USER MOD reduce.3.24.130724 H: found=0, std=0, add=970, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 968 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 Single : A 1 GLY N :NH3+ -129:sc= 0.0758 (180deg=0) USER MOD Single : A 2 SER OG : rot 37:sc= 0.299 USER MOD Single : A 3 SER OG : rot 180:sc=-6.48e-05 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot 51:sc= -0.161 USER MOD Single : A 14 TYR OH : rot 30:sc= -0.526 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.219 K(o=-0.22,f=-4.3!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0.0798 K(o=0.08,f=-1.2) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 53 HIS : no HE2:sc= -5.55! C(o=-5.5!,f=-5.1!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -0.443 K(o=-0.44,f=-1.3) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 59 MET CE :methyl 153:sc= -2.52 (180deg=-4.87!) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.0399 USER MOD Single : A 61 TYR OH : rot 180:sc= -0.205 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 MET CE :methyl -121:sc= -1.08 (180deg=-5.19!) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 TYR OH : rot 180:sc= -2.37! USER MOD Single : A 72 TYR OH : rot -80:sc= 0.15 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 LYS NZ :NH3+ -172:sc= -0.206 (180deg=-0.256) USER MOD Single : A 83 GLN : amide:sc= -0.576 K(o=-0.58,f=-3.5!) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 MET CE :methyl -132:sc= -1.12 (180deg=-2.07) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.311 X(o=-0.31,f=-0.31) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.264 22.426 21.507 1.00 0.00 N ATOM 2 CA GLY A 1 -27.800 21.828 20.269 1.00 0.00 C ATOM 3 C GLY A 1 -26.310 21.552 20.280 1.00 0.00 C ATOM 4 O GLY A 1 -25.688 21.507 21.342 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.081 21.891 21.866 1.00 0.00 H new ATOM 0 H2 GLY A 1 -27.499 22.404 22.211 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.546 23.412 21.332 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -28.338 20.896 20.096 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -28.037 22.492 19.438 1.00 0.00 H new ATOM 8 N SER A 2 -25.735 21.365 19.097 1.00 0.00 N ATOM 9 CA SER A 2 -24.309 21.086 18.975 1.00 0.00 C ATOM 10 C SER A 2 -23.556 22.316 18.476 1.00 0.00 C ATOM 11 O SER A 2 -23.819 22.818 17.384 1.00 0.00 O ATOM 12 CB SER A 2 -24.077 19.911 18.023 1.00 0.00 C ATOM 13 OG SER A 2 -24.680 20.149 16.763 1.00 0.00 O ATOM 0 H SER A 2 -26.235 21.402 18.209 1.00 0.00 H new ATOM 0 HA SER A 2 -23.929 20.824 19.963 1.00 0.00 H new ATOM 0 HB2 SER A 2 -23.007 19.750 17.893 1.00 0.00 H new ATOM 0 HB3 SER A 2 -24.486 18.999 18.459 1.00 0.00 H new ATOM 0 HG SER A 2 -24.591 21.097 16.532 1.00 0.00 H new ATOM 19 N SER A 3 -22.617 22.795 19.286 1.00 0.00 N ATOM 20 CA SER A 3 -21.827 23.968 18.931 1.00 0.00 C ATOM 21 C SER A 3 -21.265 23.837 17.518 1.00 0.00 C ATOM 22 O SER A 3 -21.376 24.755 16.706 1.00 0.00 O ATOM 23 CB SER A 3 -20.685 24.163 19.930 1.00 0.00 C ATOM 24 OG SER A 3 -19.919 22.978 20.065 1.00 0.00 O ATOM 0 H SER A 3 -22.385 22.389 20.192 1.00 0.00 H new ATOM 0 HA SER A 3 -22.481 24.839 18.964 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.043 24.979 19.599 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.091 24.450 20.900 1.00 0.00 H new ATOM 0 HG SER A 3 -19.194 23.128 20.707 1.00 0.00 H new ATOM 30 N GLY A 4 -20.661 22.688 17.233 1.00 0.00 N ATOM 31 CA GLY A 4 -20.090 22.456 15.919 1.00 0.00 C ATOM 