293 -5.228 1.00 25.00 C ATOM 321 O SER A 23 8.016 -15.514 -4.374 1.00 25.00 O ATOM 322 CB SER A 23 7.436 -18.751 -4.570 1.00 25.00 C ATOM 323 OG SER A 23 7.062 -18.311 -3.276 1.00 25.00 O ATOM 0 H SER A 23 9.644 -17.952 -3.781 1.00 25.00 H new ATOM 0 HA SER A 23 8.285 -18.012 -6.363 1.00 25.00 H new ATOM 0 HB2 SER A 23 6.542 -19.006 -5.140 1.00 25.00 H new ATOM 0 HB3 SER A 23 8.031 -19.660 -4.487 1.00 25.00 H new ATOM 0 HG SER A 23 6.553 -19.016 -2.825 1.00 25.00 H new ATOM 329 N PRO A 24 6.519 -15.926 -6.017 1.00 25.00 N ATOM 330 CA PRO A 24 6.442 -14.565 -6.604 1.00 25.00 C ATOM 331 C PRO A 24 6.883 -13.453 -5.650 1.00 25.00 C ATOM 332 O PRO A 24 6.444 -13.378 -4.498 1.00 25.00 O ATOM 333 CB PRO A 24 4.953 -14.424 -6.914 1.00 25.00 C ATOM 334 CG PRO A 24 4.499 -15.810 -7.206 1.00 25.00 C ATOM 335 CD PRO A 24 5.304 -16.718 -6.333 1.00 25.00 C ATOM 0 HA PRO A 24 7.108 -14.462 -7.461 1.00 25.00 H new ATOM 0 HB2 PRO A 24 4.411 -13.999 -6.070 1.00 25.00 H new ATOM 0 HB3 PRO A 24 4.786 -13.764 -7.765 1.00 25.00 H new ATOM 0 HG2 PRO A 24 3.434 -15.920 -7.001 1.00 25.00 H new ATOM 0 HG3 PRO A 24 4.648 -16.052 -8.258 1.00 25.00 H new ATOM 0 HD2 PRO A 24 4.759 -16.990 -5.429 1.00 25.00 H new ATOM 0 HD3 PRO A 24 5.555 -17.646 -6.846 1.00 25.00 H new ATOM 343 N ALA A 25 7.780 -12.597 -6.184 1.00 25.00 N ATOM 344 CA ALA A 25 8.549 -11.621 -5.401 1.00 25.00 C ATOM 345 C ALA A 25 7.695 -10.799 -4.468 1.00 25.00 C ATOM 346 O ALA A 25 6.577 -10.398 -4.801 1.00 25.00 O ATOM 347 CB ALA A 25 9.359 -10.718 -6.317 1.00 25.00 C ATOM 0 H ALA A 25 7.989 -12.568 -7.182 1.00 25.00 H new ATOM 0 HA ALA A 25 9.226 -12.198 -4.772 1.00 25.00 H new ATOM 0 HB1 ALA A 25 9.922 -10.002 -5.718 1.00 25.00 H new ATOM 0 HB2 ALA A 25 10.050 -11.322 -6.905 1.00 25.00 H new ATOM 0 HB3 ALA A 25 8.687 -10.182 -6.987 1.00 25.00 H new ATOM 353 N GLU A 26 8.256 -10.576 -3.289 1.00 25.00 N ATOM 354 CA GLU A 26 7.524 -10.021 -2.175 1.00 25.00 C ATOM 355 C GLU A 26 8.201 -8.750 -1.644 1.00 25.00 C ATOM 356 O GLU A 26 9.276 -8.368 -2.100 1.00 25.00 O ATOM 357 CB GLU A 26 7.378 -11.070 -1.048 1.00 25.00 C ATOM 358 CG GLU A 26 7.397 -12.539 -1.489 1.00 25.00 C ATOM 359 CD GLU A 26 7.375 -13.504 -0.320 1.00 25.00 C ATOM 360 OE1 GLU A 26 8.252 -13.388 0.564 1.00 25.00 O ATOM 361 OE2 GLU A 26 6.482 -14.376 -0.286 1.00 25.00 O ATOM 0 H GLU A 26 9.235 -10.777 -3.084 1.00 25.00 H new ATOM 0 HA GLU A 26 6.530 -9.748 -2.528 1.00 25.00 H new ATOM 0 HB2 GLU A 26 8.183 -10.917 -0.330 1.00 25.00 H new ATOM 0 HB3 GLU A 26 6.442 -10.881 -0.522 1.00 25.00 H new ATOM 0 HG2 GLU A 26 6.537 -12.732 -2.130 1.00 25.00 H new ATOM 0 HG3 GLU A 26 8.289 -12.722 -2.089 1.00 25.00 H new ATOM 368 N LEU A 27 7.500 -8.067 -0.740 1.00 25.00 N ATOM 369 CA LEU A 27 8.011 -6.897 -0.034 1.00 25.00 C ATOM 370 C LEU A 27 7.815 -7.126 1.467 1.00 25.00 C ATOM 371 O LEU A 27 6.686 -7.115 1.966 1.00 25.00 O ATOM 372 CB LEU A 27 7.288 -5.630 -0.571 1.00 25.00 C ATOM 373 CG LEU A 27 7.581 -4.231 0.043 1.00 25.00 C ATOM 374 CD1 LEU A 27 8.982 -3.726 -0.258 1.00 25.00 C ATOM 375 CD2 LEU A 27 6.552 -3.189 -0.364 1.00 25.00 C ATOM 0 H LEU A 27 6.547 -8.316 -0.475 1.00 25.00 H new ATOM 0 HA LEU A 27 9.076 -6.743 -0.205 1.00 25.00 H new ATOM 0 HB2 LEU A 27 7.504 -5.564 -1.637 1.00 25.00 H new ATOM 0 HB3 LEU A 27 6.217 -5.806 -0.473 1.00 25.00 H new ATOM 0 HG LEU A 27 7.510 -4.380 1.120 1.00 25.00 H new ATOM 0 HD11 LEU A 27 9.121 -2.746 0.199 1.00 25.00 H new ATOM 0 HD12 LEU A 27 9.715 -4.423 0.148 1.00 25.00 H new ATOM 0 HD13 LEU A 27 9.116 -3.646 -1.337 1.00 25.00 H new ATOM 0 HD21 LEU A 27 6.804 -2.231 0.092 1.00 25.00 H new ATOM 0 HD22 LEU A 27 6.549 -3.085 -1.449 1.00 25.00 H new ATOM 0 HD23 LEU A 27 5.564 -3.502 -0.027 1.00 25.00 H new ATOM 387 N THR A 28 8.924 -7.346 2.170 1.00 25.00 N ATOM 388 CA THR A 28 8.881 -7.755 3.570 1.00 25.00 C ATOM 389 C THR A 28 9.335 -6.624 4.492 1.00 25.00 C ATOM 390 O THR A 28 10.508 -6.236 4.489 1.00 25.00 O ATOM 391 CB THR A 28 9.756 -9.018 3.809 1.00 25.00 C ATOM 392 OG1 THR A 28 9.213 -10.130 3.087 1.00 25.00 O ATOM 393 CG2 THR A 28 9.831 -9.391 5.291 1.00 25.00 C ATOM 0 H THR A 28 9.866 -7.247 1.791 1.00 25.00 H new ATOM 0 HA THR A 28 7.845 -7.998 3.806 1.00 25.00 H new ATOM 0 HB THR A 28 10.761 -8.784 3.459 1.00 25.00 H new ATOM 0 HG1 THR A 28 9.941 -10.720 2.800 1.00 25.00 H new ATOM 0 HG21 THR A 28 10.452 -10.279 5.412 1.00 25.00 H new ATOM 0 HG22 THR A 28 10.266 -8.564 5.853 1.00 25.00 H new ATOM 0 HG23 THR A 28 8.828 -9.596 5.666 1.00 25.00 H new ATOM 401 N TRP A 29 8.385 -6.099 5.272 1.00 25.00 N ATOM 402 CA TRP A 29 8.698 -5.167 6.349 1.00 25.00 C ATOM 403 C TRP A 29 9.032 -5.947 7.618 1.00 25.00 C ATOM 404 O TRP A 29 8.357 -6.922 7.958 1.00 25.00 O ATOM 405 CB TRP A 29 7.526 -4.190 6.616 1.00 25.00 C ATOM 406 CG TRP A 29 7.784 -3.223 7.757 1.00 25.00 C ATOM 407 CD1 TRP A 29 8.385 -2.000 7.673 1.00 25.00 C ATOM 408 CD2 TRP A 29 7.471 -3.418 9.153 1.00 25.00 C ATOM 409 NE1 TRP A 29 8.473 -1.426 8.921 1.00 25.00 N ATOM 410 CE2 TRP A 29 7.918 -2.275 9.843 1.00 25.00 C ATOM 411 CE3 TRP A 29 6.859 -4.446 9.884 1.00 25.00 C ATOM 412 CZ2 TRP A 29 7.776 -2.136 11.226 1.00 25.00 C ATOM 413 CZ3 TRP A 29 6.719 -4.299 11.253 1.00 25.00 C ATOM 414 CH2 TRP A 29 7.177 -3.153 11.908 1.00 25.00 C ATOM 0 H TRP A 29 7.391 -6.307 5.174 1.00 25.00 H new ATOM 0 HA TRP A 29 9.560 -4.572 6.045 1.00 25.00 H new ATOM 0 HB2 TRP A 29 7.325 -3.621 5.708 1.00 25.00 H new ATOM 0 HB3 TRP A 29 6.627 -4.766 6.836 1.00 25.00 H new ATOM 0 HD1 TRP A 29 8.740 -1.548 6.759 1.00 25.00 H new ATOM 0 HE1 TRP A 29 8.885 -0.516 9.127 1.00 25.00 H new ATOM 0 HE3 TRP A 29 6.503 -5.337 9.388 1.00 25.00 H new ATOM 0 HZ2 TRP A 29 8.129 -1.253 11.737 1.00 25.00 H new ATOM 0 HZ3 TRP A 29 6.247 -5.084 11.825 1.00 25.00 H new ATOM 0 HH2 TRP A 29 7.054 -3.071 12.978 1.00 25.00 H new ATOM 425 N ARG A 30 10.081 -5.505 8.297 1.00 25.00 N ATOM 426 CA ARG A 30 10.426 -6.029 9.610 1.00 25.00 C ATOM 427 C ARG A 30 10.599 -4.883 10.589 1.00 25.00 C ATOM 428 O ARG A 30 10.962 -3.774 10.198 1.00 25.00 O ATOM 429 CB ARG A 30 11.710 -6.859 9.558 1.00 25.00 C ATOM 430 CG ARG A 30 11.592 -8.141 8.755 1.00 25.00 C ATOM 431 CD ARG A 30 12.869 -8.947 8.807 1.00 25.00 C ATOM 432 NE ARG A 30 12.980 -9.727 10.044 1.00 25.00 N ATOM 433 CZ ARG A 30 14.124 -9.956 10.707 1.00 25.00 C ATOM 434 NH1 ARG A 30 15.285 -9.470 10.270 1.00 25.00 N ATOM 435 NH2 ARG A 30 14.103 -10.678 11.819 1.00 25.00 N ATOM 0 H ARG A 30 10.712 -4.779 7.957 1.00 25.00 H new ATOM 0 HA ARG A 30 9.615 -6.678 9.940 1.00 25.00 H new ATOM 0 HB2 ARG A 30 12.506 -6.249 9.132 1.00 25.00 H new ATOM 0 HB3 ARG A 30 12.010 -7.108 10.576 1.00 25.00 H new ATOM 0 HG2 ARG A 30 10.767 -8.739 9.142 1.00 25.00 H new ATOM 0 HG3 ARG A 30 11.354 -7.902 7.719 1.00 25.00 H new ATOM 0 HD2 ARG A 30 12.908 -9.620 7.950 1.00 25.00 H new ATOM 0 HD3 ARG A 30 13.724 -8.276 8.724 1.00 25.00 H new ATOM 0 HE ARG A 30 12.124 -10.125 10.429 1.00 25.00 H new ATOM 0 HH11 ARG A 30 15.316 -8.912 9.417 1.00 25.00 H new ATOM 0 HH12 ARG A 30 16.143 -9.656 10.789 1.00 25.00 H new ATOM 0 HH21 ARG A 30 13.221 -11.055 12.165 1.00 25.00 H new ATOM 0 HH22 ARG A 30 14.969 -10.856 12.328 1.00 25.00 H new ATOM 449 N SER A 31 10.326 -5.161 11.865 1.00 25.00 N ATOM 450 CA SER A 31 10.587 -4.212 12.946 1.00 25.00 C ATOM 451 C SER A 31 12.105 -4.073 13.148 1.00 25.00 C ATOM 452 O SER A 31 12.871 -4.942 12.728 1.00 25.00 O ATOM 453 CB SER A 31 9.872 -4.691 14.219 1.00 25.00 C ATOM 454 OG SER A 31 10.431 -5.884 14.736 1.00 25.00 O ATOM 0 H SER A 31 9.921 -6.044 12.176 1.00 25.00 H new ATOM 0 HA SER A 31 10.198 -3.225 12.696 1.00 25.00 H new ATOM 0 HB2 SER A 31 9.925 -3.910 14.978 1.00 25.00 H new ATOM 0 HB3 SER A 31 8.816 -4.853 14.000 1.00 25.00 H new ATOM 0 HG SER A 31 10.573 -5.788 15.701 1.00 25.00 H new ATOM 460 N THR A 32 12.524 -2.953 13.770 1.00 25.00 N ATOM 461 CA THR A 32 13.956 -2.591 13.906 1.00 25.00 C ATOM 462 C THR A 32 14.812 -3.702 14.542 1.00 25.00 C ATOM 463 O THR A 32 16.039 -3.693 14.399 1.00 25.00 O ATOM 464 CB THR A 32 14.148 -1.282 14.711 1.00 25.00 C ATOM 465 OG1 THR A 32 13.372 -1.320 15.916 1.00 25.00 O ATOM 466 CG2 THR A 32 13.761 -0.057 13.885 1.00 25.00 C ATOM 0 H THR A 32 11.888 -2.276 14.191 1.00 25.00 H new ATOM 0 HA THR A 32 14.303 -2.445 12.883 1.00 25.00 H new ATOM 0 HB THR A 32 15.205 -1.202 14.964 1.00 25.00 H new ATOM 0 HG1 THR A 32 13.504 -0.488 16.416 1.00 25.00 H new ATOM 0 HG21 THR A 32 13.908 0.844 14.480 1.00 25.00 H new ATOM 0 HG22 THR A 32 14.385 -0.008 12.992 1.00 25.00 H new ATOM 0 HG23 THR A 32 12.714 -0.132 13.592 1.00 25.00 H new ATOM 474 N ASP A 33 14.159 -4.632 15.254 1.00 25.00 N ATOM 475 CA ASP A 33 14.818 -5.838 15.767 1.00 25.00 C ATOM 476 C ASP A 33 14.492 -7.050 14.872 1.00 25.00 C ATOM 477 O ASP A 33 15.307 -7.967 14.731 1.00 25.00 O ATOM 478 CB ASP A 33 14.388 -6.099 17.221 1.00 25.00 C ATOM 479 CG ASP A 33 14.688 -4.934 18.153 1.00 25.00 C ATOM 480 OD1 ASP A 33 15.872 -4.552 18.266 1.00 25.00 O ATOM 481 OD2 ASP A 33 13.737 -4.405 18.766 1.00 25.00 O ATOM 0 H ASP A 33 13.168 -4.569 15.488 1.00 25.00 H new ATOM 0 HA ASP A 33 15.897 -5.684 15.750 1.00 25.00 H new ATOM 0 HB2 ASP A 33 13.319 -6.309 17.245 1.00 25.00 H new ATOM 0 HB3 ASP A 33 14.896 -6.990 17.589 1.00 25.00 H new ATOM 486 N GLY A 34 13.288 -7.028 14.279 1.00 25.00 N ATOM 487 CA GLY A 34 12.829 -8.092 13.384 1.00 25.00 C ATOM 488 C GLY A 34 11.951 -9.116 14.082 1.00 25.00 C ATOM 489 O GLY A 34 11.749 -10.218 13.564 1.00 25.00 O ATOM 0 H GLY A 34 12.612 -6.275 14.408 1.00 25.00 H new ATOM 0 HA2 GLY A 34 12.274 -7.649 12.557 1.00 25.00 H new ATOM 0 HA3 GLY A 34 13.694 -8.596 12.954 1.00 25.00 H new ATOM 493 N ASP A 35 11.427 -8.746 15.263 1.00 25.00 N ATOM 494 CA ASP A 35 10.466 -9.579 15.998 1.00 25.00 C ATOM 495 C ASP A 35 9.078 -9.484 15.346 1.00 25.00 C ATOM 496 O ASP A 35 8.279 -10.423 15.422 1.00 25.00 O ATOM 497 CB ASP A 35 10.410 -9.138 17.472 1.00 25.00 C ATOM 498 CG ASP A 35 9.908 -7.713 17.655 1.00 25.00 C ATOM 499 OD1 ASP A 35 10.482 -6.796 17.033 1.00 25.00 O ATOM 500 OD2 ASP A 35 8.940 -7.520 18.420 1.00 25.00 O ATOM 0 H ASP A 35 11.656 -7.869 15.730 1.00 25.00 H new ATOM 0 HA ASP A 35 10.790 -10.619 15.961 1.00 25.00 H new ATOM 0 HB2 ASP A 35 9.761 -9.818 18.023 1.00 25.00 H new ATOM 0 HB3 ASP A 35 11.405 -9.224 17.908 1.00 25.00 H new ATOM 505 N LYS A 36 8.814 -8.335 14.708 1.00 25.00 N ATOM 506 CA LYS A 36 7.599 -8.127 13.923 1.00 25.00 C ATOM 507 C LYS A 36 7.944 -8.161 12.435 1.00 25.00 C ATOM 508 O LYS A 36 8.959 -7.593 12.019 1.00 25.00 O ATOM 509 CB LYS A 36 6.961 -6.781 14.273 1.00 25.00 C ATOM 510 CG LYS A 36 6.501 -6.675 15.708 1.00 25.00 C ATOM 511 CD LYS A 36 5.890 -5.318 15.959 1.00 25.00 C ATOM 512 CE LYS A 36 5.647 -5.082 17.438 1.00 25.00 C ATOM 513 NZ LYS A 36 6.921 -4.903 18.191 1.00 25.00 N ATOM 0 H LYS A 36 9.438 -7.528 14.724 1.00 25.00 H new ATOM 0 HA LYS A 36 6.888 -8.921 14.154 1.00 25.00 H new ATOM 0 HB2 LYS A 36 7.680 -5.987 14.073 1.00 25.00 H new ATOM 0 HB3 LYS A 36 6.108 -6.612 13.615 1.00 25.00 H new ATOM 0 HG2 LYS A 36 5.772 -7.456 15.923 1.00 25.00 H new ATOM 0 HG3 LYS A 36 7.344 -6.833 16.381 1.00 25.00 H new ATOM 0 HD2 LYS A 36 6.550 -4.543 15.570 1.00 25.00 H new ATOM 0 HD3 LYS A 36 4.948 -5.236 15.417 1.00 25.00 H new ATOM 0 HE2 LYS A 36 5.023 -4.198 17.566 1.00 25.00 H new ATOM 0 HE3 LYS A 36 5.095 -5.925 17.854 1.00 25.00 H new ATOM 0 HZ1 LYS A 36 6.717 -4.498 19.127 1.00 25.00 H new ATOM 0 HZ2 LYS A 36 7.388 -5.825 18.307 1.00 25.00 H new ATOM 0 HZ3 LYS A 36 7.548 -4.261 17.665 1.00 25.00 H new ATOM 527 N VAL A 37 7.104 -8.830 11.637 1.00 25.00 N ATOM 528 CA VAL A 37 7.368 -8.972 10.201 1.00 25.00 C ATOM 529 C VAL A 37 6.056 -9.051 9.382 1.00 25.00 C ATOM 530 O VAL A 37 5.122 -9.770 9.751 1.00 25.00 O ATOM 531 CB VAL A 37 8.314 -10.198 9.927 1.00 25.00 C ATOM 532 CG1 VAL A 37 7.793 -11.505 10.533 1.00 25.00 C ATOM 533 CG2 VAL A 37 8.596 -10.363 8.435 1.00 25.00 C ATOM 0 H VAL A 37 6.245 -9.277 11.957 1.00 25.00 H new ATOM 0 HA VAL A 37 7.888 -8.075 9.864 1.00 25.00 H new ATOM 0 HB VAL A 37 9.253 -9.973 10.432 1.00 25.00 H new ATOM 0 HG11 VAL A 37 8.490 -12.313 10.309 1.00 25.00 H new ATOM 0 HG12 VAL A 37 7.701 -11.394 11.613 1.00 25.00 H new ATOM 0 HG13 VAL A 37 6.817 -11.739 10.108 1.00 25.00 H new ATOM 0 HG21 VAL A 37 9.253 -11.219 8.281 1.00 25.00 H new ATOM 0 HG22 VAL A 37 7.658 -10.525 7.903 1.00 25.00 H new ATOM 0 HG23 VAL A 37 9.078 -9.463 8.054 1.00 25.00 H new ATOM 543 N HIS A 38 6.014 -8.290 8.277 1.00 25.00 N ATOM 544 CA HIS A 38 4.874 -8.285 7.348 1.00 25.00 C ATOM 545 C HIS A 38 5.377 -8.495 5.911 1.00 25.00 C ATOM 546 O HIS A 38 6.472 -8.042 5.567 1.00 25.00 O ATOM 547 CB HIS A 38 4.100 -6.956 7.466 1.00 25.00 C ATOM 548 CG HIS A 38 3.382 -6.767 8.775 1.00 25.00 C ATOM 549 ND1 HIS A 38 3.646 -5.947 9.821 1.00 25.00 N flip ATOM 550 CD2 HIS A 38 2.255 -7.479 9.123 1.00 25.00 C flip ATOM 551 CE1 HIS A 38 2.680 -6.178 10.771 1.00 25.00 C flip ATOM 552 NE2 HIS A 38 1.854 -7.105 10.326 1.00 25.00 N flip ATOM 0 H HIS A 38 6.769 -7.661 8.003 1.00 25.00 H new ATOM 0 HA HIS A 38 4.196 -9.099 7.604 1.00 25.00 H new ATOM 0 HB2 HIS A 38 4.797 -6.130 7.326 1.00 25.00 H new ATOM 0 HB3 HIS A 38 3.373 -6.900 6.656 1.00 25.00 H new ATOM 0 HD1 HIS A 38 4.417 -5.283 9.890 1.00 25.00 H new ATOM 0 HD2 HIS A 38 1.774 -8.226 8.509 1.00 25.00 H new ATOM 0 HE1 HIS A 38 2.609 -5.681 11.727 1.00 25.00 H new ATOM 561 N THR A 39 4.579 -9.184 5.081 1.00 25.00 N ATOM 562 CA THR A 39 5.000 -9.532 3.715 1.00 25.00 C ATOM 563 C THR A 39 3.944 -9.133 2.666 1.00 25.00 C ATOM 564 O THR A 39 2.760 -9.451 2.804 1.00 25.00 O ATOM 565 CB THR A 39 5.323 -11.050 3.613 1.00 25.00 C ATOM 566 OG1 THR A 39 6.436 -11.364 4.461 1.00 25.00 O ATOM 567 CG2 THR A 39 5.664 -11.475 2.186 1.00 25.00 C ATOM 0 H THR A 39 3.645 -9.509 5.329 1.00 25.00 H new ATOM 0 HA THR A 39 5.904 -8.963 3.499 1.00 25.00 H new ATOM 0 HB THR A 39 4.430 -11.590 3.926 1.00 25.00 H new ATOM 0 HG1 THR A 39 7.261 -11.021 