USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 897 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 65 ASN :FLIP amide:sc= -0.884 F(o=-4.3!,f=-2.2) USER MOD Set 1.2: A 95 HIS : no HD1:sc= -1.33 K(o=-2.2,f=-8.7!) USER MOD Set 2.1: A 45 THR OG1 : rot -14:sc= 0.307 USER MOD Set 2.2: A 84 GLN :FLIP amide:sc= -0.17 F(o=-1.4,f=0.14) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.102 USER MOD Single : A 8 HIS : no HD1:sc= -1.48 K(o=-1.5,f=-2.6!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 56:sc= 0.201 USER MOD Single : A 22 SER OG : rot -14:sc= 0.243! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 70:sc= -0.52 USER MOD Single : A 48 SER OG : rot 28:sc= -1.34! USER MOD Single : A 52 THR OG1 : rot 90:sc= -1.36 USER MOD Single : A 53 GLN : amide:sc= -1.03! X(o=-1!,f=-1.2) USER MOD Single : A 58 HIS : no HD1:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 HIS :FLIP no HD1:sc= -0.685 F(o=-1.9!,f=-0.69) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 29:sc= 0.0118 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot 25:sc= -0.126 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 100:sc= -0.0614 USER MOD Single : A 87 TYR OH : rot -156:sc= 0.537 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.0834) USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.667 USER MOD Single : A 101 TYR OH : rot 75:sc= -0.983 USER MOD Single : A 108 ASN :FLIP amide:sc= -0.0217! F(o=-1.5,f=-0.022!) USER MOD Single : A 109 SER OG : rot 10:sc= 1.09 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.272 USER MOD Single : A 119 CYS SG : rot 33:sc= 0.478 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -54:sc= 1.03 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.692 7.097 15.858 1.00 0.00 N ATOM 2 CA GLY A 1 22.248 7.240 15.834 1.00 0.00 C ATOM 3 C GLY A 1 21.743 8.202 16.891 1.00 0.00 C ATOM 4 O GLY A 1 21.370 7.788 17.989 1.00 0.00 O ATOM 0 H1 GLY A 1 23.987 6.429 15.117 1.00 0.00 H new ATOM 0 H2 GLY A 1 24.135 8.022 15.687 1.00 0.00 H new ATOM 0 H3 GLY A 1 23.990 6.737 16.787 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.937 7.590 14.850 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.787 6.264 15.985 1.00 0.00 H new ATOM 8 N SER A 2 21.731 9.489 16.560 1.00 0.00 N ATOM 9 CA SER A 2 21.273 10.513 17.492 1.00 0.00 C ATOM 10 C SER A 2 20.585 11.655 16.749 1.00 0.00 C ATOM 11 O SER A 2 20.938 11.973 15.614 1.00 0.00 O ATOM 12 CB SER A 2 22.449 11.055 18.306 1.00 0.00 C ATOM 13 OG SER A 2 23.321 11.822 17.493 1.00 0.00 O ATOM 0 H SER A 2 22.033 9.848 15.654 1.00 0.00 H new ATOM 0 HA SER A 2 20.552 10.056 18.169 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.076 11.670 19.125 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.998 10.227 18.753 1.00 0.00 H new ATOM 0 HG SER A 2 24.064 12.159 18.037 1.00 0.00 H new ATOM 19 N SER A 3 19.599 12.266 17.399 1.00 0.00 N ATOM 20 CA SER A 3 18.858 13.370 16.799 1.00 0.00 C ATOM 21 C SER A 3 18.017 14.092 17.848 1.00 0.00 C ATOM 22 O SER A 3 17.571 13.491 18.824 1.00 0.00 O ATOM 23 CB SER A 3 17.959 12.856 15.673 1.00 0.00 C ATOM 24 OG SER A 3 17.553 13.914 14.822 1.00 0.00 O ATOM 0 H SER A 3 19.295 12.016 18.340 1.00 0.00 H new ATOM 0 HA SER A 3 19.577 14.077 16.385 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.492 12.103 15.093 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.081 12.369 16.098 1.00 0.00 H new ATOM 0 HG SER A 3 16.981 13.560 14.110 1.00 0.00 H new ATOM 30 N GLY A 4 17.805 15.388 17.637 1.00 0.00 N ATOM 31 CA GLY A 4 17.019 16.172 18.572 1.00 0.00 C ATOM 32 C GLY A 4 17.039 17.652 18.246 1.00 0.00 C ATOM 33 O GLY A 4 18.069 18.312 18.386 1.00 0.00 O ATOM 0 H GLY A 4 18.163 15.908 16.836 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.989 15.815 18.565 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.402 16.020 19.581 1.00 0.00 H new ATOM 37 N SER A 5 15.898 18.176 17.810 1.00 0.00 N ATOM 38 CA SER A 5 15.790 19.587 17.458 1.00 0.00 C ATOM 39 C SER A 5 14.340 20.055 17.528 1.00 0.00 C ATOM 40 O SER A 5 13.509 19.662 16.710 1.00 0.00 O ATOM 41 CB SER A 5 16.349 19.829 16.054 1.00 0.00 C ATOM 42 OG SER A 5 16.025 21.130 15.594 1.00 0.00 O ATOM 0 H SER A 5 15.035 17.645 17.692 1.00 0.00 H new ATOM 0 HA SER A 5 16.374 20.161 18.178 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.432 19.702 16.063 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.947 19.086 15.366 1.00 0.00 H new ATOM 0 HG SER A 5 16.394 21.261 14.696 1.00 0.00 H new ATOM 48 N SER A 6 14.043 20.898 18.512 1.00 0.00 N ATOM 49 CA SER A 6 12.693 21.418 18.693 1.00 0.00 C ATOM 50 C SER A 6 12.726 22.890 19.092 1.00 0.00 C ATOM 51 O SER A 6 13.762 23.410 19.504 1.00 0.00 O ATOM 52 CB SER A 6 11.949 20.606 19.756 1.00 0.00 C ATOM 53 OG SER A 6 10.614 21.057 19.900 1.00 0.00 O ATOM 0 H SER A 6 14.720 21.235 19.196 1.00 0.00 H new ATOM 0 HA SER A 6 12.166 21.329 17.743 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.952 19.551 19.481 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.469 20.688 20.711 1.00 0.00 H new ATOM 0 HG SER A 6 10.160 20.521 20.583 1.00 0.00 H new ATOM 59 N GLY A 7 11.582 23.557 18.966 1.00 0.00 N ATOM 60 CA GLY A 7 11.501 24.962 19.317 1.00 0.00 C ATOM 61 C GLY A 7 10.692 25.764 18.317 1.00 0.00 C ATOM 62 O GLY A 7 11.122 25.970 17.182 1.00 0.00 O ATOM 0 H GLY A 7 10.711 23.149 18.627 1.00 0.00 H new ATOM 0 HA2 GLY A 7 11.052 25.061 20.305 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.507 25.376 19.381 1.00 0.00 H new ATOM 66 N HIS A 8 9.515 26.216 18.738 1.00 0.00 N ATOM 67 CA HIS A 8 8.642 26.999 17.870 1.00 0.00 C ATOM 68 C HIS A 8 7.807 27.983 18.684 1.00 0.00 C ATOM 69 O HIS A 8 7.257 27.631 19.728 1.00 0.00 O ATOM 70 CB HIS A 8 7.725 26.076 17.067 1.00 0.00 C ATOM 71 CG HIS A 8 8.464 25.080 16.228 1.00 0.00 C ATOM 72 ND1 HIS A 8 9.361 25.441 15.245 1.00 0.00 N ATOM 73 CD2 HIS A 8 8.437 23.726 16.230 1.00 0.00 C ATOM 74 CE1 HIS A 8 9.852 24.354 14.678 1.00 0.00 C ATOM 75 NE2 HIS A 8 9.308 23.300 15.258 1.00 0.00 N ATOM 0 H HIS A 8 9.144 26.054 19.674 1.00 0.00 H new ATOM 0 HA HIS A 8 9.269 27.565 17.181 1.00 0.00 H new ATOM 0 HB2 HIS A 8 7.067 25.543 17.754 1.00 0.00 H new ATOM 0 HB3 HIS A 8 7.089 26.681 16.422 1.00 0.00 H new ATOM 0 HD2 HIS A 8 7.841 23.098 16.876 1.00 0.00 H new ATOM 0 HE1 HIS A 8 10.575 24.331 13.876 1.00 0.00 H new ATOM 0 HE2 HIS A 8 9.503 22.327 15.022 1.00 0.00 H new ATOM 83 N PHE A 9 7.716 29.217 18.199 1.00 0.00 N ATOM 84 CA PHE A 9 6.950 30.252 18.883 1.00 0.00 C ATOM 85 C PHE A 9 5.488 29.840 19.028 1.00 0.00 C ATOM 86 O PHE A 9 4.900 29.219 18.142 1.00 0.00 O ATOM 87 CB PHE A 9 7.045 31.575 18.119 1.00 0.00 C ATOM 88 CG PHE A 9 8.370 32.264 18.276 1.00 0.00 C ATOM 89 CD1 PHE A 9 8.630 33.049 19.388 1.00 0.00 C ATOM 90 CD2 PHE A 9 9.355 32.127 17.311 1.00 0.00 C ATOM 91 CE1 PHE A 9 9.849 33.684 19.535 1.00 0.00 C ATOM 92 CE2 PHE A 9 10.576 32.760 17.454 1.00 0.00 C ATOM 93 CZ PHE A 9 10.822 33.540 18.567 1.00 0.00 C ATOM 0 H PHE A 9 8.163 29.524 17.335 1.00 0.00 H new ATOM 0 HA PHE A 9 7.373 30.384 19.879 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.865 31.388 17.060 1.00 0.00 H new ATOM 0 HB3 PHE A 9 6.255 32.242 18.464 1.00 0.00 H new ATOM 0 HD1 PHE A 9 7.872 33.166 20.148 1.00 0.00 H new ATOM 0 HD2 PHE A 9 9.167 31.519 16.438 1.00 0.00 H new ATOM 0 HE1 PHE A 9 10.040 34.292 20.407 1.00 0.00 H new ATOM 0 HE2 PHE A 9 11.337 32.645 16.696 1.00 0.00 H new ATOM 0 HZ PHE A 9 11.774 34.037 18.680 1.00 0.00 H new ATOM 103 N PRO A 10 4.886 30.191 20.174 1.00 0.00 N ATOM 104 CA PRO A 10 3.486 29.868 20.464 1.00 0.00 C ATOM 105 C PRO A 10 2.516 30.663 19.597 1.00 0.00 C ATOM 106 O PRO A 10 2.682 31.867 19.406 1.00 0.00 O ATOM 107 CB PRO A 10 3.329 30.258 21.936 1.00 0.00 C ATOM 108 CG PRO A 10 4.371 31.298 22.165 1.00 0.00 C ATOM 109 CD PRO A 10 5.525 30.931 21.275 1.00 0.00 C ATOM 0 HA PRO A 10 3.259 28.822 20.259 1.00 0.00 H new ATOM 0 HB2 PRO A 10 2.331 30.646 22.138 1.00 0.00 H new ATOM 0 HB3 PRO A 10 3.476 29.399 22.591 1.00 0.00 H new ATOM 0 HG2 PRO A 10 3.992 32.291 21.922 1.00 0.00 H new ATOM 0 HG3 PRO A 10 4.677 31.320 23.211 1.00 0.00 H new ATOM 0 HD2 PRO A 10 6.050 31.815 20.913 1.00 0.00 H new ATOM 0 HD3 PRO A 10 6.257 30.317 21.799 1.00 0.00 H new ATOM 117 N ALA A 11 1.502 29.981 19.073 1.00 0.00 N ATOM 118 CA ALA A 11 0.504 30.624 18.228 1.00 0.00 C ATOM 119 C ALA A 11 -0.623 29.659 17.877 1.00 0.00 C ATOM 120 O ALA A 11 -0.398 28.460 17.713 1.00 0.00 O ATOM 121 CB ALA A 11 1.153 31.163 16.961 1.00 0.00 C ATOM 0 H ALA A 11 1.351 28.983 19.219 1.00 0.00 H new ATOM 0 HA ALA A 11 0.074 31.456 18.786 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.396 31.641 16.339 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.918 31.893 17.226 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.611 30.342 16.409 1.00 0.00 H new ATOM 127 N ARG A 12 -1.837 30.189 17.765 1.00 0.00 N ATOM 128 CA ARG A 12 -2.999 29.374 17.436 1.00 0.00 C ATOM 129 C ARG A 12 -3.529 29.718 16.047 1.00 0.00 C ATOM 130 O ARG A 12 -4.404 30.570 15.898 1.00 0.00 O ATOM 131 CB ARG A 12 -4.101 29.575 18.478 1.00 0.00 C ATOM 132 CG ARG A 12 -3.688 29.181 19.886 1.00 0.00 C ATOM 133 CD ARG A 12 -3.645 27.670 20.052 1.00 0.00 C ATOM 134 NE ARG A 12 -4.933 27.129 20.478 1.00 0.00 N ATOM 135 CZ ARG A 12 -5.364 27.161 21.734 1.00 0.00 C ATOM 136 NH1 ARG A 12 -4.613 27.704 22.682 1.00 0.00 N ATOM 137 NH2 ARG A 12 -6.548 26.648 22.044 1.00 0.00 N ATOM 0 H ARG A 12 -2.041 31.180 17.897 1.00 0.00 H new ATOM 0 HA ARG A 12 -2.691 28.328 17.440 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -4.403 30.622 18.477 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -4.974 28.991 18.188 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -2.707 29.601 20.109 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.388 29.607 20.604 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -3.353 27.210 19.108 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -2.882 27.407 20.784 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.534 26.703 19.773 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -3.702 28.098 22.448 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -4.946 27.727 23.646 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -7.128 26.229 21.317 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.878 26.673 23.009 1.00 0.00 H new ATOM 151 N VAL A 13 -2.991 29.048 15.032 1.00 0.00 N ATOM 152 CA VAL A 13 -3.410 29.282 13.655 1.00 0.00 C ATOM 153 C VAL A 13 -4.322 28.164 13.161 1.00 0.00 C ATOM 154 O VAL A 13 -4.342 27.069 13.723 1.00 0.00 O ATOM 155 CB VAL A 13 -2.197 29.395 12.712 1.00 0.00 C ATOM 156 CG1 VAL A 13 -1.340 30.595 13.086 1.00 0.00 C ATOM 157 CG2 VAL A 13 -1.378 28.114 12.741 1.00 0.00 C ATOM 0 H VAL A 13 -2.265 28.340 15.138 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.958 30.224 13.646 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.562 29.542 11.695 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.488 30.659 12.409 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.935 31.505 13.008 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.983 30.482 14.110 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -0.525 28.212 12.069 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.022 27.933 13.755 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.999 27.278 12.420 1.00 0.00 H new ATOM 167 N LYS A 14 -5.076 28.448 12.104 1.00 0.00 N ATOM 168 CA LYS A 14 -5.990 27.467 11.531 1.00 0.00 C ATOM 169 C LYS A 14 -5.222 26.352 10.829 1.00 0.00 C ATOM 170 O LYS A 14 -4.371 26.612 9.977 1.00 0.00 O ATOM 171 CB LYS A 14 -6.944 28.144 10.544 1.00 0.00 C ATOM 172 CG LYS A 14 -8.207 28.684 11.191 1.00 0.00 C ATOM 173 CD LYS A 14 -9.307 27.637 11.225 1.00 0.00 C ATOM 174 CE LYS A 14 -9.184 26.737 12.445 1.00 0.00 C ATOM 175 NZ LYS A 14 -10.510 26.233 12.899 1.00 0.00 N ATOM 0 H LYS A 14 -5.072 29.350 11.627 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.569 27.029 12.344 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.421 28.962 10.050 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.220 27.428 9.770 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.985 29.013 12.206 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -8.553 29.559 10.641 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.279 28.130 11.232 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.263 27.032 10.319 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.536 25.893 12.210 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.708 27.288 13.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.383 25.624 13.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -11.120 27.037 13.