32 C GLY A 4 -19.383 21.119 15.822 1.00 0.00 C ATOM 33 O GLY A 4 -18.963 20.557 16.833 1.00 0.00 O ATOM 0 H GLY A 4 -20.557 21.913 17.888 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -20.880 22.501 15.170 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.385 23.254 15.687 1.00 0.00 H new ATOM 37 N SER A 5 -19.252 20.608 14.601 1.00 0.00 N ATOM 38 CA SER A 5 -18.595 19.326 14.377 1.00 0.00 C ATOM 39 C SER A 5 -17.482 19.459 13.341 1.00 0.00 C ATOM 40 O SER A 5 -17.738 19.474 12.137 1.00 0.00 O ATOM 41 CB SER A 5 -19.613 18.281 13.916 1.00 0.00 C ATOM 42 OG SER A 5 -20.596 18.053 14.911 1.00 0.00 O ATOM 0 H SER A 5 -19.592 21.062 13.753 1.00 0.00 H new ATOM 0 HA SER A 5 -18.154 19.003 15.320 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.093 18.617 12.997 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.101 17.347 13.685 1.00 0.00 H new ATOM 0 HG SER A 5 -21.236 17.383 14.591 1.00 0.00 H new ATOM 48 N SER A 6 -16.246 19.557 13.819 1.00 0.00 N ATOM 49 CA SER A 6 -15.093 19.693 12.936 1.00 0.00 C ATOM 50 C SER A 6 -14.841 18.399 12.168 1.00 0.00 C ATOM 51 O SER A 6 -14.674 18.410 10.949 1.00 0.00 O ATOM 52 CB SER A 6 -13.849 20.072 13.742 1.00 0.00 C ATOM 53 OG SER A 6 -12.735 20.282 12.891 1.00 0.00 O ATOM 0 H SER A 6 -16.017 19.545 14.813 1.00 0.00 H new ATOM 0 HA SER A 6 -15.307 20.485 12.218 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.046 20.976 14.318 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.621 19.282 14.457 1.00 0.00 H new ATOM 0 HG SER A 6 -11.953 20.524 13.430 1.00 0.00 H new ATOM 59 N GLY A 7 -14.815 17.284 12.892 1.00 0.00 N ATOM 60 CA GLY A 7 -14.583 15.997 12.263 1.00 0.00 C ATOM 61 C GLY A 7 -13.912 15.009 13.196 1.00 0.00 C ATOM 62 O GLY A 7 -12.718 15.123 13.477 1.00 0.00 O ATOM 0 H GLY A 7 -14.950 17.249 13.902 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.534 15.585 11.925 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.962 16.135 11.378 1.00 0.00 H new ATOM 66 N CYS A 8 -14.679 14.037 13.677 1.00 0.00 N ATOM 67 CA CYS A 8 -14.151 13.026 14.586 1.00 0.00 C ATOM 68 C CYS A 8 -13.568 11.849 13.811 1.00 0.00 C ATOM 69 O CYS A 8 -13.833 10.690 14.130 1.00 0.00 O ATOM 70 CB CYS A 8 -15.250 12.536 15.530 1.00 0.00 C ATOM 71 SG CYS A 8 -16.596 11.656 14.702 1.00 0.00 S ATOM 0 H CYS A 8 -15.668 13.928 13.453 1.00 0.00 H new ATOM 0 HA CYS A 8 -13.354 13.482 15.173 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -14.806 11.878 16.277 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -15.664 13.392 16.064 1.00 0.00 H new ATOM 0 HG CYS A 8 -16.102 10.722 13.945 1.00 0.00 H new ATOM 77 N ARG A 9 -12.773 12.155 12.790 1.00 0.00 N ATOM 78 CA ARG A 9 -12.154 11.123 11.968 1.00 0.00 C ATOM 79 C ARG A 9 -10.766 11.556 11.506 1.00 0.00 C ATOM 80 O ARG A 9 -10.625 12.490 10.715 1.00 0.00 O ATOM 81 CB ARG A 9 -13.033 10.813 10.754 1.00 0.00 C ATOM 82 CG ARG A 9 -14.427 10.332 11.120 1.00 0.00 C ATOM 83 CD ARG A 9 -14.475 8.818 11.260 1.00 0.00 C ATOM 84 NE ARG A 9 -14.215 8.142 9.992 1.00 0.00 N ATOM 85 CZ ARG A 9 -14.624 6.908 9.720 1.00 0.00 C ATOM 86 NH1 ARG A 9 -15.308 6.218 10.622 1.00 0.00 N ATOM 87 NH2 ARG A 9 -14.349 6.361 8.542 1.00 0.00 N ATOM 0 H ARG A 9 -12.543 13.109 12.513 1.00 0.00 H new ATOM 0 HA ARG A 9 -12.052 10.223 12.574 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -13.117 11.708 10.138 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -12.543 10.053 10.146 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -14.739 