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 42 ASN : amide:sc= -0.175 K(o=-0.44,f=-4.6!) USER MOD Set 1.2: A 64 GLN : amide:sc= -0.265 K(o=-0.44,f=-2.3) USER MOD Set 2.1: A 51 SER OG : rot -130:sc= 0.0715 USER MOD Set 2.2: A 56 LYS NZ :NH3+ 145:sc= 0.073 (180deg=-0.197) USER MOD Set 3.1: A 4 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ 162:sc= -0.0459 (180deg=-0.354) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0866 USER MOD Single : A 2 GLN : amide:sc= -0.0036 X(o=-0.0036,f=0) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 5 HIS : no HD1:sc= -0.0307 X(o=-0.031,f=-0.031) USER MOD Single : A 7 SER OG : rot 48:sc= 0.558 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -179:sc= 0.00739 USER MOD Single : A 14 SER OG : rot 180:sc= -0.112 USER MOD Single : A 16 GLN : amide:sc= 0.304 X(o=0.3,f=-0.097) USER MOD Single : A 20 ASN : amide:sc= -0.787 X(o=-0.79,f=-0.64) USER MOD Single : A 27 MET CE :methyl -177:sc= -0.274 (180deg=-0.29) USER MOD Single : A 31 ASN : amide:sc= -1.41 K(o=-1.4,f=-7.5!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot -25:sc= 1.25 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0156 USER MOD Single : A 65 GLN : amide:sc= 0.0272 X(o=0.027,f=-0.048) USER MOD Single : A 66 GLN : amide:sc= -0.0512 X(o=-0.051,f=-0.051) USER MOD Single : A 73 GLN : amide:sc= 0.826 K(o=0.83,f=0) USER MOD Single : A 80 SER OG : rot -169:sc= 1.24 USER MOD Single : A 89 GLN : amide:sc= 0.335 X(o=0.33,f=-0.075) USER MOD Single : A 91 LYS NZ :NH3+ 164:sc=0.000501 (180deg=-0.0747) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -4.728 34.517 -1.196 1.00 25.00 N ATOM 2 CA SER A 1 -5.981 33.956 -1.772 1.00 25.00 C ATOM 3 C SER A 1 -5.766 33.127 -3.018 1.00 25.00 C ATOM 4 O SER A 1 -6.645 32.833 -3.798 1.00 25.00 O ATOM 5 CB SER A 1 -6.945 35.109 -2.068 1.00 25.00 C ATOM 6 OG SER A 1 -6.915 36.014 -0.956 1.00 25.00 O ATOM 0 H1 SER A 1 -4.962 35.299 -0.552 1.00 25.00 H new ATOM 0 H2 SER A 1 -4.225 33.774 -0.670 1.00 25.00 H new ATOM 0 H3 SER A 1 -4.121 34.870 -1.963 1.00 25.00 H new ATOM 0 HA SER A 1 -6.397 33.273 -1.031 1.00 25.00 H new ATOM 0 HB2 SER A 1 -6.654 35.623 -2.984 1.00 25.00 H new ATOM 0 HB3 SER A 1 -7.955 34.730 -2.223 1.00 25.00 H new ATOM 0 HG SER A 1 -7.525 36.762 -1.126 1.00 25.00 H new ATOM 14 N GLN A 2 -4.497 32.761 -3.201 1.00 25.00 N ATOM 15 CA GLN A 2 -4.038 31.947 -4.324 1.00 25.00 C ATOM 16 C GLN A 2 -3.092 30.888 -3.777 1.00 25.00 C ATOM 17 O GLN A 2 -2.438 31.113 -2.764 1.00 25.00 O ATOM 18 CB GLN A 2 -3.296 32.809 -5.353 1.00 25.00 C ATOM 19 CG GLN A 2 -4.152 33.902 -5.987 1.00 25.00 C ATOM 20 CD GLN A 2 -3.405 34.659 -7.062 1.00 25.00 C ATOM 21 OE1 GLN A 2 -3.001 34.097 -8.062 1.00 25.00 O ATOM 22 NE2 GLN A 2 -3.209 35.935 -6.853 1.00 25.00 N ATOM 0 H GLN A 2 -3.748 33.027 -2.562 1.00 25.00 H new ATOM 0 HA GLN A 2 -4.894 31.489 -4.819 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -2.435 33.272 -4.870 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -2.910 32.163 -6.141 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -5.049 33.456 -6.416 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -4.480 34.598 -5.215 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -3.563 36.373 -6.002 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -2.703 36.493 -7.541 1.00 25.00 H new ATOM 31 N GLN A 3 -3.013 29.748 -4.447 1.00 25.00 N ATOM 32 CA GLN A 3 -2.122 28.666 -4.036 1.00 25.00 C ATOM 33 C GLN A 3 -1.707 27.885 -5.276 1.00 25.00 C ATOM 34 O GLN A 3 -2.467 27.807 -6.242 1.00 25.00 O ATOM 35 CB GLN A 3 -2.826 27.743 -3.024 1.00 25.00 C ATOM 36 CG GLN A 3 -4.097 27.061 -3.561 1.00 25.00 C ATOM 37 CD GLN A 3 -4.773 26.185 -2.526 1.00 25.00 C ATOM 38 OE1 GLN A 3 -4.763 26.475 -1.345 1.00 25.00 O ATOM 39 NE2 GLN A 3 -5.373 25.114 -2.975 1.00 25.00 N ATOM 0 H GLN A 3 -3.559 29.545 -5.285 1.00 25.00 H new ATOM 0 HA GLN A 3 -1.239 29.079 -3.549 1.00 25.00 H new ATOM 0 HB2 GLN A 3 -2.124 26.974 -2.703 1.00 25.00 H new ATOM 0 HB3 GLN A 3 -3.087 28.325 -2.140 1.00 25.00 H new ATOM 0 HG2 GLN A 3 -4.798 27.824 -3.899 1.00 25.00 H new ATOM 0 HG3 GLN A 3 -3.840 26.456 -4.431 1.00 25.00 H new ATOM 0 HE21 GLN A 3 -5.360 24.903 -3.973 1.00 25.00 H new ATOM 0 HE22 GLN A 3 -5.854 24.489 -2.328 1.00 25.00 H new ATOM 48 N SER A 4 -0.508 27.323 -5.254 1.00 25.00 N ATOM 49 CA SER A 4 0.003 26.520 -6.361 1.00 25.00 C ATOM 50 C SER A 4 1.166 25.701 -5.828 1.00 25.00 C ATOM 51 O SER A 4 1.859 26.145 -4.916 1.00 25.00 O ATOM 52 CB SER A 4 0.497 27.415 -7.502 1.00 25.00 C ATOM 53 OG SER A 4 0.968 26.630 -8.586 1.00 25.00 O ATOM 0 H SER A 4 0.140 27.409 -4.471 1.00 25.00 H new ATOM 0 HA SER A 4 -0.789 25.881 -6.752 1.00 25.00 H new ATOM 0 HB2 SER A 4 -0.312 28.062 -7.840 1.00 25.00 H new ATOM 0 HB3 SER A 4 1.295 28.064 -7.142 1.00 25.00 H new ATOM 0 HG SER A 4 1.278 27.219 -9.306 1.00 25.00 H new ATOM 59 N HIS A 5 1.384 24.529 -6.408 1.00 25.00 N ATOM 60 CA HIS A 5 2.519 23.674 -6.044 1.00 25.00 C ATOM 61 C HIS A 5 3.136 23.102 -7.315 1.00 25.00 C ATOM 62 O HIS A 5 4.335 23.212 -7.531 1.00 25.00 O ATOM 63 CB HIS A 5 2.070 22.534 -5.121 1.00 25.00 C ATOM 64 CG HIS A 5 1.420 23.007 -3.858 1.00 25.00 C ATOM 65 ND1 HIS A 5 2.044 23.767 -2.900 1.00 25.00 N ATOM 66 CD2 HIS A 5 0.153 22.825 -3.392 1.00 25.00 C ATOM 67 CE1 HIS A 5 1.170 24.015 -1.931 1.00 25.00 C ATOM 68 NE2 HIS A 5 0.000 23.461 -2.176 1.00 25.00 N ATOM 0 H HIS A 5 0.788 24.141 -7.139 1.00 25.00 H new ATOM 0 HA HIS A 5 3.257 24.271 -5.508 1.00 25.00 H new ATOM 0 HB2 HIS A 5 1.373 21.894 -5.661 1.00 25.00 H new ATOM 0 HB3 HIS A 5 2.935 21.921 -4.867 1.00 25.00 H new ATOM 0 HD2 HIS A 5 -0.619 22.265 -3.899 1.00 25.00 H new ATOM 0 HE1 HIS A 5 1.391 24.599 -1.050 1.00 25.00 H new ATOM 0 HE2 HIS A 5 -0.837 23.495 -1.594 1.00 25.00 H new ATOM 76 N SER A 6 2.270 22.568 -8.173 1.00 25.00 N ATOM 77 CA SER A 6 2.646 22.024 -9.485 1.00 25.00 C ATOM 78 C SER A 6 3.654 20.869 -9.411 1.00 25.00 C ATOM 79 O SER A 6 3.987 20.374 -8.340 1.00 25.00 O ATOM 80 CB SER A 6 3.188 23.144 -10.382 1.00 25.00 C ATOM 81 OG SER A 6 2.354 24.288 -10.294 1.00 25.00 O ATOM 0 H SER A 6 1.271 22.498 -7.978 1.00 25.00 H new ATOM 0 HA SER A 6 1.736 21.604 -9.915 1.00 25.00 H new ATOM 0 HB2 SER A 6 4.204 23.401 -10.082 1.00 25.00 H new ATOM 0 HB3 SER A 6 3.239 22.800 -11.415 1.00 25.00 H new ATOM 0 HG SER A 6 2.710 24.997 -10.869 1.00 25.00 H new ATOM 87 N SER A 7 4.104 20.433 -10.577 1.00 25.00 N ATOM 88 CA SER A 7 5.095 19.363 -10.699 1.00 25.00 C ATOM 89 C SER A 7 5.999 19.716 -11.885 1.00 25.00 C ATOM 90 O SER A 7 5.813 19.203 -12.992 1.00 25.00 O ATOM 91 CB SER A 7 4.391 18.023 -10.923 1.00 25.00 C ATOM 92 OG SER A 7 3.505 18.096 -12.029 1.00 25.00 O ATOM 0 H SER A 7 3.794 20.810 -11.473 1.00 25.00 H new ATOM 0 HA SER A 7 5.689 19.270 -9.790 1.00 25.00 H new ATOM 0 HB2 SER A 7 5.132 17.243 -11.096 1.00 25.00 H new ATOM 0 HB3 SER A 7 3.838 17.744 -10.026 1.00 25.00 H new ATOM 0 HG SER A 7 3.964 18.510 -12.789 1.00 25.00 H new ATOM 98 N PRO A 8 6.921 20.677 -11.696 1.00 25.00 N ATOM 99 CA PRO A 8 7.725 21.106 -12.840 1.00 25.00 C ATOM 100 C PRO A 8 8.812 20.091 -13.201 1.00 25.00 C ATOM 101 O PRO A 8 9.047 19.123 -12.476 1.00 25.00 O ATOM 102 CB PRO A 8 8.307 22.430 -12.355 1.00 25.00 C ATOM 103 CG PRO A 8 8.506 22.216 -10.918 1.00 25.00 C ATOM 104 CD PRO A 8 7.283 21.442 -10.485 1.00 25.00 C ATOM 0 HA PRO A 8 7.148 21.200 -13.760 1.00 25.00 H new ATOM 0 HB2 PRO A 8 9.245 22.664 -12.859 1.00 25.00 H new ATOM 0 HB3 PRO A 8 7.627 23.260 -12.546 1.00 25.00 H new ATOM 0 HG2 PRO A 8 9.421 21.657 -10.722 1.00 25.00 H new ATOM 0 HG3 PRO A 8 8.589 23.162 -10.382 1.00 25.00 H new ATOM 0 HD2 PRO A 8 7.500 20.784 -9.643 1.00 25.00 H new ATOM 0 HD3 PRO A 8 6.477 22.105 -10.172 1.00 25.00 H new ATOM 112 N GLY A 9 9.446 20.304 -14.344 1.00 25.00 N ATOM 113 CA GLY A 9 10.406 19.348 -14.883 1.00 25.00 C ATOM 114 C GLY A 9 11.850 19.712 -14.621 1.00 25.00 C ATOM 115 O GLY A 9 12.731 19.365 -15.402 1.00 25.00 O ATOM 0 H GLY A 9 9.313 21.135 -14.920 1.00 25.00 H new ATOM 0 HA2 GLY A 9 10.206 18.366 -14.454 1.00 25.00 H new ATOM 0 HA3 GLY A 9 10.253 19.262 -15.959 1.00 25.00 H new ATOM 119 N GLU A 10 12.092 20.417 -13.529 1.00 25.00 N ATOM 120 CA GLU A 10 13.426 20.941 -13.208 1.00 25.00 C ATOM 121 C GLU A 10 14.320 19.881 -12.554 1.00 25.00 C ATOM 122 O GLU A 10 14.932 20.097 -11.513 1.00 25.00 O ATOM 123 CB GLU A 10 13.315 22.185 -12.316 1.00 25.00 C ATOM 124 CG GLU A 10 12.116 23.064 -12.647 1.00 25.00 C ATOM 125 CD GLU A 10 11.955 23.353 -14.144 1.00 25.00 C ATOM 126 OE1 GLU A 10 12.902 23.855 -14.779 1.00 25.00 O ATOM 127 OE2 GLU A 10 10.862 23.034 -14.685 1.00 25.00 O ATOM 0 H GLU A 10 11.379 20.646 -12.837 1.00 25.00 H new ATOM 0 HA GLU A 10 13.899 21.224 -14.148 1.00 25.00 H new ATOM 0 HB2 GLU A 10 13.249 21.871 -11.274 1.00 25.00 H new ATOM 0 HB3 GLU A 10 14.226 22.775 -12.414 1.00 25.00 H new ATOM 0 HG2 GLU A 10 11.211 22.580 -12.280 1.00 25.00 H new ATOM 0 HG3 GLU A 10 12.211 24.009 -12.112 1.00 25.00 H new ATOM 134 N ILE A 11 14.377 18.718 -13.181 1.00 25.00 N ATOM 135 CA ILE A 11 15.175 17.605 -12.767 1.00 25.00 C ATOM 136 C ILE A 11 16.646 17.833 -13.150 1.00 25.00 C ATOM 137 O ILE A 11 17.527 16.998 -12.945 1.00 25.00 O ATOM 138 CB ILE A 11 14.594 16.331 -13.463 1.00 25.00 C ATOM 139 CG1 ILE A 11 13.035 16.349 -13.543 1.00 25.00 C ATOM 140 CG2 ILE A 11 14.991 15.147 -12.732 1.00 25.00 C ATOM 141 CD1 ILE A 11 12.261 16.451 -12.176 1.00 25.00 C ATOM 0 H ILE A 11 13.841 18.528 -14.028 1.00 25.00 H new ATOM 0 HA ILE A 11 15.145 17.482 -11.684 1.00 25.00 H new ATOM 0 HB ILE A 11 14.992 16.322 -14.478 1.00 25.00 H new ATOM 0 HG12 ILE A 11 12.735 17.190 -14.168 1.00 25.00 H new ATOM 0 HG13 ILE A 11 12.709 15.442 -14.052 1.00 25.00 H new ATOM 0 HG21 ILE A 11 14.583 14.263 -13.222 1.00 25.00 H new ATOM 0 HG22 ILE A 11 16.079 15.080 -12.710 1.00 25.00 H new ATOM 0 HG23 ILE A 11 14.611 15.204 -11.712 1.00 25.00 H new ATOM 0 HD11 ILE A 11 11.188 16.455 -12.365 1.00 25.00 H new ATOM 0 HD12 ILE A 11 12.516 15.597 -11.549 1.00 25.00 H new ATOM 0 HD13 ILE A 11 12.543 17.372 -11.666 1.00 25.00 H new ATOM 153 N THR A 12 16.884 19.011 -13.683 1.00 25.00 N ATOM 154 CA THR A 12 18.209 19.487 -14.063 1.00 25.00 C ATOM 155 C THR A 12 18.408 20.796 -13.320 1.00 25.00 C ATOM 156 O THR A 12 17.447 21.532 -13.128 1.00 25.00 O ATOM 157 CB THR A 12 18.292 19.765 -15.578 1.00 25.00 C ATOM 158 OG1 THR A 12 17.218 20.627 -15.962 1.00 25.00 O ATOM 159 CG2 THR A 12 18.165 18.478 -16.378 1.00 25.00 C ATOM 0 H THR A 12 16.145 19.688 -13.872 1.00 25.00 H new ATOM 0 HA THR A 12 18.964 18.740 -13.821 1.00 25.00 H new ATOM 0 HB THR A 12 19.259 20.226 -15.782 1.00 25.00 H new ATOM 0 HG1 THR A 12 17.270 20.806 -16.924 1.00 25.00 H new ATOM 0 HG21 THR A 12 18.227 18.704 -17.443 1.00 25.00 H new ATOM 0 HG22 THR A 12 18.972 17.798 -16.104 1.00 25.00 H new ATOM 0 HG23 THR A 12 17.205 18.008 -16.162 1.00 25.00 H new ATOM 167 N SER A 13 19.628 21.092 -12.896 1.00 25.00 N ATOM 168 CA SER A 13 19.880 22.304 -12.125 1.00 25.00 C ATOM 169 C SER A 13 21.215 22.935 -12.482 1.00 25.00 C ATOM 170 O SER A 13 22.167 22.251 -12.853 1.00 25.00 O ATOM 171 CB SER A 13 19.850 21.986 -10.632 1.00 25.00 C ATOM 172 OG SER A 13 19.894 23.168 -9.852 1.00 25.00 O ATOM 0 H SER A 13 20.452 20.517 -13.070 1.00 25.00 H new ATOM 0 HA SER A 13 19.094 23.018 -12.370 1.00 25.00 H new ATOM 0 HB2 SER A 13 18.946 21.425 -10.396 1.00 25.00 H new ATOM 0 HB3 SER A 13 20.696 21.348 -10.377 1.00 25.00 H new ATOM 0 HG SER A 13 19.888 22.933 -8.901 1.00 25.00 H new ATOM 178 N SER A 14 21.251 24.253 -12.373 1.00 25.00 N ATOM 179 CA SER A 14 22.434 25.082 -12.657 1.00 25.00 C ATOM 180 C SER A 14 22.362 26.469 -11.970 1.00 25.00 C ATOM 181 O SER A 14 23.329 26.870 -11.315 1.00 25.00 O ATOM 182 CB SER A 14 22.622 25.285 -14.168 1.00 25.00 C ATOM 183 OG SER A 14 22.715 24.046 -14.848 1.00 25.00 O ATOM 0 H SER A 14 20.442 24.800 -12.078 1.00 25.00 H new ATOM 0 HA SER A 14 23.286 24.538 -12.250 1.00 25.00 H new ATOM 0 HB2 SER A 14 21.785 25.859 -14.567 1.00 25.00 H new ATOM 0 HB3 SER A 14 23.524 25.870 -14.349 1.00 25.00 H new ATOM 0 HG SER A 14 22.833 24.207 -15.807 1.00 25.00 H new ATOM 189 N PRO A 15 21.208 27.198 -12.057 1.00 25.00 N ATOM 190 CA PRO A 15 21.178 28.526 -11.410 1.00 25.00 C ATOM 191 C PRO A 15 21.267 28.532 -9.902 1.00 25.00 C ATOM 192 O PRO A 15 21.500 29.561 -9.283 1.00 25.00 O ATOM 193 CB PRO A 15 19.825 29.070 -11.835 1.00 25.00 C ATOM 194 CG PRO A 15 19.007 27.898 -12.063 1.00 25.00 C ATOM 195 CD PRO A 15 19.917 26.960 -12.741 1.00 25.00 C ATOM 0 HA PRO A 15 22.052 29.104 -11.712 1.00 25.00 H new ATOM 0 HB2 PRO A 15 19.395 29.707 -11.062 1.00 25.00 H new ATOM 0 HB3 PRO A 15 19.908 29.675 -12.738 1.00 25.00 H new ATOM 0 HG2 PRO A 15 18.631 27.485 -11.127 1.00 25.00 H new ATOM 0 HG3 PRO A 15 18.139 28.130 -12.680 1.00 25.00 H new ATOM 0 HD2 PRO A 15 19.587 25.927 -12.632 1.00 25.00 H new ATOM 0 HD3 PRO A 15 19.983 27.163 -13.810 1.00 25.00 H new ATOM 203 N GLN A 16 21.164 27.348 -9.335 1.00 25.00 N ATOM 204 CA GLN A 16 21.400 27.121 -7.912 1.00 25.00 C ATOM 205 C GLN A 16 22.820 27.566 -7.491 1.00 25.00 C ATOM 206 O GLN A 16 23.104 27.715 -6.310 1.00 25.00 O ATOM 207 CB GLN A 16 21.216 25.632 -7.617 1.00 25.00 C ATOM 208 CG GLN A 16 20.858 25.325 -6.176 1.00 25.00 C ATOM 209 CD GLN A 16 20.865 23.843 -5.896 1.00 25.00 C ATOM 210 OE1 GLN A 16 21.822 23.309 -5.351 1.00 25.00 O ATOM 211 NE2 GLN A 16 19.813 23.172 -6.259 1.00 25.00 N ATOM 0 H GLN A 16 20.912 26.503 -9.848 1.00 25.00 H new ATOM 0 HA GLN A 16 20.687 27.716 -7.341 1.00 25.00 H new ATOM 0 HB2 GLN A 16 20.434 25.238 -8.266 1.00 25.00 H new ATOM 0 HB3 GLN A 16 22.136 25.106 -7.871 1.00 25.00 H new ATOM 0 HG2 GLN A 16 21.565 25.823 -5.513 1.00 25.00 H new ATOM 0 HG3 GLN A 16 19.872 25.732 -5.953 1.00 25.00 H new ATOM 0 HE21 GLN A 16 19.034 23.650 -6.711 1.00 25.00 H new ATOM 0 HE22 GLN A 16 19.766 22.167 -6.092 1.00 25.00 H new ATOM 220 N GLY A 17 23.701 27.787 -8.464 1.00 25.00 N ATOM 221 CA GLY A 17 25.036 28.292 -8.179 1.00 25.00 C ATOM 222 C GLY A 17 26.032 27.189 -7.906 1.00 25.00 C ATOM 223 O GLY A 17 27.134 27.434 -7.427 1.00 25.00 O ATOM 0 H GLY A 17 23.513 27.624 -9.453 1.00 25.00 H new ATOM 0 HA2 GLY A 17 25.382 28.888 -9.024 1.00 25.00 H new ATOM 0 HA3 GLY A 17 24.992 28.957 -7.317 1.00 25.00 H new ATOM 227 N LEU A 18 25.640 25.965 -8.229 1.00 25.00 N ATOM 228 CA LEU A 18 26.483 24.791 -8.002 1.00 25.00 C ATOM 229 C LEU A 18 27.767 24.813 -8.845 1.00 25.00 C ATOM 230 O LEU A 18 28.807 24.340 -8.406 1.00 25.00 O ATOM 231 CB LEU A 18 25.666 23.520 -8.227 1.00 25.00 C ATOM 232 CG LEU A 18 25.188 23.211 -9.647 1.00 25.00 C ATOM 233 CD1 LEU A 18 26.167 22.266 -10.311 1.00 25.00 C ATOM 234 CD2 LEU A 18 23.806 22.593 -9.586 1.00 25.00 C ATOM 0 H LEU A 18 24.736 25.754 -8.653 1.00 25.00 H new ATOM 0 HA LEU A 18 26.818 24.810 -6.965 1.00 25.00 H new ATOM 0 HB2 LEU A 18 26.264 22.675 -7.885 1.00 25.00 H new ATOM 0 HB3 LEU A 18 24.788 23.570 -7.583 1.00 25.00 H new ATOM 0 HG LEU A 18 25.136 24.129 -10.233 1.00 25.00 H new ATOM 0 HD11 LEU A 18 25.829 22.044 -11.323 1.00 25.00 H new ATOM 0 HD12 LEU A 18 27.152 22.732 -10.351 1.00 25.00 H new ATOM 0 HD13 LEU A 18 26.226 21.341 -9.737 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.462 22.371 -10.596 1.00 25.00 H new ATOM 0 HD22 LEU A 18 23.845 21.671 -9.005 1.00 25.00 H new ATOM 0 HD23 LEU A 18 23.116 23.291 -9.113 1.00 25.00 H new ATOM 246 N ASP A 19 27.692 25.398 -10.033 1.00 25.00 N ATOM 247 CA ASP A 19 28.867 25.531 -10.904 1.00 25.00 C ATOM 248 C ASP A 19 29.659 26.781 -10.536 1.00 25.00 C ATOM 249 O ASP A 19 30.877 26.839 -10.698 1.00 25.00 O ATOM 250 CB ASP A 19 28.414 25.630 -12.361 1.00 25.00 C ATOM 251 CG ASP A 19 29.511 26.145 -13.281 1.00 25.00 C ATOM 252 OD1 ASP A 19 30.463 25.405 -13.610 1.00 25.00 O ATOM 253 OD2 ASP A 19 29.416 27.322 -13.675 1.00 25.00 O ATOM 0 H ASP A 19 26.834 25.790 -10.421 1.00 25.00 H new ATOM 0 HA ASP A 19 29.503 24.656 -10.773 1.00 25.00 H new ATOM 0 HB2 ASP A 19 28.089 24.648 -12.704 1.00 25.00 H new ATOM 0 HB3 ASP A 19 27.551 26.292 -12.425 1.00 25.00 H new ATOM 258 N ASN A 20 28.951 27.788 -10.045 1.00 25.00 N ATOM 259 CA ASN A 20 29.546 29.063 -9.715 1.00 25.00 C ATOM 260 C ASN A 20 29.502 29.482 -8.237 1.00 25.00 C ATOM 261 O ASN A 20 28.732 30.367 -7.842 1.00 25.00 O ATOM 262 CB ASN A 20 28.878 30.110 -10.585 1.00 25.00 C ATOM 263 CG ASN A 20 29.851 31.008 -11.186 1.00 25.00 C ATOM 264 OD1 ASN A 20 30.766 31.492 -10.529 1.00 25.00 O ATOM 265 ND2 ASN A 20 29.726 31.195 -12.449 1.00 25.00 N ATOM 0 H ASN A 20 27.948 27.738 -9.866 1.00 25.00 H new ATOM 0 HA ASN A 20 30.614 28.965 -9.909 1.00 25.00 H new ATOM 0 HB2 ASN A 20 28.303 29.618 -11.370 1.00 25.00 H new ATOM 0 HB3 ASN A 20 28.173 30.686 -9.986 1.00 25.00 H new ATOM 0 HD21 ASN A 20 30.406 31.768 -12.949 1.00 25.00 H new ATOM 0 HD22 ASN A 20 28.947 30.771 -12.953 1.00 25.00 H new ATOM 272 N PRO A 21 30.400 28.918 -7.411 1.00 25.00 N ATOM 273 CA PRO A 21 30.468 29.373 -6.020 1.00 25.00 C ATOM 274 C PRO A 21 30.816 30.848 -5.881 1.00 25.00 C ATOM 275 O PRO A 21 30.430 31.476 -4.912 1.00 25.00 O ATOM 276 CB PRO A 21 31.599 28.523 -5.429 1.00 25.00 C ATOM 277 CG PRO A 21 32.385 28.091 -6.592 1.00 25.00 C ATOM 278 CD PRO A 21 31.409 27.881 -7.682 1.00 25.00 C ATOM 0 HA PRO A 21 29.503 29.264 -5.524 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.207 29.101 -4.733 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.206 27.669 -4.877 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.123 28.845 -6.867 1.00 25.00 H new ATOM 0 HG3 PRO A 21 32.932 27.174 -6.375 1.00 25.00 H new ATOM 0 HD2 PRO A 21 31.865 28.005 -8.664 1.00 25.00 H new ATOM 0 HD3 PRO A 21 30.979 26.880 -7.654 1.00 25.00 H new ATOM 286 N ALA A 22 31.542 31.403 -6.841 1.00 25.00 N ATOM 287 CA ALA A 22 31.932 32.806 -6.768 1.00 25.00 C ATOM 288 C ALA A 22 30.696 33.705 -6.815 1.00 25.00 C ATOM 289 O ALA A 22 30.576 34.648 -6.028 1.00 25.00 O ATOM 290 CB ALA A 22 32.891 33.138 -7.912 1.00 25.00 C ATOM 0 H ALA A 22 31.871 30.911 -7.672 1.00 25.00 H new ATOM 0 HA ALA A 22 32.444 32.985 -5.823 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.179 34.188 -7.852 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.780 32.513 -7.834 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.398 32.951 -8.866 1.00 25.00 H new ATOM 296 N LEU A 23 29.775 33.391 -7.717 1.00 25.00 N ATOM 297 CA LEU A 23 28.553 34.184 -7.858 1.00 25.00 C ATOM 298 C LEU A 23 27.572 33.862 -6.749 1.00 25.00 C ATOM 299 O LEU A 23 26.886 34.742 -6.249 1.00 25.00 O ATOM 300 CB LEU A 23 27.866 33.922 -9.204 1.00 25.00 C ATOM 301 CG LEU A 23 28.647 34.275 -10.482 1.00 25.00 C ATOM 302 CD1 LEU A 23 27.768 33.986 -11.701 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.090 35.722 -10.505 1.00 25.00 C ATOM 0 H LEU A 23 29.846 32.601 -8.358 1.00 25.00 H new ATOM 0 HA LEU A 23 28.848 35.232 -7.802 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.608 32.864 -9.249 1.00 25.00 H new ATOM 0 HB3 LEU A 23 26.929 34.480 -9.218 1.00 25.00 H new ATOM 0 HG LEU A 23 29.548 33.661 -10.503 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.315 34.234 -12.611 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.501 32.929 -11.715 1.00 25.00 H new ATOM 0 HD13 LEU A 23 26.861 34.589 -11.647 1.00 25.00 H new ATOM 0 HD21 LEU A 23 29.637 35.921 -11.427 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.216 36.371 -10.455 1.00 25.00 H new ATOM 0 HD23 LEU A 23 29.737 35.918 -9.650 1.00 25.00 H new ATOM 315 N LEU A 24 27.505 32.600 -6.351 1.00 25.00 N ATOM 316 CA LEU A 24 26.574 32.201 -5.304 1.00 25.00 C ATOM 317 C LEU A 24 26.957 32.850 -3.987 1.00 25.00 C ATOM 318 O LEU A 24 26.102 33.355 -3.273 1.00 25.00 O ATOM 319 CB LEU A 24 26.548 30.681 -5.154 1.00 25.00 C ATOM 320 CG LEU A 24 25.582 30.169 -4.071 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.154 30.674 -4.266 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.597 28.664 -4.041 1.00 25.00 C ATOM 0 H LEU A 24 28.075 31.844 -6.730 1.00 25.00 H new ATOM 0 HA LEU A 24 25.576 32.536 -5.586 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.271 30.238 -6.111 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.554 30.333 -4.921 1.00 25.00 H new ATOM 0 HG LEU A 24 25.932 30.564 -3.117 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.518 30.281 -3.473 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.145 31.763 -4.232 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.778 30.339 -5.233 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.911 28.309 -3.272 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.286 28.278 -5.012 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.605 28.315 -3.818 1.00 25.00 H new ATOM 334 N ARG A 25 28.250 32.891 -3.695 1.00 25.00 N ATOM 335 CA ARG A 25 28.748 33.568 -2.504 1.00 25.00 C ATOM 336 C ARG A 25 28.310 35.026 -2.529 1.00 25.00 C ATOM 337 O ARG A 25 27.866 35.552 -1.527 1.00 25.00 O ATOM 338 CB ARG A 25 30.276 33.481 -2.479 1.00 25.00 C ATOM 339 CG ARG A 25 30.953 34.199 -1.313 1.00 25.00 C ATOM 340 CD ARG A 25 32.377 34.584 -1.669 1.00 25.00 C ATOM 341 NE ARG A 25 32.396 35.548 -2.787 1.00 25.00 N ATOM 342 CZ ARG A 25 33.412 36.331 -3.121 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.541 36.341 -2.451 1.00 25.00 N ATOM 344 NH2 ARG A 25 33.282 37.125 -4.146 1.00 25.00 N ATOM 0 H ARG A 25 28.976 32.462 -4.269 1.00 25.00 H new ATOM 0 HA ARG A 25 28.345 33.091 -1.611 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.563 32.430 -2.452 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.662 33.893 -3.411 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.385 35.092 -1.051 1.00 25.00 H new ATOM 0 HG3 ARG A 25 30.955 33.553 -0.435 1.00 25.00 H new ATOM 0 HD2 ARG A 25 32.869 35.019 -0.799 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.942 33.693 -1.942 1.00 25.00 H new ATOM 0 HE ARG A 25 31.551 35.618 -3.354 1.00 25.00 H new ATOM 0 HH11 ARG A 25 34.659 35.731 -1.642 1.00 25.00 H new ATOM 0 HH12 ARG A 25 35.300 36.958 -2.740 1.00 25.00 H new ATOM 0 HH21 ARG A 25 32.410 37.136 -4.675 1.00 25.00 H new ATOM 0 HH22 ARG A 25 34.052 37.735 -4.419 1.00 25.00 H new ATOM 358 N ASP A 26 28.452 35.672 -3.675 1.00 25.00 N ATOM 359 CA ASP A 26 28.121 37.093 -3.787 1.00 25.00 C ATOM 360 C ASP A 26 26.621 37.336 -3.598 1.00 25.00 C ATOM 361 O ASP A 26 26.214 38.229 -2.859 1.00 25.00 O ATOM 362 CB ASP A 26 28.572 37.623 -5.147 1.00 25.00 C ATOM 363 CG ASP A 26 28.774 39.120 -5.143 1.00 25.00 C ATOM 364 OD1 ASP A 26 28.125 39.821 -5.942 1.00 25.00 O ATOM 365 OD2 ASP A 26 29.641 39.585 -4.370 1.00 25.00 O ATOM 0 H ASP A 26 28.791 35.244 -4.537 1.00 25.00 H new ATOM 0 HA ASP A 26 28.647 37.627 -2.995 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.503 37.134 -5.434 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.829 37.361 -5.901 1.00 25.00 H new ATOM 370 N MET A 27 25.806 36.487 -4.215 1.00 25.00 N ATOM 371 CA MET A 27 24.348 36.568 -4.086 1.00 25.00 C ATOM 372 C MET A 27 23.954 36.408 -2.634 1.00 25.00 C ATOM 373 O MET A 27 23.190 37.194 -2.094 1.00 25.00 O ATOM 374 CB MET A 27 23.692 35.455 -4.914 1.00 25.00 C ATOM 375 CG MET A 27 22.164 35.526 -4.998 1.00 25.00 C ATOM 376 SD MET A 27 21.244 35.010 -3.503 1.00 