USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 775 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 51 SER OG : rot -35:sc= 0.391 USER MOD Set 1.2: A 56 LYS NZ :NH3+ 161:sc= 0.44 (180deg=-0.0477) USER MOD Set 2.1: A 42 ASN : amide:sc= -0.419 K(o=-0.65,f=-4.6!) USER MOD Set 2.2: A 64 GLN : amide:sc= -0.234 K(o=-0.65,f=-1.2) USER MOD Single : A 1 SER N :NH3+ 157:sc= 0.00461 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00409 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HE2:sc= 0.118 K(o=0.12,f=-0.53) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 100:sc= 1.25 USER MOD Single : A 12 THR OG1 : rot 54:sc= 0.386 USER MOD Single : A 13 SER OG : rot 93:sc= 0.593 USER MOD Single : A 14 SER OG : rot -129:sc= 0.038 USER MOD Single : A 16 GLN : amide:sc= 0.747 K(o=0.75,f=-3.9!) USER MOD Single : A 20 ASN : amide:sc= 0.314 X(o=0.31,f=0) USER MOD Single : A 27 MET CE :methyl -156:sc= 0 (180deg=-0.461) USER MOD Single : A 31 ASN : amide:sc= -1.3 K(o=-1.3,f=-7.4!) USER MOD Single : A 33 HIS : no HD1:sc=-0.00135 X(o=-0.0013,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc=-0.00628 USER MOD Single : A 65 GLN : amide:sc= 0.056 X(o=0.056,f=-0.17) USER MOD Single : A 66 GLN : amide:sc= -0.337 X(o=-0.34,f=-0.68) USER MOD Single : A 73 GLN : amide:sc= 0.124 X(o=0.12,f=0) USER MOD Single : A 80 SER OG : rot -98:sc= 0.634 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 91 LYS NZ :NH3+ -107:sc= 0.798 (180deg=-0.343) USER MOD Single : A 98 GLN : amide:sc= -0.601 X(o=-0.6,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -5.954 31.459 -6.798 1.00 25.00 N ATOM 2 CA SER A 1 -5.796 31.368 -8.315 1.00 25.00 C ATOM 3 C SER A 1 -5.216 30.043 -8.787 1.00 25.00 C ATOM 4 O SER A 1 -4.240 29.531 -8.278 1.00 25.00 O ATOM 5 CB SER A 1 -4.877 32.513 -8.771 1.00 25.00 C ATOM 6 OG SER A 1 -5.343 33.712 -8.413 1.00 25.00 O ATOM 0 H1 SER A 1 -5.971 32.458 -6.510 1.00 25.00 H new ATOM 0 H2 SER A 1 -6.844 31.002 -6.514 1.00 25.00 H new ATOM 0 H3 SER A 1 -5.155 30.979 -6.336 1.00 25.00 H new ATOM 0 HA SER A 1 -6.791 31.444 -8.754 1.00 25.00 H new ATOM 0 HB2 SER A 1 -3.884 32.370 -8.345 1.00 25.00 H new ATOM 0 HB3 SER A 1 -4.767 32.478 -9.855 1.00 25.00 H new ATOM 0 HG SER A 1 -4.726 34.408 -8.722 1.00 25.00 H new ATOM 14 N GLN A 2 -5.856 29.467 -9.805 1.00 25.00 N ATOM 15 CA GLN A 2 -5.372 28.227 -10.405 1.00 25.00 C ATOM 16 C GLN A 2 -4.187 28.584 -11.292 1.00 25.00 C ATOM 17 O GLN A 2 -4.240 29.564 -12.033 1.00 25.00 O ATOM 18 CB GLN A 2 -6.475 27.557 -11.234 1.00 25.00 C ATOM 19 CG GLN A 2 -7.677 27.115 -10.400 1.00 25.00 C ATOM 20 CD GLN A 2 -8.710 26.378 -11.226 1.00 25.00 C ATOM 21 OE1 GLN A 2 -8.431 25.349 -11.810 1.00 25.00 O ATOM 22 NE2 GLN A 2 -9.906 26.903 -11.274 1.00 25.00 N ATOM 0 H GLN A 2 -6.706 29.838 -10.229 1.00 25.00 H new ATOM 0 HA GLN A 2 -5.075 27.522 -9.629 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -6.812 28.250 -12.005 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -6.058 26.689 -11.746 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -7.337 26.471 -9.589 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -8.139 27.989 -9.941 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -10.104 27.768 -10.771 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -10.642 26.448 -11.814 1.00 25.00 H new ATOM 31 N GLN A 3 -3.112 27.819 -11.177 1.00 25.00 N ATOM 32 CA GLN A 3 -1.875 28.079 -11.907 1.00 25.00 C ATOM 33 C GLN A 3 -1.323 26.732 -12.346 1.00 25.00 C ATOM 34 O GLN A 3 -1.778 25.694 -11.864 1.00 25.00 O ATOM 35 CB GLN A 3 -0.857 28.785 -10.996 1.00 25.00 C ATOM 36 CG GLN A 3 -1.308 30.162 -10.510 1.00 25.00 C ATOM 37 CD GLN A 3 -0.291 30.813 -9.607 1.00 25.00 C ATOM 38 OE1 GLN A 3 0.703 31.347 -10.059 1.00 25.00 O ATOM 39 NE2 GLN A 3 -0.542 30.775 -8.325 1.00 25.00 N ATOM 0 H GLN A 3 -3.070 26.998 -10.574 1.00 25.00 H new ATOM 0 HA GLN A 3 -2.065 28.724 -12.765 1.00 25.00 H new ATOM 0 HB2 GLN A 3 -0.659 28.152 -10.131 1.00 25.00 H new ATOM 0 HB3 GLN A 3 0.085 28.892 -11.535 1.00 25.00 H new ATOM 0 HG2 GLN A 3 -1.492 30.806 -11.370 1.00 25.00 H new ATOM 0 HG3 GLN A 3 -2.254 30.065 -9.977 1.00 25.00 H new ATOM 0 HE21 GLN A 3 -1.387 30.317 -7.984 1.00 25.00 H new ATOM 0 HE22 GLN A 3 0.107 31.203 -7.665 1.00 25.00 H new ATOM 48 N SER A 4 -0.341 26.746 -13.232 1.00 25.00 N ATOM 49 CA SER A 4 0.303 25.527 -13.707 1.00 25.00 C ATOM 50 C SER A 4 1.743 25.883 -14.036 1.00 25.00 C ATOM 51 O SER A 4 2.087 27.062 -14.095 1.00 25.00 O ATOM 52 CB SER A 4 -0.414 24.996 -14.950 1.00 25.00 C ATOM 53 OG SER A 4 -0.423 25.970 -15.980 1.00 25.00 O ATOM 0 H SER A 4 0.034 27.601 -13.644 1.00 25.00 H new ATOM 0 HA SER A 4 0.263 24.746 -12.948 1.00 25.00 H new ATOM 0 HB2 SER A 4 0.082 24.092 -15.303 1.00 25.00 H new ATOM 0 HB3 SER A 4 -1.437 24.720 -14.695 1.00 25.00 H new ATOM 0 HG SER A 4 -0.884 25.610 -16.766 1.00 25.00 H new ATOM 59 N HIS A 5 2.577 24.876 -14.241 1.00 25.00 N ATOM 60 CA HIS A 5 3.982 25.077 -14.575 1.00 25.00 C ATOM 61 C HIS A 5 4.312 24.057 -15.652 1.00 25.00 C ATOM 62 O HIS A 5 3.637 23.031 -15.754 1.00 25.00 O ATOM 63 CB HIS A 5 4.857 24.871 -13.334 1.00 25.00 C ATOM 64 CG HIS A 5 6.216 25.490 -13.445 1.00 25.00 C ATOM 65 ND1 HIS A 5 7.354 24.813 -13.802 1.00 25.00 N ATOM 66 CD2 HIS A 5 6.623 26.769 -13.218 1.00 25.00 C ATOM 67 CE1 HIS A 5 8.372 25.668 -13.776 1.00 25.00 C ATOM 68 NE2 HIS A 5 7.981 26.879 -13.436 1.00 25.00 N ATOM 0 H HIS A 5 2.301 23.896 -14.181 1.00 25.00 H new ATOM 0 HA HIS A 5 4.170 26.090 -14.930 1.00 25.00 H new ATOM 0 HB2 HIS A 5 4.346 25.290 -12.467 1.00 25.00 H new ATOM 0 HB3 HIS A 5 4.968 23.802 -13.152 1.00 25.00 H new ATOM 0 HD1 HIS A 5 7.410 23.824 -14.045 1.00 25.00 H new ATOM 0 HD2 HIS A 5 5.977 27.579 -12.912 1.00 25.00 H new ATOM 0 HE1 HIS A 5 9.393 25.402 -14.005 1.00 25.00 H new ATOM 76 N SER A 6 5.315 24.342 -16.468 1.00 25.00 N ATOM 77 CA SER A 6 5.723 23.426 -17.533 1.00 25.00 C ATOM 78 C SER A 6 6.842 22.529 -17.021 1.00 25.00 C ATOM 79 O SER A 6 7.484 22.851 -16.030 1.00 25.00 O ATOM 80 CB SER A 6 6.209 24.217 -18.745 1.00 25.00 C ATOM 81 OG SER A 6 5.164 25.026 -19.261 1.00 25.00 O ATOM 0 H SER A 6 5.865 25.200 -16.417 1.00 25.00 H new ATOM 0 HA SER A 6 4.871 22.815 -17.831 1.00 25.00 H new ATOM 0 HB2 SER A 6 7.056 24.843 -18.463 1.00 25.00 H new ATOM 0 HB3 SER A 6 6.562 23.532 -19.516 1.00 25.00 H new ATOM 0 HG SER A 6 5.491 25.528 -20.036 1.00 25.00 H new ATOM 87 N SER A 7 7.098 21.434 -17.724 1.00 25.00 N ATOM 88 CA SER A 7 8.200 20.533 -17.376 1.00 25.00 C ATOM 89 C SER A 7 9.093 20.270 -18.596 1.00 25.00 C ATOM 90 O SER A 7 9.059 19.190 -19.190 1.00 25.00 O ATOM 91 CB SER A 7 7.659 19.218 -16.809 1.00 25.00 C ATOM 92 OG SER A 7 8.710 18.396 -16.331 1.00 25.00 O ATOM 0 H SER A 7 6.560 21.144 -18.540 1.00 25.00 H new ATOM 0 HA SER A 7 8.807 21.014 -16.609 1.00 25.00 H new ATOM 0 HB2 SER A 7 6.961 19.428 -15.999 1.00 25.00 H new ATOM 0 HB3 SER A 7 7.101 18.688 -17.581 1.00 25.00 H new ATOM 0 HG SER A 7 8.777 18.483 -15.357 1.00 25.00 H new ATOM 98 N PRO A 8 9.872 21.283 -19.022 1.00 25.00 N ATOM 99 CA PRO A 8 10.825 21.024 -20.104 1.00 25.00 C ATOM 100 C PRO A 8 12.020 20.220 -19.587 1.00 25.00 C ATOM 101 O PRO A 8 12.117 19.938 -18.399 1.00 25.00 O ATOM 102 CB PRO A 8 11.246 22.428 -20.515 1.00 25.00 C ATOM 103 CG PRO A 8 11.200 23.188 -19.251 1.00 25.00 C ATOM 104 CD PRO A 8 9.980 22.679 -18.549 1.00 25.00 C ATOM 0 HA PRO A 8 10.411 20.440 -20.925 1.00 25.00 H new ATOM 0 HB2 PRO A 8 12.245 22.435 -20.951 1.00 25.00 H new ATOM 0 HB3 PRO A 8 10.570 22.847 -21.260 1.00 25.00 H new ATOM 0 HG2 PRO A 8 12.098 23.022 -18.656 1.00 25.00 H new ATOM 0 HG3 PRO A 8 11.133 24.260 -19.435 1.00 25.00 H new ATOM 0 HD2 PRO A 8 10.089 22.729 -17.466 1.00 25.00 H new ATOM 0 HD3 PRO A 8 9.095 23.261 -18.808 1.00 25.00 H new ATOM 112 N GLY A 9 12.948 19.878 -20.470 1.00 25.00 N ATOM 113 CA GLY A 9 14.107 19.083 -20.074 1.00 25.00 C ATOM 114 C GLY A 9 15.233 19.866 -19.418 1.00 25.00 C ATOM 115 O GLY A 9 16.381 19.446 -19.447 1.00 25.00 O ATOM 0 H GLY A 9 12.924 20.135 -21.457 1.00 25.00 H new ATOM 0 HA2 GLY A 9 13.777 18.306 -19.385 1.00 25.00 H new ATOM 0 HA3 GLY A 9 14.502 18.580 -20.957 1.00 25.00 H new ATOM 119 N GLU A 10 14.901 20.992 -18.814 1.00 25.00 N ATOM 120 CA GLU A 10 15.881 21.869 -18.158 1.00 25.00 C ATOM 121 C GLU A 10 16.098 21.467 -16.695 1.00 25.00 C ATOM 122 O GLU A 10 16.414 22.281 -15.841 1.00 25.00 O ATOM 123 CB GLU A 10 15.408 23.329 -18.258 1.00 25.00 C ATOM 124 CG GLU A 10 15.532 23.907 -19.674 1.00 25.00 C ATOM 125 CD GLU A 10 14.252 24.569 -20.166 1.00 25.00 C ATOM 126 OE1 GLU A 10 13.624 25.337 -19.408 1.00 25.00 O ATOM 127 OE2 GLU A 10 13.850 24.282 -21.319 1.00 25.00 O ATOM 0 H GLU A 10 13.942 21.335 -18.759 1.00 25.00 H new ATOM 0 HA GLU A 10 16.839 21.765 -18.668 1.00 25.00 H new ATOM 0 HB2 GLU A 10 14.368 23.390 -17.937 1.00 25.00 H new ATOM 0 HB3 GLU A 10 15.991 23.941 -17.570 1.00 25.00 H new ATOM 0 HG2 GLU A 10 16.341 24.637 -19.692 1.00 25.00 H new ATOM 0 HG3 GLU A 10 15.808 23.108 -20.363 1.00 25.00 H new ATOM 134 N ILE A 11 15.939 20.180 -16.419 1.00 25.00 N ATOM 135 CA ILE A 11 16.053 19.620 -15.106 1.00 25.00 C ATOM 136 C ILE A 11 17.503 19.586 -14.618 1.00 25.00 C ATOM 137 O ILE A 11 17.823 19.289 -13.465 1.00 25.00 O ATOM 138 CB ILE A 11 15.430 18.185 -15.187 1.00 25.00 C ATOM 139 CG1 ILE A 11 14.041 18.190 -15.894 1.00 25.00 C ATOM 140 CG2 ILE A 11 15.287 17.607 -13.862 1.00 25.00 C ATOM 141 CD1 ILE A 11 12.936 19.054 -15.226 1.00 25.00 C ATOM 0 H ILE A 11 15.721 19.487 -17.134 1.00 25.00 H new ATOM 0 HA ILE A 11 15.525 20.234 -14.377 1.00 25.00 H new ATOM 0 HB ILE A 11 16.117 17.580 -15.779 1.00 25.00 H new ATOM 0 HG12 ILE A 11 14.178 18.540 -16.917 1.00 25.00 H new ATOM 0 HG13 ILE A 11 13.683 17.162 -15.954 1.00 25.00 H new ATOM 0 HG21 ILE A 11 14.852 16.611 -13.945 1.00 25.00 H new ATOM 0 HG22 ILE A 11 16.266 17.538 -13.388 1.00 25.00 H new ATOM 0 HG23 ILE A 11 14.635 18.238 -13.258 1.00 25.00 H new ATOM 0 HD11 ILE A 11 12.016 18.980 -15.806 1.00 25.00 H new ATOM 0 HD12 ILE A 11 12.757 18.695 -14.213 1.00 25.00 H new ATOM 0 HD13 ILE A 11 13.259 20.094 -15.191 1.00 25.00 H new ATOM 153 N THR A 12 18.371 19.927 -15.537 1.00 25.00 N ATOM 154 CA THR A 12 19.817 19.954 -15.310 1.00 25.00 C ATOM 155 C THR A 12 20.463 21.229 -15.835 1.00 25.00 C ATOM 156 O THR A 12 21.072 21.255 -16.901 1.00 25.00 O ATOM 157 CB THR A 12 20.519 18.777 -15.966 1.00 25.00 C ATOM 158 OG1 THR A 12 20.164 18.705 -17.350 1.00 25.00 O ATOM 159 CG2 THR A 12 20.130 17.464 -15.306 1.00 25.00 C ATOM 0 H THR A 12 18.102 20.200 -16.482 1.00 25.00 H new ATOM 0 HA THR A 12 19.935 19.903 -14.228 1.00 25.00 H new ATOM 0 HB THR A 12 21.592 18.932 -15.853 1.00 25.00 H new ATOM 0 HG1 THR A 12 20.347 19.567 -17.780 1.00 25.00 H new ATOM 0 HG21 THR A 12 20.649 16.642 -15.798 1.00 25.00 H new ATOM 0 HG22 THR A 12 20.408 17.490 -14.252 1.00 25.00 H new ATOM 0 HG23 THR A 12 19.053 17.318 -15.393 1.00 25.00 H new ATOM 167 N SER A 13 20.316 22.281 -15.054 1.00 25.00 N ATOM 168 CA SER A 13 20.808 23.616 -15.424 1.00 25.00 C ATOM 169 C SER A 13 21.706 24.268 -14.364 1.00 25.00 C ATOM 170 O SER A 13 22.125 25.405 -14.522 1.00 25.00 O ATOM 171 CB SER A 13 19.606 24.526 -15.675 1.00 25.00 C ATOM 172 OG SER A 13 18.700 23.902 -16.569 1.00 25.00 O ATOM 0 H SER A 13 19.855 22.247 -14.145 1.00 25.00 H new ATOM 0 HA SER A 13 21.422 23.488 -16.315 1.00 25.00 H new ATOM 0 HB2 SER A 13 19.105 24.747 -14.733 1.00 25.00 H new ATOM 0 HB3 SER A 13 19.940 25.477 -16.089 1.00 25.00 H new ATOM 0 HG SER A 13 18.021 23.414 -16.059 1.00 25.00 H new ATOM 178 N SER A 14 21.944 23.555 -13.265 1.00 