USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=15 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 -44:sc= 0.268 USER MOD Set 1.2: A 56 LYS NZ :NH3+ 157:sc= 0.257 (180deg=-0.0685) USER MOD Set 2.1: A 16 GLN : amide:sc= 0.614 K(o=2.6,f=1.4) USER MOD Set 2.2: A 91 LYS NZ :NH3+ 142:sc= 1.94 (180deg=0.632) USER MOD Single : A 1 SER N :NH3+ 175:sc= -0.121 (180deg=-0.129) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 GLN : amide:sc= -0.0616 X(o=-0.062,f=-0.062) USER MOD Single : A 4 SER OG : rot 180:sc= -0.102 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot -92:sc= 1.19 USER MOD Single : A 13 SER OG : rot -69:sc= 0.619 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.011 K(o=-0.011,f=-0.63) USER MOD Single : A 27 MET CE :methyl -179:sc= -0.255 (180deg=-0.256) USER MOD Single : A 31 ASN : amide:sc= -1.57 K(o=-1.6,f=-7.6!) USER MOD Single : A 33 HIS : no HD1:sc= -0.0255 X(o=-0.025,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 42 ASN : amide:sc= -0.706 K(o=-0.71,f=-4.2!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.16) USER MOD Single : A 65 GLN : amide:sc= 0.407 K(o=0.41,f=-3.8!) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= 0.353 X(o=0.35,f=-0.061) USER MOD Single : A 80 SER OG : rot 180:sc= -0.127 USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 1.131 4.007 -2.553 1.00 25.00 N ATOM 2 CA SER A 1 0.302 2.766 -2.577 1.00 25.00 C ATOM 3 C SER A 1 -1.098 2.951 -3.129 1.00 25.00 C ATOM 4 O SER A 1 -1.870 2.037 -3.309 1.00 25.00 O ATOM 5 CB SER A 1 0.198 2.220 -1.145 1.00 25.00 C ATOM 6 OG SER A 1 -0.393 3.226 -0.313 1.00 25.00 O ATOM 0 H1 SER A 1 2.038 3.809 -2.085 1.00 25.00 H new ATOM 0 H2 SER A 1 1.306 4.326 -3.527 1.00 25.00 H new ATOM 0 H3 SER A 1 0.627 4.751 -2.030 1.00 25.00 H new ATOM 0 HA SER A 1 0.806 2.075 -3.253 1.00 25.00 H new ATOM 0 HB2 SER A 1 -0.406 1.313 -1.129 1.00 25.00 H new ATOM 0 HB3 SER A 1 1.186 1.951 -0.770 1.00 25.00 H new ATOM 0 HG SER A 1 -0.467 2.890 0.605 1.00 25.00 H new ATOM 14 N GLN A 2 -1.430 4.216 -3.397 1.00 25.00 N ATOM 15 CA GLN A 2 -2.741 4.604 -3.903 1.00 25.00 C ATOM 16 C GLN A 2 -2.590 5.893 -4.698 1.00 25.00 C ATOM 17 O GLN A 2 -1.584 6.585 -4.554 1.00 25.00 O ATOM 18 CB GLN A 2 -3.725 4.808 -2.738 1.00 25.00 C ATOM 19 CG GLN A 2 -3.317 5.909 -1.752 1.00 25.00 C ATOM 20 CD GLN A 2 -4.299 6.046 -0.610 1.00 25.00 C ATOM 21 OE1 GLN A 2 -4.509 5.122 0.151 1.00 25.00 O ATOM 22 NE2 GLN A 2 -4.901 7.200 -0.489 1.00 25.00 N ATOM 0 H GLN A 2 -0.791 5.001 -3.267 1.00 25.00 H new ATOM 0 HA GLN A 2 -3.137 3.817 -4.545 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -4.707 5.047 -3.145 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -3.826 3.869 -2.194 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -2.327 5.688 -1.353 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -3.243 6.859 -2.281 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -4.699 7.952 -1.147 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -5.573 7.348 0.264 1.00 25.00 H new ATOM 31 N GLN A 3 -3.604 6.196 -5.509 1.00 25.00 N ATOM 32 CA GLN A 3 -3.690 7.398 -6.370 1.00 25.00 C ATOM 33 C GLN A 3 -2.664 7.514 -7.506 1.00 25.00 C ATOM 34 O GLN A 3 -3.033 7.883 -8.619 1.00 25.00 O ATOM 35 CB GLN A 3 -3.657 8.694 -5.537 1.00 25.00 C ATOM 36 CG GLN A 3 -4.768 8.806 -4.497 1.00 25.00 C ATOM 37 CD GLN A 3 -6.145 8.732 -5.115 1.00 25.00 C ATOM 38 OE1 GLN A 3 -6.785 7.697 -5.095 1.00 25.00 O ATOM 39 NE2 GLN A 3 -6.600 9.823 -5.675 1.00 25.00 N ATOM 0 H GLN A 3 -4.424 5.595 -5.595 1.00 25.00 H new ATOM 0 HA GLN A 3 -4.653 7.263 -6.862 1.00 25.00 H new ATOM 0 HB2 GLN A 3 -2.694 8.761 -5.030 1.00 25.00 H new ATOM 0 HB3 GLN A 3 -3.722 9.547 -6.213 1.00 25.00 H new ATOM 0 HG2 GLN A 3 -4.658 8.006 -3.764 1.00 25.00 H new ATOM 0 HG3 GLN A 3 -4.664 9.748 -3.959 1.00 25.00 H new ATOM 0 HE21 GLN A 3 -6.034 10.672 -5.672 1.00 25.00 H new ATOM 0 HE22 GLN A 3 -7.520 9.825 -6.115 1.00 25.00 H new ATOM 48 N SER A 4 -1.394 7.253 -7.242 1.00 25.00 N ATOM 49 CA SER A 4 -0.348 7.415 -8.247 1.00 25.00 C ATOM 50 C SER A 4 0.830 6.492 -7.981 1.00 25.00 C ATOM 51 O SER A 4 0.933 5.883 -6.915 1.00 25.00 O ATOM 52 CB SER A 4 0.154 8.864 -8.233 1.00 25.00 C ATOM 53 OG SER A 4 -0.919 9.766 -8.448 1.00 25.00 O ATOM 0 H SER A 4 -1.058 6.926 -6.336 1.00 25.00 H new ATOM 0 HA SER A 4 -0.777 7.163 -9.217 1.00 25.00 H new ATOM 0 HB2 SER A 4 0.632 9.080 -7.277 1.00 25.00 H new ATOM 0 HB3 SER A 4 0.911 9.000 -9.006 1.00 25.00 H new ATOM 0 HG SER A 4 -0.581 10.686 -8.434 1.00 25.00 H new ATOM 59 N HIS A 5 1.741 6.449 -8.941 1.00 25.00 N ATOM 60 CA HIS A 5 3.011 5.747 -8.800 1.00 25.00 C ATOM 61 C HIS A 5 4.079 6.842 -8.823 1.00 25.00 C ATOM 62 O HIS A 5 3.810 7.960 -8.393 1.00 25.00 O ATOM 63 CB HIS A 5 3.199 4.737 -9.941 1.00 25.00 C ATOM 64 CG HIS A 5 2.115 3.707 -10.005 1.00 25.00 C ATOM 65 ND1 HIS A 5 1.836 2.809 -9.003 1.00 25.00 N ATOM 66 CD2 HIS A 5 1.207 3.435 -10.983 1.00 25.00 C ATOM 67 CE1 HIS A 5 0.815 2.055 -9.392 1.00 25.00 C ATOM 68 NE2 HIS A 5 0.393 2.389 -10.594 1.00 25.00 N ATOM 0 H HIS A 5 1.621 6.903 -9.847 1.00 25.00 H new ATOM 0 HA HIS A 5 3.065 5.166 -7.879 1.00 25.00 H new ATOM 0 HB2 HIS A 5 3.237 5.273 -10.889 1.00 25.00 H new ATOM 0 HB3 HIS A 5 4.160 4.236 -9.819 1.00 25.00 H new ATOM 0 HD2 HIS A 5 1.134 3.960 -11.924 1.00 25.00 H new ATOM 0 HE1 HIS A 5 0.383 1.265 -8.796 1.00 25.00 H new ATOM 0 HE2 HIS A 5 -0.370 1.967 -11.123 1.00 25.00 H new ATOM 76 N SER A 6 5.255 6.550 -9.357 1.00 25.00 N ATOM 77 CA SER A 6 6.313 7.546 -9.474 1.00 25.00 C ATOM 78 C SER A 6 6.676 7.720 -10.941 1.00 25.00 C ATOM 79 O SER A 6 6.371 6.860 -11.769 1.00 25.00 O ATOM 80 CB SER A 6 7.540 7.091 -8.684 1.00 25.00 C ATOM 81 OG SER A 6 8.038 5.864 -9.190 1.00 25.00 O ATOM 0 H SER A 6 5.503 5.629 -9.718 1.00 25.00 H new ATOM 0 HA SER A 6 5.967 8.498 -9.071 1.00 25.00 H new ATOM 0 HB2 SER A 6 8.317 7.854 -8.738 1.00 25.00 H new ATOM 0 HB3 SER A 6 7.279 6.976 -7.632 1.00 25.00 H new ATOM 0 HG SER A 6 8.824 5.591 -8.672 1.00 25.00 H new ATOM 87 N SER A 7 7.333 8.822 -11.257 1.00 25.00 N ATOM 88 CA SER A 7 7.835 9.079 -12.599 1.00 25.00 C ATOM 89 C SER A 7 9.125 9.845 -12.370 1.00 25.00 C ATOM 90 O SER A 7 9.169 10.690 -11.478 1.00 25.00 O ATOM 91 CB SER A 7 6.844 9.916 -13.404 1.00 25.00 C ATOM 92 OG SER A 7 5.619 9.211 -13.543 1.00 25.00 O ATOM 0 H SER A 7 7.535 9.567 -10.590 1.00 25.00 H new ATOM 0 HA SER A 7 7.986 8.162 -13.169 1.00 25.00 H new ATOM 0 HB2 SER A 7 6.671 10.870 -12.906 1.00 25.00 H new ATOM 0 HB3 SER A 7 7.258 10.141 -14.387 1.00 25.00 H new ATOM 0 HG SER A 7 4.986 9.753 -14.059 1.00 25.00 H new ATOM 98 N PRO A 8 10.200 9.510 -13.097 1.00 25.00 N ATOM 99 CA PRO A 8 11.447 10.186 -12.749 1.00 25.00 C ATOM 100 C PRO A 8 11.546 11.605 -13.296 1.00 25.00 C ATOM 101 O PRO A 8 10.760 12.024 -14.149 1.00 25.00 O ATOM 102 CB PRO A 8 12.498 9.277 -13.373 1.00 25.00 C ATOM 103 CG PRO A 8 11.849 8.785 -14.596 1.00 25.00 C ATOM 104 CD PRO A 8 10.413 8.531 -14.179 1.00 25.00 C ATOM 0 HA PRO A 8 11.553 10.323 -11.673 1.00 25.00 H new ATOM 0 HB2 PRO A 8 13.416 9.821 -13.597 1.00 25.00 H new ATOM 0 HB3 PRO A 8 12.767 8.459 -12.705 1.00 25.00 H new ATOM 0 HG2 PRO A 8 11.906 9.519 -15.400 1.00 25.00 H new ATOM 0 HG3 PRO A 8 12.325 7.875 -14.961 1.00 25.00 H new ATOM 0 HD2 PRO A 8 9.720 8.687 -15.006 1.00 25.00 H new ATOM 0 HD3 PRO A 8 10.269 7.508 -13.831 1.00 25.00 H new ATOM 112 N GLY A 9 12.522 12.332 -12.782 1.00 25.00 N ATOM 113 CA GLY A 9 12.749 13.711 -13.169 1.00 25.00 C ATOM 114 C GLY A 9 14.210 14.086 -13.043 1.00 25.00 C ATOM 115 O GLY A 9 14.554 14.994 -12.308 1.00 25.00 O ATOM 0 H GLY A 9 13.179 11.982 -12.085 1.00 25.00 H new ATOM 0 HA2 GLY A 9 12.421 13.861 -14.198 1.00 25.00 H new ATOM 0 HA3 GLY A 9 12.147 14.370 -12.543 1.00 25.00 H new ATOM 119 N GLU A 10 15.076 13.372 -13.746 1.00 25.00 N ATOM 120 CA GLU A 10 16.532 13.593 -13.698 1.00 25.00 C ATOM 121 C GLU A 10 16.985 14.863 -14.448 1.00 25.00 C ATOM 122 O GLU A 10 18.030 14.879 -15.087 1.00 25.00 O ATOM 123 CB GLU A 10 17.258 12.383 -14.309 1.00 25.00 C ATOM 124 CG GLU A 10 16.850 11.025 -13.724 1.00 25.00 C ATOM 125 CD GLU A 10 15.793 10.297 -14.554 1.00 25.00 C ATOM 126 OE1 GLU A 10 14.941 10.965 -15.187 1.00 25.00 O ATOM 127 OE2 GLU A 10 15.786 9.047 -14.529 1.00 25.00 O ATOM 0 H GLU A 10 14.797 12.617 -14.372 1.00 25.00 H new ATOM 0 HA GLU A 10 16.787 13.724 -12.646 1.00 25.00 H new ATOM 0 HB2 GLU A 10 17.073 12.370 -15.383 1.00 25.00 H new ATOM 0 HB3 GLU A 10 18.331 12.514 -14.172 1.00 25.00 H new ATOM 0 HG2 GLU A 10 17.734 10.393 -13.641 1.00 25.00 H new ATOM 0 HG3 GLU A 10 16.469 11.173 -12.714 1.00 25.00 H new ATOM 134 N ILE A 11 16.176 15.914 -14.401 1.00 25.00 N ATOM 135 CA ILE A 11 16.402 17.132 -15.115 1.00 25.00 C ATOM 136 C ILE A 11 17.371 18.002 -14.332 1.00 25.00 C ATOM 137 O ILE A 11 17.988 18.956 -14.826 1.00 25.00 O ATOM 138 CB ILE A 11 14.994 17.768 -15.290 1.00 25.00 C ATOM 139 CG1 ILE A 11 14.116 16.875 -16.201 1.00 25.00 C ATOM 140 CG2 ILE A 11 15.093 19.123 -15.810 1.00 25.00 C ATOM 141 CD1 ILE A 11 12.630 17.276 -16.251 1.00 25.00 C ATOM 0 H ILE A 11 15.322 15.927 -13.843 1.00 25.00 H new ATOM 0 HA ILE A 11 16.863 16.991 -16.092 1.00 25.00 H new ATOM 0 HB ILE A 11 14.517 17.832 -14.312 1.00 25.00 H new ATOM 0 HG12 ILE A 11 14.520 16.902 -17.213 1.00 25.00 H new ATOM 0 HG13 ILE A 11 14.189 15.844 -15.856 1.00 25.00 H new ATOM 0 HG21 ILE A 11 14.094 19.543 -15.922 1.00 25.00 H new ATOM 0 HG22 ILE A 11 15.669 19.737 -15.118 1.00 25.00 H new ATOM 0 HG23 ILE A 11 15.590 19.105 -16.780 1.00 25.00 H new ATOM 0 HD11 ILE A 11 12.092 16.597 -16.912 1.00 25.00 H new ATOM 0 HD12 ILE A 11 12.204 17.220 -15.249 1.00 25.00 H new ATOM 0 HD13 ILE A 11 12.541 18.295 -16.627 1.00 25.00 H new ATOM 153 N THR A 12 17.533 17.573 -13.107 1.00 25.00 N ATOM 154 CA THR A 12 18.402 18.207 -12.124 1.00 25.00 C ATOM 155 C THR A 12 19.864 18.157 -12.560 1.00 25.00 C ATOM 156 O THR A 12 20.545 17.139 -12.439 1.00 25.00 O ATOM 157 CB THR A 12 18.262 17.516 -10.761 1.00 25.00 C ATOM 158 OG1 THR A 12 17.373 16.399 -10.884 1.00 25.00 O ATOM 159 CG2 THR A 12 17.696 18.465 -9.728 1.00 25.00 C ATOM 0 H THR A 12 17.053 16.748 -12.746 1.00 25.00 H new ATOM 0 HA THR A 12 18.095 19.250 -12.042 1.00 25.00 H new ATOM 0 HB THR A 12 19.252 17.189 -10.442 1.00 25.00 H new ATOM 0 HG1 THR A 12 16.460 16.683 -10.670 1.00 25.00 H new ATOM 0 HG21 THR A 12 17.607 17.950 -8.771 1.00 25.00 H new ATOM 0 HG22 THR A 12 18.360 19.322 -9.619 1.00 25.00 H new ATOM 0 HG23 THR A 12 16.712 18.807 -10.049 1.00 25.00 H new ATOM 167 N SER A 13 20.331 19.270 -13.094 1.00 25.00 N ATOM 168 CA SER A 13 21.674 19.387 -13.643 1.00 25.00 C ATOM 169 C SER A 13 22.070 20.852 -13.515 1.00 25.00 C ATOM 170 O SER A 13 21.282 21.631 -12.991 1.00 25.00 O ATOM 171 CB SER A 13 21.662 18.951 -15.112 1.00 25.00 C ATOM 172 OG SER A 13 20.660 19.644 -15.832 1.00 25.00 O ATOM 0 H SER A 13 19.785 20.129 -13.161 1.00 25.00 H new ATOM 0 HA SER A 13 22.386 18.753 -13.115 1.00 25.00 H new ATOM 0 HB2 SER A 13 22.637 19.142 -15.561 1.00 25.00 H new ATOM 0 HB3 SER A 13 21.486 17.877 -15.176 1.00 25.00 H new ATOM 0 HG SER A 13 19.776 19.341 -15.537 1.00 25.00 H new ATOM 178 N SER A 14 23.276 21.186 -13.975 1.00 25.00 N ATOM 179 CA SER A 14 23.850 22.552 -13.983 1.00 25.00 C ATOM 180 C SER A 14 23.038 23.691 -13.341 1.00 25.00 C ATOM 181 O SER A 14 22.466 24.509 -14.033 1.00 25.00 O ATOM 182 CB SER A 14 24.124 22.926 -15.437 1.00 25.00 C ATOM 183 OG SER A 14 24.778 21.851 -16.098 1.00 25.00 O ATOM 0 H SER A 14 23.912 20.493 -14.370 1.00 25.00 H new ATOM 0 