25.00 S ATOM 377 CE MET A 27 21.524 33.222 -3.461 1.00 25.00 C ATOM 0 H MET A 27 26.130 35.728 -4.815 1.00 25.00 H new ATOM 0 HA MET A 27 24.012 37.539 -4.450 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.098 35.487 -5.925 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.973 34.492 -4.488 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.882 36.552 -5.236 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.838 34.904 -5.832 1.00 25.00 H new ATOM 0 HE1 MET A 27 20.971 32.787 -2.628 1.00 25.00 H new ATOM 0 HE2 MET A 27 21.181 32.778 -4.396 1.00 25.00 H new ATOM 0 HE3 MET A 27 22.588 33.023 -3.334 1.00 25.00 H new ATOM 387 N LEU A 28 24.495 35.379 -2.009 1.00 25.00 N ATOM 388 CA LEU A 28 24.198 35.074 -0.620 1.00 25.00 C ATOM 389 C LEU A 28 24.578 36.213 0.305 1.00 25.00 C ATOM 390 O LEU A 28 23.820 36.574 1.190 1.00 25.00 O ATOM 391 CB LEU A 28 24.954 33.837 -0.198 1.00 25.00 C ATOM 392 CG LEU A 28 24.216 32.537 -0.481 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.205 31.426 -0.465 1.00 25.00 C ATOM 394 CD2 LEU A 28 23.143 32.305 0.564 1.00 25.00 C ATOM 0 H LEU A 28 25.151 34.732 -2.447 1.00 25.00 H new ATOM 0 HA LEU A 28 23.122 34.914 -0.545 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.915 33.817 -0.712 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.165 33.899 0.870 1.00 25.00 H new ATOM 0 HG LEU A 28 23.730 32.587 -1.455 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.696 30.483 -0.666 1.00 25.00 H new ATOM 0 HD12 LEU A 28 25.961 31.601 -1.230 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.683 31.379 0.513 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.622 31.372 0.350 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.603 32.246 1.551 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.431 33.130 0.544 1.00 25.00 H new ATOM 406 N LEU A 29 25.750 36.789 0.092 1.00 25.00 N ATOM 407 CA LEU A 29 26.217 37.891 0.939 1.00 25.00 C ATOM 408 C LEU A 29 25.298 39.100 0.801 1.00 25.00 C ATOM 409 O LEU A 29 25.035 39.808 1.773 1.00 25.00 O ATOM 410 CB LEU A 29 27.649 38.294 0.563 1.00 25.00 C ATOM 411 CG LEU A 29 28.762 37.340 1.030 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.063 37.669 0.300 1.00 25.00 C ATOM 413 CD2 LEU A 29 28.978 37.416 2.545 1.00 25.00 C ATOM 0 H LEU A 29 26.395 36.520 -0.651 1.00 25.00 H new ATOM 0 HA LEU A 29 26.203 37.547 1.973 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.707 38.385 -0.522 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.848 39.283 0.977 1.00 25.00 H new ATOM 0 HG LEU A 29 28.453 36.322 0.792 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.849 36.991 0.634 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.917 37.554 -0.774 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.353 38.697 0.519 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.772 36.727 2.834 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.260 38.432 2.822 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.056 37.143 3.058 1.00 25.00 H new ATOM 425 N ALA A 30 24.798 39.317 -0.404 1.00 25.00 N ATOM 426 CA ALA A 30 23.898 40.429 -0.681 1.00 25.00 C ATOM 427 C ALA A 30 22.455 40.139 -0.234 1.00 25.00 C ATOM 428 O ALA A 30 21.625 41.049 -0.191 1.00 25.00 O ATOM 429 CB ALA A 30 23.927 40.739 -2.185 1.00 25.00 C ATOM 0 H ALA A 30 25.002 38.732 -1.215 1.00 25.00 H new ATOM 0 HA ALA A 30 24.244 41.290 -0.109 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.255 41.570 -2.398 1.00 25.00 H new ATOM 0 HB2 ALA A 30 24.941 41.007 -2.482 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.605 39.860 -2.744 1.00 25.00 H new ATOM 435 N ASN A 31 22.141 38.881 0.052 1.00 25.00 N ATOM 436 CA ASN A 31 20.769 38.484 0.363 1.00 25.00 C ATOM 437 C ASN A 31 20.612 38.079 1.828 1.00 25.00 C ATOM 438 O ASN A 31 20.895 36.938 2.205 1.00 25.00 O ATOM 439 CB ASN A 31 20.357 37.332 -0.551 1.00 25.00 C ATOM 440 CG ASN A 31 18.877 37.090 -0.538 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.210 37.227 0.487 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.348 36.720 -1.670 1.00 25.00 N ATOM 0 H ASN A 31 22.816 38.117 0.076 1.00 25.00 H new ATOM 0 HA ASN A 31 20.119 39.343 0.194 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.678 37.548 -1.570 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.873 36.424 -0.241 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.347 36.533 -1.728 1.00 25.00 H new ATOM 0 HD22 ASN A 31 18.935 36.618 -2.498 1.00 25.00 H new ATOM 449 N PRO A 32 20.118 38.997 2.679 1.00 25.00 N ATOM 450 CA PRO A 32 20.034 38.656 4.103 1.00 25.00 C ATOM 451 C PRO A 32 19.076 37.512 4.438 1.00 25.00 C ATOM 452 O PRO A 32 19.251 36.834 5.447 1.00 25.00 O ATOM 453 CB PRO A 32 19.582 39.974 4.742 1.00 25.00 C ATOM 454 CG PRO A 32 18.849 40.673 3.654 1.00 25.00 C ATOM 455 CD PRO A 32 19.651 40.374 2.433 1.00 25.00 C ATOM 0 HA PRO A 32 20.987 38.276 4.472 1.00 25.00 H new ATOM 0 HB2 PRO A 32 18.941 39.799 5.606 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.432 40.560 5.090 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.827 40.306 3.561 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.787 41.745 3.839 1.00 25.00 H new ATOM 0 HD2 PRO A 32 19.049 40.441 1.527 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.483 41.068 2.315 1.00 25.00 H new ATOM 463 N HIS A 33 18.073 37.278 3.603 1.00 25.00 N ATOM 464 CA HIS A 33 17.142 36.182 3.845 1.00 25.00 C ATOM 465 C HIS A 33 17.769 34.840 3.489 1.00 25.00 C ATOM 466 O HIS A 33 17.636 33.864 4.222 1.00 25.00 O ATOM 467 CB HIS A 33 15.869 36.371 3.017 1.00 25.00 C ATOM 468 CG HIS A 33 14.857 35.291 3.230 1.00 25.00 C ATOM 469 ND1 HIS A 33 14.065 35.179 4.345 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.516 34.227 2.447 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.300 34.101 4.206 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.527 33.485 3.065 1.00 25.00 N ATOM 0 H HIS A 33 17.883 37.824 2.762 1.00 25.00 H new ATOM 0 HA HIS A 33 16.896 36.189 4.907 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.421 37.333 3.267 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.134 36.408 1.960 1.00 25.00 H new ATOM 0 HD2 HIS A 33 14.954 33.998 1.487 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.580 33.771 4.940 1.00 25.00 H new ATOM 0 HE2 HIS A 33 13.072 32.643 2.713 1.00 25.00 H new ATOM 480 N GLU A 34 18.443 34.787 2.356 1.00 25.00 N ATOM 481 CA GLU A 34 18.985 33.526 1.862 1.00 25.00 C ATOM 482 C GLU A 34 20.155 33.125 2.740 1.00 25.00 C ATOM 483 O GLU A 34 20.286 31.984 3.149 1.00 25.00 O ATOM 484 CB GLU A 34 19.420 33.673 0.405 1.00 25.00 C ATOM 485 CG GLU A 34 18.630 32.808 -0.568 1.00 25.00 C ATOM 486 CD GLU A 34 18.953 31.319 -0.448 1.00 25.00 C ATOM 487 OE1 GLU A 34 18.049 30.497 -0.699 1.00 25.00 O ATOM 488 OE2 GLU A 34 20.106 30.970 -0.119 1.00 25.00 O ATOM 0 H GLU A 34 18.630 35.594 1.761 1.00 25.00 H new ATOM 0 HA GLU A 34 18.221 32.749 1.902 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.320 34.718 0.110 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.477 33.419 0.325 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.564 32.957 -0.394 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.836 33.137 -1.587 1.00 25.00 H new ATOM 495 N LEU A 35 20.956 34.097 3.128 1.00 25.00 N ATOM 496 CA LEU A 35 22.070 33.825 4.019 1.00 25.00 C ATOM 497 C LEU A 35 21.578 33.318 5.379 1.00 25.00 C ATOM 498 O LEU A 35 22.266 32.547 6.043 1.00 25.00 O ATOM 499 CB LEU A 35 22.956 35.054 4.098 1.00 25.00 C ATOM 500 CG LEU A 35 22.763 36.200 5.089 1.00 25.00 C ATOM 501 CD1 LEU A 35 23.006 35.848 6.547 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.749 37.249 4.645 1.00 25.00 C ATOM 0 H LEU A 35 20.860 35.072 2.845 1.00 25.00 H new ATOM 0 HA LEU A 35 22.683 33.015 3.623 1.00 25.00 H new ATOM 0 HB2 LEU A 35 23.969 34.685 4.257 1.00 25.00 H new ATOM 0 HB3 LEU A 35 22.933 35.506 3.106 1.00 25.00 H new ATOM 0 HG LEU A 35 21.720 36.517 5.071 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.843 36.730 7.166 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.318 35.059 6.850 1.00 25.00 H new ATOM 0 HD13 LEU A 35 24.032 35.502 6.672 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.681 38.115 5.304 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.759 36.840 4.687 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.522 37.552 3.623 1.00 25.00 H new ATOM 514 N SER A 36 20.393 33.759 5.797 1.00 25.00 N ATOM 515 CA SER A 36 19.818 33.359 7.085 1.00 25.00 C ATOM 516 C SER A 36 19.252 31.947 7.031 1.00 25.00 C ATOM 517 O SER A 36 19.368 31.189 7.987 1.00 25.00 O ATOM 518 CB SER A 36 18.746 34.348 7.567 1.00 25.00 C ATOM 519 OG SER A 36 17.523 34.228 6.862 1.00 25.00 O ATOM 0 H SER A 36 19.807 34.398 5.260 1.00 25.00 H new ATOM 0 HA SER A 36 20.634 33.372 7.808 1.00 25.00 H new ATOM 0 HB2 SER A 36 18.563 34.188 8.630 1.00 25.00 H new ATOM 0 HB3 SER A 36 19.123 35.365 7.458 1.00 25.00 H new ATOM 0 HG SER A 36 17.693 33.852 5.973 1.00 25.00 H new ATOM 525 N LEU A 37 18.675 31.569 5.900 1.00 25.00 N ATOM 526 CA LEU A 37 18.153 30.219 5.750 1.00 25.00 C ATOM 527 C LEU A 37 19.297 29.288 5.624 1.00 25.00 C ATOM 528 O LEU A 37 19.255 28.172 6.080 1.00 25.00 O ATOM 529 CB LEU A 37 17.213 30.118 4.563 1.00 25.00 C ATOM 530 CG LEU A 37 17.578 30.057 3.071 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.168 28.733 2.635 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.289 30.326 2.287 1.00 25.00 C ATOM 0 H LEU A 37 18.557 32.168 5.083 1.00 25.00 H new ATOM 0 HA LEU A 37 17.565 29.952 6.628 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.617 29.224 4.747 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.543 30.972 4.657 1.00 25.00 H new ATOM 0 HG LEU A 37 18.353 30.799 2.879 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.399 28.770 1.570 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.081 28.539 3.197 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.450 27.935 2.823 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.500 30.293 1.218 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.547 29.567 2.535 1.00 25.00 H new ATOM 0 HD23 LEU A 37 15.902 31.310 2.550 1.00 25.00 H new ATOM 544 N LEU A 38 20.347 29.773 5.013 1.00 25.00 N ATOM 545 CA LEU A 38 21.531 28.983 4.833 1.00 25.00 C ATOM 546 C LEU A 38 22.164 28.600 6.156 1.00 25.00 C ATOM 547 O LEU A 38 22.501 27.454 6.358 1.00 25.00 O ATOM 548 CB LEU A 38 22.493 29.758 3.973 1.00 25.00 C ATOM 549 CG LEU A 38 23.720 28.936 3.545 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.311 27.812 2.620 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.766 29.796 2.884 1.00 25.00 C ATOM 0 H LEU A 38 20.403 30.717 4.631 1.00 25.00 H new ATOM 0 HA LEU A 38 21.265 28.047 4.342 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.972 30.111 3.083 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.827 30.641 4.518 1.00 25.00 H new ATOM 0 HG LEU A 38 24.158 28.512 4.449 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.193 27.242 2.328 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.608 27.156 3.133 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.837 28.227 1.731 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.617 29.178 2.596 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.343 30.266 1.996 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.096 30.567 3.580 1.00 25.00 H new ATOM 563 N LYS A 39 22.275 29.533 7.085 1.00 25.00 N ATOM 564 CA LYS A 39 22.791 29.178 8.421 1.00 25.00 C ATOM 565 C LYS A 39 21.820 28.311 9.214 1.00 25.00 C ATOM 566 O LYS A 39 22.249 27.536 10.057 1.00 25.00 O ATOM 567 CB LYS A 39 23.218 30.407 