USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 660 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 111 GLN : amide:sc= -3.96! C(o=-8.8!,f=-16!) USER MOD Set 1.2: A 113 MET CE :methyl -116:sc= -4.89! (180deg=-7.65!) USER MOD Set 2.1: A 41 THR OG1 : rot -160:sc= -1.88! USER MOD Set 2.2: A 79 THR OG1 : rot -140:sc= -1.84! USER MOD Single : A 38 LYS NZ :NH3+ -142:sc= -0.041 (180deg=-0.562) USER MOD Single : A 40 ASN : amide:sc= -0.201 K(o=-0.2,f=-2.1!) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.398 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -161:sc= -0.409 (180deg=-2.1!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -0.0052 K(o=-0.0052,f=-1.7!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -107:sc= -2.41 (180deg=-9.58!) USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 75 CYS SG : rot 95:sc= -2.71 USER MOD Single : A 80 TYR OH : rot -7:sc= -5.06! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -132:sc= -12.1! (180deg=-17.1!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 94 ASN : amide:sc= -0.43 K(o=-0.43,f=-5.5!) USER MOD Single : A 96 THR OG1 : rot -81:sc= 1.28 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 100 SER OG : rot 39:sc= 0.217 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -1.89 K(o=-1.9,f=-3!) USER MOD Single : A 110 LYS NZ :NH3+ 179:sc= 0.00224 (180deg=0.00223) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ -165:sc=-0.00687 (180deg=-0.258) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 35 26.585 22.444 30.057 1.00 0.00 N ATOM 2 CA ALA A 35 25.495 23.247 29.434 1.00 0.00 C ATOM 3 C ALA A 35 25.213 22.718 28.025 1.00 0.00 C ATOM 4 O ALA A 35 26.108 22.577 27.216 1.00 0.00 O ATOM 5 CB ALA A 35 25.924 24.713 29.351 1.00 0.00 C ATOM 0 HA ALA A 35 24.593 23.166 30.040 1.00 0.00 H new ATOM 0 HB1 ALA A 35 25.127 25.300 28.895 1.00 0.00 H new ATOM 0 HB2 ALA A 35 26.125 25.091 30.354 1.00 0.00 H new ATOM 0 HB3 ALA A 35 26.826 24.794 28.745 1.00 0.00 H new ATOM 11 N PRO A 36 23.938 22.421 27.734 1.00 0.00 N ATOM 12 CA PRO A 36 23.524 21.905 26.422 1.00 0.00 C ATOM 13 C PRO A 36 23.647 22.969 25.328 1.00 0.00 C ATOM 14 O PRO A 36 23.437 24.143 25.562 1.00 0.00 O ATOM 15 CB PRO A 36 22.055 21.537 26.632 1.00 0.00 C ATOM 16 CG PRO A 36 21.609 22.405 27.760 1.00 0.00 C ATOM 17 CD PRO A 36 22.801 22.565 28.659 1.00 0.00 C ATOM 0 HA PRO A 36 24.144 21.071 26.095 1.00 0.00 H new ATOM 0 HB2 PRO A 36 21.467 21.722 25.733 1.00 0.00 H new ATOM 0 HB3 PRO A 36 21.942 20.481 26.875 1.00 0.00 H new ATOM 0 HG2 PRO A 36 21.264 23.372 27.395 1.00 0.00 H new ATOM 0 HG3 PRO A 36 20.775 21.951 28.295 1.00 0.00 H new ATOM 0 HD2 PRO A 36 22.805 23.536 29.155 1.00 0.00 H new ATOM 0 HD3 PRO A 36 22.820 21.807 29.442 1.00 0.00 H new ATOM 25 N ARG A 37 23.990 22.568 24.134 1.00 0.00 N ATOM 26 CA ARG A 37 24.128 23.556 23.027 1.00 0.00 C ATOM 27 C ARG A 37 23.375 23.053 21.794 1.00 0.00 C ATOM 28 O ARG A 37 23.321 21.868 21.527 1.00 0.00 O ATOM 29 CB ARG A 37 25.609 23.730 22.682 1.00 0.00 C ATOM 30 CG ARG A 37 26.348 24.320 23.885 1.00 0.00 C ATOM 31 CD ARG A 37 27.807 24.584 23.509 1.00 0.00 C ATOM 32 NE ARG A 37 28.419 23.330 22.985 1.00 0.00 N ATOM 33 CZ ARG A 37 29.489 23.387 22.239 1.00 0.00 C ATOM 34 NH1 ARG A 37 30.556 23.999 22.676 1.00 0.00 N ATOM 35 NH2 ARG A 37 29.492 22.832 21.059 1.00 0.00 N ATOM 0 H ARG A 37 24.180 21.599 23.878 1.00 0.00 H new ATOM 0 HA ARG A 37 23.711 24.513 23.341 1.00 0.00 H new ATOM 0 HB2 ARG A 37 26.045 22.769 22.410 1.00 0.00 H new ATOM 0 HB3 ARG A 37 25.717 24.386 21.818 1.00 0.00 H new ATOM 0 HG2 ARG A 37 25.869 25.247 24.200 1.00 0.00 H new ATOM 0 HG3 ARG A 37 26.298 23.632 24.729 1.00 0.00 H new ATOM 0 HD2 ARG A 37 27.863 25.371 22.757 1.00 0.00 H new ATOM 0 HD3 ARG A 37 28.360 24.935 24.380 1.00 0.00 H new ATOM 0 HE ARG A 37 28.002 22.427 23.209 1.00 0.00 H new ATOM 0 HH11 ARG A 37 30.553 24.432 23.599 1.00 0.00 H new ATOM 0 HH12 ARG A 37 31.392 24.044 22.094 1.00 0.00 H new ATOM 0 HH21 ARG A 37 28.658 22.353 20.719 1.00 0.00 H new ATOM 0 HH22 ARG A 37 30.328 22.877 20.476 1.00 0.00 H new ATOM 49 N LYS A 38 22.791 23.943 21.039 1.00 0.00 N ATOM 50 CA LYS A 38 22.043 23.516 19.823 1.00 0.00 C ATOM 51 C LYS A 38 23.030 22.998 18.776 1.00 0.00 C ATOM 52 O LYS A 38 24.187 22.768 19.062 1.00 0.00 O ATOM 53 CB LYS A 38 21.274 24.710 19.253 1.00 0.00 C ATOM 54 CG LYS A 38 20.287 25.229 20.301 1.00 0.00 C ATOM 55 CD LYS A 38 19.444 26.352 19.697 1.00 0.00 C ATOM 56 CE LYS A 38 18.551 26.958 20.781 1.00 0.00 C ATOM 57 NZ LYS A 38 17.689 25.893 21.365 1.00 0.00 N ATOM 0 H LYS A 38 22.800 24.948 21.212 1.00 0.00 H new ATOM 0 HA LYS A 38 21.342 22.724 20.085 1.00 0.00 H new ATOM 0 HB2 LYS A 38 21.968 25.501 18.969 1.00 0.00 H new ATOM 0 HB3 LYS A 38 20.740 24.415 18.350 1.00 0.00 H new ATOM 0 HG2 LYS A 38 19.642 24.419 20.641 1.00 0.00 H new ATOM 0 HG3 LYS A 38 20.827 25.595 21.174 1.00 0.00 H new ATOM 0 HD2 LYS A 38 20.091 27.120 19.273 1.00 0.00 H new ATOM 0 HD3 LYS A 38 18.833 25.964 18.882 1.00 0.00 H new ATOM 0 HE2 LYS A 38 19.163 27.413 21.560 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.933 27.750 20.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 16.744 26.280 21.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 17.608 25.104 20.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 18.113 25.550 22.251 1.00 0.00 H new ATOM 71 N GLY A 39 22.584 22.811 17.564 1.00 0.00 N ATOM 72 CA GLY A 39 23.504 22.308 16.504 1.00 0.00 C ATOM 73 C GLY A 39 22.712 21.505 15.470 1.00 0.00 C ATOM 74 O GLY A 39 22.397 20.350 15.676 1.00 0.00 O ATOM 0 H GLY A 39 21.625 22.984 17.262 1.00 0.00 H new ATOM 0 HA2 GLY A 39 24.008 23.144 16.020 1.00 0.00 H new ATOM 0 HA3 GLY A 39 24.278 21.683 16.948 1.00 0.00 H new ATOM 78 N ASN A 40 22.391 22.105 14.356 1.00 0.00 N ATOM 79 CA ASN A 40 21.624 21.372 13.308 1.00 0.00 C ATOM 80 C ASN A 40 22.590 20.866 12.235 1.00 0.00 C ATOM 81 O ASN A 40 23.120 21.631 11.454 1.00 0.00 O ATOM 82 CB ASN A 40 20.601 22.315 12.671 1.00 0.00 C ATOM 83 CG ASN A 40 19.640 21.508 11.796 1.00 0.00 C ATOM 84 OD1 ASN A 40 19.684 20.294 11.784 1.00 0.00 O ATOM 85 ND2 ASN A 40 18.766 22.136 11.058 1.00 0.00 N ATOM 0 H ASN A 40 22.626 23.070 14.126 1.00 0.00 H new ATOM 0 HA ASN A 40 21.105 20.527 13.759 1.00 0.00 H new ATOM 0 HB2 ASN A 40 20.047 22.845 13.446 1.00 0.00 H new ATOM 0 HB3 ASN A 40 21.110 23.069 12.071 1.00 0.00 H new ATOM 0 HD21 ASN A 40 18.120 21.608 10.471 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.729 23.155 11.068 1.00 0.00 H new ATOM 92 N THR A 41 22.826 19.583 12.192 1.00 0.00 N ATOM 93 CA THR A 41 23.762 19.031 11.173 1.00 0.00 C ATOM 94 C THR A 41 23.120 19.107 9.787 1.00 0.00 C ATOM 95 O THR A 41 21.974 18.748 9.602 1.00 0.00 O ATOM 96 CB THR A 41 24.079 17.572 11.508 1.00 0.00 C ATOM 97 OG1 THR A 41 24.818 17.515 12.720 1.00 0.00 O ATOM 98 CG2 THR A 41 24.902 16.954 10.377 1.00 0.00 C ATOM 0 H THR A 41 22.411 18.894 12.819 1.00 0.00 H new ATOM 0 HA THR A 41 24.683 19.615 11.177 1.00 0.00 H new ATOM 0 HB THR A 41 23.149 17.016 11.623 1.00 0.00 H new ATOM 0 HG1 THR A 41 25.288 16.657 12.777 1.00 0.00 H new ATOM 0 HG21 THR A 41 25.127 15.915 10.617 1.00 0.00 H new ATOM 0 HG22 THR A 41 24.334 16.997 9.448 1.00 0.00 H new ATOM 0 HG23 THR A 41 25.833 17.509 10.259 1.00 0.00 H new ATOM 106 N LEU A 42 23.852 19.568 8.810 1.00 0.00 N ATOM 107 CA LEU A 42 23.288 19.664 7.436 1.00 0.00 C ATOM 108 C LEU A 42 24.036 18.699 6.513 1.00 0.00 C ATOM 109 O LEU A 42 25.220 18.473 6.667 1.00 0.00 O ATOM 110 CB LEU A 42 23.448 21.095 6.917 1.00 0.00 C ATOM 111 CG LEU A 42 22.982 22.080 7.989 1.00 0.00 C ATOM 112 CD1 LEU A 42 22.946 23.493 7.403 1.00 0.00 C ATOM 113 CD2 LEU A 42 21.582 21.690 8.468 1.00 0.00 C ATOM 0 H LEU A 42 24.818 19.883 8.905 1.00 0.00 H new ATOM 0 HA LEU A 42 22.230 19.403 7.457 1.00 0.00 H new ATOM 0 HB2 LEU A 42 24.490 21.286 6.661 1.00 0.00 H new ATOM 0 HB3 LEU A 42 22.866 21.230 6.006 1.00 0.00 H new ATOM 0 HG LEU A 42 23.674 22.054 8.831 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.614 24.196 8.167 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.944 23.771 7.063 1.00 0.00 H new ATOM 0 HD13 LEU A 42 22.255 23.520 6.560 1.00 0.00 H new ATOM 0 HD21 LEU A 42 21.250 22.393 9.232 1.00 0.00 H new ATOM 0 HD22 LEU A 42 20.889 21.715 7.627 1.00 0.00 H new ATOM 0 HD23 LEU A 42 21.608 20.684 8.887 1.00 0.00 H new ATOM 125 N TYR A 43 23.356 18.125 5.560 1.00 0.00 N ATOM 126 CA TYR A 43 24.033 17.173 4.634 1.00 0.00 C ATOM 127 C TYR A 43 24.357 17.884 3.318 1.00 0.00 C ATOM 128 O TYR A 43 23.486 18.405 2.652 1.00 0.00 O ATOM 129 CB TYR A 43 23.107 15.986 4.358 1.00 0.00 C ATOM 130 CG TYR A 43 23.817 14.990 3.472 1.00 0.00 C ATOM 131 CD1 TYR A 43 24.650 14.019 4.039 1.00 0.00 C ATOM 132 CD2 TYR A 43 23.641 15.037 2.084 1.00 0.00 C ATOM 133 CE1 TYR A 43 25.307 13.095 3.218 1.00 0.00 C ATOM 134 CE2 TYR A 43 24.298 14.113 1.263 1.00 0.00 C ATOM 135 CZ TYR A 43 25.131 13.142 1.831 1.00 0.00 C ATOM 136 OH TYR A 43 25.779 12.231 1.021 1.00 0.00 O ATOM 0 H TYR A 43 22.363 18.273 5.382 1.00 0.00 H new ATOM 0 HA TYR A 43 24.956 16.816 5.090 1.00 0.00 H new ATOM 0 HB2 TYR A 43 22.816 15.512 5.296 1.00 0.00 H new ATOM 0 HB3 TYR A 43 22.191 16.329 3.877 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.786 13.983 5.110 1.00 0.00 H new ATOM 0 HD2 TYR A 43 22.998 15.786 1.646 1.00 0.00 H new ATOM 0 HE1 TYR A 43 25.950 12.346 3.656 1.00 0.00 H new ATOM 0 HE2 TYR A 43 24.162 14.149 0.192 1.00 0.00 H new ATOM 0 HH TYR A 43 25.547 12.403 