4.058 1.00 25.00 H new ATOM 0 HG21 THR A 39 5.882 -12.543 2.167 1.00 25.00 H new ATOM 0 HG22 THR A 39 4.818 -11.265 1.532 1.00 25.00 H new ATOM 0 HG23 THR A 39 6.536 -10.920 1.840 1.00 25.00 H new ATOM 575 N VAL A 40 4.411 -8.428 1.622 1.00 25.00 N ATOM 576 CA VAL A 40 3.584 -8.028 0.478 1.00 25.00 C ATOM 577 C VAL A 40 4.065 -8.753 -0.800 1.00 25.00 C ATOM 578 O VAL A 40 5.109 -8.410 -1.349 1.00 25.00 O ATOM 579 CB VAL A 40 3.669 -6.470 0.297 1.00 25.00 C ATOM 580 CG1 VAL A 40 2.865 -5.931 -0.891 1.00 25.00 C ATOM 581 CG2 VAL A 40 3.238 -5.752 1.562 1.00 25.00 C ATOM 0 H VAL A 40 5.380 -8.119 1.551 1.00 25.00 H new ATOM 0 HA VAL A 40 2.546 -8.308 0.659 1.00 25.00 H new ATOM 0 HB VAL A 40 4.719 -6.267 0.086 1.00 25.00 H new ATOM 0 HG11 VAL A 40 2.977 -4.848 -0.945 1.00 25.00 H new ATOM 0 HG12 VAL A 40 3.233 -6.380 -1.813 1.00 25.00 H new ATOM 0 HG13 VAL A 40 1.812 -6.181 -0.761 1.00 25.00 H new ATOM 0 HG21 VAL A 40 3.306 -4.675 1.410 1.00 25.00 H new ATOM 0 HG22 VAL A 40 2.209 -6.021 1.800 1.00 25.00 H new ATOM 0 HG23 VAL A 40 3.889 -6.044 2.386 1.00 25.00 H new ATOM 591 N VAL A 41 3.285 -9.732 -1.283 1.00 25.00 N ATOM 592 CA VAL A 41 3.593 -10.416 -2.546 1.00 25.00 C ATOM 593 C VAL A 41 3.090 -9.543 -3.709 1.00 25.00 C ATOM 594 O VAL A 41 1.903 -9.218 -3.771 1.00 25.00 O ATOM 595 CB VAL A 41 2.943 -11.839 -2.611 1.00 25.00 C ATOM 596 CG1 VAL A 41 3.286 -12.563 -3.916 1.00 25.00 C ATOM 597 CG2 VAL A 41 3.394 -12.687 -1.427 1.00 25.00 C ATOM 0 H VAL A 41 2.440 -10.066 -0.820 1.00 25.00 H new ATOM 0 HA VAL A 41 4.672 -10.557 -2.617 1.00 25.00 H new ATOM 0 HB VAL A 41 1.863 -11.700 -2.572 1.00 25.00 H new ATOM 0 HG11 VAL A 41 2.816 -13.546 -3.921 1.00 25.00 H new ATOM 0 HG12 VAL A 41 2.920 -11.981 -4.762 1.00 25.00 H new ATOM 0 HG13 VAL A 41 4.367 -12.677 -3.995 1.00 25.00 H new ATOM 0 HG21 VAL A 41 2.932 -13.673 -1.489 1.00 25.00 H new ATOM 0 HG22 VAL A 41 4.479 -12.792 -1.447 1.00 25.00 H new ATOM 0 HG23 VAL A 41 3.094 -12.203 -0.498 1.00 25.00 H new ATOM 607 N LEU A 42 3.997 -9.163 -4.618 1.00 25.00 N ATOM 608 CA LEU A 42 3.667 -8.171 -5.660 1.00 25.00 C ATOM 609 C LEU A 42 2.824 -8.733 -6.809 1.00 25.00 C ATOM 610 O LEU A 42 2.177 -7.962 -7.527 1.00 25.00 O ATOM 611 CB LEU A 42 4.929 -7.497 -6.253 1.00 25.00 C ATOM 612 CG LEU A 42 5.644 -6.412 -5.406 1.00 25.00 C ATOM 613 CD1 LEU A 42 4.651 -5.493 -4.714 1.00 25.00 C ATOM 614 CD2 LEU A 42 6.587 -7.021 -4.388 1.00 25.00 C ATOM 0 H LEU A 42 4.952 -9.519 -4.657 1.00 25.00 H new ATOM 0 HA LEU A 42 3.067 -7.428 -5.135 1.00 25.00 H new ATOM 0 HB2 LEU A 42 5.654 -8.281 -6.472 1.00 25.00 H new ATOM 0 HB3 LEU A 42 4.650 -7.046 -7.205 1.00 25.00 H new ATOM 0 HG LEU A 42 6.234 -5.817 -6.103 1.00 25.00 H new ATOM 0 HD11 LEU A 42 5.191 -4.747 -4.131 1.00 25.00 H new ATOM 0 HD12 LEU A 42 4.036 -4.993 -5.462 1.00 25.00 H new ATOM 0 HD13 LEU A 42 4.013 -6.079 -4.052 1.00 25.00 H new ATOM 0 HD21 LEU A 42 7.067 -6.227 -3.816 1.00 25.00 H new ATOM 0 HD22 LEU A 42 6.026 -7.666 -3.712 1.00 25.00 H new ATOM 0 HD23 LEU A 42 7.348 -7.608 -4.902 1.00 25.00 H new ATOM 626 N SER A 43 2.822 -10.063 -6.989 1.00 25.00 N ATOM 627 CA SER A 43 1.953 -10.710 -7.993 1.00 25.00 C ATOM 628 C SER A 43 0.476 -10.624 -7.563 1.00 25.00 C ATOM 629 O SER A 43 -0.429 -11.039 -8.295 1.00 25.00 O ATOM 630 CB SER A 43 2.382 -12.171 -8.200 1.00 25.00 C ATOM 631 OG SER A 43 2.093 -12.971 -7.062 1.00 25.00 O ATOM 0 H SER A 43 3.406 -10.710 -6.459 1.00 25.00 H new ATOM 0 HA SER A 43 2.058 -10.184 -8.942 1.00 25.00 H new ATOM 0 HB2 SER A 43 1.871 -12.580 -9.071 1.00 25.00 H new ATOM 0 HB3 SER A 43 3.451 -12.210 -8.410 1.00 25.00 H new ATOM 0 HG SER A 43 2.227 -13.916 -7.284 1.00 25.00 H new ATOM 637 N THR A 44 0.268 -10.065 -6.361 1.00 25.00 N ATOM 638 CA THR A 44 -1.063 -9.841 -5.795 1.00 25.00 C ATOM 639 C THR A 44 -1.329 -8.327 -5.640 1.00 25.00 C ATOM 640 O THR A 44 -2.354 -7.917 -5.089 1.00 25.00 O ATOM 641 CB THR A 44 -1.219 -10.540 -4.411 1.00 25.00 C ATOM 642 OG1 THR A 44 -0.456 -9.859 -3.405 1.00 25.00 O ATOM 643 CG2 THR A 44 -0.765 -11.995 -4.464 1.00 25.00 C ATOM 0 H THR A 44 1.027 -9.755 -5.754 1.00 25.00 H new ATOM 0 HA THR A 44 -1.791 -10.273 -6.482 1.00 25.00 H new ATOM 0 HB THR A 44 -2.279 -10.505 -4.158 1.00 25.00 H new ATOM 0 HG1 THR A 44 0.500 -10.000 -3.568 1.00 25.00 H new ATOM 0 HG21 THR A 44 -0.888 -12.451 -3.481 1.00 25.00 H new ATOM 0 HG22 THR A 44 -1.366 -12.537 -5.193 1.00 25.00 H new ATOM 0 HG23 THR A 44 0.285 -12.038 -4.755 1.00 25.00 H new ATOM 651 N ILE A 45 -0.381 -7.519 -6.140 1.00 25.00 N ATOM 652 CA ILE A 45 -0.435 -6.053 -6.053 1.00 25.00 C ATOM 653 C ILE A 45 -0.618 -5.457 -7.458 1.00 25.00 C ATOM 654 O ILE A 45 0.017 -5.905 -8.415 1.00 25.00 O ATOM 655 CB ILE A 45 0.870 -5.497 -5.381 1.00 25.00 C ATOM 656 CG1 ILE A 45 1.071 -6.089 -3.951 1.00 25.00 C ATOM 657 CG2 ILE A 45 0.907 -3.959 -5.345 1.00 25.00 C ATOM 658 CD1 ILE A 45 -0.010 -5.758 -2.917 1.00 25.00 C ATOM 0 H ILE A 45 0.449 -7.868 -6.619 1.00 25.00 H new ATOM 0 HA ILE A 45 -1.285 -5.763 -5.435 1.00 25.00 H new ATOM 0 HB ILE A 45 1.701 -5.822 -6.007 1.00 25.00 H new ATOM 0 HG12 ILE A 45 1.140 -7.173 -4.037 1.00 25.00 H new ATOM 0 HG13 ILE A 45 2.029 -5.738 -3.568 1.00 25.00 H new ATOM 0 HG21 ILE A 45 1.831 -3.628 -4.870 1.00 25.00 H new ATOM 0 HG22 ILE A 45 0.863 -3.570 -6.362 1.00 25.00 H new ATOM 0 HG23 ILE A 45 0.054 -3.588 -4.777 1.00 25.00 H new ATOM 0 HD11 ILE A 45 0.242 -6.225 -1.965 1.00 25.00 H new ATOM 0 HD12 ILE A 45 -0.070 -4.678 -2.786 1.00 25.00 H new ATOM 0 HD13 ILE A 45 -0.972 -6.135 -3.263 1.00 25.00 H new ATOM 670 N ASP A 46 -1.486 -4.442 -7.555 1.00 25.00 N ATOM 671 CA ASP A 46 -1.811 -3.807 -8.836 1.00 25.00 C ATOM 672 C ASP A 46 -1.172 -2.411 -8.949 1.00 25.00 C ATOM 673 O ASP A 46 -0.632 -2.064 -10.003 1.00 25.00 O ATOM 674 CB ASP A 46 -3.342 -3.720 -8.998 1.00 25.00 C ATOM 675 CG ASP A 46 -3.779 -3.154 -10.342 1.00 25.00 C ATOM 676 OD1 ASP A 46 -3.461 -3.773 -11.379 1.00 25.00 O ATOM 677 OD2 ASP A 46 -4.440 -2.094 -10.354 1.00 25.00 O ATOM 0 H ASP A 46 -1.978 -4.042 -6.756 1.00 25.00 H new ATOM 0 HA ASP A 46 -1.400 -4.419 -9.639 1.00 25.00 H new ATOM 0 HB2 ASP A 46 -3.770 -4.715 -8.875 1.00 25.00 H new ATOM 0 HB3 ASP A 46 -3.749 -3.098 -8.201 1.00 25.00 H new ATOM 682 N LYS A 47 -1.240 -1.623 -7.864 1.00 25.00 N ATOM 683 CA LYS A 47 -0.745 -0.240 -7.876 1.00 25.00 C ATOM 684 C LYS A 47 0.121 0.091 -6.653 1.00 25.00 C ATOM 685 O LYS A 47 0.190 -0.685 -5.697 1.00 25.00 O ATOM 686 CB LYS A 47 -1.920 0.741 -7.947 1.00 25.00 C ATOM 687 CG LYS A 47 -2.723 0.680 -9.235 1.00 25.00 C ATOM 688 CD LYS A 47 -3.817 1.749 -9.286 1.00 25.00 C ATOM 689 CE LYS A 47 -4.654 1.667 -10.558 1.00 25.00 C ATOM 690 NZ LYS A 47 -5.521 0.457 -10.589 1.00 25.00 N ATOM 0 H LYS A 47 -1.632 -1.920 -6.971 1.00 25.00 H new ATOM 0 HA LYS A 47 -0.116 -0.140 -8.761 1.00 25.00 H new ATOM 0 HB2 LYS A 47 -2.589 0.546 -7.109 1.00 25.00 H new ATOM 0 HB3 LYS A 47 -1.538 1.754 -7.821 1.00 25.00 H new ATOM 0 HG2 LYS A 47 -2.053 0.808 -10.085 1.00 25.00 H new ATOM 0 HG3 LYS A 47 -3.177 -0.306 -9.332 1.00 25.00 H new ATOM 0 HD2 LYS A 47 -4.468 1.640 -8.419 1.00 25.00 H new ATOM 0 HD3 LYS A 47 -3.360 2.736 -9.219 1.00 25.00 H new ATOM 0 HE2 LYS A 47 -5.276 2.559 -10.639 1.00 25.00 H new ATOM 0 HE3 LYS A 47 -3.993 1.660 -11.425 1.00 25.00 H new ATOM 0 HZ1 LYS A 47 -6.167 0.513 -11.402 1.00 25.00 H new ATOM 0 HZ2 LYS A 47 -4.928 -0.393 -10.676 1.00 25.00 H new ATOM 0 HZ3 LYS A 47 -6.075 0.404 -9.710 1.00 25.00 H new ATOM 704 N LEU A 48 0.793 1.265 -6.713 1.00 25.00 N ATOM 705 CA LEU A 48 1.669 1.762 -5.626 1.00 25.00 C ATOM 706 C LEU A 48 1.673 3.296 -5.651 1.00 25.00 C ATOM 707 O LEU A 48 1.820 3.893 -6.724 1.00 25.00 O ATOM 708 CB LEU A 48 3.126 1.258 -5.776 1.00 25.00 C ATOM 709 CG LEU A 48 3.440 0.493 -7.058 1.00 25.00 C ATOM 710 CD1 LEU A 48 3.392 1.408 -8.272 1.00 25.00 C ATOM 711 CD2 LEU A 48 4.792 -0.152 -6.948 1.00 25.00 C ATOM 0 H LEU A 48 0.743 1.893 -7.515 1.00 25.00 H new ATOM 0 HA LEU A 48 1.276 1.384 -4.682 1.00 25.00 H new ATOM 0 HB2 LEU A 48 3.795 2.117 -5.716 1.00 25.00 H new ATOM 0 HB3 LEU A 48 3.356 0.615 -4.927 1.00 25.00 H new ATOM 0 HG LEU A 48 2.681 -0.278 -7.190 1.00 25.00 H new ATOM 0 HD11 LEU A 48 3.620 0.834 -9.170 1.00 25.00 H new ATOM 0 HD12 LEU A 48 2.396 1.841 -8.362 1.00 25.00 H new ATOM 0 HD13 LEU A 48 4.126 2.206 -8.156 1.00 25.00 H new ATOM 0 HD21 LEU A 48 5.011 -0.697 -7.866 1.00 25.00 H new ATOM 0 HD22 LEU A 48 5.550 0.616 -6.792 1.00 25.00 H new ATOM 0 HD23 LEU A 48 4.798 -0.844 -6.106 1.00 25.00 H new ATOM 723 N GLN A 49 1.510 3.939 -4.482 1.00 25.00 N ATOM 724 CA GLN A 49 1.439 5.414 -4.412 1.00 25.00 C ATOM 725 C GLN A 49 2.307 5.947 -3.265 1.00 25.00 C ATOM 726 O GLN A 49 2.145 5.530 -2.121 1.00 25.00 O ATOM 727 CB GLN A 49 -0.032 5.889 -4.246 1.00 25.00 C ATOM 728 CG GLN A 49 -0.944 5.546 -5.436 1.00 25.00 C ATOM 729 CD GLN A 49 -2.401 5.980 -5.284 1.00 25.00 C ATOM 730 OE1 GLN A 49 -2.844 6.294 -4.180 1.00 25.00 O ATOM 731 NE2 GLN A 49 -3.156 6.004 -6.376 1.00 25.00 N ATOM 0 H GLN A 49 1.425 3.469 -3.580 1.00 25.00 H new ATOM 0 HA GLN A 49 1.825 5.814 -5.349 1.00 25.00 H new ATOM 0 HB2 GLN A 49 -0.447 5.440 -3.344 1.00 25.00 H new ATOM 0 HB3 GLN A 49 -0.039 6.969 -4.097 1.00 25.00 H new ATOM 0 HG2 GLN A 49 -0.535 6.011 -6.333 1.00 25.00 H new ATOM 0 HG3 GLN A 49 -0.917 4.468 -5.595 1.00 25.00 H new ATOM 0 HE21 GLN A 49 -2.758 5.738 -7.277 1.00 25.00 H new ATOM 0 HE22 GLN A 49 -4.133 6.289 -6.314 1.00 25.00 H new ATOM 740 N ALA A 50 3.235 6.871 -3.581 1.00 25.00 N ATOM 741 CA ALA A 50 4.165 7.428 -2.582 1.00 25.00 C ATOM 742 C ALA A 50 3.989 8.945 -2.384 1.00 25.00 C ATOM 743 O ALA A 50 3.704 9.676 -3.337 1.00 25.00 O ATOM 744 CB ALA A 50 5.596 7.110 -2.990 1.00 25.00 C ATOM 0 H ALA A 50 3.360 7.247 -4.521 1.00 25.00 H new ATOM 0 HA ALA A 50 3.936 6.961 -1.624 1.00 25.00 H new ATOM 0 HB1 ALA A 50 6.285 7.521 -2.252 1.00 25.00 H new ATOM 0 HB2 ALA A 50 5.727 6.029 -3.046 1.00 25.00 H new ATOM 0 HB3 ALA A 50 5.803 7.551 -3.965 1.00 25.00 H new ATOM 750 N THR A 51 4.165 9.401 -1.118 1.00 25.00 N ATOM 751 CA THR A 51 4.061 10.834 -0.736 1.00 25.00 C ATOM 752 C THR A 51 5.136 11.695 -1.446 1.00 25.00 C ATOM 753 O THR A 51 6.327 11.382 -1.345 1.00 25.00 O ATOM 754 CB THR A 51 4.211 11.036 0.795 1.00 25.00 C ATOM 755 OG1 THR A 51 5.430 10.439 1.261 1.00 25.00 O ATOM 756 CG2 THR A 51 3.032 10.432 1.554 1.00 25.00 C ATOM 0 H THR A 51 4.383 8.787 -0.333 1.00 25.00 H new ATOM 0 HA THR A 51 3.068 11.155 -1.050 1.00 25.00 H new ATOM 0 HB THR A 51 4.233 12.109 0.983 1.00 25.00 H new ATOM 0 HG1 THR A 51 6.130 10.555 0.585 1.00 25.00 H new ATOM 0 HG21 THR A 51 3.168 10.591 2.624 1.00 25.00 H new ATOM 0 HG22 THR A 51 2.108 10.911 1.231 1.00 25.00 H new ATOM 0 HG23 THR A 51 2.977 9.363 1.350 1.00 25.00 H new ATOM 764 N PRO A 52 4.741 12.790 -2.182 1.00 25.00 N ATOM 765 CA PRO A 52 5.707 13.712 -2.834 1.00 25.00 C ATOM 766 C PRO A 52 6.662 14.396 -1.841 1.00 25.00 C ATOM 767 O PRO A 52 6.432 14.377 -0.629 1.00 25.00 O ATOM 768 CB PRO A 52 4.831 14.782 -3.498 1.00 25.00 C ATOM 769 CG PRO A 52 3.474 14.187 -3.643 1.00 25.00 C ATOM 770 CD PRO A 52 3.341 13.199 -2.453 1.00 25.00 C ATOM 0 HA PRO A 52 6.343 13.159 -3.525 1.00 25.00 H new ATOM 0 HB2 PRO A 52 4.795 15.686 -2.890 1.00 25.00 H new ATOM 0 HB3 PRO A 52 5.236 15.067 -4.469 1.00 25.00 H new ATOM 0 HG2 PRO A 52 2.701 14.954 -3.608 1.00 25.00 H new ATOM 0 HG3 PRO A 52 3.369 13.672 -4.598 1.00 25.00 H new ATOM 0 HD2 PRO A 52 2.887 13.676 -1.584 1.00 25.00 H new ATOM 0 HD3 PRO A 52 2.716 12.344 -2.710 1.00 25.00 H new ATOM 778 N ALA A 53 7.730 15.008 -2.385 1.00 25.00 N ATOM 779 CA ALA A 53 8.743 15.717 -1.587 1.00 25.00 C ATOM 780 C ALA A 53 8.213 17.040 -1.010 1.00 25.00 C ATOM 781 O ALA A 53 8.840 17.631 -0.126 1.00 25.00 O ATOM 782 CB ALA A 53 9.982 15.976 -2.434 1.00 25.00 C ATOM 0 H ALA A 53 7.913 15.024 -3.388 1.00 25.00 H new ATOM 0 HA ALA A 53 8.999 15.077 -0.743 1.00 25.00 H new ATOM 0 HB1 ALA A 53 10.728 16.501 -1.837 1.00 25.00 H new ATOM 0 HB2 ALA A 53 10.394 15.027 -2.776 1.00 25.00 H new ATOM 0 HB3 ALA A 53 9.712 16.586 -3.296 1.00 25.00 H new ATOM 788 N SER A 54 7.061 17.490 -1.527 1.00 25.00 N ATOM 789 CA SER A 54 6.394 18.698 -1.032 1.00 25.00 C ATOM 790 C SER A 54 5.280 18.344 -0.033 1.00 25.00 C ATOM 791 O SER A 54 4.714 19.230 0.616 1.00 25.00 O ATOM 792 CB SER A 54 5.824 19.494 -2.205 1.00 25.00 C ATOM 793 OG SER A 54 4.884 18.732 -2.946 1.00 25.00 O ATOM 0 H SER A 54 6.570 17.030 -2.294 1.00 25.00 H new ATOM 0 HA SER A 54 7.130 19.309 -0.510 1.00 25.00 H new ATOM 0 HB2 SER A 54 5.346 20.400 -1.832 1.00 25.00 H new ATOM 0 HB3 SER A 54 6.636 19.809 -2.861 1.00 25.00 H new ATOM 0 HG SER A 54 3.975 18.995 -2.690 1.00 25.00 H new ATOM 799 N SER A 55 4.985 17.038 0.086 1.00 25.00 N ATOM 800 CA SER A 55 3.949 16.536 0.990 1.00 25.00 C ATOM 801 C SER A 55 4.407 16.495 2.448 1.00 25.00 C ATOM 802 O SER A 55 5.536 16.100 2.752 1.00 25.00 O ATOM 803 CB SER A 55 3.505 15.149 0.534 1.00 25.00 C ATOM 804 OG SER A 55 2.605 14.595 1.470 1.00 25.00 O ATOM 0 H SER A 55 5.460 16.306 -0.443 1.00 25.00 H new ATOM 0 HA SER A 55 3.110 17.230 0.946 1.00 25.00 H new ATOM 0 HB2 SER A 55 3.029 15.214 -0.445 1.00 25.00 H new ATOM 0 HB3 SER A 55 4.373 14.499 0.424 1.00 25.00 H new ATOM 0 HG SER A 55 2.498 13.637 1.294 1.00 25.00 H new ATOM 810 N GLU A 56 3.493 16.926 3.341 1.00 25.00 N ATOM 811 CA GLU A 56 3.677 16.848 4.806 1.00 25.00 C ATOM 812 C GLU A 56 3.891 15.411 5.271 1.00 25.00 C ATOM 813 O GLU A 56 4.446 15.162 6.345 1.00 25.00 O ATOM 814 CB GLU A 56 2.442 17.399 5.514 1.00 25.00 C ATOM 815 CG GLU A 56 2.016 18.775 5.037 1.00 25.00 C ATOM 816 CD GLU A 56 1.421 18.754 3.642 1.00 25.00 C ATOM 817 OE1 GLU A 56 0.468 17.977 3.413 1.00 25.00 O ATOM 818 OE2 GLU A 56 1.905 19.515 2.778 1.00 25.00 O ATOM 0 H GLU A 56 2.602 17.340 3.066 1.00 25.00 H new ATOM 0 HA GLU A 56 4.561 17.436 5.053 1.00 25.00 H new ATOM 0 HB2 GLU A 56 1.614 16.704 5.371 1.00 25.00 H new ATOM 0 HB3 