9.235 1.00 25.00 C ATOM 568 CG LYS A 39 22.225 31.561 9.243 1.00 25.00 C ATOM 569 CD LYS A 39 22.649 32.698 10.166 1.00 25.00 C ATOM 570 CE LYS A 39 23.842 33.463 9.590 1.00 25.00 C ATOM 571 NZ LYS A 39 24.223 34.630 10.454 1.00 25.00 N ATOM 0 H LYS A 39 22.027 30.515 6.960 1.00 25.00 H new ATOM 0 HA LYS A 39 23.685 28.582 8.238 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.396 30.096 10.264 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.168 30.770 8.842 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.113 31.945 8.229 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.248 31.192 9.554 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.813 33.381 10.314 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.910 32.297 11.145 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.693 32.789 9.492 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.598 33.816 8.588 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 25.035 35.124 10.032 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.419 35.285 10.527 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.480 34.290 11.403 1.00 25.00 H new ATOM 585 N GLU A 40 20.532 28.406 8.929 1.00 25.00 N ATOM 586 CA GLU A 40 19.548 27.556 9.598 1.00 25.00 C ATOM 587 C GLU A 40 19.583 26.128 9.028 1.00 25.00 C ATOM 588 O GLU A 40 19.630 25.145 9.765 1.00 25.00 O ATOM 589 CB GLU A 40 18.142 28.139 9.417 1.00 25.00 C ATOM 590 CG GLU A 40 17.073 27.413 10.218 1.00 25.00 C ATOM 591 CD GLU A 40 15.669 27.768 9.766 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.353 27.515 8.580 1.00 25.00 O ATOM 593 OE2 GLU A 40 14.841 28.153 10.610 1.00 25.00 O ATOM 0 H GLU A 40 20.141 29.055 8.246 1.00 25.00 H new ATOM 0 HA GLU A 40 19.796 27.519 10.659 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.153 29.189 9.710 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.877 28.106 8.360 1.00 25.00 H new ATOM 0 HG2 GLU A 40 17.221 26.337 10.124 1.00 25.00 H new ATOM 0 HG3 GLU A 40 17.185 27.659 11.274 1.00 25.00 H new ATOM 600 N ARG A 41 19.513 26.022 7.708 1.00 25.00 N ATOM 601 CA ARG A 41 19.440 24.719 7.027 1.00 25.00 C ATOM 602 C ARG A 41 20.781 24.028 6.818 1.00 25.00 C ATOM 603 O ARG A 41 20.858 22.805 6.839 1.00 25.00 O ATOM 604 CB ARG A 41 18.798 24.904 5.648 1.00 25.00 C ATOM 605 CG ARG A 41 17.374 25.448 5.681 1.00 25.00 C ATOM 606 CD ARG A 41 16.395 24.426 6.249 1.00 25.00 C ATOM 607 NE ARG A 41 15.629 24.981 7.374 1.00 25.00 N ATOM 608 CZ ARG A 41 14.914 24.282 8.242 1.00 25.00 C ATOM 609 NH1 ARG A 41 14.824 22.974 8.188 1.00 25.00 N ATOM 610 NH2 ARG A 41 14.276 24.913 9.184 1.00 25.00 N ATOM 0 H ARG A 41 19.505 26.823 7.077 1.00 25.00 H new ATOM 0 HA ARG A 41 18.852 24.083 7.689 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.418 25.581 5.060 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.795 23.944 5.131 1.00 25.00 H new ATOM 0 HG2 ARG A 41 17.345 26.355 6.284 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.067 25.726 4.673 1.00 25.00 H new ATOM 0 HD2 ARG A 41 15.710 24.102 5.465 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.941 23.542 6.580 1.00 25.00 H new ATOM 0 HE ARG A 41 15.650 25.993 7.497 1.00 25.00 H new ATOM 0 HH11 ARG A 41 15.316 22.459 7.458 1.00 25.00 H new ATOM 0 HH12 ARG A 41 14.262 22.473 8.876 1.00 25.00 H new ATOM 0 HH21 ARG A 41 14.332 25.930 9.245 1.00 25.00 H new ATOM 0 HH22 ARG A 41 13.720 24.391 9.862 1.00 25.00 H new ATOM 624 N ASN A 42 21.811 24.811 6.547 1.00 25.00 N ATOM 625 CA ASN A 42 23.146 24.285 6.218 1.00 25.00 C ATOM 626 C ASN A 42 24.284 25.012 6.945 1.00 25.00 C ATOM 627 O ASN A 42 25.088 25.712 6.311 1.00 25.00 O ATOM 628 CB ASN A 42 23.384 24.413 4.711 1.00 25.00 C ATOM 629 CG ASN A 42 24.494 23.524 4.229 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.185 22.897 5.007 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.661 23.456 2.945 1.00 25.00 N ATOM 0 H ASN A 42 21.757 25.830 6.546 1.00 25.00 H new ATOM 0 HA ASN A 42 23.157 23.245 6.544 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.466 24.164 4.179 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.622 25.449 4.470 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.393 22.861 2.557 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.061 23.998 2.323 1.00 25.00 H new ATOM 638 N PRO A 43 24.394 24.844 8.273 1.00 25.00 N ATOM 639 CA PRO A 43 25.485 25.573 8.935 1.00 25.00 C ATOM 640 C PRO A 43 26.933 25.370 8.412 1.00 25.00 C ATOM 641 O PRO A 43 27.682 26.347 8.375 1.00 25.00 O ATOM 642 CB PRO A 43 25.337 25.170 10.411 1.00 25.00 C ATOM 643 CG PRO A 43 24.521 23.921 10.404 1.00 25.00 C ATOM 644 CD PRO A 43 23.592 24.068 9.238 1.00 25.00 C ATOM 0 HA PRO A 43 25.373 26.637 8.728 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.311 25.000 10.871 1.00 25.00 H new ATOM 0 HB3 PRO A 43 24.846 25.956 10.985 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.152 23.039 10.297 1.00 25.00 H new ATOM 0 HG3 PRO A 43 23.968 23.806 11.336 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.297 23.100 8.832 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.676 24.590 9.515 1.00 25.00 H new ATOM 652 N PRO A 44 27.339 24.152 7.957 1.00 25.00 N ATOM 653 CA PRO A 44 28.728 24.172 7.467 1.00 25.00 C ATOM 654 C PRO A 44 28.971 24.953 6.159 1.00 25.00 C ATOM 655 O PRO A 44 30.053 25.505 5.970 1.00 25.00 O ATOM 656 CB PRO A 44 29.048 22.686 7.286 1.00 25.00 C ATOM 657 CG PRO A 44 27.759 22.074 6.967 1.00 25.00 C ATOM 658 CD PRO A 44 26.776 22.790 7.859 1.00 25.00 C ATOM 0 HA PRO A 44 29.369 24.703 8.171 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.771 22.530 6.486 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.478 22.259 8.192 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.507 22.202 5.914 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.768 21.002 7.164 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.774 22.798 7.429 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.699 22.315 8.837 1.00 25.00 H new ATOM 666 N LEU A 45 27.995 25.038 5.258 1.00 25.00 N ATOM 667 CA LEU A 45 28.190 25.869 4.063 1.00 25.00 C ATOM 668 C LEU A 45 28.056 27.324 4.475 1.00 25.00 C ATOM 669 O LEU A 45 28.734 28.204 3.952 1.00 25.00 O ATOM 670 CB LEU A 45 27.195 25.535 2.957 1.00 25.00 C ATOM 671 CG LEU A 45 27.413 26.271 1.613 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.826 26.068 1.023 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.380 25.779 0.606 1.00 25.00 C ATOM 0 H LEU A 45 27.094 24.564 5.322 1.00 25.00 H new ATOM 0 HA LEU A 45 29.181 25.672 3.655 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.232 24.461 2.772 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.191 25.762 3.316 1.00 25.00 H new ATOM 0 HG LEU A 45 27.303 27.337 1.813 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.909 26.611 0.082 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.571 26.443 1.725 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.997 25.006 0.845 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.526 26.292 -0.345 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.497 24.705 0.460 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.378 25.988 0.981 1.00 25.00 H new ATOM 685 N ALA A 46 27.194 27.571 5.444 1.00 25.00 N ATOM 686 CA ALA A 46 27.009 28.919 5.940 1.00 25.00 C ATOM 687 C ALA A 46 28.283 29.495 6.552 1.00 25.00 C ATOM 688 O ALA A 46 28.644 30.601 6.218 1.00 25.00 O ATOM 689 CB ALA A 46 25.899 28.958 6.940 1.00 25.00 C ATOM 0 H ALA A 46 26.617 26.863 5.898 1.00 25.00 H new ATOM 0 HA ALA A 46 26.750 29.540 5.083 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.772 29.978 7.303 1.00 25.00 H new ATOM 0 HB2 ALA A 46 24.974 28.623 6.470 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.140 28.302 7.777 1.00 25.00 H new ATOM 695 N GLU A 47 28.961 28.775 7.440 1.00 25.00 N ATOM 696 CA GLU A 47 30.166 29.321 8.093 1.00 25.00 C ATOM 697 C GLU A 47 31.236 29.673 7.061 1.00 25.00 C ATOM 698 O GLU A 47 31.985 30.639 7.222 1.00 25.00 O ATOM 699 CB GLU A 47 30.736 28.366 9.155 1.00 25.00 C ATOM 700 CG GLU A 47 31.225 27.029 8.622 1.00 25.00 C ATOM 701 CD GLU A 47 31.988 26.237 9.659 1.00 25.00 C ATOM 702 OE1 GLU A 47 31.496 25.173 10.089 1.00 25.00 O ATOM 703 OE2 GLU A 47 33.115 26.663 10.011 1.00 25.00 O ATOM 0 H GLU A 47 28.710 27.829 7.726 1.00 25.00 H new ATOM 0 HA GLU A 47 29.861 30.233 8.606 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.564 28.863 9.661 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.968 28.182 9.906 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.372 26.444 8.278 1.00 25.00 H new ATOM 0 HG3 GLU A 47 31.865 27.199 7.756 1.00 25.00 H new ATOM 710 N ALA A 48 31.263 28.922 5.972 1.00 25.00 N ATOM 711 CA ALA A 48 32.143 29.183 4.868 1.00 25.00 C ATOM 712 C ALA A 48 31.868 30.559 4.263 1.00 25.00 C ATOM 713 O ALA A 48 32.790 31.326 3.989 1.00 25.00 O ATOM 714 CB ALA A 48 31.966 28.070 3.827 1.00 25.00 C ATOM 0 H ALA A 48 30.664 28.107 5.838 1.00 25.00 H new ATOM 0 HA ALA A 48 33.176 29.191 5.215 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.628 28.254 2.981 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.211 27.108 4.277 1.00 25.00 H new ATOM 0 HB3 ALA A 48 30.932 28.056 3.482 1.00 25.00 H new ATOM 720 N LEU A 49 30.593 30.874 4.111 1.00 25.00 N ATOM 721 CA LEU A 49 30.159 32.164 3.589 1.00 25.00 C ATOM 722 C LEU A 49 30.474 33.288 4.572 1.00 25.00 C ATOM 723 O LEU A 49 30.940 34.350 4.175 1.00 25.00 O ATOM 724 CB LEU A 49 28.644 32.135 3.359 1.00 25.00 C ATOM 725 CG LEU A 49 28.046 33.410 2.756 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.237 33.403 1.259 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.575 33.504 3.125 1.00 25.00 C ATOM 0 H LEU A 49 29.826 30.243 4.346 1.00 25.00 H new ATOM 0 HA LEU A 49 30.690 32.347 2.655 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.409 31.298 2.701 1.00 25.00 H new ATOM 0 HB3 LEU A 49 28.153 31.939 4.312 1.00 25.00 H new ATOM 0 HG LEU A 49 28.556 34.286 3.158 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.810 34.311 0.834 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.301 33.359 1.028 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.737 32.533 0.833 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.150 34.411 2.696 1.00 25.00 H new ATOM 0 HD22 LEU A 49 26.046 32.635 2.734 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.473 33.533 4.210 1.00 25.00 H new ATOM 739 N LEU A 50 30.200 33.054 5.853 1.00 25.00 N ATOM 740 CA LEU A 50 30.348 34.097 6.882 1.00 25.00 C ATOM 741 C LEU A 50 31.798 34.530 6.996 1.00 25.00 C ATOM 742 O LEU A 50 32.104 35.653 7.375 1.00 25.00 O ATOM 743 CB LEU A 50 29.905 33.594 8.269 1.00 25.00 C ATOM 744 CG LEU A 50 28.554 32.881 8.434 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.224 32.728 9.903 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.406 33.544 7.684 1.00 25.00 C ATOM 0 H LEU A 50 29.875 32.155 6.209 1.00 25.00 H new ATOM 0 HA LEU A 50 29.717 34.931 6.574 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.677 32.913 8.628 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.902 34.454 8.939 1.00 25.00 H new ATOM 0 HG LEU A 50 28.668 31.898 7.977 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.265 32.222 10.010 1.00 25.00 H new ATOM 0 HD12 LEU A 50 29.001 32.140 10.391 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.168 33.712 10.368 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.488 32.980 7.852 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.276 34.564 8.045 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.631 33.563 6.618 1.00 25.00 H new ATOM 758 N SER A 51 