0.085 1.00 0.00 H new ATOM 146 N VAL A 44 25.605 17.906 2.938 1.00 0.00 N ATOM 147 CA VAL A 44 25.985 18.582 1.666 1.00 0.00 C ATOM 148 C VAL A 44 26.710 17.587 0.758 1.00 0.00 C ATOM 149 O VAL A 44 27.549 16.827 1.199 1.00 0.00 O ATOM 150 CB VAL A 44 26.910 19.762 1.972 1.00 0.00 C ATOM 151 CG1 VAL A 44 27.294 20.461 0.665 1.00 0.00 C ATOM 152 CG2 VAL A 44 26.185 20.753 2.886 1.00 0.00 C ATOM 0 H VAL A 44 26.378 17.485 3.454 1.00 0.00 H new ATOM 0 HA VAL A 44 25.088 18.945 1.165 1.00 0.00 H new ATOM 0 HB VAL A 44 27.810 19.400 2.469 1.00 0.00 H new ATOM 0 HG11 VAL A 44 27.953 21.302 0.882 1.00 0.00 H new ATOM 0 HG12 VAL A 44 27.809 19.756 0.013 1.00 0.00 H new ATOM 0 HG13 VAL A 44 26.394 20.824 0.169 1.00 0.00 H new ATOM 0 HG21 VAL A 44 26.843 21.594 3.105 1.00 0.00 H new ATOM 0 HG22 VAL A 44 25.285 21.116 2.389 1.00 0.00 H new ATOM 0 HG23 VAL A 44 25.910 20.256 3.816 1.00 0.00 H new ATOM 162 N TYR A 45 26.392 17.583 -0.508 1.00 0.00 N ATOM 163 CA TYR A 45 27.062 16.635 -1.441 1.00 0.00 C ATOM 164 C TYR A 45 27.778 17.423 -2.542 1.00 0.00 C ATOM 165 O TYR A 45 27.289 18.429 -3.015 1.00 0.00 O ATOM 166 CB TYR A 45 26.013 15.717 -2.072 1.00 0.00 C ATOM 167 CG TYR A 45 26.699 14.673 -2.919 1.00 0.00 C ATOM 168 CD1 TYR A 45 27.202 13.508 -2.325 1.00 0.00 C ATOM 169 CD2 TYR A 45 26.832 14.868 -4.299 1.00 0.00 C ATOM 170 CE1 TYR A 45 27.838 12.539 -3.111 1.00 0.00 C ATOM 171 CE2 TYR A 45 27.468 13.898 -5.085 1.00 0.00 C ATOM 172 CZ TYR A 45 27.971 12.735 -4.490 1.00 0.00 C ATOM 173 OH TYR A 45 28.596 11.780 -5.266 1.00 0.00 O ATOM 0 H TYR A 45 25.697 18.195 -0.936 1.00 0.00 H new ATOM 0 HA TYR A 45 27.788 16.036 -0.892 1.00 0.00 H new ATOM 0 HB2 TYR A 45 25.420 15.237 -1.294 1.00 0.00 H new ATOM 0 HB3 TYR A 45 25.324 16.301 -2.683 1.00 0.00 H new ATOM 0 HD1 TYR A 45 27.099 13.357 -1.261 1.00 0.00 H new ATOM 0 HD2 TYR A 45 26.445 15.766 -4.758 1.00 0.00 H new ATOM 0 HE1 TYR A 45 28.226 11.641 -2.653 1.00 0.00 H new ATOM 0 HE2 TYR A 45 27.570 14.048 -6.150 1.00 0.00 H new ATOM 0 HH TYR A 45 28.603 12.072 -6.202 1.00 0.00 H new ATOM 183 N GLY A 46 28.932 16.973 -2.950 1.00 0.00 N ATOM 184 CA GLY A 46 29.677 17.698 -4.019 1.00 0.00 C ATOM 185 C GLY A 46 31.045 17.045 -4.222 1.00 0.00 C ATOM 186 O GLY A 46 31.360 16.039 -3.617 1.00 0.00 O ATOM 0 H GLY A 46 29.391 16.136 -2.591 1.00 0.00 H new ATOM 0 HA2 GLY A 46 29.111 17.677 -4.950 1.00 0.00 H new ATOM 0 HA3 GLY A 46 29.800 18.746 -3.745 1.00 0.00 H new ATOM 190 N GLU A 47 31.862 17.610 -5.069 1.00 0.00 N ATOM 191 CA GLU A 47 33.210 17.022 -5.310 1.00 0.00 C ATOM 192 C GLU A 47 34.284 18.055 -4.964 1.00 0.00 C ATOM 193 O GLU A 47 34.038 19.244 -4.965 1.00 0.00 O ATOM 194 CB GLU A 47 33.339 16.625 -6.782 1.00 0.00 C ATOM 195 CG GLU A 47 32.319 15.531 -7.105 1.00 0.00 C ATOM 196 CD GLU A 47 32.539 15.036 -8.537 1.00 0.00 C ATOM 197 OE1 GLU A 47 33.332 15.643 -9.237 1.00 0.00 O ATOM 198 OE2 GLU A 47 31.911 14.058 -8.908 1.00 0.00 O ATOM 0 H GLU A 47 31.654 18.453 -5.604 1.00 0.00 H new ATOM 0 HA GLU A 47 33.339 16.139 -4.684 1.00 0.00 H new ATOM 0 HB2 GLU A 47 33.172 17.493 -7.420 1.00 0.00 H new ATOM 0 HB3 GLU A 47 34.348 16.268 -6.987 1.00 0.00 H new ATOM 0 HG2 GLU A 47 32.422 14.704 -6.403 1.00 0.00 H new ATOM 0 HG3 GLU A 47 31.306 15.919 -6.994 1.00 0.00 H new ATOM 205 N ASP A 48 35.476 17.609 -4.670 1.00 0.00 N ATOM 206 CA ASP A 48 36.564 18.567 -4.324 1.00 0.00 C ATOM 207 C ASP A 48 36.022 19.635 -3.371 1.00 0.00 C ATOM 208 O ASP A 48 36.166 20.818 -3.603 1.00 0.00 O ATOM 209 CB ASP A 48 37.078 19.237 -5.601 1.00 0.00 C ATOM 210 CG ASP A 48 37.541 18.164 -6.588 1.00 0.00 C ATOM 211 OD1 ASP A 48 37.790 17.052 -6.151 1.00 0.00 O ATOM 212 OD2 ASP A 48 37.640 18.471 -7.764 1.00 0.00 O ATOM 0 H ASP A 48 35.742 16.625 -4.655 1.00 0.00 H new ATOM 0 HA ASP A 48 37.380 18.030 -3.840 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.290 19.843 -6.049 1.00 0.00 H new ATOM 0 HB3 ASP A 48 37.903 19.910 -5.365 1.00 0.00 H new ATOM 217 N MET A 49 35.401 19.225 -2.300 1.00 0.00 N ATOM 218 CA MET A 49 34.851 20.217 -1.333 1.00 0.00 C ATOM 219 C MET A 49 35.765 20.298 -0.109 1.00 0.00 C ATOM 220 O MET A 49 36.304 19.308 0.343 1.00 0.00 O ATOM 221 CB MET A 49 33.452 19.781 -0.896 1.00 0.00 C ATOM 222 CG MET A 49 32.511 19.801 -2.101 1.00 0.00 C ATOM 223 SD MET A 49 30.816 19.481 -1.549 1.00 0.00 S ATOM 224 CE MET A 49 31.132 17.878 -0.769 1.00 0.00 C ATOM 0 H MET A 49 35.250 18.247 -2.052 1.00 0.00 H new ATOM 0 HA MET A 49 34.795 21.196 -1.810 1.00 0.00 H new ATOM 0 HB2 MET A 49 33.489 18.780 -0.467 1.00 0.00 H new ATOM 0 HB3 MET A 49 33.078 20.447 -0.118 1.00 0.00 H new ATOM 0 HG2 MET A 49 32.565 20.767 -2.602 1.00 0.00 H new ATOM 0 HG3 MET A 49 32.817 19.048 -2.827 1.00 0.00 H new ATOM 0 HE1 MET A 49 30.193 17.337 -0.656 1.00 0.00 H new ATOM 0 HE2 MET A 49 31.812 17.298 -1.392 1.00 0.00 H new ATOM 0 HE3 MET A 49 31.582 18.033 0.212 1.00 0.00 H new ATOM 234 N THR A 50 35.944 21.473 0.431 1.00 0.00 N ATOM 235 CA THR A 50 36.822 21.617 1.627 1.00 0.00 C ATOM 236 C THR A 50 36.019 22.233 2.775 1.00 0.00 C ATOM 237 O THR A 50 34.960 22.792 2.573 1.00 0.00 O ATOM 238 CB THR A 50 38.003 22.528 1.285 1.00 0.00 C ATOM 239 OG1 THR A 50 37.627 23.415 0.239 1.00 0.00 O ATOM 240 CG2 THR A 50 39.192 21.678 0.833 1.00 0.00 C ATOM 0 H THR A 50 35.521 22.338 0.096 1.00 0.00 H new ATOM 0 HA THR A 50 37.194 20.637 1.927 1.00 0.00 H new ATOM 0 HB THR A 50 38.286 23.103 2.166 1.00 0.00 H new ATOM 0 HG1 THR A 50 38.382 24.001 0.020 1.00 0.00 H new ATOM 0 HG21 THR A 50 40.032 22.328 0.590 1.00 0.00 H new ATOM 0 HG22 THR A 50 39.479 20.998 1.635 1.00 0.00 H new ATOM 0 HG23 THR A 50 38.913 21.101 -0.049 1.00 0.00 H new ATOM 248 N PRO A 51 36.539 22.124 4.007 1.00 0.00 N ATOM 249 CA PRO A 51 35.875 22.669 5.197 1.00 0.00 C ATOM 250 C PRO A 51 35.889 24.200 5.205 1.00 0.00 C ATOM 251 O PRO A 51 34.864 24.838 5.343 1.00 0.00 O ATOM 252 CB PRO A 51 36.717 22.132 6.354 1.00 0.00 C ATOM 253 CG PRO A 51 38.060 21.883 5.756 1.00 0.00 C ATOM 254 CD PRO A 51 37.815 21.464 4.335 1.00 0.00 C ATOM 0 HA PRO A 51 34.825 22.381 5.247 1.00 0.00 H new ATOM 0 HB2 PRO A 51 36.774 22.852 7.171 1.00 0.00 H new ATOM 0 HB3 PRO A 51 36.290 21.217 6.764 1.00 0.00 H new ATOM 0 HG2 PRO A 51 38.677 22.781 5.796 1.00 0.00 H new ATOM 0 HG3 PRO A 51 38.592 21.106 6.305 1.00 0.00 H new ATOM 0 HD2 PRO A 51 38.619 21.790 3.675 1.00 0.00 H new ATOM 0 HD3 PRO A 51 37.744 20.380 4.241 1.00 0.00 H new ATOM 262 N THR A 52 37.041 24.794 5.055 1.00 0.00 N ATOM 263 CA THR A 52 37.116 26.281 5.053 1.00 0.00 C ATOM 264 C THR A 52 36.087 26.838 4.067 1.00 0.00 C ATOM 265 O THR A 52 35.325 27.729 4.387 1.00 0.00 O ATOM 266 CB THR A 52 38.519 26.721 4.628 1.00 0.00 C ATOM 267 OG1 THR A 52 39.484 26.059 5.433 1.00 0.00 O ATOM 268 CG2 THR A 52 38.657 28.234 4.801 1.00 0.00 C ATOM 0 H THR A 52 37.933 24.314 4.934 1.00 0.00 H new ATOM 0 HA THR A 52 36.905 26.658 6.054 1.00 0.00 H new ATOM 0 HB THR A 52 38.680 26.463 3.581 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.383 26.338 5.161 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.657 28.545 4.498 1.00 0.00 H new ATOM 0 HG22 THR A 52 37.916 28.740 4.182 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.497 28.497 5.847 1.00 0.00 H new ATOM 276 N LEU A 53 36.056 26.318 2.871 1.00 0.00 N ATOM 277 CA LEU A 53 35.073 26.817 1.869 1.00 0.00 C ATOM 278 C LEU A 53 33.656 26.601 2.399 1.00 0.00 C ATOM 279 O LEU A 53 32.825 27.486 2.358 1.00 0.00 O ATOM 280 CB LEU A 53 35.248 26.052 0.556 1.00 0.00 C ATOM 281 CG LEU A 53 34.330 26.655 -0.509 1.00 0.00 C ATOM 282 CD1 LEU A 53 34.904 27.993 -0.980 1.00 0.00 C ATOM 283 CD2 LEU A 53 34.228 25.696 -1.697 1.00 0.00 C ATOM 0 H LEU A 53 36.668 25.570 2.545 1.00 0.00 H new ATOM 0 HA LEU A 53 35.240 27.880 1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 53 36.286 26.103 0.228 1.00 0.00 H new ATOM 0 HB3 LEU A 53 35.011 24.998 0.702 1.00 0.00 H new ATOM 0 HG LEU A 53 33.338 26.815 -0.085 1.00 0.00 H new ATOM 0 HD11 LEU A 53 34.250 28.423 -1.739 1.00 0.00 H new ATOM 0 HD12 LEU A 53 34.976 28.676 -0.134 1.00 0.00 H new ATOM 0 HD13 LEU A 53 35.896 27.835 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 53 33.574 26.125 -2.456 1.00 0.00 H new ATOM 0 HD22 LEU A 53 35.219 25.535 -2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 53 33.818 24.743 -1.361 1.00 0.00 H new ATOM 295 N LEU A 54 33.374 25.429 2.900 1.00 0.00 N ATOM 296 CA LEU A 54 32.011 25.159 3.436 1.00 0.00 C ATOM 297 C LEU A 54 31.676 26.192 4.513 1.00 0.00 C ATOM 298 O LEU A 54 30.609 26.772 4.520 1.00 0.00 O ATOM 299 CB LEU A 54 31.970 23.756 4.047 1.00 0.00 C ATOM 300 CG LEU A 54 32.040 22.712 2.931 1.00 0.00 C ATOM 301 CD1 LEU A 54 32.573 21.395 3.499 1.00 0.00 C ATOM 302 CD2 LEU A 54 30.641 22.488 2.352 1.00 0.00 C ATOM 0 H LEU A 54 34.028 24.649 2.961 1.00 0.00 H new ATOM 0 HA LEU A 54 31.283 25.224 2.627 1.00 0.00 H new ATOM 0 HB2 LEU A 54 32.804 23.623 4.736 1.00 0.00 H new ATOM 0 HB3 LEU A 54 31.055 23.626 4.625 1.00 0.00 H new ATOM 0 HG LEU A 54 32.706 23.066 2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 54 32.623 20.650 2.705 1.00 0.00 H new ATOM 0 HD12 LEU A 54 33.569 21.553 3.912 1.00 0.00 H new ATOM 0 HD13 LEU A 54 31.906 21.042 4.286 1.00 0.00 H new ATOM 0 HD21 LEU A 54 30.691 21.744 1.557 1.00 0.00 H new ATOM 0 HD22 LEU A 54 29.974 22.134 3.138 1.00 0.00 H new ATOM 0 HD23 LEU A 54 30.260 23.426 1.948 1.00 0.00 H new ATOM 314 N ARG A 55 32.582 26.428 5.422 1.00 0.00 N ATOM 315 CA ARG A 55 32.314 27.427 6.495 1.00 0.00 