10.795 12.056 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -15.135 10.650 10.355 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -13.739 8.499 11.998 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -15.454 8.520 11.636 1.00 0.00 H new ATOM 0 HE ARG A 9 -13.691 8.645 9.276 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -15.522 6.635 11.528 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -15.621 5.271 10.410 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -13.823 6.888 7.845 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -14.663 5.413 8.334 1.00 0.00 H new ATOM 101 N LEU A 10 -9.742 10.872 12.005 1.00 0.00 N ATOM 102 CA LEU A 10 -8.364 11.185 11.645 1.00 0.00 C ATOM 103 C LEU A 10 -7.905 10.340 10.460 1.00 0.00 C ATOM 104 O LEU A 10 -8.585 9.395 10.058 1.00 0.00 O ATOM 105 CB LEU A 10 -7.438 10.953 12.840 1.00 0.00 C ATOM 106 CG LEU A 10 -7.636 11.888 14.034 1.00 0.00 C ATOM 107 CD1 LEU A 10 -8.779 11.400 14.910 1.00 0.00 C ATOM 108 CD2 LEU A 10 -6.352 12.000 14.842 1.00 0.00 C ATOM 0 H LEU A 10 -9.840 10.097 12.660 1.00 0.00 H new ATOM 0 HA LEU A 10 -8.320 12.236 11.358 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.570 9.926 13.182 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -6.407 11.046 12.499 1.00 0.00 H new ATOM 0 HG LEU A 10 -7.892 12.878 13.657 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.905 12.078 15.754 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -9.699 11.373 14.326 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.553 10.399 15.278 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.511 12.669 15.688 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.066 11.014 15.208 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.558 12.397 14.210 1.00 0.00 H new ATOM 120 N LEU A 11 -6.748 10.685 9.908 1.00 0.00 N ATOM 121 CA LEU A 11 -6.196 9.957 8.770 1.00 0.00 C ATOM 122 C LEU A 11 -5.598 8.626 9.214 1.00 0.00 C ATOM 123 O LEU A 11 -6.163 7.564 8.954 1.00 0.00 O ATOM 124 CB LEU A 11 -5.129 10.800 8.069 1.00 0.00 C ATOM 125 CG LEU A 11 -4.195 10.047 7.120 1.00 0.00 C ATOM 126 CD1 LEU A 11 -4.997 9.280 6.080 1.00 0.00 C ATOM 127 CD2 LEU A 11 -3.229 11.011 6.447 1.00 0.00 C ATOM 0 H LEU A 11 -6.173 11.464 10.229 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.008 9.755 8.071 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.629 11.588 7.505 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.523 11.289 8.831 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.615 9.331 7.703 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -4.316 8.750 5.414 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.648 8.562 6.579 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.603 9.977 5.501 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.572 10.458 5.775 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.791 11.751 5.877 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -2.631 11.516 7.206 1.00 0.00 H new ATOM 139 N TRP A 12 -4.454 8.692 9.885 1.00 0.00 N ATOM 140 CA TRP A 12 -3.781 7.491 10.367 1.00 0.00 C ATOM 141 C TRP A 12 -4.792 6.429 10.781 1.00 0.00 C ATOM 142 O TRP A 12 -4.555 5.233 10.611 1.00 0.00 O ATOM 143 CB TRP A 12 -2.869 7.832 11.547 1.00 0.00 C ATOM 144 CG TRP A 12 -3.597 7.922 12.854 1.00 0.00 C ATOM 145 CD1 TRP A 12 -4.276 9.002 13.341 1.00 0.00 C ATOM 146 CD2 TRP A 12 -3.717 6.891 13.841 1.00 0.00 C ATOM 147 NE1 TRP A 12 -4.811 8.705 14.571 1.00 0.00 N ATOM 148 CE2 TRP