HA SER A 14 24.732 22.476 -13.347 1.00 25.00 H new ATOM 0 HB2 SER A 14 23.188 23.160 -15.944 1.00 25.00 H new ATOM 0 HB3 SER A 14 24.743 23.822 -15.481 1.00 25.00 H new ATOM 0 HG SER A 14 24.950 22.097 -17.031 1.00 25.00 H new ATOM 189 N PRO A 15 22.997 23.764 -11.999 1.00 25.00 N ATOM 190 CA PRO A 15 22.172 24.780 -11.327 1.00 25.00 C ATOM 191 C PRO A 15 22.753 26.178 -11.322 1.00 25.00 C ATOM 192 O PRO A 15 22.184 27.107 -10.752 1.00 25.00 O ATOM 193 CB PRO A 15 22.134 24.266 -9.906 1.00 25.00 C ATOM 194 CG PRO A 15 23.426 23.600 -9.719 1.00 25.00 C ATOM 195 CD PRO A 15 23.665 22.890 -11.018 1.00 25.00 C ATOM 0 HA PRO A 15 21.214 24.892 -11.834 1.00 25.00 H new ATOM 0 HB2 PRO A 15 22.001 25.080 -9.193 1.00 25.00 H new ATOM 0 HB3 PRO A 15 21.306 23.573 -9.757 1.00 25.00 H new ATOM 0 HG2 PRO A 15 24.217 24.319 -9.506 1.00 25.00 H new ATOM 0 HG3 PRO A 15 23.397 22.901 -8.883 1.00 25.00 H new ATOM 0 HD2 PRO A 15 24.729 22.783 -11.230 1.00 25.00 H new ATOM 0 HD3 PRO A 15 23.239 21.887 -11.014 1.00 25.00 H new ATOM 203 N GLN A 16 23.957 26.253 -11.851 1.00 25.00 N ATOM 204 CA GLN A 16 24.806 27.444 -11.919 1.00 25.00 C ATOM 205 C GLN A 16 25.370 27.873 -10.565 1.00 25.00 C ATOM 206 O GLN A 16 26.478 28.381 -10.487 1.00 25.00 O ATOM 207 CB GLN A 16 24.106 28.606 -12.615 1.00 25.00 C ATOM 208 CG GLN A 16 25.089 29.464 -13.378 1.00 25.00 C ATOM 209 CD GLN A 16 24.481 30.744 -13.896 1.00 25.00 C ATOM 210 OE1 GLN A 16 23.328 30.795 -14.256 1.00 25.00 O ATOM 211 NE2 GLN A 16 25.271 31.783 -13.942 1.00 25.00 N ATOM 0 H GLN A 16 24.404 25.439 -12.273 1.00 25.00 H new ATOM 0 HA GLN A 16 25.662 27.151 -12.527 1.00 25.00 H new ATOM 0 HB2 GLN A 16 23.350 28.220 -13.299 1.00 25.00 H new ATOM 0 HB3 GLN A 16 23.586 29.215 -11.876 1.00 25.00 H new ATOM 0 HG2 GLN A 16 25.931 29.705 -12.729 1.00 25.00 H new ATOM 0 HG3 GLN A 16 25.486 28.892 -14.217 1.00 25.00 H new ATOM 0 HE21 GLN A 16 26.239 31.702 -13.630 1.00 25.00 H new ATOM 0 HE22 GLN A 16 24.920 32.675 -14.290 1.00 25.00 H new ATOM 220 N GLY A 17 24.658 27.587 -9.488 1.00 25.00 N ATOM 221 CA GLY A 17 25.157 27.890 -8.158 1.00 25.00 C ATOM 222 C GLY A 17 26.414 27.109 -7.807 1.00 25.00 C ATOM 223 O GLY A 17 27.240 27.583 -7.032 1.00 25.00 O ATOM 0 H GLY A 17 23.738 27.148 -9.508 1.00 25.00 H new ATOM 0 HA2 GLY A 17 25.367 28.957 -8.088 1.00 25.00 H new ATOM 0 HA3 GLY A 17 24.381 27.669 -7.425 1.00 25.00 H new ATOM 227 N LEU A 18 26.582 25.927 -8.391 1.00 25.00 N ATOM 228 CA LEU A 18 27.791 25.132 -8.150 1.00 25.00 C ATOM 229 C LEU A 18 28.846 25.426 -9.199 1.00 25.00 C ATOM 230 O LEU A 18 30.036 25.294 -8.950 1.00 25.00 O ATOM 231 CB LEU A 18 27.463 23.635 -8.065 1.00 25.00 C ATOM 232 CG LEU A 18 27.282 22.783 -9.333 1.00 25.00 C ATOM 233 CD1 LEU A 18 28.613 22.317 -9.904 1.00 25.00 C ATOM 234 CD2 LEU A 18 26.457 21.562 -8.974 1.00 25.00 C ATOM 0 H LEU A 18 25.909 25.499 -9.027 1.00 25.00 H new ATOM 0 HA LEU A 18 28.204 25.421 -7.184 1.00 25.00 H new ATOM 0 HB2 LEU A 18 28.255 23.169 -7.479 1.00 25.00 H new ATOM 0 HB3 LEU A 18 26.544 23.544 -7.487 1.00 25.00 H new ATOM 0 HG LEU A 18 26.789 23.396 -10.087 1.00 25.00 H new ATOM 0 HD11 LEU A 18 28.436 21.719 -10.798 1.00 25.00 H new ATOM 0 HD12 LEU A 18 29.222 23.184 -10.162 1.00 25.00 H new ATOM 0 HD13 LEU A 18 29.136 21.714 -9.162 1.00 25.00 H new ATOM 0 HD21 LEU A 18 26.317 20.944 -9.861 1.00 25.00 H new ATOM 0 HD22 LEU A 18 26.975 20.985 -8.208 1.00 25.00 H new ATOM 0 HD23 LEU A 18 25.485 21.878 -8.595 1.00 25.00 H new ATOM 246 N ASP A 19 28.384 25.803 -10.377 1.00 25.00 N ATOM 247 CA ASP A 19 29.251 26.020 -11.528 1.00 25.00 C ATOM 248 C ASP A 19 29.947 27.374 -11.409 1.00 25.00 C ATOM 249 O ASP A 19 31.079 27.565 -11.847 1.00 25.00 O ATOM 250 CB ASP A 19 28.390 25.959 -12.787 1.00 25.00 C ATOM 251 CG ASP A 19 27.555 24.683 -12.854 1.00 25.00 C ATOM 252 OD1 ASP A 19 28.044 23.665 -13.373 1.00 25.00 O ATOM 253 OD2 ASP A 19 26.414 24.692 -12.315 1.00 25.00 O ATOM 0 H ASP A 19 27.395 25.969 -10.566 1.00 25.00 H new ATOM 0 HA ASP A 19 30.024 25.253 -11.575 1.00 25.00 H new ATOM 0 HB2 ASP A 19 27.729 26.825 -12.815 1.00 25.00 H new ATOM 0 HB3 ASP A 19 29.031 26.018 -13.667 1.00 25.00 H new ATOM 258 N ASN A 20 29.267 28.298 -10.747 1.00 25.00 N ATOM 259 CA ASN A 20 29.806 29.611 -10.431 1.00 25.00 C ATOM 260 C ASN A 20 29.604 29.865 -8.939 1.00 25.00 C ATOM 261 O ASN A 20 28.732 30.637 -8.529 1.00 25.00 O ATOM 262 CB ASN A 20 29.071 30.691 -11.226 1.00 25.00 C ATOM 263 CG ASN A 20 29.565 30.833 -12.641 1.00 25.00 C ATOM 264 OD1 ASN A 20 28.835 30.597 -13.593 1.00 25.00 O ATOM 265 ND2 ASN A 20 30.777 31.299 -12.788 1.00 25.00 N ATOM 0 H ASN A 20 28.315 28.155 -10.411 1.00 25.00 H new ATOM 0 HA ASN A 20 30.864 29.644 -10.689 1.00 25.00 H new ATOM 0 HB2 ASN A 20 28.006 30.458 -11.243 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.180 31.647 -10.713 1.00 25.00 H new ATOM 0 HD21 ASN A 20 31.145 31.479 -13.722 1.00 25.00 H new ATOM 0 HD22 ASN A 20 31.355 31.483 -11.968 1.00 25.00 H new ATOM 272 N PRO A 21 30.437 29.242 -8.101 1.00 25.00 N ATOM 273 CA PRO A 21 30.260 29.393 -6.659 1.00 25.00 C ATOM 274 C PRO A 21 30.611 30.777 -6.162 1.00 25.00 C ATOM 275 O PRO A 21 30.104 31.213 -5.148 1.00 25.00 O ATOM 276 CB PRO A 21 31.214 28.351 -6.097 1.00 25.00 C ATOM 277 CG PRO A 21 32.258 28.230 -7.092 1.00 25.00 C ATOM 278 CD PRO A 21 31.577 28.364 -8.408 1.00 25.00 C ATOM 0 HA PRO A 21 29.222 29.259 -6.353 1.00 25.00 H new ATOM 0 HB2 PRO A 21 31.619 28.664 -5.135 1.00 25.00 H new ATOM 0 HB3 PRO A 21 30.709 27.399 -5.936 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.014 29.004 -6.962 1.00 25.00 H new ATOM 0 HG3 PRO A 21 32.767 27.270 -7.011 1.00 25.00 H new ATOM 0 HD2 PRO A 21 32.233 28.802 -9.160 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.251 27.398 -8.794 1.00 25.00 H new ATOM 286 N ALA A 22 31.457 31.484 -6.894 1.00 25.00 N ATOM 287 CA ALA A 22 31.801 32.847 -6.526 1.00 25.00 C ATOM 288 C ALA A 22 30.564 33.732 -6.643 1.00 25.00 C ATOM 289 O ALA A 22 30.319 34.564 -5.784 1.00 25.00 O ATOM 290 CB ALA A 22 32.927 33.367 -7.412 1.00 25.00 C ATOM 0 H ALA A 22 31.914 31.140 -7.739 1.00 25.00 H new ATOM 0 HA ALA A 22 32.151 32.866 -5.494 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.174 34.389 -7.125 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.806 32.734 -7.292 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.607 33.350 -8.454 1.00 25.00 H new ATOM 296 N LEU A 23 29.770 33.516 -7.687 1.00 25.00 N ATOM 297 CA LEU A 23 28.550 34.300 -7.886 1.00 25.00 C ATOM 298 C LEU A 23 27.521 33.930 -6.829 1.00 25.00 C ATOM 299 O LEU A 23 26.843 34.794 -6.296 1.00 25.00 O ATOM 300 CB LEU A 23 27.948 34.071 -9.283 1.00 25.00 C ATOM 301 CG LEU A 23 28.812 34.430 -10.509 1.00 25.00 C ATOM 302 CD1 LEU A 23 27.998 34.207 -11.789 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.309 35.860 -10.476 1.00 25.00 C ATOM 0 H LEU A 23 29.945 32.812 -8.404 1.00 25.00 H new ATOM 0 HA LEU A 23 28.816 35.353 -7.798 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.677 33.018 -9.362 1.00 25.00 H new ATOM 0 HB3 LEU A 23 27.023 34.644 -9.347 1.00 25.00 H new ATOM 0 HG LEU A 23 29.687 33.781 -10.488 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.607 34.460 -12.656 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.696 33.161 -11.851 1.00 25.00 H new ATOM 0 HD13 LEU A 23 27.111 34.840 -11.771 1.00 25.00 H new ATOM 0 HD21 LEU A 23 29.911 36.056 -11.363 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.458 36.541 -10.457 1.00 25.00 H new ATOM 0 HD23 LEU A 23 29.916 36.014 -9.584 1.00 25.00 H new ATOM 315 N LEU A 24 27.420 32.648 -6.498 1.00 25.00 N ATOM 316 CA LEU A 24 26.484 32.223 -5.460 1.00 25.00 C ATOM 317 C LEU A 24 26.890 32.801 -4.108 1.00 25.00 C ATOM 318 O LEU A 24 26.056 33.325 -3.385 1.00 25.00 O ATOM 319 CB LEU A 24 26.408 30.695 -5.370 1.00 25.00 C ATOM 320 CG LEU A 24 25.452 30.169 -4.280 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.045 30.757 -4.393 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.374 28.664 -4.339 1.00 25.00 C ATOM 0 H LEU A 24 27.963 31.896 -6.923 1.00 25.00 H new ATOM 0 HA LEU A 24 25.497 32.600 -5.730 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.091 30.301 -6.336 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.407 30.304 -5.179 1.00 25.00 H new ATOM 0 HG LEU A 24 25.863 30.487 -3.322 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.416 30.351 -3.601 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.095 31.842 -4.297 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.619 30.498 -5.362 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.696 28.304 -3.565 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.004 28.357 -5.317 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.366 28.242 -4.178 1.00 25.00 H new ATOM 334 N ARG A 25 28.177 32.748 -3.793 1.00 25.00 N ATOM 335 CA ARG A 25 28.700 33.339 -2.565 1.00 25.00 C ATOM 336 C ARG A 25 28.334 34.812 -2.524 1.00 25.00 C ATOM 337 O ARG A 25 27.901 35.316 -1.506 1.00 25.00 O ATOM 338 CB ARG A 25 30.226 33.184 -2.537 1.00 25.00 C ATOM 339 CG ARG A 25 30.914 33.742 -1.293 1.00 25.00 C ATOM 340 CD ARG A 25 32.261 34.353 -1.647 1.00 25.00 C ATOM 341 NE ARG A 25 32.097 35.544 -2.503 1.00 25.00 N ATOM 342 CZ ARG A 25 32.988 36.520 -2.655 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.142 36.513 -2.031 1.00 25.00 N ATOM 344 NH2 ARG A 25 32.713 37.526 -3.438 1.00 25.00 N ATOM 0 H ARG A 25 28.884 32.299 -4.375 1.00 25.00 H new ATOM 0 HA ARG A 25 28.270 32.834 -1.700 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.469 32.125 -2.623 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.642 33.679 -3.415 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.279 34.496 -0.828 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.052 32.946 -0.561 1.00 25.00 H new ATOM 0 HD2 ARG A 25 32.790 34.628 -0.734 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.875 33.614 -2.161 1.00 25.00 H new ATOM 0 HE ARG A 25 31.224 35.626 -3.024 1.00 25.00 H new ATOM 0 HH11 ARG A 25 34.379 35.743 -1.406 1.00 25.00 H new ATOM 0 HH12 ARG A 25 34.802 37.278 -2.171 1.00 25.00 H new ATOM 0 HH21 ARG A 25 31.820 37.561 -3.929 1.00 25.00 H new ATOM 0 HH22 ARG A 25 33.391 38.278 -3.559 1.00 25.00 H new ATOM 358 N ASP A 26 28.516 35.499 -3.635 1.00 25.00 N ATOM 359 CA ASP A 26 28.245 36.929 -3.700 1.00 25.00 C ATOM 360 C ASP A 26 26.758 37.246 -3.514 1.00 25.00 C ATOM 361 O ASP A 26 26.396 38.132 -2.748 1.00 25.00 O ATOM 362 CB ASP A 26 28.736 37.464 -5.036 1.00 25.00 C ATOM 363 CG ASP A 26 29.243 38.875 -4.932 1.00 25.00 C ATOM 364 OD1 ASP A 26 30.396 39.024 -4.461 1.00 25.00 O ATOM 365 OD2 ASP A 26 28.531 39.821 -5.314 1.00 25.00 O ATOM 0 H ASP A 26 28.851 35.093 -4.509 1.00 25.00 H new ATOM 0 HA ASP A 26 28.776 37.415 -2.881 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.532 36.821 -5.412 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.924 37.424 -5.762 1.00 25.00 H new ATOM 370 N MET A 27 25.902 36.463 -4.162 1.00 25.00 N ATOM 371 CA MET A 27 24.449 36.619 -4.031 1.00 25.00 C ATOM 372 C MET A 27 24.051 36.428 -2.584 1.00 25.00 C ATOM 373 O MET A 27 23.326 37.228 -2.012 1.00 25.00 O ATOM 374 CB MET A 27 23.737 35.571 -4.899 1.00 25.00 C ATOM 375 CG MET A 27 22.214 35.714 -4.967 1.00 25.00 C ATOM 376 SD MET A 27 21.280 35.178 -3.490 1.00 25.00 S ATOM 377 CE MET A 27 21.461 33.376 -3.537 1.00 25.00 C ATOM 0 H MET A 27 26.187 35.709 -4.787 1.00 25.00 H new ATOM 0 HA MET A 27 24.161 37.617 -4.361 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.138 35.627 -5.911 