C ATOM 316 C ARG A 55 31.848 28.738 5.860 1.00 0.00 C ATOM 317 O ARG A 55 30.944 29.387 6.348 1.00 0.00 O ATOM 318 CB ARG A 55 33.594 27.674 7.296 1.00 0.00 C ATOM 319 CG ARG A 55 33.978 26.398 8.049 1.00 0.00 C ATOM 320 CD ARG A 55 35.257 26.647 8.851 1.00 0.00 C ATOM 321 NE ARG A 55 34.964 27.581 9.974 1.00 0.00 N ATOM 322 CZ ARG A 55 34.057 27.271 10.860 1.00 0.00 C ATOM 323 NH1 ARG A 55 34.244 26.255 11.656 1.00 0.00 N ATOM 324 NH2 ARG A 55 32.965 27.980 10.949 1.00 0.00 N ATOM 0 H ARG A 55 33.494 25.974 5.468 1.00 0.00 H new ATOM 0 HA ARG A 55 31.539 27.048 7.161 1.00 0.00 H new ATOM 0 HB2 ARG A 55 34.402 27.972 6.628 1.00 0.00 H new ATOM 0 HB3 ARG A 55 33.443 28.493 7.999 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.170 26.099 8.716 1.00 0.00 H new ATOM 0 HG3 ARG A 55 34.130 25.579 7.346 1.00 0.00 H new ATOM 0 HD2 ARG A 55 35.645 25.705 9.239 1.00 0.00 H new ATOM 0 HD3 ARG A 55 36.028 27.068 8.205 1.00 0.00 H new ATOM 0 HE ARG A 55 35.472 28.462 10.050 1.00 0.00 H new ATOM 0 HH11 ARG A 55 35.099 25.703 11.586 1.00 0.00 H new ATOM 0 HH12 ARG A 55 33.535 26.012 12.348 1.00 0.00 H new ATOM 0 HH21 ARG A 55 32.821 28.775 10.327 1.00 0.00 H new ATOM 0 HH22 ARG A 55 32.255 27.739 11.641 1.00 0.00 H new ATOM 338 N GLY A 56 32.457 29.132 4.775 1.00 0.00 N ATOM 339 CA GLY A 56 32.045 30.399 4.110 1.00 0.00 C ATOM 340 C GLY A 56 30.628 30.242 3.554 1.00 0.00 C ATOM 341 O GLY A 56 29.851 31.176 3.535 1.00 0.00 O ATOM 0 H GLY A 56 33.221 28.631 4.321 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.079 31.224 4.821 1.00 0.00 H new ATOM 0 HA3 GLY A 56 32.739 30.643 3.305 1.00 0.00 H new ATOM 345 N ALA A 57 30.287 29.067 3.101 1.00 0.00 N ATOM 346 CA ALA A 57 28.920 28.849 2.547 1.00 0.00 C ATOM 347 C ALA A 57 27.899 28.869 3.686 1.00 0.00 C ATOM 348 O ALA A 57 26.742 29.185 3.491 1.00 0.00 O ATOM 349 CB ALA A 57 28.866 27.494 1.838 1.00 0.00 C ATOM 0 H ALA A 57 30.895 28.248 3.090 1.00 0.00 H new ATOM 0 HA ALA A 57 28.687 29.641 1.835 1.00 0.00 H new ATOM 0 HB1 ALA A 57 27.867 27.335 1.433 1.00 0.00 H new ATOM 0 HB2 ALA A 57 29.593 27.479 1.026 1.00 0.00 H new ATOM 0 HB3 ALA A 57 29.100 26.702 2.549 1.00 0.00 H new ATOM 355 N PHE A 58 28.318 28.534 4.876 1.00 0.00 N ATOM 356 CA PHE A 58 27.374 28.534 6.027 1.00 0.00 C ATOM 357 C PHE A 58 27.801 29.602 7.037 1.00 0.00 C ATOM 358 O PHE A 58 27.275 29.685 8.129 1.00 0.00 O ATOM 359 CB PHE A 58 27.393 27.160 6.702 1.00 0.00 C ATOM 360 CG PHE A 58 26.884 26.117 5.735 1.00 0.00 C ATOM 361 CD1 PHE A 58 27.774 25.474 4.867 1.00 0.00 C ATOM 362 CD2 PHE A 58 25.523 25.794 5.707 1.00 0.00 C ATOM 363 CE1 PHE A 58 27.302 24.506 3.971 1.00 0.00 C ATOM 364 CE2 PHE A 58 25.050 24.827 4.811 1.00 0.00 C ATOM 365 CZ PHE A 58 25.940 24.183 3.943 1.00 0.00 C ATOM 0 H PHE A 58 29.275 28.260 5.100 1.00 0.00 H new ATOM 0 HA PHE A 58 26.367 28.751 5.671 1.00 0.00 H new ATOM 0 HB2 PHE A 58 28.406 26.913 7.020 1.00 0.00 H new ATOM 0 HB3 PHE A 58 26.772 27.174 7.598 1.00 0.00 H new ATOM 0 HD1 PHE A 58 28.824 25.724 4.888 1.00 0.00 H new ATOM 0 HD2 PHE A 58 24.837 26.291 6.377 1.00 0.00 H new ATOM 0 HE1 PHE A 58 27.989 24.009 3.302 1.00 0.00 H new ATOM 0 HE2 PHE A 58 23.999 24.578 4.790 1.00 0.00 H new ATOM 0 HZ PHE A 58 25.576 23.437 3.252 1.00 0.00 H new ATOM 375 N SER A 59 28.757 30.418 6.683 1.00 0.00 N ATOM 376 CA SER A 59 29.224 31.478 7.621 1.00 0.00 C ATOM 377 C SER A 59 28.171 32.586 7.718 1.00 0.00 C ATOM 378 O SER A 59 27.678 32.892 8.785 1.00 0.00 O ATOM 379 CB SER A 59 30.539 32.068 7.109 1.00 0.00 C ATOM 380 OG SER A 59 30.599 33.447 7.437 1.00 0.00 O ATOM 0 H SER A 59 29.235 30.396 5.782 1.00 0.00 H new ATOM 0 HA SER A 59 29.379 31.042 8.608 1.00 0.00 H new ATOM 0 HB2 SER A 59 31.384 31.541 7.553 1.00 0.00 H new ATOM 0 HB3 SER A 59 30.613 31.937 6.029 1.00 0.00 H new ATOM 0 HG SER A 59 31.442 33.825 7.110 1.00 0.00 H new ATOM 386 N PRO A 60 27.829 33.202 6.576 1.00 0.00 N ATOM 387 CA PRO A 60 26.837 34.286 6.527 1.00 0.00 C ATOM 388 C PRO A 60 25.421 33.781 6.822 1.00 0.00 C ATOM 389 O PRO A 60 24.587 34.506 7.327 1.00 0.00 O ATOM 390 CB PRO A 60 26.926 34.785 5.085 1.00 0.00 C ATOM 391 CG PRO A 60 27.448 33.619 4.316 1.00 0.00 C ATOM 392 CD PRO A 60 28.377 32.891 5.245 1.00 0.00 C ATOM 0 HA PRO A 60 27.036 35.056 7.273 1.00 0.00 H new ATOM 0 HB2 PRO A 60 25.951 35.101 4.714 1.00 0.00 H new ATOM 0 HB3 PRO A 60 27.592 35.644 5.003 1.00 0.00 H new ATOM 0 HG2 PRO A 60 26.634 32.971 3.991 1.00 0.00 H new ATOM 0 HG3 PRO A 60 27.972 33.947 3.418 1.00 0.00 H new ATOM 0 HD2 PRO A 60 28.382 31.818 5.052 1.00 0.00 H new ATOM 0 HD3 PRO A 60 29.405 33.238 5.141 1.00 0.00 H new ATOM 400 N PHE A 61 25.143 32.545 6.513 1.00 0.00 N ATOM 401 CA PHE A 61 23.782 32.000 6.777 1.00 0.00 C ATOM 402 C PHE A 61 23.575 31.848 8.286 1.00 0.00 C ATOM 403 O PHE A 61 22.477 31.983 8.788 1.00 0.00 O ATOM 404 CB PHE A 61 23.639 30.635 6.101 1.00 0.00 C ATOM 405 CG PHE A 61 23.438 30.830 4.617 1.00 0.00 C ATOM 406 CD1 PHE A 61 22.145 30.964 4.097 1.00 0.00 C ATOM 407 CD2 PHE A 61 24.546 30.877 3.762 1.00 0.00 C ATOM 408 CE1 PHE A 61 21.959 31.146 2.722 1.00 0.00 C ATOM 409 CE2 PHE A 61 24.360 31.059 2.386 1.00 0.00 C ATOM 410 CZ PHE A 61 23.066 31.193 1.866 1.00 0.00 C ATOM 0 H PHE A 61 25.799 31.889 6.089 1.00 0.00 H new ATOM 0 HA PHE A 61 23.034 32.684 6.376 1.00 0.00 H new ATOM 0 HB2 PHE A 61 24.528 30.032 6.283 1.00 0.00 H new ATOM 0 HB3 PHE A 61 22.794 30.093 6.526 1.00 0.00 H new ATOM 0 HD1 PHE A 61 21.291 30.927 4.757 1.00 0.00 H new ATOM 0 HD2 PHE A 61 25.543 30.773 4.163 1.00 0.00 H new ATOM 0 HE1 PHE A 61 20.962 31.250 2.321 1.00 0.00 H new ATOM 0 HE2 PHE A 61 25.214 31.096 1.726 1.00 0.00 H new ATOM 0 HZ PHE A 61 22.922 31.333 0.805 1.00 0.00 H new ATOM 420 N GLY A 62 24.623 31.569 9.013 1.00 0.00 N ATOM 421 CA GLY A 62 24.483 31.412 10.488 1.00 0.00 C ATOM 422 C GLY A 62 25.829 31.002 11.088 1.00 0.00 C ATOM 423 O GLY A 62 26.844 31.001 10.419 1.00 0.00 O ATOM 0 H GLY A 62 25.568 31.443 8.650 1.00 0.00 H new ATOM 0 HA2 GLY A 62 24.144 32.347 10.933 1.00 0.00 H new ATOM 0 HA3 GLY A 62 23.728 30.659 10.714 1.00 0.00 H new ATOM 427 N ASN A 63 25.847 30.655 12.345 1.00 0.00 N ATOM 428 CA ASN A 63 27.128 30.246 12.988 1.00 0.00 C ATOM 429 C ASN A 63 27.200 28.719 13.046 1.00 0.00 C ATOM 430 O ASN A 63 26.235 28.054 13.362 1.00 0.00 O ATOM 431 CB ASN A 63 27.193 30.815 14.405 1.00 0.00 C ATOM 432 CG ASN A 63 27.241 32.343 14.338 1.00 0.00 C ATOM 433 OD1 ASN A 63 27.502 32.909 13.294 1.00 0.00 O ATOM 434 ND2 ASN A 63 26.999 33.039 15.414 1.00 0.00 N ATOM 0 H ASN A 63 25.030 30.637 12.955 1.00 0.00 H new ATOM 0 HA ASN A 63 27.967 30.629 12.407 1.00 0.00 H new ATOM 0 HB2 ASN A 63 26.324 30.492 14.978 1.00 0.00 H new ATOM 0 HB3 ASN A 63 28.075 30.435 14.921 1.00 0.00 H new ATOM 0 HD21 ASN A 63 27.029 34.058 15.380 1.00 0.00 H new ATOM 0 HD22 ASN A 63 26.780 32.564 16.290 1.00 0.00 H new ATOM 441 N ILE A 64 28.339 28.158 12.744 1.00 0.00 N ATOM 442 CA ILE A 64 28.471 26.675 12.782 1.00 0.00 C ATOM 443 C ILE A 64 29.141 26.253 14.092 1.00 0.00 C ATOM 444 O ILE A 64 30.155 26.795 14.484 1.00 0.00 O ATOM 445 CB ILE A 64 29.323 26.209 11.599 1.00 0.00 C ATOM 446 CG1 ILE A 64 28.706 26.719 10.295 1.00 0.00 C ATOM 447 CG2 ILE A 64 29.374 24.681 11.578 1.00 0.00 C ATOM 448 CD1 ILE A 64 29.701 26.525 9.150 1.00 0.00 C ATOM 0 H ILE A 64 29.183 28.663 12.473 1.00 0.00 H new ATOM 0 HA ILE A 64 27.482 26.221 12.719 1.00 0.00 H new ATOM 0 HB ILE A 64 30.334 26.604 11.701 1.00 0.00 H new ATOM 0 HG12 ILE A 64 27.782 26.181 10.083 1.00 0.00 H new ATOM 0 HG13 ILE A 64 28.447 27.773 10.391 1.00 0.00 H new ATOM 0 HG21 ILE A 64 29.981 24.349 10.736 1.00 0.00 H new ATOM 0 HG22 ILE A 64 29.814 24.319 12.507 1.00 0.00 H new ATOM 0 HG23 ILE A 64 28.364 24.285 11.476 1.00 0.00 H new ATOM 0 HD11 ILE A 64 29.262 26.888 8.221 1.00 0.00 H new ATOM 0 HD12 ILE A 64 30.613 27.082 9.362 1.00 0.00 H new ATOM 0 HD13 ILE A 64 29.938 25.466 9.050 1.00 0.00 H new ATOM 460 N ILE A 65 28.581 25.289 14.770 1.00 0.00 N ATOM 461 CA ILE A 65 29.186 24.833 16.053 1.00 0.00 C ATOM 462 C ILE A 65 30.060 23.603 15.795 1.00 0.00 C ATOM 463 O ILE A 65 30.952 23.292 16.558 1.00 0.00 O ATOM 464 CB ILE A 65 28.075 24.471 17.042 1.00 0.00 C ATOM 465 CG1 ILE A 65 27.394 23.176 16.592 1.00 0.00 C ATOM 466 CG2 ILE A 65 27.045 25.601 17.087 1.00 0.00 C ATOM 467 CD1 ILE A 65 26.300 22.801 17.595 1.00 0.00 C ATOM 0 H ILE A 65 27.732 24.798 14.491 1.00 0.00 H new ATOM 0 HA ILE A 65 29.797 25.633 16.471 1.00 0.00 H new ATOM 0 HB ILE A 65 28.503 24.330 18.035 1.00 0.00 H new ATOM 0 HG12 ILE A 65 26.963 23.305 15.599 1.00 0.00 H new ATOM 0 HG13 ILE A 65 28.127 22.373 16.520 1.00 0.00 H new ATOM 0 HG21 ILE A 65 26.254 25.344 17.791 1.00 0.00 H new ATOM 0 HG22 ILE A 65 27.530 26.523 17.407 1.00 0.00 H new ATOM 0 HG23 ILE A 65 26.616 25.742 16.095 1.00 0.00 H new ATOM 0 HD11 ILE A 65 25.814 21.879 17.276 1.00 0.00 H new ATOM 0 HD12 ILE A 65 26.744 22.655 18.580 1.00 0.00 H new ATOM 0 HD13 ILE A 65 25.562 23.602 17.645 1.00 0.00 H new ATOM 479 N ASP A 66 29.810 22.900 14.724 1.00 0.00 N ATOM 480 CA ASP A 66 30.626 21.692 14.420 1.00 0.00 C ATOM 481 C ASP A 66 30.829 21.578 12.907 1.00 0.00 C ATOM 482 O ASP A 66 29.912 21.759 12.131 1.00 0.00 O ATOM 483 CB ASP A 66 29.902 20.445 14.933 1.00 0.00 C ATOM 484 CG ASP A 66 30.835 19.236 14.831 1.00 0.00 C ATOM 485 OD1 ASP A 66 31.989 19.430 14.487 1.00 0.00 O ATOM 486 OD2 ASP A 66 30.378 18.137 15.100 1.00 0.00 O ATOM 0 H ASP A 66 29.076 23.110 14.047 1.00 0.00 H new ATOM 0 HA ASP