GLU A 56 2.640 17.443 6.585 1.00 25.00 H new ATOM 0 HG2 GLU A 56 1.285 19.186 5.733 1.00 25.00 H new ATOM 0 HG3 GLU A 56 2.878 19.442 5.050 1.00 25.00 H new ATOM 825 N LYS A 57 3.431 14.489 4.434 1.00 25.00 N ATOM 826 CA LYS A 57 3.444 13.076 4.719 1.00 25.00 C ATOM 827 C LYS A 57 4.699 12.398 4.189 1.00 25.00 C ATOM 828 O LYS A 57 5.191 12.732 3.107 1.00 25.00 O ATOM 829 CB LYS A 57 2.210 12.442 4.073 1.00 25.00 C ATOM 830 CG LYS A 57 0.861 12.991 4.513 1.00 25.00 C ATOM 831 CD LYS A 57 0.542 12.769 5.983 1.00 25.00 C ATOM 832 CE LYS A 57 -0.880 13.195 6.259 1.00 25.00 C ATOM 833 NZ LYS A 57 -1.266 12.983 7.683 1.00 25.00 N ATOM 0 H LYS A 57 3.033 14.716 3.523 1.00 25.00 H new ATOM 0 HA LYS A 57 3.434 12.941 5.801 1.00 25.00 H new ATOM 0 HB2 LYS A 57 2.291 12.560 2.992 1.00 25.00 H new ATOM 0 HB3 LYS A 57 2.228 11.372 4.279 1.00 25.00 H new ATOM 0 HG2 LYS A 57 0.832 14.061 4.305 1.00 25.00 H new ATOM 0 HG3 LYS A 57 0.080 12.528 3.910 1.00 25.00 H new ATOM 0 HD2 LYS A 57 0.675 11.718 6.240 1.00 25.00 H new ATOM 0 HD3 LYS A 57 1.231 13.339 6.606 1.00 25.00 H new ATOM 0 HE2 LYS A 57 -0.997 14.249 6.006 1.00 25.00 H new ATOM 0 HE3 LYS A 57 -1.557 12.635 5.614 1.00 25.00 H new ATOM 0 HZ1 LYS A 57 -2.250 13.289 7.825 1.00 25.00 H new ATOM 0 HZ2 LYS A 57 -1.180 11.974 7.919 1.00 25.00 H new ATOM 0 HZ3 LYS A 57 -0.638 13.538 8.299 1.00 25.00 H new ATOM 847 N MET A 58 5.218 11.459 4.978 1.00 25.00 N ATOM 848 CA MET A 58 6.247 10.542 4.510 1.00 25.00 C ATOM 849 C MET A 58 5.701 9.121 4.566 1.00 25.00 C ATOM 850 O MET A 58 5.722 8.474 5.619 1.00 25.00 O ATOM 851 CB MET A 58 7.513 10.666 5.371 1.00 25.00 C ATOM 852 CG MET A 58 8.181 12.040 5.317 1.00 25.00 C ATOM 853 SD MET A 58 8.650 12.550 3.645 1.00 25.00 S ATOM 854 CE MET A 58 10.065 11.498 3.332 1.00 25.00 C ATOM 0 H MET A 58 4.939 11.316 5.949 1.00 25.00 H new ATOM 0 HA MET A 58 6.516 10.790 3.483 1.00 25.00 H new ATOM 0 HB2 MET A 58 7.257 10.440 6.406 1.00 25.00 H new ATOM 0 HB3 MET A 58 8.232 9.913 5.049 1.00 25.00 H new ATOM 0 HG2 MET A 58 7.502 12.782 5.738 1.00 25.00 H new ATOM 0 HG3 MET A 58 9.070 12.028 5.947 1.00 25.00 H new ATOM 0 HE1 MET A 58 9.997 11.087 2.325 1.00 25.00 H new ATOM 0 HE2 MET A 58 10.980 12.082 3.424 1.00 25.00 H new ATOM 0 HE3 MET A 58 10.080 10.683 4.056 1.00 25.00 H new ATOM 864 N MET A 59 5.207 8.642 3.415 1.00 25.00 N ATOM 865 CA MET A 59 4.522 7.352 3.332 1.00 25.00 C ATOM 866 C MET A 59 4.604 6.741 1.937 1.00 25.00 C ATOM 867 O MET A 59 4.747 7.450 0.936 1.00 25.00 O ATOM 868 CB MET A 59 3.049 7.516 3.730 1.00 25.00 C ATOM 869 CG MET A 59 2.824 7.917 5.187 1.00 25.00 C ATOM 870 SD MET A 59 1.083 7.817 5.715 1.00 25.00 S ATOM 871 CE MET A 59 0.213 8.881 4.551 1.00 25.00 C ATOM 0 H MET A 59 5.272 9.136 2.525 1.00 25.00 H new ATOM 0 HA MET A 59 5.026 6.675 4.021 1.00 25.00 H new ATOM 0 HB2 MET A 59 2.594 8.268 3.086 1.00 25.00 H new ATOM 0 HB3 MET A 59 2.529 6.577 3.541 1.00 25.00 H new ATOM 0 HG2 MET A 59 3.426 7.274 5.829 1.00 25.00 H new ATOM 0 HG3 MET A 59 3.181 8.937 5.333 1.00 25.00 H new ATOM 0 HE1 MET A 59 -0.514 9.490 5.088 1.00 25.00 H new ATOM 0 HE2 MET A 59 0.929 9.531 4.047 1.00 25.00 H new ATOM 0 HE3 MET A 59 -0.303 8.267 3.812 1.00 25.00 H new ATOM 881 N LEU A 60 4.510 5.405 1.898 1.00 25.00 N ATOM 882 CA LEU A 60 4.497 4.647 0.651 1.00 25.00 C ATOM 883 C LEU A 60 3.330 3.655 0.672 1.00 25.00 C ATOM 884 O LEU A 60 3.263 2.785 1.543 1.00 25.00 O ATOM 885 CB LEU A 60 5.836 3.907 0.473 1.00 25.00 C ATOM 886 CG LEU A 60 5.954 2.977 -0.747 1.00 25.00 C ATOM 887 CD1 LEU A 60 5.864 3.765 -2.031 1.00 25.00 C ATOM 888 CD2 LEU A 60 7.248 2.192 -0.757 1.00 25.00 C ATOM 0 H LEU A 60 4.441 4.824 2.734 1.00 25.00 H new ATOM 0 HA LEU A 60 4.367 5.328 -0.190 1.00 25.00 H new ATOM 0 HB2 LEU A 60 6.630 4.651 0.412 1.00 25.00 H new ATOM 0 HB3 LEU A 60 6.020 3.316 1.370 1.00 25.00 H new ATOM 0 HG LEU A 60 5.124 2.275 -0.673 1.00 25.00 H new ATOM 0 HD11 LEU A 60 5.950 3.087 -2.880 1.00 25.00 H new ATOM 0 HD12 LEU A 60 4.905 4.282 -2.074 1.00 25.00 H new ATOM 0 HD13 LEU A 60 6.672 4.496 -2.067 1.00 25.00 H new ATOM 0 HD21 LEU A 60 7.279 1.552 -1.639 1.00 25.00 H new ATOM 0 HD22 LEU A 60 8.092 2.882 -0.779 1.00 25.00 H new ATOM 0 HD23 LEU A 60 7.307 1.576 0.140 1.00 25.00 H new ATOM 900 N ARG A 61 2.419 3.792 -0.296 1.00 25.00 N ATOM 901 CA ARG A 61 1.214 2.959 -0.357 1.00 25.00 C ATOM 902 C ARG A 61 1.353 1.829 -1.377 1.00 25.00 C ATOM 903 O ARG A 61 1.988 1.989 -2.423 1.00 25.00 O ATOM 904 CB ARG A 61 -0.023 3.796 -0.698 1.00 25.00 C ATOM 905 CG ARG A 61 -0.294 4.949 0.256 1.00 25.00 C ATOM 906 CD ARG A 61 -1.596 5.676 -0.078 1.00 25.00 C ATOM 907 NE ARG A 61 -2.791 4.976 0.422 1.00 25.00 N ATOM 908 CZ ARG A 61 -4.035 5.160 -0.043 1.00 25.00 C ATOM 909 NH1 ARG A 61 -4.276 5.978 -1.066 1.00 25.00 N ATOM 910 NH2 ARG A 61 -5.045 4.504 0.512 1.00 25.00 N ATOM 0 H ARG A 61 2.494 4.474 -1.051 1.00 25.00 H new ATOM 0 HA ARG A 61 1.091 2.521 0.633 1.00 25.00 H new ATOM 0 HB2 ARG A 61 0.092 4.196 -1.706 1.00 25.00 H new ATOM 0 HB3 ARG A 61 -0.895 3.142 -0.712 1.00 25.00 H new ATOM 0 HG2 ARG A 61 -0.342 4.571 1.277 1.00 25.00 H new ATOM 0 HG3 ARG A 61 0.536 5.655 0.216 1.00 25.00 H new ATOM 0 HD2 ARG A 61 -1.565 6.679 0.347 1.00 25.00 H new ATOM 0 HD3 ARG A 61 -1.675 5.790 -1.159 1.00 25.00 H new ATOM 0 HE ARG A 61 -2.663 4.302 1.177 1.00 25.00 H new ATOM 0 HH11 ARG A 61 -3.507 6.479 -1.511 1.00 25.00 H new ATOM 0 HH12 ARG A 61 -5.230 6.104 -1.405 1.00 25.00 H new ATOM 0 HH21 ARG A 61 -4.873 3.864 1.288 1.00 25.00 H new ATOM 0 HH22 ARG A 61 -5.994 4.639 0.163 1.00 25.00 H new ATOM 924 N LEU A 62 0.741 0.689 -1.043 1.00 25.00 N ATOM 925 CA LEU A 62 0.747 -0.506 -1.886 1.00 25.00 C ATOM 926 C LEU A 62 -0.687 -1.007 -2.104 1.00 25.00 C ATOM 927 O LEU A 62 -1.325 -1.532 -1.190 1.00 25.00 O ATOM 928 CB LEU A 62 1.608 -1.603 -1.221 1.00 25.00 C ATOM 929 CG LEU A 62 3.139 -1.606 -1.464 1.00 25.00 C ATOM 930 CD1 LEU A 62 3.438 -1.655 -2.947 1.00 25.00 C ATOM 931 CD2 LEU A 62 3.855 -0.415 -0.818 1.00 25.00 C ATOM 0 H LEU A 62 0.224 0.571 -0.172 1.00 25.00 H new ATOM 0 HA LEU A 62 1.175 -0.260 -2.858 1.00 25.00 H new ATOM 0 HB2 LEU A 62 1.446 -1.542 -0.145 1.00 25.00 H new ATOM 0 HB3 LEU A 62 1.221 -2.568 -1.547 1.00 25.00 H new ATOM 0 HG LEU A 62 3.527 -2.503 -0.982 1.00 25.00 H new ATOM 0 HD11 LEU A 62 4.517 -1.656 -3.101 1.00 25.00 H new ATOM 0 HD12 LEU A 62 3.009 -2.561 -3.375 1.00 25.00 H new ATOM 0 HD13 LEU A 62 3.003 -0.783 -3.435 1.00 25.00 H new ATOM 0 HD21 LEU A 62 4.923 -0.477 -1.025 1.00 25.00 H new ATOM 0 HD22 LEU A 62 3.459 0.514 -1.228 1.00 25.00 H new ATOM 0 HD23 LEU A 62 3.693 -0.434 0.260 1.00 25.00 H new ATOM 943 N ILE A 63 -1.173 -0.851 -3.334 1.00 25.00 N ATOM 944 CA ILE A 63 -2.568 -1.152 -3.698 1.00 25.00 C ATOM 945 C ILE A 63 -2.698 -2.629 -4.121 1.00 25.00 C ATOM 946 O ILE A 63 -1.906 -3.121 -4.926 1.00 25.00 O ATOM 947 CB ILE A 63 -3.037 -0.194 -4.851 1.00 25.00 C ATOM 948 CG1 ILE A 63 -2.778 1.295 -4.531 1.00 25.00 C ATOM 949 CG2 ILE A 63 -4.510 -0.359 -5.211 1.00 25.00 C ATOM 950 CD1 ILE A 63 -3.896 2.223 -4.921 1.00 25.00 C ATOM 0 H ILE A 63 -0.612 -0.511 -4.115 1.00 25.00 H new ATOM 0 HA ILE A 63 -3.210 -0.989 -2.832 1.00 25.00 H new ATOM 0 HB ILE A 63 -2.431 -0.492 -5.707 1.00 25.00 H new ATOM 0 HG12 ILE A 63 -2.595 1.397 -3.461 1.00 25.00 H new ATOM 0 HG13 ILE A 63 -1.868 1.610 -5.041 1.00 25.00 H new ATOM 0 HG21 ILE A 63 -4.768 0.332 -6.014 1.00 25.00 H new ATOM 0 HG22 ILE A 63 -4.692 -1.382 -5.540 1.00 25.00 H new ATOM 0 HG23 ILE A 63 -5.124 -0.145 -4.337 1.00 25.00 H new ATOM 0 HD11 ILE A 63 -3.627 3.246 -4.659 1.00 25.00 H new ATOM 0 HD12 ILE A 63 -4.066 2.156 -5.996 1.00 25.00 H new ATOM 0 HD13 ILE A 63 -4.805 1.940 -4.391 1.00 25.00 H new ATOM 962 N GLY A 64 -3.718 -3.309 -3.580 1.00 25.00 N ATOM 963 CA GLY A 64 -3.906 -4.737 -3.827 1.00 25.00 C ATOM 964 C GLY A 64 -4.708 -5.043 -5.083 1.00 25.00 C ATOM 965 O GLY A 64 -5.407 -4.174 -5.610 1.00 25.00 O ATOM 0 H GLY A 64 -4.421 -2.891 -2.971 1.00 25.00 H new ATOM 0 HA2 GLY A 64 -2.929 -5.214 -3.906 1.00 25.00 H new ATOM 0 HA3 GLY A 64 -4.410 -5.181 -2.968 1.00 25.00 H new ATOM 969 N LYS A 65 -4.596 -6.293 -5.553 1.00 25.00 N ATOM 970 CA LYS A 65 -5.302 -6.760 -6.748 1.00 25.00 C ATOM 971 C LYS A 65 -6.714 -7.250 -6.431 1.00 25.00 C ATOM 972 O LYS A 65 -6.908 -8.217 -5.686 1.00 25.00 O ATOM 973 CB LYS A 65 -4.505 -7.861 -7.432 1.00 25.00 C ATOM 974 CG LYS A 65 -5.081 -8.247 -8.775 1.00 25.00 C ATOM 975 CD LYS A 65 -4.236 -9.294 -9.473 1.00 25.00 C ATOM 976 CE LYS A 65 -4.865 -9.721 -10.790 1.00 25.00 C ATOM 977 NZ LYS A 65 -4.912 -8.615 -11.781 1.00 25.00 N ATOM 0 H LYS A 65 -4.013 -7.006 -5.114 1.00 25.00 H new ATOM 0 HA LYS A 65 -5.398 -5.909 -7.422 1.00 25.00 H new ATOM 0 HB2 LYS A 65 -3.475 -7.530 -7.564 1.00 25.00 H new ATOM 0 HB3 LYS A 65 -4.478 -8.739 -6.787 1.00 25.00 H new ATOM 0 HG2 LYS A 65 -6.093 -8.629 -8.640 1.00 25.00 H new ATOM 0 HG3 LYS A 65 -5.156 -7.361 -9.406 1.00 25.00 H new ATOM 0 HD2 LYS A 65 -3.238 -8.896 -9.656 1.00 25.00 H new ATOM 0 HD3 LYS A 65 -4.119 -10.162 -8.824 1.00 25.00 H new ATOM 0 HE2 LYS A 65 -4.299 -10.554 -11.206 1.00 25.00 H new ATOM 0 HE3 LYS A 65 -5.876 -10.083 -10.606 1.00 25.00 H new ATOM 0 HZ1 LYS A 65 -5.206 -8.990 -12.706 1.00 25.00 H new ATOM 0 HZ2 LYS A 65 -5.594 -7.896 -11.466 1.00 25.00 H new ATOM 0 HZ3 LYS A 65 -3.969 -8.184 -11.866 1.00 25.00 H new ATOM 991 N VAL A 66 -7.686 -6.546 -7.006 1.00 25.00 N ATOM 992 CA VAL A 66 -9.105 -6.838 -6.814 1.00 25.00 C ATOM 993 C VAL A 66 -9.780 -7.138 -8.155 1.00 25.00 C ATOM 994 O VAL A 66 -9.441 -6.549 -9.186 1.00 25.00 O ATOM 995 CB VAL A 66 -9.791 -5.657 -6.040 1.00 25.00 C ATOM 996 CG1 VAL A 66 -11.307 -5.545 -6.220 1.00 25.00 C ATOM 997 CG2 VAL A 66 -9.475 -5.774 -4.558 1.00 25.00 C ATOM 0 H VAL A 66 -7.511 -5.752 -7.622 1.00 25.00 H new ATOM 0 HA VAL A 66 -9.215 -7.735 -6.204 1.00 25.00 H new ATOM 0 HB VAL A 66 -9.376 -4.749 -6.478 1.00 25.00 H new ATOM 0 HG11 VAL A 66 -11.680 -4.698 -5.644 1.00 25.00 H new ATOM 0 HG12 VAL A 66 -11.538 -5.397 -7.275 1.00 25.00 H new ATOM 0 HG13 VAL A 66 -11.784 -6.460 -5.869 1.00 25.00 H new ATOM 0 HG21 VAL A 66 -9.951 -4.955 -4.019 1.00 25.00 H new ATOM 0 HG22 VAL A 66 -9.852 -6.724 -4.180 1.00 25.00 H new ATOM 0 HG23 VAL A 66 -8.396 -5.727 -4.411 1.00 25.00 H new ATOM 1007 N ASP A 67 -10.739 -8.063 -8.108 1.00 25.00 N ATOM 1008 CA ASP A 67 -11.574 -8.389 -9.259 1.00 25.00 C ATOM 1009 C ASP A 67 -12.842 -7.543 -9.214 1.00 25.00 C ATOM 1010 O ASP A 67 -13.713 -7.765 -8.376 1.00 25.00 O ATOM 1011 CB ASP A 67 -11.931 -9.882 -9.271 1.00 25.00 C ATOM 1012 CG ASP A 67 -12.682 -10.301 -10.523 1.00 25.00 C ATOM 1013 OD1 ASP A 67 -12.930 -9.433 -11.385 1.00 25.00 O ATOM 1014 OD2 ASP A 67 -13.020 -11.499 -10.639 1.00 25.00 O ATOM 0 H ASP A 67 -10.957 -8.605 -7.272 1.00 25.00 H new ATOM 0 HA ASP A 67 -11.020 -8.170 -10.172 1.00 25.00 H new ATOM 0 HB2 ASP A 67 -11.017 -10.470 -9.188 1.00 25.00 H new ATOM 0 HB3 ASP A 67 -12.538 -10.112 -8.395 1.00 25.00 H new ATOM 1019 N GLU A 68 -12.921 -6.551 -10.100 1.00 25.00 N ATOM 1020 CA GLU A 68 -14.047 -5.608 -10.120 1.00 25.00 C ATOM 1021 C GLU A 68 -15.239 -6.143 -10.931 1.00 25.00 C ATOM 1022 O GLU A 68 -16.278 -5.484 -11.021 1.00 25.00 O ATOM 1023 CB GLU A 68 -13.588 -4.242 -10.652 1.00 25.00 C ATOM 1024 CG GLU A 68 -12.603 -3.525 -9.730 1.00 25.00 C ATOM 1025 CD GLU A 68 -12.127 -2.202 -10.298 1.00 25.00 C ATOM 1026 OE1 GLU A 68 -12.545 -1.853 -11.423 1.00 25.00 O ATOM 1027 OE2 GLU A 68 -11.336 -1.513 -9.619 1.00 25.00 O ATOM 0 H GLU A 68 -12.217 -6.376 -10.817 1.00 25.00 H new ATOM 0 HA GLU A 68 -14.393 -5.488 -9.094 1.00 25.00 H new ATOM 0 HB2 GLU A 68 -13.124 -4.379 -11.629 1.00 25.00 H new ATOM 0 HB3 GLU A 68 -14.462 -3.607 -10.800 1.00 25.00 H new ATOM 0 HG2 GLU A 68 -13.076 -3.352 -8.764 1.00 25.00 H new ATOM 0 HG3 GLU A 68 -11.743 -4.170 -9.552 1.00 25.00 H new ATOM 1034 N SER A 69 -15.082 -7.347 -11.509 1.00 25.00 N ATOM 1035 CA SER A 69 -16.168 -8.024 -12.235 1.00 25.00 C ATOM 1036 C SER A 69 -17.196 -8.648 -11.268 1.00 25.00 C ATOM 1037 O SER A 69 -18.240 -9.152 -11.697 1.00 25.00 O ATOM 1038 CB SER A 69 -15.589 -9.102 -13.164 1.00 25.00 C ATOM 1039 OG SER A 69 -15.168 -10.245 -12.434 1.00 25.00 O ATOM 0 H SER A 69 -14.208 -7.872 -11.486 1.00 25.00 H new ATOM 0 HA SER A 69 -16.688 -7.275 -12.832 1.00 25.00 H new ATOM 0 HB2 SER A 69 -16.340 -9.394 -13.898 1.00 25.00 H new ATOM 0 HB3 SER A 69 -14.745 -8.691 -13.718 1.00 25.00 H new ATOM 0 HG SER A 69 -14.198 -10.209 -12.300 1.00 25.00 H new ATOM 1045 N LYS A 70 -16.884 -8.592 -9.964 1.00 25.00 N ATOM 1046 CA LYS A 70 -17.777 -9.080 -8.902 1.00 25.00 C ATOM 1047 C LYS A 70 -18.686 -7.940 -8.381 1.00 25.00 C ATOM 1048 O LYS A 70 -19.047 -7.889 -7.198 1.00 25.00 O ATOM 1049 CB LYS A 70 -16.940 -9.684 -7.759 1.00 25.00 C ATOM 1050 CG LYS A 70 -16.309 -11.034 -8.100 1.00 25.00 C ATOM 1051 CD LYS A 70 -15.552 -11.656 -6.919 1.00 25.00 C ATOM 1052 CE LYS A 70 -14.888 -13.000 -7.242 1.00 25.00 C ATOM 1053 NZ LYS A 70 -13.993 -13.476 -6.151 1.00 25.00 N ATOM 0 H LYS A 70 -16.006 -8.207 -9.616 1.00 25.00 H new ATOM 0 HA LYS A 70 -18.424 -9.856 -9.311 1.00 25.00 H new ATOM 0 HB2 LYS A 70 -16.150 -8.982 -7.490 1.00 25.00 H new ATOM 0 HB3 LYS A 70 -17.574 -9.802 -6.880 1.00 25.00 H new ATOM 0 HG2 LYS A 70 -17.089 -11.721 -8.427 1.00 25.00 H new ATOM 0 HG3 LYS A 70 -15.624 -10.907 -8.938 1.00 25.00 H new ATOM 0 HD2 LYS A 70 -14.787 -10.956 -6.582 1.00 25.00 H new ATOM 0 HD3 LYS A 70 -16.245 -11.795 -6.089 1.00 25.00 H new ATOM 0 HE2 LYS A 70 -15.660 -13.747 -7.425 1.00 25.00 H new ATOM 0 HE3 LYS A 70 -14.312 -12.904 -8.163 1.00 25.00 H new ATOM 0 HZ1 LYS A 70 -13.571 -14.387 -6.421 1.00 25.00 H new ATOM 0 HZ2 LYS A 70 -13.238 -12.778 -5.992 1.00 25.00 H new ATOM 0 HZ3 LYS A 70 -14.544 -13.595 -5.277 1.00 25.00 H new ATOM 1067 N LYS A 71 -19.044 -7.045 -9.304 1.00 25.00 N ATOM 1068 CA LYS A 71 -19.882 -5.851 -9.045 1.00 25.00 C ATOM 1069 C LYS A 71 -21.121 -6.158 -8.198 