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.954 25.686 12.134 1.00 0.00 H new ATOM 189 N VAL A 15 -5.528 25.110 11.190 1.00 0.00 N ATOM 190 CA VAL A 15 -4.867 23.956 10.592 1.00 0.00 C ATOM 191 C VAL A 15 -4.962 23.995 9.071 1.00 0.00 C ATOM 192 O VAL A 15 -6.048 24.139 8.511 1.00 0.00 O ATOM 193 CB VAL A 15 -5.477 22.636 11.100 1.00 0.00 C ATOM 194 CG1 VAL A 15 -6.977 22.607 10.846 1.00 0.00 C ATOM 195 CG2 VAL A 15 -4.794 21.446 10.442 1.00 0.00 C ATOM 0 H VAL A 15 -6.229 24.877 11.893 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.819 24.002 10.888 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.314 22.571 12.176 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.390 21.667 11.212 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -7.451 23.439 11.368 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.167 22.695 9.776 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.237 20.522 10.812 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.924 21.503 9.361 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -3.730 21.459 10.680 1.00 0.00 H new ATOM 205 N GLU A 16 -3.817 23.865 8.409 1.00 0.00 N ATOM 206 CA GLU A 16 -3.771 23.886 6.951 1.00 0.00 C ATOM 207 C GLU A 16 -2.646 22.998 6.429 1.00 0.00 C ATOM 208 O GLU A 16 -1.541 22.969 6.972 1.00 0.00 O ATOM 209 CB GLU A 16 -3.582 25.318 6.446 1.00 0.00 C ATOM 210 CG GLU A 16 -4.873 26.117 6.383 1.00 0.00 C ATOM 211 CD GLU A 16 -4.659 27.532 5.881 1.00 0.00 C ATOM 212 OE1 GLU A 16 -3.926 28.294 6.545 1.00 0.00 O ATOM 213 OE2 GLU A 16 -5.226 27.877 4.823 1.00 0.00 O ATOM 0 H GLU A 16 -2.909 23.744 8.858 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.719 23.498 6.577 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.877 25.834 7.098 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -3.135 25.288 5.453 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.580 25.607 5.729 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.323 26.152 7.375 1.00 0.00 H new ATOM 220 N PRO A 17 -2.932 22.254 5.350 1.00 0.00 N ATOM 221 CA PRO A 17 -1.957 21.351 4.731 1.00 0.00 C ATOM 222 C PRO A 17 -0.830 22.105 4.034 1.00 0.00 C ATOM 223 O PRO A 17 -1.054 23.147 3.420 1.00 0.00 O ATOM 224 CB PRO A 17 -2.793 20.575 3.709 1.00 0.00 C ATOM 225 CG PRO A 17 -3.933 21.478 3.388 1.00 0.00 C ATOM 226 CD PRO A 17 -4.228 22.239 4.652 1.00 0.00 C ATOM 0 HA PRO A 17 -1.462 20.718 5.467 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.211 20.340 2.818 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.142 19.628 4.120 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.676 22.157 2.575 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -4.803 20.907 3.064 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -4.582 23.248 4.440 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -4.999 21.748 5.246 1.00 0.00 H new ATOM 234 N ALA A 18 0.383 21.570 4.134 1.00 0.00 N ATOM 235 CA ALA A 18 1.545 22.191 3.511 1.00 0.00 C ATOM 236 C ALA A 18 2.143 21.286 2.439 1.00 0.00 C ATOM 237 O ALA A 18 3.300 21.448 2.050 1.00 0.00 O ATOM 238 CB ALA A 18 2.591 22.529 4.563 1.00 0.00 C ATOM 0 H ALA A 18 0.586 20.708 4.640 1.00 0.00 H new ATOM 0 HA ALA A 18 1.219 23.113 3.030 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.453 22.992 4.083 1.00 0.00 H new ATOM 0 HB2 ALA A 18 2.165 23.221 5.290 1.00 0.00 H new ATOM 0 HB3 ALA A 18 2.905 21.617 5.070 1.00 0.00 H new ATOM 244 N VAL A 19 1.348 20.331 1.966 1.00 0.00 N ATOM 245 CA VAL A 19 1.799 19.400 0.939 1.00 0.00 C ATOM 246 C VAL A 19 0.708 19.152 -0.096 1.00 0.00 C ATOM 247 O VAL A 19 -0.482 19.225 0.212 1.00 0.00 O ATOM 248 CB VAL A 19 2.226 18.052 1.552 1.00 0.00 C ATOM 249 CG1 VAL A 19 1.067 17.419 2.308 1.00 0.00 C ATOM 250 CG2 VAL A 19 2.743 17.116 0.470 1.00 0.00 C ATOM 0 H VAL A 19 0.388 20.182 2.278 1.00 0.00 H new ATOM 0 HA VAL A 19 2.660 19.859 0.452 1.00 0.00 H new ATOM 0 HB VAL A 19 3.034 18.233 2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.387 16.468 2.734 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.747 18.086 3.108 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.236 17.249 1.624 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.040 16.169 0.920 1.00 0.00 H new ATOM 0 HG22 VAL A 19 1.957 16.938 -0.264 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.603 17.569 -0.023 1.00 0.00 H new ATOM 260 N ASP A 20 1.121 18.860 -1.324 1.00 0.00 N ATOM 261 CA ASP A 20 0.178 18.599 -2.406 1.00 0.00 C ATOM 262 C ASP A 20 -0.439 17.211 -2.267 1.00 0.00 C ATOM 263 O ASP A 20 -1.654 17.071 -2.121 1.00 0.00 O ATOM 264 CB ASP A 20 0.875 18.728 -3.761 1.00 0.00 C ATOM 265 CG ASP A 20 0.854 20.148 -4.291 1.00 0.00 C ATOM 266 OD1 ASP A 20 -0.253 20.690 -4.490 1.00 0.00 O ATOM 267 OD2 ASP A 20 1.944 20.718 -4.507 1.00 0.00 O ATOM 0 H ASP A 20 2.102 18.798 -1.596 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.620 19.339 -2.345 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.908 18.393 -3.668 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.390 18.068 -4.480 1.00 0.00 H new ATOM 272 N THR A 21 0.406 16.186 -2.314 1.00 0.00 N ATOM 273 CA THR A 21 -0.055 14.809 -2.196 1.00 0.00 C ATOM 274 C THR A 21 -1.244 14.547 -3.114 1.00 0.00 C ATOM 275 O THR A 21 -2.256 13.989 -2.690 1.00 0.00 O ATOM 276 CB THR A 21 -0.456 14.473 -0.747 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.989 15.636 -0.104 1.00 0.00 O ATOM 278 CG2 THR A 21 0.740 13.956 0.039 1.00 0.00 C ATOM 0 H THR A 21 1.414 16.284 -2.433 1.00 0.00 H new ATOM 0 HA THR A 21 0.777 14.170 -2.492 1.00 0.00 H new ATOM 0 HB THR A 21 -1.217 13.693 -0.775 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.737 15.987 -0.631 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.433 13.725 1.059 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.126 13.054 -0.437 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.520 14.718 0.058 1.00 0.00 H new ATOM 286 N SER A 22 -1.115 14.953 -4.373 1.00 0.00 N ATOM 287 CA SER A 22 -2.181 14.764 -5.350 1.00 0.00 C ATOM 288 C SER A 22 -1.665 14.024 -6.580 1.00 0.00 C ATOM 289 O SER A 22 -2.446 13.551 -7.406 1.00 0.00 O ATOM 290 CB SER A 22 -2.768 16.115 -5.763 1.00 0.00 C ATOM 291 OG SER A 22 -3.688 15.967 -6.830 1.00 0.00 O ATOM 0 H SER A 22 -0.283 15.415 -4.740 1.00 0.00 H new ATOM 0 HA SER A 22 -2.963 14.162 -4.887 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.267 16.574 -4.910 1.00 0.00 H new ATOM 0 HB3 SER A 22 -1.964 16.788 -6.062 1.00 0.00 H new ATOM 0 HG SER A 22 -3.586 15.078 -7.229 1.00 0.00 H new ATOM 297 N ARG A 23 -0.345 13.927 -6.694 1.00 0.00 N ATOM 298 CA ARG A 23 0.277 13.246 -7.824 1.00 0.00 C ATOM 299 C ARG A 23 1.204 12.132 -7.344 1.00 0.00 C ATOM 300 O ARG A 23 2.230 11.855 -7.965 1.00 0.00 O ATOM 301 CB ARG A 23 1.060 14.242 -8.680 1.00 0.00 C ATOM 302 CG ARG A 23 0.184 15.285 -9.355 1.00 0.00 C ATOM 303 CD ARG A 23 1.007 16.233 -10.213 1.00 0.00 C ATOM 304 NE ARG A 23 1.677 15.537 -11.309 1.00 0.00 N ATOM 305 CZ ARG A 23 2.118 16.145 -12.405 1.00 0.00 C ATOM 306 NH1 ARG A 23 1.960 17.453 -12.551 1.00 0.00 N ATOM 307 NH2 ARG A 23 2.717 15.443 -13.358 1.00 0.00 N ATOM 0 H ARG A 23 0.315 14.311 -6.018 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.514 12.802 -8.428 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.795 14.747 -8.054 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.614 13.696 -9.443 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.563 14.789 -9.974 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.356 15.854 -8.598 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.359 17.010 -10.619 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.751 16.731 -9.591 1.00 0.00 H new ATOM 0 HE ARG A 23 1.814 14.529 -11.228 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.499 17.996 -11.821 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.300 17.917 -13.394 1.00 0.00 H new ATOM 0 HH21 ARG A 23 2.839 14.436 -13.250 1.00 0.00 H new ATOM 0 HH22 ARG A 23 3.055 15.910 -14.199 1.00 0.00 H new ATOM 321 N ILE A 24 0.835 11.499 -6.236 1.00 0.00 N ATOM 322 CA ILE A 24 1.633 10.417 -5.674 1.00 0.00 C ATOM 323 C ILE A 24 1.268 9.079 -6.307 1.00 0.00 C ATOM 324 O ILE A 24 0.097 8.799 -6.563 1.00 0.00 O ATOM 325 CB ILE A 24 1.450 10.316 -4.148 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.116 11.505 -3.453 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.023 9.005 -3.631 1.00 0.00 C ATOM 328 CD1 ILE A 24 3.618 11.371 -3.333 1.00 0.00 C ATOM 0 H ILE A 24 -0.011 11.717 -5.710 1.00 0.00 H new ATOM 0 HA ILE A 24 2.676 10.648 -5.893 1.00 0.00 H new ATOM 0 HB ILE A 24 0.384 10.338 -3.923 1.00 0.00 H new ATOM 0 HG12 ILE A 24 1.884 12.415 -4.006 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.689 11.619 -2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.886 8.949 -2.551 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.508 8.170 -4.106 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.086 8.955 -3.865 1.00 0.00 H new ATOM 0 HD11 ILE A 24 4.023 12.250 -2.830 1.00 0.00 H new ATOM 0 HD12 ILE A 24 3.859 10.479 -2.755 1.00 0.00 H new ATOM 0 HD13 ILE A 24 4.056 11.288 -4.327 1.00 0.00 H new ATOM 340 N LYS A 25 2.279 8.253 -6.557 1.00 0.00 N ATOM 341 CA LYS A 25 2.066 6.942 -7.158 1.00 0.00 C ATOM 342 C LYS A 25 3.037 5.916 -6.582 1.00 0.00 C ATOM 343 O LYS A 25 4.197 6.226 -6.314 1.00 0.00 O ATOM 344 CB LYS A 25 2.232 7.021 -8.677 1.00 0.00 C ATOM 345 CG LYS A 25 0.941 7.329 -9.415 1.00 0.00 C ATOM 346 CD LYS A 25 1.163 7.410 -10.916 1.00 0.00 C ATOM 347 CE LYS A 25 -0.017 8.064 -11.619 1.00 0.00 C ATOM 348 NZ LYS A 25 0.145 9.541 -11.716 1.00 0.00 N ATOM 0 H LYS A 25 3.255 8.469 -6.352 1.00 0.00 H new ATOM 0 HA LYS A 25 1.049 6.624 -6.926 1.00 0.00 H new ATOM 0 HB2 LYS A 25 2.968 7.789 -8.914 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.631 6.074 -9.040 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.203 6.557 -9.197 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.531 8.273 -9.055 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.070 7.978 -11.121 1.00 0.00 H new ATOM 0 HD3 LYS A 25 1.317 6.408 -11.317 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -0.122 7.644 -12.619 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.935 7.834 -11.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -0.679 9.950 -12.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 0.220 9.945 -10.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.007 9.761 -12.254 1.00 0.00 H new ATOM 362 N VAL A 26 2.555 4.691 -6.397 1.00 0.00 N ATOM 363 CA VAL A 26 3.381 3.618 -5.856 1.00 0.00 C ATOM 364 C VAL A 26 3.295 2.368 -6.723 1.00 0.00 C ATOM 365 O VAL A 26 2.215 1.982 -7.171 1.00 0.00 O ATOM 366 CB VAL A 26 2.965 3.260 -4.416 1.00 0.00 C ATOM 367 CG1 VAL A 26 3.445 4.324 -3.441 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.456 3.086 -4.327 1.00 0.00 C ATOM 0 H VAL A 26 1.597 4.417 -6.614 1.00 0.00 H new ATOM 0 HA VAL A 26 4.408 3.983 -5.850 1.00 0.00 H new ATOM 0 HB VAL A 26 3.435 2.315 -4.144 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.142 4.054 -2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.532 4.396 -3.487 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.006 5.286 -3.707 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.179 2.833 -3.304 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.965 4.015 -4.617 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.142 2.285 -4.996 1.00 0.00 H new ATOM 378 N PHE A 27 4.441 1.737 -6.957 1.00 0.00 N ATOM 379 CA PHE A 27 4.497 0.529 -7.772 1.00 0.00 C ATOM 380 C PHE A 27 5.335 -0.549 -7.091 1.00 0.00 C ATOM 381 O PHE A 27 6.270 -0.248 -6.351 1.00 0.00 O ATOM 382 CB PHE A 27 5.077 0.846 -9.152 1.00 0.00 C ATOM 383 CG PHE A 27 6.181 1.863 -9.119 1.00 0.00 C ATOM 384 CD1 PHE A 27 5.892 3.218 -9.102 1.00 0.00 C ATOM 385 CD2 PHE A 27 7.508 1.465 -9.106 1.00 0.00 C ATOM 386 CE1 PHE A 27 6.906 4.157 -9.071 1.00 0.00 C ATOM 387 CE2 PHE A 27 8.526 2.399 -9.075 1.00 0.00 C ATOM 388 CZ PHE A 27 8.225 3.747 -9.059 1.00 0.00 C ATOM 0 H PHE A 27 5.344 2.042 -6.594 1.00 0.00 H new ATOM 0 HA PHE A 27 3.481 0.153 -7.890 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.454 -0.074 -9.599 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.278 1.210 -9.798 1.00 0.00 H new ATOM 0 HD1 PHE A 27 4.863 3.544 -9.113 1.00 0.00 H new ATOM 0 HD2 PHE A 27 7.750 0.412 -9.120 1.00 0.00 H new ATOM 0 HE1 PHE A 27 6.667 5.210 -9.056 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.556 2.075 -9.063 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.019 4.479 -9.037 1.00 0.00 H new ATOM 398 N GLY A 28 4.991 -1.808 -7.347 1.00 0.00 N ATOM 399 CA GLY A 28 5.720 -2.912 -6.751 1.00 0.00 C ATOM 400 C GLY A 28 4.801 -3.975 -6.183 1.00 0.00 C ATOM 401 O GLY A 28 3.589 -3.784 -6.074 1.00 0.00 O ATOM 0 H GLY A 28 4.221 -2.083 -7.956 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.370 -3.362 -7.502 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.364 -2.532 -5.958 1.00 0.00 H new ATOM 405 N PRO A 29 5.379 -5.126 -5.811 1.00 0.00 N ATOM 406 CA PRO A 29 4.621 -6.247 -5.246 1.00 0.00 C ATOM 407 C PRO A 29 4.097 -5.944 -3.847 1.00 0.00 C ATOM 408 O PRO A 29 3.013 -6.389 -3.470 1.00 0.00 O ATOM 409 CB PRO A 29 5.648 -7.381 -5.199 1.00 0.00 C ATOM 410 CG PRO A 29 6.968 -6.695 -5.125 1.00 0.00 C ATOM 411 CD PRO A 29 6.818 -5.423 -5.913 1.00 0.00 C ATOM 0 HA PRO A 29 3.735 -6.480 -5.837 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.488 -8.025 -4.334 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.580 -8.014 -6.084 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.241 -6.484 -4.091 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.757 -7.321 -5.541 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.425 -4.619 -5.497 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.129 -5.553 -6.950 1.00 0.00 H new ATOM 419 N GLY A 30 4.873 -5.184 -3.080 1.00 0.00 N ATOM 420 CA GLY A 30 4.468 -4.836 -1.730 1.00 0.00 C ATOM 421 C GLY A 30 3.149 -4.091 -1.695 1.00 0.00 C ATOM 422 O GLY A 30 2.442 -4.114 -0.686 1.00 0.00 O ATOM 0 H GLY A 30 5.774 -4.803 -3.369 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.385 -5.744 -1.133 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.241 -4.222 -1.269 1.00 0.00 H new ATOM 426 N ILE A 31 2.816 -3.427 -2.796 1.00 0.00 N ATOM 427 CA ILE A 31 1.572 -2.672 -2.886 1.00 0.00 C ATOM 428 C ILE A 31 0.617 -3.303 -3.893 1.00 0.00 C ATOM 429 O ILE A 31 -0.593 -3.087 -3.835 1.00 0.00 O ATOM 430 CB ILE A 31 1.831 -1.208 -3.289 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.616 -0.341 -2.951 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.157 -1.117 -4.772 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.574 0.101 -1.505 1.00 0.00 C ATOM 0 H ILE A 31 3.390 -3.396 -3.639 1.00 0.00 H new ATOM 0 HA ILE A 31 1.117 -2.693 -1.896 1.00 0.00 H new ATOM 0 HB ILE A 31 2.687 -0.837 -2.725 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.619 0.540 -3.592 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.293 -0.898 -3.179 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.337 -0.076 -5.042 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.048 -1.707 -4.985 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.319 -1.502 -5.353 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.313 0.712 -1.337 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.540 -0.775 -0.858 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.465 0.686 -1.277 1.00 0.00 H new ATOM 445 N GLU A 32 1.170 -4.087 -4.814 1.00 0.00 N ATOM 446 CA GLU A 32 0.366 -4.751 -5.833 1.00 0.00 C ATOM 447 C GLU A 32 -0.171 -6.084 -5.320 1.00 0.00 C ATOM 448 O GLU A 32 -1.353 -6.389 -5.470 1.00 0.00 O ATOM 449 CB GLU A 32 1.193 -4.975 -7.101 1.00 0.00 C ATOM 450 CG GLU A 32 1.511 -3.695 -7.855 1.00 0.00 C ATOM 451 CD GLU A 32 0.425 -3.315 -8.843 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.767 -3.410 -8.482 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.767 -2.922 -9.978 1.00 0.00 O ATOM 0 H GLU A 32 2.170 -4.277 -4.875 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.480 -4.106 -6.069 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.126 -5.470 -6.833 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.652 -5.651 -7.763 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.649 -2.882 -7.142 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.455 -3.816 -8.387 1.00 0.00 H new ATOM 460 N GLY A 33 0.709 -6.875 -4.714 1.00 0.00 N ATOM 461 CA GLY A 33 0.306 -8.167 -4.188 1.00 0.00 C ATOM 462 C GLY A 33 0.732 -9.315 -5.081 1.00 0.00 C ATOM 463 O GLY A 33 -0.073 -10.184 -5.415 1.00 0.00 O ATOM 0 H GLY A 33 1.693 -6.645 -4.578 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.738 -8.303 -3.196 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.777 -8.186 -4.069 1.00 0.00 H new ATOM 467 N LYS A 34 2.003 -9.319 -5.471 1.00 0.00 N ATOM 468 CA LYS A 34 2.536 -10.368 -6.332 1.00 0.00 C ATOM 469 C LYS A 34 3.254 -11.434 -5.510 1.00 0.00 C ATOM 470 O LYS A 34 2.769 -12.557 -5.373 1.00 0.00 O ATOM 471 CB LYS A 34 3.496 -9.772 -7.363 1.00 0.00 C ATOM 472 CG LYS A 34 2.975 -8.504 -8.017 1.00 0.00 C ATOM 473 CD LYS A 34 1.700 -8.765 -8.802 1.00 0.00 C ATOM 474 CE LYS A 34 2.002 -9.177 -10.235 1.00 0.00 C ATOM 475 NZ LYS A 34 0.899 -9.987 -10.823 1.00 0.00 N ATOM 0 H LYS A 34 2.683 -8.607 -5.204 1.00 0.00 H new ATOM 0 HA LYS A 34 1.700 -10.836 -6.852 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.448 -9.556 -6.878 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.693 -10.515 -8.136 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.785 -7.751 -7.252 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.736 -8.097 -8.683 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.123 -9.549 -8.311 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.082 -7.867 -8.803 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.163 -8.287 -10.843 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.928 -9.752 -10.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.143 -10.248 -11.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 0.762 -10.849 -10.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.021 -9.430 -10.822 1.00 0.00 H new ATOM 489 N ASP A 35 4.410 -11.074 -4.963 1.00 0.00 N ATOM 490 CA ASP A 35 5.193 -11.998 -4.152 1.00 0.00 C ATOM 491 C ASP A 35 5.099 -11.637 -2.673 1.00 0.00 C ATOM 492 O ASP A 35 6.023 -11.893 -1.901 1.00 0.00 O ATOM 493 CB ASP A 35 6.655 -11.990 -4.600 1.00 0.00 C ATOM 494 CG ASP A 35 7.364 -13.293 -4.288 1.00 0.00 C ATOM 495 OD1 ASP A 35 7.601 -13.568 -3.093 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.682 -14.039 -5.238 1.00 0.00 O ATOM 0 H ASP A 35 4.825 -10.148 -5.067 1.00 0.00 H new ATOM 0 HA ASP A 35 4.785 -12.999 -4.289 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.702 -11.802 -5.673 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.178 -11.169 -4.109 1.00 0.00 H new ATOM 501 N VAL A 36 3.977 -11.040 -2.285 1.00 0.00 N ATOM 502 CA VAL A 36 3.761 -10.644 -0.898 1.00 0.00 C ATOM 503 C VAL A 36 3.319 -11.831 -0.050 1.00 0.00 C ATOM 504 O VAL A 36 2.856 -11.662 1.079 1.00 0.00 O ATOM 505 CB VAL A 36 2.705 -9.528 -0.791 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.573 -9.054 0.649 1.00 0.00 C ATOM 507 CG2 VAL A 36 3.059 -8.370 -1.711 1.00 0.00 C ATOM 0 H VAL A 36 3.203 -10.820 -2.912 1.00 0.00 H new ATOM 0 HA VAL A 36 4.714 -10.269 -0.524 1.00 0.00 H new ATOM 0 HB VAL A 36 1.742 -9.931 -1.106 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.823 -8.266 0.705 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.270 -9.889 1.281 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.532 -8.667 0.994 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.302 -7.591 -1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.031 -7.965 -1.429 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.098 -8.723 -2.742 1.00 0.00 H new ATOM 517 N PHE A 37 3.464 -13.031 -0.600 1.00 0.00 N ATOM 518 CA PHE A 37 3.078 -14.248 0.106 1.00 0.00 C ATOM 519 C PHE A 37 3.557 -14.211 1.554 1.00 0.00 C ATOM 520 O PHE A 37 4.576 -13.595 1.867 1.00 0.00 O ATOM 521 CB PHE A 37 3.652 -15.477 -0.602 1.00 0.00 C ATOM 522 CG PHE A 37 3.594 -15.388 -2.100 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.391 -15.156 -2.747 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.742 -15.537 -2.861 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.334 -15.073 -4.126 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.692 -15.455 -4.240 1.00 0.00 C ATOM 527 CZ PHE A 37 3.486 -15.224 -4.873 1.00 0.00 C ATOM 0 H PHE A 37 3.846 -13.188 -1.533 1.00 0.00 H new ATOM 0 HA PHE A 37 1.990 -14.311 0.103 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.689 -15.612 -0.294 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.105 -16.362 -0.277 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.487 -15.039 -2.167 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.687 -15.719 -2.371 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.390 -14.890 -4.618 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.594 -15.571 -4.822 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.444 -15.162 -5.950 1.00 0.00 H new ATOM 537 N ARG A 38 2.814 -14.874 2.434 1.00 0.00 N ATOM 538 CA ARG A 38 3.161 -14.916 3.849 1.00 0.00 C ATOM 539 C ARG A 38 4.628 -15.288 4.039 1.00 0.00 C ATOM 540 O ARG A 38 5.136 -16.201 3.387 1.00 0.00 O ATOM 541 CB ARG A 38 2.270 -15.919 4.585 1.00 0.00 C ATOM 542 CG ARG A 38 2.164 -15.658 6.078 1.00 0.00 C ATOM 543 CD ARG A 38 1.213 -16.638 6.749 1.00 0.00 C ATOM 544 NE ARG A 38 1.556 -16.860 8.151 1.00 0.00 N ATOM 545 CZ ARG A 38 1.125 -17.900 8.857 1.00 0.00 C ATOM 546 NH1 ARG A 38 0.339 -18.808 8.295 1.00 0.00 N ATOM 547 NH2 ARG A 38 1.480 -18.032 10.129 1.00 0.00 N ATOM 0 H ARG A 38 1.968 -15.389 2.192 1.00 0.00 H new ATOM 0 HA ARG A 38 3.000 -13.922 4.266 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.272 -15.894 4.149 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.661 -16.924 4.427 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.151 -15.738 6.533 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.816 -14.639 6.247 1.00 0.00 H new ATOM 0 HD2 ARG A 38 0.194 -16.258 6.681 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.236 -17.588 6.215 1.00 0.00 H new ATOM 0 HE ARG A 38 2.159 -16.180 8.613 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.063 -18.709 7.318 1.00 0.00 H new ATOM 0 HH12 ARG A 38 0.010 -19.605 8.840 1.00 0.00 H new ATOM 0 HH21 ARG A 38 2.084 -17.335 10.565 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.149 -18.830 10.671 1.00 0.00 H new ATOM 561 N GLU A 39 5.304 -14.575 4.934 1.00 0.00 N ATOM 562 CA GLU A 39 6.713 -14.830 5.208 1.00 0.00 C ATOM 563 C GLU A 39 7.574 -14.481 3.997 1.00 0.00 C ATOM 564 O GLU A 39 8.668 -15.017 3.825 1.00 0.00 O ATOM 565 CB GLU A 39 6.924 -16.297 5.591 1.00 0.00 C ATOM 566 CG GLU A 39 6.027 -16.764 6.725 1.00 0.00 C ATOM 567 CD GLU A 39 5.787 -18.261 6.700 1.00 0.00 C ATOM 568 OE1 GLU A 39 6.645 -19.008 7.217 1.00 0.00 O ATOM 569 OE2 GLU A 39 4.743 -18.686 6.163 1.00 0.00 O ATOM 0 H GLU A 39 4.899 -13.816 5.482 1.00 0.00 H new ATOM 0 HA GLU A 39 7.015 -14.197 6.042 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.745 -16.922 4.716 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.965 -16.443 5.879 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.479 -16.488 7.678 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.070 -16.245 6.664 1.00 0.00 H new ATOM 576 N ALA A 40 7.071 -13.578 3.162 1.00 0.00 N ATOM 577 CA ALA A 40 7.794 -13.155 1.969 1.00 0.00 C ATOM 578 C ALA A 40 8.223 -11.695 2.075 1.00 0.00 C ATOM 579 O ALA A 40 7.414 -10.820 2.386 1.00 0.00 O ATOM 580 CB ALA A 40 6.936 -13.366 0.730 1.00 0.00 C ATOM 0 H ALA A 40 6.166 -13.125 3.290 1.00 0.00 H new ATOM 0 HA ALA A 40 8.693 -13.765 1.884 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.488 -13.046 -0.154 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.684 -14.422 0.638 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.021 -12.781 0.817 1.00 0.00 H new ATOM 586 N THR A 41 9.501 -11.439 1.816 1.00 0.00 N ATOM 587 CA THR A 41 10.038 -10.086 1.884 1.00 0.00 C ATOM 588 C THR A 41 9.610 -9.263 0.674 1.00 0.00 C ATOM 589 O THR A 41 10.206 -9.361 -0.399 1.00 0.00 O ATOM 590 CB THR A 41 11.576 -10.095 1.966 1.00 0.00 C ATOM 591 OG1 THR A 41 12.001 -10.849 3.107 1.00 0.00 O ATOM 592 CG2 THR A 41 12.122 -8.678 2.057 1.00 0.00 C ATOM 0 H THR A 41 10.184 -12.151 1.557 1.00 0.00 H new ATOM 0 HA THR A 41 9.636 -9.632 2.790 1.00 0.00 H new ATOM 0 HB THR A 41 11.963 -10.559 1.059 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.980 -10.852 3.151 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.210 -8.710 2.114 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.821 -8.115 1.174 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.726 -8.192 2.949 1.00 0.00 H new ATOM 600 N THR A 42 8.574 -8.449 0.854 1.00 0.00 N ATOM 601 CA THR A 42 8.066 -7.609 -0.223 1.00 0.00 C ATOM 602 C THR A 42 8.174 -6.131 0.135 1.00 0.00 C ATOM 603 O THR A 42 7.975 -5.746 1.287 1.00 0.00 O ATOM 604 CB THR A 42 6.598 -7.941 -0.550 1.00 0.00 C ATOM 605 OG1 THR A 42 6.255 -7.425 -1.841 1.00 0.00 O ATOM 606 CG2 THR A 42 5.664 -7.357 0.500 1.00 0.00 C ATOM 0 H THR A 42 8.071 -8.354 1.736 1.00 0.00 H new ATOM 0 HA THR A 42 8.680 -7.813 -1.100 1.00 0.00 H new ATOM 0 HB THR A 42 6.485 -9.025 -0.551 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.721 -7.939 -2.533 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.633 -7.604 0.248 1.00 0.00 H new ATOM 0 HG22 THR A 42 5.909 -7.774 1.477 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.781 -6.274 0.528 1.00 0.00 H new ATOM 614 N ASP A 43 8.488 -5.308 -0.859 1.00 0.00 N ATOM 615 CA ASP A 43 8.620 -3.871 -0.649 1.00 0.00 C ATOM 616 C ASP A 43 8.203 -3.099 -1.897 1.00 0.00 C ATOM 617 O ASP A 43 8.329 -3.594 -3.017 1.00 0.00 O ATOM 618 CB ASP A 43 10.060 -3.519 -0.274 1.00 0.00 C ATOM 619 CG ASP A 43 11.039 -3.811 -1.395 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.703 -3.531 -2.564 1.00 0.00 O ATOM 621 OD2 ASP A 43 12.141 -4.320 -1.102 1.00 0.00 O ATOM 0 H ASP A 43 8.656 -5.611 -1.818 1.00 0.00 H new ATOM 0 HA ASP A 43 7.960 -3.586 0.170 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.116 -2.462 -0.013 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.349 -4.083 0.613 1.00 0.00 H new ATOM 626 N PHE A 44 7.705 -1.883 -1.695 1.00 0.00 N ATOM 627 CA PHE A 44 7.267 -1.043 -2.804 1.00 0.00 C ATOM 628 C PHE A 44 8.087 0.242 -2.868 1.00 0.00 C ATOM 629 O PHE A 44 8.881 0.533 -1.973 1.00 0.00 O ATOM 630 CB PHE A 44 5.781 -0.707 -2.661 1.00 0.00 C ATOM 631 CG PHE A 44 5.452 0.029 -1.394 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.777 1.368 -1.251 1.00 0.00 C ATOM 633 CD2 PHE A 44 4.818 -0.618 -0.345 1.00 0.00 C ATOM 634 CE1 PHE A 44 5.475 2.049 -0.086 1.00 0.00 C ATOM 635 CE2 PHE A 44 4.513 0.057 0.821 1.00 0.00 C ATOM 636 CZ PHE A 44 4.843 1.392 0.952 1.00 0.00 C ATOM 0 H PHE A 44 7.595 -1.458 -0.774 1.00 0.00 H new ATOM 0 HA PHE A 44 7.419 -1.597 -3.730 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.470 -0.104 -3.514 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.203 -1.630 -2.696 1.00 0.00 H new ATOM 0 HD1 PHE A 44 6.272 1.886 -2.059 1.00 0.00 H new ATOM 0 HD2 PHE A 44 4.559 -1.662 -0.440 1.00 0.00 H new ATOM 0 HE1 PHE A 44 5.733 3.093 0.012 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.017 -0.459 1.630 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.607 1.921 1.864 1.00 0.00 H new ATOM 646 N THR A 45 7.889 1.010 -3.935 1.00 0.00 N ATOM 647 CA THR A 45 8.610 2.264 -4.119 1.00 0.00 C ATOM 648 C THR A 45 7.646 3.431 -4.296 1.00 0.00 C ATOM 649 O THR A 45 6.720 3.368 -5.105 1.00 0.00 O ATOM 650 CB THR A 45 9.548 2.198 -5.339 1.00 0.00 C ATOM 651 OG1 THR A 45 10.348 1.012 -5.279 1.00 0.00 O ATOM 652 CG2 THR A 45 10.451 3.422 -5.394 1.00 0.00 C ATOM 0 H THR A 45 7.235 0.786 -4.685 1.00 0.00 H new ATOM 0 HA THR A 45 9.206 2.422 -3.220 1.00 0.00 H new ATOM 0 HB THR A 45 8.935 2.177 -6.240 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.288 0.622 -4.382 1.00 0.00 H new ATOM 0 HG21 THR A 45 11.104 3.353 -6.264 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.840 4.322 -5.469 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.056 3.469 -4.488 1.00 0.00 H new ATOM 660 N VAL A 46 7.870 4.498 -3.535 1.00 0.00 N ATOM 661 CA VAL A 46 7.022 5.681 -3.609 1.00 0.00 C ATOM 662 C VAL A 46 7.696 6.791 -4.408 1.00 0.00 C ATOM 663 O VAL A 46 8.735 7.315 -4.008 1.00 0.00 O ATOM 664 CB VAL A 46 6.676 6.213 -2.205 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.722 7.393 -2.301 1.00 0.00 C ATOM 666 CG2 VAL A 46 6.081 5.105 -1.348 1.00 0.00 C ATOM 0 H VAL A 46 8.632 4.567 -2.860 1.00 0.00 H new ATOM 0 HA VAL A 46 6.103 5.380 -4.112 1.00 0.00 H new ATOM 0 HB VAL A 46 7.594 6.557 -1.729 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.489 7.755 -1.300 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.189 8.192 -2.876 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.803 7.079 -2.796 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.842 5.498 -0.360 1.00 0.00 H new ATOM 0 HG22 VAL A 46 5.172 4.729 -1.818 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.802 4.293 -1.251 1.00 0.00 H new ATOM 676 N ASP A 47 7.096 7.145 -5.540 1.00 0.00 N ATOM 677 CA ASP A 47 7.638 8.194 -6.396 1.00 0.00 C ATOM 678 C ASP A 47 7.081 9.558 -6.001 1.00 0.00 C ATOM 679 O ASP A 47 5.867 9.747 -5.927 1.00 0.00 O ATOM 680 CB ASP A 47 7.315 7.902 -7.862 1.00 0.00 C ATOM 681 CG ASP A 47 8.367 8.450 -8.807 1.00 0.00 C ATOM 682 OD1 ASP A 47 8.282 9.644 -9.161 1.00 0.00 O ATOM 683 OD2 ASP A 47 9.275 7.684 -9.192 1.00 0.00 O ATOM 0 H ASP A 47 6.235 6.721 -5.886 1.00 0.00 H new ATOM 0 HA ASP A 47 8.720 8.212 -6.267 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.229 6.825 -8.004 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.346 