25.00 N ATOM 179 CA SER A 14 22.706 24.084 -12.107 1.00 25.00 C ATOM 180 C SER A 14 22.329 25.528 -11.701 1.00 25.00 C ATOM 181 O SER A 14 23.207 26.385 -11.547 1.00 25.00 O ATOM 182 CB SER A 14 24.204 24.039 -12.411 1.00 25.00 C ATOM 183 OG SER A 14 24.619 22.726 -12.734 1.00 25.00 O ATOM 0 H SER A 14 21.620 22.596 -13.140 1.00 25.00 H new ATOM 0 HA SER A 14 22.445 23.441 -11.266 1.00 25.00 H new ATOM 0 HB2 SER A 14 24.430 24.709 -13.240 1.00 25.00 H new ATOM 0 HB3 SER A 14 24.764 24.399 -11.548 1.00 25.00 H new ATOM 0 HG SER A 14 25.397 22.486 -12.189 1.00 25.00 H new ATOM 189 N PRO A 15 21.026 25.816 -11.500 1.00 25.00 N ATOM 190 CA PRO A 15 20.659 27.234 -11.345 1.00 25.00 C ATOM 191 C PRO A 15 21.051 27.882 -10.032 1.00 25.00 C ATOM 192 O PRO A 15 21.115 29.099 -9.918 1.00 25.00 O ATOM 193 CB PRO A 15 19.141 27.190 -11.451 1.00 25.00 C ATOM 194 CG PRO A 15 18.781 25.855 -10.906 1.00 25.00 C ATOM 195 CD PRO A 15 19.821 24.959 -11.493 1.00 25.00 C ATOM 0 HA PRO A 15 21.183 27.838 -12.085 1.00 25.00 H new ATOM 0 HB2 PRO A 15 18.677 27.993 -10.878 1.00 25.00 H new ATOM 0 HB3 PRO A 15 18.810 27.302 -12.483 1.00 25.00 H new ATOM 0 HG2 PRO A 15 18.807 25.844 -9.816 1.00 25.00 H new ATOM 0 HG3 PRO A 15 17.776 25.556 -11.204 1.00 25.00 H new ATOM 0 HD2 PRO A 15 19.967 24.061 -10.893 1.00 25.00 H new ATOM 0 HD3 PRO A 15 19.552 24.631 -12.497 1.00 25.00 H new ATOM 203 N GLN A 16 21.293 27.061 -9.026 1.00 25.00 N ATOM 204 CA GLN A 16 21.623 27.554 -7.691 1.00 25.00 C ATOM 205 C GLN A 16 23.093 27.967 -7.563 1.00 25.00 C ATOM 206 O GLN A 16 23.629 27.978 -6.468 1.00 25.00 O ATOM 207 CB GLN A 16 21.298 26.485 -6.639 1.00 25.00 C ATOM 208 CG GLN A 16 19.836 26.060 -6.622 1.00 25.00 C ATOM 209 CD GLN A 16 19.511 25.136 -5.460 1.00 25.00 C ATOM 210 OE1 GLN A 16 20.388 24.492 -4.885 1.00 25.00 O ATOM 211 NE2 GLN A 16 18.252 25.057 -5.119 1.00 25.00 N ATOM 0 H GLN A 16 21.268 26.044 -9.104 1.00 25.00 H new ATOM 0 HA GLN A 16 21.016 28.444 -7.523 1.00 25.00 H new ATOM 0 HB2 GLN A 16 21.919 25.608 -6.823 1.00 25.00 H new ATOM 0 HB3 GLN A 16 21.567 26.865 -5.654 1.00 25.00 H new ATOM 0 HG2 GLN A 16 19.204 26.946 -6.565 1.00 25.00 H new ATOM 0 HG3 GLN A 16 19.596 25.558 -7.559 1.00 25.00 H new ATOM 0 HE21 GLN A 16 17.553 25.606 -5.619 1.00 25.00 H new ATOM 0 HE22 GLN A 16 17.968 24.446 -4.353 1.00 25.00 H new ATOM 220 N GLY A 17 23.750 28.283 -8.673 1.00 25.00 N ATOM 221 CA GLY A 17 25.147 28.695 -8.625 1.00 25.00 C ATOM 222 C GLY A 17 26.059 27.568 -8.179 1.00 25.00 C ATOM 223 O GLY A 17 27.089 27.798 -7.557 1.00 25.00 O ATOM 0 H GLY A 17 23.343 28.262 -9.608 1.00 25.00 H new ATOM 0 HA2 GLY A 17 25.456 29.042 -9.611 1.00 25.00 H new ATOM 0 HA3 GLY A 17 25.253 29.538 -7.942 1.00 25.00 H new ATOM 227 N LEU A 18 25.658 26.342 -8.484 1.00 25.00 N ATOM 228 CA LEU A 18 26.404 25.153 -8.058 1.00 25.00 C ATOM 229 C LEU A 18 27.749 25.091 -8.752 1.00 25.00 C ATOM 230 O LEU A 18 28.750 24.672 -8.183 1.00 25.00 O ATOM 231 CB LEU A 18 25.617 23.888 -8.413 1.00 25.00 C ATOM 232 CG LEU A 18 24.185 23.819 -7.878 1.00 25.00 C ATOM 233 CD1 LEU A 18 23.522 22.532 -8.354 1.00 25.00 C ATOM 234 CD2 LEU A 18 24.143 23.884 -6.340 1.00 25.00 C ATOM 0 H LEU A 18 24.818 26.138 -9.026 1.00 25.00 H new ATOM 0 HA LEU A 18 26.552 25.215 -6.980 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.583 23.797 -9.499 1.00 25.00 H new ATOM 0 HB3 LEU A 18 26.166 23.025 -8.038 1.00 25.00 H new ATOM 0 HG LEU A 18 23.644 24.684 -8.263 1.00 25.00 H new ATOM 0 HD11 LEU A 18 22.502 22.485 -7.972 1.00 25.00 H new ATOM 0 HD12 LEU A 18 23.502 22.514 -9.444 1.00 25.00 H new ATOM 0 HD13 LEU A 18 24.087 21.675 -7.987 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.108 23.832 -6.002 1.00 25.00 H new ATOM 0 HD22 LEU A 18 24.703 23.046 -5.925 1.00 25.00 H new ATOM 0 HD23 LEU A 18 24.588 24.820 -6.003 1.00 25.00 H new ATOM 246 N ASP A 19 27.740 25.507 -10.003 1.00 25.00 N ATOM 247 CA ASP A 19 28.927 25.500 -10.845 1.00 25.00 C ATOM 248 C ASP A 19 29.736 26.776 -10.629 1.00 25.00 C ATOM 249 O ASP A 19 30.930 26.828 -10.906 1.00 25.00 O ATOM 250 CB ASP A 19 28.477 25.390 -12.298 1.00 25.00 C ATOM 251 CG ASP A 19 28.396 23.947 -12.767 1.00 25.00 C ATOM 252 OD1 ASP A 19 29.447 23.276 -12.819 1.00 25.00 O ATOM 253 OD2 ASP A 19 27.272 23.469 -13.036 1.00 25.00 O ATOM 0 H ASP A 19 26.905 25.862 -10.470 1.00 25.00 H new ATOM 0 HA ASP A 19 29.566 24.655 -10.589 1.00 25.00 H new ATOM 0 HB2 ASP A 19 27.501 25.862 -12.411 1.00 25.00 H new ATOM 0 HB3 ASP A 19 29.172 25.938 -12.934 1.00 25.00 H new ATOM 258 N ASN A 20 29.087 27.797 -10.088 1.00 25.00 N ATOM 259 CA ASN A 20 29.726 29.074 -9.823 1.00 25.00 C ATOM 260 C ASN A 20 29.616 29.490 -8.356 1.00 25.00 C ATOM 261 O ASN A 20 28.839 30.396 -8.008 1.00 25.00 O ATOM 262 CB ASN A 20 29.065 30.155 -10.668 1.00 25.00 C ATOM 263 CG ASN A 20 29.264 29.959 -12.145 1.00 25.00 C ATOM 264 OD1 ASN A 20 28.430 29.376 -12.810 1.00 25.00 O ATOM 265 ND2 ASN A 20 30.318 30.517 -12.676 1.00 25.00 N ATOM 0 H ASN A 20 28.103 27.762 -9.821 1.00 25.00 H new ATOM 0 HA ASN A 20 30.781 28.960 -10.071 1.00 25.00 H new ATOM 0 HB2 ASN A 20 27.997 30.173 -10.452 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.465 31.127 -10.380 1.00 25.00 H new ATOM 0 HD21 ASN A 20 30.465 30.473 -13.684 1.00 25.00 H new ATOM 0 HD22 ASN A 20 30.995 30.997 -12.082 1.00 25.00 H new ATOM 272 N PRO A 21 30.447 28.902 -7.481 1.00 25.00 N ATOM 273 CA PRO A 21 30.429 29.311 -6.074 1.00 25.00 C ATOM 274 C PRO A 21 30.773 30.778 -5.873 1.00 25.00 C ATOM 275 O PRO A 21 30.330 31.387 -4.914 1.00 25.00 O ATOM 276 CB PRO A 21 31.510 28.427 -5.440 1.00 25.00 C ATOM 277 CG PRO A 21 32.355 28.017 -6.560 1.00 25.00 C ATOM 278 CD PRO A 21 31.455 27.857 -7.716 1.00 25.00 C ATOM 0 HA PRO A 21 29.437 29.196 -5.638 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.082 28.976 -4.692 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.072 27.565 -4.937 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.121 28.765 -6.764 1.00 25.00 H new ATOM 0 HG3 PRO A 21 32.872 27.084 -6.337 1.00 25.00 H new ATOM 0 HD2 PRO A 21 31.978 28.003 -8.661 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.009 26.863 -7.749 1.00 25.00 H new ATOM 286 N ALA A 22 31.550 31.355 -6.781 1.00 25.00 N ATOM 287 CA ALA A 22 31.929 32.759 -6.672 1.00 25.00 C ATOM 288 C ALA A 22 30.687 33.646 -6.726 1.00 25.00 C ATOM 289 O ALA A 22 30.525 34.558 -5.912 1.00 25.00 O ATOM 290 CB ALA A 22 32.903 33.121 -7.799 1.00 25.00 C ATOM 0 H ALA A 22 31.929 30.876 -7.598 1.00 25.00 H new ATOM 0 HA ALA A 22 32.424 32.924 -5.715 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.184 34.171 -7.714 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.795 32.499 -7.723 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.424 32.951 -8.763 1.00 25.00 H new ATOM 296 N LEU A 23 29.812 33.353 -7.676 1.00 25.00 N ATOM 297 CA LEU A 23 28.595 34.134 -7.875 1.00 25.00 C ATOM 298 C LEU A 23 27.597 33.864 -6.764 1.00 25.00 C ATOM 299 O LEU A 23 26.923 34.771 -6.292 1.00 25.00 O ATOM 300 CB LEU A 23 27.945 33.778 -9.216 1.00 25.00 C ATOM 301 CG LEU A 23 28.816 33.899 -10.478 1.00 25.00 C ATOM 302 CD1 LEU A 23 27.995 33.448 -11.674 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.336 35.304 -10.723 1.00 25.00 C ATOM 0 H LEU A 23 29.921 32.575 -8.327 1.00 25.00 H new ATOM 0 HA LEU A 23 28.872 35.188 -7.867 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.583 32.752 -9.153 1.00 25.00 H new ATOM 0 HB3 LEU A 23 27.071 34.416 -9.347 1.00 25.00 H new ATOM 0 HG LEU A 23 29.693 33.268 -10.331 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.597 33.527 -12.579 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.686 32.412 -11.533 1.00 25.00 H new ATOM 0 HD13 LEU A 23 27.112 34.081 -11.769 1.00 25.00 H new ATOM 0 HD21 LEU A 23 29.942 35.315 -11.629 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.495 35.988 -10.841 1.00 25.00 H new ATOM 0 HD23 LEU A 23 29.945 35.620 -9.876 1.00 25.00 H new ATOM 315 N LEU A 24 27.502 32.611 -6.344 1.00 25.00 N ATOM 316 CA LEU A 24 26.562 32.247 -5.293 1.00 25.00 C ATOM 317 C LEU A 24 26.954 32.901 -3.978 1.00 25.00 C ATOM 318 O LEU A 24 26.108 33.430 -3.269 1.00 25.00 O ATOM 319 CB LEU A 24 26.515 30.729 -5.121 1.00 25.00 C ATOM 320 CG LEU A 24 25.560 30.254 -4.014 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.131 30.740 -4.220 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.602 28.755 -3.922 1.00 25.00 C ATOM 0 H LEU A 24 28.057 31.837 -6.709 1.00 25.00 H new ATOM 0 HA LEU A 24 25.573 32.602 -5.583 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.214 30.276 -6.065 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.519 30.367 -4.900 1.00 25.00 H new ATOM 0 HG LEU A 24 25.901 30.691 -3.076 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.502 30.374 -3.409 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.115 31.830 -4.229 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.752 30.364 -5.170 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.925 28.420 -3.137 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.295 28.323 -4.875 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.617 28.433 -3.688 1.00 25.00 H new ATOM 334 N ARG A 25 28.244 32.900 -3.673 1.00 25.00 N ATOM 335 CA ARG A 25 28.756 33.543 -2.467 1.00 25.00 C ATOM 336 C ARG A 25 28.370 35.011 -2.504 1.00 25.00 C ATOM 337 O ARG A 25 27.924 35.566 -1.515 1.00 25.00 O ATOM 338 CB ARG A 25 30.282 33.386 -2.429 1.00 25.00 C ATOM 339 CG ARG A 25 31.007 34.157 -1.321 1.00 25.00 C ATOM 340 CD ARG A 25 32.362 34.660 -1.807 1.00 25.00 C ATOM 341 NE ARG A 25 32.203 35.572 -2.955 1.00 25.00 N ATOM 342 CZ ARG A 25 33.109 36.434 -3.396 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.288 36.556 -2.837 1.00 25.00 N ATOM 344 NH2 ARG A 25 32.820 37.194 -4.414 1.00 25.00 N ATOM 0 H ARG A 25 28.961 32.458 -4.248 1.00 25.00 H new ATOM 0 HA ARG A 25 28.334 33.084 -1.573 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.516 32.327 -2.321 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.685 33.705 -3.390 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.396 35.000 -0.999 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.144 33.512 -0.453 1.00 25.00 H new ATOM 0 HD2 ARG A 25 32.875 35.176 -0.996 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.987 33.814 -2.093 1.00 25.00 H new ATOM 0 HE ARG A 25 31.315 35.536 -3.456 1.00 25.00 H new ATOM 0 HH11 ARG A 25 34.534 35.976 -2.035 1.00 25.00 H new ATOM 0 HH12 ARG A 25 34.959 37.230 -3.204 1.00 25.00 H new ATOM 0 HH21 ARG A 25 31.906 37.122 -4.861 1.00 25.00 H new ATOM 0 HH22 ARG A 25 33.508 37.861 -4.764 1.00 25.00 H new ATOM 358 N ASP A 26 28.534 35.628 -3.660 1.00 25.00 N ATOM 359 CA ASP A 26 28.232 37.046 -3.824 1.00 25.00 C ATOM 360 C ASP A 26 26.742 37.337 -3.599 1.00 25.00 C ATOM 361 O ASP A 26 26.381 38.235 -2.841 1.00 25.00 O ATOM 362 CB ASP A 26 28.656 37.479 -5.224 1.00 25.00 C ATOM 363 CG ASP A 26 29.269 38.856 -5.239 1.00 25.00 C ATOM 364 OD1 ASP A 26 28.545 39.853 -5.407 1.00 25.00 O ATOM 365 OD2 ASP A 26 30.512 38.929 -5.089 1.00 25.00 O ATOM 0 H ASP A 26 28.876 35.171 -4.505 1.00 25.00 H new ATOM 0 HA ASP A 26 28.785 37.613 -3.075 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.373 36.761 -5.622 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.789 37.463 -5.884 1.00 25.00 H new ATOM 370 N MET A 27 25.882 36.527 -4.207 1.00 25.00 N ATOM 371 CA MET A 27 24.433 36.672 -4.042 1.00 25.00 C ATOM 372 C MET A 27 24.029 36.479 -2.593 1.00 25.00 C ATOM 373 O MET A 27 23.202 37.210 -2.072 1.00 25.00 O ATOM 374 CB MET A 27 23.698 35.628 -4.883 1.00 25.00 C ATOM 375 CG