A 12 -4.483 7.416 14.900 1.00 0.00 C ATOM 149 CE3 TRP A 12 -3.253 5.576 13.932 1.00 0.00 C ATOM 150 CZ2 TRP A 12 -4.793 6.671 16.034 1.00 0.00 C ATOM 151 CZ3 TRP A 12 -3.562 4.838 15.058 1.00 0.00 C ATOM 152 CH2 TRP A 12 -4.326 5.386 16.097 1.00 0.00 C ATOM 0 H TRP A 12 -3.973 9.564 10.108 1.00 0.00 H new ATOM 0 HA TRP A 12 -3.177 7.092 9.552 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -2.089 7.074 11.625 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -2.372 8.782 11.350 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -4.378 9.950 12.834 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -5.363 9.341 15.146 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -2.664 5.145 13.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -5.381 7.092 16.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -3.209 3.821 15.139 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -4.551 4.783 16.964 1.00 0.00 H new ATOM 163 N ASP A 13 -5.921 6.872 11.324 1.00 0.00 N ATOM 164 CA ASP A 13 -6.970 5.958 11.761 1.00 0.00 C ATOM 165 C ASP A 13 -7.745 5.410 10.567 1.00 0.00 C ATOM 166 O ASP A 13 -7.983 4.206 10.468 1.00 0.00 O ATOM 167 CB ASP A 13 -7.925 6.666 12.723 1.00 0.00 C ATOM 168 CG ASP A 13 -9.066 5.773 13.169 1.00 0.00 C ATOM 169 OD1 ASP A 13 -8.871 4.540 13.216 1.00 0.00 O ATOM 170 OD2 ASP A 13 -10.153 6.307 13.471 1.00 0.00 O ATOM 0 H ASP A 13 -6.133 7.859 11.472 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.498 5.123 12.279 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -7.370 7.005 13.598 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -8.331 7.554 12.239 1.00 0.00 H new ATOM 175 N TYR A 14 -8.137 6.301 9.663 1.00 0.00 N ATOM 176 CA TYR A 14 -8.888 5.907 8.477 1.00 0.00 C ATOM 177 C TYR A 14 -8.323 4.624 7.875 1.00 0.00 C ATOM 178 O TYR A 14 -9.025 3.887 7.183 1.00 0.00 O ATOM 179 CB TYR A 14 -8.863 7.027 7.436 1.00 0.00 C ATOM 180 CG TYR A 14 -9.094 6.544 6.022 1.00 0.00 C ATOM 181 CD1 TYR A 14 -10.381 6.393 5.520 1.00 0.00 C ATOM 182 CD2 TYR A 14 -8.026 6.239 5.187 1.00 0.00 C ATOM 183 CE1 TYR A 14 -10.597 5.952 4.229 1.00 0.00 C ATOM 184 CE2 TYR A 14 -8.233 5.798 3.895 1.00 0.00 C ATOM 185 CZ TYR A 14 -9.520 5.657 3.420 1.00 0.00 C ATOM 186 OH TYR A 14 -9.730 5.217 2.133 1.00 0.00 O ATOM 0 H TYR A 14 -7.947 7.301 9.729 1.00 0.00 H new ATOM 0 HA TYR A 14 -9.920 5.722 8.777 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -9.626 7.764 7.689 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -7.900 7.536 7.485 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.227 6.624 6.150 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -7.017 6.349 5.555 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.604 5.839 3.855 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -7.391 5.565 3.260 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.564 5.599 1.789 1.00 0.00 H new ATOM 196 N VAL A 15 -7.047 4.364 8.144 1.00 0.00 N ATOM 197 CA VAL A 15 -6.386 3.170 7.632 1.00 0.00 C ATOM 198 C VAL A 15 -7.149 1.909 8.021 1.00 0.00 C ATOM 199 O VAL A 15 -7.702 1.217 7.166 1.00 0.00 O ATOM 200 CB VAL A 15 -4.940 3.063 8.151 1.00 0.00 C ATOM 201 CG1 VAL A 15 -4.262 1.822 7.591 1.00 0.00 C ATOM 202 CG2 VAL A 15 -4.153 4.316 7.798 1.00 0.00 C ATOM 0 H VAL A 15 -6.451 4.965 8.714 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.369 3.259 6.546 1.00 0.00 H new ATOM 0 HB VAL A 15 -4.968 2.973 9.237 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.241 1.763 7.969 