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.977 34.579 -4.515 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.977 36.760 -5.159 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.855 35.143 -5.824 1.00 25.00 H new ATOM 0 HE1 MET A 27 20.921 32.934 -2.699 1.00 25.00 H new ATOM 0 HE2 MET A 27 21.054 32.994 -4.473 1.00 25.00 H new ATOM 0 HE3 MET A 27 22.517 33.114 -3.467 1.00 25.00 H new ATOM 387 N LEU A 28 24.551 35.356 -1.996 1.00 25.00 N ATOM 388 CA LEU A 28 24.255 35.018 -0.612 1.00 25.00 C ATOM 389 C LEU A 28 24.715 36.102 0.347 1.00 25.00 C ATOM 390 O LEU A 28 23.998 36.457 1.270 1.00 25.00 O ATOM 391 CB LEU A 28 24.939 33.723 -0.253 1.00 25.00 C ATOM 392 CG LEU A 28 24.221 32.467 -0.732 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.174 31.338 -0.625 1.00 25.00 C ATOM 394 CD2 LEU A 28 22.984 32.197 0.096 1.00 25.00 C ATOM 0 H LEU A 28 25.173 34.695 -2.462 1.00 25.00 H new ATOM 0 HA LEU A 28 23.173 34.920 -0.520 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.945 33.732 -0.672 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.045 33.673 0.831 1.00 25.00 H new ATOM 0 HG LEU A 28 23.893 32.596 -1.764 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.691 30.421 -0.961 1.00 25.00 H new ATOM 0 HD12 LEU A 28 26.046 31.538 -1.248 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.488 31.224 0.413 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.492 31.295 -0.268 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.267 32.059 1.139 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.300 33.042 0.014 1.00 25.00 H new ATOM 406 N LEU A 29 25.901 36.645 0.118 1.00 25.00 N ATOM 407 CA LEU A 29 26.437 37.709 0.976 1.00 25.00 C ATOM 408 C LEU A 29 25.546 38.944 0.916 1.00 25.00 C ATOM 409 O LEU A 29 25.338 39.626 1.917 1.00 25.00 O ATOM 410 CB LEU A 29 27.857 38.094 0.536 1.00 25.00 C ATOM 411 CG LEU A 29 28.992 37.150 0.966 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.250 37.446 0.151 1.00 25.00 C ATOM 413 CD2 LEU A 29 29.293 37.282 2.459 1.00 25.00 C ATOM 0 H LEU A 29 26.514 36.373 -0.650 1.00 25.00 H new ATOM 0 HA LEU A 29 26.465 37.331 1.998 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.868 38.167 -0.552 1.00 25.00 H new ATOM 0 HB3 LEU A 29 28.076 39.089 0.924 1.00 25.00 H new ATOM 0 HG LEU A 29 28.669 36.126 0.779 1.00 25.00 H new ATOM 0 HD11 LEU A 29 31.050 36.774 0.460 1.00 25.00 H new ATOM 0 HD12 LEU A 29 30.041 37.297 -0.908 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.558 38.478 0.319 1.00 25.00 H new ATOM 0 HD21 LEU A 29 30.100 36.601 2.729 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.593 38.306 2.680 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.401 37.033 3.033 1.00 25.00 H new ATOM 425 N ALA A 30 25.019 39.217 -0.266 1.00 25.00 N ATOM 426 CA ALA A 30 24.157 40.371 -0.483 1.00 25.00 C ATOM 427 C ALA A 30 22.709 40.123 -0.027 1.00 25.00 C ATOM 428 O ALA A 30 21.917 41.063 0.065 1.00 25.00 O ATOM 429 CB ALA A 30 24.179 40.745 -1.973 1.00 25.00 C ATOM 0 H ALA A 30 25.174 38.649 -1.099 1.00 25.00 H new ATOM 0 HA ALA A 30 24.544 41.191 0.122 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.535 41.608 -2.141 1.00 25.00 H new ATOM 0 HB2 ALA A 30 25.198 40.989 -2.272 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.819 39.903 -2.565 1.00 25.00 H new ATOM 435 N ASN A 31 22.346 38.867 0.204 1.00 25.00 N ATOM 436 CA ASN A 31 20.959 38.515 0.510 1.00 25.00 C ATOM 437 C ASN A 31 20.771 38.115 1.976 1.00 25.00 C ATOM 438 O ASN A 31 21.034 36.971 2.357 1.00 25.00 O ATOM 439 CB ASN A 31 20.515 37.370 -0.397 1.00 25.00 C ATOM 440 CG ASN A 31 19.026 37.192 -0.409 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.353 37.332 0.612 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.497 36.875 -1.556 1.00 25.00 N ATOM 0 H ASN A 31 22.989 38.075 0.186 1.00 25.00 H new ATOM 0 HA ASN A 31 20.346 39.399 0.333 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.863 37.559 -1.412 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.986 36.444 -0.065 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.490 36.733 -1.631 1.00 25.00 H new ATOM 0 HD22 ASN A 31 19.090 36.768 -2.379 1.00 25.00 H new ATOM 449 N PRO A 32 20.271 39.036 2.817 1.00 25.00 N ATOM 450 CA PRO A 32 20.157 38.693 4.238 1.00 25.00 C ATOM 451 C PRO A 32 19.162 37.574 4.562 1.00 25.00 C ATOM 452 O PRO A 32 19.301 36.897 5.577 1.00 25.00 O ATOM 453 CB PRO A 32 19.731 40.020 4.873 1.00 25.00 C ATOM 454 CG PRO A 32 19.021 40.735 3.780 1.00 25.00 C ATOM 455 CD PRO A 32 19.822 40.419 2.564 1.00 25.00 C ATOM 0 HA PRO A 32 21.094 38.285 4.616 1.00 25.00 H new ATOM 0 HB2 PRO A 32 19.080 39.860 5.733 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.592 40.587 5.227 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.992 40.391 3.681 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.982 41.809 3.965 1.00 25.00 H new ATOM 0 HD2 PRO A 32 19.223 40.490 1.656 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.663 41.102 2.445 1.00 25.00 H new ATOM 463 N HIS A 33 18.161 37.370 3.718 1.00 25.00 N ATOM 464 CA HIS A 33 17.186 36.306 3.946 1.00 25.00 C ATOM 465 C HIS A 33 17.773 34.941 3.596 1.00 25.00 C ATOM 466 O HIS A 33 17.579 33.957 4.308 1.00 25.00 O ATOM 467 CB HIS A 33 15.938 36.556 3.093 1.00 25.00 C ATOM 468 CG HIS A 33 14.833 35.579 3.348 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.816 35.778 4.247 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.586 34.356 2.797 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.018 34.715 4.213 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.440 33.816 3.348 1.00 25.00 N ATOM 0 H HIS A 33 18.001 37.921 2.875 1.00 25.00 H new ATOM 0 HA HIS A 33 16.920 36.309 5.003 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.572 37.564 3.286 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.214 36.513 2.039 1.00 25.00 H new ATOM 0 HD2 HIS A 33 15.195 33.881 2.043 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.132 34.603 4.820 1.00 25.00 H new ATOM 0 HE2 HIS A 33 13.013 32.915 3.132 1.00 25.00 H new ATOM 480 N GLU A 34 18.477 34.885 2.479 1.00 25.00 N ATOM 481 CA GLU A 34 18.998 33.621 1.969 1.00 25.00 C ATOM 482 C GLU A 34 20.183 33.184 2.814 1.00 25.00 C ATOM 483 O GLU A 34 20.302 32.031 3.191 1.00 25.00 O ATOM 484 CB GLU A 34 19.409 33.788 0.510 1.00 25.00 C ATOM 485 CG GLU A 34 18.481 33.106 -0.491 1.00 25.00 C ATOM 486 CD GLU A 34 18.628 31.585 -0.514 1.00 25.00 C ATOM 487 OE1 GLU A 34 19.656 31.061 -0.034 1.00 25.00 O ATOM 488 OE2 GLU A 34 17.711 30.916 -1.031 1.00 25.00 O ATOM 0 H GLU A 34 18.703 35.698 1.905 1.00 25.00 H new ATOM 0 HA GLU A 34 18.226 32.854 2.026 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.454 34.852 0.278 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.416 33.391 0.382 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.449 33.361 -0.250 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.682 33.498 -1.488 1.00 25.00 H new ATOM 495 N LEU A 35 21.014 34.131 3.204 1.00 25.00 N ATOM 496 CA LEU A 35 22.136 33.826 4.081 1.00 25.00 C ATOM 497 C LEU A 35 21.633 33.289 5.426 1.00 25.00 C ATOM 498 O LEU A 35 22.308 32.502 6.081 1.00 25.00 O ATOM 499 CB LEU A 35 23.034 35.041 4.203 1.00 25.00 C ATOM 500 CG LEU A 35 22.822 36.177 5.203 1.00 25.00 C ATOM 501 CD1 LEU A 35 23.056 35.820 6.661 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.807 37.234 4.770 1.00 25.00 C ATOM 0 H LEU A 35 20.938 35.111 2.932 1.00 25.00 H new ATOM 0 HA LEU A 35 22.745 33.030 3.653 1.00 25.00 H new ATOM 0 HB2 LEU A 35 24.037 34.657 4.390 1.00 25.00 H new ATOM 0 HB3 LEU A 35 23.049 35.506 3.217 1.00 25.00 H new ATOM 0 HG LEU A 35 21.776 36.484 5.183 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.878 36.697 7.283 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.373 35.022 6.954 1.00 25.00 H new ATOM 0 HD13 LEU A 35 24.085 35.484 6.793 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.730 38.096 5.432 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.818 36.830 4.817 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.586 37.541 3.748 1.00 25.00 H new ATOM 514 N SER A 36 20.442 33.724 5.822 1.00 25.00 N ATOM 515 CA SER A 36 19.818 33.308 7.075 1.00 25.00 C ATOM 516 C SER A 36 19.280 31.884 6.981 1.00 25.00 C ATOM 517 O SER A 36 19.470 31.087 7.890 1.00 25.00 O ATOM 518 CB SER A 36 18.683 34.261 7.454 1.00 25.00 C ATOM 519 OG SER A 36 18.200 33.974 8.754 1.00 25.00 O ATOM 0 H SER A 36 19.878 34.379 5.280 1.00 25.00 H new ATOM 0 HA SER A 36 20.586 33.338 7.848 1.00 25.00 H new ATOM 0 HB2 SER A 36 19.037 35.291 7.412 1.00 25.00 H new ATOM 0 HB3 SER A 36 17.871 34.173 6.732 1.00 25.00 H new ATOM 0 HG SER A 36 17.476 34.595 8.978 1.00 25.00 H new ATOM 525 N LEU A 37 18.647 31.531 5.870 1.00 25.00 N ATOM 526 CA LEU A 37 18.164 30.161 5.702 1.00 25.00 C ATOM 527 C LEU A 37 19.324 29.247 5.594 1.00 25.00 C ATOM 528 O LEU A 37 19.274 28.108 6.008 1.00 25.00 O ATOM 529 CB LEU A 37 17.244 30.025 4.503 1.00 25.00 C ATOM 530 CG LEU A 37 17.639 30.043 3.018 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.287 28.758 2.552 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.366 30.292 2.208 1.00 25.00 C ATOM 0 H LEU A 37 18.457 32.156 5.086 1.00 25.00 H new ATOM 0 HA LEU A 37 17.571 29.892 6.576 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.719 29.081 4.649 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.507 30.821 4.614 1.00 25.00 H new ATOM 0 HG LEU A 37 18.382 30.828 2.874 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.540 28.841 1.495 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.194 28.578 3.129 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.595 27.928 2.696 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.609 30.311 1.146 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.649 29.494 2.402 1.00 25.00 H new ATOM 0 HD23 LEU A 37 15.931 31.248 2.498 1.00 25.00 H new ATOM 544 N LEU A 38 20.381 29.758 5.018 1.00 25.00 N ATOM 545 CA LEU A 38 21.570 28.988 4.830 1.00 25.00 C ATOM 546 C LEU A 38 22.212 28.601 6.150 1.00 25.00 C ATOM 547 O LEU A 38 22.544 27.451 6.346 1.00 25.00 O ATOM 548 CB LEU A 38 22.509 29.791 3.971 1.00 25.00 C ATOM 549 CG LEU A 38 23.736 29.002 3.505 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.323 27.900 2.561 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.742 29.910 2.850 1.00 25.00 C ATOM 0 H LEU A 38 20.436 30.715 4.670 1.00 25.00 H new ATOM 0 HA LEU A 38 21.323 28.049 4.336 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.968 30.155 3.098 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.840 30.667 4.529 1.00 25.00 H new ATOM 0 HG LEU A 38 24.206 28.553 4.380 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.206 27.348 2.238 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.637 27.223 3.070 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.827 28.332 1.692 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.604 29.326 2.528 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.287 30.393 1.985 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.064 30.670 3.562 1.00 25.00 H new ATOM 563 N LYS A 39 22.326 29.530 7.084 1.00 25.00 N ATOM 564 CA LYS A 39 22.839 29.170 8.421 1.00 25.00 C ATOM 565 C LYS A 39 21.868 28.285 9.193 1.00 25.00 C ATOM 566 O LYS A 39 22.293 27.477 10.005 1.00 25.00 O ATOM 567 CB LYS A 39 23.240 30.403 9.250 1.00 25.00 C ATOM 568 CG LYS A 39 22.217 31.536 9.287 1.00 25.00 C ATOM 569 CD LYS A 39 22.595 32.644 10.259 1.00 25.00 C ATOM 570 CE LYS A 39 23.773 33.464 9.734 1.00 25.00 C ATOM 571 NZ LYS A 39 24.089 