1.00 25.00 C ATOM 1070 O LYS A 71 -21.888 -7.077 -8.507 1.00 25.00 O ATOM 1071 CB LYS A 71 -20.340 -5.257 -10.382 1.00 25.00 C ATOM 1072 CG LYS A 71 -19.248 -4.524 -11.146 1.00 25.00 C ATOM 1073 CD LYS A 71 -19.820 -3.782 -12.343 1.00 25.00 C ATOM 1074 CE LYS A 71 -18.760 -2.920 -13.003 1.00 25.00 C ATOM 1075 NZ LYS A 71 -17.637 -3.722 -13.568 1.00 25.00 N ATOM 0 H LYS A 71 -18.757 -7.124 -10.280 1.00 25.00 H new ATOM 0 HA LYS A 71 -19.266 -5.148 -8.484 1.00 25.00 H new ATOM 0 HB2 LYS A 71 -20.730 -6.059 -11.008 1.00 25.00 H new ATOM 0 HB3 LYS A 71 -21.164 -4.568 -10.197 1.00 25.00 H new ATOM 0 HG2 LYS A 71 -18.747 -3.819 -10.483 1.00 25.00 H new ATOM 0 HG3 LYS A 71 -18.494 -5.236 -11.482 1.00 25.00 H new ATOM 0 HD2 LYS A 71 -20.214 -4.497 -13.065 1.00 25.00 H new ATOM 0 HD3 LYS A 71 -20.655 -3.158 -12.024 1.00 25.00 H new ATOM 0 HE2 LYS A 71 -19.218 -2.333 -13.799 1.00 25.00 H new ATOM 0 HE3 LYS A 71 -18.365 -2.214 -12.273 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 -16.985 -3.094 -14.080 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 -17.126 -4.196 -12.796 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 -18.015 -4.436 -14.223 1.00 25.00 H new ATOM 1089 N ARG A 72 -21.298 -5.377 -7.123 1.00 25.00 N ATOM 1090 CA ARG A 72 -22.429 -5.544 -6.220 1.00 25.00 C ATOM 1091 C ARG A 72 -23.392 -4.360 -6.365 1.00 25.00 C ATOM 1092 O ARG A 72 -22.962 -3.232 -6.616 1.00 25.00 O ATOM 1093 CB ARG A 72 -21.918 -5.669 -4.775 1.00 25.00 C ATOM 1094 CG ARG A 72 -21.139 -6.949 -4.483 1.00 25.00 C ATOM 1095 CD ARG A 72 -20.703 -7.015 -3.028 1.00 25.00 C ATOM 1096 NE ARG A 72 -21.846 -7.039 -2.108 1.00 25.00 N ATOM 1097 CZ ARG A 72 -22.131 -6.079 -1.213 1.00 25.00 C ATOM 1098 NH1 ARG A 72 -21.362 -4.998 -1.092 1.00 25.00 N ATOM 1099 NH2 ARG A 72 -23.196 -6.208 -0.432 1.00 25.00 N ATOM 0 H ARG A 72 -20.664 -4.621 -6.863 1.00 25.00 H new ATOM 0 HA ARG A 72 -22.972 -6.454 -6.475 1.00 25.00 H new ATOM 0 HB2 ARG A 72 -21.280 -4.813 -4.554 1.00 25.00 H new ATOM 0 HB3 ARG A 72 -22.770 -5.615 -4.097 1.00 25.00 H new ATOM 0 HG2 ARG A 72 -21.758 -7.815 -4.718 1.00 25.00 H new ATOM 0 HG3 ARG A 72 -20.263 -6.999 -5.129 1.00 25.00 H new ATOM 0 HD2 ARG A 72 -20.095 -7.906 -2.873 1.00 25.00 H new ATOM 0 HD3 ARG A 72 -20.073 -6.155 -2.800 1.00 25.00 H new ATOM 0 HE ARG A 72 -22.470 -7.844 -2.151 1.00 25.00 H new ATOM 0 HH11 ARG A 72 -20.540 -4.888 -1.685 1.00 25.00 H new ATOM 0 HH12 ARG A 72 -21.596 -4.280 -0.406 1.00 25.00 H new ATOM 0 HH21 ARG A 72 -23.792 -7.032 -0.514 1.00 25.00 H new ATOM 0 HH22 ARG A 72 -23.419 -5.483 0.250 1.00 25.00 H new ATOM 1113 N LYS A 73 -24.690 -4.639 -6.228 1.00 25.00 N ATOM 1114 CA LYS A 73 -25.725 -3.604 -6.273 1.00 25.00 C ATOM 1115 C LYS A 73 -26.584 -3.686 -5.012 1.00 25.00 C ATOM 1116 O LYS A 73 -26.935 -4.781 -4.561 1.00 25.00 O ATOM 1117 CB LYS A 73 -26.602 -3.756 -7.523 1.00 25.00 C ATOM 1118 CG LYS A 73 -25.849 -3.515 -8.816 1.00 25.00 C ATOM 1119 CD LYS A 73 -26.738 -3.676 -10.031 1.00 25.00 C ATOM 1120 CE LYS A 73 -25.946 -3.500 -11.314 1.00 25.00 C ATOM 1121 NZ LYS A 73 -26.780 -3.751 -12.520 1.00 25.00 N ATOM 0 H LYS A 73 -25.051 -5.582 -6.084 1.00 25.00 H new ATOM 0 HA LYS A 73 -25.241 -2.629 -6.320 1.00 25.00 H new ATOM 0 HB2 LYS A 73 -27.028 -4.759 -7.540 1.00 25.00 H new ATOM 0 HB3 LYS A 73 -27.436 -3.057 -7.461 1.00 25.00 H new ATOM 0 HG2 LYS A 73 -25.426 -2.510 -8.807 1.00 25.00 H new ATOM 0 HG3 LYS A 73 -25.013 -4.212 -8.884 1.00 25.00 H new ATOM 0 HD2 LYS A 73 -27.201 -4.662 -10.018 1.00 25.00 H new ATOM 0 HD3 LYS A 73 -27.545 -2.944 -9.995 1.00 25.00 H new ATOM 0 HE2 LYS A 73 -25.543 -2.488 -11.356 1.00 25.00 H new ATOM 0 HE3 LYS A 73 -25.096 -4.182 -11.312 1.00 25.00 H new ATOM 0 HZ1 LYS A 73 -26.202 -3.621 -13.375 1.00 25.00 H new ATOM 0 HZ2 LYS A 73 -27.144 -4.725 -12.494 1.00 25.00 H new ATOM 0 HZ3 LYS A 73 -27.577 -3.083 -12.536 1.00 25.00 H new ATOM 1135 N ASP A 74 -26.920 -2.519 -4.452 1.00 25.00 N ATOM 1136 CA ASP A 74 -27.654 -2.435 -3.180 1.00 25.00 C ATOM 1137 C ASP A 74 -29.170 -2.688 -3.357 1.00 25.00 C ATOM 1138 O ASP A 74 -29.604 -3.078 -4.445 1.00 25.00 O ATOM 1139 CB ASP A 74 -27.373 -1.077 -2.493 1.00 25.00 C ATOM 1140 CG ASP A 74 -27.943 0.121 -3.241 1.00 25.00 C ATOM 1141 OD1 ASP A 74 -28.783 -0.083 -4.142 1.00 25.00 O ATOM 1142 OD2 ASP A 74 -27.551 1.261 -2.916 1.00 25.00 O ATOM 0 H ASP A 74 -26.694 -1.612 -4.861 1.00 25.00 H new ATOM 0 HA ASP A 74 -27.291 -3.232 -2.531 1.00 25.00 H new ATOM 0 HB2 ASP A 74 -27.790 -1.097 -1.486 1.00 25.00 H new ATOM 0 HB3 ASP A 74 -26.296 -0.949 -2.389 1.00 25.00 H new ATOM 1147 N ASN A 75 -29.964 -2.460 -2.293 1.00 25.00 N ATOM 1148 CA ASN A 75 -31.411 -2.779 -2.284 1.00 25.00 C ATOM 1149 C ASN A 75 -32.200 -2.109 -3.423 1.00 25.00 C ATOM 1150 O ASN A 75 -33.168 -2.685 -3.932 1.00 25.00 O ATOM 1151 CB ASN A 75 -32.029 -2.371 -0.938 1.00 25.00 C ATOM 1152 CG ASN A 75 -31.599 -3.261 0.219 1.00 25.00 C ATOM 1153 OD1 ASN A 75 -31.178 -4.405 0.027 1.00 25.00 O ATOM 1154 ND2 ASN A 75 -31.705 -2.737 1.434 1.00 25.00 N ATOM 0 H ASN A 75 -29.627 -2.053 -1.421 1.00 25.00 H new ATOM 0 HA ASN A 75 -31.483 -3.856 -2.437 1.00 25.00 H new ATOM 0 HB2 ASN A 75 -31.751 -1.340 -0.717 1.00 25.00 H new ATOM 0 HB3 ASN A 75 -33.115 -2.397 -1.023 1.00 25.00 H new ATOM 0 HD21 ASN A 75 -31.434 -3.284 2.251 1.00 25.00 H new ATOM 0 HD22 ASN A 75 -32.058 -1.787 1.551 1.00 25.00 H new ATOM 1161 N GLU A 76 -31.765 -0.912 -3.834 1.00 25.00 N ATOM 1162 CA GLU A 76 -32.477 -0.133 -4.857 1.00 25.00 C ATOM 1163 C GLU A 76 -31.984 -0.462 -6.274 1.00 25.00 C ATOM 1164 O GLU A 76 -32.626 -0.090 -7.263 1.00 25.00 O ATOM 1165 CB GLU A 76 -32.328 1.371 -4.585 1.00 25.00 C ATOM 1166 CG GLU A 76 -33.002 1.836 -3.299 1.00 25.00 C ATOM 1167 CD GLU A 76 -32.778 3.311 -3.022 1.00 25.00 C ATOM 1168 OE1 GLU A 76 -32.025 3.951 -3.787 1.00 25.00 O ATOM 1169 OE2 GLU A 76 -33.356 3.826 -2.041 1.00 25.00 O ATOM 0 H GLU A 76 -30.924 -0.461 -3.475 1.00 25.00 H new ATOM 0 HA GLU A 76 -33.530 -0.408 -4.799 1.00 25.00 H new ATOM 0 HB2 GLU A 76 -31.267 1.618 -4.538 1.00 25.00 H new ATOM 0 HB3 GLU A 76 -32.748 1.925 -5.424 1.00 25.00 H new ATOM 0 HG2 GLU A 76 -34.072 1.641 -3.363 1.00 25.00 H new ATOM 0 HG3 GLU A 76 -32.621 1.251 -2.462 1.00 25.00 H new ATOM 1176 N GLY A 77 -30.847 -1.167 -6.357 1.00 25.00 N ATOM 1177 CA GLY A 77 -30.262 -1.534 -7.642 1.00 25.00 C ATOM 1178 C GLY A 77 -29.183 -0.566 -8.099 1.00 25.00 C ATOM 1179 O GLY A 77 -28.865 -0.505 -9.290 1.00 25.00 O ATOM 0 H GLY A 77 -30.319 -1.491 -5.547 1.00 25.00 H new ATOM 0 HA2 GLY A 77 -29.838 -2.535 -7.569 1.00 25.00 H new ATOM 0 HA3 GLY A 77 -31.049 -1.575 -8.395 1.00 25.00 H new ATOM 1183 N ASN A 78 -28.625 0.188 -7.144 1.00 25.00 N ATOM 1184 CA ASN A 78 -27.544 1.137 -7.421 1.00 25.00 C ATOM 1185 C ASN A 78 -26.187 0.442 -7.312 1.00 25.00 C ATOM 1186 O ASN A 78 -26.016 -0.483 -6.512 1.00 25.00 O ATOM 1187 CB ASN A 78 -27.611 2.327 -6.448 1.00 25.00 C ATOM 1188 CG ASN A 78 -28.884 3.152 -6.587 1.00 25.00 C ATOM 1189 OD1 ASN A 78 -29.206 3.658 -7.664 1.00 25.00 O ATOM 1190 ND2 ASN A 78 -29.618 3.289 -5.488 1.00 25.00 N ATOM 0 H ASN A 78 -28.909 0.157 -6.165 1.00 25.00 H new ATOM 0 HA ASN A 78 -27.665 1.512 -8.437 1.00 25.00 H new ATOM 0 HB2 ASN A 78 -27.538 1.955 -5.426 1.00 25.00 H new ATOM 0 HB3 ASN A 78 -26.749 2.972 -6.615 1.00 25.00 H new ATOM 0 HD21 ASN A 78 -30.483 3.829 -5.516 1.00 25.00 H new ATOM 0 HD22 ASN A 78 -29.317 2.854 -4.616 1.00 25.00 H new ATOM 1197 N GLU A 79 -25.227 0.903 -8.121 1.00 25.00 N ATOM 1198 CA GLU A 79 -23.901 0.281 -8.214 1.00 25.00 C ATOM 1199 C GLU A 79 -23.072 0.545 -6.953 1.00 25.00 C ATOM 1200 O GLU A 79 -22.811 1.699 -6.594 1.00 25.00 O ATOM 1201 CB GLU A 79 -23.162 0.823 -9.450 1.00 25.00 C ATOM 1202 CG GLU A 79 -22.037 -0.059 -9.959 1.00 25.00 C ATOM 1203 CD GLU A 79 -21.340 0.540 -11.166 1.00 25.00 C ATOM 1204 OE1 GLU A 79 -21.604 1.720 -11.479 1.00 25.00 O ATOM 1205 OE2 GLU A 79 -20.527 -0.170 -11.796 1.00 25.00 O ATOM 0 H GLU A 79 -25.346 1.714 -8.728 1.00 25.00 H new ATOM 0 HA GLU A 79 -24.035 -0.797 -8.309 1.00 25.00 H new ATOM 0 HB2 GLU A 79 -23.884 0.966 -10.254 1.00 25.00 H new ATOM 0 HB3 GLU A 79 -22.754 1.805 -9.210 1.00 25.00 H new ATOM 0 HG2 GLU A 79 -21.310 -0.214 -9.162 1.00 25.00 H new ATOM 0 HG3 GLU A 79 -22.436 -1.039 -10.221 1.00 25.00 H new ATOM 1212 N VAL A 80 -22.676 -0.542 -6.293 1.00 25.00 N ATOM 1213 CA VAL A 80 -21.749 -0.480 -5.171 1.00 25.00 C ATOM 1214 C VAL A 80 -20.617 -1.469 -5.415 1.00 25.00 C ATOM 1215 O VAL A 80 -20.760 -2.676 -5.184 1.00 25.00 O ATOM 1216 CB VAL A 80 -22.435 -0.738 -3.788 1.00 25.00 C ATOM 1217 CG1 VAL A 80 -21.421 -0.610 -2.661 1.00 25.00 C ATOM 1218 CG2 VAL A 80 -23.613 0.202 -3.536 1.00 25.00 C ATOM 0 H VAL A 80 -22.989 -1.486 -6.522 1.00 25.00 H new ATOM 0 HA VAL A 80 -21.356 0.535 -5.115 1.00 25.00 H new ATOM 0 HB VAL A 80 -22.828 -1.754 -3.814 1.00 25.00 H new ATOM 0 HG11 VAL A 80 -21.914 -0.792 -1.706 1.00 25.00 H new ATOM 0 HG12 VAL A 80 -20.624 -1.340 -2.804 1.00 25.00 H new ATOM 0 HG13 VAL A 80 -20.997 0.394 -2.665 1.00 25.00 H new ATOM 0 HG21 VAL A 80 -24.053 -0.019 -2.564 1.00 25.00 H new ATOM 0 HG22 VAL A 80 -23.264 1.235 -3.550 1.00 25.00 H new ATOM 0 HG23 VAL A 80 -24.363 0.062 -4.314 1.00 25.00 H new ATOM 1228 N VAL A 81 -19.492 -0.942 -5.889 1.00 25.00 N ATOM 1229 CA VAL A 81 -18.392 -1.777 -6.351 1.00 25.00 C ATOM 1230 C VAL A 81 -17.282 -1.894 -5.277 1.00 25.00 C ATOM 1231 O VAL A 81 -16.788 -0.872 -4.791 1.00 25.00 O ATOM 1232 CB VAL A 81 -17.840 -1.281 -7.734 1.00 25.00 C ATOM 1233 CG1 VAL A 81 -16.710 -2.165 -8.265 1.00 25.00 C ATOM 1234 CG2 VAL A 81 -18.948 -1.132 -8.780 1.00 25.00 C ATOM 0 H VAL A 81 -19.320 0.061 -5.963 1.00 25.00 H new ATOM 0 HA VAL A 81 -18.779 -2.783 -6.511 1.00 25.00 H new ATOM 0 HB VAL A 81 -17.422 -0.292 -7.549 1.00 25.00 H new ATOM 0 HG11 VAL A 81 -16.365 -1.778 -9.224 1.00 25.00 H new ATOM 0 HG12 VAL A 81 -15.883 -2.165 -7.555 1.00 25.00 H new ATOM 0 HG13 VAL A 81 -17.076 -3.183 -8.396 1.00 25.00 H new ATOM 0 HG21 VAL A 81 -18.517 -0.787 -9.720 1.00 25.00 H new ATOM 0 HG22 VAL A 81 -19.433 -2.095 -8.936 1.00 25.00 H new ATOM 0 HG23 VAL A 81 -19.684 -0.408 -8.430 1.00 25.00 H new ATOM 1244 N PRO A 82 -16.878 -3.150 -4.887 1.00 25.00 N ATOM 1245 CA PRO A 82 -15.820 -3.379 -3.877 1.00 25.00 C ATOM 1246 C PRO A 82 -14.441 -2.932 -4.357 1.00 25.00 C ATOM 1247 O PRO A 82 -13.963 -3.361 -5.414 1.00 25.00 O ATOM 1248 CB PRO A 82 -15.849 -4.898 -3.657 1.00 25.00 C ATOM 1249 CG PRO A 82 -16.373 -5.443 -4.935 1.00 25.00 C ATOM 1250 CD PRO A 82 -17.418 -4.448 -5.359 1.00 25.00 C ATOM 0 HA PRO A 82 -16.000 -2.803 -2.970 1.00 25.00 H new ATOM 0 HB2 PRO A 82 -14.855 -5.287 -3.436 1.00 25.00 H new ATOM 0 HB3 PRO A 82 -16.490 -5.166 -2.817 1.00 25.00 H new ATOM 0 HG2 PRO A 82 -15.584 -5.535 -5.682 1.00 25.00 H new ATOM 0 HG3 PRO A 82 -16.801 -6.436 -4.799 1.00 25.00 H new ATOM 0 HD2 PRO A 82 -17.561 -4.453 -6.440 1.00 25.00 H new ATOM 0 HD3 PRO A 82 -18.386 -4.667 -4.908 1.00 25.00 H new ATOM 1258 N LYS A 83 -13.823 -2.063 -3.564 1.00 25.00 N ATOM 1259 CA LYS A 83 -12.551 -1.432 -3.935 1.00 25.00 C ATOM 1260 C LYS A 83 -11.326 -2.171 -3.334 1.00 25.00 C ATOM 1261 O LYS A 83 -11.461 -2.860 -2.319 1.00 25.00 O ATOM 1262 CB LYS A 83 -12.558 0.064 -3.543 1.00 25.00 C ATOM 1263 CG LYS A 83 -13.641 0.900 -4.223 1.00 25.00 C ATOM 1264 CD LYS A 83 -13.468 0.989 -5.743 1.00 25.00 C ATOM 1265 CE LYS A 83 -14.597 1.758 -6.427 1.00 25.00 C ATOM 1266 NZ LYS A 83 -14.549 1.641 -7.913 1.00 25.00 N ATOM 0 H LYS A 83 -14.181 -1.775 -2.653 1.00 25.00 H new ATOM 0 HA LYS A 83 -12.452 -1.506 -5.018 1.00 25.00 H new ATOM 0 HB2 LYS A 83 -12.684 0.141 -2.463 1.00 25.00 H new ATOM 0 HB3 LYS A 83 -11.585 0.492 -3.782 1.00 25.00 H new ATOM 0 HG2 LYS A 83 -14.617 0.470 -3.999 1.00 25.00 H new ATOM 0 HG3 LYS A 83 -13.632 1.906 -3.803 1.00 25.00 H new ATOM 0 HD2 LYS A 83 -12.518 1.473 -5.967 1.00 25.00 H new ATOM 0 HD3 LYS A 83 -13.418 -0.018 -6.157 1.00 25.00 H new ATOM 0 HE2 LYS A 83 -15.556 1.385 -6.067 1.00 25.00 H new ATOM 0 HE3 LYS A 83 -14.538 2.810 -6.146 1.00 25.00 H new ATOM 0 HZ1 LYS A 83 -15.335 2.180 -8.329 1.00 25.00 H new ATOM 0 HZ2 LYS A 83 -13.646 2.021 -8.262 1.00 25.00 H new ATOM 0 HZ3 LYS A 83 -14.632 0.641 -8.185 1.00 25.00 H new ATOM 1280 N PRO A 84 -10.109 -2.034 -3.962 1.00 25.00 N ATOM 1281 CA PRO A 84 -8.862 -2.627 -3.439 1.00 25.00 C ATOM 1282 C PRO A 84 -8.363 -1.988 -2.145 1.00 25.00 C ATOM 1283 O PRO A 84 -8.617 -0.811 -1.873 1.00 25.00 O ATOM 1284 CB PRO A 84 -7.822 -2.400 -4.546 1.00 25.00 C ATOM 1285 CG PRO A 84 -8.256 -1.193 -5.306 1.00 25.00 C ATOM 1286 CD PRO A 84 -9.870 -1.329 -5.236 1.00 25.00 C ATOM 0 HA PRO A 84 -9.035 -3.675 -3.193 1.00 25.00 H new ATOM 0 HB2 PRO A 84 -6.830 -2.252 -4.119 1.00 25.00 H new ATOM 0 HB3 PRO A 84 -7.760 -3.268 -5.202 1.00 25.00 H new ATOM 0 HG2 PRO A 84 -7.902 -0.270 -4.847 1.00 25.00 H new ATOM 0 HG3 PRO A 84 -7.888 -1.200 -6.332 1.00 25.00 H new ATOM 0 HD2 PRO A 84 -10.355 -0.353 -5.250 1.00 25.00 H new ATOM 0 HD3 PRO A 84 -10.261 -1.891 -6.084 1.00 25.00 H new ATOM 1294 N GLN A 85 -7.639 -2.798 -1.362 1.00 25.00 N ATOM 1295 CA GLN A 85 -7.033 -2.358 -0.103 1.00 25.00 C ATOM 1296 C GLN A 85 -5.607 -1.865 -0.334 1.00 25.00 C ATOM 1297 O GLN A 85 -4.867 -2.435 -1.142 1.00 25.00 O ATOM 1298 CB GLN A 85 -7.040 -3.489 0.934 1.00 25.00 C ATOM 1299 CG GLN A 85 -8.438 -3.938 1.349 1.00 25.00 C ATOM 1300 CD GLN A 85 -8.434 -5.106 2.327 1.00 25.00 C ATOM 1301 OE1 GLN A 85 -8.328 -6.273 1.939 1.00 25.00 O ATOM 1302 NE2 GLN A 85 -8.552 -4.793 3.611 1.00 25.00 N ATOM 0 H GLN A 85 -7.458 -3.777 -1.585 1.00 25.00 H new ATOM 0 HA GLN A 85 -7.630 -1.532 0.284 1.00 25.00 H new ATOM 0 HB2 GLN A 85 -6.500 -4.344 0.528 1.00 25.00 H new ATOM 0 HB3 GLN A 85 -6.497 -3.160 1.820 1.00 25.00 H new ATOM 0 HG2 GLN A 85 -8.962 -3.096 1.802 1.00 25.00 H new ATOM 0 HG3 GLN A 85 -9.000 -4.221 0.459 1.00 25.00 H new ATOM 0 HE21 GLN A 85 -8.637 -3.816 3.892 1.00 25.00 H new ATOM 0 HE22 