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.815 0.935 7.900 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.243 1.877 6.503 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -3.134 4.223 8.172 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.132 4.439 6.715 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.629 5.185 8.253 1.00 0.00 H new ATOM 212 N TYR A 16 -7.175 1.617 9.316 1.00 0.00 N ATOM 213 CA TYR A 16 -7.869 0.437 9.819 1.00 0.00 C ATOM 214 C TYR A 16 -9.153 0.184 9.034 1.00 0.00 C ATOM 215 O TYR A 16 -9.336 -0.885 8.453 1.00 0.00 O ATOM 216 CB TYR A 16 -8.192 0.604 11.305 1.00 0.00 C ATOM 217 CG TYR A 16 -8.299 -0.706 12.053 1.00 0.00 C ATOM 218 CD1 TYR A 16 -7.181 -1.504 12.260 1.00 0.00 C ATOM 219 CD2 TYR A 16 -9.519 -1.146 12.551 1.00 0.00 C ATOM 220 CE1 TYR A 16 -7.274 -2.702 12.941 1.00 0.00 C ATOM 221 CE2 TYR A 16 -9.622 -2.342 13.235 1.00 0.00 C ATOM 222 CZ TYR A 16 -8.497 -3.116 13.427 1.00 0.00 C ATOM 223 OH TYR A 16 -8.595 -4.309 14.107 1.00 0.00 O ATOM 0 H TYR A 16 -6.724 2.181 10.037 1.00 0.00 H new ATOM 0 HA TYR A 16 -7.211 -0.422 9.691 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -7.419 1.216 11.770 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -9.131 1.148 11.405 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -6.222 -1.182 11.882 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -10.402 -0.543 12.401 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -6.395 -3.311 13.092 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -10.578 -2.669 13.617 1.00 0.00 H new ATOM 0 HH TYR A 16 -9.524 -4.453 14.383 1.00 0.00 H new ATOM 233 N GLN A 17 -10.037 1.176 9.023 1.00 0.00 N ATOM 234 CA GLN A 17 -11.304 1.061 8.310 1.00 0.00 C ATOM 235 C GLN A 17 -11.137 0.249 7.031 1.00 0.00 C ATOM 236 O GLN A 17 -11.968 -0.602 6.710 1.00 0.00 O ATOM 237 CB GLN A 17 -11.854 2.450 7.978 1.00 0.00 C ATOM 238 CG GLN A 17 -13.371 2.532 8.032 1.00 0.00 C ATOM 239 CD GLN A 17 -14.018 2.256 6.690 1.00 0.00 C ATOM 240 OE1 GLN A 17 -13.377 1.744 5.772 1.00 0.00 O ATOM 241 NE2 GLN A 17 -15.297 2.593 6.569 1.00 0.00 N ATOM 0 H GLN A 17 -9.900 2.068 9.499 1.00 0.00 H new ATOM 0 HA GLN A 17 -12.011 0.543 8.958 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -11.434 3.174 8.676 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -11.518 2.736 6.981 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -13.744 1.816 8.765 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -13.665 3.523 8.376 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.790 3.015 7.356 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -15.786 2.430 5.689 1.00 0.00 H new ATOM 250 N LEU A 18 -10.058 0.516 6.303 1.00 0.00 N ATOM 251 CA LEU A 18 -9.782 -0.191 5.057 1.00 0.00 C ATOM 252 C LEU A 18 -9.315 -1.617 5.332 1.00 0.00 C ATOM 253 O LEU A 18 -9.901 -2.580 4.836 1.00 0.00 O ATOM 254 CB LEU A 18 -8.721 0.557 4.247 1.00 0.00 C ATOM 255 CG LEU A 18 -9.094 1.970 3.796 1.00 0.00 C ATOM 256 CD1 LEU A 18 -7.897 2.663 3.164 1.00 0.00 C ATOM 257 CD2 LEU A 18 -10.263 1.928 2.823 1.00 0.00 C ATOM 0 H LEU A 18 -9.360 1.217 6.554 1.00 0.00 H new ATOM 0 HA LEU A 18 -10.706 -0.235 4.481 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -7.811 0.616 4.844 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -8.484 -0.034 3.363 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.397 2.542 4.673 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.182 3.667 2.849 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.088 