A 66 31.596 21.777 14.910 1.00 0.00 H new ATOM 0 HB2 ASP A 66 29.591 20.592 15.967 1.00 0.00 H new ATOM 0 HB3 ASP A 66 28.998 20.270 14.350 1.00 0.00 H new ATOM 491 N LEU A 67 32.026 21.278 12.482 1.00 0.00 N ATOM 492 CA LEU A 67 32.290 21.150 11.020 1.00 0.00 C ATOM 493 C LEU A 67 32.844 19.754 10.726 1.00 0.00 C ATOM 494 O LEU A 67 33.923 19.402 11.159 1.00 0.00 O ATOM 495 CB LEU A 67 33.314 22.207 10.595 1.00 0.00 C ATOM 496 CG LEU A 67 33.437 22.226 9.068 1.00 0.00 C ATOM 497 CD1 LEU A 67 34.193 20.983 8.598 1.00 0.00 C ATOM 498 CD2 LEU A 67 32.042 22.241 8.441 1.00 0.00 C ATOM 0 H LEU A 67 32.833 21.116 13.084 1.00 0.00 H new ATOM 0 HA LEU A 67 31.363 21.298 10.465 1.00 0.00 H new ATOM 0 HB2 LEU A 67 33.008 23.189 10.957 1.00 0.00 H new ATOM 0 HB3 LEU A 67 34.283 21.989 11.044 1.00 0.00 H new ATOM 0 HG LEU A 67 33.982 23.119 8.762 1.00 0.00 H new ATOM 0 HD11 LEU A 67 34.279 20.999 7.512 1.00 0.00 H new ATOM 0 HD12 LEU A 67 35.189 20.974 9.041 1.00 0.00 H new ATOM 0 HD13 LEU A 67 33.651 20.089 8.906 1.00 0.00 H new ATOM 0 HD21 LEU A 67 32.131 22.255 7.355 1.00 0.00 H new ATOM 0 HD22 LEU A 67 31.495 21.350 8.749 1.00 0.00 H new ATOM 0 HD23 LEU A 67 31.504 23.129 8.772 1.00 0.00 H new ATOM 510 N SER A 68 32.115 18.956 9.995 1.00 0.00 N ATOM 511 CA SER A 68 32.605 17.584 9.679 1.00 0.00 C ATOM 512 C SER A 68 32.510 17.342 8.172 1.00 0.00 C ATOM 513 O SER A 68 31.606 17.816 7.512 1.00 0.00 O ATOM 514 CB SER A 68 31.749 16.554 10.418 1.00 0.00 C ATOM 515 OG SER A 68 32.245 15.250 10.155 1.00 0.00 O ATOM 0 H SER A 68 31.204 19.194 9.604 1.00 0.00 H new ATOM 0 HA SER A 68 33.643 17.487 9.996 1.00 0.00 H new ATOM 0 HB2 SER A 68 31.767 16.752 11.490 1.00 0.00 H new ATOM 0 HB3 SER A 68 30.710 16.631 10.097 1.00 0.00 H new ATOM 0 HG SER A 68 31.698 14.590 10.630 1.00 0.00 H new ATOM 521 N MET A 69 33.435 16.604 7.621 1.00 0.00 N ATOM 522 CA MET A 69 33.399 16.330 6.158 1.00 0.00 C ATOM 523 C MET A 69 33.559 14.827 5.917 1.00 0.00 C ATOM 524 O MET A 69 34.284 14.151 6.620 1.00 0.00 O ATOM 525 CB MET A 69 34.539 17.081 5.469 1.00 0.00 C ATOM 526 CG MET A 69 34.259 18.584 5.515 1.00 0.00 C ATOM 527 SD MET A 69 35.411 19.446 4.416 1.00 0.00 S ATOM 528 CE MET A 69 34.617 18.990 2.856 1.00 0.00 C ATOM 0 H MET A 69 34.215 16.179 8.123 1.00 0.00 H new ATOM 0 HA MET A 69 32.445 16.665 5.749 1.00 0.00 H new ATOM 0 HB2 MET A 69 35.485 16.861 5.963 1.00 0.00 H new ATOM 0 HB3 MET A 69 34.635 16.749 4.435 1.00 0.00 H new ATOM 0 HG2 MET A 69 33.231 18.783 5.211 1.00 0.00 H new ATOM 0 HG3 MET A 69 34.367 18.954 6.535 1.00 0.00 H new ATOM 0 HE1 MET A 69 35.225 18.245 2.343 1.00 0.00 H new ATOM 0 HE2 MET A 69 33.629 18.576 3.058 1.00 0.00 H new ATOM 0 HE3 MET A 69 34.518 19.874 2.226 1.00 0.00 H new ATOM 538 N ASP A 70 32.888 14.298 4.931 1.00 0.00 N ATOM 539 CA ASP A 70 33.003 12.840 4.650 1.00 0.00 C ATOM 540 C ASP A 70 33.607 12.632 3.260 1.00 0.00 C ATOM 541 O ASP A 70 32.962 12.849 2.254 1.00 0.00 O ATOM 542 CB ASP A 70 31.613 12.201 4.702 1.00 0.00 C ATOM 543 CG ASP A 70 31.728 10.771 5.236 1.00 0.00 C ATOM 544 OD1 ASP A 70 32.244 10.608 6.330 1.00 0.00 O ATOM 545 OD2 ASP A 70 31.298 9.865 4.542 1.00 0.00 O ATOM 0 H ASP A 70 32.265 14.813 4.308 1.00 0.00 H new ATOM 0 HA ASP A 70 33.646 12.376 5.398 1.00 0.00 H new ATOM 0 HB2 ASP A 70 30.955 12.788 5.343 1.00 0.00 H new ATOM 0 HB3 ASP A 70 31.167 12.194 3.708 1.00 0.00 H new ATOM 550 N PRO A 71 34.876 12.196 3.210 1.00 0.00 N ATOM 551 CA PRO A 71 35.574 11.954 1.947 1.00 0.00 C ATOM 552 C PRO A 71 35.123 10.664 1.230 1.00 0.00 C ATOM 553 O PRO A 71 35.207 10.582 0.020 1.00 0.00 O ATOM 554 CB PRO A 71 37.042 11.847 2.359 1.00 0.00 C ATOM 555 CG PRO A 71 37.022 11.427 3.792 1.00 0.00 C ATOM 556 CD PRO A 71 35.723 11.916 4.384 1.00 0.00 C ATOM 0 HA PRO A 71 35.369 12.749 1.230 1.00 0.00 H new ATOM 0 HB2 PRO A 71 37.571 11.119 1.744 1.00 0.00 H new ATOM 0 HB3 PRO A 71 37.555 12.801 2.236 1.00 0.00 H new ATOM 0 HG2 PRO A 71 37.099 10.343 3.876 1.00 0.00 H new ATOM 0 HG3 PRO A 71 37.872 11.849 4.328 1.00 0.00 H new ATOM 0 HD2 PRO A 71 35.272 11.164 5.031 1.00 0.00 H new ATOM 0 HD3 PRO A 71 35.872 12.810 4.990 1.00 0.00 H new ATOM 564 N PRO A 72 34.638 9.634 1.961 1.00 0.00 N ATOM 565 CA PRO A 72 34.199 8.386 1.327 1.00 0.00 C ATOM 566 C PRO A 72 32.843 8.546 0.635 1.00 0.00 C ATOM 567 O PRO A 72 32.550 7.883 -0.341 1.00 0.00 O ATOM 568 CB PRO A 72 34.072 7.410 2.493 1.00 0.00 C ATOM 569 CG PRO A 72 33.822 8.265 3.688 1.00 0.00 C ATOM 570 CD PRO A 72 34.481 9.593 3.429 1.00 0.00 C ATOM 0 HA PRO A 72 34.894 8.058 0.554 1.00 0.00 H new ATOM 0 HB2 PRO A 72 33.254 6.708 2.332 1.00 0.00 H new ATOM 0 HB3 PRO A 72 34.980 6.819 2.614 1.00 0.00 H new ATOM 0 HG2 PRO A 72 32.752 8.392 3.854 1.00 0.00 H new ATOM 0 HG3 PRO A 72 34.231 7.801 4.586 1.00 0.00 H new ATOM 0 HD2 PRO A 72 33.868 10.420 3.788 1.00 0.00 H new ATOM 0 HD3 PRO A 72 35.443 9.667 3.936 1.00 0.00 H new ATOM 578 N ARG A 73 32.012 9.421 1.131 1.00 0.00 N ATOM 579 CA ARG A 73 30.677 9.622 0.501 1.00 0.00 C ATOM 580 C ARG A 73 30.658 10.956 -0.249 1.00 0.00 C ATOM 581 O ARG A 73 29.658 11.341 -0.823 1.00 0.00 O ATOM 582 CB ARG A 73 29.598 9.632 1.586 1.00 0.00 C ATOM 583 CG ARG A 73 29.562 8.270 2.281 1.00 0.00 C ATOM 584 CD ARG A 73 28.425 8.250 3.305 1.00 0.00 C ATOM 585 NE ARG A 73 27.117 8.326 2.596 1.00 0.00 N ATOM 586 CZ ARG A 73 26.932 7.649 1.496 1.00 0.00 C ATOM 587 NH1 ARG A 73 26.961 6.344 1.521 1.00 0.00 N ATOM 588 NH2 ARG A 73 26.717 8.276 0.372 1.00 0.00 N ATOM 0 H ARG A 73 32.200 10.005 1.946 1.00 0.00 H new ATOM 0 HA ARG A 73 30.482 8.810 -0.200 1.00 0.00 H new ATOM 0 HB2 ARG A 73 29.805 10.418 2.313 1.00 0.00 H new ATOM 0 HB3 ARG A 73 28.626 9.853 1.145 1.00 0.00 H new ATOM 0 HG2 ARG A 73 29.418 7.478 1.546 1.00 0.00 H new ATOM 0 HG3 ARG A 73 30.514 8.077 2.775 1.00 0.00 H new ATOM 0 HD2 ARG A 73 28.475 7.339 3.902 1.00 0.00 H new ATOM 0 HD3 ARG A 73 28.527 9.089 3.994 1.00 0.00 H new ATOM 0 HE ARG A 73 26.367 8.907 2.970 1.00 0.00 H new ATOM 0 HH11 ARG A 73 27.128 5.854 2.400 1.00 0.00 H new ATOM 0 HH12 ARG A 73 26.816 5.814 0.662 1.00 0.00 H new ATOM 0 HH21 ARG A 73 26.694 9.296 0.353 1.00 0.00 H new ATOM 0 HH22 ARG A 73 26.572 7.747 -0.488 1.00 0.00 H new ATOM 602 N ASN A 74 31.753 11.666 -0.251 1.00 0.00 N ATOM 603 CA ASN A 74 31.793 12.973 -0.965 1.00 0.00 C ATOM 604 C ASN A 74 30.705 13.892 -0.407 1.00 0.00 C ATOM 605 O ASN A 74 30.060 14.620 -1.135 1.00 0.00 O ATOM 606 CB ASN A 74 31.551 12.746 -2.459 1.00 0.00 C ATOM 607 CG ASN A 74 32.625 11.809 -3.012 1.00 0.00 C ATOM 608 OD1 ASN A 74 33.781 11.908 -2.650 1.00 0.00 O ATOM 609 ND2 ASN A 74 32.292 10.895 -3.882 1.00 0.00 N ATOM 0 H ASN A 74 32.622 11.397 0.211 1.00 0.00 H new ATOM 0 HA ASN A 74 32.769 13.436 -0.821 1.00 0.00 H new ATOM 0 HB2 ASN A 74 30.562 12.316 -2.617 1.00 0.00 H new ATOM 0 HB3 ASN A 74 31.574 13.697 -2.991 1.00 0.00 H new ATOM 0 HD21 ASN A 74 33.001 10.265 -4.257 1.00 0.00 H new ATOM 0 HD22 ASN A 74 31.322 10.810 -4.187 1.00 0.00 H new ATOM 616 N CYS A 75 30.495 13.866 0.881 1.00 0.00 N ATOM 617 CA CYS A 75 29.448 14.738 1.483 1.00 0.00 C ATOM 618 C CYS A 75 30.004 15.410 2.741 1.00 0.00 C ATOM 619 O CYS A 75 30.720 14.806 3.513 1.00 0.00 O ATOM 620 CB CYS A 75 28.230 13.890 1.854 1.00 0.00 C ATOM 621 SG CYS A 75 28.717 12.631 3.060 1.00 0.00 S ATOM 0 H CYS A 75 31.003 13.279 1.542 1.00 0.00 H new ATOM 0 HA CYS A 75 29.154 15.502 0.763 1.00 0.00 H new ATOM 0 HB2 CYS A 75 27.446 14.523 2.269 1.00 0.00 H new ATOM 0 HB3 CYS A 75 27.819 13.416 0.963 1.00 0.00 H new ATOM 0 HG CYS A 75 28.479 13.066 4.262 1.00 0.00 H new ATOM 627 N ALA A 76 29.678 16.656 2.951 1.00 0.00 N ATOM 628 CA ALA A 76 30.187 17.366 4.159 1.00 0.00 C ATOM 629 C ALA A 76 29.038 17.574 5.148 1.00 0.00 C ATOM 630 O ALA A 76 27.888 17.665 4.768 1.00 0.00 O ATOM 631 CB ALA A 76 30.761 18.724 3.750 1.00 0.00 C ATOM 0 H ALA A 76 29.082 17.213 2.339 1.00 0.00 H new ATOM 0 HA ALA A 76 30.969 16.769 4.629 1.00 0.00 H new ATOM 0 HB1 ALA A 76 31.133 19.243 4.634 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.579 18.576 3.045 1.00 0.00 H new ATOM 0 HB3 ALA A 76 29.981 19.322 3.280 1.00 0.00 H new ATOM 637 N PHE A 77 29.340 17.650 6.415 1.00 0.00 N ATOM 638 CA PHE A 77 28.265 17.851 7.427 1.00 0.00 C ATOM 639 C PHE A 77 28.488 19.179 8.153 1.00 0.00 C ATOM 640 O PHE A 77 29.569 19.463 8.631 1.00 0.00 O ATOM 641 CB PHE A 77 28.295 16.704 8.438 1.00 0.00 C ATOM 642 CG PHE A 77 27.907 15.417 7.750 1.00 0.00 C ATOM 643 CD1 PHE A 77 26.557 15.064 7.637 1.00 0.00 C ATOM 644 CD2 PHE A 77 28.896 14.578 7.225 1.00 0.00 C ATOM 645 CE1 PHE A 77 26.196 13.871 6.998 1.00 0.00 C ATOM 646 CE2 PHE A 77 28.535 13.385 6.587 1.00 0.00 C ATOM 647 CZ PHE A 77 27.186 13.032 6.473 1.00 0.00 C ATOM 0 H PHE A 77 30.285 17.582 6.793 1.00 0.00 H new ATOM 0 HA PHE A 77 27.296 17.869 6.928 1.00 0.00 H new ATOM 0 HB2 PHE A 77 29.291 16.612 8.870 1.00 0.00 H new ATOM 0 HB3 PHE A 77 27.609 16.911 9.259 1.00 0.00 H new ATOM 0 HD1 PHE A 77 25.794 15.712 8.043 1.00 0.00 H new ATOM 0 HD2 PHE A 77 29.937 14.850 7.312 1.00 0.00 H new ATOM 0 HE1 PHE A 77 25.155 13.599 6.910 1.00 0.00 H new ATOM 0 HE2 PHE A 77 29.298 12.737 6.183 1.00 0.00 H new ATOM 0 HZ PHE A 77 26.908 12.112 5.980 1.00 0.00 H new ATOM 657 N VAL A 78 27.473 19.995 8.241 1.00 0.00 N ATOM 658 CA VAL A 78 27.627 21.304 8.937 1.00 0.00 C ATOM 659 C VAL A 78 26.572 21.421 10.040 1.00 0.00 C ATOM 660 O VAL A 78 25.404 21.164 9.825 1.00 0.00 O ATOM 661 CB VAL A 78 27.441 22.440 7.932 1.00 0.00 C ATOM 662 CG1 VAL A 78 