32.684 33.602 6.686 1.00 25.00 N ATOM 759 CA SER A 51 34.114 33.836 6.763 1.00 25.00 C ATOM 760 C SER A 51 34.620 34.723 5.626 1.00 25.00 C ATOM 761 O SER A 51 35.688 35.315 5.732 1.00 25.00 O ATOM 762 CB SER A 51 34.809 32.501 6.678 1.00 25.00 C ATOM 763 OG SER A 51 36.164 32.577 7.094 1.00 25.00 O ATOM 0 H SER A 51 32.432 32.664 6.374 1.00 25.00 H new ATOM 0 HA SER A 51 34.327 34.349 7.701 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.280 31.777 7.298 1.00 25.00 H new ATOM 0 HB3 SER A 51 34.765 32.135 5.652 1.00 25.00 H new ATOM 0 HG SER A 51 36.737 32.157 6.419 1.00 25.00 H new ATOM 769 N GLY A 52 33.882 34.759 4.522 1.00 25.00 N ATOM 770 CA GLY A 52 34.253 35.573 3.370 1.00 25.00 C ATOM 771 C GLY A 52 35.175 34.850 2.406 1.00 25.00 C ATOM 772 O GLY A 52 35.312 35.234 1.241 1.00 25.00 O ATOM 0 H GLY A 52 33.018 34.230 4.400 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.350 35.877 2.841 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.741 36.484 3.717 1.00 25.00 H new ATOM 776 N ASP A 53 35.801 33.792 2.895 1.00 25.00 N ATOM 777 CA ASP A 53 36.733 33.000 2.099 1.00 25.00 C ATOM 778 C ASP A 53 36.021 32.243 0.983 1.00 25.00 C ATOM 779 O ASP A 53 35.263 31.304 1.237 1.00 25.00 O ATOM 780 CB ASP A 53 37.431 31.967 2.970 1.00 25.00 C ATOM 781 CG ASP A 53 38.501 31.230 2.225 1.00 25.00 C ATOM 782 OD1 ASP A 53 38.841 30.111 2.647 1.00 25.00 O ATOM 783 OD2 ASP A 53 38.928 31.713 1.159 1.00 25.00 O ATOM 0 H ASP A 53 35.680 33.456 3.851 1.00 25.00 H new ATOM 0 HA ASP A 53 37.449 33.701 1.671 1.00 25.00 H new ATOM 0 HB2 ASP A 53 37.869 32.461 3.837 1.00 25.00 H new ATOM 0 HB3 ASP A 53 36.696 31.255 3.346 1.00 25.00 H new ATOM 788 N LEU A 54 36.297 32.609 -0.259 1.00 25.00 N ATOM 789 CA LEU A 54 35.732 31.884 -1.386 1.00 25.00 C ATOM 790 C LEU A 54 36.286 30.466 -1.400 1.00 25.00 C ATOM 791 O LEU A 54 35.582 29.539 -1.741 1.00 25.00 O ATOM 792 CB LEU A 54 36.067 32.581 -2.707 1.00 25.00 C ATOM 793 CG LEU A 54 35.492 31.994 -4.019 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.384 30.910 -4.636 1.00 25.00 C ATOM 795 CD2 LEU A 54 34.048 31.479 -3.896 1.00 25.00 C ATOM 0 H LEU A 54 36.900 33.392 -0.510 1.00 25.00 H new ATOM 0 HA LEU A 54 34.648 31.859 -1.277 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.730 33.615 -2.631 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.153 32.606 -2.803 1.00 25.00 H new ATOM 0 HG LEU A 54 35.474 32.848 -4.696 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.925 30.540 -5.553 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.363 31.331 -4.865 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.499 30.088 -3.930 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.719 31.084 -4.857 1.00 25.00 H new ATOM 0 HD22 LEU A 54 34.006 30.689 -3.146 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.394 32.298 -3.597 1.00 25.00 H new ATOM 807 N GLU A 55 37.544 30.291 -1.032 1.00 25.00 N ATOM 808 CA GLU A 55 38.161 28.966 -1.098 1.00 25.00 C ATOM 809 C GLU A 55 37.418 27.979 -0.199 1.00 25.00 C ATOM 810 O GLU A 55 37.030 26.901 -0.649 1.00 25.00 O ATOM 811 CB GLU A 55 39.643 29.023 -0.717 1.00 25.00 C ATOM 812 CG GLU A 55 40.457 30.000 -1.565 1.00 25.00 C ATOM 813 CD GLU A 55 41.573 29.312 -2.333 1.00 25.00 C ATOM 814 OE1 GLU A 55 41.565 29.391 -3.582 1.00 25.00 O ATOM 815 OE2 GLU A 55 42.451 28.686 -1.699 1.00 25.00 O ATOM 0 H GLU A 55 38.154 31.033 -0.689 1.00 25.00 H new ATOM 0 HA GLU A 55 38.091 28.619 -2.129 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.729 29.307 0.332 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.073 28.026 -0.814 1.00 25.00 H new ATOM 0 HG2 GLU A 55 39.795 30.506 -2.268 1.00 25.00 H new ATOM 0 HG3 GLU A 55 40.884 30.768 -0.920 1.00 25.00 H new ATOM 822 N LYS A 56 37.149 28.352 1.049 1.00 25.00 N ATOM 823 CA LYS A 56 36.383 27.467 1.931 1.00 25.00 C ATOM 824 C LYS A 56 34.951 27.352 1.430 1.00 25.00 C ATOM 825 O LYS A 56 34.384 26.277 1.482 1.00 25.00 O ATOM 826 CB LYS A 56 36.455 27.890 3.422 1.00 25.00 C ATOM 827 CG LYS A 56 35.558 28.931 3.873 1.00 25.00 C ATOM 828 CD LYS A 56 36.056 29.501 5.208 1.00 25.00 C ATOM 829 CE LYS A 56 35.595 28.700 6.435 1.00 25.00 C ATOM 830 NZ LYS A 56 36.038 29.352 7.716 1.00 25.00 N ATOM 0 H LYS A 56 37.439 29.236 1.467 1.00 25.00 H new ATOM 0 HA LYS A 56 36.842 26.479 1.894 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.272 27.004 4.030 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.475 28.214 3.629 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.501 29.724 3.127 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.551 28.531 3.991 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.145 29.533 5.195 1.00 25.00 H new ATOM 0 HD3 LYS A 56 35.708 30.529 5.306 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.509 28.612 6.427 1.00 25.00 H new ATOM 0 HE3 LYS A 56 35.997 27.688 6.382 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 35.311 29.212 8.446 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 36.932 28.925 8.032 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 36.178 30.370 7.557 1.00 25.00 H new ATOM 844 N PHE A 57 34.383 28.426 0.896 1.00 25.00 N ATOM 845 CA PHE A 57 33.017 28.367 0.374 1.00 25.00 C ATOM 846 C PHE A 57 32.907 27.378 -0.782 1.00 25.00 C ATOM 847 O PHE A 57 32.061 26.502 -0.753 1.00 25.00 O ATOM 848 CB PHE A 57 32.529 29.756 -0.043 1.00 25.00 C ATOM 849 CG PHE A 57 31.104 29.770 -0.513 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.044 29.775 0.415 1.00 25.00 C ATOM 851 CD2 PHE A 57 30.806 29.763 -1.889 1.00 25.00 C ATOM 852 CE1 PHE A 57 28.699 29.775 -0.025 1.00 25.00 C ATOM 853 CE2 PHE A 57 29.464 29.756 -2.336 1.00 25.00 C ATOM 854 CZ PHE A 57 28.413 29.768 -1.407 1.00 25.00 C ATOM 0 H PHE A 57 34.835 29.336 0.812 1.00 25.00 H new ATOM 0 HA PHE A 57 32.371 28.010 1.176 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.632 30.438 0.801 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.170 30.135 -0.839 1.00 25.00 H new ATOM 0 HD1 PHE A 57 30.260 29.779 1.473 1.00 25.00 H new ATOM 0 HD2 PHE A 57 31.610 29.763 -2.610 1.00 25.00 H new ATOM 0 HE1 PHE A 57 27.894 29.780 0.695 1.00 25.00 H new ATOM 0 HE2 PHE A 57 29.248 29.741 -3.394 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.388 29.772 -1.748 1.00 25.00 H new ATOM 864 N SER A 58 33.787 27.484 -1.765 1.00 25.00 N ATOM 865 CA SER A 58 33.798 26.576 -2.908 1.00 25.00 C ATOM 866 C SER A 58 34.114 25.143 -2.508 1.00 25.00 C ATOM 867 O SER A 58 33.497 24.203 -2.995 1.00 25.00 O ATOM 868 CB SER A 58 34.851 27.052 -3.913 1.00 25.00 C ATOM 869 OG SER A 58 34.875 26.224 -5.061 1.00 25.00 O ATOM 0 H SER A 58 34.514 28.199 -1.796 1.00 25.00 H new ATOM 0 HA SER A 58 32.800 26.587 -3.346 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.638 28.080 -4.207 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.834 27.052 -3.441 1.00 25.00 H new ATOM 0 HG SER A 58 35.555 26.551 -5.686 1.00 25.00 H new ATOM 875 N ARG A 59 35.058 24.968 -1.599 1.00 25.00 N ATOM 876 CA ARG A 59 35.442 23.627 -1.164 1.00 25.00 C ATOM 877 C ARG A 59 34.273 22.945 -0.474 1.00 25.00 C ATOM 878 O ARG A 59 33.958 21.797 -0.759 1.00 25.00 O ATOM 879 CB ARG A 59 36.649 23.717 -0.232 1.00 25.00 C ATOM 880 CG ARG A 59 37.156 22.362 0.278 1.00 25.00 C ATOM 881 CD ARG A 59 36.751 22.107 1.728 1.00 25.00 C ATOM 882 NE ARG A 59 37.410 23.052 2.647 1.00 25.00 N ATOM 883 CZ ARG A 59 37.244 23.083 3.963 1.00 25.00 C ATOM 884 NH1 ARG A 59 36.450 22.249 4.589 1.00 25.00 N ATOM 885 NH2 ARG A 59 37.894 23.973 4.663 1.00 25.00 N ATOM 0 H ARG A 59 35.571 25.726 -1.149 1.00 25.00 H new ATOM 0 HA ARG A 59 35.717 23.029 -2.033 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.461 24.222 -0.756 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.387 24.339 0.624 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.761 21.566 -0.354 1.00 25.00 H new ATOM 0 HG3 ARG A 59 38.242 22.327 0.194 1.00 25.00 H new ATOM 0 HD2 ARG A 59 35.669 22.197 1.826 1.00 25.00 H new ATOM 0 HD3 ARG A 59 37.012 21.086 2.006 1.00 25.00 H new ATOM 0 HE ARG A 59 38.045 23.738 2.238 1.00 25.00 H new ATOM 0 HH11 ARG A 59 35.933 21.544 4.063 1.00 25.00 H new ATOM 0 HH12 ARG A 59 36.349 22.305 5.602 1.00 25.00 H new ATOM 0 HH21 ARG A 59 38.518 24.631 4.197 1.00 25.00 H new ATOM 0 HH22 ARG A 59 37.777 24.010 5.676 1.00 25.00 H new ATOM 899 N VAL A 60 33.609 23.661 0.417 1.00 25.00 N ATOM 900 CA VAL A 60 32.462 23.107 1.122 1.00 25.00 C ATOM 901 C VAL A 60 31.317 22.922 0.128 1.00 25.00 C ATOM 902 O VAL A 60 30.559 21.976 0.246 1.00 25.00 O ATOM 903 CB VAL A 60 32.043 23.990 2.335 1.00 25.00 C ATOM 904 CG1 VAL A 60 30.799 23.423 3.020 1.00 25.00 C ATOM 905 CG2 VAL A 60 33.188 24.044 3.371 1.00 25.00 C ATOM 0 H VAL A 60 33.841 24.622 0.670 1.00 25.00 H new ATOM 0 HA VAL A 60 32.733 22.137 1.540 1.00 25.00 H new ATOM 0 HB VAL A 60 31.825 24.990 1.959 1.00 25.00 H new ATOM 0 HG11 VAL A 60 30.527 24.058 3.864 1.00 25.00 H new ATOM 0 HG12 VAL A 60 29.974 23.392 2.308 1.00 25.00 H new ATOM 0 HG13 VAL A 60 31.008 22.415 3.377 1.00 25.00 H new ATOM 0 HG21 VAL A 60 32.886 24.664 4.215 1.00 25.00 H new ATOM 0 HG22 VAL A 60 33.409 23.036 3.722 1.00 25.00 H new ATOM 0 HG23 VAL A 60 34.078 24.471 2.908 1.00 25.00 H new ATOM 915 N LEU A 61 31.212 23.788 -0.873 1.00 25.00 N ATOM 916 CA LEU A 61 30.175 23.647 -1.898 1.00 25.00 C ATOM 917 C LEU A 61 30.252 22.278 -2.572 1.00 25.00 C ATOM 918 O LEU A 61 29.230 21.636 -2.772 1.00 25.00 O ATOM 919 CB LEU A 61 30.312 24.742 -2.968 1.00 25.00 C ATOM 920 CG LEU A 61 29.045 25.011 -3.786 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.220 26.060 -3.073 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.363 25.511 -5.184 1.00 25.00 C ATOM 0 H LEU A 61 31.827 24.592 -1.000 1.00 25.00 H new ATOM 0 HA LEU A 61 29.211 23.746 -1.400 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.615 25.669 -2.481 1.00 25.00 H new ATOM 0 HB3 LEU A 61 31.115 24.463 -3.651 1.00 25.00 H new ATOM 0 HG LEU A 61 28.500 24.072 -3.880 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.314 26.261 -3.645 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.950 25.698 -2.081 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.801 26.977 -2.979 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.435 25.688 -5.727 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.928 26.441 -5.118 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.955 24.763 -5.712 1.00 25.00 H new ATOM 934 N VAL A 62 31.453 21.813 -2.893 1.00 25.00 N ATOM 935 CA VAL A 62 31.611 20.493 -3.518 1.00 25.00 C ATOM 936 C VAL A 62 31.243 19.395 -2.536 1.00 25.00 C ATOM 937 O VAL A 62 30.513 18.478 -2.885 1.00 25.00 O ATOM 938 CB VAL A 62 33.062 20.239 -4.011 1.00 25.00 C ATOM 939 CG1 VAL A 62 33.178 18.834 -4.654 1.00 25.00 C ATOM 940 CG2 VAL A 62 33.468 21.304 -5.025 1.00 25.00 C ATOM 0 H VAL A 62 32.325 22.318 -2.736 1.00 25.00 H new ATOM 0 HA VAL A 62 30.944 20.479 -4.380 1.00 25.00 H new ATOM 0 HB VAL A 62 33.731 20.290 -3.152 1.00 25.00 H new ATOM 0 HG11 VAL A 62 34.201 18.673 -4.994 1.00 25.00 H new ATOM 0 HG12 VAL A 62 32.916 18.074 -3.918 1.00 25.00 H new ATOM 0 HG13 VAL A 62 32.498 18.765 -5.503 1.00 25.00 H new ATOM 0 HG21 VAL A 62 34.487 21.115 -5.363 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.791 21.271 -5.878 1.00 25.00 H new ATOM 0 HG23 VAL A 62 33.417 22.288 -4.559 1.00 25.00 H new ATOM 950 N GLU A 63 31.710 19.504 -1.302 1.00 25.00 N ATOM 951 CA GLU A 63 31.396 18.503 -0.272 1.00 25.00 C ATOM 952 C GLU A 63 29.883 18.409 -0.065 1.00 25.00 C ATOM 953 O GLU A 63 29.312 17.324 0.051 1.00 25.00 O ATOM 954 CB GLU A 63 32.071 18.869 1.055 1.00 25.00 