2.727 3.891 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.562 2.093 2.298 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.515 2.942 2.513 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.987 1.339 1.948 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.126 1.473 3.310 1.00 0.00 H new ATOM 269 N LEU A 19 -8.258 -1.745 6.126 1.00 0.00 N ATOM 270 CA LEU A 19 -7.714 -3.054 6.470 1.00 0.00 C ATOM 271 C LEU A 19 -8.832 -4.048 6.768 1.00 0.00 C ATOM 272 O LEU A 19 -8.888 -5.129 6.181 1.00 0.00 O ATOM 273 CB LEU A 19 -6.782 -2.940 7.678 1.00 0.00 C ATOM 274 CG LEU A 19 -5.305 -2.701 7.366 1.00 0.00 C ATOM 275 CD1 LEU A 19 -4.839 -3.622 6.249 1.00 0.00 C ATOM 276 CD2 LEU A 19 -5.067 -1.245 6.992 1.00 0.00 C ATOM 0 H LEU A 19 -7.761 -0.959 6.544 1.00 0.00 H new ATOM 0 HA LEU A 19 -7.147 -3.420 5.614 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.136 -2.125 8.309 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.865 -3.856 8.264 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.724 -2.925 8.261 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.785 -3.437 6.041 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.972 -4.660 6.554 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.425 -3.430 5.350 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.010 -1.094 6.773 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.659 -0.994 6.112 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.361 -0.603 7.823 1.00 0.00 H new ATOM 288 N SER A 20 -9.721 -3.674 7.682 1.00 0.00 N ATOM 289 CA SER A 20 -10.837 -4.533 8.060 1.00 0.00 C ATOM 290 C SER A 20 -11.566 -5.051 6.823 1.00 0.00 C ATOM 291 O SER A 20 -11.909 -6.231 6.741 1.00 0.00 O ATOM 292 CB SER A 20 -11.813 -3.771 8.959 1.00 0.00 C ATOM 293 OG SER A 20 -11.410 -3.832 10.316 1.00 0.00 O ATOM 0 H SER A 20 -9.690 -2.781 8.175 1.00 0.00 H new ATOM 0 HA SER A 20 -10.438 -5.385 8.610 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.870 -2.730 8.640 1.00 0.00 H new ATOM 0 HB3 SER A 20 -12.813 -4.192 8.854 1.00 0.00 H new ATOM 0 HG SER A 20 -12.049 -3.336 10.870 1.00 0.00 H new ATOM 299 N ASP A 21 -11.799 -4.161 5.865 1.00 0.00 N ATOM 300 CA ASP A 21 -12.485 -4.527 4.632 1.00 0.00 C ATOM 301 C ASP A 21 -11.515 -5.153 3.635 1.00 0.00 C ATOM 302 O ASP A 21 -10.678 -4.463 3.051 1.00 0.00 O ATOM 303 CB ASP A 21 -13.153 -3.299 4.011 1.00 0.00 C ATOM 304 CG ASP A 21 -13.806 -2.408 5.049 1.00 0.00 C ATOM 305 OD1 ASP A 21 -14.229 -2.933 6.101 1.00 0.00 O ATOM 306 OD2 ASP A 21 -13.892 -1.186 4.811 1.00 0.00 O ATOM 0 H ASP A 21 -11.523 -3.181 5.919 1.00 0.00 H new ATOM 0 HA ASP A 21 -13.251 -5.263 4.876 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -12.409 -2.724 3.459 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.904 -3.623 3.290 1.00 0.00 H new ATOM 311 N SER A 22 -11.632 -6.463 3.445 1.00 0.00 N ATOM 312 CA SER A 22 -10.762 -7.182 2.522 1.00 0.00 C ATOM 313 C SER A 22 -10.897 -6.630 1.106 1.00 0.00 C ATOM 314 O SER A 22 -9.926 -6.587 0.349 1.00 0.00 O ATOM 315 CB SER A 22 -11.094 -8.676 2.533 1.00 0.00 C ATOM 316 OG SER A 22 -11.058 -9.196 3.851 1.00 0.00 O ATOM 0 H SER A 22 -12.321 -7.048 3.918 1.00 0.00 H new ATOM 0 HA SER A 22 -9.732 -7.044 2.851 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.083 -8.835 2.103 1.00 0.00 H new ATOM 0 HB3 SER A 22 -10.383 -9.215 1.906 1.00 0.00 H new ATOM 0 HG SER A 22 -11.275 -10.151 3.832 1.00 0.00 H new ATOM 322 N ARG A 23 -12.107 -6.209 0.755 