GLN A 85 -8.557 -5.529 4.317 1.00 25.00 H new ATOM 1311 N ARG A 86 -5.230 -0.810 0.391 1.00 25.00 N ATOM 1312 CA ARG A 86 -3.931 -0.156 0.203 1.00 25.00 C ATOM 1313 C ARG A 86 -3.052 -0.335 1.445 1.00 25.00 C ATOM 1314 O ARG A 86 -3.478 -0.033 2.565 1.00 25.00 O ATOM 1315 CB ARG A 86 -4.125 1.340 -0.099 1.00 25.00 C ATOM 1316 CG ARG A 86 -4.644 1.621 -1.506 1.00 25.00 C ATOM 1317 CD ARG A 86 -6.127 1.320 -1.639 1.00 25.00 C ATOM 1318 NE ARG A 86 -6.785 2.228 -2.586 1.00 25.00 N ATOM 1319 CZ ARG A 86 -7.994 2.784 -2.407 1.00 25.00 C ATOM 1320 NH1 ARG A 86 -8.702 2.554 -1.303 1.00 25.00 N ATOM 1321 NH2 ARG A 86 -8.492 3.581 -3.342 1.00 25.00 N ATOM 0 H ARG A 86 -5.808 -0.388 1.117 1.00 25.00 H new ATOM 0 HA ARG A 86 -3.431 -0.624 -0.645 1.00 25.00 H new ATOM 0 HB2 ARG A 86 -4.822 1.760 0.626 1.00 25.00 H new ATOM 0 HB3 ARG A 86 -3.174 1.855 0.037 1.00 25.00 H new ATOM 0 HG2 ARG A 86 -4.463 2.666 -1.757 1.00 25.00 H new ATOM 0 HG3 ARG A 86 -4.087 1.020 -2.224 1.00 25.00 H new ATOM 0 HD2 ARG A 86 -6.261 0.290 -1.970 1.00 25.00 H new ATOM 0 HD3 ARG A 86 -6.604 1.405 -0.663 1.00 25.00 H new ATOM 0 HE ARG A 86 -6.285 2.454 -3.446 1.00 25.00 H new ATOM 0 HH11 ARG A 86 -8.328 1.946 -0.575 1.00 25.00 H new ATOM 0 HH12 ARG A 86 -9.619 2.986 -1.186 1.00 25.00 H new ATOM 0 HH21 ARG A 86 -7.957 3.768 -4.190 1.00 25.00 H new ATOM 0 HH22 ARG A 86 -9.410 4.007 -3.213 1.00 25.00 H new ATOM 1335 N HIS A 87 -1.827 -0.832 1.234 1.00 25.00 N ATOM 1336 CA HIS A 87 -0.858 -1.044 2.317 1.00 25.00 C ATOM 1337 C HIS A 87 0.111 0.141 2.401 1.00 25.00 C ATOM 1338 O HIS A 87 0.935 0.341 1.504 1.00 25.00 O ATOM 1339 CB HIS A 87 -0.072 -2.349 2.084 1.00 25.00 C ATOM 1340 CG HIS A 87 -0.916 -3.586 1.978 1.00 25.00 C ATOM 1341 ND1 HIS A 87 -1.490 -4.201 3.070 1.00 25.00 N ATOM 1342 CD2 HIS A 87 -1.249 -4.344 0.905 1.00 25.00 C ATOM 1343 CE1 HIS A 87 -2.135 -5.285 2.676 1.00 25.00 C ATOM 1344 NE2 HIS A 87 -2.008 -5.392 1.366 1.00 25.00 N ATOM 0 H HIS A 87 -1.480 -1.098 0.312 1.00 25.00 H new ATOM 0 HA HIS A 87 -1.402 -1.124 3.258 1.00 25.00 H new ATOM 0 HB2 HIS A 87 0.512 -2.246 1.169 1.00 25.00 H new ATOM 0 HB3 HIS A 87 0.637 -2.480 2.902 1.00 25.00 H new ATOM 0 HD2 HIS A 87 -0.970 -4.159 -0.122 1.00 25.00 H new ATOM 0 HE1 HIS A 87 -2.674 -5.967 3.316 1.00 25.00 H new ATOM 0 HE2 HIS A 87 -2.408 -6.132 0.790 1.00 25.00 H new ATOM 1353 N MET A 88 0.019 0.916 3.489 1.00 25.00 N ATOM 1354 CA MET A 88 0.835 2.127 3.639 1.00 25.00 C ATOM 1355 C MET A 88 2.010 1.894 4.590 1.00 25.00 C ATOM 1356 O MET A 88 1.879 1.228 5.622 1.00 25.00 O ATOM 1357 CB MET A 88 -0.020 3.306 4.143 1.00 25.00 C ATOM 1358 CG MET A 88 -1.483 3.235 3.716 1.00 25.00 C ATOM 1359 SD MET A 88 -2.364 4.798 3.916 1.00 25.00 S ATOM 1360 CE MET A 88 -1.567 5.460 5.374 1.00 25.00 C ATOM 0 H MET A 88 -0.607 0.728 4.272 1.00 25.00 H new ATOM 0 HA MET A 88 1.233 2.374 2.655 1.00 25.00 H new ATOM 0 HB2 MET A 88 0.030 3.339 5.231 1.00 25.00 H new ATOM 0 HB3 MET A 88 0.411 4.238 3.776 1.00 25.00 H new ATOM 0 HG2 MET A 88 -1.535 2.928 2.671 1.00 25.00 H new ATOM 0 HG3 MET A 88 -1.987 2.465 4.300 1.00 25.00 H new ATOM 0 HE1 MET A 88 -2.053 6.392 5.663 1.00 25.00 H new ATOM 0 HE2 MET A 88 -1.646 4.741 6.190 1.00 25.00 H new ATOM 0 HE3 MET A 88 -0.516 5.651 5.159 1.00 25.00 H new ATOM 1370 N PHE A 89 3.152 2.460 4.205 1.00 25.00 N ATOM 1371 CA PHE A 89 4.355 2.483 5.034 1.00 25.00 C ATOM 1372 C PHE A 89 4.732 3.941 5.301 1.00 25.00 C ATOM 1373 O PHE A 89 4.224 4.831 4.624 1.00 25.00 O ATOM 1374 CB PHE A 89 5.520 1.767 4.323 1.00 25.00 C ATOM 1375 CG PHE A 89 5.321 0.285 4.101 1.00 25.00 C ATOM 1376 CD1 PHE A 89 4.793 -0.193 2.912 1.00 25.00 C ATOM 1377 CD2 PHE A 89 5.663 -0.624 5.090 1.00 25.00 C ATOM 1378 CE1 PHE A 89 4.616 -1.549 2.714 1.00 25.00 C ATOM 1379 CE2 PHE A 89 5.486 -1.979 4.901 1.00 25.00 C ATOM 1380 CZ PHE A 89 4.947 -2.434 3.675 1.00 25.00 C ATOM 0 H PHE A 89 3.269 2.919 3.302 1.00 25.00 H new ATOM 0 HA PHE A 89 4.158 1.964 5.972 1.00 25.00 H new ATOM 0 HB2 PHE A 89 5.684 2.245 3.357 1.00 25.00 H new ATOM 0 HB3 PHE A 89 6.427 1.912 4.909 1.00 25.00 H new ATOM 0 HD1 PHE A 89 4.517 0.501 2.132 1.00 25.00 H new ATOM 0 HD2 PHE A 89 6.074 -0.266 6.022 1.00 25.00 H new ATOM 0 HE1 PHE A 89 4.208 -1.904 1.779 1.00 25.00 H new ATOM 0 HE2 PHE A 89 5.755 -2.681 5.677 1.00 25.00 H new ATOM 0 HZ PHE A 89 4.801 -3.491 3.509 1.00 25.00 H new ATOM 1390 N SER A 90 5.600 4.191 6.288 1.00 25.00 N ATOM 1391 CA SER A 90 6.078 5.550 6.557 1.00 25.00 C ATOM 1392 C SER A 90 7.597 5.632 6.446 1.00 25.00 C ATOM 1393 O SER A 90 8.319 4.734 6.885 1.00 25.00 O ATOM 1394 CB SER A 90 5.594 6.049 7.916 1.00 25.00 C ATOM 1395 OG SER A 90 4.204 6.314 7.897 1.00 25.00 O ATOM 0 H SER A 90 5.982 3.477 6.908 1.00 25.00 H new ATOM 0 HA SER A 90 5.655 6.206 5.796 1.00 25.00 H new ATOM 0 HB2 SER A 90 5.815 5.304 8.680 1.00 25.00 H new ATOM 0 HB3 SER A 90 6.136 6.955 8.188 1.00 25.00 H new ATOM 0 HG SER A 90 3.919 6.630 8.780 1.00 25.00 H new ATOM 1401 N PHE A 91 8.058 6.731 5.853 1.00 25.00 N ATOM 1402 CA PHE A 91 9.465 6.906 5.472 1.00 25.00 C ATOM 1403 C PHE A 91 10.074 8.169 6.093 1.00 25.00 C ATOM 1404 O PHE A 91 9.392 8.920 6.793 1.00 25.00 O ATOM 1405 CB PHE A 91 9.566 6.971 3.941 1.00 25.00 C ATOM 1406 CG PHE A 91 9.489 5.628 3.256 1.00 25.00 C ATOM 1407 CD1 PHE A 91 8.377 4.811 3.405 1.00 25.00 C ATOM 1408 CD2 PHE A 91 10.531 5.189 2.453 1.00 25.00 C ATOM 1409 CE1 PHE A 91 8.311 3.587 2.767 1.00 25.00 C ATOM 1410 CE2 PHE A 91 10.466 3.964 1.815 1.00 25.00 C ATOM 1411 CZ PHE A 91 9.354 3.164 1.974 1.00 25.00 C ATOM 0 H PHE A 91 7.468 7.530 5.621 1.00 25.00 H new ATOM 0 HA PHE A 91 10.030 6.054 5.851 1.00 25.00 H new ATOM 0 HB2 PHE A 91 8.765 7.605 3.562 1.00 25.00 H new ATOM 0 HB3 PHE A 91 10.507 7.450 3.671 1.00 25.00 H new ATOM 0 HD1 PHE A 91 7.555 5.135 4.026 1.00 25.00 H new ATOM 0 HD2 PHE A 91 11.404 5.812 2.324 1.00 25.00 H new ATOM 0 HE1 PHE A 91 7.440 2.961 2.891 1.00 25.00 H new ATOM 0 HE2 PHE A 91 11.285 3.634 1.193 1.00 25.00 H new ATOM 0 HZ PHE A 91 9.301 2.207 1.477 1.00 25.00 H new ATOM 1421 N ASN A 92 11.381 8.366 5.853 1.00 25.00 N ATOM 1422 CA ASN A 92 12.097 9.557 6.318 1.00 25.00 C ATOM 1423 C ASN A 92 12.750 10.306 5.137 1.00 25.00 C ATOM 1424 O ASN A 92 13.101 11.482 5.266 1.00 25.00 O ATOM 1425 CB ASN A 92 13.159 9.154 7.359 1.00 25.00 C ATOM 1426 CG ASN A 92 12.571 8.494 8.598 1.00 25.00 C ATOM 1427 OD1 ASN A 92 11.935 9.152 9.422 1.00 25.00 O ATOM 1428 ND2 ASN A 92 12.779 7.189 8.732 1.00 25.00 N ATOM 0 H ASN A 92 11.963 7.708 5.335 1.00 25.00 H new ATOM 0 HA ASN A 92 11.381 10.233 6.785 1.00 25.00 H new ATOM 0 HB2 ASN A 92 13.870 8.471 6.895 1.00 25.00 H new ATOM 0 HB3 ASN A 92 13.718 10.041 7.659 1.00 25.00 H new ATOM 0 HD21 ASN A 92 12.406 6.694 9.542 1.00 25.00 H new ATOM 0 HD22 ASN A 92 13.312 6.682 8.025 1.00 25.00 H new ATOM 1435 N ASN A 93 12.906 9.614 3.992 1.00 25.00 N ATOM 1436 CA ASN A 93 13.546 10.188 2.798 1.00 25.00 C ATOM 1437 C ASN A 93 12.821 9.753 1.521 1.00 25.00 C ATOM 1438 O ASN A 93 12.341 8.618 1.426 1.00 25.00 O ATOM 1439 CB ASN A 93 15.022 9.763 2.717 1.00 25.00 C ATOM 1440 CG ASN A 93 15.816 10.554 1.692 1.00 25.00 C ATOM 1441 OD1 ASN A 93 15.245 11.206 0.816 1.00 25.00 O ATOM 1442 ND2 ASN A 93 17.139 10.497 1.793 1.00 25.00 N ATOM 0 H ASN A 93 12.594 8.650 3.871 1.00 25.00 H new ATOM 0 HA ASN A 93 13.487 11.273 2.884 1.00 25.00 H new ATOM 0 HB2 ASN A 93 15.483 9.885 3.697 1.00 25.00 H new ATOM 0 HB3 ASN A 93 15.075 8.703 2.469 1.00 25.00 H new ATOM 0 HD21 ASN A 93 17.724 11.006 1.130 1.00 25.00 H new ATOM 0 HD22 ASN A 93 17.571 9.945 2.534 1.00 25.00 H new ATOM 1449 N ARG A 94 12.750 10.672 0.543 1.00 25.00 N ATOM 1450 CA ARG A 94 12.078 10.420 -0.745 1.00 25.00 C ATOM 1451 C ARG A 94 12.940 9.604 -1.708 1.00 25.00 C ATOM 1452 O ARG A 94 12.425 9.028 -2.672 1.00 25.00 O ATOM 1453 CB ARG A 94 11.678 11.738 -1.424 1.00 25.00 C ATOM 1454 CG ARG A 94 12.853 12.560 -1.946 1.00 25.00 C ATOM 1455 CD ARG A 94 12.409 13.870 -2.584 1.00 25.00 C ATOM 1456 NE ARG A 94 13.527 14.599 -3.200 1.00 25.00 N ATOM 1457 CZ ARG A 94 13.954 14.424 -4.459 1.00 25.00 C ATOM 1458 NH1 ARG A 94 13.370 13.543 -5.272 1.00 25.00 N ATOM 1459 NH2 ARG A 94 14.976 15.139 -4.909 1.00 25.00 N ATOM 0 H ARG A 94 13.154 11.605 0.621 1.00 25.00 H new ATOM 0 HA ARG A 94 11.186 9.838 -0.512 1.00 25.00 H new ATOM 0 HB2 ARG A 94 11.008 11.516 -2.255 1.00 25.00 H new ATOM 0 HB3 ARG A 94 11.115 12.343 -0.713 1.00 25.00 H new ATOM 0 HG2 ARG A 94 13.537 12.773 -1.124 1.00 25.00 H new ATOM 0 HG3 ARG A 94 13.407 11.972 -2.678 1.00 25.00 H new ATOM 0 HD2 ARG A 94 11.652 13.664 -3.341 1.00 25.00 H new ATOM 0 HD3 ARG A 94 11.941 14.500 -1.827 1.00 25.00 H new ATOM 0 HE ARG A 94 14.014 15.289 -2.628 1.00 25.00 H new ATOM 0 HH11 ARG A 94 12.582 12.986 -4.940 1.00 25.00 H new ATOM 0 HH12 ARG A 94 13.711 13.426 -6.226 1.00 25.00 H new ATOM 0 HH21 ARG A 94 15.432 15.817 -4.299 1.00 25.00 H new ATOM 0 HH22 ARG A 94 15.306 15.011 -5.866 1.00 25.00 H new ATOM 1473 N THR A 95 14.252 9.564 -1.444 1.00 25.00 N ATOM 1474 CA THR A 95 15.196 8.824 -2.287 1.00 25.00 C ATOM 1475 C THR A 95 15.093 7.310 -2.036 1.00 25.00 C ATOM 1476 O THR A 95 15.379 6.517 -2.934 1.00 25.00 O ATOM 1477 CB THR A 95 16.654 9.306 -2.052 1.00 25.00 C ATOM 1478 OG1 THR A 95 17.004 9.144 -0.671 1.00 25.00 O ATOM 1479 CG2 THR A 95 16.836 10.777 -2.434 1.00 25.00 C ATOM 0 H THR A 95 14.684 10.037 -0.650 1.00 25.00 H new ATOM 0 HA THR A 95 14.930 9.022 -3.325 1.00 25.00 H new ATOM 0 HB THR A 95 17.302 8.700 -2.685 1.00 25.00 H new ATOM 0 HG1 THR A 95 17.925 9.449 -0.529 1.00 25.00 H new ATOM 0 HG21 THR A 95 17.869 11.074 -2.255 1.00 25.00 H new ATOM 0 HG22 THR A 95 16.598 10.911 -3.489 1.00 25.00 H new ATOM 0 HG23 THR A 95 16.171 11.395 -1.831 1.00 25.00 H new ATOM 1487 N VAL A 96 14.668 6.921 -0.821 1.00 25.00 N ATOM 1488 CA VAL A 96 14.457 5.502 -0.488 1.00 25.00 C ATOM 1489 C VAL A 96 13.158 5.006 -1.143 1.00 25.00 C ATOM 1490 O VAL A 96 13.211 4.122 -1.986 1.00 25.00 O ATOM 1491 CB VAL A 96 14.420 5.231 1.054 1.00 25.00 C ATOM 1492 CG1 VAL A 96 14.231 3.739 1.353 1.00 25.00 C ATOM 1493 CG2 VAL A 96 15.687 5.730 1.741 1.00 25.00 C ATOM 0 H VAL A 96 14.465 7.566 -0.057 1.00 25.00 H new ATOM 0 HA VAL A 96 15.312 4.951 -0.880 1.00 25.00 H new ATOM 0 HB VAL A 96 13.567 5.783 1.450 1.00 25.00 H new ATOM 0 HG11 VAL A 96 14.210 3.584 2.432 1.00 25.00 H new ATOM 0 HG12 VAL A 96 13.292 3.397 0.918 1.00 25.00 H new ATOM 0 HG13 VAL A 96 15.057 3.174 0.922 1.00 25.00 H new ATOM 0 HG21 VAL A 96 15.626 5.525 2.810 1.00 25.00 H new ATOM 0 HG22 VAL A 96 16.554 5.218 1.322 1.00 25.00 H new ATOM 0 HG23 VAL A 96 15.788 6.804 1.583 1.00 25.00 H new ATOM 1503 N MET A 97 12.009 5.624 -0.784 1.00 25.00 N ATOM 1504 CA MET A 97 10.678 5.239 -1.325 1.00 25.00 C ATOM 1505 C MET A 97 10.681 5.091 -2.853 1.00 25.00 C ATOM 1506 O MET A 97 10.073 4.164 -3.380 1.00 25.00 O ATOM 1507 CB MET A 97 9.586 6.245 -0.898 1.00 25.00 C ATOM 1508 CG MET A 97 9.760 7.653 -1.445 1.00 25.00 C ATOM 1509 SD MET A 97 8.437 8.787 -0.963 1.00 25.00 S ATOM 1510 CE MET A 97 8.718 8.959 0.799 1.00 25.00 C ATOM 0 H MET A 97 11.974 6.396 -0.118 1.00 25.00 H new ATOM 0 HA MET A 97 10.450 4.262 -0.898 1.00 25.00 H new ATOM 0 HB2 MET A 97 8.617 5.864 -1.219 1.00 25.00 H new ATOM 0 HB3 MET A 97 9.564 6.294 0.191 1.00 25.00 H new ATOM 0 HG2 MET A 97 10.713 8.053 -1.099 1.00 25.00 H new ATOM 0 HG3 MET A 97 9.809 7.607 -2.533 1.00 25.00 H new ATOM 0 HE1 MET A 97 8.374 9.939 1.128 1.00 25.00 H new ATOM 0 HE2 MET A 97 8.168 8.183 1.332 1.00 25.00 H new ATOM 0 HE3 MET A 97 9.783 8.859 1.009 1.00 25.00 H new ATOM 1520 N ASP A 98 11.375 6.006 -3.547 1.00 25.00 N ATOM 1521 CA ASP A 98 11.510 5.939 -5.013 1.00 25.00 C ATOM 1522 C ASP A 98 12.440 4.791 -5.452 1.00 25.00 C ATOM 1523 O ASP A 98 12.375 4.348 -6.602 1.00 25.00 O ATOM 1524 CB ASP A 98 12.038 7.279 -5.548 1.00 25.00 C ATOM 1525 CG ASP A 98 10.988 8.379 -5.542 1.00 25.00 C ATOM 1526 OD1 ASP A 98 9.795 8.058 -5.361 1.00 25.00 O ATOM 1527 OD2 ASP A 98 11.361 9.558 -5.716 1.00 25.00 O ATOM 0 H ASP A 98 11.851 6.800 -3.119 1.00 25.00 H new ATOM 0 HA ASP A 98 10.523 5.740 -5.430 1.00 25.00 H new ATOM 0 HB2 ASP A 98 12.889 7.594 -4.945 1.00 25.00 H new ATOM 0 HB3 ASP A 98 12.403 7.139 -6.565 1.00 25.00 H new ATOM 1532 N ASN A 99 13.299 4.325 -4.535 1.00 25.00 N ATOM 1533 CA ASN A 99 14.175 3.173 -4.787 1.00 25.00 C ATOM 1534 C ASN A 99 13.472 1.845 -4.459 1.00 25.00 C ATOM 1535 O ASN A 99 13.789 0.815 -5.061 1.00 25.00 O ATOM 1536 CB ASN A 99 15.485 3.302 -3.991 1.00 25.00 C ATOM 1537 CG ASN A 99 16.670 3.734 -4.846 1.00 25.00 C ATOM 1538 OD1 ASN A 99 17.060 3.049 -5.793 1.00 25.00 O ATOM 1539 ND2 ASN A 99 17.262 4.870 -4.496 1.00 25.00 N ATOM 0 H ASN A 99 13.406 4.732 -3.606 1.00 25.00 H new ATOM 0 HA ASN A 99 14.413 3.168 -5.851 1.00 25.00 H new ATOM 0 HB2 ASN A 99 15.344 4.024 -3.187 1.00 25.00 H new ATOM 0 HB3 ASN A 99 15.713 2.344 -3.523 1.00 25.00 H new ATOM 0 HD21 ASN A 99 18.072 5.205 -5.018 1.00 25.00 H new ATOM 0 HD22 ASN A 99 16.907 5.407 -3.705 1.00 25.00 H new ATOM 1546 N ILE A 100 12.518 1.876 -3.506 1.00 25.00 N ATOM 1547 CA ILE A 100 11.664 0.711 -3.216 1.00 25.00 C ATOM 1548 C ILE A 100 10.540 0.631 -4.275 1.00 25.00 C ATOM 1549 O ILE A 100 10.388 -0.394 -4.940 1.00 25.00 O ATOM 1550 CB ILE A 100 11.046 0.759 -1.764 1.00 25.00 C ATOM 1551 CG1 ILE A 100 12.127 0.795 -0.643 1.00 25.00 C ATOM 1552 CG2 ILE A 100 10.085 -0.413 -1.505 1.00 25.00 C ATOM 1553 CD1 ILE A 100 13.083 -0.395 -0.570 1.00 25.00 C ATOM 0 H ILE A 100 12.322 2.693 -2.927 1.00 25.00 H new ATOM 0 HA ILE A 100 12.289 -0.181 -3.260 1.00 25.00 H new ATOM 0 HB ILE A 100 10.487 1.694 -1.726 1.00 25.00 H new ATOM 0 HG12 ILE A 100 12.720 1.700 -0.772 1.00 25.00 H new ATOM 0 HG13 ILE A 100 11.618 0.882 0.317 1.00 25.00 H new ATOM 0 HG21 ILE A 100 9.684 -0.338 -0.494 1.00 25.00 H new ATOM 0 HG22 ILE A 100 9.266 -0.378 -2.223 1.00 25.00 H new ATOM 0 HG23 ILE A 100 10.622 -1.355 -1.614 1.00 25.00 H new