C ATOM 955 CG GLU A 63 33.593 18.800 1.015 1.00 25.00 C ATOM 956 CD GLU A 63 34.096 17.423 0.618 1.00 25.00 C ATOM 957 OE1 GLU A 63 33.690 16.431 1.257 1.00 25.00 O ATOM 958 OE2 GLU A 63 34.886 17.335 -0.344 1.00 25.00 O ATOM 0 H GLU A 63 32.305 20.268 -0.982 1.00 25.00 H new ATOM 0 HA GLU A 63 31.773 17.538 -0.610 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.770 19.878 1.338 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.707 18.198 1.833 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.970 19.540 0.309 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.993 19.062 1.995 1.00 25.00 H new ATOM 965 N GLN A 64 29.222 19.556 -0.077 1.00 25.00 N ATOM 966 CA GLN A 64 27.774 19.600 0.045 1.00 25.00 C ATOM 967 C GLN A 64 27.113 19.015 -1.188 1.00 25.00 C ATOM 968 O GLN A 64 26.095 18.361 -1.074 1.00 25.00 O ATOM 969 CB GLN A 64 27.296 21.036 0.255 1.00 25.00 C ATOM 970 CG GLN A 64 27.603 21.564 1.646 1.00 25.00 C ATOM 971 CD GLN A 64 26.877 20.788 2.719 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.668 20.657 2.680 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.607 20.266 3.666 1.00 25.00 N ATOM 0 H GLN A 64 29.666 20.470 -0.170 1.00 25.00 H new ATOM 0 HA GLN A 64 27.492 19.002 0.912 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.767 21.682 -0.486 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.221 21.085 0.083 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.677 21.512 1.825 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.321 22.615 1.705 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.618 20.399 3.662 1.00 25.00 H new ATOM 0 HE22 GLN A 64 27.166 19.725 4.410 1.00 25.00 H new ATOM 982 N GLN A 65 27.696 19.205 -2.360 1.00 25.00 N ATOM 983 CA GLN A 65 27.141 18.606 -3.571 1.00 25.00 C ATOM 984 C GLN A 65 27.230 17.084 -3.512 1.00 25.00 C ATOM 985 O GLN A 65 26.337 16.414 -4.014 1.00 25.00 O ATOM 986 CB GLN A 65 27.829 19.131 -4.835 1.00 25.00 C ATOM 987 CG GLN A 65 27.335 20.508 -5.247 1.00 25.00 C ATOM 988 CD GLN A 65 28.037 21.029 -6.476 1.00 25.00 C ATOM 989 OE1 GLN A 65 27.942 20.452 -7.545 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.727 22.126 -6.333 1.00 25.00 N ATOM 0 H GLN A 65 28.540 19.759 -2.502 1.00 25.00 H new ATOM 0 HA GLN A 65 26.091 18.895 -3.621 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.905 19.172 -4.667 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.660 18.430 -5.653 1.00 25.00 H new ATOM 0 HG2 GLN A 65 26.262 20.464 -5.436 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.485 21.206 -4.423 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.782 22.579 -5.421 1.00 25.00 H new ATOM 0 HE22 GLN A 65 29.212 22.531 -7.133 1.00 25.00 H new ATOM 999 N GLN A 66 28.246 16.526 -2.859 1.00 25.00 N ATOM 1000 CA GLN A 66 28.319 15.069 -2.722 1.00 25.00 C ATOM 1001 C GLN A 66 27.141 14.561 -1.876 1.00 25.00 C ATOM 1002 O GLN A 66 26.481 13.582 -2.222 1.00 25.00 O ATOM 1003 CB GLN A 66 29.629 14.642 -2.053 1.00 25.00 C ATOM 1004 CG GLN A 66 30.876 15.142 -2.758 1.00 25.00 C ATOM 1005 CD GLN A 66 30.876 14.852 -4.244 1.00 25.00 C ATOM 1006 OE1 GLN A 66 30.725 13.719 -4.674 1.00 25.00 O ATOM 1007 NE2 GLN A 66 31.024 15.881 -5.038 1.00 25.00 N ATOM 0 H GLN A 66 29.012 17.041 -2.426 1.00 25.00 H new ATOM 0 HA GLN A 66 28.275 14.638 -3.722 1.00 25.00 H new ATOM 0 HB2 GLN A 66 29.635 15.006 -1.025 1.00 25.00 H new ATOM 0 HB3 GLN A 66 29.663 13.554 -2.006 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.967 16.217 -2.604 1.00 25.00 H new ATOM 0 HG3 GLN A 66 31.753 14.680 -2.304 1.00 25.00 H new ATOM 0 HE21 GLN A 66 31.148 16.814 -4.646 1.00 25.00 H new ATOM 0 HE22 GLN A 66 31.015 15.750 -6.050 1.00 25.00 H new ATOM 1016 N ASP A 67 26.864 15.251 -0.781 1.00 25.00 N ATOM 1017 CA ASP A 67 25.734 14.909 0.085 1.00 25.00 C ATOM 1018 C ASP A 67 24.408 15.145 -0.622 1.00 25.00 C ATOM 1019 O ASP A 67 23.467 14.357 -0.507 1.00 25.00 O ATOM 1020 CB ASP A 67 25.750 15.770 1.333 1.00 25.00 C ATOM 1021 CG ASP A 67 24.628 15.419 2.289 1.00 25.00 C ATOM 1022 OD1 ASP A 67 23.798 16.298 2.582 1.00 25.00 O ATOM 1023 OD2 ASP A 67 24.543 14.249 2.732 1.00 25.00 O ATOM 0 H ASP A 67 27.406 16.056 -0.465 1.00 25.00 H new ATOM 0 HA ASP A 67 25.833 13.854 0.342 1.00 25.00 H new ATOM 0 HB2 ASP A 67 26.707 15.652 1.841 1.00 25.00 H new ATOM 0 HB3 ASP A 67 25.667 16.819 1.049 1.00 25.00 H new ATOM 1028 N ARG A 68 24.336 16.239 -1.368 1.00 25.00 N ATOM 1029 CA ARG A 68 23.124 16.561 -2.101 1.00 25.00 C ATOM 1030 C ARG A 68 22.872 15.467 -3.100 1.00 25.00 C ATOM 1031 O ARG A 68 21.767 15.014 -3.217 1.00 25.00 O ATOM 1032 CB ARG A 68 23.189 17.905 -2.818 1.00 25.00 C ATOM 1033 CG ARG A 68 22.944 19.100 -1.909 1.00 25.00 C ATOM 1034 CD ARG A 68 22.674 20.350 -2.726 1.00 25.00 C ATOM 1035 NE ARG A 68 21.238 20.483 -3.050 1.00 25.00 N ATOM 1036 CZ ARG A 68 20.520 21.596 -2.938 1.00 25.00 C ATOM 1037 NH1 ARG A 68 21.023 22.725 -2.502 1.00 25.00 N ATOM 1038 NH2 ARG A 68 19.262 21.560 -3.263 1.00 25.00 N ATOM 0 H ARG A 68 25.095 16.911 -1.480 1.00 25.00 H new ATOM 0 HA ARG A 68 22.311 16.639 -1.379 1.00 25.00 H new ATOM 0 HB2 ARG A 68 24.169 18.010 -3.284 1.00 25.00 H new ATOM 0 HB3 ARG A 68 22.451 17.914 -3.621 1.00 25.00 H new ATOM 0 HG2 ARG A 68 22.096 18.897 -1.254 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.811 19.259 -1.268 1.00 25.00 H new ATOM 0 HD2 ARG A 68 23.006 21.228 -2.172 1.00 25.00 H new ATOM 0 HD3 ARG A 68 23.255 20.317 -3.648 1.00 25.00 H new ATOM 0 HE ARG A 68 20.757 19.650 -3.388 1.00 25.00 H new ATOM 0 HH11 ARG A 68 22.005 22.775 -2.231 1.00 25.00 H new ATOM 0 HH12 ARG A 68 20.432 23.554 -2.433 1.00 25.00 H new ATOM 0 HH21 ARG A 68 18.846 20.690 -3.596 1.00 25.00 H new ATOM 0 HH22 ARG A 68 18.691 22.402 -3.185 1.00 25.00 H new ATOM 1052 N ALA A 69 23.897 14.994 -3.780 1.00 25.00 N ATOM 1053 CA ALA A 69 23.715 13.927 -4.752 1.00 25.00 C ATOM 1054 C ALA A 69 23.060 12.690 -4.138 1.00 25.00 C ATOM 1055 O ALA A 69 22.285 12.010 -4.806 1.00 25.00 O ATOM 1056 CB ALA A 69 25.048 13.572 -5.388 1.00 25.00 C ATOM 0 H ALA A 69 24.857 15.325 -3.682 1.00 25.00 H new ATOM 0 HA ALA A 69 23.036 14.293 -5.522 1.00 25.00 H new ATOM 0 HB1 ALA A 69 24.903 12.772 -6.114 1.00 25.00 H new ATOM 0 HB2 ALA A 69 25.457 14.449 -5.890 1.00 25.00 H new ATOM 0 HB3 ALA A 69 25.742 13.240 -4.616 1.00 25.00 H new ATOM 1062 N ARG A 70 23.319 12.412 -2.867 1.00 25.00 N ATOM 1063 CA ARG A 70 22.715 11.270 -2.212 1.00 25.00 C ATOM 1064 C ARG A 70 21.219 11.529 -1.908 1.00 25.00 C ATOM 1065 O ARG A 70 20.380 10.686 -2.181 1.00 25.00 O ATOM 1066 CB ARG A 70 23.577 10.953 -0.969 1.00 25.00 C ATOM 1067 CG ARG A 70 22.959 11.202 0.379 1.00 25.00 C ATOM 1068 CD ARG A 70 23.784 10.537 1.448 1.00 25.00 C ATOM 1069 NE ARG A 70 24.125 11.476 2.526 1.00 25.00 N ATOM 1070 CZ ARG A 70 24.509 11.140 3.750 1.00 25.00 C ATOM 1071 NH1 ARG A 70 24.605 9.890 4.142 1.00 25.00 N ATOM 1072 NH2 ARG A 70 24.802 12.086 4.591 1.00 25.00 N ATOM 0 H ARG A 70 23.941 12.962 -2.275 1.00 25.00 H new ATOM 0 HA ARG A 70 22.705 10.390 -2.855 1.00 25.00 H new ATOM 0 HB2 ARG A 70 23.868 9.904 -1.018 1.00 25.00 H new ATOM 0 HB3 ARG A 70 24.493 11.541 -1.034 1.00 25.00 H new ATOM 0 HG2 ARG A 70 22.897 12.274 0.569 1.00 25.00 H new ATOM 0 HG3 ARG A 70 21.940 10.815 0.399 1.00 25.00 H new ATOM 0 HD2 ARG A 70 23.234 9.692 1.861 1.00 25.00 H new ATOM 0 HD3 ARG A 70 24.698 10.138 1.008 1.00 25.00 H new ATOM 0 HE ARG A 70 24.061 12.472 2.314 1.00 25.00 H new ATOM 0 HH11 ARG A 70 24.380 9.134 3.495 1.00 25.00 H new ATOM 0 HH12 ARG A 70 24.905 9.675 5.093 1.00 25.00 H new ATOM 0 HH21 ARG A 70 24.734 13.062 4.304 1.00 25.00 H new ATOM 0 HH22 ARG A 70 25.100 11.852 5.538 1.00 25.00 H new ATOM 1086 N ARG A 71 20.902 12.683 -1.330 1.00 25.00 N ATOM 1087 CA ARG A 71 19.525 13.001 -0.906 1.00 25.00 C ATOM 1088 C ARG A 71 18.603 13.605 -1.963 1.00 25.00 C ATOM 1089 O ARG A 71 17.392 13.467 -1.900 1.00 25.00 O ATOM 1090 CB ARG A 71 19.582 13.917 0.311 1.00 25.00 C ATOM 1091 CG ARG A 71 20.186 15.293 0.070 1.00 25.00 C ATOM 1092 CD ARG A 71 20.854 15.821 1.333 1.00 25.00 C ATOM 1093 NE ARG A 71 19.903 15.973 2.447 1.00 25.00 N ATOM 1094 CZ ARG A 71 20.215 16.396 3.668 1.00 25.00 C ATOM 1095 NH1 ARG A 71 21.433 16.721 4.014 1.00 25.00 N ATOM 1096 NH2 ARG A 71 19.272 16.496 4.563 1.00 25.00 N ATOM 0 H ARG A 71 21.578 13.423 -1.140 1.00 25.00 H new ATOM 0 HA ARG A 71 19.071 12.035 -0.682 1.00 25.00 H new ATOM 0 HB2 ARG A 71 18.570 14.046 0.694 1.00 25.00 H new ATOM 0 HB3 ARG A 71 20.157 13.419 1.092 1.00 25.00 H new ATOM 0 HG2 ARG A 71 20.917 15.238 -0.737 1.00 25.00 H new ATOM 0 HG3 ARG A 71 19.408 15.985 -0.251 1.00 25.00 H new ATOM 0 HD2 ARG A 71 21.653 15.141 1.630 1.00 25.00 H new ATOM 0 HD3 ARG A 71 21.318 16.784 1.120 1.00 25.00 H new ATOM 0 HE ARG A 71 18.928 15.735 2.268 1.00 25.00 H new ATOM 0 HH11 ARG A 71 22.191 16.655 3.335 1.00 25.00 H new ATOM 0 HH12 ARG A 71 21.625 17.041 4.963 1.00 25.00 H new ATOM 0 HH21 ARG A 71 18.312 16.251 4.322 1.00 25.00 H new ATOM 0 HH22 ARG A 71 19.495 16.819 5.505 1.00 25.00 H new ATOM 1110 N GLU A 72 19.171 14.330 -2.903 1.00 25.00 N ATOM 1111 CA GLU A 72 18.391 15.059 -3.899 1.00 25.00 C ATOM 1112 C GLU A 72 17.676 14.092 -4.825 1.00 25.00 C ATOM 1113 O GLU A 72 16.559 14.352 -5.253 1.00 25.00 O ATOM 1114 CB GLU A 72 19.305 15.981 -4.709 1.00 25.00 C ATOM 1115 CG GLU A 72 18.578 17.068 -5.435 1.00 25.00 C ATOM 1116 CD GLU A 72 18.059 18.123 -4.479 1.00 25.00 C ATOM 1117 OE1 GLU A 72 18.883 18.814 -3.833 1.00 25.00 O ATOM 1118 OE2 GLU A 72 16.828 18.219 -4.307 1.00 25.00 O ATOM 0 H GLU A 72 20.181 14.435 -3.004 1.00 25.00 H new ATOM 0 HA GLU A 72 17.645 15.662 -3.382 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.037 16.432 -4.039 1.00 25.00 H new ATOM 0 HB3 GLU A 72 19.860 15.383 -5.432 1.00 25.00 H new ATOM 0 HG2 GLU A 72 19.245 17.531 -6.162 1.00 25.00 H new ATOM 0 HG3 GLU A 72 17.745 16.640 -5.994 1.00 25.00 H new ATOM 1125 N GLN A 73 18.296 12.946 -5.079 1.00 25.00 N ATOM 1126 CA GLN A 73 17.680 11.912 -5.910 1.00 25.00 C ATOM 1127 C GLN A 73 16.351 11.455 -5.315 1.00 25.00 C ATOM 1128 O GLN A 73 15.415 11.155 -6.043 1.00 25.00 O ATOM 1129 CB GLN A 73 18.617 10.713 -6.059 1.00 25.00 C ATOM 1130 CG GLN A 73 19.831 11.010 -6.929 1.00 25.00 C ATOM 1131 CD GLN A 73 20.689 9.783 -7.158 1.00 25.00 C ATOM 1132 OE1 GLN A 73 20.285 8.851 -7.835 1.00 25.00 O ATOM 1133 NE2 GLN A 73 21.867 9.779 -6.601 1.00 25.00 N ATOM 0 H GLN A 73 19.222 12.707 -4.724 1.00 25.00 H new ATOM 0 HA GLN A 73 17.493 12.343 -6.894 1.00 25.00 H new ATOM 0 HB2 GLN A 73 18.953 10.397 -5.072 1.00 25.00 H new ATOM 0 HB3 GLN A 73 18.064 9.878 -6.490 1.00 25.00 H new ATOM 0 HG2 GLN A 73 19.499 11.403 -7.890 1.00 25.00 H new ATOM 0 HG3 GLN A 73 20.432 11.788 -6.457 1.00 25.00 H new ATOM 0 HE21 GLN A 73 22.170 10.577 -6.042 1.00 25.00 H new ATOM 0 HE22 GLN A 73 22.487 8.978 -6.724 1.00 25.00 H new ATOM 1142 N GLU A 74 16.258 11.441 -3.993 1.00 25.00 N ATOM 1143 CA GLU A 74 15.021 11.055 -3.316 1.00 25.00 C ATOM 1144 C GLU A 74 13.945 12.127 -3.498 1.00 25.00 C ATOM 1145 O GLU A 74 12.761 11.820 -3.608 1.00 25.00 O ATOM 1146 CB GLU A 74 15.279 10.851 -1.818 1.00 25.00 C ATOM 1147 CG GLU A 74 16.367 9.825 -1.511 1.00 25.00 C ATOM 1148 CD GLU A 74 16.582 9.650 -0.014 1.00 25.00 C ATOM 1149 OE1 GLU A 74 16.315 8.542 0.503 1.00 25.00 O ATOM 1150 OE2 GLU A 74 17.009 10.624 0.651 1.00 25.00 O ATOM 0 H GLU A 74 17.022 11.692 -3.365 1.00 25.00 H new ATOM 0 HA GLU A 74 14.672 10.122 -3.759 1.00 25.00 H new ATOM 0 HB2 GLU A 74 15.559 11.806 -1.374 1.00 25.00 H new ATOM 0 HB3 GLU A 74 14.352 10.537 -1.339 1.00 25.00 H new ATOM 0 HG2 GLU