1.00 0.00 N ATOM 323 CA ARG A 23 -12.371 -5.661 -0.570 1.00 0.00 C ATOM 324 C ARG A 23 -11.327 -4.613 -0.943 1.00 0.00 C ATOM 325 O ARG A 23 -11.124 -4.315 -2.120 1.00 0.00 O ATOM 326 CB ARG A 23 -13.770 -5.044 -0.621 1.00 0.00 C ATOM 327 CG ARG A 23 -14.890 -6.070 -0.592 1.00 0.00 C ATOM 328 CD ARG A 23 -16.233 -5.422 -0.294 1.00 0.00 C ATOM 329 NE ARG A 23 -17.344 -6.349 -0.490 1.00 0.00 N ATOM 330 CZ ARG A 23 -17.738 -6.782 -1.682 1.00 0.00 C ATOM 331 NH1 ARG A 23 -17.113 -6.375 -2.779 1.00 0.00 N ATOM 332 NH2 ARG A 23 -18.758 -7.625 -1.779 1.00 0.00 N ATOM 0 H ARG A 23 -12.921 -6.237 1.370 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.315 -6.477 -1.291 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -13.889 -4.365 0.223 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -13.861 -4.445 -1.527 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.938 -6.584 -1.552 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.674 -6.825 0.164 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.240 -5.060 0.734 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.367 -4.554 -0.939 1.00 0.00 H new ATOM 0 HE ARG A 23 -17.845 -6.682 0.334 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -16.328 -5.728 -2.708 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -17.418 -6.709 -3.693 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -19.240 -7.941 -0.938 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.060 -7.957 -2.695 1.00 0.00 H new ATOM 346 N TYR A 24 -10.668 -4.056 0.068 1.00 0.00 N ATOM 347 CA TYR A 24 -9.647 -3.039 -0.153 1.00 0.00 C ATOM 348 C TYR A 24 -8.250 -3.618 0.046 1.00 0.00 C ATOM 349 O TYR A 24 -7.338 -2.925 0.497 1.00 0.00 O ATOM 350 CB TYR A 24 -9.862 -1.858 0.795 1.00 0.00 C ATOM 351 CG TYR A 24 -11.220 -1.209 0.656 1.00 0.00 C ATOM 352 CD1 TYR A 24 -12.373 -1.872 1.059 1.00 0.00 C ATOM 353 CD2 TYR A 24 -11.352 0.067 0.122 1.00 0.00 C ATOM 354 CE1 TYR A 24 -13.617 -1.284 0.934 1.00 0.00 C ATOM 355 CE2 TYR A 24 -12.591 0.663 -0.006 1.00 0.00 C ATOM 356 CZ TYR A 24 -13.720 -0.016 0.401 1.00 0.00 C ATOM 357 OH TYR A 24 -14.957 0.575 0.274 1.00 0.00 O ATOM 0 H TYR A 24 -10.823 -4.292 1.048 1.00 0.00 H new ATOM 0 HA TYR A 24 -9.733 -2.691 -1.182 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.736 -2.200 1.822 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -9.091 -1.110 0.611 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -12.295 -2.865 1.477 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -10.470 0.602 -0.199 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -14.503 -1.814 1.252 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -12.675 1.656 -0.423 1.00 0.00 H new ATOM 0 HH TYR A 24 -14.855 1.467 -0.118 1.00 0.00 H new ATOM 367 N GLU A 25 -8.090 -4.893 -0.295 1.00 0.00 N ATOM 368 CA GLU A 25 -6.804 -5.565 -0.154 1.00 0.00 C ATOM 369 C GLU A 25 -5.818 -5.080 -1.213 1.00 0.00 C ATOM 370 O GLU A 25 -4.639 -4.872 -0.929 1.00 0.00 O ATOM 371 CB GLU A 25 -6.982 -7.081 -0.263 1.00 0.00 C ATOM 372 CG GLU A 25 -7.260 -7.759 1.068 1.00 0.00 C ATOM 373 CD GLU A 25 -7.599 -9.229 0.915 1.00 0.00 C ATOM 374 OE1 GLU A 25 -8.682 -9.534 0.373 1.00 0.00 O ATOM 375 OE2 GLU A 25 -6.783 -10.074 1.337 1.00 0.00 O ATOM 0 H GLU A 25 -8.834 -5.481 -0.671 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.402 -5.323 0.830 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.803 -7.294 -0.948 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.082 -7.513 -0.700 