ATOM 0 HD11 ILE A 100 13.785 -0.248 0.251 1.00 25.00 H new ATOM 0 HD12 ILE A 100 12.514 -1.309 -0.401 1.00 25.00 H new ATOM 0 HD13 ILE A 100 13.633 -0.478 -1.507 1.00 25.00 H new ATOM 1565 N LYS A 101 9.784 1.742 -4.431 1.00 25.00 N ATOM 1566 CA LYS A 101 8.698 1.875 -5.425 1.00 25.00 C ATOM 1567 C LYS A 101 9.144 1.473 -6.835 1.00 25.00 C ATOM 1568 O LYS A 101 8.401 0.799 -7.542 1.00 25.00 O ATOM 1569 CB LYS A 101 8.186 3.316 -5.427 1.00 25.00 C ATOM 1570 CG LYS A 101 7.035 3.566 -6.398 1.00 25.00 C ATOM 1571 CD LYS A 101 6.666 5.045 -6.494 1.00 25.00 C ATOM 1572 CE LYS A 101 5.505 5.304 -7.450 1.00 25.00 C ATOM 1573 NZ LYS A 101 5.129 6.745 -7.486 1.00 25.00 N ATOM 0 H LYS A 101 9.914 2.579 -3.863 1.00 25.00 H new ATOM 0 HA LYS A 101 7.899 1.192 -5.137 1.00 25.00 H new ATOM 0 HB2 LYS A 101 7.861 3.576 -4.420 1.00 25.00 H new ATOM 0 HB3 LYS A 101 9.011 3.983 -5.678 1.00 25.00 H new ATOM 0 HG2 LYS A 101 7.310 3.198 -7.386 1.00 25.00 H new ATOM 0 HG3 LYS A 101 6.163 2.997 -6.078 1.00 25.00 H new ATOM 0 HD2 LYS A 101 6.404 5.414 -5.503 1.00 25.00 H new ATOM 0 HD3 LYS A 101 7.537 5.611 -6.825 1.00 25.00 H new ATOM 0 HE2 LYS A 101 5.779 4.975 -8.452 1.00 25.00 H new ATOM 0 HE3 LYS A 101 4.643 4.711 -7.144 1.00 25.00 H new ATOM 0 HZ1 LYS A 101 4.337 6.881 -8.146 1.00 25.00 H new ATOM 0 HZ2 LYS A 101 4.843 7.053 -6.535 1.00 25.00 H new ATOM 0 HZ3 LYS A 101 5.944 7.309 -7.802 1.00 25.00 H new ATOM 1587 N MET A 102 10.358 1.885 -7.225 1.00 25.00 N ATOM 1588 CA MET A 102 10.947 1.498 -8.516 1.00 25.00 C ATOM 1589 C MET A 102 11.026 -0.028 -8.655 1.00 25.00 C ATOM 1590 O MET A 102 10.424 -0.582 -9.572 1.00 25.00 O ATOM 1591 CB MET A 102 12.313 2.153 -8.678 1.00 25.00 C ATOM 1592 CG MET A 102 13.022 1.833 -10.000 1.00 25.00 C ATOM 1593 SD MET A 102 14.657 2.593 -10.177 1.00 25.00 S ATOM 1594 CE MET A 102 15.602 1.795 -8.882 1.00 25.00 C ATOM 0 H MET A 102 10.955 2.490 -6.661 1.00 25.00 H new ATOM 0 HA MET A 102 10.301 1.854 -9.319 1.00 25.00 H new ATOM 0 HB2 MET A 102 12.195 3.234 -8.596 1.00 25.00 H new ATOM 0 HB3 MET A 102 12.952 1.839 -7.853 1.00 25.00 H new ATOM 0 HG2 MET A 102 13.126 0.752 -10.090 1.00 25.00 H new ATOM 0 HG3 MET A 102 12.391 2.162 -10.825 1.00 25.00 H new ATOM 0 HE1 MET A 102 16.662 2.011 -9.019 1.00 25.00 H new ATOM 0 HE2 MET A 102 15.278 2.170 -7.911 1.00 25.00 H new ATOM 0 HE3 MET A 102 15.443 0.718 -8.927 1.00 25.00 H new ATOM 1604 N THR A 103 11.742 -0.700 -7.729 1.00 25.00 N ATOM 1605 CA THR A 103 11.845 -2.172 -7.733 1.00 25.00 C ATOM 1606 C THR A 103 10.445 -2.797 -7.812 1.00 25.00 C ATOM 1607 O THR A 103 10.136 -3.469 -8.787 1.00 25.00 O ATOM 1608 CB THR A 103 12.601 -2.708 -6.488 1.00 25.00 C ATOM 1609 OG1 THR A 103 13.878 -2.073 -6.390 1.00 25.00 O ATOM 1610 CG2 THR A 103 12.808 -4.225 -6.557 1.00 25.00 C ATOM 0 H THR A 103 12.255 -0.247 -6.972 1.00 25.00 H new ATOM 0 HA THR A 103 12.422 -2.458 -8.612 1.00 25.00 H new ATOM 0 HB THR A 103 11.992 -2.483 -5.612 1.00 25.00 H new ATOM 0 HG1 THR A 103 13.772 -1.185 -5.989 1.00 25.00 H new ATOM 0 HG21 THR A 103 13.341 -4.560 -5.667 1.00 25.00 H new ATOM 0 HG22 THR A 103 11.839 -4.722 -6.609 1.00 25.00 H new ATOM 0 HG23 THR A 103 13.391 -4.473 -7.444 1.00 25.00 H new ATOM 1618 N LEU A 104 9.593 -2.476 -6.818 1.00 25.00 N ATOM 1619 CA LEU A 104 8.179 -2.892 -6.780 1.00 25.00 C ATOM 1620 C LEU A 104 7.529 -2.726 -8.156 1.00 25.00 C ATOM 1621 O LEU A 104 7.107 -3.700 -8.766 1.00 25.00 O ATOM 1622 CB LEU A 104 7.422 -2.019 -5.752 1.00 25.00 C ATOM 1623 CG LEU A 104 7.840 -2.155 -4.279 1.00 25.00 C ATOM 1624 CD1 LEU A 104 7.101 -1.143 -3.414 1.00 25.00 C ATOM 1625 CD2 LEU A 104 7.565 -3.543 -3.736 1.00 25.00 C ATOM 0 H LEU A 104 9.871 -1.916 -6.012 1.00 25.00 H new ATOM 0 HA LEU A 104 8.130 -3.943 -6.494 1.00 25.00 H new ATOM 0 HB2 LEU A 104 7.539 -0.975 -6.042 1.00 25.00 H new ATOM 0 HB3 LEU A 104 6.360 -2.253 -5.826 1.00 25.00 H new ATOM 0 HG LEU A 104 8.913 -1.969 -4.243 1.00 25.00 H new ATOM 0 HD11 LEU A 104 7.412 -1.257 -2.375 1.00 25.00 H new ATOM 0 HD12 LEU A 104 7.334 -0.134 -3.754 1.00 25.00 H new ATOM 0 HD13 LEU A 104 6.027 -1.313 -3.492 1.00 25.00 H new ATOM 0 HD21 LEU A 104 7.876 -3.594 -2.692 1.00 25.00 H new ATOM 0 HD22 LEU A 104 6.499 -3.757 -3.808 1.00 25.00 H new ATOM 0 HD23 LEU A 104 8.123 -4.278 -4.317 1.00 25.00 H new ATOM 1637 N GLN A 105 7.537 -1.486 -8.658 1.00 25.00 N ATOM 1638 CA GLN A 105 6.989 -1.148 -9.989 1.00 25.00 C ATOM 1639 C GLN A 105 7.606 -1.989 -11.125 1.00 25.00 C ATOM 1640 O GLN A 105 6.934 -2.270 -12.122 1.00 25.00 O ATOM 1641 CB GLN A 105 7.203 0.343 -10.295 1.00 25.00 C ATOM 1642 CG GLN A 105 6.505 0.836 -11.555 1.00 25.00 C ATOM 1643 CD GLN A 105 6.548 2.348 -11.693 1.00 25.00 C ATOM 1644 OE1 GLN A 105 7.099 3.044 -10.839 1.00 25.00 O ATOM 1645 NE2 GLN A 105 5.965 2.863 -12.770 1.00 25.00 N ATOM 0 H GLN A 105 7.922 -0.685 -8.158 1.00 25.00 H new ATOM 0 HA GLN A 105 5.924 -1.377 -9.947 1.00 25.00 H new ATOM 0 HB2 GLN A 105 6.850 0.929 -9.447 1.00 25.00 H new ATOM 0 HB3 GLN A 105 8.272 0.531 -10.390 1.00 25.00 H new ATOM 0 HG2 GLN A 105 6.975 0.382 -12.427 1.00 25.00 H new ATOM 0 HG3 GLN A 105 5.466 0.505 -11.544 1.00 25.00 H new ATOM 0 HE21 GLN A 105 5.520 2.249 -13.452 1.00 25.00 H new ATOM 0 HE22 GLN A 105 5.962 3.873 -12.915 1.00 25.00 H new ATOM 1654 N GLN A 106 8.883 -2.383 -10.964 1.00 25.00 N ATOM 1655 CA GLN A 106 9.573 -3.239 -11.936 1.00 25.00 C ATOM 1656 C GLN A 106 9.161 -4.712 -11.776 1.00 25.00 C ATOM 1657 O GLN A 106 9.311 -5.512 -12.704 1.00 25.00 O ATOM 1658 CB GLN A 106 11.090 -3.085 -11.793 1.00 25.00 C ATOM 1659 CG GLN A 106 11.632 -1.716 -12.220 1.00 25.00 C ATOM 1660 CD GLN A 106 11.306 -1.346 -13.662 1.00 25.00 C ATOM 1661 OE1 GLN A 106 11.496 -2.147 -14.577 1.00 25.00 O ATOM 1662 NE2 GLN A 106 10.812 -0.130 -13.864 1.00 25.00 N ATOM 0 H GLN A 106 9.457 -2.118 -10.164 1.00 25.00 H new ATOM 0 HA GLN A 106 9.279 -2.920 -12.936 1.00 25.00 H new ATOM 0 HB2 GLN A 106 11.364 -3.262 -10.753 1.00 25.00 H new ATOM 0 HB3 GLN A 106 11.579 -3.857 -12.387 1.00 25.00 H new ATOM 0 HG2 GLN A 106 11.224 -0.952 -11.558 1.00 25.00 H new ATOM 0 HG3 GLN A 106 12.714 -1.707 -12.089 1.00 25.00 H new ATOM 0 HE21 GLN A 106 10.671 0.501 -13.075 1.00 25.00 H new ATOM 0 HE22 GLN A 106 10.573 0.173 -14.808 1.00 25.00 H new ATOM 1671 N ILE A 107 8.642 -5.049 -10.584 1.00 25.00 N ATOM 1672 CA ILE A 107 8.153 -6.397 -10.268 1.00 25.00 C ATOM 1673 C ILE A 107 6.683 -6.594 -10.719 1.00 25.00 C ATOM 1674 O ILE A 107 6.347 -7.645 -11.269 1.00 25.00 O ATOM 1675 CB ILE A 107 8.317 -6.701 -8.734 1.00 25.00 C ATOM 1676 CG1 ILE A 107 9.824 -6.680 -8.345 1.00 25.00 C ATOM 1677 CG2 ILE A 107 7.656 -8.032 -8.354 1.00 25.00 C ATOM 1678 CD1 ILE A 107 10.140 -6.665 -6.850 1.00 25.00 C ATOM 0 H ILE A 107 8.550 -4.390 -9.811 1.00 25.00 H new ATOM 0 HA ILE A 107 8.761 -7.108 -10.827 1.00 25.00 H new ATOM 0 HB ILE A 107 7.806 -5.921 -8.170 1.00 25.00 H new ATOM 0 HG12 ILE A 107 10.303 -7.554 -8.787 1.00 25.00 H new ATOM 0 HG13 ILE A 107 10.282 -5.802 -8.800 1.00 25.00 H new ATOM 0 HG21 ILE A 107 7.788 -8.212 -7.287 1.00 25.00 H new ATOM 0 HG22 ILE A 107 6.592 -7.989 -8.586 1.00 25.00 H new ATOM 0 HG23 ILE A 107 8.118 -8.842 -8.918 1.00 25.00 H new ATOM 0 HD11 ILE A 107 11.220 -6.651 -6.707 1.00 25.00 H new ATOM 0 HD12 ILE A 107 9.702 -5.777 -6.394 1.00 25.00 H new ATOM 0 HD13 ILE A 107 9.723 -7.556 -6.381 1.00 25.00 H new ATOM 1690 N ILE A 108 5.821 -5.586 -10.484 1.00 25.00 N ATOM 1691 CA ILE A 108 4.381 -5.682 -10.823 1.00 25.00 C ATOM 1692 C ILE A 108 4.163 -5.634 -12.338 1.00 25.00 C ATOM 1693 O ILE A 108 3.269 -6.299 -12.860 1.00 25.00 O ATOM 1694 CB ILE A 108 3.540 -4.566 -10.125 1.00 25.00 C ATOM 1695 CG1 ILE A 108 3.700 -4.691 -8.612 1.00 25.00 C ATOM 1696 CG2 ILE A 108 2.051 -4.671 -10.493 1.00 25.00 C ATOM 1697 CD1 ILE A 108 3.244 -3.489 -7.822 1.00 25.00 C ATOM 0 H ILE A 108 6.092 -4.698 -10.062 1.00 25.00 H new ATOM 0 HA ILE A 108 4.035 -6.646 -10.450 1.00 25.00 H new ATOM 0 HB ILE A 108 3.904 -3.597 -10.467 1.00 25.00 H new ATOM 0 HG12 ILE A 108 3.141 -5.563 -8.273 1.00 25.00 H new ATOM 0 HG13 ILE A 108 4.750 -4.878 -8.387 1.00 25.00 H new ATOM 0 HG21 ILE A 108 1.495 -3.880 -9.990 1.00 25.00 H new ATOM 0 HG22 ILE A 108 1.935 -4.567 -11.572 1.00 25.00 H new ATOM 0 HG23 ILE A 108 1.666 -5.641 -10.178 1.00 25.00 H new ATOM 0 HD11 ILE A 108 3.397 -3.673 -6.759 1.00 25.00 H new ATOM 0 HD12 ILE A 108 3.819 -2.614 -8.126 1.00 25.00 H new ATOM 0 HD13 ILE A 108 2.185 -3.310 -8.010 1.00 25.00 H new ATOM 1709 N SER A 109 4.992 -4.842 -13.022 1.00 25.00 N ATOM 1710 CA SER A 109 4.974 -4.750 -14.495 1.00 25.00 C ATOM 1711 C SER A 109 5.317 -6.100 -15.158 1.00 25.00 C ATOM 1712 O SER A 109 5.013 -6.318 -16.334 1.00 25.00 O ATOM 1713 CB SER A 109 5.939 -3.658 -14.968 1.00 25.00 C ATOM 1714 OG SER A 109 7.287 -3.996 -14.682 1.00 25.00 O ATOM 0 H SER A 109 5.693 -4.247 -12.580 1.00 25.00 H new ATOM 0 HA SER A 109 3.961 -4.487 -14.799 1.00 25.00 H new ATOM 0 HB2 SER A 109 5.821 -3.506 -16.041 1.00 25.00 H new ATOM 0 HB3 SER A 109 5.689 -2.715 -14.483 1.00 25.00 H new ATOM 0 HG SER A 109 7.878 -3.280 -14.997 1.00 25.00 H new ATOM 1720 N ARG A 110 5.953 -6.996 -14.380 1.00 25.00 N ATOM 1721 CA ARG A 110 6.209 -8.384 -14.806 1.00 25.00 C ATOM 1722 C ARG A 110 4.941 -9.239 -14.691 1.00 25.00 C ATOM 1723 O ARG A 110 4.629 -10.027 -15.587 1.00 25.00 O ATOM 1724 CB ARG A 110 7.322 -9.014 -13.968 1.00 25.00 C ATOM 1725 CG ARG A 110 8.698 -8.438 -14.248 1.00 25.00 C ATOM 1726 CD ARG A 110 9.741 -9.033 -13.324 1.00 25.00 C ATOM 1727 NE ARG A 110 11.086 -8.494 -13.574 1.00 25.00 N ATOM 1728 CZ ARG A 110 12.119 -8.583 -12.721 1.00 25.00 C ATOM 1729 NH1 ARG A 110 11.990 -9.185 -11.539 1.00 25.00 N ATOM 1730 NH2 ARG A 110 13.291 -8.063 -13.057 1.00 25.00 N ATOM 0 H ARG A 110 6.301 -6.780 -13.446 1.00 25.00 H new ATOM 0 HA ARG A 110 6.521 -8.352 -15.850 1.00 25.00 H new ATOM 0 HB2 ARG A 110 7.090 -8.879 -12.912 1.00 25.00 H new ATOM 0 HB3 ARG A 110 7.342 -10.088 -14.156 1.00 25.00 H new ATOM 0 HG2 ARG A 110 8.973 -8.634 -15.284 1.00 25.00 H new ATOM 0 HG3 ARG A 110 8.674 -7.355 -14.124 1.00 25.00 H new ATOM 0 HD2 ARG A 110 9.460 -8.836 -12.289 1.00 25.00 H new ATOM 0 HD3 ARG A 110 9.758 -10.116 -13.449 1.00 25.00 H new ATOM 0 HE ARG A 110 11.246 -8.017 -14.461 1.00 25.00 H new ATOM 0 HH11 ARG A 110 11.094 -9.589 -11.268 1.00 25.00 H new ATOM 0 HH12 ARG A 110 12.788 -9.242 -10.906 1.00 25.00 H new ATOM 0 HH21 ARG A 110 13.404 -7.599 -13.958 1.00 25.00 H new ATOM 0 HH22 ARG A 110 14.080 -8.127 -12.414 1.00 25.00 H new ATOM 1744 N TYR A 111 4.223 -9.065 -13.570 1.00 25.00 N ATOM 1745 CA TYR A 111 2.932 -9.740 -13.332 1.00 25.00 C ATOM 1746 C TYR A 111 1.779 -8.997 -14.023 1.00 25.00 C ATOM 1747 O TYR A 111 0.624 -9.434 -13.980 1.00 25.00 O ATOM 1748 CB TYR A 111 2.659 -9.857 -11.827 1.00 25.00 C ATOM 1749 CG TYR A 111 3.729 -10.630 -11.078 1.00 25.00 C ATOM 1750 CD1 TYR A 111 4.684 -9.970 -10.316 1.00 25.00 C ATOM 1751 CD2 TYR A 111 3.787 -12.020 -11.146 1.00 25.00 C ATOM 1752 CE1 TYR A 111 5.664 -10.670 -9.644 1.00 25.00 C ATOM 1753 CE2 TYR A 111 4.764 -12.725 -10.476 1.00 25.00 C ATOM 1754 CZ TYR A 111 5.671 -12.039 -9.685 1.00 25.00 C ATOM 1755 OH TYR A 111 6.678 -12.743 -9.064 1.00 25.00 O ATOM 0 H TYR A 111 4.517 -8.457 -12.806 1.00 25.00 H new ATOM 0 HA TYR A 111 2.995 -10.740 -13.760 1.00 25.00 H new ATOM 0 HB2 TYR A 111 2.579 -8.857 -11.401 1.00 25.00 H new ATOM 0 HB3 TYR A 111 1.696 -10.346 -11.677 1.00 25.00 H new ATOM 0 HD1 TYR A 111 4.659 -8.892 -10.249 1.00 25.00 H new ATOM 0 HD2 TYR A 111 3.055 -12.554 -11.733 1.00 25.00 H new ATOM 0 HE1 TYR A 111 6.423 -10.141 -9.087 1.00 25.00 H new ATOM 0 HE2 TYR A 111 4.822 -13.800 -10.567 1.00 25.00 H new ATOM 0 HH TYR A 111 7.501 -12.211 -9.069 1.00 25.00 H new ATOM 1765 N LYS A 112 2.126 -7.878 -14.666 1.00 25.00 N ATOM 1766 CA LYS A 112 1.181 -7.057 -15.417 1.00 25.00 C ATOM 1767 C LYS A 112 1.088 -7.552 -16.866 1.00 25.00 C ATOM 1768 O LYS A 112 0.068 -7.366 -17.537 1.00 25.00 O ATOM 1769 CB LYS A 112 1.656 -5.600 -15.372 1.00 25.00 C ATOM 1770 CG LYS A 112 0.862 -4.646 -16.265 1.00 25.00 C ATOM 1771 CD LYS A 112 -0.608 -4.493 -15.831 1.00 25.00 C ATOM 1772 CE LYS A 112 -1.470 -3.760 -16.863 1.00 25.00 C ATOM 1773 NZ LYS A 112 -1.663 -4.559 -18.102 1.00 25.00 N ATOM 0 H LYS A 112 3.080 -7.516 -14.678 1.00 25.00 H new ATOM 0 HA LYS A 112 0.188 -7.129 -14.973 1.00 25.00 H new ATOM 0 HB2 LYS A 112 1.601 -5.245 -14.343 1.00 25.00 H new ATOM 0 HB3 LYS A 112 2.705 -5.564 -15.666 1.00 25.00 H new ATOM 0 HG2 LYS A 112 1.341 -3.667 -16.256 1.00 25.00 H new ATOM 0 HG3 LYS A 112 0.895 -5.008 -17.293 1.00 25.00 H new ATOM 0 HD2 LYS A 112 -1.031 -5.481 -15.650 1.00 25.00 H new ATOM 0 HD3 LYS A 112 -0.646 -3.952 -14.886 1.00 25.00 H new ATOM 0 HE2 LYS A 112 -2.442 -3.531 -16.425 1.00 25.00 H new ATOM 0 HE3 LYS A 112 -1.002 -2.809 -17.115 1.00 25.00 H new ATOM 0 HZ1 LYS A 112 -1.298 -4.028 -18.918 1.00 25.00 H new ATOM 0 HZ2 LYS A 112 -1.150 -5.460 -18.018 1.00 25.00 H new ATOM 0 HZ3 LYS A 112 -2.676 -4.749 -18.238 1.00 25.00 H new ATOM 1787 N ASP A 113 2.177 -8.185 -17.325 1.00 25.00 N ATOM 1788 CA ASP A 113 2.250 -8.808 -18.639 1.00 25.00 C ATOM 1789 C ASP A 113 1.927 -10.306 -18.568 1.00 25.00 C ATOM 1790 O ASP A 113 1.617 -10.931 -19.587 1.00 25.00 O ATOM 1791 CB ASP A 113 3.654 -8.606 -19.210 1.00 25.00 C ATOM 1792 CG ASP A 113 3.934 -7.163 -19.588 1.00 25.00 C ATOM 1793 OD1 ASP A 113 2.963 -6.394 -19.753 1.00 25.00 O ATOM 1794 OD2 ASP A 113 5.123 -6.803 -19.717 1.00 25.00 O ATOM 0 H ASP A 113 3.036 -8.276 -16.783 1.00 25.00 H new ATOM 0 HA ASP A 113 1.510 -8.339 -19.287 1.00 25.00 H new ATOM 0 HB2 ASP A 113 4.390 -8.934 -18.476 1.00 25.00 H new ATOM 0 HB3 ASP A 113 3.778 -9.238 -20.090 1.00 25.00 H new ATOM 1799 N ALA A 114 1.996 -10.868 -17.350 1.00 25.00 N ATOM 1800 CA ALA A 114 1.737 -12.296 -17.117 1.00 25.00 C ATOM 1801 C ALA A 114 0.239 -12.622 -17.052 1.00 25.00 C ATOM 1802 O ALA A 114 -0.150 -13.796 -17.046 