34.611 10.646 1.00 25.00 N ATOM 0 H LYS A 39 22.082 30.513 6.962 1.00 25.00 H new ATOM 0 HA LYS A 39 23.745 28.589 8.246 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.437 30.082 10.273 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.176 30.796 8.854 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.112 31.957 8.287 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.244 31.131 9.566 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.738 33.297 10.421 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.852 32.211 11.226 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.649 32.823 9.635 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.541 33.842 8.738 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.893 35.148 10.263 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.260 35.234 10.720 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.334 34.247 11.589 1.00 25.00 H new ATOM 585 N GLU A 40 20.581 28.404 8.913 1.00 25.00 N ATOM 586 CA GLU A 40 19.575 27.559 9.556 1.00 25.00 C ATOM 587 C GLU A 40 19.597 26.124 9.004 1.00 25.00 C ATOM 588 O GLU A 40 19.557 25.151 9.755 1.00 25.00 O ATOM 589 CB GLU A 40 18.188 28.166 9.325 1.00 25.00 C ATOM 590 CG GLU A 40 17.558 28.796 10.560 1.00 25.00 C ATOM 591 CD GLU A 40 16.767 27.782 11.372 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.550 27.632 11.111 1.00 25.00 O ATOM 593 OE2 GLU A 40 17.368 27.055 12.183 1.00 25.00 O ATOM 0 H GLU A 40 20.203 29.076 8.245 1.00 25.00 H new ATOM 0 HA GLU A 40 19.803 27.513 10.621 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.263 28.924 8.545 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.523 27.388 8.951 1.00 25.00 H new ATOM 0 HG2 GLU A 40 18.339 29.231 11.184 1.00 25.00 H new ATOM 0 HG3 GLU A 40 16.901 29.611 10.257 1.00 25.00 H new ATOM 600 N ARG A 41 19.607 25.989 7.683 1.00 25.00 N ATOM 601 CA ARG A 41 19.525 24.660 7.048 1.00 25.00 C ATOM 602 C ARG A 41 20.856 24.002 6.712 1.00 25.00 C ATOM 603 O ARG A 41 20.962 22.782 6.737 1.00 25.00 O ATOM 604 CB ARG A 41 18.698 24.761 5.766 1.00 25.00 C ATOM 605 CG ARG A 41 17.295 25.355 5.950 1.00 25.00 C ATOM 606 CD ARG A 41 16.298 24.386 6.644 1.00 25.00 C ATOM 607 NE ARG A 41 16.558 24.259 8.093 1.00 25.00 N ATOM 608 CZ ARG A 41 16.080 25.056 9.042 1.00 25.00 C ATOM 609 NH1 ARG A 41 15.252 26.037 8.792 1.00 25.00 N ATOM 610 NH2 ARG A 41 16.463 24.871 10.270 1.00 25.00 N ATOM 0 H ARG A 41 19.670 26.769 7.028 1.00 25.00 H new ATOM 0 HA ARG A 41 19.060 24.021 7.799 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.244 25.370 5.046 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.602 23.765 5.333 1.00 25.00 H new ATOM 0 HG2 ARG A 41 17.370 26.269 6.539 1.00 25.00 H new ATOM 0 HG3 ARG A 41 16.897 25.636 4.975 1.00 25.00 H new ATOM 0 HD2 ARG A 41 15.280 24.743 6.490 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.365 23.403 6.177 1.00 25.00 H new ATOM 0 HE ARG A 41 17.158 23.490 8.391 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.947 26.216 7.835 1.00 25.00 H new ATOM 0 HH12 ARG A 41 14.911 26.623 9.554 1.00 25.00 H new ATOM 0 HH21 ARG A 41 17.120 24.123 10.492 1.00 25.00 H new ATOM 0 HH22 ARG A 41 16.106 25.473 11.012 1.00 25.00 H new ATOM 624 N ASN A 42 21.850 24.802 6.374 1.00 25.00 N ATOM 625 CA ASN A 42 23.186 24.291 6.017 1.00 25.00 C ATOM 626 C ASN A 42 24.320 25.014 6.753 1.00 25.00 C ATOM 627 O ASN A 42 25.128 25.716 6.124 1.00 25.00 O ATOM 628 CB ASN A 42 23.422 24.437 4.511 1.00 25.00 C ATOM 629 CG ASN A 42 24.531 23.547 4.013 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.217 22.899 4.778 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.702 23.505 2.729 1.00 25.00 N ATOM 0 H ASN A 42 21.769 25.818 6.335 1.00 25.00 H new ATOM 0 HA ASN A 42 23.200 23.243 6.317 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.502 24.199 3.977 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.663 25.475 4.283 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.432 22.914 2.331 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.107 24.063 2.117 1.00 25.00 H new ATOM 638 N PRO A 43 24.423 24.841 8.082 1.00 25.00 N ATOM 639 CA PRO A 43 25.511 25.569 8.752 1.00 25.00 C ATOM 640 C PRO A 43 26.957 25.360 8.236 1.00 25.00 C ATOM 641 O PRO A 43 27.709 26.331 8.206 1.00 25.00 O ATOM 642 CB PRO A 43 25.354 25.164 10.226 1.00 25.00 C ATOM 643 CG PRO A 43 24.544 23.913 10.212 1.00 25.00 C ATOM 644 CD PRO A 43 23.617 24.064 9.044 1.00 25.00 C ATOM 0 HA PRO A 43 25.402 26.634 8.549 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.325 24.997 10.693 1.00 25.00 H new ATOM 0 HB3 PRO A 43 24.856 25.947 10.797 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.178 23.033 10.101 1.00 25.00 H new ATOM 0 HG3 PRO A 43 23.990 23.791 11.143 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.321 23.098 8.636 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.702 24.587 9.320 1.00 25.00 H new ATOM 652 N PRO A 44 27.360 24.145 7.770 1.00 25.00 N ATOM 653 CA PRO A 44 28.748 24.164 7.282 1.00 25.00 C ATOM 654 C PRO A 44 28.989 24.964 5.984 1.00 25.00 C ATOM 655 O PRO A 44 30.076 25.502 5.792 1.00 25.00 O ATOM 656 CB PRO A 44 29.059 22.679 7.077 1.00 25.00 C ATOM 657 CG PRO A 44 27.769 22.081 6.749 1.00 25.00 C ATOM 658 CD PRO A 44 26.791 22.785 7.654 1.00 25.00 C ATOM 0 HA PRO A 44 29.394 24.678 7.994 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.781 22.531 6.274 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.486 22.235 7.976 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.517 22.230 5.699 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.772 21.006 6.927 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.788 22.803 7.228 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.716 22.295 8.625 1.00 25.00 H new ATOM 666 N LEU A 45 28.004 25.087 5.098 1.00 25.00 N ATOM 667 CA LEU A 45 28.196 25.953 3.929 1.00 25.00 C ATOM 668 C LEU A 45 28.080 27.399 4.382 1.00 25.00 C ATOM 669 O LEU A 45 28.776 28.286 3.891 1.00 25.00 O ATOM 670 CB LEU A 45 27.187 25.654 2.819 1.00 25.00 C ATOM 671 CG LEU A 45 27.304 26.504 1.532 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.703 26.470 0.898 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.290 25.997 0.510 1.00 25.00 C ATOM 0 H LEU A 45 27.099 24.621 5.157 1.00 25.00 H new ATOM 0 HA LEU A 45 29.184 25.764 3.509 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.284 24.604 2.544 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.184 25.786 3.225 1.00 25.00 H new ATOM 0 HG LEU A 45 27.109 27.538 1.818 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.711 27.088 0.000 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.434 26.854 1.609 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.958 25.444 0.634 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.364 26.590 -0.401 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.496 24.952 0.281 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.284 26.087 0.920 1.00 25.00 H new ATOM 685 N ALA A 46 27.205 27.629 5.342 1.00 25.00 N ATOM 686 CA ALA A 46 27.004 28.968 5.863 1.00 25.00 C ATOM 687 C ALA A 46 28.252 29.538 6.524 1.00 25.00 C ATOM 688 O ALA A 46 28.600 30.664 6.252 1.00 25.00 O ATOM 689 CB ALA A 46 25.872 28.979 6.832 1.00 25.00 C ATOM 0 H ALA A 46 26.625 26.911 5.775 1.00 25.00 H new ATOM 0 HA ALA A 46 26.771 29.605 5.010 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.731 29.989 7.216 1.00 25.00 H new ATOM 0 HB2 ALA A 46 24.961 28.651 6.331 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.094 28.305 7.659 1.00 25.00 H new ATOM 695 N GLU A 47 28.912 28.789 7.398 1.00 25.00 N ATOM 696 CA GLU A 47 30.078 29.319 8.121 1.00 25.00 C ATOM 697 C GLU A 47 31.181 29.722 7.142 1.00 25.00 C ATOM 698 O GLU A 47 31.909 30.690 7.368 1.00 25.00 O ATOM 699 CB GLU A 47 30.606 28.310 9.156 1.00 25.00 C ATOM 700 CG GLU A 47 31.209 27.048 8.563 1.00 25.00 C ATOM 701 CD GLU A 47 31.747 26.110 9.620 1.00 25.00 C ATOM 702 OE1 GLU A 47 30.953 25.355 10.218 1.00 25.00 O ATOM 703 OE2 GLU A 47 32.980 26.120 9.840 1.00 25.00 O ATOM 0 H GLU A 47 28.670 27.825 7.627 1.00 25.00 H new ATOM 0 HA GLU A 47 29.757 30.208 8.664 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.360 28.802 9.771 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.788 28.028 9.819 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.452 26.530 7.974 1.00 25.00 H new ATOM 0 HG3 GLU A 47 32.014 27.320 7.880 1.00 25.00 H new ATOM 710 N ALA A 48 31.257 29.015 6.027 1.00 25.00 N ATOM 711 CA ALA A 48 32.202 29.333 4.987 1.00 25.00 C ATOM 712 C ALA A 48 31.873 30.680 4.339 1.00 25.00 C ATOM 713 O ALA A 48 32.765 31.470 4.040 1.00 25.00 O ATOM 714 CB ALA A 48 32.177 28.226 3.965 1.00 25.00 C ATOM 0 H ALA A 48 30.665 28.209 5.824 1.00 25.00 H new ATOM 0 HA ALA A 48 33.201 29.418 5.415 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.887 28.450 3.169 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.451 27.285 4.441 1.00 25.00 H new ATOM 0 HB3 ALA A 48 31.175 28.142 3.544 1.00 25.00 H new ATOM 720 N LEU A 49 30.587 30.943 4.169 1.00 25.00 N ATOM 721 CA LEU A 49 30.114 32.200 3.598 1.00 25.00 C ATOM 722 C LEU A 49 30.411 33.354 4.546 1.00 25.00 C ATOM 723 O LEU A 49 30.851 34.416 4.120 1.00 25.00 O ATOM 724 CB LEU A 49 28.600 32.133 3.373 1.00 25.00 C ATOM 725 CG LEU A 49 27.986 33.375 2.720 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.174 33.309 1.225 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.516 33.475 3.085 1.00 25.00 C ATOM 0 H LEU A 49 29.841 30.295 4.421 1.00 25.00 H new ATOM 0 HA LEU A 49 30.627 32.361 2.650 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.379 31.267 2.750 1.00 25.00 H new ATOM 0 HB3 LEU A 49 28.112 31.968 4.334 1.00 25.00 H new ATOM 0 HG LEU A 49 28.488 34.270 3.088 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.736 34.194 0.764 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.238 33.268 0.994 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.684 32.417 0.836 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.085 34.360 2.618 1.00 25.00 H new ATOM 0 HD22 LEU A 49 25.992 32.587 2.732 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.414 33.550 4.168 1.00 25.00 H new ATOM 739 N LEU A 50 30.172 33.137 5.835 1.00 25.00 N ATOM 740 CA LEU A 50 30.341 34.193 6.845 1.00 25.00 C ATOM 741 C LEU A 50 31.791 34.628 6.904 1.00 25.00 C ATOM 742 O LEU A 50 32.112 35.755 7.260 1.00 25.00 O ATOM 743 CB LEU A 50 29.944 33.699 8.247 1.00 25.00 C ATOM 744 CG LEU A 50 28.606 32.974 8.454 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.320 32.824 9.932 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.430 33.622 7.732 1.00 25.00 C ATOM 0 H LEU A 50 29.860 32.242 6.212 1.00 25.00 H new ATOM 0 HA LEU A 50 29.696 35.023 6.554 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.732 33.029 8.590 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.950 34.564 8.910 1.00 25.00 H new ATOM 0 HG LEU A 50 28.716 31.990 7.999 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.369 32.309 10.068 1.00 25.00 H new ATOM 0 HD12 LEU A 50 29.117 32.245 10.400 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.268 33.810 10.394 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.523 33.051 7.928 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.301 34.643 8.091 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.625 33.636 6.660 1.00 25.00 H new ATOM 758 N SER A 51 32.664 33.693 6.576 1.00 25.00 N ATOM 759 CA SER A 51 34.096 33.910 6.618 1.00 25.00 C ATOM 760 C SER A 51 34.609 34.672 5.395 1.00 25.00 C ATOM 761 O SER A 51 