A 74 16.096 8.866 -1.953 1.00 25.00 H new ATOM 0 HG3 GLU A 74 17.301 10.137 -1.977 1.00 25.00 H new ATOM 1157 N ARG A 75 14.358 13.389 -3.530 1.00 25.00 N ATOM 1158 CA ARG A 75 13.416 14.502 -3.709 1.00 25.00 C ATOM 1159 C ARG A 75 12.862 14.555 -5.125 1.00 25.00 C ATOM 1160 O ARG A 75 11.645 14.542 -5.315 1.00 25.00 O ATOM 1161 CB ARG A 75 14.077 15.839 -3.377 1.00 25.00 C ATOM 1162 CG ARG A 75 14.518 15.941 -1.926 1.00 25.00 C ATOM 1163 CD ARG A 75 15.007 17.341 -1.586 1.00 25.00 C ATOM 1164 NE ARG A 75 13.908 18.330 -1.569 1.00 25.00 N ATOM 1165 CZ ARG A 75 13.704 19.283 -2.476 1.00 25.00 C ATOM 1166 NH1 ARG A 75 14.479 19.471 -3.512 1.00 25.00 N ATOM 1167 NH2 ARG A 75 12.679 20.076 -2.333 1.00 25.00 N ATOM 0 H ARG A 75 15.333 13.672 -3.435 1.00 25.00 H new ATOM 0 HA ARG A 75 12.590 14.325 -3.020 1.00 25.00 H new ATOM 0 HB2 ARG A 75 14.942 15.981 -4.024 1.00 25.00 H new ATOM 0 HB3 ARG A 75 13.379 16.647 -3.596 1.00 25.00 H new ATOM 0 HG2 ARG A 75 13.686 15.677 -1.273 1.00 25.00 H new ATOM 0 HG3 ARG A 75 15.314 15.221 -1.736 1.00 25.00 H new ATOM 0 HD2 ARG A 75 15.495 17.326 -0.611 1.00 25.00 H new ATOM 0 HD3 ARG A 75 15.758 17.648 -2.314 1.00 25.00 H new ATOM 0 HE ARG A 75 13.247 18.277 -0.794 1.00 25.00 H new ATOM 0 HH11 ARG A 75 15.290 18.870 -3.658 1.00 25.00 H new ATOM 0 HH12 ARG A 75 14.272 20.219 -4.175 1.00 25.00 H new ATOM 0 HH21 ARG A 75 12.051 19.960 -1.537 1.00 25.00 H new ATOM 0 HH22 ARG A 75 12.505 20.813 -3.017 1.00 25.00 H new ATOM 1181 N ILE A 76 13.755 14.588 -6.111 1.00 25.00 N ATOM 1182 CA ILE A 76 13.372 14.695 -7.530 1.00 25.00 C ATOM 1183 C ILE A 76 12.586 13.475 -7.995 1.00 25.00 C ATOM 1184 O ILE A 76 11.885 13.525 -8.999 1.00 25.00 O ATOM 1185 CB ILE A 76 14.594 14.960 -8.461 1.00 25.00 C ATOM 1186 CG1 ILE A 76 15.532 13.736 -8.494 1.00 25.00 C ATOM 1187 CG2 ILE A 76 15.328 16.248 -7.998 1.00 25.00 C ATOM 1188 CD1 ILE A 76 16.774 13.894 -9.387 1.00 25.00 C ATOM 0 H ILE A 76 14.762 14.542 -5.958 1.00 25.00 H new ATOM 0 HA ILE A 76 12.719 15.565 -7.605 1.00 25.00 H new ATOM 0 HB ILE A 76 14.247 15.117 -9.482 1.00 25.00 H new ATOM 0 HG12 ILE A 76 15.859 13.520 -7.477 1.00 25.00 H new ATOM 0 HG13 ILE A 76 14.964 12.871 -8.837 1.00 25.00 H new ATOM 0 HG21 ILE A 76 16.183 16.434 -8.649 1.00 25.00 H new ATOM 0 HG22 ILE A 76 14.643 17.095 -8.048 1.00 25.00 H new ATOM 0 HG23 ILE A 76 15.674 16.121 -6.972 1.00 25.00 H new ATOM 0 HD11 ILE A 76 17.371 12.983 -9.345 1.00 25.00 H new ATOM 0 HD12 ILE A 76 16.462 14.076 -10.415 1.00 25.00 H new ATOM 0 HD13 ILE A 76 17.371 14.735 -9.035 1.00 25.00 H new ATOM 1200 N ARG A 77 12.673 12.393 -7.228 1.00 25.00 N ATOM 1201 CA ARG A 77 11.871 11.193 -7.465 1.00 25.00 C ATOM 1202 C ARG A 77 10.370 11.504 -7.413 1.00 25.00 C ATOM 1203 O ARG A 77 9.558 10.719 -7.905 1.00 25.00 O ATOM 1204 CB ARG A 77 12.207 10.146 -6.395 1.00 25.00 C ATOM 1205 CG ARG A 77 12.497 8.749 -6.923 1.00 25.00 C ATOM 1206 CD ARG A 77 11.232 8.086 -7.428 1.00 25.00 C ATOM 1207 NE ARG A 77 11.429 6.658 -7.719 1.00 25.00 N ATOM 1208 CZ ARG A 77 10.491 5.846 -8.189 1.00 25.00 C ATOM 1209 NH1 ARG A 77 9.276 6.263 -8.452 1.00 25.00 N ATOM 1210 NH2 ARG A 77 10.781 4.591 -8.399 1.00 25.00 N ATOM 0 H ARG A 77 13.299 12.321 -6.426 1.00 25.00 H new ATOM 0 HA ARG A 77 12.106 10.814 -8.459 1.00 25.00 H new ATOM 0 HB2 ARG A 77 13.074 10.491 -5.832 1.00 25.00 H new ATOM 0 HB3 ARG A 77 11.374 10.086 -5.694 1.00 25.00 H new ATOM 0 HG2 ARG A 77 13.229 8.806 -7.729 1.00 25.00 H new ATOM 0 HG3 ARG A 77 12.939 8.142 -6.133 1.00 25.00 H new ATOM 0 HD2 ARG A 77 10.444 8.198 -6.683 1.00 25.00 H new ATOM 0 HD3 ARG A 77 10.893 8.595 -8.330 1.00 25.00 H new ATOM 0 HE ARG A 77 12.354 6.263 -7.547 1.00 25.00 H new ATOM 0 HH11 ARG A 77 9.027 7.240 -8.296 1.00 25.00 H new ATOM 0 HH12 ARG A 77 8.580 5.611 -8.813 1.00 25.00 H new ATOM 0 HH21 ARG A 77 11.720 4.245 -8.202 1.00 25.00 H new ATOM 0 HH22 ARG A 77 10.069 3.956 -8.760 1.00 25.00 H new ATOM 1224 N LEU A 78 10.010 12.634 -6.814 1.00 25.00 N ATOM 1225 CA LEU A 78 8.614 13.060 -6.736 1.00 25.00 C ATOM 1226 C LEU A 78 8.404 14.505 -7.219 1.00 25.00 C ATOM 1227 O LEU A 78 7.536 14.749 -8.049 1.00 25.00 O ATOM 1228 CB LEU A 78 8.120 12.909 -5.292 1.00 25.00 C ATOM 1229 CG LEU A 78 6.608 13.102 -5.087 1.00 25.00 C ATOM 1230 CD1 LEU A 78 5.794 12.051 -5.840 1.00 25.00 C ATOM 1231 CD2 LEU A 78 6.285 13.035 -3.595 1.00 25.00 C ATOM 0 H LEU A 78 10.669 13.276 -6.373 1.00 25.00 H new ATOM 0 HA LEU A 78 8.037 12.421 -7.404 1.00 25.00 H new ATOM 0 HB2 LEU A 78 8.394 11.916 -4.934 1.00 25.00 H new ATOM 0 HB3 LEU A 78 8.649 13.630 -4.668 1.00 25.00 H new ATOM 0 HG LEU A 78 6.336 14.079 -5.486 1.00 25.00 H new ATOM 0 HD11 LEU A 78 4.731 12.223 -5.669 1.00 25.00 H new ATOM 0 HD12 LEU A 78 6.006 12.122 -6.907 1.00 25.00 H new ATOM 0 HD13 LEU A 78 6.063 11.057 -5.482 1.00 25.00 H new ATOM 0 HD21 LEU A 78 5.214 13.172 -3.448 1.00 25.00 H new ATOM 0 HD22 LEU A 78 6.584 12.064 -3.201 1.00 25.00 H new ATOM 0 HD23 LEU A 78 6.826 13.822 -3.070 1.00 25.00 H new ATOM 1243 N PHE A 79 9.188 15.448 -6.705 1.00 25.00 N ATOM 1244 CA PHE A 79 9.076 16.862 -7.099 1.00 25.00 C ATOM 1245 C PHE A 79 10.449 17.536 -7.139 1.00 25.00 C ATOM 1246 O PHE A 79 11.355 17.153 -6.409 1.00 25.00 O ATOM 1247 CB PHE A 79 8.224 17.652 -6.088 1.00 25.00 C ATOM 1248 CG PHE A 79 6.784 17.214 -6.014 1.00 25.00 C ATOM 1249 CD1 PHE A 79 6.255 16.710 -4.810 1.00 25.00 C ATOM 1250 CD2 PHE A 79 5.939 17.328 -7.135 1.00 25.00 C ATOM 1251 CE1 PHE A 79 4.893 16.318 -4.722 1.00 25.00 C ATOM 1252 CE2 PHE A 79 4.580 16.932 -7.062 1.00 25.00 C ATOM 1253 CZ PHE A 79 4.059 16.425 -5.853 1.00 25.00 C ATOM 0 H PHE A 79 9.913 15.264 -6.011 1.00 25.00 H new ATOM 0 HA PHE A 79 8.614 16.870 -8.086 1.00 25.00 H new ATOM 0 HB2 PHE A 79 8.672 17.555 -5.099 1.00 25.00 H new ATOM 0 HB3 PHE A 79 8.257 18.709 -6.351 1.00 25.00 H new ATOM 0 HD1 PHE A 79 6.893 16.621 -3.943 1.00 25.00 H new ATOM 0 HD2 PHE A 79 6.331 17.722 -8.061 1.00 25.00 H new ATOM 0 HE1 PHE A 79 4.497 15.939 -3.791 1.00 25.00 H new ATOM 0 HE2 PHE A 79 3.944 17.018 -7.931 1.00 25.00 H new ATOM 0 HZ PHE A 79 3.025 16.120 -5.794 1.00 25.00 H new ATOM 1263 N SER A 80 10.561 18.610 -7.903 1.00 25.00 N ATOM 1264 CA SER A 80 11.745 19.448 -7.906 1.00 25.00 C ATOM 1265 C SER A 80 11.182 20.851 -7.874 1.00 25.00 C ATOM 1266 O SER A 80 10.011 21.048 -8.189 1.00 25.00 O ATOM 1267 CB SER A 80 12.602 19.234 -9.153 1.00 25.00 C ATOM 1268 OG SER A 80 13.777 20.027 -9.066 1.00 25.00 O ATOM 0 H SER A 80 9.830 18.925 -8.540 1.00 25.00 H new ATOM 0 HA SER A 80 12.408 19.226 -7.069 1.00 25.00 H new ATOM 0 HB2 SER A 80 12.868 18.181 -9.247 1.00 25.00 H new ATOM 0 HB3 SER A 80 12.036 19.501 -10.046 1.00 25.00 H new ATOM 0 HG SER A 80 14.238 20.025 -9.931 1.00 25.00 H new ATOM 1274 N ALA A 81 11.996 21.799 -7.448 1.00 25.00 N ATOM 1275 CA ALA A 81 11.577 23.194 -7.319 1.00 25.00 C ATOM 1276 C ALA A 81 12.780 24.135 -7.455 1.00 25.00 C ATOM 1277 O ALA A 81 12.861 25.150 -6.769 1.00 25.00 O ATOM 1278 CB ALA A 81 10.875 23.408 -5.963 1.00 25.00 C ATOM 0 H ALA A 81 12.966 21.630 -7.181 1.00 25.00 H new ATOM 0 HA ALA A 81 10.875 23.424 -8.120 1.00 25.00 H new ATOM 0 HB1 ALA A 81 10.566 24.449 -5.874 1.00 25.00 H new ATOM 0 HB2 ALA A 81 9.999 22.763 -5.901 1.00 25.00 H new ATOM 0 HB3 ALA A 81 11.564 23.164 -5.154 1.00 25.00 H new ATOM 1284 N ASP A 82 13.721 23.776 -8.313 1.00 25.00 N ATOM 1285 CA ASP A 82 14.858 24.640 -8.600 1.00 25.00 C ATOM 1286 C ASP A 82 14.340 25.688 -9.580 1.00 25.00 C ATOM 1287 O ASP A 82 13.390 25.423 -10.320 1.00 25.00 O ATOM 1288 CB ASP A 82 15.997 23.840 -9.249 1.00 25.00 C ATOM 1289 CG ASP A 82 17.178 23.641 -8.315 1.00 25.00 C ATOM 1290 OD1 ASP A 82 17.676 22.503 -8.215 1.00 25.00 O ATOM 1291 OD2 ASP A 82 17.646 24.622 -7.697 1.00 25.00 O ATOM 0 H ASP A 82 13.721 22.893 -8.823 1.00 25.00 H new ATOM 0 HA ASP A 82 15.255 25.088 -7.689 1.00 25.00 H new ATOM 0 HB2 ASP A 82 15.619 22.867 -9.563 1.00 25.00 H new ATOM 0 HB3 ASP A 82 16.333 24.357 -10.148 1.00 25.00 H new ATOM 1296 N PRO A 83 14.937 26.889 -9.595 1.00 25.00 N ATOM 1297 CA PRO A 83 14.456 27.857 -10.581 1.00 25.00 C ATOM 1298 C PRO A 83 14.912 27.470 -11.992 1.00 25.00 C ATOM 1299 O PRO A 83 15.858 26.701 -12.168 1.00 25.00 O ATOM 1300 CB PRO A 83 15.072 29.167 -10.096 1.00 25.00 C ATOM 1301 CG PRO A 83 16.328 28.763 -9.479 1.00 25.00 C ATOM 1302 CD PRO A 83 16.045 27.439 -8.798 1.00 25.00 C ATOM 0 HA PRO A 83 13.370 27.916 -10.656 1.00 25.00 H new ATOM 0 HB2 PRO A 83 15.238 29.859 -10.922 1.00 25.00 H new ATOM 0 HB3 PRO A 83 14.422 29.673 -9.382 1.00 25.00 H new ATOM 0 HG2 PRO A 83 17.115 28.658 -10.226 1.00 25.00 H new ATOM 0 HG3 PRO A 83 16.668 29.508 -8.760 1.00 25.00 H new ATOM 0 HD2 PRO A 83 16.916 26.784 -8.811 1.00 25.00 H new ATOM 0 HD3 PRO A 83 15.763 27.574 -7.754 1.00 25.00 H new ATOM 1310 N PHE A 84 14.205 27.976 -12.988 1.00 25.00 N ATOM 1311 CA PHE A 84 14.374 27.536 -14.377 1.00 25.00 C ATOM 1312 C PHE A 84 15.327 28.418 -15.175 1.00 25.00 C ATOM 1313 O PHE A 84 15.372 28.360 -16.403 1.00 25.00 O ATOM 1314 CB PHE A 84 13.001 27.487 -15.062 1.00 25.00 C ATOM 1315 CG PHE A 84 12.263 28.804 -15.041 1.00 25.00 C ATOM 1316 CD1 PHE A 84 12.496 29.776 -16.035 1.00 25.00 C ATOM 1317 CD2 PHE A 84 11.330 29.082 -14.022 1.00 25.00 C ATOM 1318 CE1 PHE A 84 11.815 31.018 -16.009 1.00 25.00 C ATOM 1319 CE2 PHE A 84 10.642 30.322 -13.986 1.00 25.00 C ATOM 1320 CZ PHE A 84 10.890 31.293 -14.981 1.00 25.00 C ATOM 0 H PHE A 84 13.498 28.701 -12.865 1.00 25.00 H new ATOM 0 HA PHE A 84 14.824 26.544 -14.350 1.00 25.00 H new ATOM 0 HB2 PHE A 84 13.133 27.171 -16.097 1.00 25.00 H new ATOM 0 HB3 PHE A 84 12.388 26.730 -14.573 1.00 25.00 H new ATOM 0 HD1 PHE A 84 13.202 29.571 -16.826 1.00 25.00 H new ATOM 0 HD2 PHE A 84 11.137 28.342 -13.259 1.00 25.00 H new ATOM 0 HE1 PHE A 84 12.004 31.754 -16.776 1.00 25.00 H new ATOM 0 HE2 PHE A 84 9.930 30.523 -13.199 1.00 25.00 H new ATOM 0 HZ PHE A 84 10.374 32.241 -14.955 1.00 25.00 H new ATOM 1330 N ASP A 85 16.113 29.211 -14.466 1.00 25.00 N ATOM 1331 CA ASP A 85 17.074 30.145 -15.072 1.00 25.00 C ATOM 1332 C ASP A 85 18.337 29.422 -15.578 1.00 25.00 C ATOM 1333 O ASP A 85 19.468 29.872 -15.389 1.00 25.00 O ATOM 1334 CB ASP A 85 17.462 31.227 -14.059 1.00 25.00 C ATOM 1335 CG ASP A 85 16.265 32.016 -13.561 1.00 25.00 C ATOM 1336 OD1 ASP A 85 15.539 31.501 -12.680 1.00 25.00 O ATOM 1337 OD2 ASP A 85 16.062 33.154 -14.024 1.00 25.00 O ATOM 0 H ASP A 85 16.109 29.232 -13.446 1.00 25.00 H new ATOM 0 HA ASP A 85 16.589 30.605 -15.933 1.00 25.00 H new ATOM 0 HB2 ASP A 85 17.964 30.762 -13.211 1.00 25.00 H new ATOM 0 HB3 ASP A 85 18.177 31.910 -14.518 1.00 25.00 H new ATOM 1342 N LEU A 86 18.120 28.297 -16.239 1.00 25.00 N ATOM 1343 CA LEU A 86 19.180 27.486 -16.832 1.00 25.00 C ATOM 1344 C LEU A 86 19.779 28.253 -18.004 1.00 25.00 C ATOM 1345 O LEU A 86 20.947 28.108 -18.339 1.00 25.00 O ATOM 1346 CB LEU A 86 18.570 26.171 -17.339 1.00 25.00 C ATOM 1347 CG LEU A 86 17.923 25.264 -16.276 1.00 25.00 C ATOM 1348 CD1 LEU A 86 17.009 24.238 -16.936 1.00 25.00 C ATOM 1349 CD2 LEU A 86 18.986 24.548 -15.457 1.00 25.00 C ATOM 0 H LEU A 86 17.187 27.912 -16.383 1.00 25.00 H new ATOM 0 HA LEU A 86 19.955 27.271 -16.096 1.00 25.00 H new ATOM 0 HB2 LEU A 86 17.816 26.410 -18.089 1.00 25.00 H new ATOM 0 HB3 LEU A 86 19.352 25.603 -17.843 1.00 25.00 H new ATOM 0 HG LEU A 86 17.333 25.895 -15.611 1.00 25.00 H new ATOM 0 HD11 LEU A 86 16.560 23.605 -16.171 1.00 25.00 H new ATOM 0 HD12 LEU A 86 16.223 24.753 -17.488 1.00 25.00 H new ATOM 0 HD13 LEU A 86 17.590 23.621 -17.622 1.00 25.00 H new ATOM 0 HD21 LEU A 86 18.505 