1.00 25.00 O ATOM 1803 CB ALA A 114 2.432 -12.752 -15.841 1.00 25.00 C ATOM 0 H ALA A 114 2.231 -10.348 -16.505 1.00 25.00 H new ATOM 0 HA ALA A 114 2.143 -12.839 -17.970 1.00 25.00 H new ATOM 0 HB1 ALA A 114 2.234 -13.811 -15.677 1.00 25.00 H new ATOM 0 HB2 ALA A 114 3.506 -12.594 -15.936 1.00 25.00 H new ATOM 0 HB3 ALA A 114 2.054 -12.177 -14.995 1.00 25.00 H new ATOM 1809 N ASP A 115 -0.588 -11.574 -17.014 1.00 25.00 N ATOM 1810 CA ASP A 115 -2.042 -11.723 -16.932 1.00 25.00 C ATOM 1811 C ASP A 115 -2.710 -11.161 -18.197 1.00 25.00 C ATOM 1812 O ASP A 115 -2.839 -9.920 -18.307 1.00 25.00 O ATOM 1813 CB ASP A 115 -2.571 -11.035 -15.661 1.00 25.00 C ATOM 1814 CG ASP A 115 -4.064 -11.234 -15.444 1.00 25.00 C ATOM 1815 OD1 ASP A 115 -4.676 -12.012 -16.207 1.00 25.00 O ATOM 1816 OD2 ASP A 115 -4.617 -10.613 -14.511 1.00 25.00 O ATOM 1817 OXT ASP A 115 -3.098 -11.971 -19.065 1.00 25.00 O ATOM 0 H ASP A 115 -0.271 -10.605 -17.039 1.00 25.00 H new ATOM 0 HA ASP A 115 -2.291 -12.782 -16.870 1.00 25.00 H new ATOM 0 HB2 ASP A 115 -2.031 -11.421 -14.796 1.00 25.00 H new ATOM 0 HB3 ASP A 115 -2.359 -9.967 -15.719 1.00 25.00 H new TER 1822 ASP A 115 ATOM 1823 N GLY B 519 -31.172 -7.793 18.174 1.00 25.00 N ATOM 1824 CA GLY B 519 -31.168 -7.910 16.690 1.00 25.00 C ATOM 1825 C GLY B 519 -29.997 -7.188 16.054 1.00 25.00 C ATOM 1826 O GLY B 519 -30.035 -5.966 15.882 1.00 25.00 O ATOM 0 HA2 GLY B 519 -31.136 -8.963 16.412 1.00 25.00 H new ATOM 0 HA3 GLY B 519 -32.099 -7.504 16.294 1.00 25.00 H new ATOM 1832 N SER B 520 -28.954 -7.953 15.705 1.00 25.00 N ATOM 1833 CA SER B 520 -27.754 -7.399 15.074 1.00 25.00 C ATOM 1834 C SER B 520 -27.671 -7.805 13.588 1.00 25.00 C ATOM 1835 O SER B 520 -27.805 -8.992 13.272 1.00 25.00 O ATOM 1836 CB SER B 520 -26.496 -7.863 15.824 1.00 25.00 C ATOM 1837 OG SER B 520 -25.314 -7.504 15.126 1.00 25.00 O ATOM 0 H SER B 520 -28.920 -8.962 15.851 1.00 25.00 H new ATOM 0 HA SER B 520 -27.815 -6.312 15.125 1.00 25.00 H new ATOM 0 HB2 SER B 520 -26.481 -7.420 16.820 1.00 25.00 H new ATOM 0 HB3 SER B 520 -26.528 -8.944 15.956 1.00 25.00 H new ATOM 0 HG SER B 520 -24.531 -7.811 15.629 1.00 25.00 H new ATOM 1843 N PRO B 521 -27.455 -6.827 12.645 1.00 25.00 N ATOM 1844 CA PRO B 521 -27.382 -7.123 11.192 1.00 25.00 C ATOM 1845 C PRO B 521 -26.087 -7.838 10.762 1.00 25.00 C ATOM 1846 O PRO B 521 -26.032 -8.428 9.677 1.00 25.00 O ATOM 1847 CB PRO B 521 -27.472 -5.729 10.555 1.00 25.00 C ATOM 1848 CG PRO B 521 -26.974 -4.801 11.597 1.00 25.00 C ATOM 1849 CD PRO B 521 -27.289 -5.365 12.902 1.00 25.00 C ATOM 0 HA PRO B 521 -28.168 -7.813 10.887 1.00 25.00 H new ATOM 0 HB2 PRO B 521 -26.867 -5.668 9.650 1.00 25.00 H new ATOM 0 HB3 PRO B 521 -28.497 -5.490 10.270 1.00 25.00 H new ATOM 0 HG2 PRO B 521 -25.898 -4.658 11.495 1.00 25.00 H new ATOM 0 HG3 PRO B 521 -27.438 -3.821 11.485 1.00 25.00 H new ATOM 0 HD2 PRO B 521 -26.491 -5.176 13.620 1.00 25.00 H new ATOM 0 HD3 PRO B 521 -28.199 -4.928 13.315 1.00 25.00 H new ATOM 1857 N GLY B 522 -25.058 -7.775 11.619 1.00 25.00 N ATOM 1858 CA GLY B 522 -23.781 -8.410 11.324 1.00 25.00 C ATOM 1859 C GLY B 522 -22.610 -7.712 11.993 1.00 25.00 C ATOM 1860 O GLY B 522 -22.743 -6.577 12.463 1.00 25.00 O ATOM 0 H GLY B 522 -25.092 -7.291 12.516 1.00 25.00 H new ATOM 0 HA2 GLY B 522 -23.813 -9.450 11.650 1.00 25.00 H new ATOM 0 HA3 GLY B 522 -23.625 -8.419 10.245 1.00 25.00 H new ATOM 1864 N TYR B 523 -21.462 -8.397 12.033 1.00 25.00 N ATOM 1865 CA TYR B 523 -20.248 -7.856 12.652 1.00 25.00 C ATOM 1866 C TYR B 523 -19.125 -7.674 11.607 1.00 25.00 C ATOM 1867 O TYR B 523 -18.854 -8.603 10.837 1.00 25.00 O ATOM 1868 CB TYR B 523 -19.780 -8.759 13.818 1.00 25.00 C ATOM 1869 CG TYR B 523 -20.745 -8.867 14.994 1.00 25.00 C ATOM 1870 CD1 TYR B 523 -21.705 -9.871 15.036 1.00 25.00 C ATOM 1871 CD2 TYR B 523 -20.685 -7.971 16.057 1.00 25.00 C ATOM 1872 CE1 TYR B 523 -22.580 -9.977 16.101 1.00 25.00 C ATOM 1873 CE2 TYR B 523 -21.557 -8.072 17.124 1.00 25.00 C ATOM 1874 CZ TYR B 523 -22.508 -9.056 17.140 1.00 25.00 C ATOM 1875 OH TYR B 523 -23.373 -9.180 18.203 1.00 25.00 O ATOM 0 H TYR B 523 -21.349 -9.332 11.642 1.00 25.00 H new ATOM 0 HA TYR B 523 -20.485 -6.873 13.058 1.00 25.00 H new ATOM 0 HB2 TYR B 523 -19.597 -9.760 13.428 1.00 25.00 H new ATOM 0 HB3 TYR B 523 -18.826 -8.381 14.187 1.00 25.00 H new ATOM 0 HD1 TYR B 523 -21.768 -10.580 14.224 1.00 25.00 H new ATOM 0 HD2 TYR B 523 -19.945 -7.184 16.048 1.00 25.00 H new ATOM 0 HE1 TYR B 523 -23.314 -10.769 16.126 1.00 25.00 H new ATOM 0 HE2 TYR B 523 -21.488 -7.374 17.946 1.00 25.00 H new ATOM 0 HH TYR B 523 -23.201 -8.464 18.850 1.00 25.00 H new ATOM 1885 N PRO B 524 -18.454 -6.475 11.550 1.00 25.00 N ATOM 1886 CA PRO B 524 -17.360 -6.225 10.584 1.00 25.00 C ATOM 1887 C PRO B 524 -16.063 -6.974 10.928 1.00 25.00 C ATOM 1888 O PRO B 524 -15.747 -7.175 12.105 1.00 25.00 O ATOM 1889 CB PRO B 524 -17.153 -4.706 10.667 1.00 25.00 C ATOM 1890 CG PRO B 524 -17.604 -4.330 12.045 1.00 25.00 C ATOM 1891 CD PRO B 524 -18.721 -5.271 12.391 1.00 25.00 C ATOM 0 HA PRO B 524 -17.617 -6.582 9.587 1.00 25.00 H new ATOM 0 HB2 PRO B 524 -16.108 -4.440 10.507 1.00 25.00 H new ATOM 0 HB3 PRO B 524 -17.734 -4.186 9.905 1.00 25.00 H new ATOM 0 HG2 PRO B 524 -16.786 -4.417 12.760 1.00 25.00 H new ATOM 0 HG3 PRO B 524 -17.944 -3.295 12.075 1.00 25.00 H new ATOM 0 HD2 PRO B 524 -18.720 -5.518 13.453 1.00 25.00 H new ATOM 0 HD3 PRO B 524 -19.694 -4.835 12.166 1.00 25.00 H new ATOM 1899 N ASN B 525 -15.324 -7.376 9.886 1.00 25.00 N ATOM 1900 CA ASN B 525 -14.069 -8.118 10.052 1.00 25.00 C ATOM 1901 C ASN B 525 -12.860 -7.187 9.952 1.00 25.00 C ATOM 1902 O ASN B 525 -12.823 -6.292 9.102 1.00 25.00 O ATOM 1903 CB ASN B 525 -13.956 -9.235 8.997 1.00 25.00 C ATOM 1904 CG ASN B 525 -15.017 -10.327 9.132 1.00 25.00 C ATOM 1905 OD1 ASN B 525 -14.989 -11.109 10.082 1.00 25.00 O ATOM 1906 ND2 ASN B 525 -15.969 -10.376 8.201 1.00 25.00 N ATOM 0 H ASN B 525 -15.576 -7.198 8.914 1.00 25.00 H new ATOM 0 HA ASN B 525 -14.079 -8.566 11.046 1.00 25.00 H new ATOM 0 HB2 ASN B 525 -14.030 -8.792 8.004 1.00 25.00 H new ATOM 0 HB3 ASN B 525 -12.969 -9.691 9.070 1.00 25.00 H new ATOM 0 HD21 ASN B 525 -16.706 -11.078 8.262 1.00 25.00 H new ATOM 0 HD22 ASN B 525 -15.960 -9.711 7.427 1.00 25.00 H new ATOM 1913 N GLY B 526 -11.879 -7.410 10.835 1.00 25.00 N ATOM 1914 CA GLY B 526 -10.672 -6.596 10.854 1.00 25.00 C ATOM 1915 C GLY B 526 -10.359 -6.056 12.236 1.00 25.00 C ATOM 1916 O GLY B 526 -10.217 -6.828 13.190 1.00 25.00 O ATOM 0 H GLY B 526 -11.903 -8.146 11.541 1.00 25.00 H new ATOM 0 HA2 GLY B 526 -9.830 -7.191 10.501 1.00 25.00 H new ATOM 0 HA3 GLY B 526 -10.788 -5.764 10.160 1.00 25.00 H new ATOM 1920 N LEU B 527 -10.252 -4.726 12.338 1.00 25.00 N ATOM 1921 CA LEU B 527 -9.977 -4.058 13.609 1.00 25.00 C ATOM 1922 C LEU B 527 -10.957 -2.912 13.822 1.00 25.00 C ATOM 1923 O LEU B 527 -11.277 -2.170 12.887 1.00 25.00 O ATOM 1924 CB LEU B 527 -8.524 -3.529 13.646 1.00 25.00 C ATOM 1925 CG LEU B 527 -7.371 -4.569 13.516 1.00 25.00 C ATOM 1926 CD1 LEU B 527 -6.016 -3.916 13.236 1.00 25.00 C ATOM 1927 CD2 LEU B 527 -7.291 -5.456 14.751 1.00 25.00 C ATOM 0 H LEU B 527 -10.353 -4.090 11.547 1.00 25.00 H new ATOM 0 HA LEU B 527 -10.100 -4.784 14.413 1.00 25.00 H new ATOM 0 HB2 LEU B 527 -8.411 -2.801 12.842 1.00 25.00 H new ATOM 0 HB3 LEU B 527 -8.387 -2.991 14.584 1.00 25.00 H new ATOM 0 HG LEU B 527 -7.611 -5.190 12.653 1.00 25.00 H new ATOM 0 HD11 LEU B 527 -5.250 -4.687 13.155 1.00 25.00 H new ATOM 0 HD12 LEU B 527 -6.068 -3.357 12.302 1.00 25.00 H new ATOM 0 HD13 LEU B 527 -5.763 -3.238 14.051 1.00 25.00 H new ATOM 0 HD21 LEU B 527 -6.478 -6.172 14.633 1.00 25.00 H new ATOM 0 HD22 LEU B 527 -7.106 -4.839 15.631 1.00 25.00 H new ATOM 0 HD23 LEU B 527 -8.232 -5.993 14.875 1.00 25.00 H new ATOM 1939 N LEU B 528 -11.432 -2.782 15.065 1.00 25.00 N ATOM 1940 CA LEU B 528 -12.284 -1.665 15.459 1.00 25.00 C ATOM 1941 C LEU B 528 -11.418 -0.438 15.780 1.00 25.00 C ATOM 1942 O LEU B 528 -10.902 -0.293 16.894 1.00 25.00 O ATOM 1943 CB LEU B 528 -13.177 -2.070 16.655 1.00 25.00 C ATOM 1944 CG LEU B 528 -14.152 -0.998 17.189 1.00 25.00 C ATOM 1945 CD1 LEU B 528 -15.102 -0.558 16.088 1.00 25.00 C ATOM 1946 CD2 LEU B 528 -14.955 -1.511 18.382 1.00 25.00 C ATOM 0 H LEU B 528 -11.237 -3.443 15.817 1.00 25.00 H new ATOM 0 HA LEU B 528 -12.945 -1.400 14.634 1.00 25.00 H new ATOM 0 HB2 LEU B 528 -13.759 -2.944 16.364 1.00 25.00 H new ATOM 0 HB3 LEU B 528 -12.528 -2.378 17.475 1.00 25.00 H new ATOM 0 HG LEU B 528 -13.555 -0.148 17.521 1.00 25.00 H new ATOM 0 HD11 LEU B 528 -15.784 0.198 16.477 1.00 25.00 H new ATOM 0 HD12 LEU B 528 -14.530 -0.139 15.260 1.00 25.00 H new ATOM 0 HD13 LEU B 528 -15.674 -1.417 15.736 1.00 25.00 H new ATOM 0 HD21 LEU B 528 -15.630 -0.729 18.730 1.00 25.00 H new ATOM 0 HD22 LEU B 528 -15.535 -2.384 18.082 1.00 25.00 H new ATOM 0 HD23 LEU B 528 -14.274 -1.787 19.187 1.00 25.00 H new ATOM 1958 N SER B 529 -11.257 0.433 14.760 1.00 25.00 N ATOM 1959 CA SER B 529 -10.377 1.623 14.814 1.00 25.00 C ATOM 1960 C SER B 529 -8.899 1.202 14.910 1.00 25.00 C ATOM 1961 O SER B 529 -8.192 1.527 15.873 1.00 25.00 O ATOM 1962 CB SER B 529 -10.767 2.580 15.962 1.00 25.00 C ATOM 1963 OG SER B 529 -12.097 3.043 15.813 1.00 25.00 O ATOM 0 H SER B 529 -11.739 0.329 13.867 1.00 25.00 H new ATOM 0 HA SER B 529 -10.514 2.176 13.885 1.00 25.00 H new ATOM 0 HB2 SER B 529 -10.663 2.067 16.918 1.00 25.00 H new ATOM 0 HB3 SER B 529 -10.083 3.429 15.980 1.00 25.00 H new ATOM 0 HG SER B 529 -12.319 3.645 16.554 1.00 25.00 H new ATOM 1969 N GLY B 530 -8.454 0.466 13.883 1.00 25.00 N ATOM 1970 CA GLY B 530 -7.102 -0.066 13.854 1.00 25.00 C ATOM 1971 C GLY B 530 -6.265 0.519 12.733 1.00 25.00 C ATOM 1972 O GLY B 530 -5.670 1.588 12.895 1.00 25.00 O ATOM 0 H GLY B 530 -9.017 0.230 13.066 1.00 25.00 H new ATOM 0 HA2 GLY B 530 -6.616 0.137 14.808 1.00 25.00 H new ATOM 0 HA3 GLY B 530 -7.145 -1.149 13.742 1.00 25.00 H new ATOM 1976 N ASP B 531 -6.225 -0.185 11.596 1.00 25.00 N ATOM 1977 CA ASP B 531 -5.438 0.247 10.432 1.00 25.00 C ATOM 1978 C ASP B 531 -6.268 0.212 9.146 1.00 25.00 C ATOM 1979 O ASP B 531 -5.824 0.688 8.096 1.00 25.00 O ATOM 1980 CB ASP B 531 -4.187 -0.631 10.267 1.00 25.00 C ATOM 1981 CG ASP B 531 -3.151 -0.394 11.352 1.00 25.00 C ATOM 1982 OD1 ASP B 531 -2.559 0.706 11.377 1.00 25.00 O ATOM 1983 OD2 ASP B 531 -2.932 -1.308 12.176 1.00 25.00 O ATOM 0 H ASP B 531 -6.730 -1.060 11.456 1.00 25.00 H new ATOM 0 HA ASP B 531 -5.132 1.277 10.612 1.00 25.00 H new ATOM 0 HB2 ASP B 531 -4.482 -1.680 10.276 1.00 25.00 H new ATOM 0 HB3 ASP B 531 -3.738 -0.435 9.294 1.00 25.00 H new ATOM 1988 N GLU B 532 -7.475 -0.346 9.248 1.00 25.00 N ATOM 1989 CA GLU B 532 -8.373 -0.510 8.110 1.00 25.00 C ATOM 1990 C GLU B 532 -9.509 0.515 8.112 1.00 25.00 C ATOM 1991 O GLU B 532 -10.382 0.501 7.236 1.00 25.00 O ATOM 1992 CB GLU B 532 -8.946 -1.920 8.137 1.00 25.00 C ATOM 1993 CG GLU B 532 -7.902 -3.019 8.093 1.00 25.00 C ATOM 1994 CD GLU B 532 -7.070 -2.988 6.824 1.00 25.00 C ATOM 1995 OE1 GLU B 532 -7.661 -2.865 5.730 1.00 25.00 O ATOM 1996 OE2 GLU B 532 -5.829 -3.084 6.925 1.00 25.00 O ATOM 0 H GLU B 532 -7.856 -0.697 10.126 1.00 25.00 H new ATOM 0 HA GLU B 532 -7.799 -0.346 7.198 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -9.544 -2.039 9.040 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -9.621 -2.042 7.290 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -7.244 -2.923 8.956 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -8.396 -3.987 8.175 1.00 25.00 H new ATOM 2003 N ASP B 533 -9.470 1.405 9.092 1.00 25.00 N ATOM 2004 CA ASP B 533 -10.507 2.425 9.281 1.00 25.00 C ATOM 2005 C ASP B 533 -9.953 3.842 9.052 1.00 25.00 C ATOM 2006 O ASP B 533 -10.713 4.759 8.728 1.00 25.00 O ATOM 2007 CB ASP B 533 -11.107 2.302 10.695 1.00 25.00 C ATOM 2008 CG ASP B 533 -11.962 1.056 10.879 1.00 25.00 C ATOM 2009 OD1 ASP B 533 -12.275 0.394 9.867 1.00 25.00 O ATOM 2010 OD2 ASP B 533 -12.317 0.746 12.036 1.00 25.00 O ATOM 0 H ASP B 533 -8.721 1.446 9.783 1.00 25.00 H new ATOM 0 HA ASP B 533 -11.290 2.257 8.542 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -10.298 2.291 11.426 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -11.713 3.184 10.903 1.00 25.00 H new ATOM 2015 N PHE B 534 -8.632 4.008 9.217 1.00 25.00 N ATOM 2016 CA PHE B 534 -7.990 5.324 9.085 1.00 25.00 C ATOM 2017 C PHE B 534 -7.312 5.505 7.724 1.00 25.00 C ATOM 2018 O PHE B 534 -6.954 6.627 7.353 1.00 25.00 O ATOM 2019 CB PHE B 534 -6.963 5.541 10.211 1.00 25.00 C ATOM 2020 CG PHE B 534 -7.560 5.621 11.595 1.00 25.00 C ATOM 2021 CD1 PHE B 534 -7.455 4.553 12.475 1.00 25.00 C ATOM 2022 CD2 PHE B 534 -8.221 6.767 12.016 1.00 25.00 C ATOM 2023 CE1 PHE B 534 -7.996 4.627 13.745 1.00 25.00 C ATOM 2024 CE2 PHE B 534 -8.765 6.845 13.284 1.00 25.00 C ATOM 2025 CZ PHE B 534 -8.652 5.774 14.149 1.00 25.00 C ATOM 0 H PHE B 534 -7.989 3.249 9.442 1.00 25.00 H new ATOM 0 HA PHE B 534 -8.780 6.071 9.164 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -6.239 4.726 10.188 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -6.414 6.461 10.012 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -6.945 3.653 12.164 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -8.311 7.608 11.344 1.00 25.00 H new ATOM 0 HE1 PHE B 534 -7.906 3.789 14.421 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -9.278 7.742 13.598 1.00 25.00 H new ATOM 0 HZ PHE B 534 -9.076 5.833 15.140 1.00 25.00 H new ATOM 2035 N SER B 535 -7.151 4.403 6.984 1.00 25.00 N ATOM 2036 CA SER B 535 -6.540 4.436 5.651 1.00 25.00 C ATOM 2037 C SER B 535 -7.575 4.760 4.557 1.00 25.00 C ATOM 2038 O SER B 535 -7.219 4.910 3.384 1.00 25.00 O ATOM 2039 CB SER B 535 -5.834 3.108 5.351 1.00 25.00 C ATOM 2040 OG SER B 535 -6.752 2.026 5.311 1.00 25.00 O ATOM 0 H SER B 535 -7.437 3.472 7.288 1.00 25.00 H new ATOM 0 HA SER B 535 -5.799 5.236 5.647 1.00 25.00 H new ATOM 0 HB2 SER B 535 -5.313 3.180 