27.668 23.782 8.631 1.00 0.00 C ATOM 663 CG2 VAL A 78 28.447 22.283 6.790 1.00 0.00 C ATOM 0 H VAL A 78 26.544 19.812 7.861 1.00 0.00 H new ATOM 0 HA VAL A 78 28.622 21.368 9.377 1.00 0.00 H new ATOM 0 HB VAL A 78 26.428 22.406 7.530 1.00 0.00 H new ATOM 0 HG11 VAL A 78 27.535 24.593 7.914 1.00 0.00 H new ATOM 0 HG12 VAL A 78 26.950 23.895 9.444 1.00 0.00 H new ATOM 0 HG13 VAL A 78 28.680 23.816 9.034 1.00 0.00 H new ATOM 0 HG21 VAL A 78 28.314 23.094 6.074 1.00 0.00 H new ATOM 0 HG22 VAL A 78 29.460 22.316 7.191 1.00 0.00 H new ATOM 0 HG23 VAL A 78 28.285 21.328 6.291 1.00 0.00 H new ATOM 673 N THR A 79 26.975 21.808 11.220 1.00 0.00 N ATOM 674 CA THR A 79 25.993 21.941 12.333 1.00 0.00 C ATOM 675 C THR A 79 25.633 23.416 12.523 1.00 0.00 C ATOM 676 O THR A 79 26.492 24.276 12.546 1.00 0.00 O ATOM 677 CB THR A 79 26.608 21.392 13.623 1.00 0.00 C ATOM 678 OG1 THR A 79 27.141 20.098 13.378 1.00 0.00 O ATOM 679 CG2 THR A 79 25.533 21.305 14.707 1.00 0.00 C ATOM 0 H THR A 79 27.939 22.037 11.461 1.00 0.00 H new ATOM 0 HA THR A 79 25.092 21.377 12.093 1.00 0.00 H new ATOM 0 HB THR A 79 27.404 22.057 13.957 1.00 0.00 H new ATOM 0 HG1 THR A 79 26.951 19.516 14.143 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.972 20.914 15.625 1.00 0.00 H new ATOM 0 HG22 THR A 79 25.124 22.298 14.895 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.735 20.641 14.375 1.00 0.00 H new ATOM 687 N TYR A 80 24.370 23.716 12.659 1.00 0.00 N ATOM 688 CA TYR A 80 23.955 25.136 12.847 1.00 0.00 C ATOM 689 C TYR A 80 23.452 25.337 14.277 1.00 0.00 C ATOM 690 O TYR A 80 22.836 24.465 14.857 1.00 0.00 O ATOM 691 CB TYR A 80 22.832 25.471 11.864 1.00 0.00 C ATOM 692 CG TYR A 80 23.401 26.208 10.674 1.00 0.00 C ATOM 693 CD1 TYR A 80 24.353 27.218 10.862 1.00 0.00 C ATOM 694 CD2 TYR A 80 22.975 25.880 9.382 1.00 0.00 C ATOM 695 CE1 TYR A 80 24.876 27.901 9.757 1.00 0.00 C ATOM 696 CE2 TYR A 80 23.498 26.563 8.277 1.00 0.00 C ATOM 697 CZ TYR A 80 24.449 27.573 8.466 1.00 0.00 C ATOM 698 OH TYR A 80 24.964 28.247 7.377 1.00 0.00 O ATOM 0 H TYR A 80 23.607 23.039 12.648 1.00 0.00 H new ATOM 0 HA TYR A 80 24.808 25.790 12.666 1.00 0.00 H new ATOM 0 HB2 TYR A 80 22.338 24.557 11.536 1.00 0.00 H new ATOM 0 HB3 TYR A 80 22.076 26.083 12.356 1.00 0.00 H new ATOM 0 HD1 TYR A 80 24.684 27.470 11.859 1.00 0.00 H new ATOM 0 HD2 TYR A 80 22.243 25.100 9.237 1.00 0.00 H new ATOM 0 HE1 TYR A 80 25.609 28.681 9.902 1.00 0.00 H new ATOM 0 HE2 TYR A 80 23.168 26.311 7.280 1.00 0.00 H new ATOM 0 HH TYR A 80 25.523 28.990 7.687 1.00 0.00 H new ATOM 708 N GLU A 81 23.707 26.481 14.852 1.00 0.00 N ATOM 709 CA GLU A 81 23.239 26.736 16.243 1.00 0.00 C ATOM 710 C GLU A 81 21.710 26.796 16.265 1.00 0.00 C ATOM 711 O GLU A 81 21.079 26.441 17.240 1.00 0.00 O ATOM 712 CB GLU A 81 23.808 28.067 16.739 1.00 0.00 C ATOM 713 CG GLU A 81 23.489 28.237 18.225 1.00 0.00 C ATOM 714 CD GLU A 81 23.986 29.603 18.702 1.00 0.00 C ATOM 715 OE1 GLU A 81 24.546 30.323 17.891 1.00 0.00 O ATOM 716 OE2 GLU A 81 23.798 29.907 19.868 1.00 0.00 O ATOM 0 H GLU A 81 24.219 27.249 14.418 1.00 0.00 H new ATOM 0 HA GLU A 81 23.581 25.930 16.893 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.886 28.094 16.582 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.382 28.892 16.168 1.00 0.00 H new ATOM 0 HG2 GLU A 81 22.415 28.152 18.389 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.964 27.444 18.803 1.00 0.00 H new ATOM 723 N LYS A 82 21.111 27.244 15.195 1.00 0.00 N ATOM 724 CA LYS A 82 19.623 27.327 15.154 1.00 0.00 C ATOM 725 C LYS A 82 19.108 26.624 13.896 1.00 0.00 C ATOM 726 O LYS A 82 19.791 26.546 12.894 1.00 0.00 O ATOM 727 CB LYS A 82 19.195 28.796 15.131 1.00 0.00 C ATOM 728 CG LYS A 82 19.659 29.482 16.417 1.00 0.00 C ATOM 729 CD LYS A 82 19.123 30.914 16.453 1.00 0.00 C ATOM 730 CE LYS A 82 19.762 31.668 17.622 1.00 0.00 C ATOM 731 NZ LYS A 82 18.964 31.436 18.859 1.00 0.00 N ATOM 0 H LYS A 82 21.587 27.556 14.348 1.00 0.00 H new ATOM 0 HA LYS A 82 19.207 26.842 16.037 1.00 0.00 H new ATOM 0 HB2 LYS A 82 19.624 29.297 14.263 1.00 0.00 H new ATOM 0 HB3 LYS A 82 18.111 28.869 15.038 1.00 0.00 H new ATOM 0 HG2 LYS A 82 19.304 28.928 17.286 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.748 29.489 16.466 1.00 0.00 H new ATOM 0 HD2 LYS A 82 19.346 31.421 15.514 1.00 0.00 H new ATOM 0 HD3 LYS A 82 18.038 30.905 16.561 1.00 0.00 H new ATOM 0 HE2 LYS A 82 20.788 31.330 17.769 1.00 0.00 H new ATOM 0 HE3 LYS A 82 19.807 32.734 17.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 19.398 31.948 19.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 17.993 31.779 18.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 18.943 30.418 19.073 1.00 0.00 H new ATOM 745 N MET A 83 17.909 26.111 13.939 1.00 0.00 N ATOM 746 CA MET A 83 17.352 25.414 12.745 1.00 0.00 C ATOM 747 C MET A 83 17.066 26.437 11.644 1.00 0.00 C ATOM 748 O MET A 83 16.988 26.103 10.479 1.00 0.00 O ATOM 749 CB MET A 83 16.053 24.703 13.129 1.00 0.00 C ATOM 750 CG MET A 83 16.357 23.600 14.145 1.00 0.00 C ATOM 751 SD MET A 83 14.902 22.541 14.338 1.00 0.00 S ATOM 752 CE MET A 83 15.340 21.843 15.949 1.00 0.00 C ATOM 0 H MET A 83 17.291 26.144 14.750 1.00 0.00 H new ATOM 0 HA MET A 83 18.074 24.682 12.383 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.346 25.417 13.552 1.00 0.00 H new ATOM 0 HB3 MET A 83 15.583 24.277 12.243 1.00 0.00 H new ATOM 0 HG2 MET A 83 17.209 23.008 13.811 1.00 0.00 H new ATOM 0 HG3 MET A 83 16.630 24.039 15.104 1.00 0.00 H new ATOM 0 HE1 MET A 83 15.219 20.760 15.921 1.00 0.00 H new ATOM 0 HE2 MET A 83 16.377 22.087 16.181 1.00 0.00 H new ATOM 0 HE3 MET A 83 14.688 22.261 16.716 1.00 0.00 H new ATOM 762 N GLU A 84 16.907 27.681 12.004 1.00 0.00 N ATOM 763 CA GLU A 84 16.625 28.724 10.977 1.00 0.00 C ATOM 764 C GLU A 84 17.881 28.973 10.140 1.00 0.00 C ATOM 765 O GLU A 84 17.806 29.266 8.963 1.00 0.00 O ATOM 766 CB GLU A 84 16.207 30.021 11.670 1.00 0.00 C ATOM 767 CG GLU A 84 14.899 29.796 12.430 1.00 0.00 C ATOM 768 CD GLU A 84 14.494 31.090 13.142 1.00 0.00 C ATOM 769 OE1 GLU A 84 15.306 32.000 13.179 1.00 0.00 O ATOM 770 OE2 GLU A 84 13.382 31.146 13.638 1.00 0.00 O ATOM 0 H GLU A 84 16.960 28.020 12.964 1.00 0.00 H new ATOM 0 HA GLU A 84 15.819 28.383 10.326 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.988 30.346 12.357 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.080 30.814 10.934 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.114 29.487 11.740 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.021 28.992 13.156 1.00 0.00 H new ATOM 777 N SER A 85 19.036 28.863 10.736 1.00 0.00 N ATOM 778 CA SER A 85 20.294 29.096 9.973 1.00 0.00 C ATOM 779 C SER A 85 20.466 27.995 8.924 1.00 0.00 C ATOM 780 O SER A 85 21.029 28.211 7.870 1.00 0.00 O ATOM 781 CB SER A 85 21.485 29.078 10.933 1.00 0.00 C ATOM 782 OG SER A 85 21.255 30.000 11.989 1.00 0.00 O ATOM 0 H SER A 85 19.163 28.622 11.719 1.00 0.00 H new ATOM 0 HA SER A 85 20.243 30.065 9.477 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.626 28.075 11.336 1.00 0.00 H new ATOM 0 HB3 SER A 85 22.399 29.339 10.400 1.00 0.00 H new ATOM 0 HG SER A 85 22.017 29.988 12.606 1.00 0.00 H new ATOM 788 N ALA A 86 19.986 26.814 9.206 1.00 0.00 N ATOM 789 CA ALA A 86 20.124 25.701 8.224 1.00 0.00 C ATOM 790 C ALA A 86 19.048 25.837 7.144 1.00 0.00 C ATOM 791 O ALA A 86 19.262 25.503 5.995 1.00 0.00 O ATOM 792 CB ALA A 86 19.955 24.362 8.945 1.00 0.00 C ATOM 0 H ALA A 86 19.505 26.572 10.072 1.00 0.00 H new ATOM 0 HA ALA A 86 21.110 25.744 7.762 1.00 0.00 H new ATOM 0 HB1 ALA A 86 20.056 23.547 8.228 1.00 0.00 H new ATOM 0 HB2 ALA A 86 20.720 24.264 9.715 1.00 0.00 H new ATOM 0 HB3 ALA A 86 18.968 24.319 9.406 1.00 0.00 H new ATOM 798 N ASP A 87 17.891 26.323 7.504 1.00 0.00 N ATOM 799 CA ASP A 87 16.802 26.479 6.499 1.00 0.00 C ATOM 800 C ASP A 87 17.211 27.523 5.457 1.00 0.00 C ATOM 801 O ASP A 87 16.970 27.363 4.277 1.00 0.00 O ATOM 802 CB ASP A 87 15.522 26.934 7.202 1.00 0.00 C ATOM 803 CG ASP A 87 14.363 26.931 6.203 1.00 0.00 C ATOM 804 OD1 ASP A 87 14.568 26.476 5.089 1.00 0.00 O ATOM 805 OD2 ASP A 87 13.290 27.383 6.569 1.00 0.00 O ATOM 0 H ASP A 87 17.653 26.619 8.451 1.00 0.00 H new ATOM 0 HA ASP A 87 16.626 25.524 6.004 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.298 26.271 8.037 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.657 27.933 7.616 1.00 0.00 H new ATOM 810 N GLN A 88 17.827 28.591 5.884 1.00 0.00 N ATOM 811 CA GLN A 88 18.248 29.643 4.917 1.00 0.00 C ATOM 812 C GLN A 88 19.459 29.153 4.121 1.00 0.00 C ATOM 813 O GLN A 88 19.574 29.396 2.936 1.00 0.00 O ATOM 814 CB GLN A 88 18.621 30.916 5.679 1.00 0.00 C ATOM 815 CG GLN A 88 18.870 32.051 4.685 1.00 0.00 C ATOM 816 CD GLN A 88 19.280 33.314 5.445 1.00 0.00 C ATOM 817 OE1 GLN A 88 19.236 33.348 6.659 1.00 0.00 O ATOM 818 NE2 GLN A 88 19.682 34.361 4.778 1.00 0.00 N ATOM 0 H GLN A 88 18.057 28.780 6.860 1.00 0.00 H new ATOM 0 HA GLN A 88 17.426 29.855 4.233 1.00 0.00 H new ATOM 0 HB2 GLN A 88 17.820 31.189 6.366 1.00 0.00 H new ATOM 0 HB3 GLN A 88 19.513 30.744 6.282 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.652 31.767 3.981 1.00 0.00 H new ATOM 0 HG3 GLN A 88 17.970 32.241 4.101 1.00 0.00 H new ATOM 0 HE21 GLN A 88 19.719 34.333 3.759 1.00 0.00 H new ATOM 0 HE22 GLN A 88 19.959 35.207 5.276 1.00 0.00 H new ATOM 827 N ALA A 89 20.362 28.462 4.761 1.00 0.00 N ATOM 828 CA ALA A 89 21.564 27.957 4.039 1.00 0.00 C ATOM 829 C ALA A 89 21.179 26.741 3.194 1.00 0.00 C