35.742 35.139 5.394 1.00 25.00 O ATOM 762 CB SER A 51 34.768 32.553 6.680 1.00 25.00 C ATOM 763 OG SER A 51 36.134 32.649 7.054 1.00 25.00 O ATOM 0 H SER A 51 32.397 32.757 6.271 1.00 25.00 H new ATOM 0 HA SER A 51 34.329 34.517 7.493 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.241 31.920 7.394 1.00 25.00 H new ATOM 0 HB3 SER A 51 34.692 32.067 5.707 1.00 25.00 H new ATOM 0 HG SER A 51 36.558 33.381 6.559 1.00 25.00 H new ATOM 769 N GLY A 52 33.797 34.763 4.348 1.00 25.00 N ATOM 770 CA GLY A 52 34.169 35.503 3.145 1.00 25.00 C ATOM 771 C GLY A 52 35.018 34.720 2.156 1.00 25.00 C ATOM 772 O GLY A 52 34.945 34.948 0.943 1.00 25.00 O ATOM 0 H GLY A 52 32.873 34.332 4.307 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.260 35.833 2.642 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.713 36.400 3.440 1.00 25.00 H new ATOM 776 N ASP A 53 35.820 33.803 2.679 1.00 25.00 N ATOM 777 CA ASP A 53 36.724 32.979 1.871 1.00 25.00 C ATOM 778 C ASP A 53 35.987 32.180 0.808 1.00 25.00 C ATOM 779 O ASP A 53 35.286 31.212 1.107 1.00 25.00 O ATOM 780 CB ASP A 53 37.529 32.044 2.763 1.00 25.00 C ATOM 781 CG ASP A 53 38.992 32.368 2.763 1.00 25.00 C ATOM 782 OD1 ASP A 53 39.552 32.551 1.666 1.00 25.00 O ATOM 783 OD2 ASP A 53 39.595 32.384 3.854 1.00 25.00 O ATOM 0 H ASP A 53 35.866 33.605 3.679 1.00 25.00 H new ATOM 0 HA ASP A 53 37.400 33.661 1.354 1.00 25.00 H new ATOM 0 HB2 ASP A 53 37.147 32.102 3.782 1.00 25.00 H new ATOM 0 HB3 ASP A 53 37.388 31.016 2.428 1.00 25.00 H new ATOM 788 N LEU A 54 36.175 32.565 -0.448 1.00 25.00 N ATOM 789 CA LEU A 54 35.584 31.821 -1.554 1.00 25.00 C ATOM 790 C LEU A 54 36.195 30.432 -1.522 1.00 25.00 C ATOM 791 O LEU A 54 35.536 29.461 -1.803 1.00 25.00 O ATOM 792 CB LEU A 54 35.877 32.494 -2.901 1.00 25.00 C ATOM 793 CG LEU A 54 35.297 31.846 -4.185 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.243 30.802 -4.790 1.00 25.00 C ATOM 795 CD2 LEU A 54 33.888 31.231 -4.011 1.00 25.00 C ATOM 0 H LEU A 54 36.725 33.378 -0.725 1.00 25.00 H new ATOM 0 HA LEU A 54 34.500 31.784 -1.447 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.508 33.518 -2.849 1.00 25.00 H new ATOM 0 HB3 LEU A 54 36.959 32.551 -3.016 1.00 25.00 H new ATOM 0 HG LEU A 54 35.195 32.683 -4.876 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.791 30.378 -5.687 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.189 31.276 -5.050 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.422 30.009 -4.064 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.560 30.800 -4.957 1.00 25.00 H new ATOM 0 HD22 LEU A 54 33.923 30.451 -3.250 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.188 32.007 -3.703 1.00 25.00 H new ATOM 807 N GLU A 55 37.451 30.344 -1.123 1.00 25.00 N ATOM 808 CA GLU A 55 38.142 29.059 -1.035 1.00 25.00 C ATOM 809 C GLU A 55 37.366 28.056 -0.190 1.00 25.00 C ATOM 810 O GLU A 55 37.056 26.952 -0.639 1.00 25.00 O ATOM 811 CB GLU A 55 39.521 29.253 -0.402 1.00 25.00 C ATOM 812 CG GLU A 55 40.460 30.128 -1.198 1.00 25.00 C ATOM 813 CD GLU A 55 41.081 29.389 -2.378 1.00 25.00 C ATOM 814 OE1 GLU A 55 42.296 29.108 -2.337 1.00 25.00 O ATOM 815 OE2 GLU A 55 40.344 29.079 -3.343 1.00 25.00 O ATOM 0 H GLU A 55 38.019 31.147 -0.853 1.00 25.00 H new ATOM 0 HA GLU A 55 38.232 28.671 -2.049 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.393 29.687 0.590 1.00 25.00 H new ATOM 0 HB3 GLU A 55 39.984 28.276 -0.265 1.00 25.00 H new ATOM 0 HG2 GLU A 55 39.918 31.000 -1.563 1.00 25.00 H new ATOM 0 HG3 GLU A 55 41.252 30.495 -0.545 1.00 25.00 H new ATOM 822 N LYS A 56 37.033 28.438 1.035 1.00 25.00 N ATOM 823 CA LYS A 56 36.330 27.527 1.929 1.00 25.00 C ATOM 824 C LYS A 56 34.893 27.375 1.495 1.00 25.00 C ATOM 825 O LYS A 56 34.344 26.291 1.606 1.00 25.00 O ATOM 826 CB LYS A 56 36.463 27.961 3.400 1.00 25.00 C ATOM 827 CG LYS A 56 35.765 29.188 3.830 1.00 25.00 C ATOM 828 CD LYS A 56 36.378 29.705 5.130 1.00 25.00 C ATOM 829 CE LYS A 56 35.945 28.905 6.362 1.00 25.00 C ATOM 830 NZ LYS A 56 36.452 29.560 7.619 1.00 25.00 N ATOM 0 H LYS A 56 37.234 29.357 1.429 1.00 25.00 H new ATOM 0 HA LYS A 56 36.797 26.545 1.863 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.108 27.140 4.023 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.524 28.089 3.615 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.839 29.950 3.054 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.704 28.982 3.974 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.465 29.675 5.049 1.00 25.00 H new ATOM 0 HD3 LYS A 56 36.097 30.749 5.266 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.858 28.835 6.394 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.328 27.887 6.295 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 35.862 29.269 8.424 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 37.436 29.271 7.788 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 36.408 30.594 7.514 1.00 25.00 H new ATOM 844 N PHE A 57 34.310 28.429 0.940 1.00 25.00 N ATOM 845 CA PHE A 57 32.940 28.369 0.436 1.00 25.00 C ATOM 846 C PHE A 57 32.833 27.371 -0.703 1.00 25.00 C ATOM 847 O PHE A 57 32.003 26.487 -0.661 1.00 25.00 O ATOM 848 CB PHE A 57 32.466 29.752 -0.022 1.00 25.00 C ATOM 849 CG PHE A 57 31.060 29.757 -0.557 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.820 29.566 -1.933 1.00 25.00 C ATOM 851 CD2 PHE A 57 29.964 29.936 0.308 1.00 25.00 C ATOM 852 CE1 PHE A 57 29.501 29.559 -2.443 1.00 25.00 C ATOM 853 CE2 PHE A 57 28.638 29.929 -0.197 1.00 25.00 C ATOM 854 CZ PHE A 57 28.411 29.738 -1.578 1.00 25.00 C ATOM 0 H PHE A 57 34.762 29.336 0.826 1.00 25.00 H new ATOM 0 HA PHE A 57 32.295 28.038 1.250 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.530 30.445 0.817 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.141 30.122 -0.794 1.00 25.00 H new ATOM 0 HD1 PHE A 57 31.653 29.423 -2.605 1.00 25.00 H new ATOM 0 HD2 PHE A 57 30.134 30.080 1.365 1.00 25.00 H new ATOM 0 HE1 PHE A 57 29.332 29.416 -3.500 1.00 25.00 H new ATOM 0 HE2 PHE A 57 27.803 30.070 0.474 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.403 29.730 -1.966 1.00 25.00 H new ATOM 864 N SER A 58 33.691 27.489 -1.702 1.00 25.00 N ATOM 865 CA SER A 58 33.664 26.603 -2.855 1.00 25.00 C ATOM 866 C SER A 58 33.996 25.184 -2.430 1.00 25.00 C ATOM 867 O SER A 58 33.363 24.236 -2.863 1.00 25.00 O ATOM 868 CB SER A 58 34.676 27.077 -3.902 1.00 25.00 C ATOM 869 OG SER A 58 34.594 26.295 -5.078 1.00 25.00 O ATOM 0 H SER A 58 34.423 28.198 -1.738 1.00 25.00 H new ATOM 0 HA SER A 58 32.664 26.621 -3.288 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.491 28.124 -4.144 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.684 27.018 -3.491 1.00 25.00 H new ATOM 0 HG SER A 58 35.249 26.618 -5.732 1.00 25.00 H new ATOM 875 N ARG A 59 34.964 25.030 -1.540 1.00 25.00 N ATOM 876 CA ARG A 59 35.356 23.694 -1.103 1.00 25.00 C ATOM 877 C ARG A 59 34.214 22.992 -0.387 1.00 25.00 C ATOM 878 O ARG A 59 33.887 21.858 -0.716 1.00 25.00 O ATOM 879 CB ARG A 59 36.591 23.771 -0.203 1.00 25.00 C ATOM 880 CG ARG A 59 37.128 22.394 0.215 1.00 25.00 C ATOM 881 CD ARG A 59 36.758 22.033 1.652 1.00 25.00 C ATOM 882 NE ARG A 59 36.832 20.575 1.867 1.00 25.00 N ATOM 883 CZ ARG A 59 37.297 19.968 2.953 1.00 25.00 C ATOM 884 NH1 ARG A 59 37.773 20.624 3.985 1.00 25.00 N ATOM 885 NH2 ARG A 59 37.272 18.669 2.995 1.00 25.00 N ATOM 0 H ARG A 59 35.485 25.795 -1.112 1.00 25.00 H new ATOM 0 HA ARG A 59 35.604 23.107 -1.988 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.378 24.317 -0.724 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.345 24.343 0.691 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.734 21.634 -0.460 1.00 25.00 H new ATOM 0 HG3 ARG A 59 38.213 22.383 0.109 1.00 25.00 H new ATOM 0 HD2 ARG A 59 37.431 22.541 2.343 1.00 25.00 H new ATOM 0 HD3 ARG A 59 35.750 22.386 1.871 1.00 25.00 H new ATOM 0 HE ARG A 59 36.495 19.978 1.112 1.00 25.00 H new ATOM 0 HH11 ARG A 59 37.797 21.644 3.974 1.00 25.00 H new ATOM 0 HH12 ARG A 59 38.119 20.114 4.798 1.00 25.00 H new ATOM 0 HH21 ARG A 59 36.901 18.140 2.205 1.00 25.00 H new ATOM 0 HH22 ARG A 59 37.623 18.178 3.817 1.00 25.00 H new ATOM 899 N VAL A 60 33.594 23.651 0.579 1.00 25.00 N ATOM 900 CA VAL A 60 32.511 23.031 1.335 1.00 25.00 C ATOM 901 C VAL A 60 31.298 22.842 0.420 1.00 25.00 C ATOM 902 O VAL A 60 30.532 21.903 0.584 1.00 25.00 O ATOM 903 CB VAL A 60 32.160 23.821 2.641 1.00 25.00 C ATOM 904 CG1 VAL A 60 31.458 25.075 2.354 1.00 25.00 C ATOM 905 CG2 VAL A 60 31.335 22.945 3.589 1.00 25.00 C ATOM 0 H VAL A 60 33.817 24.606 0.858 1.00 25.00 H new ATOM 0 HA VAL A 60 32.844 22.051 1.678 1.00 25.00 H new ATOM 0 HB VAL A 60 33.100 24.082 3.128 1.00 25.00 H new ATOM 0 HG11 VAL A 60 31.235 25.589 3.289 1.00 25.00 H new ATOM 0 HG12 VAL A 60 32.088 25.711 1.732 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.528 24.859 1.828 1.00 25.00 H new ATOM 0 HG21 VAL A 60 31.099 23.508 4.492 1.00 25.00 H new ATOM 0 HG22 VAL A 60 30.410 22.646 3.096 1.00 25.00 H new ATOM 0 HG23 VAL A 60 31.908 22.057 3.855 1.00 25.00 H new ATOM 915 N LEU A 61 31.144 23.707 -0.571 1.00 25.00 N ATOM 916 CA LEU A 61 30.067 23.575 -1.546 1.00 25.00 C ATOM 917 C LEU A 61 30.205 22.244 -2.275 1.00 25.00 C ATOM 918 O LEU A 61 29.219 21.553 -2.475 1.00 25.00 O ATOM 919 CB LEU A 61 30.136 24.729 -2.543 1.00 25.00 C ATOM 920 CG LEU A 61 28.961 25.009 -3.481 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.177 26.191 -2.976 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.498 25.352 -4.845 1.00 25.00 C ATOM 0 H LEU A 61 31.753 24.511 -0.723 1.00 25.00 H new ATOM 0 HA LEU A 61 29.104 23.605 -1.036 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.317 25.639 -1.971 1.00 25.00 H new ATOM 0 HB3 LEU A 61 31.015 24.565 -3.167 1.00 25.00 H new ATOM 0 HG LEU A 61 28.320 24.129 -3.526 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.341 26.387 -3.647 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.798 25.976 -1.977 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.824 27.067 -2.937 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.668 25.554 -5.523 1.00 25.00 H new ATOM 0 HD22 LEU A 61 30.132 26.236 -4.775 1.00 25.00 H new ATOM 0 HD23 LEU A 61 30.083 24.515 -5.227 1.00 25.00 H new ATOM 934 N VAL A 62 31.426 21.862 -2.632 1.00 25.00 N ATOM 935 CA VAL A 62 31.675 20.579 -3.307 1.00 25.00 C ATOM 936 C VAL A 62 31.480 19.421 -2.350 1.00 25.00 C ATOM 937 O VAL A 62 30.917 18.397 -2.720 1.00 25.00 O ATOM 938 CB VAL A 62 33.096 20.517 -3.917 1.00 25.00 C ATOM 939 CG1 VAL A 62 33.355 19.156 -4.591 1.00 25.00 C ATOM 940 CG2 VAL A 62 33.239 21.612 -4.942 1.00 25.00 C ATOM 0 H VAL A 62 32.265 22.419 -2.468 1.00 25.00 H new ATOM 0 HA VAL A 62 30.952 20.500 -4.119 1.00 25.00 H new ATOM 0 HB VAL A 62 33.822 20.646 -3.115 1.00 25.00 H new ATOM 0 HG11 VAL A 62 34.361 19.143 -5.010 1.00 25.00 H new ATOM 0 HG12 VAL A 62 33.259 18.360 -3.852 1.00 25.00 H new ATOM 0 HG13 VAL A 62 32.628 19.001 -5.388 1.00 25.00 H new ATOM 0 HG21 VAL A 62 34.238 21.575 -5.377 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.496 21.474 -5.728 1.00 25.00 H new ATOM 0 HG23 VAL A 62 33.087 22.580 -4.464 1.00 25.00 H new ATOM 950 N GLU A 63 31.872 19.599 -1.099 1.00 25.00 N ATOM 951 CA GLU A 63 31.612 18.569 -0.080 1.00 25.00 C ATOM 952 C GLU A 63 30.097 18.321 -0.008 1.00 25.00 C ATOM 953 O GLU A 63 29.633 17.179 0.037 1.00 25.00 O ATOM 954 CB GLU A 63 32.128 18.987 1.309 1.00 25.00 C ATOM 955 CG GLU A 63 33.638 19.200 1.421 1.00 25.00 C ATOM 956 CD GLU A 63 34.469 17.982 1.049 1.00 25.00 C ATOM 957 OE1 GLU