4.396 1.00 25.00 H new ATOM 0 HB3 SER B 535 -5.078 2.917 6.113 1.00 25.00 H new ATOM 0 HG SER B 535 -6.632 1.465 6.106 1.00 25.00 H new ATOM 2046 N SER B 536 -8.850 4.875 4.960 1.00 25.00 N ATOM 2047 CA SER B 536 -9.937 5.257 4.049 1.00 25.00 C ATOM 2048 C SER B 536 -10.064 6.781 3.958 1.00 25.00 C ATOM 2049 O SER B 536 -10.378 7.323 2.893 1.00 25.00 O ATOM 2050 CB SER B 536 -11.263 4.635 4.506 1.00 25.00 C ATOM 2051 OG SER B 536 -11.644 5.107 5.789 1.00 25.00 O ATOM 0 H SER B 536 -9.154 4.707 5.919 1.00 25.00 H new ATOM 0 HA SER B 536 -9.698 4.876 3.056 1.00 25.00 H new ATOM 0 HB2 SER B 536 -12.045 4.870 3.784 1.00 25.00 H new ATOM 0 HB3 SER B 536 -11.168 3.549 4.530 1.00 25.00 H new ATOM 0 HG SER B 536 -11.081 4.687 6.472 1.00 25.00 H new ATOM 2057 N ILE B 537 -9.820 7.457 5.089 1.00 25.00 N ATOM 2058 CA ILE B 537 -9.787 8.923 5.140 1.00 25.00 C ATOM 2059 C ILE B 537 -8.384 9.438 4.803 1.00 25.00 C ATOM 2060 O ILE B 537 -8.229 10.576 4.347 1.00 25.00 O ATOM 2061 CB ILE B 537 -10.282 9.455 6.535 1.00 25.00 C ATOM 2062 CG1 ILE B 537 -9.306 9.033 7.666 1.00 25.00 C ATOM 2063 CG2 ILE B 537 -11.717 9.011 6.876 1.00 25.00 C ATOM 2064 CD1 ILE B 537 -9.466 9.786 8.987 1.00 25.00 C ATOM 0 H ILE B 537 -9.641 7.007 5.987 1.00 25.00 H new ATOM 0 HA ILE B 537 -10.475 9.309 4.388 1.00 25.00 H new ATOM 0 HB ILE B 537 -10.296 10.542 6.459 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -9.437 7.968 7.857 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -8.285 9.170 7.311 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -12.000 9.410 7.850 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -12.404 9.386 6.117 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -11.764 7.922 6.902 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -8.737 9.415 9.708 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -9.302 10.851 8.821 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -10.472 9.630 9.375 1.00 25.00 H new ATOM 2076 N ALA B 538 -7.372 8.588 5.010 1.00 25.00 N ATOM 2077 CA ALA B 538 -6.009 8.908 4.605 1.00 25.00 C ATOM 2078 C ALA B 538 -5.766 8.517 3.137 1.00 25.00 C ATOM 2079 O ALA B 538 -4.642 8.598 2.625 1.00 25.00 O ATOM 2080 CB ALA B 538 -5.008 8.247 5.541 1.00 25.00 C ATOM 0 H ALA B 538 -7.476 7.676 5.455 1.00 25.00 H new ATOM 0 HA ALA B 538 -5.867 9.986 4.678 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -3.995 8.496 5.225 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -5.169 8.605 6.558 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -5.142 7.166 5.512 1.00 25.00 H new ATOM 2086 N ASP B 539 -6.858 8.107 2.479 1.00 25.00 N ATOM 2087 CA ASP B 539 -6.891 7.853 1.035 1.00 25.00 C ATOM 2088 C ASP B 539 -7.292 9.143 0.308 1.00 25.00 C ATOM 2089 O ASP B 539 -6.900 9.374 -0.841 1.00 25.00 O ATOM 2090 CB ASP B 539 -7.888 6.720 0.727 1.00 25.00 C ATOM 2091 CG ASP B 539 -8.030 6.417 -0.758 1.00 25.00 C ATOM 2092 OD1 ASP B 539 -6.995 6.203 -1.422 1.00 25.00 O ATOM 2093 OD2 ASP B 539 -9.176 6.401 -1.252 1.00 25.00 O ATOM 0 H ASP B 539 -7.752 7.941 2.940 1.00 25.00 H new ATOM 0 HA ASP B 539 -5.905 7.543 0.689 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -7.568 5.816 1.244 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -8.865 6.988 1.129 1.00 25.00 H new ATOM 2098 N MET B 540 -8.079 9.972 1.009 1.00 25.00 N ATOM 2099 CA MET B 540 -8.435 11.319 0.557 1.00 25.00 C ATOM 2100 C MET B 540 -7.261 12.288 0.748 1.00 25.00 C ATOM 2101 O MET B 540 -7.185 13.329 0.088 1.00 25.00 O ATOM 2102 CB MET B 540 -9.656 11.821 1.336 1.00 25.00 C ATOM 2103 CG MET B 540 -10.954 11.095 0.988 1.00 25.00 C ATOM 2104 SD MET B 540 -12.338 11.541 2.065 1.00 25.00 S ATOM 2105 CE MET B 540 -12.820 13.146 1.420 1.00 25.00 C ATOM 0 H MET B 540 -8.487 9.723 1.910 1.00 25.00 H new ATOM 0 HA MET B 540 -8.674 11.274 -0.506 1.00 25.00 H new ATOM 0 HB2 MET B 540 -9.464 11.710 2.403 1.00 25.00 H new ATOM 0 HB3 MET B 540 -9.784 12.886 1.144 1.00 25.00 H new ATOM 0 HG2 MET B 540 -11.221 11.318 -0.045 1.00 25.00 H new ATOM 0 HG3 MET B 540 -10.788 10.019 1.049 1.00 25.00 H new ATOM 0 HE1 MET B 540 -13.662 13.531 1.995 1.00 25.00 H new ATOM 0 HE2 MET B 540 -11.980 13.837 1.499 1.00 25.00 H new ATOM 0 HE3 MET B 540 -13.111 13.046 0.374 1.00 25.00 H new ATOM 2115 N ASP B 541 -6.353 11.917 1.661 1.00 25.00 N ATOM 2116 CA ASP B 541 -5.138 12.673 1.941 1.00 25.00 C ATOM 2117 C ASP B 541 -4.077 12.505 0.848 1.00 25.00 C ATOM 2118 O ASP B 541 -3.323 13.439 0.566 1.00 25.00 O ATOM 2119 CB ASP B 541 -4.553 12.218 3.279 1.00 25.00 C ATOM 2120 CG ASP B 541 -5.369 12.682 4.470 1.00 25.00 C ATOM 2121 OD1 ASP B 541 -6.255 13.541 4.287 1.00 25.00 O ATOM 2122 OD2 ASP B 541 -5.122 12.183 5.589 1.00 25.00 O ATOM 0 H ASP B 541 -6.448 11.075 2.228 1.00 25.00 H new ATOM 0 HA ASP B 541 -5.413 13.727 1.976 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -4.490 11.130 3.291 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -3.535 12.598 3.372 1.00 25.00 H new ATOM 2127 N PHE B 542 -4.036 11.314 0.227 1.00 25.00 N ATOM 2128 CA PHE B 542 -2.947 10.953 -0.686 1.00 25.00 C ATOM 2129 C PHE B 542 -3.116 11.545 -2.089 1.00 25.00 C ATOM 2130 O PHE B 542 -2.132 11.952 -2.705 1.00 25.00 O ATOM 2131 CB PHE B 542 -2.827 9.429 -0.772 1.00 25.00 C ATOM 2132 CG PHE B 542 -1.430 8.917 -0.597 1.00 25.00 C ATOM 2133 CD1 PHE B 542 -0.803 8.973 0.637 1.00 25.00 C ATOM 2134 CD2 PHE B 542 -0.742 8.390 -1.674 1.00 25.00 C ATOM 2135 CE1 PHE B 542 0.483 8.509 0.787 1.00 25.00 C ATOM 2136 CE2 PHE B 542 0.545 7.928 -1.525 1.00 25.00 C ATOM 2137 CZ PHE B 542 1.154 7.988 -0.297 1.00 25.00 C ATOM 0 H PHE B 542 -4.744 10.589 0.343 1.00 25.00 H new ATOM 0 HA PHE B 542 -2.033 11.381 -0.274 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -3.465 8.981 -0.010 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -3.205 9.099 -1.739 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -1.328 9.384 1.487 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -1.219 8.341 -2.641 1.00 25.00 H new ATOM 0 HE1 PHE B 542 0.965 8.553 1.752 1.00 25.00 H new ATOM 0 HE2 PHE B 542 1.075 7.519 -2.373 1.00 25.00 H new ATOM 0 HZ PHE B 542 2.164 7.625 -0.180 1.00 25.00 H new ATOM 2147 N SER B 543 -4.360 11.600 -2.581 1.00 25.00 N ATOM 2148 CA SER B 543 -4.652 12.102 -3.935 1.00 25.00 C ATOM 2149 C SER B 543 -4.587 13.637 -3.995 1.00 25.00 C ATOM 2150 O SER B 543 -4.358 14.211 -5.064 1.00 25.00 O ATOM 2151 CB SER B 543 -6.037 11.620 -4.377 1.00 25.00 C ATOM 2152 OG SER B 543 -7.065 12.201 -3.588 1.00 25.00 O ATOM 0 H SER B 543 -5.186 11.302 -2.061 1.00 25.00 H new ATOM 0 HA SER B 543 -3.893 11.710 -4.612 1.00 25.00 H new ATOM 0 HB2 SER B 543 -6.194 11.873 -5.425 1.00 25.00 H new ATOM 0 HB3 SER B 543 -6.087 10.534 -4.300 1.00 25.00 H new ATOM 0 HG SER B 543 -7.937 11.875 -3.895 1.00 25.00 H new ATOM 2158 N ALA B 544 -4.789 14.285 -2.837 1.00 25.00 N ATOM 2159 CA ALA B 544 -4.674 15.744 -2.720 1.00 25.00 C ATOM 2160 C ALA B 544 -3.206 16.176 -2.610 1.00 25.00 C ATOM 2161 O ALA B 544 -2.851 17.301 -2.971 1.00 25.00 O ATOM 2162 CB ALA B 544 -5.466 16.239 -1.517 1.00 25.00 C ATOM 0 H ALA B 544 -5.034 13.817 -1.965 1.00 25.00 H new ATOM 0 HA ALA B 544 -5.088 16.191 -3.624 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -5.373 17.322 -1.441 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -6.516 15.973 -1.638 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -5.077 15.777 -0.610 1.00 25.00 H new ATOM 2168 N LEU B 545 -2.365 15.260 -2.105 1.00 25.00 N ATOM 2169 CA LEU B 545 -0.922 15.461 -2.009 1.00 25.00 C ATOM 2170 C LEU B 545 -0.218 15.062 -3.304 1.00 25.00 C ATOM 2171 O LEU B 545 0.716 15.733 -3.750 1.00 25.00 O ATOM 2172 CB LEU B 545 -0.361 14.620 -0.863 1.00 25.00 C ATOM 2173 CG LEU B 545 -0.826 14.983 0.551 1.00 25.00 C ATOM 2174 CD1 LEU B 545 -0.497 13.856 1.513 1.00 25.00 C ATOM 2175 CD2 LEU B 545 -0.170 16.274 1.030 1.00 25.00 C ATOM 0 H LEU B 545 -2.675 14.355 -1.751 1.00 25.00 H new ATOM 0 HA LEU B 545 -0.743 16.521 -1.826 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -0.619 13.577 -1.049 1.00 25.00 H new ATOM 0 HB3 LEU B 545 0.726 14.689 -0.891 1.00 25.00 H new ATOM 0 HG LEU B 545 -1.905 15.134 0.523 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -0.832 14.124 2.515 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -1.003 12.945 1.193 1.00 25.00 H new ATOM 0 HD13 LEU B 545 0.580 13.689 1.523 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -0.518 16.507 2.036 1.00 25.00 H new ATOM 0 HD22 LEU B 545 0.913 16.150 1.040 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -0.435 17.089 0.356 1.00 25.00 H new ATOM 2187 N LEU B 546 -0.689 13.958 -3.895 1.00 25.00 N ATOM 2188 CA LEU B 546 -0.108 13.386 -5.111 1.00 25.00 C ATOM 2189 C LEU B 546 -0.374 14.279 -6.333 1.00 25.00 C ATOM 2190 O LEU B 546 0.422 14.310 -7.276 1.00 25.00 O ATOM 2191 CB LEU B 546 -0.685 11.972 -5.313 1.00 25.00 C ATOM 2192 CG LEU B 546 0.243 10.798 -5.008 1.00 25.00 C ATOM 2193 CD1 LEU B 546 -0.406 9.466 -5.383 1.00 25.00 C ATOM 2194 CD2 LEU B 546 1.566 10.980 -5.729 1.00 25.00 C ATOM 0 H LEU B 546 -1.489 13.435 -3.539 1.00 25.00 H new ATOM 0 HA LEU B 546 0.975 13.324 -5.001 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -1.572 11.875 -4.687 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -1.014 11.884 -6.348 1.00 25.00 H new ATOM 0 HG LEU B 546 0.430 10.778 -3.934 1.00 25.00 H new ATOM 0 HD11 LEU B 546 0.279 8.650 -5.154 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -1.327 9.337 -4.814 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -0.634 9.460 -6.449 1.00 25.00 H new ATOM 0 HD21 LEU B 546 2.221 10.138 -5.505 1.00 25.00 H new ATOM 0 HD22 LEU B 546 1.391 11.028 -6.804 1.00 25.00 H new ATOM 0 HD23 LEU B 546 2.037 11.905 -5.396 1.00 25.00 H new ATOM 2206 N SER B 547 -1.501 14.994 -6.294 1.00 25.00 N ATOM 2207 CA SER B 547 -1.856 15.959 -7.332 1.00 25.00 C ATOM 2208 C SER B 547 -2.016 17.360 -6.719 1.00 25.00 C ATOM 2209 O SER B 547 -3.136 17.845 -6.508 1.00 25.00 O ATOM 2210 CB SER B 547 -3.139 15.512 -8.055 1.00 25.00 C ATOM 2211 OG SER B 547 -2.950 14.277 -8.729 1.00 25.00 O ATOM 0 H SER B 547 -2.189 14.919 -5.545 1.00 25.00 H new ATOM 0 HA SER B 547 -1.055 16.005 -8.069 1.00 25.00 H new ATOM 0 HB2 SER B 547 -3.950 15.414 -7.333 1.00 25.00 H new ATOM 0 HB3 SER B 547 -3.440 16.277 -8.771 1.00 25.00 H new ATOM 0 HG SER B 547 -3.782 14.018 -9.177 1.00 25.00 H new ATOM 2217 N GLN B 548 -0.874 17.996 -6.423 1.00 25.00 N ATOM 2218 CA GLN B 548 -0.852 19.349 -5.857 1.00 25.00 C ATOM 2219 C GLN B 548 -0.655 20.393 -6.966 1.00 25.00 C ATOM 2220 O GLN B 548 0.400 21.034 -7.074 1.00 25.00 O ATOM 2221 CB GLN B 548 0.239 19.477 -4.778 1.00 25.00 C ATOM 2222 CG GLN B 548 -0.151 18.907 -3.419 1.00 25.00 C ATOM 2223 CD GLN B 548 1.011 18.876 -2.444 1.00 25.00 C ATOM 2224 OE1 GLN B 548 2.217 19.118 -2.949 1.00 25.00 O flip ATOM 2225 NE2 GLN B 548 0.829 18.637 -1.250 1.00 25.00 N flip ATOM 0 H GLN B 548 0.051 17.591 -6.568 1.00 25.00 H new ATOM 0 HA GLN B 548 -1.814 19.536 -5.380 1.00 25.00 H new ATOM 0 HB2 GLN B 548 1.139 18.970 -5.126 1.00 25.00 H new ATOM 0 HB3 GLN B 548 0.492 20.530 -4.658 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -0.959 19.505 -2.997 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -0.537 17.896 -3.550 1.00 25.00 H new ATOM 0 HE21 GLN B 548 -0.113 18.457 -0.904 1.00 25.00 H new ATOM 0 HE22 GLN B 548 1.621 18.619 -0.607 1.00 25.00 H new ATOM 2234 N ILE B 549 -1.691 20.539 -7.796 1.00 25.00 N ATOM 2235 CA ILE B 549 -1.676 21.490 -8.918 1.00 25.00 C ATOM 2236 C ILE B 549 -2.535 22.733 -8.638 1.00 25.00 C ATOM 2237 O ILE B 549 -2.394 23.754 -9.320 1.00 25.00 O ATOM 2238 CB ILE B 549 -2.110 20.824 -10.269 1.00 25.00 C ATOM 2239 CG1 ILE B 549 -3.561 20.283 -10.248 1.00 25.00 C ATOM 2240 CG2 ILE B 549 -1.145 19.704 -10.636 1.00 25.00 C ATOM 2241 CD1 ILE B 549 -4.108 19.878 -11.605 1.00 25.00 C ATOM 0 H ILE B 549 -2.558 20.008 -7.713 1.00 25.00 H new ATOM 0 HA ILE B 549 -0.640 21.812 -9.020 1.00 25.00 H new ATOM 0 HB ILE B 549 -2.078 21.609 -11.024 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -3.603 19.421 -9.583 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -4.212 21.046 -9.822 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -1.457 19.249 -11.576 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -0.140 20.111 -10.745 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -1.147 18.950 -9.849 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -5.128 19.512 -11.491 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -4.104 20.741 -12.271 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -3.485 19.090 -12.028 1.00 25.00 H new ATOM 2253 N SER B 550 -3.418 22.637 -7.635 1.00 25.00 N ATOM 2254 CA SER B 550 -4.289 23.750 -7.247 1.00 25.00 C ATOM 2255 C SER B 550 -3.885 24.318 -5.885 1.00 25.00 C ATOM 2256 O SER B 550 -3.567 23.565 -4.958 1.00 25.00 O ATOM 2257 CB SER B 550 -5.757 23.299 -7.219 1.00 25.00 C ATOM 2258 OG SER B 550 -6.211 22.927 -8.512 1.00 25.00 O ATOM 0 H SER B 550 -3.547 21.794 -7.076 1.00 25.00 H new ATOM 0 HA SER B 550 -4.176 24.538 -7.991 1.00 25.00 H new ATOM 0 HB2 SER B 550 -5.867 22.456 -6.537 1.00 25.00 H new ATOM 0 HB3 SER B 550 -6.379 24.106 -6.832 1.00 25.00 H new ATOM 0 HG SER B 550 -7.148 22.643 -8.461 1.00 25.00 H new ATOM 2264 N SER B 551 -3.898 25.652 -5.779 1.00 25.00 N ATOM 2265 CA SER B 551 -3.545 26.342 -4.538 1.00 25.00 C ATOM 2266 C SER B 551 -4.775 27.011 -3.910 1.00 25.00 C ATOM 2267 O SER B 551 -5.185 28.091 -4.392 1.00 25.00 O ATOM 2268 CB SER B 551 -2.428 27.370 -4.792 1.00 25.00 C ATOM 2269 OG SER B 551 -2.190 28.173 -3.647 1.00 25.00 O ATOM 2270 OXT SER B 551 -5.319 26.443 -2.940 1.00 25.00 O ATOM 0 H SER B 551 -4.151 26.276 -6.545 1.00 25.00 H new ATOM 0 HA SER B 551 -3.173 25.601 -3.830 1.00 25.00 H new ATOM 0 HB2 SER B 551 -1.511 26.851 -5.071 1.00 25.00 H new ATOM 0 HB3 SER B 551 -2.702 28.006 -5.633 1.00 25.00 H new ATOM 0 HG SER B 551 -1.475 28.814 -3.840 1.00 25.00 H new TER 2276 SER B 551