23.913 -14.713 1.00 25.00 H new ATOM 0 HD22 LEU A 86 19.600 23.934 -16.115 1.00 25.00 H new ATOM 0 HD23 LEU A 86 19.615 25.283 -14.955 1.00 25.00 H new ATOM 1361 N GLU A 87 18.949 29.083 -18.611 1.00 25.00 N ATOM 1362 CA GLU A 87 19.351 29.919 -19.740 1.00 25.00 C ATOM 1363 C GLU A 87 20.252 31.076 -19.323 1.00 25.00 C ATOM 1364 O GLU A 87 21.083 31.552 -20.085 1.00 25.00 O ATOM 1365 CB GLU A 87 18.096 30.477 -20.415 1.00 25.00 C ATOM 1366 CG GLU A 87 17.180 31.339 -19.528 1.00 25.00 C ATOM 1367 CD GLU A 87 15.943 31.818 -20.279 1.00 25.00 C ATOM 1368 OE1 GLU A 87 15.670 33.037 -20.266 1.00 25.00 O ATOM 1369 OE2 GLU A 87 15.252 30.976 -20.897 1.00 25.00 O ATOM 0 H GLU A 87 17.973 29.200 -18.338 1.00 25.00 H new ATOM 0 HA GLU A 87 19.923 29.294 -20.426 1.00 25.00 H new ATOM 0 HB2 GLU A 87 18.404 31.074 -21.273 1.00 25.00 H new ATOM 0 HB3 GLU A 87 17.513 29.641 -20.801 1.00 25.00 H new ATOM 0 HG2 GLU A 87 16.873 30.762 -18.655 1.00 25.00 H new ATOM 0 HG3 GLU A 87 17.737 32.201 -19.161 1.00 25.00 H new ATOM 1376 N ALA A 88 20.053 31.520 -18.096 1.00 25.00 N ATOM 1377 CA ALA A 88 20.749 32.686 -17.546 1.00 25.00 C ATOM 1378 C ALA A 88 22.195 32.411 -17.090 1.00 25.00 C ATOM 1379 O ALA A 88 22.773 33.205 -16.347 1.00 25.00 O ATOM 1380 CB ALA A 88 19.937 33.250 -16.377 1.00 25.00 C ATOM 0 H ALA A 88 19.402 31.085 -17.443 1.00 25.00 H new ATOM 0 HA ALA A 88 20.829 33.407 -18.360 1.00 25.00 H new ATOM 0 HB1 ALA A 88 20.450 34.118 -15.963 1.00 25.00 H new ATOM 0 HB2 ALA A 88 18.949 33.546 -16.730 1.00 25.00 H new ATOM 0 HB3 ALA A 88 19.833 32.488 -15.605 1.00 25.00 H new ATOM 1386 N GLN A 89 22.768 31.284 -17.483 1.00 25.00 N ATOM 1387 CA GLN A 89 24.112 30.929 -17.027 1.00 25.00 C ATOM 1388 C GLN A 89 25.195 31.483 -17.944 1.00 25.00 C ATOM 1389 O GLN A 89 25.197 31.255 -19.151 1.00 25.00 O ATOM 1390 CB GLN A 89 24.254 29.414 -16.912 1.00 25.00 C ATOM 1391 CG GLN A 89 23.223 28.787 -15.977 1.00 25.00 C ATOM 1392 CD GLN A 89 23.264 29.392 -14.595 1.00 25.00 C ATOM 1393 OE1 GLN A 89 24.239 29.252 -13.872 1.00 25.00 O ATOM 1394 NE2 GLN A 89 22.218 30.076 -14.228 1.00 25.00 N ATOM 0 H GLN A 89 22.334 30.605 -18.108 1.00 25.00 H new ATOM 0 HA GLN A 89 24.246 31.382 -16.045 1.00 25.00 H new ATOM 0 HB2 GLN A 89 24.156 28.969 -17.902 1.00 25.00 H new ATOM 0 HB3 GLN A 89 25.255 29.175 -16.553 1.00 25.00 H new ATOM 0 HG2 GLN A 89 22.226 28.916 -16.399 1.00 25.00 H new ATOM 0 HG3 GLN A 89 23.403 27.714 -15.908 1.00 25.00 H new ATOM 0 HE21 GLN A 89 21.423 30.170 -14.860 1.00 25.00 H new ATOM 0 HE22 GLN A 89 22.194 30.517 -13.309 1.00 25.00 H new ATOM 1403 N ALA A 90 26.126 32.206 -17.340 1.00 25.00 N ATOM 1404 CA ALA A 90 27.238 32.830 -18.050 1.00 25.00 C ATOM 1405 C ALA A 90 28.369 33.081 -17.047 1.00 25.00 C ATOM 1406 O ALA A 90 28.148 33.027 -15.836 1.00 25.00 O ATOM 1407 CB ALA A 90 26.777 34.160 -18.682 1.00 25.00 C ATOM 0 H ALA A 90 26.133 32.379 -16.335 1.00 25.00 H new ATOM 0 HA ALA A 90 27.590 32.177 -18.848 1.00 25.00 H new ATOM 0 HB1 ALA A 90 27.612 34.620 -19.210 1.00 25.00 H new ATOM 0 HB2 ALA A 90 25.965 33.967 -19.384 1.00 25.00 H new ATOM 0 HB3 ALA A 90 26.428 34.833 -17.899 1.00 25.00 H new ATOM 1413 N LYS A 91 29.561 33.378 -17.551 1.00 25.00 N ATOM 1414 CA LYS A 91 30.713 33.709 -16.706 1.00 25.00 C ATOM 1415 C LYS A 91 31.393 34.932 -17.293 1.00 25.00 C ATOM 1416 O LYS A 91 31.501 35.053 -18.509 1.00 25.00 O ATOM 1417 CB LYS A 91 31.696 32.531 -16.645 1.00 25.00 C ATOM 1418 CG LYS A 91 31.209 31.419 -15.725 1.00 25.00 C ATOM 1419 CD LYS A 91 32.131 30.203 -15.688 1.00 25.00 C ATOM 1420 CE LYS A 91 31.524 29.173 -14.738 1.00 25.00 C ATOM 1421 NZ LYS A 91 32.157 27.804 -14.727 1.00 25.00 N ATOM 0 H LYS A 91 29.761 33.398 -18.551 1.00 25.00 H new ATOM 0 HA LYS A 91 30.379 33.915 -15.689 1.00 25.00 H new ATOM 0 HB2 LYS A 91 31.843 32.131 -17.648 1.00 25.00 H new ATOM 0 HB3 LYS A 91 32.666 32.888 -16.298 1.00 25.00 H new ATOM 0 HG2 LYS A 91 31.105 31.815 -14.715 1.00 25.00 H new ATOM 0 HG3 LYS A 91 30.217 31.102 -16.047 1.00 25.00 H new ATOM 0 HD2 LYS A 91 32.243 29.780 -16.686 1.00 25.00 H new ATOM 0 HD3 LYS A 91 33.127 30.491 -15.351 1.00 25.00 H new ATOM 0 HE2 LYS A 91 31.568 29.576 -13.726 1.00 25.00 H new ATOM 0 HE3 LYS A 91 30.470 29.058 -14.990 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 31.853 27.288 -13.877 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 31.862 27.278 -15.575 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 33.193 27.900 -14.722 1.00 25.00 H new ATOM 1435 N ILE A 92 31.821 35.834 -16.426 1.00 25.00 N ATOM 1436 CA ILE A 92 32.504 37.058 -16.814 1.00 25.00 C ATOM 1437 C ILE A 92 33.624 37.176 -15.796 1.00 25.00 C ATOM 1438 O ILE A 92 33.393 37.023 -14.598 1.00 25.00 O ATOM 1439 CB ILE A 92 31.570 38.320 -16.735 1.00 25.00 C ATOM 1440 CG1 ILE A 92 30.364 38.157 -17.692 1.00 25.00 C ATOM 1441 CG2 ILE A 92 32.369 39.611 -17.094 1.00 25.00 C ATOM 1442 CD1 ILE A 92 29.285 39.248 -17.560 1.00 25.00 C ATOM 0 H ILE A 92 31.702 35.736 -15.418 1.00 25.00 H new ATOM 0 HA ILE A 92 32.845 37.017 -17.848 1.00 25.00 H new ATOM 0 HB ILE A 92 31.198 38.412 -15.714 1.00 25.00 H new ATOM 0 HG12 ILE A 92 30.731 38.150 -18.718 1.00 25.00 H new ATOM 0 HG13 ILE A 92 29.903 37.186 -17.512 1.00 25.00 H new ATOM 0 HG21 ILE A 92 31.708 40.476 -17.035 1.00 25.00 H new ATOM 0 HG22 ILE A 92 33.194 39.735 -16.392 1.00 25.00 H new ATOM 0 HG23 ILE A 92 32.764 39.525 -18.106 1.00 25.00 H new ATOM 0 HD11 ILE A 92 28.480 39.052 -18.269 1.00 25.00 H new ATOM 0 HD12 ILE A 92 28.885 39.243 -16.546 1.00 25.00 H new ATOM 0 HD13 ILE A 92 29.725 40.222 -17.772 1.00 25.00 H new ATOM 1454 N GLU A 93 34.826 37.411 -16.280 1.00 25.00 N ATOM 1455 CA GLU A 93 36.012 37.556 -15.454 1.00 25.00 C ATOM 1456 C GLU A 93 36.663 38.875 -15.863 1.00 25.00 C ATOM 1457 O GLU A 93 36.247 39.477 -16.856 1.00 25.00 O ATOM 1458 CB GLU A 93 36.936 36.358 -15.673 1.00 25.00 C ATOM 1459 CG GLU A 93 37.374 36.137 -17.126 1.00 25.00 C ATOM 1460 CD GLU A 93 38.077 34.795 -17.324 1.00 25.00 C ATOM 1461 OE1 GLU A 93 38.276 34.061 -16.329 1.00 25.00 O ATOM 1462 OE2 GLU A 93 38.389 34.456 -18.485 1.00 25.00 O ATOM 0 H GLU A 93 35.012 37.509 -17.278 1.00 25.00 H new ATOM 0 HA GLU A 93 35.779 37.577 -14.389 1.00 25.00 H new ATOM 0 HB2 GLU A 93 37.826 36.486 -15.056 1.00 25.00 H new ATOM 0 HB3 GLU A 93 36.431 35.459 -15.320 1.00 25.00 H new ATOM 0 HG2 GLU A 93 36.501 36.187 -17.777 1.00 25.00 H new ATOM 0 HG3 GLU A 93 38.043 36.943 -17.428 1.00 25.00 H new ATOM 1469 N GLU A 94 37.621 39.361 -15.084 1.00 25.00 N ATOM 1470 CA GLU A 94 38.209 40.680 -15.333 1.00 25.00 C ATOM 1471 C GLU A 94 39.734 40.678 -15.352 1.00 25.00 C ATOM 1472 O GLU A 94 40.383 39.887 -14.668 1.00 25.00 O ATOM 1473 CB GLU A 94 37.695 41.680 -14.276 1.00 25.00 C ATOM 1474 CG GLU A 94 38.084 41.371 -12.802 1.00 25.00 C ATOM 1475 CD GLU A 94 39.399 42.021 -12.354 1.00 25.00 C ATOM 1476 OE1 GLU A 94 40.094 42.643 -13.180 1.00 25.00 O ATOM 1477 OE2 GLU A 94 39.725 41.945 -11.147 1.00 25.00 O ATOM 0 H GLU A 94 38.008 38.869 -14.279 1.00 25.00 H new ATOM 0 HA GLU A 94 37.894 40.981 -16.332 1.00 25.00 H new ATOM 0 HB2 GLU A 94 38.069 42.672 -14.530 1.00 25.00 H new ATOM 0 HB3 GLU A 94 36.608 41.723 -14.343 1.00 25.00 H new ATOM 0 HG2 GLU A 94 37.282 41.710 -12.147 1.00 25.00 H new ATOM 0 HG3 GLU A 94 38.163 40.291 -12.677 1.00 25.00 H new ATOM 1484 N ASP A 95 40.283 41.616 -16.112 1.00 25.00 N ATOM 1485 CA ASP A 95 41.722 41.869 -16.160 1.00 25.00 C ATOM 1486 C ASP A 95 41.928 43.386 -16.234 1.00 25.00 C ATOM 1487 O ASP A 95 42.541 43.916 -17.158 1.00 25.00 O ATOM 1488 CB ASP A 95 42.376 41.178 -17.365 1.00 25.00 C ATOM 1489 CG ASP A 95 43.902 41.277 -17.338 1.00 25.00 C ATOM 1490 OD1 ASP A 95 44.457 41.737 -16.310 1.00 25.00 O ATOM 1491 OD2 ASP A 95 44.548 40.887 -18.334 1.00 25.00 O ATOM 0 H ASP A 95 39.740 42.230 -16.719 1.00 25.00 H new ATOM 0 HA ASP A 95 42.195 41.460 -15.267 1.00 25.00 H new ATOM 0 HB2 ASP A 95 42.083 40.128 -17.381 1.00 25.00 H new ATOM 0 HB3 ASP A 95 42.002 41.627 -18.285 1.00 25.00 H new ATOM 1496 N ILE A 96 41.380 44.105 -15.266 1.00 25.00 N ATOM 1497 CA ILE A 96 41.528 45.566 -15.233 1.00 25.00 C ATOM 1498 C ILE A 96 42.818 45.931 -14.483 1.00 25.00 C ATOM 1499 O ILE A 96 42.865 46.855 -13.670 1.00 25.00 O ATOM 1500 CB ILE A 96 40.260 46.299 -14.660 1.00 25.00 C ATOM 1501 CG1 ILE A 96 39.921 45.847 -13.225 1.00 25.00 C ATOM 1502 CG2 ILE A 96 39.044 46.038 -15.586 1.00 25.00 C ATOM 1503 CD1 ILE A 96 39.056 46.841 -12.444 1.00 25.00 C ATOM 0 H ILE A 96 40.834 43.714 -14.498 1.00 25.00 H new ATOM 0 HA ILE A 96 41.611 45.926 -16.259 1.00 25.00 H new ATOM 0 HB ILE A 96 40.487 47.364 -14.624 1.00 25.00 H new ATOM 0 HG12 ILE A 96 39.403 44.889 -13.270 1.00 25.00 H new ATOM 0 HG13 ILE A 96 40.850 45.682 -12.679 1.00 25.00 H new ATOM 0 HG21 ILE A 96 38.167 46.547 -15.187 1.00 25.00 H new ATOM 0 HG22 ILE A 96 39.260 46.416 -16.585 1.00 25.00 H new ATOM 0 HG23 ILE A 96 38.850 44.967 -15.638 1.00 25.00 H new ATOM 0 HD11 ILE A 96 38.863 46.449 -11.446 1.00 25.00 H new ATOM 0 HD12 ILE A 96 39.579 47.794 -12.365 1.00 25.00 H new ATOM 0 HD13 ILE A 96 38.110 46.988 -12.965 1.00 25.00 H new ATOM 1515 N ARG A 97 43.891 45.212 -14.797 1.00 25.00 N ATOM 1516 CA ARG A 97 45.201 45.435 -14.169 1.00 25.00 C ATOM 1517 C ARG A 97 45.964 46.584 -14.822 1.00 25.00 C ATOM 1518 O ARG A 97 47.160 46.765 -14.603 1.00 25.00 O ATOM 1519 CB ARG A 97 46.046 44.153 -14.246 1.00 25.00 C ATOM 1520 CG ARG A 97 45.427 42.915 -13.569 1.00 25.00 C ATOM 1521 CD ARG A 97 45.358 43.015 -12.041 1.00 25.00 C ATOM 1522 NE ARG A 97 44.130 43.680 -11.569 1.00 25.00 N ATOM 1523 CZ ARG A 97 42.931 43.110 -11.476 1.00 25.00 C ATOM 1524 NH1 ARG A 97 42.706 41.869 -11.816 1.00 25.00 N ATOM 1525 NH2 ARG A 97 41.933 43.809 -11.030 1.00 25.00 N ATOM 0 H ARG A 97 43.884 44.462 -15.488 1.00 25.00 H new ATOM 0 HA ARG A 97 45.019 45.703 -13.128 1.00 25.00 H new ATOM 0 HB2 ARG A 97 46.228 43.920 -15.295 1.00 25.00 H new ATOM 0 HB3 ARG A 97 47.016 44.349 -13.790 1.00 25.00 H new ATOM 0 HG2 ARG A 97 44.421 42.764 -13.960 1.00 25.00 H new ATOM 0 HG3 ARG A 97 46.010 42.035 -13.840 1.00 25.00 H new ATOM 0 HD2 ARG A 97 45.412 42.014 -11.613 1.00 25.00 H new ATOM 0 HD3 ARG A 97 46.226 43.564 -11.677 1.00 25.00 H new ATOM 0 HE ARG A 97 44.206 44.658 -11.291 1.00 25.00 H new ATOM 0 HH11 ARG A 97 43.468 41.291 -12.171 1.00 25.00 H new ATOM 0 HH12 ARG A 97 41.768 41.478 -11.726 1.00 25.00 H new ATOM 0 HH21 ARG A 97 42.073 44.782 -10.756 1.00 25.00 H new ATOM 0 HH22 ARG A 97 41.008 43.386 -10.953 1.00 25.00 H new ATOM 1539 N GLN A 98 45.248 47.387 -15.613 1.00 25.00 N ATOM 1540 CA GLN A 98 45.742 48.612 -16.286 1.00 25.00 C ATOM 1541 C GLN A 98 46.824 48.370 -17.350 1.00 25.00 C ATOM 1542 O GLN A 98 46.726 48.797 -18.481 1.00 25.00 O ATOM 1543 CB GLN A 98 46.166 49.692 -15.256 1.00 25.00 C ATOM 1544 CG GLN A 98 46.404 51.054 -15.935 1.00 25.00 C ATOM 1545 CD GLN A 98 46.714 52.119 -14.912 1.00 25.00 C ATOM 1546 OE1 GLN A 98 47.258 51.914 -13.856 1.00 25.00 O ATOM 1547 NE2 GLN A 98 46.335 53.349 -15.225 1.00 25.00 N ATOM 1548 OXT GLN A 98 47.886 47.737 -16.940 1.00 25.00 O ATOM 0 H GLN A 98 44.266 47.202 -15.817 1.00 25.00 H new ATOM 0 HA GLN A 98 44.890 48.993 -16.849 1.00 25.00 H new ATOM 0 HB2 GLN A 98 45.393 49.794 -14.494 1.00 25.00 H new ATOM 0 HB3 GLN A 98 47.076 49.374 -14.747 1.00 25.00 H new ATOM 0 HG2 GLN A 98 47.229 50.973 -16.643 1.00 25.00 H new ATOM 0 HG3 GLN A 98 45.521 51.339 -16.507 1.00 25.00 H new ATOM 0 HE21 GLN A 98 45.874 53.529 -16.117 1.00 25.00 H new ATOM 0 HE22 GLN A 98 46.504 54.116 -14.574 1.00 25.00 H new TER 1558 GLN A 98