8.335 -8.111 1.00 0.00 H new ATOM 688 N SER A 48 7.977 10.507 -5.748 1.00 0.00 N ATOM 689 CA SER A 48 7.575 11.853 -5.355 1.00 0.00 C ATOM 690 C SER A 48 8.336 12.902 -6.160 1.00 0.00 C ATOM 691 O SER A 48 9.565 12.878 -6.227 1.00 0.00 O ATOM 692 CB SER A 48 7.819 12.065 -3.860 1.00 0.00 C ATOM 693 OG SER A 48 9.082 11.554 -3.471 1.00 0.00 O ATOM 0 H SER A 48 8.986 10.369 -5.808 1.00 0.00 H new ATOM 0 HA SER A 48 6.510 11.963 -5.561 1.00 0.00 H new ATOM 0 HB2 SER A 48 7.766 13.129 -3.627 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.033 11.574 -3.287 1.00 0.00 H new ATOM 0 HG SER A 48 9.695 11.579 -4.236 1.00 0.00 H new ATOM 699 N ARG A 49 7.596 13.823 -6.769 1.00 0.00 N ATOM 700 CA ARG A 49 8.199 14.881 -7.570 1.00 0.00 C ATOM 701 C ARG A 49 8.006 16.242 -6.907 1.00 0.00 C ATOM 702 O ARG A 49 8.943 16.840 -6.377 1.00 0.00 O ATOM 703 CB ARG A 49 7.592 14.896 -8.974 1.00 0.00 C ATOM 704 CG ARG A 49 8.401 14.113 -9.995 1.00 0.00 C ATOM 705 CD ARG A 49 9.788 14.708 -10.182 1.00 0.00 C ATOM 706 NE ARG A 49 9.876 15.519 -11.393 1.00 0.00 N ATOM 707 CZ ARG A 49 11.025 15.900 -11.940 1.00 0.00 C ATOM 708 NH1 ARG A 49 12.177 15.545 -11.387 1.00 0.00 N ATOM 709 NH2 ARG A 49 11.024 16.638 -13.044 1.00 0.00 N ATOM 0 H ARG A 49 6.578 13.858 -6.723 1.00 0.00 H new ATOM 0 HA ARG A 49 9.268 14.681 -7.645 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.584 14.485 -8.929 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.500 15.929 -9.310 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.489 13.076 -9.672 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.875 14.106 -10.950 1.00 0.00 H new ATOM 0 HD2 ARG A 49 10.040 15.321 -9.316 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.524 13.905 -10.229 1.00 0.00 H new ATOM 0 HE ARG A 49 9.008 15.809 -11.843 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.182 14.978 -10.539 1.00 0.00 H new ATOM 0 HH12 ARG A 49 13.058 15.839 -11.809 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.140 16.913 -13.473 1.00 0.00 H new ATOM 0 HH22 ARG A 49 11.907 16.930 -13.463 1.00 0.00 H new ATOM 723 N PRO A 50 6.763 16.745 -6.937 1.00 0.00 N ATOM 724 CA PRO A 50 6.418 18.040 -6.344 1.00 0.00 C ATOM 725 C PRO A 50 6.476 18.014 -4.820 1.00 0.00 C ATOM 726 O PRO A 50 6.192 19.014 -4.161 1.00 0.00 O ATOM 727 CB PRO A 50 4.983 18.278 -6.821 1.00 0.00 C ATOM 728 CG PRO A 50 4.437 16.915 -7.074 1.00 0.00 C ATOM 729 CD PRO A 50 5.598 16.086 -7.552 1.00 0.00 C ATOM 0 HA PRO A 50 7.116 18.823 -6.641 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.398 18.805 -6.068 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.962 18.887 -7.725 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.004 16.494 -6.167 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.644 16.945 -7.822 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.509 15.048 -7.233 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.667 16.080 -8.640 1.00 0.00 H new ATOM 737 N LEU A 51 6.845 16.864 -4.267 1.00 0.00 N ATOM 738 CA LEU A 51 6.941 16.707 -2.819 1.00 0.00 C ATOM 739 C LEU A 51 8.397 16.723 -2.365 1.00 0.00 C ATOM 740 O LEU A 51 8.748 17.388 -1.390 1.00 0.00 O ATOM 741 CB LEU A 51 6.272 15.403 -2.382 1.00 0.00 C ATOM 742 CG LEU A 51 4.926 15.087 -3.034 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.196 14.005 -2.255 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.073 16.344 -3.132 1.00 0.00 C ATOM 0 H LEU A 51 7.083 16.027 -4.799 1.00 0.00 H new ATOM 0 HA LEU A 51 6.425 17.546 -2.352 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.956 14.580 -2.590 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.131 15.435 -1.302 1.00 0.00 H new ATOM 0 HG LEU A 51 5.111 14.717 -4.043 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.240 13.794 -2.734 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.801 13.099 -2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.023 14.346 -1.234 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.118 16.101 -3.599 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.897 16.743 -2.133 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.592 17.090 -3.735 1.00 0.00 H new ATOM 756 N THR A 52 9.243 15.987 -3.080 1.00 0.00 N ATOM 757 CA THR A 52 10.661 15.917 -2.752 1.00 0.00 C ATOM 758 C THR A 52 11.502 15.663 -3.997 1.00 0.00 C ATOM 759 O THR A 52 11.060 14.990 -4.928 1.00 0.00 O ATOM 760 CB THR A 52 10.944 14.809 -1.720 1.00 0.00 C ATOM 761 OG1 THR A 52 12.218 15.028 -1.104 1.00 0.00 O ATOM 762 CG2 THR A 52 10.922 13.438 -2.379 1.00 0.00 C ATOM 0 H THR A 52 8.970 15.431 -3.890 1.00 0.00 H new ATOM 0 HA THR A 52 10.934 16.881 -2.324 1.00 0.00 H new ATOM 0 HB THR A 52 10.163 14.842 -0.960 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.104 15.588 -0.308 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.124 12.671 -1.631 1.00 0.00 H new ATOM 0 HG22 THR A 52 9.942 13.263 -2.822 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.684 13.396 -3.157 1.00 0.00 H new ATOM 770 N GLN A 53 12.715 16.206 -4.008 1.00 0.00 N ATOM 771 CA GLN A 53 13.617 16.038 -5.140 1.00 0.00 C ATOM 772 C GLN A 53 14.825 15.191 -4.753 1.00 0.00 C ATOM 773 O GLN A 53 15.281 14.350 -5.528 1.00 0.00 O ATOM 774 CB GLN A 53 14.080 17.401 -5.658 1.00 0.00 C ATOM 775 CG GLN A 53 12.982 18.194 -6.348 1.00 0.00 C ATOM 776 CD GLN A 53 12.415 17.476 -7.558 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.142 17.147 -8.495 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.111 17.229 -7.542 1.00 0.00 N ATOM 0 H GLN A 53 13.095 16.766 -3.245 1.00 0.00 H new ATOM 0 HA GLN A 53 13.073 15.522 -5.931 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.469 17.985 -4.824 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.904 17.254 -6.356 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.179 18.390 -5.637 1.00 0.00 H new ATOM 0 HG3 GLN A 53 13.377 19.162 -6.657 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.547 17.520 -6.744 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.673 16.748 -8.328 1.00 0.00 H new ATOM 787 N VAL A 54 15.339 15.419 -3.548 1.00 0.00 N ATOM 788 CA VAL A 54 16.494 14.677 -3.057 1.00 0.00 C ATOM 789 C VAL A 54 16.184 13.992 -1.731 1.00 0.00 C ATOM 790 O VAL A 54 17.031 13.925 -0.842 1.00 0.00 O ATOM 791 CB VAL A 54 17.716 15.596 -2.874 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.098 16.246 -4.195 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.435 16.650 -1.814 1.00 0.00 C ATOM 0 H VAL A 54 14.974 16.112 -2.894 1.00 0.00 H new ATOM 0 HA VAL A 54 16.727 13.921 -3.807 1.00 0.00 H new ATOM 0 HB VAL A 54 18.557 14.990 -2.538 1.00 0.00 H new ATOM 0 HG11 VAL A 54 18.963 16.892 -4.046 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.343 15.473 -4.923 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.262 16.840 -4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.309 17.291 -1.697 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.580 17.254 -2.119 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.214 16.162 -0.865 1.00 0.00 H new ATOM 803 N GLY A 55 14.962 13.483 -1.605 1.00 0.00 N ATOM 804 CA GLY A 55 14.561 12.809 -0.384 1.00 0.00 C ATOM 805 C GLY A 55 13.981 13.764 0.641 1.00 0.00 C ATOM 806 O GLY A 55 14.204 14.972 0.571 1.00 0.00 O ATOM 0 H GLY A 55 14.243 13.526 -2.327 1.00 0.00 H new ATOM 0 HA2 GLY A 55 13.823 12.043 -0.621 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.423 12.299 0.046 1.00 0.00 H new ATOM 810 N GLY A 56 13.233 13.221 1.597 1.00 0.00 N ATOM 811 CA GLY A 56 12.629 14.047 2.626 1.00 0.00 C ATOM 812 C GLY A 56 12.578 13.351 3.971 1.00 0.00 C ATOM 813 O GLY A 56 12.700 13.993 5.015 1.00 0.00 O ATOM 0 H GLY A 56 13.035 12.224 1.677 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.194 14.974 2.721 1.00 0.00 H new ATOM 0 HA3 GLY A 56 11.618 14.319 2.322 1.00 0.00 H new ATOM 817 N ASP A 57 12.395 12.036 3.949 1.00 0.00 N ATOM 818 CA ASP A 57 12.326 11.252 5.177 1.00 0.00 C ATOM 819 C ASP A 57 11.053 11.570 5.954 1.00 0.00 C ATOM 820 O ASP A 57 11.068 11.656 7.183 1.00 0.00 O ATOM 821 CB ASP A 57 13.553 11.524 6.049 1.00 0.00 C ATOM 822 CG ASP A 57 14.834 11.590 5.242 1.00 0.00 C ATOM 823 OD1 ASP A 57 15.098 12.648 4.634 1.00 0.00 O ATOM 824 OD2 ASP A 57 15.573 10.583 5.218 1.00 0.00 O ATOM 0 H ASP A 57 12.292 11.490 3.094 1.00 0.00 H new ATOM 0 HA ASP A 57 12.309 10.196 4.905 1.00 0.00 H new ATOM 0 HB2 ASP A 57 13.414 12.464 6.583 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.641 10.740 6.802 1.00 0.00 H new ATOM 829 N HIS A 58 9.952 11.745 5.231 1.00 0.00 N ATOM 830 CA HIS A 58 8.669 12.054 5.853 1.00 0.00 C ATOM 831 C HIS A 58 7.592 11.076 5.392 1.00 0.00 C ATOM 832 O HIS A 58 6.408 11.412 5.360 1.00 0.00 O ATOM 833 CB HIS A 58 8.250 13.486 5.521 1.00 0.00 C ATOM 834 CG HIS A 58 8.766 14.502 6.492 1.00 0.00 C ATOM 835 ND1 HIS A 58 8.021 15.582 6.918 1.00 0.00 N ATOM 836 CD2 HIS A 58 9.959 14.597 7.124 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.736 16.298 7.768 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.915 15.722 7.910 1.00 0.00 N ATOM 0 H HIS A 58 9.922 11.678 4.214 1.00 0.00 H new ATOM 0 HA HIS A 58 8.784 11.958 6.933 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.606 13.737 4.522 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.162 13.540 5.495 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.791 13.915 7.028 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.411 17.201 8.263 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.671 16.058 8.507 1.00 0.00 H new ATOM 846 N ILE A 59 8.011 9.866 5.037 1.00 0.00 N ATOM 847 CA ILE A 59 7.083 8.840 4.580 1.00 0.00 C ATOM 848 C ILE A 59 6.617 7.964 5.738 1.00 0.00 C ATOM 849 O ILE A 59 7.376 7.687 6.666 1.00 0.00 O ATOM 850 CB ILE A 59 7.719 7.947 3.498 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.782 8.691 2.163 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.934 6.652 3.352 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.451 9.261 1.725 1.00 0.00 C ATOM 0 H ILE A 59 8.988 9.572 5.057 1.00 0.00 H new ATOM 0 HA ILE A 59 6.225 9.359 4.153 1.00 0.00 H new ATOM 0 HB ILE A 59 8.736 7.701 3.803 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.507 9.501 2.242 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.147 8.010 1.394 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.395 6.031 2.584 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.936 6.116 4.301 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.907 6.879 3.066 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.571 9.774 0.771 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.728 8.453 1.613 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.093 9.967 2.474 1.00 0.00 H new ATOM 865 N LYS A 60 5.363 7.529 5.676 1.00 0.00 N ATOM 866 CA LYS A 60 4.794 6.681 6.717 1.00 0.00 C ATOM 867 C LYS A 60 4.109 5.461 6.111 1.00 0.00 C ATOM 868 O LYS A 60 3.881 5.401 4.903 1.00 0.00 O ATOM 869 CB LYS A 60 3.794 7.475 7.560 1.00 0.00 C ATOM 870 CG LYS A 60 4.405 8.097 8.804 1.00 0.00 C ATOM 871 CD LYS A 60 3.471 9.117 9.433 1.00 0.00 C ATOM 872 CE LYS A 60 2.547 8.471 10.454 1.00 0.00 C ATOM 873 NZ LYS A 60 1.835 9.486 11.279 1.00 0.00 N ATOM 0 H LYS A 60 4.721 7.750 4.915 1.00 0.00 H new ATOM 0 HA LYS A 60 5.607 6.338 7.357 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.359 8.264 6.946 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.978 6.816 7.857 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.633 7.315 9.529 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.349 8.577 8.546 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.057 9.900 9.915 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.877 9.596 8.655 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.818 7.845 9.939 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.126 7.816 11.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.216 9.005 11.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.530 10.067 11.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.262 10.095 10.661 1.00 0.00 H new ATOM 887 N ALA A 61 3.782 4.490 6.957 1.00 0.00 N ATOM 888 CA ALA A 61 3.120 3.273 6.505 1.00 0.00 C ATOM 889 C ALA A 61 2.552 2.487 7.682 1.00 0.00 C ATOM 890 O ALA A 61 3.168 2.411 8.746 1.00 0.00 O ATOM 891 CB ALA A 61 4.088 2.409 5.710 1.00 0.00 C ATOM 0 H ALA A 61 3.965 4.523 7.960 1.00 0.00 H new ATOM 0 HA ALA A 61 2.290 3.560 5.859 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.580 1.503 5.379 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.442 2.964 4.842 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.936 2.139 6.339 1.00 0.00 H new ATOM 897 N HIS A 62 1.373 1.905 7.485 1.00 0.00 N ATOM 898 CA HIS A 62 0.721 1.125 8.531 1.00 0.00 C ATOM 899 C HIS A 62 -0.102 -0.010 7.929 1.00 0.00 C ATOM 900 O HIS A 62 -1.108 0.228 7.260 1.00 0.00 O ATOM 901 CB HIS A 62 -0.174 2.024 9.384 1.00 0.00 C ATOM 902 CG HIS A 62 -1.023 1.270 10.361 1.00 0.00 C ATOM 903 ND1 HIS A 62 -1.990 0.344 10.163 1.00 0.00 N flip ATOM 904 CD2 HIS A 62 -0.926 1.435 11.727 1.00 0.00 C flip ATOM 905 CE1 HIS A 62 -2.454 -0.031 11.400 1.00 0.00 C flip ATOM 906 NE2 HIS A 62 -1.795 0.641 12.327 1.00 0.00 N flip ATOM 0 H HIS A 62 0.850 1.959 6.611 1.00 0.00 H new ATOM 0 HA HIS A 62 1.496 0.692 9.164 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.450 2.733 9.929 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.820 2.607 8.728 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.246 2.108 12.228 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -3.232 -0.757 11.585 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -1.933 0.561 13.334 1.00 0.00 H new ATOM 914 N ILE A 63 0.331 -1.242 8.172 1.00 0.00 N ATOM 915 CA ILE A 63 -0.367 -2.412 7.654 1.00 0.00 C ATOM 916 C ILE A 63 -1.392 -2.930 8.658 1.00 0.00 C ATOM 917 O ILE A 63 -1.165 -2.895 9.867 1.00 0.00 O ATOM 918 CB ILE A 63 0.616 -3.547 7.310 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.669 -3.055 6.315 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.135 -4.745 6.747 1.00 0.00 C ATOM 921 CD1 ILE A 63 2.927 -3.895 6.302 1.00 0.00 C ATOM 0 H ILE A 63 1.162 -1.456 8.724 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.879 -2.097 6.745 1.00 0.00 H new ATOM 0 HB ILE A 63 1.124 -3.858 8.223 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.236 -3.048 5.315 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.932 -2.025 6.556 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.573 -5.539 6.509 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.850 -5.106 7.486 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.666 -4.449 5.842 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.629 -3.488 5.574 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.383 -3.882 7.292 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.677 -4.921 6.031 1.00 0.00 H new ATOM 933 N ALA A 64 -2.521 -3.411 8.147 1.00 0.00 N ATOM 934 CA ALA A 64 -3.580 -3.939 8.998 1.00 0.00 C ATOM 935 C ALA A 64 -4.072 -5.289 8.487 1.00 0.00 C ATOM 936 O ALA A 64 -4.652 -5.380 7.406 1.00 0.00 O ATOM 937 CB ALA A 64 -4.734 -2.951 9.080 1.00 0.00 C ATOM 0 H ALA A 64 -2.725 -3.446 7.148 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.170 -4.085 9.997 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.517 -3.359 9.719 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.378 -2.010 9.498 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.135 -2.776 8.082 1.00 0.00 H new ATOM 943 N ASN A 65 -3.836 -6.335 9.272 1.00 0.00 N ATOM 944 CA ASN A 65 -4.255 -7.681 8.898 1.00 0.00 C ATOM 945 C ASN A 65 -5.764 -7.845 9.056 1.00 0.00 C ATOM 946 O ASN A 65 -6.403 -7.182 9.873 1.00 0.00 O ATOM 947 CB ASN A 65 -3.525 -8.721 9.752 1.00 0.00 C ATOM 948 CG ASN A 65 -2.075 -8.891 9.341 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.215 -9.171 10.313 1.00 0.00 O flip ATOM 950 ND2 ASN A 65 -1.733 -8.771 8.165 1.00 0.00 N flip ATOM 0 H ASN A 65 -3.357 -6.277 10.171 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.998 -7.836 7.850 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.570 -8.424 10.800 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.038 -9.679 9.670 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -2.429 -8.555 7.451 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.754 -8.887 7.904 1.00 0.00 H new ATOM 957 N PRO A 66 -6.347 -8.751 8.257 1.00 0.00 N ATOM 958 CA PRO A 66 -7.787 -9.025 8.291 1.00 0.00 C ATOM 959 C PRO A 66 -8.213 -9.735 9.571 1.00 0.00 C ATOM 960 O PRO A 66 -9.392 -10.027 9.767 1.00 0.00 O ATOM 961 CB PRO A 66 -8.004 -9.933 7.078 1.00 0.00 C ATOM 962 CG PRO A 66 -6.684 -10.588 6.854 1.00 0.00 C ATOM 963 CD PRO A 66 -5.647 -9.578 7.260 1.00 0.00 C ATOM 0 HA PRO A 66 -8.376 -8.108 8.266 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.784 -10.670 7.270 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.315 -9.359 6.205 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.595 -11.499 7.446 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.562 -10.874 5.809 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.764 -10.057 7.684 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.311 -8.984 6.410 1.00 0.00 H new ATOM 971 N SER A 67 -7.245 -10.011 10.439 1.00 0.00 N ATOM 972 CA SER A 67 -7.519 -10.690 11.700 1.00 0.00 C ATOM 973 C SER A 67 -7.404 -9.724 12.875 1.00 0.00 C ATOM 974 O SER A 67 -7.960 -9.962 13.946 1.00 0.00 O ATOM 975 CB SER A 67 -6.555 -11.862 11.892 1.00 0.00 C ATOM 976 OG SER A 67 -7.046 -13.035 11.266 1.00 0.00 O ATOM 0 H SER A 67 -6.264 -9.775 10.292 1.00 0.00 H new ATOM 0 HA SER A 67 -8.540 -11.070 11.665 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.580 -11.606 11.478 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.411 -12.047 12.956 1.00 0.00 H new ATOM 0 HG SER A 67 -6.411 -13.769 11.402 1.00 0.00 H new ATOM 982 N GLY A 68 -6.677 -8.631 12.664 1.00 0.00 N ATOM 983 CA GLY A 68 -6.501 -7.644 13.714 1.00 0.00 C ATOM 984 C GLY A 68 -5.042 -7.322 13.968 1.00 0.00 C ATOM 985 O GLY A 68 -4.709 -6.219 14.401 1.00 0.00 O ATOM 0 H GLY A 68 -6.207 -8.411 11.786 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.029 -6.730 13.442 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.954 -8.012 14.634 1.00 0.00 H new ATOM 989 N ALA A 69 -4.169 -8.287 13.699 1.00 0.00 N ATOM 990 CA ALA A 69 -2.737 -8.101 13.901 1.00 0.00 C ATOM 991 C ALA A 69 -2.192 -7.007 12.989 1.00 0.00 C ATOM 992 O ALA A 69 -2.892 -6.521 12.100 1.00 0.00 O ATOM 993 CB ALA A 69 -1.996 -9.408 13.662 1.00 0.00 C ATOM 0 H ALA A 69 -4.428 -9.206 13.340 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.578 -7.790 14.933 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.928 -9.254 13.816 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.358 -10.164 14.359 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.170 -9.743 12.640 1.00 0.00 H new ATOM 999 N SER A 70 -0.939 -6.625 13.214 1.00 0.00 N ATOM 1000 CA SER A 70 -0.302 -5.585 12.415 1.00 0.00 C ATOM 1001 C SER A 70 1.099 -6.011 11.987 1.00 0.00 C ATOM 1002 O SER A 70 1.889 -6.497 12.797 1.00 0.00 O ATOM 1003 CB SER A 70 -0.230 -4.277 13.206 1.00 0.00 C ATOM 1004 OG SER A 70 0.408 -4.471 14.456 1.00 0.00 O ATOM 0 H SER A 70 -0.345 -7.020 13.943 1.00 0.00 H new ATOM 0 HA SER A 70 -0.905 -5.428 11.520 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.314 -3.529 12.629 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.236 -3.888 13.364 1.00 0.00 H new ATOM 0 HG SER A 70 1.055 -5.203 14.383 1.00 0.00 H new ATOM 1010 N THR A 71 1.402 -5.825 10.706 1.00 0.00 N ATOM 1011 CA THR A 71 2.706 -6.191 10.168 1.00 0.00 C ATOM 1012 C THR A 71 3.706 -5.051 10.327 1.00 0.00 C ATOM 1013 O THR A 71 3.348 -3.880 10.208 1.00 0.00 O ATOM 1014 CB THR A 71 2.612 -6.572 8.678 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.661 -7.628 8.502 1.00 0.00 O ATOM 1016 CG2 THR A 71 3.968 -7.010 8.145 1.00 0.00 C ATOM 0 H THR A 71 0.761 -5.423 10.022 1.00 0.00 H new ATOM 0 HA THR A 71 3.051 -7.055 10.736 1.00 0.00 H new ATOM 0 HB THR A 71 2.287 -5.694 8.121 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.606 -7.863 7.552 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.877 -7.274 7.091 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.683 -6.194 8.254 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.317 -7.876 8.707 1.00 0.00 H new ATOM 1024 N GLU A 72 4.959 -5.402 10.595 1.00 0.00 N ATOM 1025 CA GLU A 72 6.010 -4.407 10.771 1.00 0.00 C ATOM 1026 C GLU A 72 6.576 -3.971 9.422 1.00 0.00 C ATOM 1027 O GLU A 72 6.990 -4.801 8.613 1.00 0.00 O ATOM 1028 CB GLU A 72 7.131 -4.965 11.650 1.00 0.00 C ATOM 1029 CG GLU A 72 8.016 -3.892 12.262 1.00 0.00 C ATOM 1030 CD GLU A 72 8.692 -4.352 13.539 1.00 0.00 C ATOM 1031 OE1 GLU A 72 9.694 -5.091 13.448 1.00 0.00 O ATOM 1032 OE2 GLU A 72 8.218 -3.971 14.630 1.00 0.00 O ATOM 0 H GLU A 72 5.271 -6.368 10.695 1.00 0.00 H new ATOM 0 HA GLU A 72 5.573 -3.537 11.262 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.692 -5.561 12.450 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.748 -5.637 11.054 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.776 -3.597 11.539 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.415 -3.007 12.472 1.00 0.00 H new ATOM 1039 N CYS A 73 6.591 -2.663 9.189 1.00 0.00 N ATOM 1040 CA CYS A 73 7.105 -2.115 7.939 1.00 0.00 C ATOM 1041 C CYS A 73 8.363 -1.288 8.184 1.00 0.00 C ATOM 1042 O CYS A 73 8.592 -0.801 9.291 1.00 0.00 O ATOM 1043 CB CYS A 73 6.039 -1.255 7.258 1.00 0.00 C ATOM 1044 SG CYS A 73 5.428 0.107 8.278 1.00 0.00 S ATOM 0 H CYS A 73 6.253 -1.963 9.849 1.00 0.00 H new ATOM 0 HA CYS A 73 7.362 -2.948 7.285 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.451 -0.847 6.335 1.00 0.00 H new ATOM 0 HB3 CYS A 73 5.199 -1.891 6.978 1.00 0.00 H new ATOM 0 HG CYS A 73 6.328 0.426 9.160 1.00 0.00 H new ATOM 1050 N PHE A 74 9.176 -1.134 7.144 1.00 0.00 N ATOM 1051 CA PHE A 74 10.412 -0.368 7.247 1.00 0.00 C ATOM 1052 C PHE A 74 10.570 0.573 6.056 1.00 0.00 C ATOM 1053 O PHE A 74 10.872 0.140 4.944 1.00 0.00 O ATOM 1054 CB PHE A 74 11.615 -1.310 7.330 1.00 0.00 C ATOM 1055 CG PHE A 74 11.607 -2.186 8.550 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.695 -3.221 8.670 1.00 0.00 C ATOM 1057 CD2 PHE A 74 12.512 -1.973 9.577 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.685 -4.029 9.791 1.00 0.00 C ATOM 1059 CE2 PHE A 74 12.508 -2.778 10.701 1.00 0.00 C ATOM 1060 CZ PHE A 74 11.592 -3.807 10.808 1.00 0.00 C ATOM 0 H PHE A 74 9.001 -1.530 6.220 1.00 0.00 H new ATOM 0 HA PHE A 74 10.364 0.231 8.157 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.635 -1.940 6.440 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.531 -0.719 7.323 1.00 0.00 H new ATOM 0 HD1 PHE A 74 9.983 -3.399 7.878 1.00 0.00 H new ATOM 0 HD2 PHE A 74 13.229 -1.169 9.499 1.00 0.00 H new ATOM 0 HE1 PHE A 74 9.969 -4.833 9.871 1.00 0.00 H new ATOM 0 HE2 PHE A 74 13.220 -2.603 11.494 1.00 0.00 H new ATOM 0 HZ PHE A 74 11.586 -4.436 11.686 1.00 0.00 H new ATOM 1070 N VAL A 75 10.361 1.863 6.297 1.00 0.00 N ATOM 1071 CA VAL A 75 10.481 2.866 5.245 1.00 0.00 C ATOM 1072 C VAL A 75 11.912 3.380 5.135 1.00 0.00 C ATOM 1073 O VAL A 75 12.539 3.726 6.137 1.00 0.00 O ATOM 1074 CB VAL A 75 9.538 4.058 5.497 1.00 0.00 C ATOM 1075 CG1 VAL A 75 8.087 3.599 5.507 1.00 0.00 C ATOM 1076 CG2 VAL A 75 9.894 4.753 6.802 1.00 0.00 C ATOM 0 H VAL A 75 10.108 2.238 7.211 1.00 0.00 H new ATOM 0 HA VAL A 75 10.200 2.380 4.311 1.00 0.00 H new ATOM 0 HB VAL A 75 9.662 4.774 4.685 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.436 4.455 5.686 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.840 3.151 4.544 1.00 0.00 H new ATOM 0 HG13 VAL A 75 7.944 2.862 6.297 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.218 5.592 6.964 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.800 4.047 7.627 1.00 0.00 H new ATOM 0 HG23 VAL A 75 10.920 5.118 6.752 1.00 0.00 H new ATOM 1086 N THR A 76 12.425 3.427 3.909 1.00 0.00 N ATOM 1087 CA THR A 76 13.783 3.897 3.667 1.00 0.00 C ATOM 1088 C THR A 76 13.825 4.880 2.502 1.00 0.00 C ATOM 1089 O THR A 76 13.297 4.603 1.425 1.00 0.00 O ATOM 1090 CB THR A 76 14.739 2.726 3.371 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.718 1.791 4.455 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.158 3.228 3.154 1.00 0.00 C ATOM 0 H THR A 76 11.920 3.145 3.069 1.00 0.00 H new ATOM 0 HA THR A 76 14.110 4.401 4.576 1.00 0.00 H new ATOM 0 HB THR A 76 14.402 2.232 2.460 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.327 1.049 4.259 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.815 2.383 2.947 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.175 3.917 2.309 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.502 3.744 4.050 1.00 0.00 H new ATOM 1100 N ASP A 77 14.456 6.027 2.724 1.00 0.00 N ATOM 1101 CA ASP A 77 14.569 7.050 1.692 1.00 0.00 C ATOM 1102 C ASP A 77 15.882 6.910 0.928 1.00 0.00 C ATOM 1103 O ASP A 77 16.952 6.814 1.527 1.00 0.00 O ATOM 1104 CB ASP A 77 14.472 8.445 2.313 1.00 0.00 C ATOM 1105 CG ASP A 77 14.621 9.548 1.284 1.00 0.00 C ATOM 1106 OD1 ASP A 77 13.913 9.501 0.256 1.00 0.00 O ATOM 1107 OD2 ASP A 77 15.445 10.460 1.507 1.00 0.00 O ATOM 0 H ASP A 77 14.897 6.272 3.610 1.00 0.00 H new ATOM 0 HA ASP A 77 13.746 6.915 0.991 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.511 8.549 2.817 1.00 0.00 H new ATOM 0 HB3 ASP A 77 15.244 8.555 3.074 1.00 0.00 H new ATOM 1112 N ASN A 78 15.791 6.898 -0.398 1.00 0.00 N ATOM 1113 CA ASN A 78 16.973 6.768 -1.243 1.00 0.00 C ATOM 1114 C ASN A 78 17.619 8.128 -1.488 1.00 0.00 C ATOM 1115 O ASN A 78 18.500 8.264 -2.336 1.00 0.00 O ATOM 1116 CB ASN A 78 16.600 6.120 -2.579 1.00 0.00 C ATOM 1117 CG ASN A 78 16.185 4.670 -2.422 1.00 0.00 C ATOM 1118 OD1 ASN A 78 17.027 3.779 -2.318 1.00 0.00 O ATOM 1119 ND2 ASN A 78 14.879 4.428 -2.404 1.00 0.00 N ATOM 0 H ASN A 78 14.912 6.977 -0.910 1.00 0.00 H new ATOM 0 HA ASN A 78 17.692 6.133 -0.725 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.785 6.681 -3.037 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.450 6.180 -3.259 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.539 3.472 -2.301 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.216 5.198 -2.493 1.00 0.00 H new ATOM 1126 N ALA A 79 17.176 9.132 -0.738 1.00 0.00 N ATOM 1127 CA ALA A 79 17.713 10.480 -0.871 1.00 0.00 C ATOM 1128 C ALA A 79 17.883 10.861 -2.338 1.00 0.00 C ATOM 1129 O ALA A 79 18.767 11.643 -2.688 1.00 0.00 O ATOM 1130 CB ALA A 79 19.040 10.594 -0.137 1.00 0.00 C ATOM 0 H ALA A 79 16.446 9.037 -0.032 1.00 0.00 H new ATOM 0 HA ALA A 79 17.002 11.174 -0.423 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.430 11.606 -0.245 1.00 0.00 H new ATOM 0 HB2 ALA A 79 18.891 10.373 0.920 1.00 0.00 H new ATOM 0 HB3 ALA A 79 19.752 9.884 -0.559 1.00 0.00 H new ATOM 1136 N ASP A 80 17.032 10.303 -3.192 1.00 0.00 N ATOM 1137 CA ASP A 80 17.088 10.584 -4.622 1.00 0.00 C ATOM 1138 C ASP A 80 15.759 11.145 -5.118 1.00 0.00 C ATOM 1139 O ASP A 80 15.660 11.628 -6.245 1.00 0.00 O ATOM 1140 CB ASP A 80 17.443 9.316 -5.399 1.00 0.00 C ATOM 1141 CG ASP A 80 17.994 9.618 -6.779 1.00 0.00 C ATOM 1142 OD1 ASP A 80 17.529 10.595 -7.402 1.00 0.00 O ATOM 1143 OD2 ASP A 80 18.888 8.876 -7.237 1.00 0.00 O ATOM 0 H ASP A 80 16.295 9.653 -2.919 1.00 0.00 H new ATOM 0 HA ASP A 80 17.863 11.332 -4.790 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.178 8.742 -4.835 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.555 8.691 -5.494 1.00 0.00 H new ATOM 1148 N GLY A 81 14.739 11.076 -4.268 1.00 0.00 N ATOM 1149 CA GLY A 81 13.429 11.579 -4.638 1.00 0.00 C ATOM 1150 C GLY A 81 12.345 10.529 -4.502 1.00 0.00 C ATOM 1151 O GLY A 81 11.185 10.775 -4.835 1.00 0.00 O ATOM 0 H GLY A 81 14.797 10.681 -3.330 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.182 12.435 -4.011 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.458 11.936 -5.668 1.00 0.00 H new ATOM 1155 N THR A 82 12.721 9.352 -4.012 1.00 0.00 N ATOM 1156 CA THR A 82 11.773 8.259 -3.834 1.00 0.00 C ATOM 1157 C THR A 82 12.033 7.512 -2.532 1.00 0.00 C ATOM 1158 O THR A 82 13.077 7.686 -1.902 1.00 0.00 O ATOM 1159 CB THR A 82 11.840 7.262 -5.007 1.00 0.00 C ATOM 1160 OG1 THR A 82 13.203 6.929 -5.290 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.186 7.845 -6.251 1.00 0.00 C ATOM 0 H THR A 82 13.676 9.131 -3.731 1.00 0.00 H new ATOM 0 HA THR A 82 10.779 8.705 -3.801 1.00 0.00 H new ATOM 0 HB THR A 82 11.299 6.361 -4.720 