MET A 27 22.184 35.803 -4.883 1.00 25.00 C ATOM 376 SD MET A 27 21.338 34.466 -5.751 1.00 25.00 S ATOM 377 CE MET A 27 21.294 33.165 -4.457 1.00 25.00 C ATOM 0 H MET A 27 26.160 35.761 -4.820 1.00 25.00 H new ATOM 0 HA MET A 27 24.166 37.678 -4.366 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.062 35.678 -5.909 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.941 34.634 -4.507 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.826 35.849 -3.854 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.931 36.754 -5.351 1.00 25.00 H new ATOM 0 HE1 MET A 27 21.209 32.186 -4.928 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.210 33.206 -3.868 1.00 25.00 H new ATOM 0 HE3 MET A 27 20.436 33.329 -3.805 1.00 25.00 H new ATOM 387 N LEU A 28 24.607 35.479 -1.949 1.00 25.00 N ATOM 388 CA LEU A 28 24.281 35.165 -0.567 1.00 25.00 C ATOM 389 C LEU A 28 24.669 36.296 0.361 1.00 25.00 C ATOM 390 O LEU A 28 23.913 36.661 1.248 1.00 25.00 O ATOM 391 CB LEU A 28 25.010 33.915 -0.140 1.00 25.00 C ATOM 392 CG LEU A 28 24.272 32.628 -0.493 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.257 31.516 -0.462 1.00 25.00 C ATOM 394 CD2 LEU A 28 23.151 32.368 0.497 1.00 25.00 C ATOM 0 H LEU A 28 25.309 34.867 -2.364 1.00 25.00 H new ATOM 0 HA LEU A 28 23.203 35.014 -0.506 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.994 33.900 -0.609 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.171 33.948 0.938 1.00 25.00 H new ATOM 0 HG LEU A 28 23.825 32.711 -1.484 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.757 30.580 -0.711 1.00 25.00 H new ATOM 0 HD12 LEU A 28 26.047 31.710 -1.187 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.690 31.442 0.535 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.636 31.446 0.229 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.566 32.273 1.500 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.445 33.198 0.473 1.00 25.00 H new ATOM 406 N LEU A 29 25.842 36.864 0.139 1.00 25.00 N ATOM 407 CA LEU A 29 26.320 37.976 0.968 1.00 25.00 C ATOM 408 C LEU A 29 25.389 39.177 0.821 1.00 25.00 C ATOM 409 O LEU A 29 25.144 39.907 1.779 1.00 25.00 O ATOM 410 CB LEU A 29 27.743 38.380 0.559 1.00 25.00 C ATOM 411 CG LEU A 29 28.867 37.419 0.985 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.142 37.735 0.204 1.00 25.00 C ATOM 413 CD2 LEU A 29 29.142 37.501 2.490 1.00 25.00 C ATOM 0 H LEU A 29 26.483 36.581 -0.602 1.00 25.00 H new ATOM 0 HA LEU A 29 26.329 37.649 2.008 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.772 38.483 -0.526 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.955 39.363 0.979 1.00 25.00 H new ATOM 0 HG LEU A 29 28.542 36.403 0.762 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.935 37.052 0.509 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.953 37.618 -0.863 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.449 38.761 0.408 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.942 36.808 2.752 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.442 38.516 2.750 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.239 37.237 3.040 1.00 25.00 H new ATOM 425 N ALA A 30 24.858 39.356 -0.378 1.00 25.00 N ATOM 426 CA ALA A 30 23.942 40.451 -0.666 1.00 25.00 C ATOM 427 C ALA A 30 22.491 40.155 -0.243 1.00 25.00 C ATOM 428 O ALA A 30 21.643 41.048 -0.282 1.00 25.00 O ATOM 429 CB ALA A 30 23.993 40.765 -2.169 1.00 25.00 C ATOM 0 H ALA A 30 25.048 38.750 -1.176 1.00 25.00 H new ATOM 0 HA ALA A 30 24.267 41.310 -0.079 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.310 41.584 -2.393 1.00 25.00 H new ATOM 0 HB2 ALA A 30 25.007 41.052 -2.446 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.698 39.882 -2.735 1.00 25.00 H new ATOM 435 N ASN A 31 22.186 38.911 0.110 1.00 25.00 N ATOM 436 CA ASN A 31 20.804 38.517 0.396 1.00 25.00 C ATOM 437 C ASN A 31 20.607 38.068 1.848 1.00 25.00 C ATOM 438 O ASN A 31 20.922 36.930 2.207 1.00 25.00 O ATOM 439 CB ASN A 31 20.393 37.393 -0.550 1.00 25.00 C ATOM 440 CG ASN A 31 18.908 37.175 -0.572 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.236 37.216 0.457 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.383 36.942 -1.740 1.00 25.00 N ATOM 0 H ASN A 31 22.869 38.160 0.206 1.00 25.00 H new ATOM 0 HA ASN A 31 20.175 39.394 0.244 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.738 37.626 -1.557 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.888 36.470 -0.249 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.379 36.785 -1.826 1.00 25.00 H new ATOM 0 HD22 ASN A 31 18.976 36.916 -2.570 1.00 25.00 H new ATOM 449 N PRO A 32 20.039 38.942 2.699 1.00 25.00 N ATOM 450 CA PRO A 32 19.915 38.556 4.108 1.00 25.00 C ATOM 451 C PRO A 32 18.962 37.392 4.395 1.00 25.00 C ATOM 452 O PRO A 32 19.120 36.703 5.396 1.00 25.00 O ATOM 453 CB PRO A 32 19.428 39.849 4.770 1.00 25.00 C ATOM 454 CG PRO A 32 18.699 40.559 3.688 1.00 25.00 C ATOM 455 CD PRO A 32 19.529 40.306 2.471 1.00 25.00 C ATOM 0 HA PRO A 32 20.862 38.172 4.486 1.00 25.00 H new ATOM 0 HB2 PRO A 32 18.777 39.641 5.619 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.261 40.443 5.145 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.686 40.174 3.569 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.612 41.625 3.898 1.00 25.00 H new ATOM 0 HD2 PRO A 32 18.937 40.369 1.558 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.339 41.030 2.376 1.00 25.00 H new ATOM 463 N HIS A 33 17.985 37.152 3.533 1.00 25.00 N ATOM 464 CA HIS A 33 17.059 36.037 3.737 1.00 25.00 C ATOM 465 C HIS A 33 17.729 34.716 3.379 1.00 25.00 C ATOM 466 O HIS A 33 17.594 33.712 4.077 1.00 25.00 O ATOM 467 CB HIS A 33 15.815 36.219 2.864 1.00 25.00 C ATOM 468 CG HIS A 33 14.819 35.109 3.006 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.863 35.046 3.988 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.641 33.976 2.267 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.166 33.926 3.819 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.596 33.235 2.784 1.00 25.00 N ATOM 0 H HIS A 33 17.810 37.704 2.694 1.00 25.00 H new ATOM 0 HA HIS A 33 16.770 36.022 4.788 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.335 37.163 3.122 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.121 36.291 1.820 1.00 25.00 H new ATOM 0 HD2 HIS A 33 15.230 33.699 1.405 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.347 33.621 4.453 1.00 25.00 H new ATOM 0 HE2 HIS A 33 13.236 32.345 2.439 1.00 25.00 H new ATOM 480 N GLU A 34 18.445 34.725 2.268 1.00 25.00 N ATOM 481 CA GLU A 34 19.055 33.515 1.727 1.00 25.00 C ATOM 482 C GLU A 34 20.205 33.100 2.627 1.00 25.00 C ATOM 483 O GLU A 34 20.358 31.937 2.972 1.00 25.00 O ATOM 484 CB GLU A 34 19.550 33.796 0.308 1.00 25.00 C ATOM 485 CG GLU A 34 18.690 33.203 -0.793 1.00 25.00 C ATOM 486 CD GLU A 34 18.816 31.689 -0.882 1.00 25.00 C ATOM 487 OE1 GLU A 34 19.958 31.181 -0.901 1.00 25.00 O ATOM 488 OE2 GLU A 34 17.775 31.009 -0.946 1.00 25.00 O ATOM 0 H GLU A 34 18.621 35.564 1.716 1.00 25.00 H new ATOM 0 HA GLU A 34 18.328 32.704 1.688 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.607 34.875 0.165 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.563 33.407 0.208 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.647 33.467 -0.617 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.974 33.644 -1.748 1.00 25.00 H new ATOM 495 N LEU A 35 20.975 34.071 3.084 1.00 25.00 N ATOM 496 CA LEU A 35 22.080 33.785 3.986 1.00 25.00 C ATOM 497 C LEU A 35 21.567 33.239 5.321 1.00 25.00 C ATOM 498 O LEU A 35 22.239 32.449 5.977 1.00 25.00 O ATOM 499 CB LEU A 35 22.948 35.025 4.124 1.00 25.00 C ATOM 500 CG LEU A 35 22.672 36.157 5.115 1.00 25.00 C ATOM 501 CD1 LEU A 35 22.889 35.817 6.579 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.619 37.252 4.700 1.00 25.00 C ATOM 0 H LEU A 35 20.859 35.057 2.849 1.00 25.00 H new ATOM 0 HA LEU A 35 22.710 32.996 3.574 1.00 25.00 H new ATOM 0 HB2 LEU A 35 23.955 34.669 4.342 1.00 25.00 H new ATOM 0 HB3 LEU A 35 22.979 35.486 3.137 1.00 25.00 H new ATOM 0 HG LEU A 35 21.615 36.420 5.070 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.665 36.690 7.192 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.232 34.995 6.863 1.00 25.00 H new ATOM 0 HD13 LEU A 35 23.927 35.522 6.734 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.492 38.111 5.358 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.645 36.891 4.768 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.406 37.547 3.673 1.00 25.00 H new ATOM 514 N SER A 36 20.372 33.664 5.711 1.00 25.00 N ATOM 515 CA SER A 36 19.754 33.250 6.972 1.00 25.00 C ATOM 516 C SER A 36 19.237 31.827 6.894 1.00 25.00 C ATOM 517 O SER A 36 19.396 31.053 7.832 1.00 25.00 O ATOM 518 CB SER A 36 18.603 34.182 7.353 1.00 25.00 C ATOM 519 OG SER A 36 18.102 33.859 8.640 1.00 25.00 O ATOM 0 H SER A 36 19.800 34.307 5.163 1.00 25.00 H new ATOM 0 HA SER A 36 20.528 33.304 7.737 1.00 25.00 H new ATOM 0 HB2 SER A 36 18.946 35.216 7.340 1.00 25.00 H new ATOM 0 HB3 SER A 36 17.804 34.102 6.616 1.00 25.00 H new ATOM 0 HG SER A 36 17.367 34.467 8.867 1.00 25.00 H new ATOM 525 N LEU A 37 18.631 31.458 5.778 1.00 25.00 N ATOM 526 CA LEU A 37 18.146 30.093 5.626 1.00 25.00 C ATOM 527 C LEU A 37 19.317 29.187 5.533 1.00 25.00 C ATOM 528 O LEU A 37 19.290 28.069 5.994 1.00 25.00 O ATOM 529 CB LEU A 37 17.234 29.956 4.422 1.00 25.00 C ATOM 530 CG LEU A 37 17.646 29.934 2.942 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.282 28.627 2.513 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.379 30.175 2.120 1.00 25.00 C ATOM 0 H LEU A 37 18.464 32.068 4.978 1.00 25.00 H new ATOM 0 HA LEU A 37 17.545 29.821 6.494 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.683 29.029 4.582 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.517 30.772 4.509 1.00 25.00 H new ATOM 0 HG LEU A 37 18.401 30.704 2.783 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.548 28.681 1.457 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.180 28.448 3.105 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.576 27.811 2.668 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.627 30.167 1.059 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.654 29.388 2.329 1.00 25.00 H new ATOM 0 HD23 LEU A 37 15.951 31.142 2.386 1.00 25.00 H new ATOM 544 N LEU A 38 20.368 29.688 4.932 1.00 25.00 N ATOM 545 CA LEU A 38 21.560 28.911 4.764 1.00 25.00 C ATOM 546 C LEU A 38 22.206 28.565 6.092 1.00 25.00 C ATOM 547 O LEU A 38 22.559 27.426 6.316 1.00 25.00 O ATOM 548 CB LEU A 38 22.503 29.679 3.878 1.00 25.00 C ATOM 549 CG LEU A 38 23.742 28.872 3.462 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.350 27.704 2.581 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.755 29.735 2.752 1.00 25.00 C ATOM 0 H LEU A 38 20.417 30.633 4.552 1.00 25.00 H new ATOM 0 HA LEU A 38 21.305 27.959 4.298 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.970 29.999 2.983 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.824 30.582 4.398 1.00 25.00 H new ATOM 0 HG LEU A 38 24.202 28.491 4.374 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.243 27.146 2.298 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.670 27.049 3.126 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.855 28.075 1.684 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.617 29.129 2.473 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.305 30.161 1.855 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.075 30.539 3.414 1.00 25.00 H new ATOM 563 N LYS A 39 22.305 29.518 7.002 1.00 25.00 N ATOM 564 CA LYS A 39 22.830 29.203 8.342 1.00 25.00 C ATOM 565 C LYS A 39 21.882 