A 63 33.993 16.839 1.182 1.00 25.00 O ATOM 958 OE2 GLU A 63 35.649 18.185 0.671 1.00 25.00 O ATOM 0 H GLU A 63 32.363 20.426 -0.759 1.00 25.00 H new ATOM 0 HA GLU A 63 32.143 17.662 -0.368 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.627 19.911 1.599 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.833 18.225 2.030 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.925 20.032 0.778 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.878 19.491 2.444 1.00 25.00 H new ATOM 965 N GLN A 64 29.322 19.395 -0.074 1.00 25.00 N ATOM 966 CA GLN A 64 27.867 19.285 -0.093 1.00 25.00 C ATOM 967 C GLN A 64 27.366 18.673 -1.405 1.00 25.00 C ATOM 968 O GLN A 64 26.400 17.921 -1.382 1.00 25.00 O ATOM 969 CB GLN A 64 27.214 20.655 0.131 1.00 25.00 C ATOM 970 CG GLN A 64 27.407 21.214 1.545 1.00 25.00 C ATOM 971 CD GLN A 64 26.722 20.375 2.601 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.549 20.050 2.485 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.444 20.023 3.631 1.00 25.00 N ATOM 0 H GLN A 64 29.674 20.351 -0.115 1.00 25.00 H new ATOM 0 HA GLN A 64 27.581 18.620 0.722 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.625 21.364 -0.588 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.147 20.575 -0.074 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.473 21.271 1.767 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.018 22.231 1.586 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.420 20.313 3.693 1.00 25.00 H new ATOM 0 HE22 GLN A 64 27.032 19.458 4.373 1.00 25.00 H new ATOM 982 N GLN A 65 28.022 18.935 -2.533 1.00 25.00 N ATOM 983 CA GLN A 65 27.613 18.299 -3.797 1.00 25.00 C ATOM 984 C GLN A 65 27.780 16.790 -3.708 1.00 25.00 C ATOM 985 O GLN A 65 26.931 16.038 -4.177 1.00 25.00 O ATOM 986 CB GLN A 65 28.421 18.774 -5.016 1.00 25.00 C ATOM 987 CG GLN A 65 28.372 20.257 -5.319 1.00 25.00 C ATOM 988 CD GLN A 65 26.997 20.855 -5.200 1.00 25.00 C ATOM 989 OE1 GLN A 65 26.029 20.372 -5.780 1.00 25.00 O ATOM 990 NE2 GLN A 65 26.898 21.910 -4.445 1.00 25.00 N ATOM 0 H GLN A 65 28.820 19.566 -2.606 1.00 25.00 H new ATOM 0 HA GLN A 65 26.571 18.586 -3.938 1.00 25.00 H new ATOM 0 HB2 GLN A 65 29.463 18.490 -4.867 1.00 25.00 H new ATOM 0 HB3 GLN A 65 28.065 18.234 -5.893 1.00 25.00 H new ATOM 0 HG2 GLN A 65 29.046 20.780 -4.640 1.00 25.00 H new ATOM 0 HG3 GLN A 65 28.745 20.425 -6.329 1.00 25.00 H new ATOM 0 HE21 GLN A 65 27.725 22.283 -3.979 1.00 25.00 H new ATOM 0 HE22 GLN A 65 25.993 22.364 -4.319 1.00 25.00 H new ATOM 999 N GLN A 66 28.866 16.342 -3.097 1.00 25.00 N ATOM 1000 CA GLN A 66 29.115 14.911 -2.969 1.00 25.00 C ATOM 1001 C GLN A 66 28.026 14.275 -2.125 1.00 25.00 C ATOM 1002 O GLN A 66 27.587 13.166 -2.402 1.00 25.00 O ATOM 1003 CB GLN A 66 30.457 14.646 -2.287 1.00 25.00 C ATOM 1004 CG GLN A 66 31.681 15.070 -3.075 1.00 25.00 C ATOM 1005 CD GLN A 66 32.945 14.815 -2.288 1.00 25.00 C ATOM 1006 OE1 GLN A 66 33.246 13.681 -1.943 1.00 25.00 O ATOM 1007 NE2 GLN A 66 33.663 15.859 -1.970 1.00 25.00 N ATOM 0 H GLN A 66 29.583 16.939 -2.685 1.00 25.00 H new ATOM 0 HA GLN A 66 29.126 14.484 -3.972 1.00 25.00 H new ATOM 0 HB2 GLN A 66 30.466 15.163 -1.328 1.00 25.00 H new ATOM 0 HB3 GLN A 66 30.533 13.580 -2.075 1.00 25.00 H new ATOM 0 HG2 GLN A 66 31.719 14.524 -4.018 1.00 25.00 H new ATOM 0 HG3 GLN A 66 31.610 16.129 -3.323 1.00 25.00 H new ATOM 0 HE21 GLN A 66 33.376 16.788 -2.278 1.00 25.00 H new ATOM 0 HE22 GLN A 66 34.510 15.745 -1.414 1.00 25.00 H new ATOM 1016 N ASP A 67 27.612 14.961 -1.072 1.00 25.00 N ATOM 1017 CA ASP A 67 26.640 14.396 -0.148 1.00 25.00 C ATOM 1018 C ASP A 67 25.214 14.455 -0.675 1.00 25.00 C ATOM 1019 O ASP A 67 24.439 13.507 -0.515 1.00 25.00 O ATOM 1020 CB ASP A 67 26.712 15.109 1.193 1.00 25.00 C ATOM 1021 CG ASP A 67 26.038 14.322 2.295 1.00 25.00 C ATOM 1022 OD1 ASP A 67 26.138 13.073 2.296 1.00 25.00 O ATOM 1023 OD2 ASP A 67 25.350 14.941 3.132 1.00 25.00 O ATOM 0 H ASP A 67 27.930 15.901 -0.836 1.00 25.00 H new ATOM 0 HA ASP A 67 26.901 13.344 -0.031 1.00 25.00 H new ATOM 0 HB2 ASP A 67 27.756 15.279 1.457 1.00 25.00 H new ATOM 0 HB3 ASP A 67 26.241 16.088 1.108 1.00 25.00 H new ATOM 1028 N ARG A 68 24.850 15.560 -1.313 1.00 25.00 N ATOM 1029 CA ARG A 68 23.488 15.701 -1.830 1.00 25.00 C ATOM 1030 C ARG A 68 23.231 14.670 -2.894 1.00 25.00 C ATOM 1031 O ARG A 68 22.204 14.019 -2.879 1.00 25.00 O ATOM 1032 CB ARG A 68 23.195 17.121 -2.344 1.00 25.00 C ATOM 1033 CG ARG A 68 23.957 17.644 -3.571 1.00 25.00 C ATOM 1034 CD ARG A 68 23.093 17.711 -4.839 1.00 25.00 C ATOM 1035 NE ARG A 68 23.740 18.555 -5.864 1.00 25.00 N ATOM 1036 CZ ARG A 68 23.270 18.799 -7.082 1.00 25.00 C ATOM 1037 NH1 ARG A 68 22.160 18.295 -7.542 1.00 25.00 N ATOM 1038 NH2 ARG A 68 23.950 19.588 -7.858 1.00 25.00 N ATOM 0 H ARG A 68 25.461 16.358 -1.484 1.00 25.00 H new ATOM 0 HA ARG A 68 22.802 15.531 -1.000 1.00 25.00 H new ATOM 0 HB2 ARG A 68 22.130 17.175 -2.571 1.00 25.00 H new ATOM 0 HB3 ARG A 68 23.381 17.813 -1.522 1.00 25.00 H new ATOM 0 HG2 ARG A 68 24.346 18.638 -3.352 1.00 25.00 H new ATOM 0 HG3 ARG A 68 24.816 17.000 -3.759 1.00 25.00 H new ATOM 0 HD2 ARG A 68 22.937 16.707 -5.233 1.00 25.00 H new ATOM 0 HD3 ARG A 68 22.110 18.114 -4.595 1.00 25.00 H new ATOM 0 HE ARG A 68 24.628 18.990 -5.614 1.00 25.00 H new ATOM 0 HH11 ARG A 68 21.600 17.675 -6.956 1.00 25.00 H new ATOM 0 HH12 ARG A 68 21.851 18.520 -8.488 1.00 25.00 H new ATOM 0 HH21 ARG A 68 24.821 20.002 -7.527 1.00 25.00 H new ATOM 0 HH22 ARG A 68 23.613 19.793 -8.799 1.00 25.00 H new ATOM 1052 N ALA A 69 24.212 14.475 -3.749 1.00 25.00 N ATOM 1053 CA ALA A 69 24.129 13.505 -4.840 1.00 25.00 C ATOM 1054 C ALA A 69 23.783 12.087 -4.358 1.00 25.00 C ATOM 1055 O ALA A 69 23.111 11.341 -5.064 1.00 25.00 O ATOM 1056 CB ALA A 69 25.452 13.492 -5.616 1.00 25.00 C ATOM 0 H ALA A 69 25.096 14.982 -3.714 1.00 25.00 H new ATOM 0 HA ALA A 69 23.313 13.819 -5.491 1.00 25.00 H new ATOM 0 HB1 ALA A 69 25.390 12.769 -6.429 1.00 25.00 H new ATOM 0 HB2 ALA A 69 25.643 14.484 -6.026 1.00 25.00 H new ATOM 0 HB3 ALA A 69 26.265 13.214 -4.945 1.00 25.00 H new ATOM 1062 N ARG A 70 24.214 11.721 -3.156 1.00 25.00 N ATOM 1063 CA ARG A 70 23.941 10.381 -2.612 1.00 25.00 C ATOM 1064 C ARG A 70 22.454 10.168 -2.354 1.00 25.00 C ATOM 1065 O ARG A 70 21.882 9.165 -2.756 1.00 25.00 O ATOM 1066 CB ARG A 70 24.717 10.179 -1.305 1.00 25.00 C ATOM 1067 CG ARG A 70 26.222 10.225 -1.492 1.00 25.00 C ATOM 1068 CD ARG A 70 26.947 10.528 -0.184 1.00 25.00 C ATOM 1069 NE ARG A 70 28.371 10.819 -0.428 1.00 25.00 N ATOM 1070 CZ ARG A 70 29.173 11.494 0.392 1.00 25.00 C ATOM 1071 NH1 ARG A 70 28.765 11.993 1.532 1.00 25.00 N ATOM 1072 NH2 ARG A 70 30.419 11.678 0.048 1.00 25.00 N ATOM 0 H ARG A 70 24.753 12.326 -2.536 1.00 25.00 H new ATOM 0 HA ARG A 70 24.265 9.653 -3.355 1.00 25.00 H new ATOM 0 HB2 ARG A 70 24.422 10.949 -0.592 1.00 25.00 H new ATOM 0 HB3 ARG A 70 24.440 9.219 -0.870 1.00 25.00 H new ATOM 0 HG2 ARG A 70 26.568 9.270 -1.887 1.00 25.00 H new ATOM 0 HG3 ARG A 70 26.473 10.985 -2.231 1.00 25.00 H new ATOM 0 HD2 ARG A 70 26.477 11.379 0.308 1.00 25.00 H new ATOM 0 HD3 ARG A 70 26.856 9.678 0.492 1.00 25.00 H new ATOM 0 HE ARG A 70 28.776 10.474 -1.298 1.00 25.00 H new ATOM 0 HH11 ARG A 70 27.795 11.871 1.824 1.00 25.00 H new ATOM 0 HH12 ARG A 70 29.417 12.503 2.128 1.00 25.00 H new ATOM 0 HH21 ARG A 70 30.764 11.307 -0.837 1.00 25.00 H new ATOM 0 HH22 ARG A 70 31.048 12.193 0.664 1.00 25.00 H new ATOM 1086 N ARG A 71 21.826 11.122 -1.683 1.00 25.00 N ATOM 1087 CA ARG A 71 20.391 11.027 -1.368 1.00 25.00 C ATOM 1088 C ARG A 71 19.551 11.358 -2.589 1.00 25.00 C ATOM 1089 O ARG A 71 18.415 10.915 -2.724 1.00 25.00 O ATOM 1090 CB ARG A 71 20.019 11.948 -0.196 1.00 25.00 C ATOM 1091 CG ARG A 71 20.605 13.359 -0.258 1.00 25.00 C ATOM 1092 CD ARG A 71 20.234 14.159 0.982 1.00 25.00 C ATOM 1093 NE ARG A 71 21.164 15.282 1.202 1.00 25.00 N ATOM 1094 CZ ARG A 71 22.328 15.197 1.844 1.00 25.00 C ATOM 1095 NH1 ARG A 71 22.774 14.075 2.345 1.00 25.00 N ATOM 1096 NH2 ARG A 71 23.063 16.262 1.988 1.00 25.00 N ATOM 0 H ARG A 71 22.277 11.971 -1.343 1.00 25.00 H new ATOM 0 HA ARG A 71 20.182 9.999 -1.071 1.00 25.00 H new ATOM 0 HB2 ARG A 71 18.933 12.026 -0.148 1.00 25.00 H new ATOM 0 HB3 ARG A 71 20.346 11.478 0.731 1.00 25.00 H new ATOM 0 HG2 ARG A 71 21.690 13.302 -0.347 1.00 25.00 H new ATOM 0 HG3 ARG A 71 20.238 13.870 -1.148 1.00 25.00 H new ATOM 0 HD2 ARG A 71 19.219 14.542 0.878 1.00 25.00 H new ATOM 0 HD3 ARG A 71 20.241 13.504 1.853 1.00 25.00 H new ATOM 0 HE ARG A 71 20.895 16.195 0.834 1.00 25.00 H new ATOM 0 HH11 ARG A 71 22.225 13.221 2.251 1.00 25.00 H new ATOM 0 HH12 ARG A 71 23.671 14.054 2.830 1.00 25.00 H new ATOM 0 HH21 ARG A 71 22.746 17.155 1.610 1.00 25.00 H new ATOM 0 HH22 ARG A 71 23.955 16.203 2.479 1.00 25.00 H new ATOM 1110 N GLU A 72 20.123 12.154 -3.468 1.00 25.00 N ATOM 1111 CA GLU A 72 19.458 12.588 -4.692 1.00 25.00 C ATOM 1112 C GLU A 72 19.064 11.426 -5.587 1.00 25.00 C ATOM 1113 O GLU A 72 18.052 11.500 -6.264 1.00 25.00 O ATOM 1114 CB GLU A 72 20.365 13.543 -5.448 1.00 25.00 C ATOM 1115 CG GLU A 72 19.685 14.385 -6.475 1.00 25.00 C ATOM 1116 CD GLU A 72 20.484 15.639 -6.706 1.00 25.00 C ATOM 1117 OE1 GLU A 72 21.687 15.517 -7.006 1.00 25.00 O ATOM 1118 OE2 GLU A 72 19.975 16.744 -6.416 1.00 25.00 O ATOM 0 H GLU A 72 21.067 12.524 -3.358 1.00 25.00 H new ATOM 0 HA GLU A 72 18.536 13.092 -4.404 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.855 14.200 -4.729 1.00 25.00 H new ATOM 0 HB3 GLU A 72 21.149 12.964 -5.937 1.00 25.00 H new ATOM 0 HG2 GLU A 72 19.583 13.829 -7.407 1.00 25.00 H new ATOM 0 HG3 GLU A 72 18.678 14.639 -6.144 1.00 25.00 H new ATOM 1125 N GLN A 73 19.832 10.341 -5.556 1.00 25.00 N ATOM 1126 CA GLN A 73 19.520 9.157 -6.364 1.00 25.00 C ATOM 1127 C GLN A 73 18.098 8.671 -6.102 1.00 25.00 C ATOM 1128 O GLN A 73 17.397 8.257 -7.015 1.00 25.00 O ATOM 1129 CB GLN A 73 20.496 8.013 -6.054 1.00 25.00 C ATOM 1130 CG GLN A 73 21.963 8.354 -6.273 1.00 25.00 C ATOM 1131 CD GLN A 73 22.245 8.839 -7.678 1.00 25.00 C ATOM 1132 OE1 GLN A 73 22.007 8.135 -8.644 1.00 25.00 O ATOM 1133 NE2 GLN A 73 22.749 10.038 -7.794 1.00 25.00 N ATOM 0 H GLN A 73 20.672 10.253 -4.984 1.00 25.00 H new ATOM 0 HA GLN A 73 19.615 9.447 -7.410 1.00 25.00 H new ATOM 0 HB2 GLN A 73 20.359 7.707 -5.017 1.00 25.00 H new ATOM 0 HB3 GLN A 73 20.239 7.155 -6.676 1.00 25.00 H new ATOM 0 HG2 GLN A 73 22.264 9.122 -5.560 1.00 25.00 H new ATOM 0 HG3 GLN A 73 22.571 7.473 -6.068 1.00 25.00 H new ATOM 0 HE21 GLN A 73 22.934 10.596 -6.961 1.00 25.00 H new ATOM 0 HE22 GLN A 73 22.958 10.416 -8.718 1.00 25.00 H new ATOM 1142 N GLU A 74 17.671 8.729 -4.850 1.00 25.00 N ATOM 1143 CA GLU A 74 16.308 8.350 -4.497 1.00 25.00 C ATOM 1144 C GLU A 74 15.299 9.454 -4.810 1.00 25.00 C ATOM 1145 O GLU A 74 14.142 9.180 -5.118 1.00 25.00 O ATOM 1146 CB GLU A 74 16.228 7.961 -3.021 1.00 25.00 C ATOM 1147 CG GLU A 74 17.199 6.842 -2.636 1.00 25.00 C ATOM 1148 CD GLU A 74 17.115 5.649 -3.586 1.00 25.00 C ATOM 1149 OE1 GLU A 74 18.171 5.219 -4.094 1.00 25.00 O ATOM 1150 OE2 GLU A 74 15.994 5.190 -3.893 1.00 25.00 O ATOM 0 H GLU A 74 18.244 9.033 -4.063 1.00 25.00 H new ATOM 0 HA GLU A 74 16.045 7.489 -5.111 1.00 25.00 H new ATOM 0 HB2 GLU A 74 16.436 8.839 -2.409 1.00 25.00 H new ATOM 0 HB3 GLU A 74 15.211 7.645 -2.790 1.00 25.00 H new ATOM 0 HG2 GLU A 74 18.217 7.232 -2.635 1.00 25.00 H new ATOM 0 HG3 GLU A 74 16.984 6.511 -1.620 1.00 25.00 H new ATOM 1157 N ARG A 75 15.727 10.707 -4.721 1.00 25.00 N ATOM 1158 CA ARG A 75 