ATOM 830 O ALA A 89 21.618 26.590 2.071 1.00 0.00 O ATOM 831 CB ALA A 89 22.637 27.556 5.052 1.00 0.00 C ATOM 0 H ALA A 89 20.320 28.225 5.752 1.00 0.00 H new ATOM 0 HA ALA A 89 21.953 28.741 3.390 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.516 27.187 4.524 1.00 0.00 H new ATOM 0 HB2 ALA A 89 22.912 28.423 5.653 1.00 0.00 H new ATOM 0 HB3 ALA A 89 22.249 26.772 5.702 1.00 0.00 H new ATOM 837 N VAL A 90 20.365 25.871 3.726 1.00 0.00 N ATOM 838 CA VAL A 90 19.956 24.663 2.954 1.00 0.00 C ATOM 839 C VAL A 90 19.119 25.085 1.745 1.00 0.00 C ATOM 840 O VAL A 90 19.263 24.553 0.662 1.00 0.00 O ATOM 841 CB VAL A 90 19.126 23.742 3.851 1.00 0.00 C ATOM 842 CG1 VAL A 90 18.493 22.639 3.000 1.00 0.00 C ATOM 843 CG2 VAL A 90 20.030 23.113 4.912 1.00 0.00 C ATOM 0 H VAL A 90 19.965 25.944 4.662 1.00 0.00 H new ATOM 0 HA VAL A 90 20.846 24.134 2.612 1.00 0.00 H new ATOM 0 HB VAL A 90 18.342 24.320 4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 90 17.901 21.982 3.637 1.00 0.00 H new ATOM 0 HG12 VAL A 90 17.849 23.087 2.244 1.00 0.00 H new ATOM 0 HG13 VAL A 90 19.277 22.061 2.512 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.439 22.457 5.551 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.815 22.534 4.425 1.00 0.00 H new ATOM 0 HG23 VAL A 90 20.482 23.899 5.518 1.00 0.00 H new ATOM 853 N ALA A 91 18.241 26.036 1.919 1.00 0.00 N ATOM 854 CA ALA A 91 17.393 26.486 0.779 1.00 0.00 C ATOM 855 C ALA A 91 18.226 27.341 -0.179 1.00 0.00 C ATOM 856 O ALA A 91 18.076 27.268 -1.382 1.00 0.00 O ATOM 857 CB ALA A 91 16.221 27.312 1.310 1.00 0.00 C ATOM 0 H ALA A 91 18.075 26.520 2.801 1.00 0.00 H new ATOM 0 HA ALA A 91 17.014 25.614 0.247 1.00 0.00 H new ATOM 0 HB1 ALA A 91 15.601 27.641 0.476 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.624 26.702 1.988 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.602 28.182 1.845 1.00 0.00 H new ATOM 863 N GLU A 92 19.100 28.157 0.345 1.00 0.00 N ATOM 864 CA GLU A 92 19.936 29.019 -0.539 1.00 0.00 C ATOM 865 C GLU A 92 21.083 28.195 -1.129 1.00 0.00 C ATOM 866 O GLU A 92 21.308 28.196 -2.323 1.00 0.00 O ATOM 867 CB GLU A 92 20.508 30.180 0.277 1.00 0.00 C ATOM 868 CG GLU A 92 20.687 31.400 -0.629 1.00 0.00 C ATOM 869 CD GLU A 92 21.947 31.223 -1.479 1.00 0.00 C ATOM 870 OE1 GLU A 92 22.725 30.335 -1.172 1.00 0.00 O ATOM 871 OE2 GLU A 92 22.113 31.980 -2.422 1.00 0.00 O ATOM 0 H GLU A 92 19.271 28.264 1.345 1.00 0.00 H new ATOM 0 HA GLU A 92 19.321 29.410 -1.349 1.00 0.00 H new ATOM 0 HB2 GLU A 92 19.839 30.422 1.103 1.00 0.00 H new ATOM 0 HB3 GLU A 92 21.465 29.895 0.714 1.00 0.00 H new ATOM 0 HG2 GLU A 92 19.815 31.520 -1.272 1.00 0.00 H new ATOM 0 HG3 GLU A 92 20.766 32.305 -0.027 1.00 0.00 H new ATOM 878 N LEU A 93 21.813 27.497 -0.303 1.00 0.00 N ATOM 879 CA LEU A 93 22.947 26.678 -0.822 1.00 0.00 C ATOM 880 C LEU A 93 22.410 25.598 -1.764 1.00 0.00 C ATOM 881 O LEU A 93 23.037 25.249 -2.743 1.00 0.00 O ATOM 882 CB LEU A 93 23.677 26.019 0.348 1.00 0.00 C ATOM 883 CG LEU A 93 24.322 27.098 1.221 1.00 0.00 C ATOM 884 CD1 LEU A 93 24.691 26.502 2.580 1.00 0.00 C ATOM 885 CD2 LEU A 93 25.585 27.622 0.534 1.00 0.00 C ATOM 0 H LEU A 93 21.675 27.458 0.707 1.00 0.00 H new ATOM 0 HA LEU A 93 23.639 27.321 -1.366 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.978 25.427 0.940 1.00 0.00 H new ATOM 0 HB3 LEU A 93 24.439 25.334 -0.024 1.00 0.00 H new ATOM 0 HG LEU A 93 23.618 27.918 1.363 1.00 0.00 H new ATOM 0 HD11 LEU A 93 25.150 27.270 3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 93 23.792 26.129 3.070 1.00 0.00 H new ATOM 0 HD13 LEU A 93 25.394 25.681 2.439 1.00 0.00 H new ATOM 0 HD21 LEU A 93 26.045 28.391 1.155 1.00 0.00 H new ATOM 0 HD22 LEU A 93 26.289 26.802 0.391 1.00 0.00 H new ATOM 0 HD23 LEU A 93 25.322 28.047 -0.435 1.00 0.00 H new ATOM 897 N ASN A 94 21.255 25.064 -1.474 1.00 0.00 N ATOM 898 CA ASN A 94 20.683 24.006 -2.354 1.00 0.00 C ATOM 899 C ASN A 94 20.150 24.642 -3.639 1.00 0.00 C ATOM 900 O ASN A 94 19.394 25.593 -3.605 1.00 0.00 O ATOM 901 CB ASN A 94 19.541 23.299 -1.623 1.00 0.00 C ATOM 902 CG ASN A 94 19.130 22.050 -2.406 1.00 0.00 C ATOM 903 OD1 ASN A 94 19.615 21.815 -3.495 1.00 0.00 O ATOM 904 ND2 ASN A 94 18.251 21.233 -1.893 1.00 0.00 N ATOM 0 H ASN A 94 20.684 25.314 -0.667 1.00 0.00 H new ATOM 0 HA ASN A 94 21.459 23.282 -2.603 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.855 23.023 -0.616 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.690 23.972 -1.518 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.971 20.397 -2.406 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.844 21.430 -0.979 1.00 0.00 H new ATOM 911 N GLY A 95 20.535 24.124 -4.772 1.00 0.00 N ATOM 912 CA GLY A 95 20.049 24.698 -6.058 1.00 0.00 C ATOM 913 C GLY A 95 21.031 25.765 -6.546 1.00 0.00 C ATOM 914 O GLY A 95 20.674 26.657 -7.290 1.00 0.00 O ATOM 0 H GLY A 95 21.166 23.327 -4.863 1.00 0.00 H new ATOM 0 HA2 GLY A 95 19.950 23.911 -6.805 1.00 0.00 H new ATOM 0 HA3 GLY A 95 19.059 25.134 -5.922 1.00 0.00 H new ATOM 918 N THR A 96 22.267 25.682 -6.134 1.00 0.00 N ATOM 919 CA THR A 96 23.268 26.692 -6.576 1.00 0.00 C ATOM 920 C THR A 96 24.475 25.982 -7.191 1.00 0.00 C ATOM 921 O THR A 96 24.765 24.844 -6.876 1.00 0.00 O ATOM 922 CB THR A 96 23.722 27.520 -5.372 1.00 0.00 C ATOM 923 OG1 THR A 96 24.477 26.699 -4.492 1.00 0.00 O ATOM 924 CG2 THR A 96 22.499 28.069 -4.636 1.00 0.00 C ATOM 0 H THR A 96 22.626 24.959 -5.511 1.00 0.00 H new ATOM 0 HA THR A 96 22.816 27.348 -7.320 1.00 0.00 H new ATOM 0 HB THR A 96 24.339 28.350 -5.715 1.00 0.00 H new ATOM 0 HG1 THR A 96 23.868 26.178 -3.928 1.00 0.00 H new ATOM 0 HG21 THR A 96 22.824 28.658 -3.779 1.00 0.00 H new ATOM 0 HG22 THR A 96 21.921 28.699 -5.311 1.00 0.00 H new ATOM 0 HG23 THR A 96 21.879 27.241 -4.293 1.00 0.00 H new ATOM 932 N GLN A 97 25.181 26.642 -8.068 1.00 0.00 N ATOM 933 CA GLN A 97 26.368 26.004 -8.703 1.00 0.00 C ATOM 934 C GLN A 97 27.627 26.795 -8.342 1.00 0.00 C ATOM 935 O GLN A 97 27.627 28.010 -8.328 1.00 0.00 O ATOM 936 CB GLN A 97 26.190 25.995 -10.223 1.00 0.00 C ATOM 937 CG GLN A 97 27.372 25.273 -10.871 1.00 0.00 C ATOM 938 CD GLN A 97 27.202 25.279 -12.392 1.00 0.00 C ATOM 939 OE1 GLN A 97 26.177 25.693 -12.898 1.00 0.00 O ATOM 940 NE2 GLN A 97 28.170 24.837 -13.147 1.00 0.00 N ATOM 0 H GLN A 97 24.987 27.596 -8.372 1.00 0.00 H new ATOM 0 HA GLN A 97 26.466 24.980 -8.342 1.00 0.00 H new ATOM 0 HB2 GLN A 97 25.257 25.497 -10.488 1.00 0.00 H new ATOM 0 HB3 GLN A 97 26.124 27.016 -10.598 1.00 0.00 H new ATOM 0 HG2 GLN A 97 28.306 25.763 -10.597 1.00 0.00 H new ATOM 0 HG3 GLN A 97 27.431 24.248 -10.505 1.00 0.00 H new ATOM 0 HE21 GLN A 97 29.030 24.490 -12.722 1.00 0.00 H new ATOM 0 HE22 GLN A 97 28.067 24.839 -14.162 1.00 0.00 H new ATOM 949 N VAL A 98 28.703 26.115 -8.050 1.00 0.00 N ATOM 950 CA VAL A 98 29.961 26.828 -7.690 1.00 0.00 C ATOM 951 C VAL A 98 30.669 27.283 -8.969 1.00 0.00 C ATOM 952 O VAL A 98 30.044 27.522 -9.983 1.00 0.00 O ATOM 953 CB VAL A 98 30.880 25.886 -6.905 1.00 0.00 C ATOM 954 CG1 VAL A 98 31.740 26.703 -5.939 1.00 0.00 C ATOM 955 CG2 VAL A 98 30.035 24.886 -6.111 1.00 0.00 C ATOM 0 H VAL A 98 28.765 25.097 -8.045 1.00 0.00 H new ATOM 0 HA VAL A 98 29.723 27.696 -7.075 1.00 0.00 H new ATOM 0 HB VAL A 98 31.523 25.346 -7.600 1.00 0.00 H new ATOM 0 HG11 VAL A 98 32.394 26.034 -5.380 1.00 0.00 H new ATOM 0 HG12 VAL A 98 32.344 27.414 -6.502 1.00 0.00 H new ATOM 0 HG13 VAL A 98 31.095 27.243 -5.246 1.00 0.00 H new ATOM 0 HG21 VAL A 98 30.691 24.217 -5.554 1.00 0.00 H new ATOM 0 HG22 VAL A 98 29.391 25.425 -5.416 1.00 0.00 H new ATOM 0 HG23 VAL A 98 29.421 24.303 -6.797 1.00 0.00 H new ATOM 965 N GLU A 99 31.968 27.404 -8.931 1.00 0.00 N ATOM 966 CA GLU A 99 32.711 27.843 -10.146 1.00 0.00 C ATOM 967 C GLU A 99 32.481 26.837 -11.276 1.00 0.00 C ATOM 968 O GLU A 99 32.353 27.201 -12.428 1.00 0.00 O ATOM 969 CB GLU A 99 34.205 27.922 -9.829 1.00 0.00 C ATOM 970 CG GLU A 99 34.448 29.012 -8.783 1.00 0.00 C ATOM 971 CD GLU A 99 35.951 29.156 -8.538 1.00 0.00 C ATOM 972 OE1 GLU A 99 36.696 28.331 -9.041 1.00 0.00 O ATOM 973 OE2 GLU A 99 36.331 30.090 -7.850 1.00 0.00 O ATOM 0 H GLU A 99 32.546 27.218 -8.112 1.00 0.00 H new ATOM 0 HA GLU A 99 32.353 28.825 -10.456 1.00 0.00 H new ATOM 0 HB2 GLU A 99 34.560 26.961 -9.457 1.00 0.00 H new ATOM 0 HB3 GLU A 99 34.769 28.141 -10.736 1.00 0.00 H new ATOM 0 HG2 GLU A 99 34.032 29.959 -9.126 1.00 0.00 H new ATOM 0 HG3 GLU A 99 33.939 28.758 -7.853 1.00 0.00 H new ATOM 980 N SER A 100 32.427 25.573 -10.955 1.00 0.00 N ATOM 981 CA SER A 100 32.205 24.546 -12.012 1.00 0.00 C ATOM 982 C SER A 100 31.648 23.270 -11.375 1.00 0.00 C ATOM 983 O SER A 100 31.765 22.191 -11.921 1.00 0.00 O ATOM 984 CB SER A 100 33.532 24.231 -12.706 1.00 0.00 C ATOM 985 OG SER A 100 33.596 24.928 -13.942 1.00 0.00 O ATOM 0 H SER A 100 32.527 25.208 -10.008 1.00 0.00 H new ATOM 0 HA SER A 100 31.494 24.928 -12.744 1.00 0.00 H new ATOM 0 HB2 SER A 100 34.367 24.522 -12.068 1.00 0.00 H new ATOM 0 HB3 SER A 100 33.620 23.158 -12.876 1.00 0.00 H new ATOM 0 HG SER A 100 33.214 25.824 -13.833 1.00 0.00 H new ATOM 991 N VAL A 101 31.042 23.384 -10.225 1.00 0.00 N ATOM 992 CA VAL A 101 30.479 22.178 -9.556 1.00 0.00 C ATOM 993 C VAL A 101 29.122 22.523 -8.939 1.00 0.00 C ATOM 994 O VAL A 101 28.850 23.662 -8.614 1.00 0.00 O ATOM 995 CB VAL A 101 31.435 21.710 -8.457 1.00 0.00 C ATOM 996 CG1 VAL A 101 30.892 20.430 -7.819 1.00 0.00 C ATOM 997 CG2 VAL A 101 32.812 21.433 -9.063 1.00 0.00 