28.329 9.151 1.00 25.00 C ATOM 566 O LYS A 39 22.330 27.585 10.011 1.00 25.00 O ATOM 567 CB LYS A 39 23.235 30.456 9.132 1.00 25.00 C ATOM 568 CG LYS A 39 22.184 31.554 9.207 1.00 25.00 C ATOM 569 CD LYS A 39 22.537 32.634 10.223 1.00 25.00 C ATOM 570 CE LYS A 39 23.725 33.477 9.750 1.00 25.00 C ATOM 571 NZ LYS A 39 24.043 34.568 10.731 1.00 25.00 N ATOM 0 H LYS A 39 22.041 30.492 6.857 1.00 25.00 H new ATOM 0 HA LYS A 39 23.738 28.625 8.169 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.494 30.156 10.147 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.137 30.871 8.683 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.069 32.009 8.223 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.222 31.114 9.469 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.673 33.279 10.386 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.775 32.171 11.181 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.598 32.838 9.618 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.500 33.914 8.777 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.852 35.122 10.384 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.217 35.191 10.838 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.281 34.148 11.652 1.00 25.00 H new ATOM 585 N GLU A 40 20.591 28.389 8.868 1.00 25.00 N ATOM 586 CA GLU A 40 19.635 27.528 9.563 1.00 25.00 C ATOM 587 C GLU A 40 19.694 26.094 9.018 1.00 25.00 C ATOM 588 O GLU A 40 19.802 25.132 9.770 1.00 25.00 O ATOM 589 CB GLU A 40 18.210 28.074 9.397 1.00 25.00 C ATOM 590 CG GLU A 40 17.192 27.420 10.332 1.00 25.00 C ATOM 591 CD GLU A 40 15.841 27.206 9.667 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.335 28.129 9.000 1.00 25.00 O ATOM 593 OE2 GLU A 40 15.304 26.080 9.756 1.00 25.00 O ATOM 0 H GLU A 40 20.181 29.013 8.173 1.00 25.00 H new ATOM 0 HA GLU A 40 19.901 27.516 10.620 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.218 29.149 9.577 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.891 27.926 8.365 1.00 25.00 H new ATOM 0 HG2 GLU A 40 17.581 26.461 10.673 1.00 25.00 H new ATOM 0 HG3 GLU A 40 17.063 28.044 11.216 1.00 25.00 H new ATOM 600 N ARG A 41 19.587 25.959 7.701 1.00 25.00 N ATOM 601 CA ARG A 41 19.523 24.636 7.060 1.00 25.00 C ATOM 602 C ARG A 41 20.875 23.969 6.837 1.00 25.00 C ATOM 603 O ARG A 41 20.975 22.749 6.852 1.00 25.00 O ATOM 604 CB ARG A 41 18.833 24.759 5.695 1.00 25.00 C ATOM 605 CG ARG A 41 17.434 25.366 5.746 1.00 25.00 C ATOM 606 CD ARG A 41 16.406 24.431 6.377 1.00 25.00 C ATOM 607 NE ARG A 41 15.383 25.202 7.097 1.00 25.00 N ATOM 608 CZ ARG A 41 14.270 25.703 6.579 1.00 25.00 C ATOM 609 NH1 ARG A 41 13.928 25.529 5.325 1.00 25.00 N ATOM 610 NH2 ARG A 41 13.491 26.402 7.349 1.00 25.00 N ATOM 0 H ARG A 41 19.542 26.744 7.051 1.00 25.00 H new ATOM 0 HA ARG A 41 18.966 24.008 7.756 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.456 25.368 5.041 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.770 23.769 5.243 1.00 25.00 H new ATOM 0 HG2 ARG A 41 17.467 26.297 6.312 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.116 25.619 4.735 1.00 25.00 H new ATOM 0 HD2 ARG A 41 15.935 23.824 5.604 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.903 23.745 7.063 1.00 25.00 H new ATOM 0 HE ARG A 41 15.545 25.368 8.090 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.529 24.988 4.703 1.00 25.00 H new ATOM 0 HH12 ARG A 41 13.061 25.934 4.972 1.00 25.00 H new ATOM 0 HH21 ARG A 41 13.742 26.554 8.326 1.00 25.00 H new ATOM 0 HH22 ARG A 41 12.629 26.799 6.976 1.00 25.00 H new ATOM 624 N ASN A 42 21.892 24.767 6.558 1.00 25.00 N ATOM 625 CA ASN A 42 23.230 24.252 6.232 1.00 25.00 C ATOM 626 C ASN A 42 24.364 24.996 6.947 1.00 25.00 C ATOM 627 O ASN A 42 25.161 25.698 6.302 1.00 25.00 O ATOM 628 CB ASN A 42 23.465 24.358 4.724 1.00 25.00 C ATOM 629 CG ASN A 42 24.578 23.467 4.251 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.269 22.847 5.032 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.748 23.393 2.969 1.00 25.00 N ATOM 0 H ASN A 42 21.824 25.785 6.548 1.00 25.00 H new ATOM 0 HA ASN A 42 23.249 23.217 6.573 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.547 24.098 4.197 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.697 25.392 4.468 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.483 22.798 2.585 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.147 23.929 2.343 1.00 25.00 H new ATOM 638 N PRO A 43 24.479 24.843 8.277 1.00 25.00 N ATOM 639 CA PRO A 43 25.566 25.588 8.928 1.00 25.00 C ATOM 640 C PRO A 43 27.013 25.385 8.409 1.00 25.00 C ATOM 641 O PRO A 43 27.755 26.365 8.359 1.00 25.00 O ATOM 642 CB PRO A 43 25.419 25.205 10.409 1.00 25.00 C ATOM 643 CG PRO A 43 24.617 23.948 10.419 1.00 25.00 C ATOM 644 CD PRO A 43 23.687 24.070 9.252 1.00 25.00 C ATOM 0 HA PRO A 43 25.449 26.649 8.705 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.393 25.052 10.873 1.00 25.00 H new ATOM 0 HB3 PRO A 43 24.919 25.994 10.970 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.257 23.071 10.323 1.00 25.00 H new ATOM 0 HG3 PRO A 43 24.066 23.839 11.353 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.403 23.094 8.858 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.765 24.585 9.522 1.00 25.00 H new ATOM 652 N PRO A 44 27.429 24.165 7.970 1.00 25.00 N ATOM 653 CA PRO A 44 28.818 24.186 7.479 1.00 25.00 C ATOM 654 C PRO A 44 29.055 24.959 6.168 1.00 25.00 C ATOM 655 O PRO A 44 30.131 25.514 5.967 1.00 25.00 O ATOM 656 CB PRO A 44 29.142 22.700 7.302 1.00 25.00 C ATOM 657 CG PRO A 44 27.854 22.083 6.991 1.00 25.00 C ATOM 658 CD PRO A 44 26.873 22.799 7.885 1.00 25.00 C ATOM 0 HA PRO A 44 29.458 24.721 8.181 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.862 22.543 6.499 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.577 22.277 8.208 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.597 22.207 5.939 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.867 21.012 7.192 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.868 22.799 7.462 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.806 22.330 8.867 1.00 25.00 H new ATOM 666 N LEU A 45 28.072 25.040 5.274 1.00 25.00 N ATOM 667 CA LEU A 45 28.263 25.855 4.071 1.00 25.00 C ATOM 668 C LEU A 45 28.138 27.318 4.467 1.00 25.00 C ATOM 669 O LEU A 45 28.836 28.187 3.950 1.00 25.00 O ATOM 670 CB LEU A 45 27.251 25.510 2.981 1.00 25.00 C ATOM 671 CG LEU A 45 27.420 26.256 1.639 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.831 26.113 1.047 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.399 25.719 0.636 1.00 25.00 C ATOM 0 H LEU A 45 27.168 24.573 5.350 1.00 25.00 H new ATOM 0 HA LEU A 45 29.250 25.652 3.657 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.306 24.439 2.788 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.251 25.714 3.364 1.00 25.00 H new ATOM 0 HG LEU A 45 27.259 27.316 1.836 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.887 26.659 0.105 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.562 26.520 1.746 1.00 25.00 H new ATOM 0 HD13 LEU A 45 29.046 25.059 0.869 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.513 26.241 -0.314 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.563 24.652 0.485 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.392 25.880 1.020 1.00 25.00 H new ATOM 685 N ALA A 46 27.253 27.580 5.412 1.00 25.00 N ATOM 686 CA ALA A 46 27.054 28.935 5.884 1.00 25.00 C ATOM 687 C ALA A 46 28.303 29.522 6.538 1.00 25.00 C ATOM 688 O ALA A 46 28.660 30.636 6.233 1.00 25.00 O ATOM 689 CB ALA A 46 25.915 28.980 6.844 1.00 25.00 C ATOM 0 H ALA A 46 26.666 26.878 5.863 1.00 25.00 H new ATOM 0 HA ALA A 46 26.830 29.545 5.009 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.774 30.003 7.193 1.00 25.00 H new ATOM 0 HB2 ALA A 46 25.007 28.637 6.348 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.130 28.333 7.694 1.00 25.00 H new ATOM 695 N GLU A 47 28.956 28.799 7.438 1.00 25.00 N ATOM 696 CA GLU A 47 30.130 29.343 8.141 1.00 25.00 C ATOM 697 C GLU A 47 31.250 29.683 7.155 1.00 25.00 C ATOM 698 O GLU A 47 31.993 30.646 7.345 1.00 25.00 O ATOM 699 CB GLU A 47 30.620 28.390 9.243 1.00 25.00 C ATOM 700 CG GLU A 47 31.203 27.078 8.743 1.00 25.00 C ATOM 701 CD GLU A 47 31.602 26.140 9.873 1.00 25.00 C ATOM 702 OE1 GLU A 47 32.067 25.021 9.572 1.00 25.00 O ATOM 703 OE2 GLU A 47 31.468 26.524 11.055 1.00 25.00 O ATOM 0 H GLU A 47 28.704 27.846 7.702 1.00 25.00 H new ATOM 0 HA GLU A 47 29.824 30.268 8.629 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.376 28.903 9.837 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.786 28.170 9.909 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.472 26.581 8.105 1.00 25.00 H new ATOM 0 HG3 GLU A 47 32.076 27.286 8.125 1.00 25.00 H new ATOM 710 N ALA A 48 31.324 28.928 6.070 1.00 25.00 N ATOM 711 CA ALA A 48 32.272 29.185 5.009 1.00 25.00 C ATOM 712 C ALA A 48 31.978 30.542 4.345 1.00 25.00 C ATOM 713 O ALA A 48 32.894 31.296 4.027 1.00 25.00 O ATOM 714 CB ALA A 48 32.194 28.043 3.993 1.00 25.00 C ATOM 0 H ALA A 48 30.725 28.119 5.905 1.00 25.00 H new ATOM 0 HA ALA A 48 33.282 29.232 5.416 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.905 28.224 3.187 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.436 27.101 4.485 1.00 25.00 H new ATOM 0 HB3 ALA A 48 31.186 27.989 3.583 1.00 25.00 H new ATOM 720 N LEU A 49 30.699 30.858 4.192 1.00 25.00 N ATOM 721 CA LEU A 49 30.268 32.144 3.637 1.00 25.00 C ATOM 722 C LEU A 49 30.572 33.276 4.613 1.00 25.00 C ATOM 723 O LEU A 49 31.022 34.343 4.210 1.00 25.00 O ATOM 724 CB LEU A 49 28.754 32.122 3.377 1.00 25.00 C ATOM 725 CG LEU A 49 28.158 33.407 2.787 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.368 33.437 1.292 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.679 33.493 3.132 1.00 25.00 C ATOM 0 H LEU A 49 29.931 30.237 4.446 1.00 25.00 H new ATOM 0 HA LEU A 49 30.808 32.308 2.705 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.533 31.297 2.700 1.00 25.00 H new ATOM 0 HB3 LEU A 49 28.246 31.907 4.317 1.00 25.00 H new ATOM 0 HG LEU A 49 28.663 34.272 3.217 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.941 34.353 0.883 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.435 33.405 1.074 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.879 32.575 0.839 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.260 34.407 2.711 1.00 25.00 H new ATOM 0 HD22 LEU A 49 26.158 32.630 2.717 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.558 33.504 4.215 1.00 25.00 H new ATOM 739 N LEU A 50 30.310 33.044 5.895 1.00 25.00 N ATOM 740 CA LEU A 50 30.478 34.086 6.921 1.00 25.00 C ATOM 741 C LEU A 50 31.937 34.493 7.026 1.00 25.00 C ATOM 742 O LEU A 50 32.265 35.605 7.417 1.00 25.00 O ATOM 743 CB LEU A 50 30.018 33.598 8.307 1.00 25.00 C ATOM 744 CG LEU A 50 28.645 32.925 8.468 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.305 32.782 9.936 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.521 33.622 7.712 1.00 25.00 C ATOM 0 H LEU A 50 29.981 32.148 6.255 1.00 25.00 H new ATOM 0 HA LEU A 50 29.864 34.934 6.616 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.768 32.895 8.669 1.00 25.00 H new ATOM 0 HB3 LEU A 50 30.038 34.458 8.977 1.00 25.00 H new ATOM 0 HG LEU A 50 28.731 31.938 8.013 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.331 32.304 10.039 1.00 25.00 H new ATOM 0 HD12 LEU A 50 29.062 32.171 10.427 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.277 33.768 10.401 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.586 33.087 7.876 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.421 34.646 8.072 