14.818 11.831 -4.976 1.00 25.00 C ATOM 1159 C ARG A 75 14.379 11.885 -6.422 1.00 25.00 C ATOM 1160 O ARG A 75 13.200 12.035 -6.683 1.00 25.00 O ATOM 1161 CB ARG A 75 15.458 13.177 -4.639 1.00 25.00 C ATOM 1162 CG ARG A 75 15.705 13.408 -3.161 1.00 25.00 C ATOM 1163 CD ARG A 75 16.085 14.863 -2.918 1.00 25.00 C ATOM 1164 NE ARG A 75 14.930 15.763 -3.108 1.00 25.00 N ATOM 1165 CZ ARG A 75 14.998 17.078 -3.296 1.00 25.00 C ATOM 1166 NH1 ARG A 75 16.138 17.726 -3.334 1.00 25.00 N ATOM 1167 NH2 ARG A 75 13.895 17.756 -3.461 1.00 25.00 N ATOM 0 H ARG A 75 16.681 10.974 -4.479 1.00 25.00 H new ATOM 0 HA ARG A 75 13.958 11.657 -4.329 1.00 25.00 H new ATOM 0 HB2 ARG A 75 16.407 13.255 -5.169 1.00 25.00 H new ATOM 0 HB3 ARG A 75 14.816 13.974 -5.015 1.00 25.00 H new ATOM 0 HG2 ARG A 75 14.811 13.157 -2.591 1.00 25.00 H new ATOM 0 HG3 ARG A 75 16.502 12.752 -2.810 1.00 25.00 H new ATOM 0 HD2 ARG A 75 16.472 14.975 -1.905 1.00 25.00 H new ATOM 0 HD3 ARG A 75 16.887 15.149 -3.599 1.00 25.00 H new ATOM 0 HE ARG A 75 14.002 15.341 -3.094 1.00 25.00 H new ATOM 0 HH11 ARG A 75 17.016 17.220 -3.217 1.00 25.00 H new ATOM 0 HH12 ARG A 75 16.146 18.735 -3.481 1.00 25.00 H new ATOM 0 HH21 ARG A 75 12.995 17.277 -3.445 1.00 25.00 H new ATOM 0 HH22 ARG A 75 13.933 18.765 -3.606 1.00 25.00 H new ATOM 1181 N ILE A 76 15.321 11.772 -7.348 1.00 25.00 N ATOM 1182 CA ILE A 76 15.048 11.922 -8.788 1.00 25.00 C ATOM 1183 C ILE A 76 14.055 10.907 -9.332 1.00 25.00 C ATOM 1184 O ILE A 76 13.489 11.096 -10.395 1.00 25.00 O ATOM 1185 CB ILE A 76 16.355 11.897 -9.628 1.00 25.00 C ATOM 1186 CG1 ILE A 76 17.089 10.547 -9.452 1.00 25.00 C ATOM 1187 CG2 ILE A 76 17.232 13.093 -9.224 1.00 25.00 C ATOM 1188 CD1 ILE A 76 18.419 10.421 -10.213 1.00 25.00 C ATOM 0 H ILE A 76 16.298 11.574 -7.132 1.00 25.00 H new ATOM 0 HA ILE A 76 14.582 12.902 -8.887 1.00 25.00 H new ATOM 0 HB ILE A 76 16.119 11.988 -10.688 1.00 25.00 H new ATOM 0 HG12 ILE A 76 17.280 10.391 -8.390 1.00 25.00 H new ATOM 0 HG13 ILE A 76 16.425 9.746 -9.777 1.00 25.00 H new ATOM 0 HG21 ILE A 76 18.152 13.084 -9.809 1.00 25.00 H new ATOM 0 HG22 ILE A 76 16.692 14.021 -9.413 1.00 25.00 H new ATOM 0 HG23 ILE A 76 17.475 13.024 -8.164 1.00 25.00 H new ATOM 0 HD11 ILE A 76 18.854 9.440 -10.025 1.00 25.00 H new ATOM 0 HD12 ILE A 76 18.239 10.539 -11.282 1.00 25.00 H new ATOM 0 HD13 ILE A 76 19.107 11.195 -9.873 1.00 25.00 H new ATOM 1200 N ARG A 77 13.849 9.820 -8.604 1.00 25.00 N ATOM 1201 CA ARG A 77 12.884 8.787 -9.007 1.00 25.00 C ATOM 1202 C ARG A 77 11.430 9.280 -9.007 1.00 25.00 C ATOM 1203 O ARG A 77 10.554 8.619 -9.566 1.00 25.00 O ATOM 1204 CB ARG A 77 12.986 7.594 -8.060 1.00 25.00 C ATOM 1205 CG ARG A 77 14.403 7.072 -7.896 1.00 25.00 C ATOM 1206 CD ARG A 77 14.433 5.676 -7.280 1.00 25.00 C ATOM 1207 NE ARG A 77 15.771 5.336 -6.756 1.00 25.00 N ATOM 1208 CZ ARG A 77 16.846 5.049 -7.483 1.00 25.00 C ATOM 1209 NH1 ARG A 77 16.827 5.024 -8.795 1.00 25.00 N ATOM 1210 NH2 ARG A 77 17.964 4.784 -6.877 1.00 25.00 N ATOM 0 H ARG A 77 14.334 9.623 -7.729 1.00 25.00 H new ATOM 0 HA ARG A 77 13.140 8.510 -10.030 1.00 25.00 H new ATOM 0 HB2 ARG A 77 12.597 7.881 -7.083 1.00 25.00 H new ATOM 0 HB3 ARG A 77 12.351 6.790 -8.432 1.00 25.00 H new ATOM 0 HG2 ARG A 77 14.895 7.049 -8.868 1.00 25.00 H new ATOM 0 HG3 ARG A 77 14.971 7.758 -7.267 1.00 25.00 H new ATOM 0 HD2 ARG A 77 13.702 5.619 -6.474 1.00 25.00 H new ATOM 0 HD3 ARG A 77 14.139 4.942 -8.030 1.00 25.00 H new ATOM 0 HE ARG A 77 15.880 5.320 -5.742 1.00 25.00 H new ATOM 0 HH11 ARG A 77 15.963 5.230 -9.297 1.00 25.00 H new ATOM 0 HH12 ARG A 77 17.676 4.799 -9.313 1.00 25.00 H new ATOM 0 HH21 ARG A 77 18.008 4.798 -5.858 1.00 25.00 H new ATOM 0 HH22 ARG A 77 18.798 4.562 -7.420 1.00 25.00 H new ATOM 1224 N LEU A 78 11.180 10.396 -8.336 1.00 25.00 N ATOM 1225 CA LEU A 78 9.822 10.950 -8.198 1.00 25.00 C ATOM 1226 C LEU A 78 9.814 12.487 -8.148 1.00 25.00 C ATOM 1227 O LEU A 78 8.958 13.148 -8.725 1.00 25.00 O ATOM 1228 CB LEU A 78 9.205 10.389 -6.906 1.00 25.00 C ATOM 1229 CG LEU A 78 7.672 10.318 -6.777 1.00 25.00 C ATOM 1230 CD1 LEU A 78 7.348 9.461 -5.553 1.00 25.00 C ATOM 1231 CD2 LEU A 78 6.982 11.669 -6.633 1.00 25.00 C ATOM 0 H LEU A 78 11.902 10.947 -7.871 1.00 25.00 H new ATOM 0 HA LEU A 78 9.242 10.659 -9.074 1.00 25.00 H new ATOM 0 HB2 LEU A 78 9.593 9.380 -6.768 1.00 25.00 H new ATOM 0 HB3 LEU A 78 9.577 10.990 -6.076 1.00 25.00 H new ATOM 0 HG LEU A 78 7.293 9.892 -7.706 1.00 25.00 H new ATOM 0 HD11 LEU A 78 6.267 9.391 -5.434 1.00 25.00 H new ATOM 0 HD12 LEU A 78 7.764 8.462 -5.688 1.00 25.00 H new ATOM 0 HD13 LEU A 78 7.782 9.918 -4.664 1.00 25.00 H new ATOM 0 HD21 LEU A 78 5.905 11.521 -6.549 1.00 25.00 H new ATOM 0 HD22 LEU A 78 7.350 12.172 -5.739 1.00 25.00 H new ATOM 0 HD23 LEU A 78 7.196 12.282 -7.508 1.00 25.00 H new ATOM 1243 N PHE A 79 10.757 13.035 -7.403 1.00 25.00 N ATOM 1244 CA PHE A 79 10.863 14.471 -7.157 1.00 25.00 C ATOM 1245 C PHE A 79 12.030 15.059 -7.954 1.00 25.00 C ATOM 1246 O PHE A 79 12.676 14.363 -8.718 1.00 25.00 O ATOM 1247 CB PHE A 79 11.133 14.709 -5.663 1.00 25.00 C ATOM 1248 CG PHE A 79 10.254 13.896 -4.746 1.00 25.00 C ATOM 1249 CD1 PHE A 79 10.729 12.691 -4.188 1.00 25.00 C ATOM 1250 CD2 PHE A 79 8.957 14.335 -4.419 1.00 25.00 C ATOM 1251 CE1 PHE A 79 9.912 11.922 -3.321 1.00 25.00 C ATOM 1252 CE2 PHE A 79 8.134 13.577 -3.546 1.00 25.00 C ATOM 1253 CZ PHE A 79 8.615 12.367 -2.998 1.00 25.00 C ATOM 0 H PHE A 79 11.485 12.490 -6.942 1.00 25.00 H new ATOM 0 HA PHE A 79 9.932 14.949 -7.462 1.00 25.00 H new ATOM 0 HB2 PHE A 79 12.176 14.476 -5.451 1.00 25.00 H new ATOM 0 HB3 PHE A 79 10.991 15.767 -5.442 1.00 25.00 H new ATOM 0 HD1 PHE A 79 11.726 12.350 -4.424 1.00 25.00 H new ATOM 0 HD2 PHE A 79 8.584 15.258 -4.837 1.00 25.00 H new ATOM 0 HE1 PHE A 79 10.284 10.996 -2.909 1.00 25.00 H new ATOM 0 HE2 PHE A 79 7.141 13.925 -3.301 1.00 25.00 H new ATOM 0 HZ PHE A 79 7.991 11.786 -2.335 1.00 25.00 H new ATOM 1263 N SER A 80 12.333 16.326 -7.680 1.00 25.00 N ATOM 1264 CA SER A 80 13.523 17.010 -8.211 1.00 25.00 C ATOM 1265 C SER A 80 13.615 17.105 -9.730 1.00 25.00 C ATOM 1266 O SER A 80 14.703 17.122 -10.289 1.00 25.00 O ATOM 1267 CB SER A 80 14.803 16.382 -7.647 1.00 25.00 C ATOM 1268 OG SER A 80 14.839 16.553 -6.241 1.00 25.00 O ATOM 0 H SER A 80 11.758 16.917 -7.079 1.00 25.00 H new ATOM 0 HA SER A 80 13.413 18.040 -7.872 1.00 25.00 H new ATOM 0 HB2 SER A 80 14.839 15.321 -7.895 1.00 25.00 H new ATOM 0 HB3 SER A 80 15.678 16.846 -8.102 1.00 25.00 H new ATOM 0 HG SER A 80 15.657 16.149 -5.883 1.00 25.00 H new ATOM 1274 N ALA A 81 12.472 17.313 -10.371 1.00 25.00 N ATOM 1275 CA ALA A 81 12.416 17.632 -11.803 1.00 25.00 C ATOM 1276 C ALA A 81 12.710 19.136 -11.989 1.00 25.00 C ATOM 1277 O ALA A 81 12.033 19.829 -12.748 1.00 25.00 O ATOM 1278 CB ALA A 81 11.021 17.277 -12.349 1.00 25.00 C ATOM 0 H ALA A 81 11.558 17.267 -9.921 1.00 25.00 H new ATOM 0 HA ALA A 81 13.160 17.054 -12.352 1.00 25.00 H new ATOM 0 HB1 ALA A 81 10.976 17.513 -13.412 1.00 25.00 H new ATOM 0 HB2 ALA A 81 10.834 16.213 -12.205 1.00 25.00 H new ATOM 0 HB3 ALA A 81 10.264 17.854 -11.817 1.00 25.00 H new ATOM 1284 N ASP A 82 13.660 19.635 -11.215 1.00 25.00 N ATOM 1285 CA ASP A 82 13.968 21.058 -11.145 1.00 25.00 C ATOM 1286 C ASP A 82 14.821 21.472 -12.354 1.00 25.00 C ATOM 1287 O ASP A 82 15.627 20.678 -12.840 1.00 25.00 O ATOM 1288 CB ASP A 82 14.726 21.349 -9.839 1.00 25.00 C ATOM 1289 CG ASP A 82 13.943 20.920 -8.597 1.00 25.00 C ATOM 1290 OD1 ASP A 82 12.749 21.268 -8.484 1.00 25.00 O ATOM 1291 OD2 ASP A 82 14.519 20.201 -7.743 1.00 25.00 O ATOM 0 H ASP A 82 14.246 19.059 -10.611 1.00 25.00 H new ATOM 0 HA ASP A 82 13.041 21.631 -11.161 1.00 25.00 H new ATOM 0 HB2 ASP A 82 15.685 20.831 -9.856 1.00 25.00 H new ATOM 0 HB3 ASP A 82 14.941 22.416 -9.778 1.00 25.00 H new ATOM 1296 N PRO A 83 14.642 22.706 -12.868 1.00 25.00 N ATOM 1297 CA PRO A 83 15.388 23.129 -14.063 1.00 25.00 C ATOM 1298 C PRO A 83 16.853 23.495 -13.805 1.00 25.00 C ATOM 1299 O PRO A 83 17.287 23.610 -12.663 1.00 25.00 O ATOM 1300 CB PRO A 83 14.602 24.359 -14.523 1.00 25.00 C ATOM 1301 CG PRO A 83 14.123 24.958 -13.260 1.00 25.00 C ATOM 1302 CD PRO A 83 13.725 23.773 -12.412 1.00 25.00 C ATOM 0 HA PRO A 83 15.457 22.321 -14.791 1.00 25.00 H new ATOM 0 HB2 PRO A 83 15.232 25.051 -15.081 1.00 25.00 H new ATOM 0 HB3 PRO A 83 13.774 24.084 -15.176 1.00 25.00 H new ATOM 0 HG2 PRO A 83 14.903 25.548 -12.778 1.00 25.00 H new ATOM 0 HG3 PRO A 83 13.279 25.626 -13.432 1.00 25.00 H new ATOM 0 HD2 PRO A 83 13.846 23.980 -11.349 1.00 25.00 H new ATOM 0 HD3 PRO A 83 12.681 23.500 -12.567 1.00 25.00 H new ATOM 1310 N PHE A 84 17.593 23.710 -14.890 1.00 25.00 N ATOM 1311 CA PHE A 84 19.025 24.030 -14.839 1.00 25.00 C ATOM 1312 C PHE A 84 19.301 25.416 -15.416 1.00 25.00 C ATOM 1313 O PHE A 84 20.433 25.790 -15.652 1.00 25.00 O ATOM 1314 CB PHE A 84 19.788 22.977 -15.653 1.00 25.00 C ATOM 1315 CG PHE A 84 19.341 22.889 -17.096 1.00 25.00 C ATOM 1316 CD1 PHE A 84 19.868 23.765 -18.066 1.00 25.00 C ATOM 1317 CD2 PHE A 84 18.383 21.933 -17.489 1.00 25.00 C ATOM 1318 CE1 PHE A 84 19.437 23.703 -19.413 1.00 25.00 C ATOM 1319 CE2 PHE A 84 17.943 21.860 -18.838 1.00 25.00 C ATOM 1320 CZ PHE A 84 18.470 22.752 -19.798 1.00 25.00 C ATOM 0 H PHE A 84 17.217 23.668 -15.837 1.00 25.00 H new ATOM 0 HA PHE A 84 19.353 24.026 -13.799 1.00 25.00 H new ATOM 0 HB2 PHE A 84 20.853 23.209 -15.624 1.00 25.00 H new ATOM 0 HB3 PHE A 84 19.661 22.003 -15.181 1.00 25.00 H new ATOM 0 HD1 PHE A 84 20.611 24.494 -17.778 1.00 25.00 H new ATOM 0 HD2 PHE A 84 17.979 21.249 -16.757 1.00 25.00 H new ATOM 0 HE1 PHE A 84 19.848 24.383 -20.144 1.00 25.00 H new ATOM 0 HE2 PHE A 84 17.208 21.124 -19.129 1.00 25.00 H new ATOM 0 HZ PHE A 84 18.133 22.706 -20.823 1.00 25.00 H new ATOM 1330 N ASP A 85 18.212 26.125 -15.665 1.00 25.00 N ATOM 1331 CA ASP A 85 18.186 27.426 -16.346 1.00 25.00 C ATOM 1332 C ASP A 85 18.710 27.336 -17.784 1.00 25.00 C ATOM 1333 O ASP A 85 19.882 27.144 -18.048 1.00 25.00 O ATOM 1334 CB ASP A 85 18.923 28.510 -15.555 1.00 25.00 C ATOM 1335 CG ASP A 85 18.622 29.909 -16.080 1.00 25.00 C ATOM 1336 OD1 ASP A 85 19.122 30.895 -15.509 1.00 25.00 O ATOM 1337 OD2 ASP A 85 17.895 30.020 -17.095 1.00 25.00 O ATOM 0 H ASP A 85 17.283 25.805 -15.391 1.00 25.00 H new ATOM 0 HA ASP A 85 17.138 27.721 -16.399 1.00 25.00 H new ATOM 0 HB2 ASP A 85 18.638 28.449 -14.505 1.00 25.00 H new ATOM 0 HB3 ASP A 85 19.997 28.328 -15.605 1.00 25.00 H new ATOM 1342 N LEU A 86 17.789 27.471 -18.720 1.00 25.00 N ATOM 1343 CA LEU A 86 18.125 27.416 -20.136 1.00 25.00 C ATOM 1344 C LEU A 86 18.995 28.601 -20.565 1.00 25.00 C ATOM 1345 O LEU A 86 19.779 28.481 -21.500 1.00 25.00 O ATOM 1346 CB LEU A 86 16.841 27.366 -20.972 1.00 25.00 C ATOM 1347 CG LEU A 86 15.761 28.413 -20.640 1.00 25.00 C ATOM 1348 CD1 LEU A 86 15.655 29.445 -21.758 1.00 25.00 C ATOM 1349 CD2 LEU A 86 14.407 27.727 -20.438 1.00 25.00 C ATOM 0 H LEU A 86 16.799 27.620 -18.527 1.00 25.00 H new ATOM 0 HA LEU A 86 18.707 26.510 -20.307 1.00 25.00 H new ATOM 0 HB2 LEU A 86 17.113 27.478 -22.021 1.00 25.00 H new ATOM 0 HB3 LEU A 86 16.401 26.375 -20.861 1.00 25.00 H new ATOM 0 HG LEU A 86 16.046 28.922 -19.719 1.00 25.00 H new ATOM 0 HD11 LEU A 86 14.887 30.177 -21.506 1.00 25.00 H new ATOM 0 HD12 LEU A 86 16.613 29.951 -21.878 1.00 25.00 H new ATOM 0 HD13 LEU A 86 15.389 28.946 -22.690 1.00 25.00 H new ATOM 0 HD21 LEU A 86 13.651 28.476 -20.204 1.00 25.00 H new ATOM 0 HD22 LEU A 86 14.126 27.201 -21.350 1.00 25.00 H new ATOM 