C ATOM 0 H VAL A 101 30.913 24.261 -9.720 1.00 0.00 H new ATOM 0 HA VAL A 101 30.352 21.382 -10.290 1.00 0.00 H new ATOM 0 HB VAL A 101 31.522 22.486 -7.697 1.00 0.00 H new ATOM 0 HG11 VAL A 101 31.573 20.096 -7.036 1.00 0.00 H new ATOM 0 HG12 VAL A 101 29.911 20.627 -7.387 1.00 0.00 H new ATOM 0 HG13 VAL A 101 30.805 19.653 -8.579 1.00 0.00 H new ATOM 0 HG21 VAL A 101 33.494 21.100 -8.280 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.725 20.657 -9.824 1.00 0.00 H new ATOM 0 HG23 VAL A 101 33.200 22.345 -9.517 1.00 0.00 H new ATOM 1007 N GLN A 102 28.269 21.550 -8.773 1.00 0.00 N ATOM 1008 CA GLN A 102 26.931 21.824 -8.176 1.00 0.00 C ATOM 1009 C GLN A 102 26.925 21.376 -6.713 1.00 0.00 C ATOM 1010 O GLN A 102 27.533 20.387 -6.355 1.00 0.00 O ATOM 1011 CB GLN A 102 25.860 21.055 -8.951 1.00 0.00 C ATOM 1012 CG GLN A 102 25.824 21.548 -10.399 1.00 0.00 C ATOM 1013 CD GLN A 102 24.798 20.733 -11.189 1.00 0.00 C ATOM 1014 OE1 GLN A 102 24.360 19.690 -10.744 1.00 0.00 O ATOM 1015 NE2 GLN A 102 24.394 21.166 -12.353 1.00 0.00 N ATOM 0 H GLN A 102 28.441 20.577 -9.025 1.00 0.00 H new ATOM 0 HA GLN A 102 26.720 22.892 -8.229 1.00 0.00 H new ATOM 0 HB2 GLN A 102 26.074 19.987 -8.925 1.00 0.00 H new ATOM 0 HB3 GLN A 102 24.886 21.197 -8.483 1.00 0.00 H new ATOM 0 HG2 GLN A 102 25.564 22.606 -10.428 1.00 0.00 H new ATOM 0 HG3 GLN A 102 26.810 21.449 -10.853 1.00 0.00 H new ATOM 0 HE21 GLN A 102 24.761 22.041 -12.727 1.00 0.00 H new ATOM 0 HE22 GLN A 102 23.711 20.629 -12.888 1.00 0.00 H new ATOM 1024 N LEU A 103 26.241 22.095 -5.866 1.00 0.00 N ATOM 1025 CA LEU A 103 26.197 21.709 -4.427 1.00 0.00 C ATOM 1026 C LEU A 103 24.795 21.211 -4.073 1.00 0.00 C ATOM 1027 O LEU A 103 23.802 21.768 -4.497 1.00 0.00 O ATOM 1028 CB LEU A 103 26.538 22.923 -3.562 1.00 0.00 C ATOM 1029 CG LEU A 103 27.959 23.394 -3.878 1.00 0.00 C ATOM 1030 CD1 LEU A 103 28.240 24.702 -3.135 1.00 0.00 C ATOM 1031 CD2 LEU A 103 28.961 22.327 -3.430 1.00 0.00 C ATOM 0 H LEU A 103 25.711 22.932 -6.108 1.00 0.00 H new ATOM 0 HA LEU A 103 26.922 20.916 -4.243 1.00 0.00 H new ATOM 0 HB2 LEU A 103 25.827 23.728 -3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 103 26.456 22.665 -2.506 1.00 0.00 H new ATOM 0 HG LEU A 103 28.058 23.558 -4.951 1.00 0.00 H new ATOM 0 HD11 LEU A 103 29.252 25.038 -3.360 1.00 0.00 H new ATOM 0 HD12 LEU A 103 27.526 25.462 -3.453 1.00 0.00 H new ATOM 0 HD13 LEU A 103 28.142 24.539 -2.062 1.00 0.00 H new ATOM 0 HD21 LEU A 103 29.974 22.662 -3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 103 28.863 22.163 -2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 103 28.761 21.395 -3.959 1.00 0.00 H new ATOM 1043 N LYS A 104 24.706 20.167 -3.296 1.00 0.00 N ATOM 1044 CA LYS A 104 23.369 19.634 -2.911 1.00 0.00 C ATOM 1045 C LYS A 104 23.228 19.677 -1.388 1.00 0.00 C ATOM 1046 O LYS A 104 24.151 19.366 -0.661 1.00 0.00 O ATOM 1047 CB LYS A 104 23.235 18.189 -3.396 1.00 0.00 C ATOM 1048 CG LYS A 104 23.361 18.150 -4.919 1.00 0.00 C ATOM 1049 CD LYS A 104 23.180 16.711 -5.409 1.00 0.00 C ATOM 1050 CE LYS A 104 23.413 16.654 -6.920 1.00 0.00 C ATOM 1051 NZ LYS A 104 23.810 15.271 -7.310 1.00 0.00 N ATOM 0 H LYS A 104 25.502 19.659 -2.911 1.00 0.00 H new ATOM 0 HA LYS A 104 22.588 20.242 -3.368 1.00 0.00 H new ATOM 0 HB2 LYS A 104 24.006 17.568 -2.940 1.00 0.00 H new ATOM 0 HB3 LYS A 104 22.273 17.779 -3.089 1.00 0.00 H new ATOM 0 HG2 LYS A 104 22.611 18.797 -5.373 1.00 0.00 H new ATOM 0 HG3 LYS A 104 24.336 18.529 -5.224 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.880 16.050 -4.897 1.00 0.00 H new ATOM 0 HD3 LYS A 104 22.176 16.358 -5.171 1.00 0.00 H new ATOM 0 HE2 LYS A 104 22.506 16.947 -7.450 1.00 0.00 H new ATOM 0 HE3 LYS A 104 24.191 17.361 -7.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 23.968 15.232 -8.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 24.686 15.008 -6.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 23.053 14.606 -7.051 1.00 0.00 H new ATOM 1065 N VAL A 105 22.083 20.062 -0.897 1.00 0.00 N ATOM 1066 CA VAL A 105 21.890 20.127 0.579 1.00 0.00 C ATOM 1067 C VAL A 105 20.710 19.242 0.983 1.00 0.00 C ATOM 1068 O VAL A 105 19.677 19.233 0.344 1.00 0.00 O ATOM 1069 CB VAL A 105 21.607 21.572 0.992 1.00 0.00 C ATOM 1070 CG1 VAL A 105 21.638 21.682 2.517 1.00 0.00 C ATOM 1071 CG2 VAL A 105 22.672 22.492 0.392 1.00 0.00 C ATOM 0 H VAL A 105 21.273 20.334 -1.454 1.00 0.00 H new ATOM 0 HA VAL A 105 22.793 19.775 1.077 1.00 0.00 H new ATOM 0 HB VAL A 105 20.624 21.868 0.627 1.00 0.00 H new ATOM 0 HG11 VAL A 105 21.436 22.712 2.812 1.00 0.00 H new ATOM 0 HG12 VAL A 105 20.879 21.027 2.945 1.00 0.00 H new ATOM 0 HG13 VAL A 105 22.621 21.386 2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.471 23.522 0.686 1.00 0.00 H new ATOM 0 HG22 VAL A 105 23.656 22.196 0.757 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.650 22.414 -0.695 1.00 0.00 H new ATOM 1081 N ASN A 106 20.855 18.499 2.047 1.00 0.00 N ATOM 1082 CA ASN A 106 19.743 17.616 2.499 1.00 0.00 C ATOM 1083 C ASN A 106 19.600 17.726 4.019 1.00 0.00 C ATOM 1084 O ASN A 106 20.258 18.524 4.656 1.00 0.00 O ATOM 1085 CB ASN A 106 20.051 16.168 2.116 1.00 0.00 C ATOM 1086 CG ASN A 106 20.050 16.032 0.591 1.00 0.00 C ATOM 1087 OD1 ASN A 106 19.514 16.872 -0.104 1.00 0.00 O ATOM 1088 ND2 ASN A 106 20.633 15.003 0.041 1.00 0.00 N ATOM 0 H ASN A 106 21.696 18.466 2.623 1.00 0.00 H new ATOM 0 HA ASN A 106 18.813 17.924 2.021 1.00 0.00 H new ATOM 0 HB2 ASN A 106 21.020 15.873 2.517 1.00 0.00 H new ATOM 0 HB3 ASN A 106 19.309 15.500 2.552 1.00 0.00 H new ATOM 0 HD21 ASN A 106 20.639 14.903 -0.974 1.00 0.00 H new ATOM 0 HD22 ASN A 106 21.083 14.299 0.626 1.00 0.00 H new ATOM 1095 N ILE A 107 18.746 16.933 4.605 1.00 0.00 N ATOM 1096 CA ILE A 107 18.566 16.999 6.084 1.00 0.00 C ATOM 1097 C ILE A 107 19.201 15.767 6.733 1.00 0.00 C ATOM 1098 O ILE A 107 19.023 14.654 6.281 1.00 0.00 O ATOM 1099 CB ILE A 107 17.074 17.039 6.416 1.00 0.00 C ATOM 1100 CG1 ILE A 107 16.398 18.142 5.600 1.00 0.00 C ATOM 1101 CG2 ILE A 107 16.892 17.324 7.908 1.00 0.00 C ATOM 1102 CD1 ILE A 107 17.197 19.440 5.736 1.00 0.00 C ATOM 0 H ILE A 107 18.166 16.244 4.126 1.00 0.00 H new ATOM 0 HA ILE A 107 19.047 17.899 6.467 1.00 0.00 H new ATOM 0 HB ILE A 107 16.622 16.078 6.171 1.00 0.00 H new ATOM 0 HG12 ILE A 107 16.337 17.848 4.552 1.00 0.00 H new ATOM 0 HG13 ILE A 107 15.376 18.293 5.949 1.00 0.00 H new ATOM 0 HG21 ILE A 107 15.829 17.353 8.146 1.00 0.00 H new ATOM 0 HG22 ILE A 107 17.373 16.538 8.490 1.00 0.00 H new ATOM 0 HG23 ILE A 107 17.345 18.285 8.153 1.00 0.00 H new ATOM 0 HD11 ILE A 107 16.716 20.226 5.155 1.00 0.00 H new ATOM 0 HD12 ILE A 107 17.235 19.736 6.784 1.00 0.00 H new ATOM 0 HD13 ILE A 107 18.210 19.284 5.366 1.00 0.00 H new ATOM 1114 N ALA A 108 19.940 15.959 7.791 1.00 0.00 N ATOM 1115 CA ALA A 108 20.586 14.800 8.470 1.00 0.00 C ATOM 1116 C ALA A 108 19.916 14.566 9.826 1.00 0.00 C ATOM 1117 O ALA A 108 19.396 15.478 10.437 1.00 0.00 O ATOM 1118 CB ALA A 108 22.073 15.094 8.680 1.00 0.00 C ATOM 0 H ALA A 108 20.125 16.868 8.215 1.00 0.00 H new ATOM 0 HA ALA A 108 20.476 13.909 7.851 1.00 0.00 H new ATOM 0 HB1 ALA A 108 22.545 14.246 9.177 1.00 0.00 H new ATOM 0 HB2 ALA A 108 22.551 15.261 7.715 1.00 0.00 H new ATOM 0 HB3 ALA A 108 22.184 15.985 9.299 1.00 0.00 H new ATOM 1124 N ARG A 109 19.922 13.350 10.299 1.00 0.00 N ATOM 1125 CA ARG A 109 19.284 13.059 11.615 1.00 0.00 C ATOM 1126 C ARG A 109 20.361 12.950 12.695 1.00 0.00 C ATOM 1127 O ARG A 109 20.102 12.528 13.804 1.00 0.00 O ATOM 1128 CB ARG A 109 18.513 11.740 11.527 1.00 0.00 C ATOM 1129 CG ARG A 109 17.407 11.865 10.478 1.00 0.00 C ATOM 1130 CD ARG A 109 16.566 10.587 10.469 1.00 0.00 C ATOM 1131 NE ARG A 109 17.446 9.415 10.205 1.00 0.00 N ATOM 1132 CZ ARG A 109 17.185 8.613 9.209 1.00 0.00 C ATOM 1133 NH1 ARG A 109 16.833 9.103 8.051 1.00 0.00 N ATOM 1134 NH2 ARG A 109 17.275 7.321 9.370 1.00 0.00 N ATOM 0 H ARG A 109 20.341 12.546 9.832 1.00 0.00 H new ATOM 0 HA ARG A 109 18.597 13.866 11.871 1.00 0.00 H new ATOM 0 HB2 ARG A 109 19.190 10.928 11.262 1.00 0.00 H new ATOM 0 HB3 ARG A 109 18.082 11.493 12.497 1.00 0.00 H new ATOM 0 HG2 ARG A 109 16.777 12.726 10.699 1.00 0.00 H new ATOM 0 HG3 ARG A 109 17.843 12.033 9.493 1.00 0.00 H new ATOM 0 HD2 ARG A 109 16.059 10.466 11.426 1.00 0.00 H new ATOM 0 HD3 ARG A 109 15.792 10.654 9.704 1.00 0.00 H new ATOM 0 HE ARG A 109 18.253 9.239 10.803 1.00 0.00 H new ATOM 0 HH11 ARG A 109 16.762 10.113 7.925 1.00 0.00 H new ATOM 0 HH12 ARG A 109 16.629 8.476 7.273 1.00 0.00 H new ATOM 0 HH21 ARG A 109 17.549 6.938 10.275 1.00 0.00 H new ATOM 0 HH22 ARG A 109 17.071 6.695 8.591 1.00 0.00 H new ATOM 1148 N LYS A 110 21.571 13.326 12.381 1.00 0.00 N ATOM 1149 CA LYS A 110 22.663 13.242 13.392 1.00 0.00 C ATOM 1150 C LYS A 110 22.605 14.467 14.307 1.00 0.00 C ATOM 1151 O LYS A 110 21.807 15.362 14.112 1.00 0.00 O ATOM 1152 CB LYS A 110 24.015 13.203 12.678 1.00 0.00 C ATOM 1153 CG LYS A 110 24.115 11.926 11.843 1.00 0.00 C ATOM 1154 CD LYS A 110 25.505 11.835 11.211 1.00 0.00 C ATOM 1155 CE LYS A 110 25.571 10.609 10.297 1.00 0.00 C ATOM 1156 NZ LYS A 110 26.597 10.832 9.240 1.00 0.00 N ATOM 0 H LYS A 110 21.850 13.687 11.469 1.00 0.00 H new ATOM 0 HA LYS A 110 22.540 12.337 13.987 1.00 0.00 H new ATOM 0 HB2 LYS A 110 24.125 14.078 12.038 1.00 0.00 H new ATOM 0 HB3 LYS A 110 24.824 13.237 13.407 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.932 11.054 12.470 1.00 0.00 H new ATOM 0 HG3 LYS A 110 23.350 11.926 11.066 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.716 12.739 10.640 1.00 0.00 H new ATOM 0 HD3 LYS A 110 26.266 11.764 11.988 1.00 0.00 H new ATOM 0 HE2 LYS A 110 25.820 9.721 10.879 1.00 0.00 H new ATOM 0 HE3 LYS A 110 24.597 10.429 9.