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.751 33.632 6.647 1.00 25.00 H new ATOM 758 N SER A 51 32.805 33.558 6.681 1.00 25.00 N ATOM 759 CA SER A 51 34.244 33.763 6.733 1.00 25.00 C ATOM 760 C SER A 51 34.759 34.579 5.545 1.00 25.00 C ATOM 761 O SER A 51 35.870 35.091 5.583 1.00 25.00 O ATOM 762 CB SER A 51 34.909 32.399 6.739 1.00 25.00 C ATOM 763 OG SER A 51 36.275 32.460 7.122 1.00 25.00 O ATOM 0 H SER A 51 32.531 32.631 6.355 1.00 25.00 H new ATOM 0 HA SER A 51 34.483 34.328 7.634 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.373 31.740 7.422 1.00 25.00 H new ATOM 0 HB3 SER A 51 34.833 31.957 5.745 1.00 25.00 H new ATOM 0 HG SER A 51 36.675 33.286 6.778 1.00 25.00 H new ATOM 769 N GLY A 52 33.965 34.680 4.483 1.00 25.00 N ATOM 770 CA GLY A 52 34.332 35.477 3.317 1.00 25.00 C ATOM 771 C GLY A 52 35.164 34.741 2.279 1.00 25.00 C ATOM 772 O GLY A 52 35.065 35.011 1.078 1.00 25.00 O ATOM 0 H GLY A 52 33.059 34.217 4.406 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.421 35.840 2.841 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.887 36.353 3.653 1.00 25.00 H new ATOM 776 N ASP A 53 35.981 33.810 2.748 1.00 25.00 N ATOM 777 CA ASP A 53 36.862 33.011 1.911 1.00 25.00 C ATOM 778 C ASP A 53 36.102 32.222 0.853 1.00 25.00 C ATOM 779 O ASP A 53 35.410 31.248 1.149 1.00 25.00 O ATOM 780 CB ASP A 53 37.635 32.078 2.805 1.00 25.00 C ATOM 781 CG ASP A 53 38.746 32.769 3.548 1.00 25.00 C ATOM 782 OD1 ASP A 53 38.841 32.550 4.777 1.00 25.00 O ATOM 783 OD2 ASP A 53 39.504 33.539 2.927 1.00 25.00 O ATOM 0 H ASP A 53 36.051 33.585 3.740 1.00 25.00 H new ATOM 0 HA ASP A 53 37.534 33.679 1.372 1.00 25.00 H new ATOM 0 HB2 ASP A 53 36.953 31.622 3.523 1.00 25.00 H new ATOM 0 HB3 ASP A 53 38.053 31.270 2.205 1.00 25.00 H new ATOM 788 N LEU A 54 36.260 32.622 -0.401 1.00 25.00 N ATOM 789 CA LEU A 54 35.622 31.904 -1.498 1.00 25.00 C ATOM 790 C LEU A 54 36.184 30.490 -1.522 1.00 25.00 C ATOM 791 O LEU A 54 35.469 29.545 -1.786 1.00 25.00 O ATOM 792 CB LEU A 54 35.883 32.593 -2.843 1.00 25.00 C ATOM 793 CG LEU A 54 35.239 31.979 -4.113 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.138 30.923 -4.771 1.00 25.00 C ATOM 795 CD2 LEU A 54 33.835 31.398 -3.893 1.00 25.00 C ATOM 0 H LEU A 54 36.817 33.429 -0.683 1.00 25.00 H new ATOM 0 HA LEU A 54 34.543 31.890 -1.343 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.542 33.625 -2.761 1.00 25.00 H new ATOM 0 HB3 LEU A 54 36.961 32.625 -2.998 1.00 25.00 H new ATOM 0 HG LEU A 54 35.130 32.828 -4.788 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.642 30.523 -5.656 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.084 31.380 -5.061 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.327 30.115 -4.065 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.459 30.990 -4.831 1.00 25.00 H new ATOM 0 HD22 LEU A 54 33.882 30.606 -3.146 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.166 32.185 -3.546 1.00 25.00 H new ATOM 807 N GLU A 55 37.463 30.334 -1.226 1.00 25.00 N ATOM 808 CA GLU A 55 38.073 29.007 -1.263 1.00 25.00 C ATOM 809 C GLU A 55 37.367 28.016 -0.331 1.00 25.00 C ATOM 810 O GLU A 55 37.064 26.900 -0.745 1.00 25.00 O ATOM 811 CB GLU A 55 39.574 29.071 -0.958 1.00 25.00 C ATOM 812 CG GLU A 55 39.961 29.769 0.342 1.00 25.00 C ATOM 813 CD GLU A 55 41.453 29.675 0.598 1.00 25.00 C ATOM 814 OE1 GLU A 55 41.845 28.993 1.569 1.00 25.00 O ATOM 815 OE2 GLU A 55 42.233 30.227 -0.204 1.00 25.00 O ATOM 0 H GLU A 55 38.093 31.091 -0.962 1.00 25.00 H new ATOM 0 HA GLU A 55 37.950 28.636 -2.280 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.963 28.053 -0.931 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.071 29.581 -1.783 1.00 25.00 H new ATOM 0 HG2 GLU A 55 39.663 30.817 0.297 1.00 25.00 H new ATOM 0 HG3 GLU A 55 39.419 29.319 1.174 1.00 25.00 H new ATOM 822 N LYS A 56 37.037 28.420 0.891 1.00 25.00 N ATOM 823 CA LYS A 56 36.330 27.516 1.797 1.00 25.00 C ATOM 824 C LYS A 56 34.880 27.399 1.387 1.00 25.00 C ATOM 825 O LYS A 56 34.315 26.322 1.469 1.00 25.00 O ATOM 826 CB LYS A 56 36.493 27.920 3.273 1.00 25.00 C ATOM 827 CG LYS A 56 35.854 29.158 3.728 1.00 25.00 C ATOM 828 CD LYS A 56 36.498 29.616 5.041 1.00 25.00 C ATOM 829 CE LYS A 56 36.107 28.791 6.257 1.00 25.00 C ATOM 830 NZ LYS A 56 36.695 29.435 7.484 1.00 25.00 N ATOM 0 H LYS A 56 37.240 29.344 1.272 1.00 25.00 H new ATOM 0 HA LYS A 56 36.785 26.529 1.713 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.110 27.104 3.886 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.560 28.001 3.480 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.959 29.934 2.969 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.786 28.996 3.872 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.582 29.584 4.930 1.00 25.00 H new ATOM 0 HD3 LYS A 56 36.226 30.656 5.221 1.00 25.00 H new ATOM 0 HE2 LYS A 56 35.022 28.734 6.343 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.472 27.769 6.154 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 36.193 29.095 8.329 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 37.703 29.188 7.557 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 36.596 30.468 7.415 1.00 25.00 H new ATOM 844 N PHE A 57 34.292 28.472 0.880 1.00 25.00 N ATOM 845 CA PHE A 57 32.913 28.409 0.409 1.00 25.00 C ATOM 846 C PHE A 57 32.794 27.393 -0.723 1.00 25.00 C ATOM 847 O PHE A 57 31.963 26.505 -0.664 1.00 25.00 O ATOM 848 CB PHE A 57 32.423 29.786 -0.037 1.00 25.00 C ATOM 849 CG PHE A 57 31.000 29.784 -0.507 1.00 25.00 C ATOM 850 CD1 PHE A 57 29.944 29.840 0.421 1.00 25.00 C ATOM 851 CD2 PHE A 57 30.702 29.704 -1.879 1.00 25.00 C ATOM 852 CE1 PHE A 57 28.600 29.825 -0.017 1.00 25.00 C ATOM 853 CE2 PHE A 57 29.364 29.688 -2.326 1.00 25.00 C ATOM 854 CZ PHE A 57 28.314 29.755 -1.396 1.00 25.00 C ATOM 0 H PHE A 57 34.738 29.384 0.784 1.00 25.00 H new ATOM 0 HA PHE A 57 32.278 28.086 1.234 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.524 30.486 0.792 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.064 30.149 -0.841 1.00 25.00 H new ATOM 0 HD1 PHE A 57 30.162 29.895 1.477 1.00 25.00 H new ATOM 0 HD2 PHE A 57 31.506 29.654 -2.598 1.00 25.00 H new ATOM 0 HE1 PHE A 57 27.795 29.867 0.702 1.00 25.00 H new ATOM 0 HE2 PHE A 57 29.148 29.624 -3.382 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.289 29.753 -1.736 1.00 25.00 H new ATOM 864 N SER A 58 33.664 27.489 -1.716 1.00 25.00 N ATOM 865 CA SER A 58 33.694 26.547 -2.831 1.00 25.00 C ATOM 866 C SER A 58 34.017 25.125 -2.388 1.00 25.00 C ATOM 867 O SER A 58 33.375 24.177 -2.821 1.00 25.00 O ATOM 868 CB SER A 58 34.746 26.999 -3.847 1.00 25.00 C ATOM 869 OG SER A 58 34.783 26.128 -4.962 1.00 25.00 O ATOM 0 H SER A 58 34.371 28.222 -1.775 1.00 25.00 H new ATOM 0 HA SER A 58 32.698 26.539 -3.274 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.523 28.012 -4.180 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.726 27.029 -3.372 1.00 25.00 H new ATOM 0 HG SER A 58 35.461 26.439 -5.597 1.00 25.00 H new ATOM 875 N ARG A 59 34.993 24.973 -1.505 1.00 25.00 N ATOM 876 CA ARG A 59 35.383 23.644 -1.027 1.00 25.00 C ATOM 877 C ARG A 59 34.196 22.951 -0.378 1.00 25.00 C ATOM 878 O ARG A 59 33.897 21.800 -0.683 1.00 25.00 O ATOM 879 CB ARG A 59 36.542 23.774 -0.033 1.00 25.00 C ATOM 880 CG ARG A 59 37.000 22.461 0.610 1.00 25.00 C ATOM 881 CD ARG A 59 36.502 22.356 2.049 1.00 25.00 C ATOM 882 NE ARG A 59 37.039 21.170 2.736 1.00 25.00 N ATOM 883 CZ ARG A 59 36.774 20.830 3.994 1.00 25.00 C ATOM 884 NH1 ARG A 59 35.995 21.547 4.766 1.00 25.00 N ATOM 885 NH2 ARG A 59 37.311 19.750 4.490 1.00 25.00 N ATOM 0 H ARG A 59 35.529 25.743 -1.105 1.00 25.00 H new ATOM 0 HA ARG A 59 35.711 23.039 -1.872 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.391 24.224 -0.547 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.246 24.463 0.758 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.627 21.617 0.029 1.00 25.00 H new ATOM 0 HG3 ARG A 59 38.088 22.403 0.593 1.00 25.00 H new ATOM 0 HD2 ARG A 59 36.789 23.253 2.598 1.00 25.00 H new ATOM 0 HD3 ARG A 59 35.413 22.315 2.053 1.00 25.00 H new ATOM 0 HE ARG A 59 37.663 20.562 2.206 1.00 25.00 H new ATOM 0 HH11 ARG A 59 35.567 22.400 4.407 1.00 25.00 H new ATOM 0 HH12 ARG A 59 35.817 21.252 5.726 1.00 25.00 H new ATOM 0 HH21 ARG A 59 37.927 19.176 3.914 1.00 25.00 H new ATOM 0 HH22 ARG A 59 37.115 19.479 5.454 1.00 25.00 H new ATOM 899 N VAL A 60 33.502 23.660 0.496 1.00 25.00 N ATOM 900 CA VAL A 60 32.360 23.084 1.191 1.00 25.00 C ATOM 901 C VAL A 60 31.208 22.906 0.207 1.00 25.00 C ATOM 902 O VAL A 60 30.447 21.955 0.315 1.00 25.00 O ATOM 903 CB VAL A 60 31.941 23.935 2.420 1.00 25.00 C ATOM 904 CG1 VAL A 60 30.748 23.300 3.133 1.00 25.00 C ATOM 905 CG2 VAL A 60 33.115 24.037 3.416 1.00 25.00 C ATOM 0 H VAL A 60 33.706 24.629 0.741 1.00 25.00 H new ATOM 0 HA VAL A 60 32.644 22.107 1.582 1.00 25.00 H new ATOM 0 HB VAL A 60 31.664 24.928 2.065 1.00 25.00 H new ATOM 0 HG11 VAL A 60 30.470 23.911 3.991 1.00 25.00 H new ATOM 0 HG12 VAL A 60 29.905 23.235 2.445 1.00 25.00 H new ATOM 0 HG13 VAL A 60 31.017 22.300 3.472 1.00 25.00 H new ATOM 0 HG21 VAL A 60 32.812 24.636 4.275 1.00 25.00 H new ATOM 0 HG22 VAL A 60 33.396 23.038 3.751 1.00 25.00 H new ATOM 0 HG23 VAL A 60 33.967 24.509 2.927 1.00 25.00 H new ATOM 915 N LEU A 61 31.092 23.786 -0.775 1.00 25.00 N ATOM 916 CA LEU A 61 30.038 23.670 -1.784 1.00 25.00 C ATOM 917 C LEU A 61 30.119 22.317 -2.489 1.00 25.00 C ATOM 918 O LEU A 61 29.108 21.647 -2.660 1.00 25.00 O ATOM 919 CB LEU A 61 30.155 24.794 -2.824 1.00 25.00 C ATOM 920 CG LEU A 61 28.894 25.037 -3.661 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.071 26.112 -3.000 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.206 25.485 -5.072 1.00 25.00 C ATOM 0 H LEU A 61 31.710 24.588 -0.899 1.00 25.00 H new ATOM 0 HA LEU A 61 29.077 23.754 -1.276 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.415 25.719 -2.309 1.00 25.00 H new ATOM 0 HB3 LEU A 61 30.980 24.561 -3.497 1.00 25.00 H new ATOM 0 HG LEU A 61 28.357 24.090 -3.719 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.171 26.294 -3.587 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.791 25.791 -1.997 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.655 27.030 -2.938 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.276 25.642 -5.618 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.770 26.417 -5.041 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.797 24.719 -5.575 1.00 25.00 H new ATOM 934 N VAL A 62 31.320 21.896 -2.864 1.00 25.00 N ATOM 935 CA VAL A 62 31.496 20.605 -3.540 1.00 25.00 C ATOM 936 C VAL A 62 31.195 19.458 -2.586 1.00 25.00 C ATOM 937 O VAL A 62 30.507 18.508 -2.947 1.00 25.00 O ATOM 938 CB VAL A 62 32.943 20.441 -4.090 1.00 25.00 C ATOM 939 CG1 VAL A 62 33.111 19.077 -4.788 1.00 25.00 C ATOM 940 CG2 VAL A 62 33.261 21.559 -5.074 1.00 25.00 C ATOM 0 H VAL A 62 32.183 22.420 -2.716 1.00 25.00 H new ATOM 0 HA VAL A 62 30.798 20.582 -4.377 1.00 25.00 H new ATOM 0 HB VAL A 62 33.634 20.492 -3.248 1.00 25.00 H new ATOM 0 HG11 VAL A 62 34.130 18.984 -5.165 1.00 25.00 H new ATOM 0 HG12 VAL A 62 32.913 18.277 -4.075 1.00 25.00 H new ATOM 0 HG13 VAL A 62 32.409 19.004 -5.619 1.00 25.00 H new ATOM 0 HG21 VAL A 62 34.276 21.433 -5.452 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.557 21.523 -5.906 1.00 25.00 H new ATOM 0 HG23 VAL A 62 33.178 22.522 -4.570 1.00 25.00 H new ATOM 950 N GLU A 63 31.676 19.555 -1.355 1.00 25.00 N ATOM 951 CA GLU A 63 31.419 18.510 -0.353 1.00 25.00 C ATOM 952 C GLU A 63 29.914 18.355 -0.126 1.00 25.00 C ATOM 953 O GLU A 63 29.387 17.241 -0.063 1.00 25.00 O ATOM 