0 HD23 LEU A 86 14.479 27.015 -19.616 1.00 25.00 H new ATOM 1361 N GLU A 87 18.848 29.736 -19.893 1.00 25.00 N ATOM 1362 CA GLU A 87 19.692 30.904 -20.172 1.00 25.00 C ATOM 1363 C GLU A 87 21.036 30.737 -19.462 1.00 25.00 C ATOM 1364 O GLU A 87 22.097 30.945 -20.056 1.00 25.00 O ATOM 1365 CB GLU A 87 19.027 32.197 -19.672 1.00 25.00 C ATOM 1366 CG GLU A 87 17.751 32.599 -20.412 1.00 25.00 C ATOM 1367 CD GLU A 87 18.028 33.364 -21.704 1.00 25.00 C ATOM 1368 OE1 GLU A 87 18.538 32.762 -22.673 1.00 25.00 O ATOM 1369 OE2 GLU A 87 17.699 34.572 -21.757 1.00 25.00 O ATOM 0 H GLU A 87 18.159 29.878 -19.155 1.00 25.00 H new ATOM 0 HA GLU A 87 19.834 30.974 -21.250 1.00 25.00 H new ATOM 0 HB2 GLU A 87 18.793 32.081 -18.614 1.00 25.00 H new ATOM 0 HB3 GLU A 87 19.747 33.012 -19.752 1.00 25.00 H new ATOM 0 HG2 GLU A 87 17.174 31.704 -20.643 1.00 25.00 H new ATOM 0 HG3 GLU A 87 17.136 33.215 -19.756 1.00 25.00 H new ATOM 1376 N ALA A 88 20.954 30.408 -18.172 1.00 25.00 N ATOM 1377 CA ALA A 88 22.111 30.263 -17.270 1.00 25.00 C ATOM 1378 C ALA A 88 23.138 31.397 -17.485 1.00 25.00 C ATOM 1379 O ALA A 88 24.350 31.178 -17.659 1.00 25.00 O ATOM 1380 CB ALA A 88 22.733 28.869 -17.430 1.00 25.00 C ATOM 0 H ALA A 88 20.063 30.230 -17.709 1.00 25.00 H new ATOM 0 HA ALA A 88 21.767 30.354 -16.240 1.00 25.00 H new ATOM 0 HB1 ALA A 88 23.587 28.772 -16.759 1.00 25.00 H new ATOM 0 HB2 ALA A 88 21.991 28.109 -17.185 1.00 25.00 H new ATOM 0 HB3 ALA A 88 23.064 28.734 -18.460 1.00 25.00 H new ATOM 1386 N GLN A 89 22.601 32.608 -17.544 1.00 25.00 N ATOM 1387 CA GLN A 89 23.346 33.811 -17.917 1.00 25.00 C ATOM 1388 C GLN A 89 24.354 34.319 -16.876 1.00 25.00 C ATOM 1389 O GLN A 89 24.345 33.896 -15.724 1.00 25.00 O ATOM 1390 CB GLN A 89 22.340 34.930 -18.226 1.00 25.00 C ATOM 1391 CG GLN A 89 21.507 35.374 -17.021 1.00 25.00 C ATOM 1392 CD GLN A 89 20.550 36.487 -17.373 1.00 25.00 C ATOM 1393 OE1 GLN A 89 20.957 37.615 -17.608 1.00 25.00 O ATOM 1394 NE2 GLN A 89 19.282 36.181 -17.413 1.00 25.00 N ATOM 0 H GLN A 89 21.620 32.789 -17.331 1.00 25.00 H new ATOM 0 HA GLN A 89 23.946 33.530 -18.782 1.00 25.00 H new ATOM 0 HB2 GLN A 89 22.881 35.792 -18.617 1.00 25.00 H new ATOM 0 HB3 GLN A 89 21.667 34.591 -19.014 1.00 25.00 H new ATOM 0 HG2 GLN A 89 20.946 34.523 -16.635 1.00 25.00 H new ATOM 0 HG3 GLN A 89 22.172 35.706 -16.224 1.00 25.00 H new ATOM 0 HE21 GLN A 89 18.981 35.228 -17.211 1.00 25.00 H new ATOM 0 HE22 GLN A 89 18.592 36.895 -17.647 1.00 25.00 H new ATOM 1403 N ALA A 90 25.176 35.272 -17.321 1.00 25.00 N ATOM 1404 CA ALA A 90 26.191 35.983 -16.519 1.00 25.00 C ATOM 1405 C ALA A 90 27.349 35.115 -15.991 1.00 25.00 C ATOM 1406 O ALA A 90 27.161 34.016 -15.472 1.00 25.00 O ATOM 1407 CB ALA A 90 25.521 36.757 -15.377 1.00 25.00 C ATOM 0 H ALA A 90 25.157 35.587 -18.291 1.00 25.00 H new ATOM 0 HA ALA A 90 26.668 36.674 -17.214 1.00 25.00 H new ATOM 0 HB1 ALA A 90 26.282 37.276 -14.794 1.00 25.00 H new ATOM 0 HB2 ALA A 90 24.822 37.484 -15.791 1.00 25.00 H new ATOM 0 HB3 ALA A 90 24.982 36.062 -14.733 1.00 25.00 H new ATOM 1413 N LYS A 91 28.565 35.613 -16.169 1.00 25.00 N ATOM 1414 CA LYS A 91 29.777 34.907 -15.776 1.00 25.00 C ATOM 1415 C LYS A 91 30.699 35.923 -15.107 1.00 25.00 C ATOM 1416 O LYS A 91 30.262 37.014 -14.777 1.00 25.00 O ATOM 1417 CB LYS A 91 30.425 34.275 -17.018 1.00 25.00 C ATOM 1418 CG LYS A 91 29.563 33.178 -17.694 1.00 25.00 C ATOM 1419 CD LYS A 91 29.427 31.903 -16.833 1.00 25.00 C ATOM 1420 CE LYS A 91 28.269 31.022 -17.318 1.00 25.00 C ATOM 1421 NZ LYS A 91 26.976 31.406 -16.647 1.00 25.00 N ATOM 0 H LYS A 91 28.739 36.524 -16.593 1.00 25.00 H new ATOM 0 HA LYS A 91 29.565 34.099 -15.076 1.00 25.00 H new ATOM 0 HB2 LYS A 91 30.631 35.060 -17.746 1.00 25.00 H new ATOM 0 HB3 LYS A 91 31.385 33.844 -16.734 1.00 25.00 H new ATOM 0 HG2 LYS A 91 28.570 33.579 -17.900 1.00 25.00 H new ATOM 0 HG3 LYS A 91 30.006 32.916 -18.655 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.357 31.336 -16.870 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.264 32.181 -15.792 1.00 25.00 H new ATOM 0 HE2 LYS A 91 28.164 31.117 -18.399 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.493 29.976 -17.111 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 26.196 31.336 -17.331 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 26.795 30.765 -15.849 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.043 32.383 -16.298 1.00 25.00 H new ATOM 1435 N ILE A 92 31.948 35.550 -14.885 1.00 25.00 N ATOM 1436 CA ILE A 92 32.914 36.407 -14.214 1.00 25.00 C ATOM 1437 C ILE A 92 33.907 36.852 -15.274 1.00 25.00 C ATOM 1438 O ILE A 92 34.684 36.049 -15.786 1.00 25.00 O ATOM 1439 CB ILE A 92 33.668 35.652 -13.077 1.00 25.00 C ATOM 1440 CG1 ILE A 92 32.663 35.038 -12.078 1.00 25.00 C ATOM 1441 CG2 ILE A 92 34.640 36.615 -12.339 1.00 25.00 C ATOM 1442 CD1 ILE A 92 33.267 33.985 -11.157 1.00 25.00 C ATOM 0 H ILE A 92 32.322 34.643 -15.165 1.00 25.00 H new ATOM 0 HA ILE A 92 32.402 37.250 -13.750 1.00 25.00 H new ATOM 0 HB ILE A 92 34.249 34.846 -13.525 1.00 25.00 H new ATOM 0 HG12 ILE A 92 32.238 35.836 -11.470 1.00 25.00 H new ATOM 0 HG13 ILE A 92 31.841 34.589 -12.635 1.00 25.00 H new ATOM 0 HG21 ILE A 92 35.159 36.073 -11.548 1.00 25.00 H new ATOM 0 HG22 ILE A 92 35.369 37.009 -13.047 1.00 25.00 H new ATOM 0 HG23 ILE A 92 34.075 37.439 -11.903 1.00 25.00 H new ATOM 0 HD11 ILE A 92 32.497 33.603 -10.486 1.00 25.00 H new ATOM 0 HD12 ILE A 92 33.667 33.166 -11.754 1.00 25.00 H new ATOM 0 HD13 ILE A 92 34.070 34.432 -10.571 1.00 25.00 H new ATOM 1454 N GLU A 93 33.836 38.119 -15.626 1.00 25.00 N ATOM 1455 CA GLU A 93 34.687 38.706 -16.647 1.00 25.00 C ATOM 1456 C GLU A 93 35.277 40.022 -16.131 1.00 25.00 C ATOM 1457 O GLU A 93 34.577 40.826 -15.522 1.00 25.00 O ATOM 1458 CB GLU A 93 33.864 38.922 -17.924 1.00 25.00 C ATOM 1459 CG GLU A 93 32.540 39.686 -17.734 1.00 25.00 C ATOM 1460 CD GLU A 93 31.677 39.654 -18.985 1.00 25.00 C ATOM 1461 OE1 GLU A 93 32.095 40.216 -20.021 1.00 25.00 O ATOM 1462 OE2 GLU A 93 30.584 39.042 -18.937 1.00 25.00 O ATOM 0 H GLU A 93 33.180 38.779 -15.209 1.00 25.00 H new ATOM 0 HA GLU A 93 35.515 38.036 -16.880 1.00 25.00 H new ATOM 0 HB2 GLU A 93 34.477 39.464 -18.644 1.00 25.00 H new ATOM 0 HB3 GLU A 93 33.643 37.949 -18.363 1.00 25.00 H new ATOM 0 HG2 GLU A 93 31.987 39.251 -16.901 1.00 25.00 H new ATOM 0 HG3 GLU A 93 32.754 40.721 -17.468 1.00 25.00 H new ATOM 1469 N GLU A 94 36.574 40.211 -16.340 1.00 25.00 N ATOM 1470 CA GLU A 94 37.283 41.406 -15.877 1.00 25.00 C ATOM 1471 C GLU A 94 38.512 41.650 -16.743 1.00 25.00 C ATOM 1472 O GLU A 94 39.142 40.705 -17.213 1.00 25.00 O ATOM 1473 CB GLU A 94 37.795 41.219 -14.439 1.00 25.00 C ATOM 1474 CG GLU A 94 36.882 41.756 -13.349 1.00 25.00 C ATOM 1475 CD GLU A 94 37.607 41.856 -12.013 1.00 25.00 C ATOM 1476 OE1 GLU A 94 38.598 42.620 -11.936 1.00 25.00 O ATOM 1477 OE2 GLU A 94 37.203 41.172 -11.048 1.00 25.00 O ATOM 0 H GLU A 94 37.167 39.544 -16.834 1.00 25.00 H new ATOM 0 HA GLU A 94 36.581 42.238 -15.931 1.00 25.00 H new ATOM 0 HB2 GLU A 94 37.956 40.155 -14.264 1.00 25.00 H new ATOM 0 HB3 GLU A 94 38.766 41.707 -14.350 1.00 25.00 H new ATOM 0 HG2 GLU A 94 36.509 42.739 -13.637 1.00 25.00 H new ATOM 0 HG3 GLU A 94 36.015 41.104 -13.246 1.00 25.00 H new ATOM 1484 N ASP A 95 38.901 42.913 -16.863 1.00 25.00 N ATOM 1485 CA ASP A 95 40.195 43.285 -17.451 1.00 25.00 C ATOM 1486 C ASP A 95 40.672 44.539 -16.721 1.00 25.00 C ATOM 1487 O ASP A 95 41.131 45.514 -17.325 1.00 25.00 O ATOM 1488 CB ASP A 95 40.111 43.534 -18.962 1.00 25.00 C ATOM 1489 CG ASP A 95 41.495 43.621 -19.615 1.00 25.00 C ATOM 1490 OD1 ASP A 95 41.587 43.989 -20.805 1.00 25.00 O ATOM 1491 OD2 ASP A 95 42.507 43.290 -18.946 1.00 25.00 O ATOM 0 H ASP A 95 38.338 43.708 -16.560 1.00 25.00 H new ATOM 0 HA ASP A 95 40.898 42.461 -17.330 1.00 25.00 H new ATOM 0 HB2 ASP A 95 39.541 42.731 -19.429 1.00 25.00 H new ATOM 0 HB3 ASP A 95 39.566 44.460 -19.146 1.00 25.00 H new ATOM 1496 N ILE A 96 40.515 44.528 -15.403 1.00 25.00 N ATOM 1497 CA ILE A 96 40.901 45.667 -14.562 1.00 25.00 C ATOM 1498 C ILE A 96 42.411 45.544 -14.299 1.00 25.00 C ATOM 1499 O ILE A 96 42.880 45.354 -13.181 1.00 25.00 O ATOM 1500 CB ILE A 96 40.063 45.726 -13.237 1.00 25.00 C ATOM 1501 CG1 ILE A 96 38.550 45.567 -13.540 1.00 25.00 C ATOM 1502 CG2 ILE A 96 40.313 47.068 -12.479 1.00 25.00 C ATOM 1503 CD1 ILE A 96 37.924 46.632 -14.493 1.00 25.00 C ATOM 0 H ILE A 96 40.122 43.741 -14.886 1.00 25.00 H new ATOM 0 HA ILE A 96 40.689 46.607 -15.070 1.00 25.00 H new ATOM 0 HB ILE A 96 40.385 44.901 -12.601 1.00 25.00 H new ATOM 0 HG12 ILE A 96 38.389 44.581 -13.975 1.00 25.00 H new ATOM 0 HG13 ILE A 96 38.007 45.591 -12.595 1.00 25.00 H new ATOM 0 HG21 ILE A 96 39.721 47.085 -11.564 1.00 25.00 H new ATOM 0 HG22 ILE A 96 41.370 47.153 -12.229 1.00 25.00 H new ATOM 0 HG23 ILE A 96 40.022 47.904 -13.115 1.00 25.00 H new ATOM 0 HD11 ILE A 96 36.864 46.419 -14.631 1.00 25.00 H new ATOM 0 HD12 ILE A 96 38.041 47.624 -14.057 1.00 25.00 H new ATOM 0 HD13 ILE A 96 38.429 46.598 -15.458 1.00 25.00 H new ATOM 1515 N ARG A 97 43.163 45.598 -15.387 1.00 25.00 N ATOM 1516 CA ARG A 97 44.608 45.360 -15.392 1.00 25.00 C ATOM 1517 C ARG A 97 45.438 46.552 -14.905 1.00 25.00 C ATOM 1518 O ARG A 97 46.577 46.755 -15.322 1.00 25.00 O ATOM 1519 CB ARG A 97 45.007 45.002 -16.829 1.00 25.00 C ATOM 1520 CG ARG A 97 45.856 43.747 -16.944 1.00 25.00 C ATOM 1521 CD ARG A 97 46.376 43.583 -18.365 1.00 25.00 C ATOM 1522 NE ARG A 97 45.279 43.509 -19.346 1.00 25.00 N ATOM 1523 CZ ARG A 97 45.422 43.492 -20.664 1.00 25.00 C ATOM 1524 NH1 ARG A 97 46.600 43.519 -21.242 1.00 25.00 N ATOM 1525 NH2 ARG A 97 44.363 43.455 -21.415 1.00 25.00 N ATOM 0 H ARG A 97 42.785 45.812 -16.310 1.00 25.00 H new ATOM 0 HA ARG A 97 44.819 44.553 -14.690 1.00 25.00 H new ATOM 0 HB2 ARG A 97 44.103 44.872 -17.424 1.00 25.00 H new ATOM 0 HB3 ARG A 97 45.555 45.839 -17.262 1.00 25.00 H new ATOM 0 HG2 ARG A 97 46.693 43.802 -16.248 1.00 25.00 H new ATOM 0 HG3 ARG A 97 45.266 42.875 -16.664 1.00 25.00 H new ATOM 0 HD2 ARG A 97 47.028 44.421 -18.612 1.00 25.00 H new ATOM 0 HD3 ARG A 97 46.981 42.679 -18.428 1.00 25.00 H new ATOM 0 HE ARG A 97 44.328 43.467 -18.980 1.00 25.00 H new ATOM 0 HH11 ARG A 97 47.446 43.554 -20.674 1.00 25.00 H new ATOM 0 HH12 ARG A 97 46.669 43.505 -22.260 1.00 25.00 H new ATOM 0 HH21 ARG A 97 43.436 43.439 -20.989 1.00 25.00 H new ATOM 0 HH22 ARG A 97 44.458 43.442 -22.430 1.00 25.00 H new ATOM 1539 N GLN A 98 44.853 47.368 -14.027 1.00 25.00 N ATOM 1540 CA GLN A 98 45.488 48.583 -13.493 1.00 25.00 C ATOM 1541 C GLN A 98 45.240 48.711 -11.996 1.00 25.00 C ATOM 1542 O GLN A 98 44.151 48.827 -11.479 1.00 25.00 O ATOM 1543 CB GLN A 98 45.002 49.860 -14.231 1.00 25.00 C ATOM 1544 CG GLN A 98 45.344 49.818 -15.734 1.00 25.00 C ATOM 1545 CD GLN A 98 44.950 51.104 -16.409 1.00 25.00 C ATOM 1546 OE1 GLN A 98 45.470 52.168 -16.188 1.00 25.00 O ATOM 1547 NE2 GLN A 98 43.972 51.015 -17.298 1.00 25.00 N ATOM 1548 OXT GLN A 98 46.317 48.666 -11.283 1.00 25.00 O ATOM 0 H GLN A 98 43.915 47.206 -13.660 1.00 25.00 H new ATOM 0 HA GLN A 98 46.560 48.488 -13.664 1.00 25.00 H new ATOM 0 HB2 GLN A 98 43.924 49.964 -14.106 1.00 25.00 H new ATOM 0 HB3 GLN A 98 45.461 50.739 -13.778 1.00 25.00 H new ATOM 0 HG2 GLN A 98 46.413 49.647 -15.864 1.00 25.00 H new ATOM 0 HG3 GLN A 98 44.828 48.982 -16.206 1.00 25.00 H new ATOM 0 HE21 GLN A 98 43.533 50.114 -17.484 1.00 25.00 H new ATOM 0 HE22 GLN A 98 43.658 51.848 -17.796 1.00 25.00 H new TER 1558 GLN A 98