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 26.654 9.992 8.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 26.332 11.659 8.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 27.522 11.000 9.684 1.00 0.00 H new ATOM 1170 N GLN A 111 23.446 14.515 15.304 1.00 0.00 N ATOM 1171 CA GLN A 111 23.438 15.684 16.228 1.00 0.00 C ATOM 1172 C GLN A 111 22.236 15.577 17.171 1.00 0.00 C ATOM 1173 O GLN A 111 21.499 16.523 17.363 1.00 0.00 O ATOM 1174 CB GLN A 111 23.338 16.974 15.409 1.00 0.00 C ATOM 1175 CG GLN A 111 23.955 18.136 16.192 1.00 0.00 C ATOM 1176 CD GLN A 111 25.371 17.764 16.636 1.00 0.00 C ATOM 1177 OE1 GLN A 111 25.740 17.978 17.773 1.00 0.00 O ATOM 1178 NE2 GLN A 111 26.186 17.210 15.780 1.00 0.00 N ATOM 0 H GLN A 111 24.137 13.796 15.518 1.00 0.00 H new ATOM 0 HA GLN A 111 24.357 15.697 16.814 1.00 0.00 H new ATOM 0 HB2 GLN A 111 23.853 16.851 14.456 1.00 0.00 H new ATOM 0 HB3 GLN A 111 22.294 17.191 15.181 1.00 0.00 H new ATOM 0 HG2 GLN A 111 23.982 19.032 15.572 1.00 0.00 H new ATOM 0 HG3 GLN A 111 23.340 18.369 17.061 1.00 0.00 H new ATOM 0 HE21 GLN A 111 25.877 17.030 14.825 1.00 0.00 H new ATOM 0 HE22 GLN A 111 27.132 16.957 16.066 1.00 0.00 H new ATOM 1187 N PRO A 112 22.043 14.391 17.768 1.00 0.00 N ATOM 1188 CA PRO A 112 20.932 14.139 18.696 1.00 0.00 C ATOM 1189 C PRO A 112 21.138 14.841 20.041 1.00 0.00 C ATOM 1190 O PRO A 112 20.202 15.061 20.785 1.00 0.00 O ATOM 1191 CB PRO A 112 20.969 12.625 18.893 1.00 0.00 C ATOM 1192 CG PRO A 112 22.384 12.239 18.614 1.00 0.00 C ATOM 1193 CD PRO A 112 22.894 13.205 17.581 1.00 0.00 C ATOM 0 HA PRO A 112 19.985 14.513 18.307 1.00 0.00 H new ATOM 0 HB2 PRO A 112 20.677 12.351 19.907 1.00 0.00 H new ATOM 0 HB3 PRO A 112 20.280 12.121 18.215 1.00 0.00 H new ATOM 0 HG2 PRO A 112 22.986 12.288 19.522 1.00 0.00 H new ATOM 0 HG3 PRO A 112 22.442 11.214 18.248 1.00 0.00 H new ATOM 0 HD2 PRO A 112 23.947 13.439 17.736 1.00 0.00 H new ATOM 0 HD3 PRO A 112 22.802 12.800 16.573 1.00 0.00 H new ATOM 1201 N MET A 113 22.355 15.190 20.361 1.00 0.00 N ATOM 1202 CA MET A 113 22.616 15.873 21.661 1.00 0.00 C ATOM 1203 C MET A 113 21.549 16.944 21.899 1.00 0.00 C ATOM 1204 O MET A 113 21.160 17.207 23.020 1.00 0.00 O ATOM 1205 CB MET A 113 23.999 16.524 21.630 1.00 0.00 C ATOM 1206 CG MET A 113 24.304 17.013 20.212 1.00 0.00 C ATOM 1207 SD MET A 113 24.903 18.719 20.279 1.00 0.00 S ATOM 1208 CE MET A 113 23.717 19.417 19.105 1.00 0.00 C ATOM 0 H MET A 113 23.178 15.032 19.780 1.00 0.00 H new ATOM 0 HA MET A 113 22.580 15.141 22.468 1.00 0.00 H new ATOM 0 HB2 MET A 113 24.035 17.359 22.329 1.00 0.00 H new ATOM 0 HB3 MET A 113 24.756 15.808 21.950 1.00 0.00 H new ATOM 0 HG2 MET A 113 25.053 16.371 19.748 1.00 0.00 H new ATOM 0 HG3 MET A 113 23.407 16.955 19.595 1.00 0.00 H new ATOM 0 HE1 MET A 113 24.248 19.786 18.228 1.00 0.00 H new ATOM 0 HE2 MET A 113 23.008 18.646 18.802 1.00 0.00 H new ATOM 0 HE3 MET A 113 23.179 20.240 19.577 1.00 0.00 H new ATOM 1218 N LEU A 114 21.069 17.560 20.854 1.00 0.00 N ATOM 1219 CA LEU A 114 20.026 18.610 21.023 1.00 0.00 C ATOM 1220 C LEU A 114 19.110 18.611 19.801 1.00 0.00 C ATOM 1221 O LEU A 114 18.388 19.555 19.553 1.00 0.00 O ATOM 1222 CB LEU A 114 20.694 19.981 21.166 1.00 0.00 C ATOM 1223 CG LEU A 114 19.892 20.850 22.140 1.00 0.00 C ATOM 1224 CD1 LEU A 114 18.521 21.165 21.538 1.00 0.00 C ATOM 1225 CD2 LEU A 114 19.710 20.105 23.464 1.00 0.00 C ATOM 0 H LEU A 114 21.354 17.382 19.891 1.00 0.00 H new ATOM 0 HA LEU A 114 19.440 18.402 21.918 1.00 0.00 H new ATOM 0 HB2 LEU A 114 21.716 19.862 21.527 1.00 0.00 H new ATOM 0 HB3 LEU A 114 20.754 20.470 20.193 1.00 0.00 H new ATOM 0 HG LEU A 114 20.431 21.780 22.320 1.00 0.00 H new ATOM 0 HD11 LEU A 114 17.952 21.783 22.232 1.00 0.00 H new ATOM 0 HD12 LEU A 114 18.651 21.701 20.598 1.00 0.00 H new ATOM 0 HD13 LEU A 114 17.982 20.236 21.354 1.00 0.00 H new ATOM 0 HD21 LEU A 114 19.139 20.725 24.155 1.00 0.00 H new ATOM 0 HD22 LEU A 114 19.174 19.173 23.286 1.00 0.00 H new ATOM 0 HD23 LEU A 114 20.687 19.886 23.895 1.00 0.00 H new ATOM 1237 N ASP A 115 19.136 17.552 19.040 1.00 0.00 N ATOM 1238 CA ASP A 115 18.271 17.473 17.827 1.00 0.00 C ATOM 1239 C ASP A 115 18.248 18.833 17.126 1.00 0.00 C ATOM 1240 O ASP A 115 17.207 19.322 16.738 1.00 0.00 O ATOM 1241 CB ASP A 115 16.848 17.089 18.241 1.00 0.00 C ATOM 1242 CG ASP A 115 16.863 15.703 18.890 1.00 0.00 C ATOM 1243 OD1 ASP A 115 17.842 14.999 18.715 1.00 0.00 O ATOM 1244 OD2 ASP A 115 15.892 15.372 19.552 1.00 0.00 O ATOM 0 H ASP A 115 19.722 16.734 19.206 1.00 0.00 H new ATOM 0 HA ASP A 115 18.668 16.720 17.146 1.00 0.00 H new ATOM 0 HB2 ASP A 115 16.450 17.825 18.939 1.00 0.00 H new ATOM 0 HB3 ASP A 115 16.192 17.088 17.370 1.00 0.00 H new ATOM 1249 N ALA A 116 19.389 19.450 16.971 1.00 0.00 N ATOM 1250 CA ALA A 116 19.429 20.782 16.304 1.00 0.00 C ATOM 1251 C ALA A 116 18.944 21.849 17.276 1.00 0.00 C ATOM 1252 O ALA A 116 19.691 22.711 17.692 1.00 0.00 O ATOM 1253 CB ALA A 116 18.515 20.774 15.082 1.00 0.00 C ATOM 0 H ALA A 116 20.293 19.089 17.277 1.00 0.00 H new ATOM 0 HA ALA A 116 20.452 20.997 15.995 1.00 0.00 H new ATOM 0 HB1 ALA A 116 18.547 21.750 14.597 1.00 0.00 H new ATOM 0 HB2 ALA A 116 18.851 20.009 14.381 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.493 20.557 15.393 1.00 0.00 H new ATOM 1259 N ALA A 117 17.694 21.802 17.635 1.00 0.00 N ATOM 1260 CA ALA A 117 17.163 22.820 18.574 1.00 0.00 C ATOM 1261 C ALA A 117 15.802 22.371 19.108 1.00 0.00 C ATOM 1262 O ALA A 117 15.117 21.575 18.499 1.00 0.00 O ATOM 1263 CB ALA A 117 17.017 24.149 17.836 1.00 0.00 C ATOM 0 H ALA A 117 17.020 21.104 17.319 1.00 0.00 H new ATOM 0 HA ALA A 117 17.849 22.940 19.413 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.627 24.904 18.519 1.00 0.00 H new ATOM 0 HB2 ALA A 117 17.990 24.466 17.462 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.329 24.027 16.999 1.00 0.00 H new ATOM 1269 N THR A 118 15.406 22.875 20.245 1.00 0.00 N ATOM 1270 CA THR A 118 14.091 22.476 20.818 1.00 0.00 C ATOM 1271 C THR A 118 13.249 23.725 21.086 1.00 0.00 C ATOM 1272 O THR A 118 13.737 24.836 21.037 1.00 0.00 O ATOM 1273 CB THR A 118 14.315 21.721 22.131 1.00 0.00 C ATOM 1274 OG1 THR A 118 14.661 22.646 23.153 1.00 0.00 O ATOM 1275 CG2 THR A 118 15.448 20.709 21.952 1.00 0.00 C ATOM 0 H THR A 118 15.937 23.546 20.801 1.00 0.00 H new ATOM 0 HA THR A 118 13.568 21.831 20.111 1.00 0.00 H new ATOM 0 HB THR A 118 13.402 21.195 22.409 1.00 0.00 H new ATOM 0 HG1 THR A 118 14.803 22.165 23.995 1.00 0.00 H new ATOM 0 HG21 THR A 118 15.607 20.172 22.887 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.183 20.001 21.167 1.00 0.00 H new ATOM 0 HG23 THR A 118 16.363 21.232 21.674 1.00 0.00 H new ATOM 1283 N GLY A 119 11.987 23.552 21.369 1.00 0.00 N ATOM 1284 CA GLY A 119 11.116 24.731 21.640 1.00 0.00 C ATOM 1285 C GLY A 119 10.502 25.223 20.328 1.00 0.00 C ATOM 1286 O GLY A 119 9.896 26.276 20.272 1.00 0.00 O ATOM 0 H GLY A 119 11.521 22.646 21.424 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.329 24.461 22.344 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.698 25.528 22.103 1.00 0.00 H new ATOM 1290 N LYS A 120 10.651 24.472 19.272 1.00 0.00 N ATOM 1291 CA LYS A 120 10.074 24.899 17.966 1.00 0.00 C ATOM 1292 C LYS A 120 8.580 24.567 17.936 1.00 0.00 C ATOM 1293 O LYS A 120 8.148 23.560 18.460 1.00 0.00 O ATOM 1294 CB LYS A 120 10.783 24.159 16.830 1.00 0.00 C ATOM 1295 CG LYS A 120 10.383 22.682 16.856 1.00 0.00 C ATOM 1296 CD LYS A 120 11.162 21.923 15.781 1.00 0.00 C ATOM 1297 CE LYS A 120 10.538 20.540 15.580 1.00 0.00 C ATOM 1298 NZ LYS A 120 10.610 19.773 16.856 1.00 0.00 N ATOM 0 H LYS A 120 11.147 23.581 19.257 1.00 0.00 H new ATOM 0 HA LYS A 120 10.210 25.973 17.842 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.516 24.602 15.871 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.863 24.256 16.937 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.589 22.256 17.838 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.312 22.581 16.683 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.147 22.480 14.844 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.207 21.823 16.076 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.500 20.640 15.261 1.00 0.00 H new ATOM 0 HE3 LYS A 120 11.064 20.003 14.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 10.428 18.767 16.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 11.557 19.881 17.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 9.896 20.135 17.520 1.00 0.00 H new ATOM 1312 N SER A 121 7.789 25.406 17.327 1.00 0.00 N ATOM 1313 CA SER A 121 6.324 25.137 17.264 1.00 0.00 C ATOM 1314 C SER A 121 6.057 23.999 16.278 1.00 0.00 C ATOM 1315 O SER A 121 6.706 23.971 15.246 1.00 0.00 O ATOM 1316 CB SER A 121 5.593 26.399 16.799 1.00 0.00 C ATOM 1317 OG SER A 121 4.207 26.273 17.082 1.00 0.00 O ATOM 1318 OXT SER A 121 5.207 23.174 16.573 1.00 0.00 O ATOM 0 H SER A 121 8.093 26.266 16.870 1.00 0.00 H new ATOM 0 HA SER A 121 5.963 24.853 18.253 1.00 0.00 H new ATOM 0 HB2 SER A 121 6.000 27.275 17.304 1.00 0.00 H new ATOM 0 HB3 SER A 121 5.745 26.548 15.730 1.00 0.00 H new ATOM 0 HG SER A 121 3.738 27.081 16.786 1.00 0.00 H new TER 1324 SER A 121