954 CB GLU A 63 32.104 18.866 0.970 1.00 25.00 C ATOM 955 CG GLU A 63 33.623 18.791 0.901 1.00 25.00 C ATOM 956 CD GLU A 63 34.287 19.218 2.201 1.00 25.00 C ATOM 957 OE1 GLU A 63 33.872 20.241 2.794 1.00 25.00 O ATOM 958 OE2 GLU A 63 35.264 18.552 2.612 1.00 25.00 O ATOM 0 H GLU A 63 32.242 20.335 -1.020 1.00 25.00 H new ATOM 0 HA GLU A 63 31.824 17.568 -0.723 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.810 19.874 1.264 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.749 18.191 1.748 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.923 17.771 0.662 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.978 19.426 0.090 1.00 25.00 H new ATOM 965 N GLN A 64 29.212 19.473 -0.057 1.00 25.00 N ATOM 966 CA GLN A 64 27.766 19.462 0.112 1.00 25.00 C ATOM 967 C GLN A 64 27.081 18.891 -1.118 1.00 25.00 C ATOM 968 O GLN A 64 26.110 18.163 -0.990 1.00 25.00 O ATOM 969 CB GLN A 64 27.250 20.877 0.377 1.00 25.00 C ATOM 970 CG GLN A 64 27.567 21.376 1.781 1.00 25.00 C ATOM 971 CD GLN A 64 26.831 20.594 2.843 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.623 20.429 2.772 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.546 20.112 3.824 1.00 25.00 N ATOM 0 H GLN A 64 29.621 20.406 -0.116 1.00 25.00 H new ATOM 0 HA GLN A 64 27.533 18.828 0.968 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.688 21.559 -0.352 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.171 20.898 0.226 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.640 21.304 1.957 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.302 22.430 1.859 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.553 20.272 3.847 1.00 25.00 H new ATOM 0 HE22 GLN A 64 27.097 19.576 4.567 1.00 25.00 H new ATOM 982 N GLN A 65 27.580 19.187 -2.308 1.00 25.00 N ATOM 983 CA GLN A 65 26.988 18.630 -3.526 1.00 25.00 C ATOM 984 C GLN A 65 27.178 17.117 -3.581 1.00 25.00 C ATOM 985 O GLN A 65 26.272 16.402 -3.992 1.00 25.00 O ATOM 986 CB GLN A 65 27.579 19.270 -4.781 1.00 25.00 C ATOM 987 CG GLN A 65 27.056 20.673 -5.048 1.00 25.00 C ATOM 988 CD GLN A 65 27.547 21.224 -6.363 1.00 25.00 C ATOM 989 OE1 GLN A 65 27.190 20.728 -7.413 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.353 22.249 -6.309 1.00 25.00 N ATOM 0 H GLN A 65 28.381 19.800 -2.462 1.00 25.00 H new ATOM 0 HA GLN A 65 25.922 18.854 -3.496 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.664 19.307 -4.684 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.357 18.638 -5.641 1.00 25.00 H new ATOM 0 HG2 GLN A 65 25.966 20.659 -5.046 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.367 21.335 -4.240 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.628 22.635 -5.406 1.00 25.00 H new ATOM 0 HE22 GLN A 65 28.708 22.664 -7.170 1.00 25.00 H new ATOM 999 N GLN A 66 28.322 16.618 -3.128 1.00 25.00 N ATOM 1000 CA GLN A 66 28.550 15.172 -3.091 1.00 25.00 C ATOM 1001 C GLN A 66 27.553 14.516 -2.135 1.00 25.00 C ATOM 1002 O GLN A 66 26.966 13.477 -2.442 1.00 25.00 O ATOM 1003 CB GLN A 66 29.972 14.849 -2.625 1.00 25.00 C ATOM 1004 CG GLN A 66 31.059 15.197 -3.637 1.00 25.00 C ATOM 1005 CD GLN A 66 32.447 14.878 -3.118 1.00 25.00 C ATOM 1006 OE1 GLN A 66 32.632 13.976 -2.317 1.00 25.00 O ATOM 1007 NE2 GLN A 66 33.426 15.606 -3.582 1.00 25.00 N ATOM 0 H GLN A 66 29.099 17.182 -2.784 1.00 25.00 H new ATOM 0 HA GLN A 66 28.415 14.784 -4.101 1.00 25.00 H new ATOM 0 HB2 GLN A 66 30.169 15.388 -1.698 1.00 25.00 H new ATOM 0 HB3 GLN A 66 30.033 13.785 -2.395 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.883 14.646 -4.561 1.00 25.00 H new ATOM 0 HG3 GLN A 66 30.999 16.257 -3.882 1.00 25.00 H new ATOM 0 HE21 GLN A 66 33.234 16.352 -4.251 1.00 25.00 H new ATOM 0 HE22 GLN A 66 34.383 15.429 -3.276 1.00 25.00 H new ATOM 1016 N ASP A 67 27.350 15.131 -0.980 1.00 25.00 N ATOM 1017 CA ASP A 67 26.427 14.593 0.017 1.00 25.00 C ATOM 1018 C ASP A 67 24.980 14.704 -0.444 1.00 25.00 C ATOM 1019 O ASP A 67 24.177 13.802 -0.226 1.00 25.00 O ATOM 1020 CB ASP A 67 26.582 15.341 1.328 1.00 25.00 C ATOM 1021 CG ASP A 67 25.866 14.656 2.474 1.00 25.00 C ATOM 1022 OD1 ASP A 67 25.219 15.368 3.273 1.00 25.00 O ATOM 1023 OD2 ASP A 67 25.871 13.407 2.542 1.00 25.00 O ATOM 0 H ASP A 67 27.809 16.000 -0.707 1.00 25.00 H new ATOM 0 HA ASP A 67 26.671 13.540 0.153 1.00 25.00 H new ATOM 0 HB2 ASP A 67 27.641 15.432 1.568 1.00 25.00 H new ATOM 0 HB3 ASP A 67 26.193 16.353 1.214 1.00 25.00 H new ATOM 1028 N ARG A 68 24.647 15.788 -1.129 1.00 25.00 N ATOM 1029 CA ARG A 68 23.305 15.928 -1.700 1.00 25.00 C ATOM 1030 C ARG A 68 23.107 14.786 -2.668 1.00 25.00 C ATOM 1031 O ARG A 68 22.145 14.049 -2.564 1.00 25.00 O ATOM 1032 CB ARG A 68 23.125 17.232 -2.490 1.00 25.00 C ATOM 1033 CG ARG A 68 22.851 18.487 -1.677 1.00 25.00 C ATOM 1034 CD ARG A 68 22.527 19.623 -2.648 1.00 25.00 C ATOM 1035 NE ARG A 68 22.384 20.935 -1.992 1.00 25.00 N ATOM 1036 CZ ARG A 68 21.946 22.040 -2.595 1.00 25.00 C ATOM 1037 NH1 ARG A 68 21.574 22.050 -3.850 1.00 25.00 N ATOM 1038 NH2 ARG A 68 21.879 23.157 -1.926 1.00 25.00 N ATOM 0 H ARG A 68 25.272 16.575 -1.304 1.00 25.00 H new ATOM 0 HA ARG A 68 22.589 15.931 -0.878 1.00 25.00 H new ATOM 0 HB2 ARG A 68 24.025 17.399 -3.082 1.00 25.00 H new ATOM 0 HB3 ARG A 68 22.303 17.094 -3.192 1.00 25.00 H new ATOM 0 HG2 ARG A 68 22.019 18.323 -0.993 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.718 18.743 -1.068 1.00 25.00 H new ATOM 0 HD2 ARG A 68 23.315 19.685 -3.398 1.00 25.00 H new ATOM 0 HD3 ARG A 68 21.603 19.387 -3.175 1.00 25.00 H new ATOM 0 HE ARG A 68 22.638 21.002 -1.006 1.00 25.00 H new ATOM 0 HH11 ARG A 68 21.614 21.192 -4.401 1.00 25.00 H new ATOM 0 HH12 ARG A 68 21.244 22.915 -4.277 1.00 25.00 H new ATOM 0 HH21 ARG A 68 22.161 23.182 -0.946 1.00 25.00 H new ATOM 0 HH22 ARG A 68 21.545 24.006 -2.383 1.00 25.00 H new ATOM 1052 N ALA A 69 24.041 14.626 -3.590 1.00 25.00 N ATOM 1053 CA ALA A 69 23.924 13.630 -4.645 1.00 25.00 C ATOM 1054 C ALA A 69 23.773 12.206 -4.117 1.00 25.00 C ATOM 1055 O ALA A 69 23.133 11.381 -4.765 1.00 25.00 O ATOM 1056 CB ALA A 69 25.138 13.722 -5.580 1.00 25.00 C ATOM 0 H ALA A 69 24.897 15.178 -3.630 1.00 25.00 H new ATOM 0 HA ALA A 69 23.008 13.854 -5.192 1.00 25.00 H new ATOM 0 HB1 ALA A 69 25.047 12.975 -6.369 1.00 25.00 H new ATOM 0 HB2 ALA A 69 25.180 14.716 -6.025 1.00 25.00 H new ATOM 0 HB3 ALA A 69 26.050 13.540 -5.011 1.00 25.00 H new ATOM 1062 N ARG A 70 24.355 11.900 -2.964 1.00 25.00 N ATOM 1063 CA ARG A 70 24.294 10.550 -2.440 1.00 25.00 C ATOM 1064 C ARG A 70 22.838 10.174 -2.124 1.00 25.00 C ATOM 1065 O ARG A 70 22.398 9.088 -2.474 1.00 25.00 O ATOM 1066 CB ARG A 70 25.256 10.421 -1.237 1.00 25.00 C ATOM 1067 CG ARG A 70 24.631 10.556 0.136 1.00 25.00 C ATOM 1068 CD ARG A 70 25.658 10.418 1.243 1.00 25.00 C ATOM 1069 NE ARG A 70 26.188 9.047 1.341 1.00 25.00 N ATOM 1070 CZ ARG A 70 27.171 8.669 2.150 1.00 25.00 C ATOM 1071 NH1 ARG A 70 27.775 9.508 2.954 1.00 25.00 N ATOM 1072 NH2 ARG A 70 27.550 7.419 2.147 1.00 25.00 N ATOM 0 H ARG A 70 24.868 12.563 -2.383 1.00 25.00 H new ATOM 0 HA ARG A 70 24.632 9.829 -3.184 1.00 25.00 H new ATOM 0 HB2 ARG A 70 25.749 9.451 -1.295 1.00 25.00 H new ATOM 0 HB3 ARG A 70 26.032 11.180 -1.336 1.00 25.00 H new ATOM 0 HG2 ARG A 70 24.139 11.525 0.217 1.00 25.00 H new ATOM 0 HG3 ARG A 70 23.860 9.796 0.260 1.00 25.00 H new ATOM 0 HD2 ARG A 70 26.479 11.111 1.063 1.00 25.00 H new ATOM 0 HD3 ARG A 70 25.205 10.700 2.194 1.00 25.00 H new ATOM 0 HE ARG A 70 25.769 8.335 0.743 1.00 25.00 H new ATOM 0 HH11 ARG A 70 27.494 10.488 2.973 1.00 25.00 H new ATOM 0 HH12 ARG A 70 28.526 9.181 3.561 1.00 25.00 H new ATOM 0 HH21 ARG A 70 27.092 6.749 1.529 1.00 25.00 H new ATOM 0 HH22 ARG A 70 28.304 7.113 2.763 1.00 25.00 H new ATOM 1086 N ARG A 71 22.090 11.085 -1.507 1.00 25.00 N ATOM 1087 CA ARG A 71 20.672 10.849 -1.197 1.00 25.00 C ATOM 1088 C ARG A 71 19.738 11.207 -2.345 1.00 25.00 C ATOM 1089 O ARG A 71 18.692 10.591 -2.515 1.00 25.00 O ATOM 1090 CB ARG A 71 20.259 11.607 0.073 1.00 25.00 C ATOM 1091 CG ARG A 71 20.582 13.095 0.070 1.00 25.00 C ATOM 1092 CD ARG A 71 20.174 13.753 1.373 1.00 25.00 C ATOM 1093 NE ARG A 71 20.922 15.003 1.579 1.00 25.00 N ATOM 1094 CZ ARG A 71 22.119 15.090 2.158 1.00 25.00 C ATOM 1095 NH1 ARG A 71 22.747 14.043 2.628 1.00 25.00 N ATOM 1096 NH2 ARG A 71 22.697 16.249 2.268 1.00 25.00 N ATOM 0 H ARG A 71 22.438 11.997 -1.209 1.00 25.00 H new ATOM 0 HA ARG A 71 20.573 9.776 -1.031 1.00 25.00 H new ATOM 0 HB2 ARG A 71 19.186 11.484 0.218 1.00 25.00 H new ATOM 0 HB3 ARG A 71 20.751 11.146 0.929 1.00 25.00 H new ATOM 0 HG2 ARG A 71 21.651 13.236 -0.092 1.00 25.00 H new ATOM 0 HG3 ARG A 71 20.067 13.579 -0.760 1.00 25.00 H new ATOM 0 HD2 ARG A 71 19.104 13.961 1.362 1.00 25.00 H new ATOM 0 HD3 ARG A 71 20.358 13.072 2.204 1.00 25.00 H new ATOM 0 HE ARG A 71 20.492 15.869 1.254 1.00 25.00 H new ATOM 0 HH11 ARG A 71 22.321 13.119 2.558 1.00 25.00 H new ATOM 0 HH12 ARG A 71 23.663 14.151 3.065 1.00 25.00 H new ATOM 0 HH21 ARG A 71 22.234 17.085 1.912 1.00 25.00 H new ATOM 0 HH22 ARG A 71 23.613 16.322 2.710 1.00 25.00 H new ATOM 1110 N GLU A 72 20.090 12.226 -3.113 1.00 25.00 N ATOM 1111 CA GLU A 72 19.224 12.713 -4.188 1.00 25.00 C ATOM 1112 C GLU A 72 19.000 11.624 -5.216 1.00 25.00 C ATOM 1113 O GLU A 72 17.894 11.464 -5.708 1.00 25.00 O ATOM 1114 CB GLU A 72 19.832 13.939 -4.879 1.00 25.00 C ATOM 1115 CG GLU A 72 18.813 14.988 -5.295 1.00 25.00 C ATOM 1116 CD GLU A 72 18.998 16.288 -4.515 1.00 25.00 C ATOM 1117 OE1 GLU A 72 19.385 17.305 -5.127 1.00 25.00 O ATOM 1118 OE2 GLU A 72 18.796 16.278 -3.277 1.00 25.00 O ATOM 0 H GLU A 72 20.968 12.735 -3.016 1.00 25.00 H new ATOM 0 HA GLU A 72 18.272 12.999 -3.740 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.557 14.399 -4.207 1.00 25.00 H new ATOM 0 HB3 GLU A 72 20.380 13.610 -5.762 1.00 25.00 H new ATOM 0 HG2 GLU A 72 18.908 15.186 -6.363 1.00 25.00 H new ATOM 0 HG3 GLU A 72 17.806 14.604 -5.131 1.00 25.00 H new ATOM 1125 N GLN A 73 20.034 10.840 -5.496 1.00 25.00 N ATOM 1126 CA GLN A 73 19.921 9.742 -6.456 1.00 25.00 C ATOM 1127 C GLN A 73 18.833 8.754 -6.060 1.00 25.00 C ATOM 1128 O GLN A 73 18.138 8.219 -6.912 1.00 25.00 O ATOM 1129 CB GLN A 73 21.248 9.003 -6.579 1.00 25.00 C ATOM 1130 CG GLN A 73 22.252 9.728 -7.455 1.00 25.00 C ATOM 1131 CD GLN A 73 23.573 9.003 -7.514 1.00 25.00 C ATOM 1132 OE1 GLN A 73 23.708 7.991 -8.186 1.00 25.00 O ATOM 1133 NE2 GLN A 73 24.545 9.505 -6.804 1.00 25.00 N ATOM 0 H GLN A 73 20.958 10.941 -5.075 1.00 25.00 H new ATOM 0 HA GLN A 73 19.653 10.183 -7.416 1.00 25.00 H new ATOM 0 HB2 GLN A 73 21.674 8.865 -5.585 1.00 25.00 H new ATOM 0 HB3 GLN A 73 21.067 8.009 -6.989 1.00 25.00 H new ATOM 0 HG2 GLN A 73 21.848 9.830 -8.462 1.00 25.00 H new ATOM 0 HG3 GLN A 73 22.408 10.736 -7.071 1.00 25.00 H new ATOM 0 HE21 GLN A 73 24.392 10.352 -6.256 1.00 25.00 H new ATOM 0 HE22 GLN A 73 25.458 9.051 -6.796 1.00 25.00 H new ATOM 1142 N GLU A 74 18.662 8.524 -4.769 1.00 25.00 N ATOM 1143 CA GLU A 74 17.634 7.605 -4.299 1.00 25.00 C ATOM 1144 C GLU A 74 16.251 8.201 -4.545 1.00 25.00 C ATOM 1145 O GLU A 74 15.317 7.502 -4.927 1.00 25.00 O ATOM 1146 CB GLU A 74 17.811 7.330 -2.802 1.00 25.00 C ATOM 1147 CG GLU A 74 19.214 6.872 -2.417 1.00 25.00 C ATOM 1148 CD GLU A 74 19.338 6.610 -0.924 1.00 25.00 C ATOM 1149 OE1 GLU A 74 18.844 5.559 -0.465 1.00 25.00 O ATOM 1150 OE2 GLU A 74 19.917 7.459 -0.209 1.00 25.00 O ATOM 0 H GLU A 74 19.217 8.957 -4.030 1.00 25.00 H new ATOM 0 HA GLU A 74 17.729 6.668 -4.848 1.00 25.00 H new ATOM 0 HB2 GLU A 74 17.570 8.236 -2.246 1.00 25.00 H new ATOM 0 HB3 GLU A 74 17.094 6.568 -2.496 1.00 25.00 H new