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.237 6.294 -6.035 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.246 7.123 -7.066 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.140 8.070 -6.041 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.703 8.760 -6.539 1.00 0.00 H new ATOM 1169 N TYR A 83 11.078 6.679 -2.133 1.00 0.00 N ATOM 1170 CA TYR A 83 11.203 5.906 -0.903 1.00 0.00 C ATOM 1171 C TYR A 83 11.007 4.417 -1.173 1.00 0.00 C ATOM 1172 O TYR A 83 10.513 4.028 -2.230 1.00 0.00 O ATOM 1173 CB TYR A 83 10.185 6.386 0.132 1.00 0.00 C ATOM 1174 CG TYR A 83 10.348 7.840 0.513 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.844 8.851 -0.296 1.00 0.00 C ATOM 1176 CD2 TYR A 83 11.007 8.203 1.681 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.992 10.181 0.048 1.00 0.00 C ATOM 1178 CE2 TYR A 83 11.158 9.530 2.034 1.00 0.00 C ATOM 1179 CZ TYR A 83 10.649 10.516 1.214 1.00 0.00 C ATOM 1180 OH TYR A 83 10.798 11.839 1.560 1.00 0.00 O ATOM 0 H TYR A 83 10.209 6.522 -2.643 1.00 0.00 H new ATOM 0 HA TYR A 83 12.209 6.057 -0.510 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.180 6.233 -0.261 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.274 5.772 1.028 1.00 0.00 H new ATOM 0 HD1 TYR A 83 9.328 8.593 -1.209 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.408 7.434 2.324 1.00 0.00 H new ATOM 0 HE1 TYR A 83 9.595 10.955 -0.593 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.672 9.794 2.947 1.00 0.00 H new ATOM 0 HH TYR A 83 10.122 12.081 2.228 1.00 0.00 H new ATOM 1190 N GLN A 84 11.399 3.591 -0.208 1.00 0.00 N ATOM 1191 CA GLN A 84 11.267 2.145 -0.341 1.00 0.00 C ATOM 1192 C GLN A 84 10.819 1.516 0.974 1.00 0.00 C ATOM 1193 O GLN A 84 11.573 1.483 1.947 1.00 0.00 O ATOM 1194 CB GLN A 84 12.594 1.529 -0.789 1.00 0.00 C ATOM 1195 CG GLN A 84 12.479 0.071 -1.203 1.00 0.00 C ATOM 1196 CD GLN A 84 12.121 -0.093 -2.667 1.00 0.00 C ATOM 1197 OE1 GLN A 84 10.965 -0.690 -2.931 1.00 0.00 O flip ATOM 1198 NE2 GLN A 84 12.876 0.312 -3.552 1.00 0.00 N flip ATOM 0 H GLN A 84 11.810 3.898 0.673 1.00 0.00 H new ATOM 0 HA GLN A 84 10.508 1.943 -1.096 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.988 2.106 -1.626 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.316 1.611 0.023 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.424 -0.435 -1.005 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.721 -0.418 -0.591 1.00 0.00 H new ATOM 0 HE21 GLN A 84 13.755 0.765 -3.304 1.00 0.00 H new ATOM 0 HE22 GLN A 84 12.622 0.194 -4.533 1.00 0.00 H new ATOM 1207 N VAL A 85 9.587 1.018 0.997 1.00 0.00 N ATOM 1208 CA VAL A 85 9.038 0.389 2.192 1.00 0.00 C ATOM 1209 C VAL A 85 8.985 -1.127 2.041 1.00 0.00 C ATOM 1210 O VAL A 85 8.399 -1.645 1.091 1.00 0.00 O ATOM 1211 CB VAL A 85 7.623 0.913 2.503 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.074 0.254 3.759 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.636 2.427 2.647 1.00 0.00 C ATOM 0 H VAL A 85 8.950 1.038 0.201 1.00 0.00 H new ATOM 0 HA VAL A 85 9.702 0.646 3.017 1.00 0.00 H new ATOM 0 HB VAL A 85 6.968 0.656 1.671 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.074 0.636 3.963 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.027 -0.825 3.613 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.727 0.478 4.602 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.628 2.780 2.866 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.305 2.709 3.460 1.00 0.00 H new ATOM 0 HG23 VAL A 85 7.984 2.878 1.718 1.00 0.00 H new ATOM 1223 N GLU A 86 9.602 -1.832 2.984 1.00 0.00 N ATOM 1224 CA GLU A 86 9.625 -3.290 2.954 1.00 0.00 C ATOM 1225 C GLU A 86 8.929 -3.870 4.182 1.00 0.00 C ATOM 1226 O GLU A 86 9.130 -3.401 5.303 1.00 0.00 O ATOM 1227 CB GLU A 86 11.066 -3.798 2.884 1.00 0.00 C ATOM 1228 CG GLU A 86 11.174 -5.310 2.772 1.00 0.00 C ATOM 1229 CD GLU A 86 12.492 -5.841 3.300 1.00 0.00 C ATOM 1230 OE1 GLU A 86 12.739 -5.712 4.518 1.00 0.00 O ATOM 1231 OE2 GLU A 86 13.278 -6.386 2.497 1.00 0.00 O ATOM 0 H GLU A 86 10.092 -1.418 3.777 1.00 0.00 H new ATOM 0 HA GLU A 86 9.088 -3.618 2.064 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.562 -3.342 2.027 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.602 -3.469 3.774 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.354 -5.771 3.323 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.061 -5.602 1.728 1.00 0.00 H new ATOM 1238 N TYR A 87 8.110 -4.893 3.963 1.00 0.00 N ATOM 1239 CA TYR A 87 7.382 -5.535 5.050 1.00 0.00 C ATOM 1240 C TYR A 87 7.125 -7.007 4.739 1.00 0.00 C ATOM 1241 O TYR A 87 7.033 -7.402 3.576 1.00 0.00 O ATOM 1242 CB TYR A 87 6.055 -4.816 5.299 1.00 0.00 C ATOM 1243 CG TYR A 87 5.009 -5.093 4.242 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.246 -6.254 4.279 1.00 0.00 C ATOM 1245 CD2 TYR A 87 4.783 -4.194 3.207 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.290 -6.511 3.316 1.00 0.00 C ATOM 1247 CE2 TYR A 87 3.829 -4.442 2.240 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.085 -5.603 2.299 1.00 0.00 C ATOM 1249 OH TYR A 87 2.133 -5.855 1.338 1.00 0.00 O ATOM 0 H TYR A 87 7.934 -5.295 3.042 1.00 0.00 H new ATOM 0 HA TYR A 87 7.995 -5.473 5.949 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.665 -5.117 6.272 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.236 -3.742 5.346 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.403 -6.967 5.074 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.364 -3.285 3.158 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.706 -7.418 3.359 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.666 -3.732 1.443 1.00 0.00 H new ATOM 0 HH TYR A 87 2.354 -5.361 0.521 1.00 0.00 H new ATOM 1259 N THR A 88 7.010 -7.815 5.788 1.00 0.00 N ATOM 1260 CA THR A 88 6.765 -9.243 5.629 1.00 0.00 C ATOM 1261 C THR A 88 5.510 -9.672 6.381 1.00 0.00 C ATOM 1262 O THR A 88 5.517 -9.847 7.600 1.00 0.00 O ATOM 1263 CB THR A 88 7.959 -10.078 6.129 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.186 -9.504 5.663 1.00 0.00 O ATOM 1265 CG2 THR A 88 7.852 -11.517 5.649 1.00 0.00 C ATOM 0 H THR A 88 7.083 -7.505 6.757 1.00 0.00 H new ATOM 0 HA THR A 88 6.627 -9.423 4.563 1.00 0.00 H new ATOM 0 HB THR A 88 7.947 -10.074 7.219 1.00 0.00 H new ATOM 0 HG1 THR A 88 9.941 -10.039 5.986 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.706 -12.087 6.015 1.00 0.00 H new ATOM 0 HG22 THR A 88 6.931 -11.960 6.029 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.842 -11.537 4.559 1.00 0.00 H new ATOM 1273 N PRO A 89 4.406 -9.848 5.640 1.00 0.00 N ATOM 1274 CA PRO A 89 3.123 -10.260 6.216 1.00 0.00 C ATOM 1275 C PRO A 89 3.144 -11.705 6.703 1.00 0.00 C ATOM 1276 O PRO A 89 3.588 -12.605 5.990 1.00 0.00 O ATOM 1277 CB PRO A 89 2.143 -10.103 5.051 1.00 0.00 C ATOM 1278 CG PRO A 89 2.984 -10.238 3.828 1.00 0.00 C ATOM 1279 CD PRO A 89 4.325 -9.657 4.182 1.00 0.00 C ATOM 0 HA PRO A 89 2.862 -9.668 7.093 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.365 -10.866 5.083 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.642 -9.135 5.082 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.077 -11.283 3.532 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.538 -9.707 2.987 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.135 -10.171 3.664 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.391 -8.603 3.911 1.00 0.00 H new ATOM 1287 N PHE A 90 2.660 -11.921 7.922 1.00 0.00 N ATOM 1288 CA PHE A 90 2.624 -13.258 8.504 1.00 0.00 C ATOM 1289 C PHE A 90 1.201 -13.809 8.513 1.00 0.00 C ATOM 1290 O PHE A 90 0.852 -14.638 9.352 1.00 0.00 O ATOM 1291 CB PHE A 90 3.182 -13.232 9.929 1.00 0.00 C ATOM 1292 CG PHE A 90 2.739 -12.037 10.724 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.412 -11.889 11.096 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.648 -11.062 11.100 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.001 -10.791 11.828 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.243 -9.963 11.833 1.00 0.00 C ATOM 1297 CZ PHE A 90 1.918 -9.826 12.196 1.00 0.00 C ATOM 0 H PHE A 90 2.288 -11.188 8.526 1.00 0.00 H new ATOM 0 HA PHE A 90 3.244 -13.911 7.890 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.873 -14.139 10.448 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.271 -13.246 9.885 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.691 -12.640 10.811 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.685 -11.162 10.817 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.036 -10.688 12.112 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.963 -9.211 12.122 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.599 -8.966 12.766 1.00 0.00 H new ATOM 1307 N GLU A 91 0.386 -13.340 7.574 1.00 0.00 N ATOM 1308 CA GLU A 91 -1.000 -13.785 7.474 1.00 0.00 C ATOM 1309 C GLU A 91 -1.484 -13.736 6.028 1.00 0.00 C ATOM 1310 O GLU A 91 -1.357 -12.715 5.353 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.901 -12.918 8.356 1.00 0.00 C ATOM 1312 CG GLU A 91 -2.002 -13.407 9.791 1.00 0.00 C ATOM 1313 CD GLU A 91 -3.008 -14.529 9.956 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -2.867 -15.559 9.264 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -3.938 -14.378 10.776 1.00 0.00 O ATOM 0 H GLU A 91 0.660 -12.653 6.872 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.050 -14.817 7.820 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.521 -11.896 8.355 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.900 -12.887 7.921 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.022 -13.751 10.123 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.283 -12.574 10.436 1.00 0.00 H new ATOM 1322 N LYS A 92 -2.040 -14.848 5.559 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.546 -14.935 4.194 1.00 0.00 C ATOM 1324 C LYS A 92 -3.921 -14.284 4.081 1.00 0.00 C ATOM 1325 O LYS A 92 -4.939 -14.905 4.382 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.624 -16.397 3.749 1.00 0.00 C ATOM 1327 CG LYS A 92 -1.367 -17.193 4.054 1.00 0.00 C ATOM 1328 CD LYS A 92 -1.393 -18.556 3.382 1.00 0.00 C ATOM 1329 CE LYS A 92 -2.036 -19.606 4.276 1.00 0.00 C ATOM 1330 NZ LYS A 92 -1.035 -20.278 5.150 1.00 0.00 N ATOM 0 H LYS A 92 -2.152 -15.702 6.105 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.855 -14.400 3.542 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.473 -16.873 4.240 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.815 -16.432 2.676 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.492 -16.637 3.717 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -1.268 -17.320 5.132 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -1.943 -18.490 2.443 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.376 -18.860 3.135 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.801 -19.137 4.894 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.537 -20.351 3.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.526 -20.792 5.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.475 -20.948 4.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.404 -19.564 5.567 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.942 -13.029 3.643 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.198 -12.315 3.496 1.00 0.00 C ATOM 1346 C GLY A 93 -5.010 -10.920 2.935 1.00 0.00 C ATOM 1347 O GLY A 93 -3.920 -10.567 2.482 1.00 0.00 O ATOM 0 H GLY A 93 -3.112 -12.494 3.387 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.859 -12.881 2.840 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.691 -12.250 4.466 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.073 -10.125 2.962 1.00 0.00 N ATOM 1352 CA LEU A 94 -6.022 -8.760 2.450 1.00 0.00 C ATOM 1353 C LEU A 94 -5.843 -7.758 3.587 1.00 0.00 C ATOM 1354 O LEU A 94 -6.707 -7.629 4.455 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.296 -8.439 1.668 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.548 -6.960 1.373 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.429 -6.388 0.516 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -8.895 -6.775 0.688 1.00 0.00 C ATOM 0 H LEU A 94 -6.982 -10.402 3.333 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.164 -8.681 1.782 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.262 -8.977 0.721 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.148 -8.828 2.225 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.566 -6.418 2.319 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.626 -5.335 0.316 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.480 -6.486 1.043 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.378 -6.933 -0.427 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.058 -5.716 0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.905 -7.330 -0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.688 -7.146 1.338 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.718 -7.050 3.574 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.428 -6.057 4.603 1.00 0.00 C ATOM 1372 C HIS A 95 -4.648 -4.644 4.071 1.00 0.00 C ATOM 1373 O HIS A 95 -4.622 -4.414 2.862 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.990 -6.211 5.097 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.452 -7.601 4.955 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.170 -8.725 5.304 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.259 -8.047 4.496 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.442 -9.802 5.067 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.277 -9.417 4.577 1.00 0.00 N ATOM 0 H HIS A 95 -3.993 -7.145 2.863 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.110 -6.222 5.437 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.349 -5.524 4.544 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.942 -5.917 6.146 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.444 -7.438 4.133 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.747 -10.823 5.244 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.515 -10.037 4.303 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.865 -3.702 4.983 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.089 -2.311 4.606 1.00 0.00 C ATOM 1389 C VAL A 96 -3.868 -1.453 4.918 1.00 0.00 C ATOM 1390 O VAL A 96 -3.585 -1.157 6.078 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.315 -1.724 5.331 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.484 -0.252 4.987 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.569 -2.510 4.980 1.00 0.00 C ATOM 0 H VAL A 96 -4.890 -3.876 5.988 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.272 -2.300 3.531 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.153 -1.805 6.406 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.355 0.146 5.508 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.595 0.298 5.295 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.624 -0.143 3.911 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.425 -2.081 5.501 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.738 -2.463 3.904 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.443 -3.550 5.283 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.148 -1.057 3.873 1.00 0.00 N ATOM 1404 CA VAL A 97 -1.957 -0.231 4.035 1.00 0.00 C ATOM 1405 C VAL A 97 -2.305 1.252 3.976 1.00 0.00 C ATOM 1406 O VAL A 97 -2.878 1.726 2.996 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.906 -0.544 2.954 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.277 0.405 3.069 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.451 -1.992 3.057 1.00 0.00 C ATOM 0 H VAL A 97 -3.368 -1.295 2.906 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.540 -0.465 5.015 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.363 -0.400 1.975 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.009 0.169 2.297 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.066 1.432 2.941 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.737 0.296 4.051 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.292 -2.196 2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.011 -2.166 4.039 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.307 -2.653 2.920 1.00 0.00 H new ATOM 1419 N GLU A 98 -1.953 1.979 5.032 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.229 3.410 5.100 1.00 0.00 C ATOM 1421 C GLU A 98 -0.959 4.220 4.858 1.00 0.00 C ATOM 1422 O GLU A 98 -0.055 4.244 5.693 1.00 0.00 O ATOM 1423 CB GLU A 98 -2.827 3.772 6.461 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.323 3.523 6.555 1.00 0.00 C ATOM 1425 CD GLU A 98 -4.807 3.409 7.987 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.658 4.391 8.744 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.335 2.337 8.351 1.00 0.00 O ATOM 0 H GLU A 98 -1.477 1.601 5.851 1.00 0.00 H new ATOM 0 HA GLU A 98 -2.949 3.654 4.319 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.322 3.195 7.235 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.629 4.824 6.667 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.854 4.335 6.060 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.569 2.607 6.018 1.00 0.00 H new ATOM 1434 N VAL A 99 -0.898 4.884 3.707 1.00 0.00 N ATOM 1435 CA VAL A 99 0.260 5.697 3.354 1.00 0.00 C ATOM 1436 C VAL A 99 -0.029 7.180 3.552 1.00 0.00 C ATOM 1437 O VAL A 99 -1.030 7.701 3.059 1.00 0.00 O ATOM 1438 CB VAL A 99 0.687 5.459 1.894 1.00 0.00 C ATOM 1439 CG1 VAL A 99 2.054 6.072 1.631 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.692 3.971 1.576 1.00 0.00 C ATOM 0 H VAL A 99 -1.637 4.875 3.004 1.00 0.00 H new ATOM 0 HA VAL A 99 1.072 5.397 4.016 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.036 5.945 1.239 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.339 5.894 0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.013 7.145 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.790 5.617 2.293 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.996 3.821 0.540 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.392 3.460 2.237 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.309 3.564 1.723 1.00 0.00 H new ATOM 1450 N THR A 100 0.855 7.858 4.278 1.00 0.00 N ATOM 1451 CA THR A 100 0.696 9.282 4.542 1.00 0.00 C ATOM 1452 C THR A 100 1.995 10.038 4.287 1.00 0.00 C ATOM 1453 O THR A 100 2.997 9.817 4.967 1.00 0.00 O ATOM 1454 CB THR A 100 0.243 9.537 5.992 1.00 0.00 C ATOM 1455 OG1 THR A 100 1.159 8.923 6.906 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.157 8.991 6.226 1.00 0.00 C ATOM 0 H THR A 100 1.689 7.443 4.694 1.00 0.00 H new ATOM 0 HA THR A 100 -0.072 9.646 3.859 1.00 0.00 H new ATOM 0 HB THR A 100 0.228 10.614 6.161 1.00 0.00 H new ATOM 0 HG1 THR A 100 0.865 9.091 7.826 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.455 9.183 7.257 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.857 9.481 5.549 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.164 7.917 6.040 1.00 0.00 H new ATOM 1464 N TYR A 101 1.971 10.930 3.303 1.00 0.00 N ATOM 1465 CA TYR A 101 3.148 11.718 2.957 1.00 0.00 C ATOM 1466 C TYR A 101 3.115 13.078 3.646 1.00 0.00 C ATOM 1467 O TYR A 101 2.235 13.898 3.386 1.00 0.00 O ATOM 1468 CB TYR A 101 3.235 11.904 1.441 1.00 0.00 C ATOM 1469 CG TYR A 101 4.528 12.541 0.983 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.808 13.872 1.267 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.468 11.813 0.265 1.00 0.00 C ATOM 1472 CE1 TYR A 101 5.987 14.459 0.849 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.650 12.390 -0.155 1.00 0.00 C ATOM 1474 CZ TYR A 101 6.905 13.714 0.139 1.00 0.00 C ATOM 1475 OH TYR A 101 8.081 14.294 -0.279 1.00 0.00 O ATOM 0 H TYR A 101 1.149 11.125 2.731 1.00 0.00 H new ATOM 0 HA TYR A 101 4.030 11.178 3.302 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.127 10.933 0.957 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.399 12.520 1.110 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.092 14.458 1.824 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.271 10.777 0.031 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.188 15.495 1.077 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.371 11.808 -0.710 1.00 0.00 H new ATOM 0 HH TYR A 101 8.686 14.395 0.485 1.00 0.00 H new ATOM 1485 N ASP A 102 4.082 13.311 4.527 1.00 0.00 N ATOM 1486 CA ASP A 102 4.167 14.572 5.254 1.00 0.00 C ATOM 1487 C ASP A 102 2.935 14.778 6.130 1.00 0.00 C ATOM 1488 O ASP A 102 2.398 15.883 6.213 1.00 0.00 O ATOM 1489 CB ASP A 102 4.315 15.739 4.277 1.00 0.00 C ATOM 1490 CG ASP A 102 4.901 16.974 4.935 1.00 0.00 C ATOM 1491 OD1 ASP A 102 4.163 17.661 5.671 1.00 0.00 O ATOM 1492 OD2 ASP A 102 6.098 17.253 4.712 1.00 0.00 O ATOM 0 H ASP A 102 4.818 12.643 4.755 1.00 0.00 H new ATOM 0 HA ASP A 102 5.046 14.534 5.898 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.953 15.436 3.447 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.339 15.983 3.856 1.00 0.00 H new ATOM 1497 N ASP A 103 2.493 13.708 6.781 1.00 0.00 N ATOM 1498 CA ASP A 103 1.324 13.771 7.651 1.00 0.00 C ATOM 1499 C ASP A 103 0.056 14.021 6.840 1.00 0.00 C ATOM 1500 O ASP A 103 -0.872 14.682 7.307 1.00 0.00 O ATOM 1501 CB ASP A 103 1.500 14.872 8.698 1.00 0.00 C ATOM 1502 CG ASP A 103 2.800 14.739 9.465 1.00 0.00 C ATOM 1503 OD1 ASP A 103 3.873 14.919 8.851 1.00 0.00 O ATOM 1504 OD2 ASP A 103 2.746 14.456 10.680 1.00 0.00 O ATOM 0 H ASP A 103 2.926 12.786 6.723 1.00 0.00 H new ATOM 0 HA ASP A 103 1.226 12.811 8.158 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.469 15.845 8.207 1.00 0.00 H new ATOM 0 HB3 ASP A 103 0.664 14.841 9.397 1.00 0.00 H new ATOM 1509 N VAL A 104 0.024 13.489 5.622 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.130 13.654 4.746 1.00 0.00 C ATOM 1511 C VAL A 104 -1.332 12.425 3.867 1.00 0.00 C ATOM 1512 O VAL A 104 -0.416 11.958 3.189 1.00 0.00 O ATOM 1513 CB VAL A 104 -0.979 14.896 3.847 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.167 15.021 2.906 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -0.825 16.150 4.694 1.00 0.00 C ATOM 0 H VAL A 104 0.784 12.940 5.220 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.000 13.784 5.389 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.079 14.780 3.244 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.043 15.904 2.279 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.227 14.134 2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.084 15.115 3.488 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.719 17.018 4.043 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.706 16.274 5.324 1.00 0.00 H new ATOM 0 HG23 VAL A 104 0.061 16.058 5.323 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.561 11.888 3.875 1.00 0.00 N ATOM 1526 CA PRO A 105 -2.913 10.706 3.082 1.00 0.00 C ATOM 1527 C PRO A 105 -2.945 11.000 1.586 1.00 0.00 C ATOM 1528 O PRO A 105 -3.281 12.109 1.169 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.313 10.345 3.586 1.00 0.00 C ATOM 1530 CG PRO A 105 -4.870 11.625 4.105 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.701 12.392 4.658 1.00 0.00 C ATOM 0 HA PRO A 105 -2.183 9.905 3.199 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.931 9.941 2.784 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.269 9.587 4.368 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.364 12.186 3.312 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.616 11.441 4.878 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.830 13.467 4.533 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.568 12.209 5.724 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.595 10.001 0.784 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.586 10.153 -0.666 1.00 0.00 C ATOM 1541 C ILE A 106 -3.899 9.678 -1.277 1.00 0.00 C ATOM 1542 O ILE A 106 -4.638 8.889 -0.687 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.423 9.372 -1.306 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.195 8.054 -0.564 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.155 10.214 -1.304 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.234 7.122 -1.269 1.00 0.00 C ATOM 0 H ILE A 106 -2.314 9.077 1.113 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.456 11.216 -0.871 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.683 9.144 -2.340 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -0.813 8.270 0.434 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.152 7.548 -0.437 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.658 9.649 -1.759 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.324 11.128 -1.873 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.111 10.469 -0.278 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.120 6.208 -0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.624 6.876 -2.257 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.735 7.609 -1.373 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.199 10.168 -2.489 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.424 9.805 -3.209 1.00 0.00 C ATOM 1560 C PRO A 107 -5.407 8.358 -3.689 1.00 0.00 C ATOM 1561 O PRO A 107 -6.326 7.911 -4.375 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.432 10.765 -4.401 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.000 11.116 -4.615 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.365 11.112 -3.251 1.00 0.00 C ATOM 0 HA PRO A 107 -6.308 9.883 -2.576 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.861 10.294 -5.286 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.030 11.652 -4.191 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.515 10.395 -5.273 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.904 12.094 -5.087 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.326 10.787 -3.293 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.370 12.105 -2.802 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.357 7.630 -3.324 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.221 6.233 -3.719 1.00 0.00 C ATOM 1574 C ASN A 108 -4.441 5.307 -2.526 1.00 0.00 C ATOM 1575 O ASN A 108 -4.590 4.096 -2.686 1.00 0.00 O ATOM 1576 CB ASN A 108 -2.838 5.984 -4.324 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.426 7.077 -5.291 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -3.126 7.166 -6.416 1.00 0.00 O flip ATOM 1579 ND2 ASN A 108 -1.489 7.831 -5.030 1.00 0.00 N flip ATOM 0 H ASN A 108 -3.588 7.984 -2.755 1.00 0.00 H new ATOM 0 HA ASN A 108 -4.982 6.018 -4.469 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.101 5.914 -3.524 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.838 5.025 -4.842 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -0.979 7.726 -4.153 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.223 8.561 -5.691 1.00 0.00 H new ATOM 1586 N SER A 109 -4.459 5.886 -1.330 1.00 0.00 N ATOM 1587 CA SER A 109 -4.657 5.114 -0.109 1.00 0.00 C ATOM 1588 C SER A 109 -6.064 5.321 0.443 1.00 0.00 C ATOM 1589 O SER A 109 -6.752 6.287 0.113 1.00 0.00 O ATOM 1590 CB SER A 109 -3.620 5.509 0.944 1.00 0.00 C ATOM 1591 OG SER A 109 -2.466 4.692 0.855 1.00 0.00 O ATOM 0 H SER A 109 -4.339 6.888 -1.180 1.00 0.00 H new ATOM 0 HA SER A 109 -4.533 4.059 -0.352 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.341 6.554 0.810 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.056 5.421 1.939 1.00 0.00 H new ATOM 0 HG SER A 109 -2.506 4.157 0.035 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.503 4.392 1.305 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.693 3.238 1.705 1.00 0.00 C ATOM 1599 C PRO A 110 -5.509 2.237 0.569 1.00 0.00 C ATOM 1600 O PRO A 110 -6.157 2.339 -0.473 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.505 2.612 2.843 1.00 0.00 C ATOM 1602 CG PRO A 110 -7.910 3.032 2.581 1.00 0.00 C ATOM 1603 CD PRO A 110 -7.824 4.397 1.955 1.00 0.00 C ATOM 0 HA PRO A 110 -4.683 3.529 1.993 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.410 1.526 2.846 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.161 2.965 3.815 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.410 2.328 1.916 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.487 3.062 3.505 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.626 4.560 1.235 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -7.901 5.187 2.702 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.622 1.270 0.777 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.353 0.250 -0.230 1.00 0.00 C ATOM 1613 C PHE A 111 -4.822 -1.122 0.245 1.00 0.00 C ATOM 1614 O PHE A 111 -5.040 -1.338 1.437 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.858 0.206 -0.554 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.410 1.310 -1.470 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.774 1.309 -2.807 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.625 2.347 -0.994 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.365 2.323 -3.652 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -1.213 3.364 -1.834 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.582 3.351 -3.165 1.00 0.00 C ATOM 0 H PHE A 111 -4.077 1.171 1.634 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.907 0.511 -1.132 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.291 0.263 0.375 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.622 -0.754 -1.013 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.385 0.506 -3.193 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.332 2.361 0.045 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.657 2.312 -4.692 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.603 4.168 -1.450 1.00 0.00 H new ATOM 0 HZ PHE A 111 -1.259 4.143 -3.824 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.977 -2.046 -0.697 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.419 -3.398 -0.377 1.00 0.00 C ATOM 1633 C LYS A 112 -4.476 -4.436 -0.976 1.00 0.00 C ATOM 1634 O LYS A 112 -4.432 -4.621 -2.192 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.841 -3.627 -0.895 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.921 -3.265 0.111 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.241 -2.956 -0.575 1.00 0.00 C ATOM 1638 CE LYS A 112 -9.374 -1.474 -0.887 1.00 0.00 C ATOM 1639 NZ LYS A 112 -10.519 -1.199 -1.798 1.00 0.00 N ATOM 0 H LYS A 112 -4.803 -1.883 -1.689 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.410 -3.509 0.707 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.988 -3.038 -1.801 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.953 -4.675 -1.174 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.058 -4.089 0.811 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.602 -2.401 0.694 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.316 -3.531 -1.498 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -10.066 -3.270 0.064 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.507 -0.918 0.041 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -8.452 -1.115 -1.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.575 -0.178 -1.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.380 -1.709 -2.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -11.402 -1.518 -1.351 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.722 -5.112 -0.114 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.781 -6.133 -0.558 1.00 0.00 C ATOM 1655 C VAL A 113 -3.323 -7.533 -0.293 1.00 0.00 C ATOM 1656 O VAL A 113 -3.299 -8.015 0.839 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.417 -5.981 0.141 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.466 -7.083 -0.300 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.824 -4.609 -0.141 1.00 0.00 C ATOM 0 H VAL A 113 -3.745 -4.970 0.896 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.648 -5.996 -1.631 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.567 -6.072 1.217 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.493 -6.960 0.204 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.889 -8.054 -0.042 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.319 -7.027 -1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.140 -4.519 0.361 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.687 -4.486 -1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.499 -3.838 0.229 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.813 -8.181 -1.345 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.359 -9.527 -1.226 1.00 0.00 C ATOM 1671 C ALA A 114 -3.254 -10.576 -1.298 1.00 0.00 C ATOM 1672 O ALA A 114 -2.876 -11.020 -2.382 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.395 -9.774 -2.312 1.00 0.00 C ATOM 0 H ALA A 114 -3.843 -7.795 -2.289 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.842 -9.612 -0.252 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.794 -10.783 -2.211 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.205 -9.052 -2.213 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.929 -9.665 -3.291 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.740 -10.968 -0.137 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.679 -11.965 -0.068 1.00 0.00 C ATOM 1681 C VAL A 115 -2.216 -13.361 -0.365 1.00 0.00 C ATOM 1682 O VAL A 115 -3.349 -13.691 -0.012 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.003 -11.971 1.316 1.00 0.00 C ATOM 1684 CG1 VAL A 115 0.031 -13.084 1.401 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.367 -10.619 1.604 1.00 0.00 C ATOM 0 H VAL A 115 -3.042 -10.610 0.769 1.00 0.00 H new ATOM 0 HA VAL A 115 -0.941 -11.694 -0.823 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.765 -12.157 2.072 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.498 -13.072 2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.456 -14.046 1.242 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.793 -12.932 0.636 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.106 -10.641 2.586 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.384 -10.401 0.844 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.134 -9.845 1.588 1.00 0.00 H new ATOM 1695 N THR A 116 -1.395 -14.179 -1.017 1.00 0.00 N ATOM 1696 CA THR A 116 -1.787 -15.539 -1.362 1.00 0.00 C ATOM 1697 C THR A 116 -0.730 -16.545 -0.921 1.00 0.00 C ATOM 1698 O THR A 116 0.365 -16.166 -0.507 1.00 0.00 O ATOM 1699 CB THR A 116 -2.021 -15.689 -2.878 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.412 -17.032 -3.183 1.00 0.00 O ATOM 1701 CG2 THR A 116 -0.764 -15.331 -3.657 1.00 0.00 C ATOM 0 H THR A 116 -0.454 -13.922 -1.316 1.00 0.00 H new ATOM 0 HA THR A 116 -2.720 -15.742 -0.836 1.00 0.00 H new ATOM 0 HB THR A 116 -2.818 -15.005 -3.170 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.560 -17.118 -4.148 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.953 -15.444 -4.725 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.486 -14.298 -3.445 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.049 -15.993 -3.360 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.065 -17.828 -1.015 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.142 -18.888 -0.624 1.00 0.00 C ATOM 1711 C GLU A 117 0.993 -19.021 -1.636 1.00 0.00 C ATOM 1712 O GLU A 117 0.789 -19.486 -2.756 1.00 0.00 O ATOM 1713 CB GLU A 117 -0.885 -20.219 -0.497 1.00 0.00 C ATOM 1714 CG GLU A 117 -1.716 -20.334 0.770 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.359 -21.699 0.924 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -1.647 -22.712 0.756 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -3.572 -21.755 1.213 1.00 0.00 O ATOM 0 H GLU A 117 -1.967 -18.158 -1.358 1.00 0.00 H new ATOM 0 HA GLU A 117 0.286 -18.625 0.343 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.537 -20.346 -1.362 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.161 -21.033 -0.522 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.083 -20.135 1.635 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.493 -19.569 0.761 1.00 0.00 H new ATOM 1724 N GLY A 118 2.190 -18.608 -1.230 1.00 0.00 N ATOM 1725 CA GLY A 118 3.340 -18.688 -2.112 1.00 0.00 C ATOM 1726 C GLY A 118 4.254 -19.847 -1.768 1.00 0.00 C ATOM 1727 O GLY A 118 3.824 -21.001 -1.749 1.00 0.00 O ATOM 0 H GLY A 118 2.384 -18.220 -0.307 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.998 -18.792 -3.142 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.903 -17.756 -2.056 1.00 0.00 H new ATOM 1731 N CYS A 119 5.518 -19.542 -1.499 1.00 0.00 N ATOM 1732 CA CYS A 119 6.497 -20.569 -1.157 1.00 0.00 C ATOM 1733 C CYS A 119 7.672 -19.967 -0.393 1.00 0.00 C ATOM 1734 O CYS A 119 8.117 -18.860 -0.693 1.00 0.00 O ATOM 1735 CB CYS A 119 6.999 -21.266 -2.423 1.00 0.00 C ATOM 1736 SG CYS A 119 6.000 -22.685 -2.929 1.00 0.00 S ATOM 0 H CYS A 119 5.890 -18.592 -1.511 1.00 0.00 H new ATOM 0 HA CYS A 119 6.009 -21.303 -0.516 1.00 0.00 H new ATOM 0 HB2 CYS A 119 7.023 -20.543 -3.238 1.00 0.00 H new ATOM 0 HB3 CYS A 119 8.025 -21.597 -2.260 1.00 0.00 H new ATOM 0 HG CYS A 119 4.757 -22.476 -2.612 1.00 0.00 H new ATOM 1742 N GLN A 120 8.167 -20.704 0.596 1.00 0.00 N ATOM 1743 CA GLN A 120 9.289 -20.241 1.404 1.00 0.00 C ATOM 1744 C GLN A 120 10.616 -20.521 0.705 1.00 0.00 C ATOM 1745 O GLN A 120 10.739 -21.446 -0.098 1.00 0.00 O ATOM 1746 CB GLN A 120 9.269 -20.917 2.776 1.00 0.00 C ATOM 1747 CG GLN A 120 8.340 -20.244 3.773 1.00 0.00 C ATOM 1748 CD GLN A 120 8.344 -20.924 5.127 1.00 0.00 C ATOM 1749 OE1 GLN A 120 7.345 -21.511 5.543 1.00 0.00 O ATOM 1750 NE2 GLN A 120 9.472 -20.850 5.824 1.00 0.00 N ATOM 0 H GLN A 120 7.809 -21.623 0.857 1.00 0.00 H new ATOM 0 HA GLN A 120 9.189 -19.164 1.536 1.00 0.00 H new ATOM 0 HB2 GLN A 120 8.966 -21.957 2.655 1.00 0.00 H new ATOM 0 HB3 GLN A 120 10.280 -20.925 3.183 1.00 0.00 H new ATOM 0 HG2 GLN A 120 8.636 -19.202 3.893 1.00 0.00 H new ATOM 0 HG3 GLN A 120 7.325 -20.243 3.375 1.00 0.00 H new ATOM 0 HE21 GLN A 120 10.276 -20.353 5.441 1.00 0.00 H new ATOM 0 HE22 GLN A 120 9.534 -21.290 6.742 1.00 0.00 H new ATOM 1759 N PRO A 121 11.633 -19.703 1.016 1.00 0.00 N ATOM 1760 CA PRO A 121 12.968 -19.843 0.429 1.00 0.00 C ATOM 1761 C PRO A 121 13.691 -21.091 0.924 1.00 0.00 C ATOM 1762 O PRO A 121 13.725 -21.366 2.124 1.00 0.00 O ATOM 1763 CB PRO A 121 13.696 -18.581 0.899 1.00 0.00 C ATOM 1764 CG PRO A 121 12.995 -18.184 2.152 1.00 0.00 C ATOM 1765 CD PRO A 121 11.557 -18.580 1.965 1.00 0.00 C ATOM 0 HA PRO A 121 12.928 -19.950 -0.655 1.00 0.00 H new ATOM 0 HB2 PRO A 121 14.752 -18.778 1.082 1.00 0.00 H new ATOM 0 HB3 PRO A 121 13.644 -17.792 0.149 1.00 0.00 H new ATOM 0 HG2 PRO A 121 13.428 -18.685 3.017 1.00 0.00 H new ATOM 0 HG3 PRO A 121 13.085 -17.112 2.327 1.00 0.00 H new ATOM 0 HD2 PRO A 121 11.097 -18.880 2.907 1.00 0.00 H new ATOM 0 HD3 PRO A 121 10.962 -17.758 1.568 1.00 0.00 H new ATOM 1773 N SER A 122 14.270 -21.843 -0.007 1.00 0.00 N ATOM 1774 CA SER A 122 14.990 -23.064 0.335 1.00 0.00 C ATOM 1775 C SER A 122 16.422 -23.015 -0.189 1.00 0.00 C ATOM 1776 O SER A 122 16.650 -22.913 -1.394 1.00 0.00 O ATOM 1777 CB SER A 122 14.267 -24.285 -0.237 1.00 0.00 C ATOM 1778 OG SER A 122 15.092 -25.436 -0.188 1.00 0.00 O ATOM 0 H SER A 122 14.254 -21.628 -1.004 1.00 0.00 H new ATOM 0 HA SER A 122 15.022 -23.146 1.421 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.351 -24.466 0.326 1.00 0.00 H new ATOM 0 HB3 SER A 122 13.974 -24.088 -1.268 1.00 0.00 H new ATOM 0 HG SER A 122 14.606 -26.203 -0.558 1.00 0.00 H new ATOM 1784 N SER A 123 17.383 -23.089 0.726 1.00 0.00 N ATOM 1785 CA SER A 123 18.794 -23.049 0.358 1.00 0.00 C ATOM 1786 C SER A 123 19.412 -24.442 0.426 1.00 0.00 C ATOM 1787 O SER A 123 20.039 -24.903 -0.528 1.00 0.00 O ATOM 1788 CB SER A 123 19.556 -22.095 1.279 1.00 0.00 C ATOM 1789 OG SER A 123 20.839 -21.798 0.756 1.00 0.00 O ATOM 0 H SER A 123 17.211 -23.177 1.727 1.00 0.00 H new ATOM 0 HA SER A 123 18.867 -22.688 -0.668 1.00 0.00 H new ATOM 0 HB2 SER A 123 18.988 -21.173 1.403 1.00 0.00 H new ATOM 0 HB3 SER A 123 19.657 -22.542 2.268 1.00 0.00 H new ATOM 0 HG SER A 123 21.305 -21.185 1.362 1.00 0.00 H new ATOM 1795 N GLY A 124 19.231 -25.109 1.562 1.00 0.00 N ATOM 1796 CA GLY A 124 19.776 -26.442 1.735 1.00 0.00 C ATOM 1797 C GLY A 124 20.671 -26.549 2.954 1.00 0.00 C ATOM 1798 O GLY A 124 20.891 -25.577 3.676 1.00 0.00 O ATOM 0 H GLY A 124 18.716 -24.749 2.366 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.958 -27.157 1.825 1.00 0.00 H new ATOM 0 HA3 GLY A 124 20.344 -26.717 0.846 1.00 0.00 H new ATOM 1802 N PRO A 125 21.202 -27.756 3.199 1.00 0.00 N ATOM 1803 CA PRO A 125 22.084 -28.016 4.340 1.00 0.00 C ATOM 1804 C PRO A 125 23.443 -27.341 4.188 1.00 0.00 C ATOM 1805 O PRO A 125 24.353 -27.888 3.565 1.00 0.00 O ATOM 1806 CB PRO A 125 22.240 -29.539 4.330 1.00 0.00 C ATOM 1807 CG PRO A 125 21.996 -29.934 2.914 1.00 0.00 C ATOM 1808 CD PRO A 125 20.982 -28.961 2.381 1.00 0.00 C ATOM 0 HA PRO A 125 21.673 -27.622 5.270 1.00 0.00 H new ATOM 0 HB2 PRO A 125 23.236 -29.837 4.659 1.00 0.00 H new ATOM 0 HB3 PRO A 125 21.526 -30.015 5.003 1.00 0.00 H new ATOM 0 HG2 PRO A 125 22.918 -29.894 2.333 1.00 0.00 H new ATOM 0 HG3 PRO A 125 21.625 -30.957 2.853 1.00 0.00 H new ATOM 0 HD2 PRO A 125 21.136 -28.761 1.321 1.00 0.00 H new ATOM 0 HD3 PRO A 125 19.966 -29.340 2.489 1.00 0.00 H new ATOM 1816 N SER A 126 23.574 -26.148 4.761 1.00 0.00 N ATOM 1817 CA SER A 126 24.821 -25.397 4.685 1.00 0.00 C ATOM 1818 C SER A 126 25.354 -25.370 3.256 1.00 0.00 C ATOM 1819 O SER A 126 26.550 -25.545 3.024 1.00 0.00 O ATOM 1820 CB SER A 126 25.867 -26.008 5.620 1.00 0.00 C ATOM 1821 OG SER A 126 27.089 -25.294 5.554 1.00 0.00 O ATOM 0 H SER A 126 22.832 -25.682 5.283 1.00 0.00 H new ATOM 0 HA SER A 126 24.618 -24.373 4.998 1.00 0.00 H new ATOM 0 HB2 SER A 126 25.493 -26.001 6.644 1.00 0.00 H new ATOM 0 HB3 SER A 126 26.036 -27.050 5.350 1.00 0.00 H new ATOM 0 HG SER A 126 27.390 -25.246 4.623 1.00 0.00 H new ATOM 1827 N SER A 127 24.456 -25.151 2.300 1.00 0.00 N ATOM 1828 CA SER A 127 24.834 -25.105 0.892 1.00 0.00 C ATOM 1829 C SER A 127 25.556 -23.802 0.566 1.00 0.00 C ATOM 1830 O SER A 127 24.989 -22.717 0.690 1.00 0.00 O ATOM 1831 CB SER A 127 23.596 -25.253 0.006 1.00 0.00 C ATOM 1832 OG SER A 127 23.090 -26.575 0.052 1.00 0.00 O ATOM 0 H SER A 127 23.462 -25.003 2.475 1.00 0.00 H new ATOM 0 HA SER A 127 25.514 -25.934 0.695 1.00 0.00 H new ATOM 0 HB2 SER A 127 22.826 -24.554 0.333 1.00 0.00 H new ATOM 0 HB3 SER A 127 23.848 -24.992 -1.022 1.00 0.00 H new ATOM 0 HG SER A 127 22.298 -26.642 -0.521 1.00 0.00 H new ATOM 1838 N GLY A 128 26.812 -23.917 0.146 1.00 0.00 N ATOM 1839 CA GLY A 128 27.592 -22.741 -0.192 1.00 0.00 C ATOM 1840 C GLY A 128 28.967 -23.091 -0.726 1.00 0.00 C ATOM 1841 O GLY A 128 29.438 -22.488 -1.690 1.00 0.00 O ATOM 0 H GLY A 128 27.303 -24.804 0.034 1.00 0.00 H new ATOM 0 HA2 GLY A 128 27.055 -22.154 -0.937 1.00 0.00 H new ATOM 0 HA3 GLY A 128 27.698 -22.113 0.692 1.00 0.00 H new TER 1845 GLY A 128