ATOM 0 HG2 GLU A 74 19.462 5.964 -2.966 1.00 25.00 H new ATOM 0 HG3 GLU A 74 19.937 7.632 -2.713 1.00 25.00 H new ATOM 1157 N ARG A 75 16.124 9.502 -4.324 1.00 25.00 N ATOM 1158 CA ARG A 75 14.838 10.182 -4.493 1.00 25.00 C ATOM 1159 C ARG A 75 14.424 10.315 -5.953 1.00 25.00 C ATOM 1160 O ARG A 75 13.266 10.081 -6.286 1.00 25.00 O ATOM 1161 CB ARG A 75 14.878 11.568 -3.849 1.00 25.00 C ATOM 1162 CG ARG A 75 15.272 11.534 -2.375 1.00 25.00 C ATOM 1163 CD ARG A 75 14.783 12.770 -1.641 1.00 25.00 C ATOM 1164 NE ARG A 75 13.324 12.713 -1.434 1.00 25.00 N ATOM 1165 CZ ARG A 75 12.598 13.648 -0.834 1.00 25.00 C ATOM 1166 NH1 ARG A 75 13.123 14.751 -0.361 1.00 25.00 N ATOM 1167 NH2 ARG A 75 11.312 13.464 -0.707 1.00 25.00 N ATOM 0 H ARG A 75 16.889 10.109 -4.029 1.00 25.00 H new ATOM 0 HA ARG A 75 14.094 9.559 -3.997 1.00 25.00 H new ATOM 0 HB2 ARG A 75 15.585 12.194 -4.393 1.00 25.00 H new ATOM 0 HB3 ARG A 75 13.898 12.035 -3.946 1.00 25.00 H new ATOM 0 HG2 ARG A 75 14.856 10.642 -1.906 1.00 25.00 H new ATOM 0 HG3 ARG A 75 16.356 11.463 -2.288 1.00 25.00 H new ATOM 0 HD2 ARG A 75 15.289 12.851 -0.679 1.00 25.00 H new ATOM 0 HD3 ARG A 75 15.039 13.663 -2.212 1.00 25.00 H new ATOM 0 HE ARG A 75 12.833 11.888 -1.780 1.00 25.00 H new ATOM 0 HH11 ARG A 75 14.126 14.916 -0.447 1.00 25.00 H new ATOM 0 HH12 ARG A 75 12.529 15.445 0.093 1.00 25.00 H new ATOM 0 HH21 ARG A 75 10.881 12.612 -1.066 1.00 25.00 H new ATOM 0 HH22 ARG A 75 10.738 14.172 -0.249 1.00 25.00 H new ATOM 1181 N ILE A 76 15.353 10.695 -6.820 1.00 25.00 N ATOM 1182 CA ILE A 76 15.025 10.912 -8.235 1.00 25.00 C ATOM 1183 C ILE A 76 14.700 9.608 -8.950 1.00 25.00 C ATOM 1184 O ILE A 76 14.039 9.617 -9.983 1.00 25.00 O ATOM 1185 CB ILE A 76 16.147 11.677 -9.002 1.00 25.00 C ATOM 1186 CG1 ILE A 76 17.432 10.836 -9.086 1.00 25.00 C ATOM 1187 CG2 ILE A 76 16.392 13.054 -8.330 1.00 25.00 C ATOM 1188 CD1 ILE A 76 18.557 11.471 -9.916 1.00 25.00 C ATOM 0 H ILE A 76 16.330 10.860 -6.579 1.00 25.00 H new ATOM 0 HA ILE A 76 14.134 11.540 -8.237 1.00 25.00 H new ATOM 0 HB ILE A 76 15.824 11.854 -10.028 1.00 25.00 H new ATOM 0 HG12 ILE A 76 17.800 10.657 -8.076 1.00 25.00 H new ATOM 0 HG13 ILE A 76 17.187 9.864 -9.513 1.00 25.00 H new ATOM 0 HG21 ILE A 76 17.176 13.587 -8.868 1.00 25.00 H new ATOM 0 HG22 ILE A 76 15.473 13.640 -8.355 1.00 25.00 H new ATOM 0 HG23 ILE A 76 16.699 12.904 -7.295 1.00 25.00 H new ATOM 0 HD11 ILE A 76 19.423 10.810 -9.921 1.00 25.00 H new ATOM 0 HD12 ILE A 76 18.212 11.625 -10.939 1.00 25.00 H new ATOM 0 HD13 ILE A 76 18.835 12.430 -9.479 1.00 25.00 H new ATOM 1200 N ARG A 77 15.114 8.482 -8.373 1.00 25.00 N ATOM 1201 CA ARG A 77 14.768 7.167 -8.928 1.00 25.00 C ATOM 1202 C ARG A 77 13.279 6.890 -8.786 1.00 25.00 C ATOM 1203 O ARG A 77 12.748 6.023 -9.468 1.00 25.00 O ATOM 1204 CB ARG A 77 15.545 6.059 -8.218 1.00 25.00 C ATOM 1205 CG ARG A 77 16.948 5.853 -8.753 1.00 25.00 C ATOM 1206 CD ARG A 77 17.740 4.953 -7.818 1.00 25.00 C ATOM 1207 NE ARG A 77 19.119 4.749 -8.290 1.00 25.00 N ATOM 1208 CZ ARG A 77 20.038 4.013 -7.674 1.00 25.00 C ATOM 1209 NH1 ARG A 77 19.787 3.376 -6.555 1.00 25.00 N ATOM 1210 NH2 ARG A 77 21.229 3.918 -8.193 1.00 25.00 N ATOM 0 H ARG A 77 15.685 8.449 -7.528 1.00 25.00 H new ATOM 0 HA ARG A 77 15.033 7.180 -9.985 1.00 25.00 H new ATOM 0 HB2 ARG A 77 15.603 6.293 -7.155 1.00 25.00 H new ATOM 0 HB3 ARG A 77 14.991 5.125 -8.309 1.00 25.00 H new ATOM 0 HG2 ARG A 77 16.904 5.408 -9.747 1.00 25.00 H new ATOM 0 HG3 ARG A 77 17.451 6.815 -8.856 1.00 25.00 H new ATOM 0 HD2 ARG A 77 17.759 5.393 -6.821 1.00 25.00 H new ATOM 0 HD3 ARG A 77 17.239 3.989 -7.732 1.00 25.00 H new ATOM 0 HE ARG A 77 19.391 5.209 -9.159 1.00 25.00 H new ATOM 0 HH11 ARG A 77 18.862 3.437 -6.130 1.00 25.00 H new ATOM 0 HH12 ARG A 77 20.517 2.820 -6.110 1.00 25.00 H new ATOM 0 HH21 ARG A 77 21.447 4.405 -9.062 1.00 25.00 H new ATOM 0 HH22 ARG A 77 21.944 3.356 -7.730 1.00 25.00 H new ATOM 1224 N LEU A 78 12.610 7.611 -7.896 1.00 25.00 N ATOM 1225 CA LEU A 78 11.172 7.449 -7.714 1.00 25.00 C ATOM 1226 C LEU A 78 10.440 8.373 -8.692 1.00 25.00 C ATOM 1227 O LEU A 78 9.589 7.925 -9.453 1.00 25.00 O ATOM 1228 CB LEU A 78 10.787 7.754 -6.261 1.00 25.00 C ATOM 1229 CG LEU A 78 9.689 6.860 -5.658 1.00 25.00 C ATOM 1230 CD1 LEU A 78 9.555 7.174 -4.168 1.00 25.00 C ATOM 1231 CD2 LEU A 78 8.330 7.029 -6.340 1.00 25.00 C ATOM 0 H LEU A 78 13.037 8.312 -7.290 1.00 25.00 H new ATOM 0 HA LEU A 78 10.882 6.419 -7.922 1.00 25.00 H new ATOM 0 HB2 LEU A 78 11.680 7.668 -5.642 1.00 25.00 H new ATOM 0 HB3 LEU A 78 10.458 8.791 -6.202 1.00 25.00 H new ATOM 0 HG LEU A 78 9.992 5.825 -5.816 1.00 25.00 H new ATOM 0 HD11 LEU A 78 8.779 6.545 -3.732 1.00 25.00 H new ATOM 0 HD12 LEU A 78 10.504 6.979 -3.668 1.00 25.00 H new ATOM 0 HD13 LEU A 78 9.287 8.223 -4.040 1.00 25.00 H new ATOM 0 HD21 LEU A 78 7.601 6.371 -5.867 1.00 25.00 H new ATOM 0 HD22 LEU A 78 8.001 8.064 -6.244 1.00 25.00 H new ATOM 0 HD23 LEU A 78 8.418 6.773 -7.396 1.00 25.00 H new ATOM 1243 N PHE A 79 10.798 9.653 -8.689 1.00 25.00 N ATOM 1244 CA PHE A 79 10.256 10.621 -9.624 1.00 25.00 C ATOM 1245 C PHE A 79 11.209 11.811 -9.725 1.00 25.00 C ATOM 1246 O PHE A 79 11.896 12.132 -8.758 1.00 25.00 O ATOM 1247 CB PHE A 79 8.886 11.100 -9.141 1.00 25.00 C ATOM 1248 CG PHE A 79 8.919 11.832 -7.819 1.00 25.00 C ATOM 1249 CD1 PHE A 79 9.038 13.236 -7.781 1.00 25.00 C ATOM 1250 CD2 PHE A 79 8.806 11.127 -6.607 1.00 25.00 C ATOM 1251 CE1 PHE A 79 9.056 13.930 -6.545 1.00 25.00 C ATOM 1252 CE2 PHE A 79 8.825 11.806 -5.363 1.00 25.00 C ATOM 1253 CZ PHE A 79 8.949 13.212 -5.335 1.00 25.00 C ATOM 0 H PHE A 79 11.475 10.045 -8.034 1.00 25.00 H new ATOM 0 HA PHE A 79 10.145 10.156 -10.603 1.00 25.00 H new ATOM 0 HB2 PHE A 79 8.455 11.757 -9.897 1.00 25.00 H new ATOM 0 HB3 PHE A 79 8.223 10.239 -9.051 1.00 25.00 H new ATOM 0 HD1 PHE A 79 9.116 13.790 -8.705 1.00 25.00 H new ATOM 0 HD2 PHE A 79 8.703 10.052 -6.625 1.00 25.00 H new ATOM 0 HE1 PHE A 79 9.151 15.006 -6.530 1.00 25.00 H new ATOM 0 HE2 PHE A 79 8.745 11.250 -4.440 1.00 25.00 H new ATOM 0 HZ PHE A 79 8.962 13.736 -4.391 1.00 25.00 H new ATOM 1263 N SER A 80 11.241 12.464 -10.881 1.00 25.00 N ATOM 1264 CA SER A 80 12.096 13.640 -11.096 1.00 25.00 C ATOM 1265 C SER A 80 11.716 14.387 -12.380 1.00 25.00 C ATOM 1266 O SER A 80 12.156 14.018 -13.461 1.00 25.00 O ATOM 1267 CB SER A 80 13.562 13.207 -11.198 1.00 25.00 C ATOM 1268 OG SER A 80 13.675 11.905 -11.762 1.00 25.00 O ATOM 0 H SER A 80 10.683 12.201 -11.693 1.00 25.00 H new ATOM 0 HA SER A 80 11.953 14.308 -10.246 1.00 25.00 H new ATOM 0 HB2 SER A 80 14.113 13.921 -11.810 1.00 25.00 H new ATOM 0 HB3 SER A 80 14.017 13.218 -10.208 1.00 25.00 H new ATOM 0 HG SER A 80 13.777 11.245 -11.044 1.00 25.00 H new ATOM 1274 N ALA A 81 10.885 15.418 -12.267 1.00 25.00 N ATOM 1275 CA ALA A 81 10.459 16.195 -13.440 1.00 25.00 C ATOM 1276 C ALA A 81 9.951 17.596 -13.056 1.00 25.00 C ATOM 1277 O ALA A 81 9.010 18.095 -13.664 1.00 25.00 O ATOM 1278 CB ALA A 81 9.349 15.427 -14.199 1.00 25.00 C ATOM 0 H ALA A 81 10.491 15.739 -11.382 1.00 25.00 H new ATOM 0 HA ALA A 81 11.330 16.326 -14.081 1.00 25.00 H new ATOM 0 HB1 ALA A 81 9.035 16.005 -15.068 1.00 25.00 H new ATOM 0 HB2 ALA A 81 9.733 14.461 -14.526 1.00 25.00 H new ATOM 0 HB3 ALA A 81 8.496 15.273 -13.538 1.00 25.00 H new ATOM 1284 N ASP A 82 10.496 18.177 -11.995 1.00 25.00 N ATOM 1285 CA ASP A 82 10.002 19.472 -11.499 1.00 25.00 C ATOM 1286 C ASP A 82 11.062 20.596 -11.552 1.00 25.00 C ATOM 1287 O ASP A 82 11.895 20.706 -10.647 1.00 25.00 O ATOM 1288 CB ASP A 82 9.512 19.274 -10.057 1.00 25.00 C ATOM 1289 CG ASP A 82 8.663 20.431 -9.561 1.00 25.00 C ATOM 1290 OD1 ASP A 82 8.567 20.604 -8.327 1.00 25.00 O ATOM 1291 OD2 ASP A 82 7.999 21.086 -10.393 1.00 25.00 O ATOM 0 H ASP A 82 11.271 17.784 -11.461 1.00 25.00 H new ATOM 0 HA ASP A 82 9.193 19.796 -12.153 1.00 25.00 H new ATOM 0 HB2 ASP A 82 8.933 18.353 -9.998 1.00 25.00 H new ATOM 0 HB3 ASP A 82 10.372 19.152 -9.399 1.00 25.00 H new ATOM 1296 N PRO A 83 11.047 21.440 -12.606 1.00 25.00 N ATOM 1297 CA PRO A 83 11.978 22.579 -12.661 1.00 25.00 C ATOM 1298 C PRO A 83 11.413 23.816 -11.955 1.00 25.00 C ATOM 1299 O PRO A 83 10.214 23.895 -11.704 1.00 25.00 O ATOM 1300 CB PRO A 83 12.098 22.836 -14.159 1.00 25.00 C ATOM 1301 CG PRO A 83 10.753 22.507 -14.682 1.00 25.00 C ATOM 1302 CD PRO A 83 10.192 21.399 -13.810 1.00 25.00 C ATOM 0 HA PRO A 83 12.925 22.371 -12.163 1.00 25.00 H new ATOM 0 HB2 PRO A 83 12.366 23.872 -14.367 1.00 25.00 H new ATOM 0 HB3 PRO A 83 12.867 22.211 -14.612 1.00 25.00 H new ATOM 0 HG2 PRO A 83 10.105 23.383 -14.656 1.00 25.00 H new ATOM 0 HG3 PRO A 83 10.812 22.186 -15.722 1.00 25.00 H new ATOM 0 HD2 PRO A 83 9.144 21.573 -13.564 1.00 25.00 H new ATOM 0 HD3 PRO A 83 10.246 20.431 -14.308 1.00 25.00 H new ATOM 1310 N PHE A 84 12.256 24.799 -11.659 1.00 25.00 N ATOM 1311 CA PHE A 84 11.790 26.014 -10.966 1.00 25.00 C ATOM 1312 C PHE A 84 12.521 27.265 -11.420 1.00 25.00 C ATOM 1313 O PHE A 84 12.400 28.348 -10.847 1.00 25.00 O ATOM 1314 CB PHE A 84 11.990 25.846 -9.452 1.00 25.00 C ATOM 1315 CG PHE A 84 13.435 25.987 -9.011 1.00 25.00 C ATOM 1316 CD1 PHE A 84 13.875 27.171 -8.386 1.00 25.00 C ATOM 1317 CD2 PHE A 84 14.364 24.950 -9.234 1.00 25.00 C ATOM 1318 CE1 PHE A 84 15.228 27.328 -7.995 1.00 25.00 C ATOM 1319 CE2 PHE A 84 15.721 25.098 -8.846 1.00 25.00 C ATOM 1320 CZ PHE A 84 16.153 26.292 -8.231 1.00 25.00 C ATOM 0 H PHE A 84 13.252 24.789 -11.880 1.00 25.00 H new ATOM 0 HA PHE A 84 10.735 26.139 -11.212 1.00 25.00 H new ATOM 0 HB2 PHE A 84 11.385 26.587 -8.930 1.00 25.00 H new ATOM 0 HB3 PHE A 84 11.621 24.865 -9.152 1.00 25.00 H new ATOM 0 HD1 PHE A 84 13.171 27.970 -8.203 1.00 25.00 H new ATOM 0 HD2 PHE A 84 14.040 24.034 -9.705 1.00 25.00 H new ATOM 0 HE1 PHE A 84 15.550 28.241 -7.516 1.00 25.00 H new ATOM 0 HE2 PHE A 84 16.423 24.296 -9.022 1.00 25.00 H new ATOM 0 HZ PHE A 84 17.187 26.411 -7.943 1.00 25.00 H new ATOM 1330 N ASP A 85 13.354 27.059 -12.407 1.00 25.00 N ATOM 1331 CA ASP A 85 14.398 27.984 -12.785 1.00 25.00 C ATOM 1332 C ASP A 85 14.272 28.376 -14.242 1.00 25.00 C ATOM 1333 O ASP A 85 15.194 28.236 -15.008 1.00 25.00 O ATOM 1334 CB ASP A 85 15.761 27.331 -12.499 1.00 25.00 C ATOM 1335 CG ASP A 85 15.916 25.928 -13.134 1.00 25.00 C ATOM 1336 OD1 ASP A 85 16.979 25.683 -13.738 1.00 25.00 O ATOM 1337 OD2 ASP A 85 15.054 25.035 -12.889 1.00 25.00 O ATOM 0 H ASP A 85 13.326 26.221 -12.988 1.00 25.00 H new ATOM 0 HA ASP A 85 14.307 28.899 -12.200 1.00 25.00 H new ATOM 0 HB2 ASP A 85 16.552 27.980 -12.873 1.00 25.00 H new ATOM 0 HB3 ASP A 85 15.898 27.251 -11.421 1.00 25.00 H new ATOM 1342 N LEU A 86 13.114 28.909 -14.601 1.00 25.00 N ATOM 1343 CA LEU A 86 12.842 29.325 -15.983 1.00 25.00 C ATOM 1344 C LEU A 86 13.818 30.395 -16.490 1.00 25.00 C ATOM 1345 O LEU A 86 14.060 30.504 -17.682 1.00 25.00 O ATOM 1346 CB LEU A 86 11.414 29.875 -16.082 1.00 25.00 C ATOM 1347 CG LEU A 86 10.282 28.925 -15.652 1.00 25.00 C ATOM 1348 CD1 LEU A 86 8.951 29.675 -15.684 1.00 25.00 C ATOM 1349 CD2 LEU A 86 10.210 27.693 -16.552 1.00 25.00 C ATOM 0 H LEU A 86 12.339 29.067 -13.957 1.00 25.00 H new ATOM 0 HA LEU A 86 12.968 28.441 -16.608 1.00 25.00 H new ATOM 0 HB2 LEU A 86 11.353 30.777 -15.473 1.00 25.00 H new ATOM 0 HB3 LEU A 86 11.234 30.175 -17.114 1.00 25.00 H new ATOM 0 HG LEU A 86 10.490 28.582 -14.639 1.00 25.00 H new ATOM 0 HD11 LEU A 86 8.148 29.004 -15.380 1.00 25.00 H new ATOM 0 HD12 LEU A 86 8.994 30.523 -15.000 1.00 25.00 H new ATOM 0 HD13 LEU A 86 8.760 30.034 -16.695 1.00 25.00 H new ATOM 0 HD21 LEU A 86 9.399 27.045 -16.218 1.00 25.00 H new ATOM 0 HD22 LEU A 86 10.026 28.004 -17.580 1.00 25.00 H new ATOM 0 HD23 LEU A 86 11.153 27.149 -16.501 1.00 25.00 H new ATOM 1361 N GLU A 87 14.368 31.179 -15.574 1.00 25.00 N ATOM 1362 CA GLU A 87 15.345 32.217 -15.932 1.00 25.00 C ATOM 1363 C GLU A 87 16.736 31.612 -16.169 1.00 25.00 C ATOM 1364 O GLU A 87 17.540 32.185 -16.897 1.00 25.00 O ATOM 1365 CB GLU A 87 15.444 33.256 -14.809 1.00 25.00 C ATOM 1366 CG GLU A 87 14.208 34.148 -14.658 1.00 25.00 C ATOM 1367 CD GLU A 87 14.244 35.362 -15.585 1.00 25.00 C ATOM 1368 OE1 GLU A 87 14.088 35.194 -16.812 1.00 25.00 O ATOM 1369 OE2 GLU A 87 14.414 36.491 -15.071 1.00 25.00 O ATOM 0 H GLU A 87 14.160 31.122 -14.577 1.00 25.00 H new ATOM 0 HA GLU A 87 15.002 32.690 -16.852 1.00 25.00 H new ATOM 0 HB2 GLU A 87 15.620 32.738 -13.866 1.00 25.00 H new ATOM 0 HB3 GLU A 87 16.313 33.888 -14.992 1.00 25.00 H new ATOM 0 HG2 GLU A 87 13.313 33.562 -14.868 1.00 25.00 H new ATOM 0 HG3 GLU A 87 14.133 34.486 -13.625 1.00 25.00 H new ATOM 1376 N ALA A 88 16.990 30.472 -15.519 1.00 25.00 N ATOM 1377 CA ALA A 88 18.242 29.695 -15.603 1.00 25.00 C ATOM 1378 C ALA A 88 19.497 30.537 -15.883 1.00 25.00 C ATOM 1379 O ALA A 88 20.216 30.331 -16.864 1.00 25.00 O ATOM 1380 CB ALA A 88 18.077 28.578 -16.635 1.00 25.00 C ATOM 0 H ALA A 88 16.306 30.044 -14.895 1.00 25.00 H new ATOM 0 HA ALA A 88 18.415 29.270 -14.614 1.00 25.00 H new ATOM 0 HB1 ALA A 88 19.000 28.002 -16.699 1.00 25.00 H new ATOM 0 HB2 ALA A 88 17.261 27.922 -16.333 1.00 25.00 H new ATOM 0 HB3 ALA A 88 17.852 29.013 -17.609 1.00 25.00 H new ATOM 1386 N GLN A 89 19.723 31.518 -15.022 1.00 25.00 N ATOM 1387 CA GLN A 89 20.816 32.465 -15.224 1.00 25.00 C ATOM 1388 C GLN A 89 22.189 31.787 -15.285 1.00 25.00 C ATOM 1389 O GLN A 89 22.483 30.851 -14.545 1.00 25.00 O ATOM 1390 CB GLN A 89 20.818 33.565 -14.144 1.00 25.00 C ATOM 1391 CG GLN A 89 21.230 33.108 -12.731 1.00 25.00 C ATOM 1392 CD GLN A 89 21.461 34.273 -11.794 1.00 25.00 C ATOM 1393 OE1 GLN A 89 22.157 35.228 -12.130 1.00 25.00 O ATOM 1394 NE2 GLN A 89 20.901 34.198 -10.613 1.00 25.00 N ATOM 0 H GLN A 89 19.169 31.681 -14.181 1.00 25.00 H new ATOM 0 HA GLN A 89 20.635 32.924 -16.196 1.00 25.00 H new ATOM 0 HB2 GLN A 89 21.493 34.360 -14.461 1.00 25.00 H new ATOM 0 HB3 GLN A 89 19.819 33.998 -14.090 1.00 25.00 H new ATOM 0 HG2 GLN A 89 20.454 32.463 -12.320 1.00 25.00 H new ATOM 0 HG3 GLN A 89 22.140 32.511 -12.796 1.00 25.00 H new ATOM 0 HE21 GLN A 89 20.330 33.389 -10.370 1.00 25.00 H new ATOM 0 HE22 GLN A 89 21.036 34.949 -9.936 1.00 25.00 H new ATOM 1403 N ALA A 90 23.041 32.320 -16.148 1.00 25.00 N ATOM 1404 CA ALA A 90 24.405 31.839 -16.310 1.00 25.00 C ATOM 1405 C ALA A 90 25.285 33.059 -16.569 1.00 25.00 C ATOM 1406 O ALA A 90 24.770 34.146 -16.874 1.00 25.00 O ATOM 1407 CB ALA A 90 24.477 30.851 -17.485 1.00 25.00 C ATOM 0 H ALA A 90 22.805 33.102 -16.759 1.00 25.00 H new ATOM 0 HA ALA A 90 24.745 31.312 -15.419 1.00 25.00 H new ATOM 0 HB1 ALA A 90 25.501 30.496 -17.599 1.00 25.00 H new ATOM 0 HB2 ALA A 90 23.819 30.004 -17.289 1.00 25.00 H new ATOM 0 HB3 ALA A 90 24.162 31.351 -18.401 1.00 25.00 H new ATOM 1413 N LYS A 91 26.593 32.892 -16.447 1.00 25.00 N ATOM 1414 CA LYS A 91 27.559 33.963 -16.711 1.00 25.00 C ATOM 1415 C LYS A 91 28.793 33.320 -17.311 1.00 25.00 C ATOM 1416 O LYS A 91 28.957 32.112 -17.236 1.00 25.00 O ATOM 1417 CB LYS A 91 27.943 34.706 -15.418 1.00 25.00 C ATOM 1418 CG LYS A 91 27.084 35.942 -15.135 1.00 25.00 C ATOM 1419 CD LYS A 91 25.994 35.655 -14.100 1.00 25.00 C ATOM 1420 CE LYS A 91 24.870 36.686 -14.144 1.00 25.00 C ATOM 1421 NZ LYS A 91 24.097 36.597 -15.429 1.00 25.00 N ATOM 0 H LYS A 91 27.021 32.011 -16.162 1.00 25.00 H new ATOM 0 HA LYS A 91 27.119 34.694 -17.389 1.00 25.00 H new ATOM 0 HB2 LYS A 91 27.861 34.018 -14.577 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.988 35.009 -15.481 1.00 25.00 H new ATOM 0 HG2 LYS A 91 27.720 36.752 -14.777 1.00 25.00 H new ATOM 0 HG3 LYS A 91 26.623 36.284 -16.062 1.00 25.00 H new ATOM 0 HD2 LYS A 91 25.581 34.662 -14.276 1.00 25.00 H new ATOM 0 HD3 LYS A 91 26.436 35.644 -13.104 1.00 25.00 H new ATOM 0 HE2 LYS A 91 24.197 36.530 -13.301 1.00 25.00 H new ATOM 0 HE3 LYS A 91 25.288 37.687 -14.037 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 24.333 37.410 -16.033 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 24.344 35.716 -15.923 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 23.078 36.603 -15.222 1.00 25.00 H new ATOM 1435 N ILE A 92 29.663 34.146 -17.861 1.00 25.00 N ATOM 1436 CA ILE A 92 30.947 33.718 -18.376 1.00 25.00 C ATOM 1437 C ILE A 92 31.892 34.574 -17.559 1.00 25.00 C ATOM 1438 O ILE A 92 31.741 35.794 -17.524 1.00 25.00 O ATOM 1439 CB ILE A 92 31.111 34.012 -19.902 1.00 25.00 C ATOM 1440 CG1 ILE A 92 30.031 33.254 -20.707 1.00 25.00 C ATOM 1441 CG2 ILE A 92 32.534 33.612 -20.380 1.00 25.00 C ATOM 1442 CD1 ILE A 92 29.934 33.666 -22.189 1.00 25.00 C ATOM 0 H ILE A 92 29.494 35.147 -17.963 1.00 25.00 H new ATOM 0 HA ILE A 92 31.109 32.643 -18.293 1.00 25.00 H new ATOM 0 HB ILE A 92 30.983 35.081 -20.071 1.00 25.00 H new ATOM 0 HG12 ILE A 92 30.238 32.185 -20.653 1.00 25.00 H new ATOM 0 HG13 ILE A 92 29.063 33.415 -20.234 1.00 25.00 H new ATOM 0 HG21 ILE A 92 32.633 33.823 -21.445 1.00 25.00 H new ATOM 0 HG22 ILE A 92 33.278 34.184 -19.826 1.00 25.00 H new ATOM 0 HG23 ILE A 92 32.691 32.548 -20.205 1.00 25.00 H new ATOM 0 HD11 ILE A 92 29.152 33.085 -22.678 1.00 25.00 H new ATOM 0 HD12 ILE A 92 29.694 34.727 -22.257 1.00 25.00 H new ATOM 0 HD13 ILE A 92 30.888 33.478 -22.682 1.00 25.00 H new ATOM 1454 N GLU A 93 32.799 33.936 -16.848 1.00 25.00 N ATOM 1455 CA GLU A 93 33.746 34.633 -15.988 1.00 25.00 C ATOM 1456 C GLU A 93 35.149 34.444 -16.554 1.00 25.00 C ATOM 1457 O GLU A 93 35.401 33.507 -17.311 1.00 25.00 O ATOM 1458 CB GLU A 93 33.634 34.129 -14.538 1.00 25.00 C ATOM 1459 CG GLU A 93 33.847 32.623 -14.342 1.00 25.00 C ATOM 1460 CD GLU A 93 33.634 32.197 -12.884 1.00 25.00 C ATOM 1461 OE1 GLU A 93 34.577 31.656 -12.273 1.00 25.00 O ATOM 1462 OE2 GLU A 93 32.518 32.415 -12.345 1.00 25.00 O ATOM 0 H GLU A 93 32.904 32.921 -16.847 1.00 25.00 H new ATOM 0 HA GLU A 93 33.520 35.699 -15.966 1.00 25.00 H new ATOM 0 HB2 GLU A 93 34.363 34.663 -13.929 1.00 25.00 H new ATOM 0 HB3 GLU A 93 32.647 34.391 -14.156 1.00 25.00 H new ATOM 0 HG2 GLU A 93 33.159 32.073 -14.984 1.00 25.00 H new ATOM 0 HG3 GLU A 93 34.857 32.356 -14.654 1.00 25.00 H new ATOM 1469 N GLU A 94 36.037 35.371 -16.233 1.00 25.00 N ATOM 1470 CA GLU A 94 37.393 35.377 -16.764 1.00 25.00 C ATOM 1471 C GLU A 94 38.263 36.115 -15.757 1.00 25.00 C ATOM 1472 O GLU A 94 37.763 36.960 -15.012 1.00 25.00 O ATOM 1473 CB GLU A 94 37.432 36.136 -18.094 1.00 25.00 C ATOM 1474 CG GLU A 94 38.435 35.592 -19.099 1.00 25.00 C ATOM 1475 CD GLU A 94 38.549 36.484 -20.337 1.00 25.00 C ATOM 1476 OE1 GLU A 94 38.626 37.724 -20.176 1.00 25.00 O ATOM 1477 OE2 GLU A 94 38.600 35.946 -21.463 1.00 25.00 O ATOM 0 H GLU A 94 35.839 36.142 -15.596 1.00 25.00 H new ATOM 0 HA GLU A 94 37.742 34.358 -16.929 1.00 25.00 H new ATOM 0 HB2 GLU A 94 36.438 36.112 -18.541 1.00 25.00 H new ATOM 0 HB3 GLU A 94 37.666 37.182 -17.895 1.00 25.00 H new ATOM 0 HG2 GLU A 94 39.412 35.504 -18.624 1.00 25.00 H new ATOM 0 HG3 GLU A 94 38.137 34.588 -19.402 1.00 25.00 H new ATOM 1484 N ASP A 95 39.558 35.838 -15.762 1.00 25.00 N ATOM 1485 CA ASP A 95 40.505 36.536 -14.888 1.00 25.00 C ATOM 1486 C ASP A 95 41.814 36.797 -15.631 1.00 25.00 C ATOM 1487 O ASP A 95 42.836 36.154 -15.404 1.00 25.00 O ATOM 1488 CB ASP A 95 40.769 35.755 -13.596 1.00 25.00 C ATOM 1489 CG ASP A 95 41.544 36.581 -12.576 1.00 25.00 C ATOM 1490 OD1 ASP A 95 41.794 36.087 -11.458 1.00 25.00 O ATOM 1491 OD2 ASP A 95 41.865 37.757 -12.883 1.00 25.00 O ATOM 0 H ASP A 95 39.984 35.132 -16.363 1.00 25.00 H new ATOM 0 HA ASP A 95 40.057 37.489 -14.608 1.00 25.00 H new ATOM 0 HB2 ASP A 95 39.820 35.441 -13.162 1.00 25.00 H new ATOM 0 HB3 ASP A 95 41.328 34.849 -13.828 1.00 25.00 H new ATOM 1496 N ILE A 96 41.766 37.751 -16.542 1.00 25.00 N ATOM 1497 CA ILE A 96 42.936 38.132 -17.336 1.00 25.00 C ATOM 1498 C ILE A 96 43.721 39.261 -16.656 1.00 25.00 C ATOM 1499 O ILE A 96 44.321 40.111 -17.318 1.00 25.00 O ATOM 1500 CB ILE A 96 42.513 38.546 -18.780 1.00 25.00 C ATOM 1501 CG1 ILE A 96 41.438 39.659 -18.734 1.00 25.00 C ATOM 1502 CG2 ILE A 96 41.990 37.308 -19.539 1.00 25.00 C ATOM 1503 CD1 ILE A 96 41.159 40.322 -20.090 1.00 25.00 C ATOM 0 H ILE A 96 40.924 38.285 -16.757 1.00 25.00 H new ATOM 0 HA ILE A 96 43.590 37.263 -17.407 1.00 25.00 H new ATOM 0 HB ILE A 96 43.381 38.943 -19.307 1.00 25.00 H new ATOM 0 HG12 ILE A 96 40.509 39.236 -18.351 1.00 25.00 H new ATOM 0 HG13 ILE A 96 41.755 40.425 -18.026 1.00 25.00 H new ATOM 0 HG21 ILE A 96 41.695 37.597 -20.547 1.00 25.00 H new ATOM 0 HG22 ILE A 96 42.777 36.555 -19.593 1.00 25.00 H new ATOM 0 HG23 ILE A 96 41.129 36.896 -19.013 1.00 25.00 H new ATOM 0 HD11 ILE A 96 40.394 41.089 -19.969 1.00 25.00 H new ATOM 0 HD12 ILE A 96 42.074 40.778 -20.467 1.00 25.00 H new ATOM 0 HD13 ILE A 96 40.810 39.570 -20.798 1.00 25.00 H new ATOM 1515 N ARG A 97 43.735 39.268 -15.327 1.00 25.00 N ATOM 1516 CA ARG A 97 44.449 40.306 -14.562 1.00 25.00 C ATOM 1517 C ARG A 97 45.937 39.984 -14.435 1.00 25.00 C ATOM 1518 O ARG A 97 46.496 39.958 -13.343 1.00 25.00 O ATOM 1519 CB ARG A 97 43.841 40.443 -13.161 1.00 25.00 C ATOM 1520 CG ARG A 97 42.371 40.854 -13.137 1.00 25.00 C ATOM 1521 CD ARG A 97 42.159 42.275 -13.638 1.00 25.00 C ATOM 1522 NE ARG A 97 40.758 42.691 -13.454 1.00 25.00 N ATOM 1523 CZ ARG A 97 40.245 43.188 -12.332 1.00 25.00 C ATOM 1524 NH1 ARG A 97 40.962 43.370 -11.249 1.00 25.00 N ATOM 1525 NH2 ARG A 97 38.980 43.506 -12.300 1.00 25.00 N ATOM 0 H ARG A 97 43.263 38.571 -14.750 1.00 25.00 H new ATOM 0 HA ARG A 97 44.343 41.245 -15.105 1.00 25.00 H new ATOM 0 HB2 ARG A 97 43.946 39.491 -12.640 1.00 25.00 H new ATOM 0 HB3 ARG A 97 44.418 41.178 -12.600 1.00 25.00 H new ATOM 0 HG2 ARG A 97 41.793 40.164 -13.753 1.00 25.00 H new ATOM 0 HG3 ARG A 97 41.989 40.769 -12.120 1.00 25.00 H new ATOM 0 HD2 ARG A 97 42.819 42.957 -13.102 1.00 25.00 H new ATOM 0 HD3 ARG A 97 42.426 42.337 -14.693 1.00 25.00 H new ATOM 0 HE ARG A 97 40.130 42.590 -14.252 1.00 25.00 H new ATOM 0 HH11 ARG A 97 41.953 43.127 -11.247 1.00 25.00 H new ATOM 0 HH12 ARG A 97 40.529 43.754 -10.409 1.00 25.00 H new ATOM 0 HH21 ARG A 97 38.399 43.372 -13.128 1.00 25.00 H new ATOM 0 HH22 ARG A 97 38.572 43.888 -11.447 1.00 25.00 H new ATOM 1539 N GLN A 98 46.572 39.795 -15.601 1.00 25.00 N ATOM 1540 CA GLN A 98 48.008 39.487 -15.796 1.00 25.00 C ATOM 1541 C GLN A 98 48.388 38.068 -15.350 1.00 25.00 C ATOM 1542 O GLN A 98 48.823 37.231 -16.106 1.00 25.00 O ATOM 1543 CB GLN A 98 48.978 40.553 -15.210 1.00 25.00 C ATOM 1544 CG GLN A 98 48.719 41.966 -15.801 1.00 25.00 C ATOM 1545 CD GLN A 98 47.575 42.696 -15.121 1.00 25.00 C ATOM 1546 OE1 GLN A 98 46.629 43.159 -15.708 1.00 25.00 O ATOM 1547 NE2 GLN A 98 47.662 42.842 -13.808 1.00 25.00 N ATOM 1548 OXT GLN A 98 48.238 37.816 -14.093 1.00 25.00 O ATOM 0 H GLN A 98 46.073 39.855 -16.489 1.00 25.00 H new ATOM 0 HA GLN A 98 48.141 39.529 -16.877 1.00 25.00 H new ATOM 0 HB2 GLN A 98 48.866 40.588 -14.126 1.00 25.00 H new ATOM 0 HB3 GLN A 98 50.007 40.258 -15.415 1.00 25.00 H new ATOM 0 HG2 GLN A 98 49.627 42.563 -15.712 1.00 25.00 H new ATOM 0 HG3 GLN A 98 48.502 41.874 -16.865 1.00 25.00 H new ATOM 0 HE21 GLN A 98 48.459 42.454 -13.303 1.00 25.00 H new ATOM 0 HE22 GLN A 98 46.932 43.343 -13.301 1.00 25.00 H new TER 1558 GLN A 98