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -6.387 -7.657 1.713 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.085 -7.250 1.565 1.00 0.00 H new ATOM 382 N ASN A 26 -6.310 -4.903 -2.435 1.00 0.00 N ATOM 383 CA ASN A 26 -5.472 -4.444 -3.537 1.00 0.00 C ATOM 384 C ASN A 26 -4.887 -3.067 -3.238 1.00 0.00 C ATOM 385 O ASN A 26 -3.771 -2.752 -3.652 1.00 0.00 O ATOM 386 CB ASN A 26 -6.282 -4.396 -4.834 1.00 0.00 C ATOM 387 CG ASN A 26 -7.003 -5.700 -5.114 1.00 0.00 C ATOM 388 OD1 ASN A 26 -8.053 -5.979 -4.535 1.00 0.00 O ATOM 389 ND2 ASN A 26 -6.441 -6.507 -6.007 1.00 0.00 N ATOM 0 H ASN A 26 -7.284 -5.070 -2.687 1.00 0.00 H new ATOM 0 HA ASN A 26 -4.650 -5.150 -3.655 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.010 -3.587 -4.775 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -5.617 -4.166 -5.666 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.881 -7.398 -6.237 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.570 -6.235 -6.463 1.00 0.00 H new ATOM 396 N PHE A 27 -5.647 -2.251 -2.516 1.00 0.00 N ATOM 397 CA PHE A 27 -5.205 -0.908 -2.161 1.00 0.00 C ATOM 398 C PHE A 27 -4.294 -0.940 -0.938 1.00 0.00 C ATOM 399 O PHE A 27 -3.282 -0.241 -0.886 1.00 0.00 O ATOM 400 CB PHE A 27 -6.411 -0.006 -1.890 1.00 0.00 C ATOM 401 CG PHE A 27 -7.198 0.330 -3.124 1.00 0.00 C ATOM 402 CD1 PHE A 27 -6.586 0.933 -4.210 1.00 0.00 C ATOM 403 CD2 PHE A 27 -8.552 0.042 -3.198 1.00 0.00 C ATOM 404 CE1 PHE A 27 -7.308 1.243 -5.348 1.00 0.00 C ATOM 405 CE2 PHE A 27 -9.279 0.349 -4.332 1.00 0.00 C ATOM 406 CZ PHE A 27 -8.656 0.951 -5.408 1.00 0.00 C ATOM 0 H PHE A 27 -6.573 -2.497 -2.165 1.00 0.00 H new ATOM 0 HA PHE A 27 -4.640 -0.505 -3.002 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -7.068 -0.497 -1.172 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -6.066 0.918 -1.426 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -5.532 1.164 -4.168 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -9.044 -0.428 -2.359 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.818 1.713 -6.188 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -10.333 0.119 -4.377 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.223 1.193 -6.295 1.00 0.00 H new ATOM 416 N ILE A 28 -4.662 -1.756 0.044 1.00 0.00 N ATOM 417 CA ILE A 28 -3.878 -1.880 1.267 1.00 0.00 C ATOM 418 C ILE A 28 -4.235 -3.157 2.021 1.00 0.00 C ATOM 419 O ILE A 28 -5.407 -3.433 2.276 1.00 0.00 O ATOM 420 CB ILE A 28 -4.091 -0.672 2.198 1.00 0.00 C ATOM 421 CG1 ILE A 28 -3.219 -0.803 3.448 1.00 0.00 C ATOM 422 CG2 ILE A 28 -5.559 -0.549 2.579 1.00 0.00 C ATOM 423 CD1 ILE A 28 -3.055 0.494 4.209 1.00 0.00 C ATOM 0 H ILE A 28 -5.497 -2.341 0.017 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.831 -1.917 0.968 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.797 0.233 1.667 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -3.657 -1.550 4.110 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -2.235 -1.171 3.158 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -5.693 0.309 3.237 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -6.158 -0.413 1.679 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -5.878 -1.455 3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -2.425 0.326 5.083 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.589 1.238 3.563 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -4.033 0.854 4.530 1.00 0.00 H new ATOM 435 N ARG A 29 -3.215 -3.932 2.377 1.00 0.00 N ATOM 436 CA ARG A 29 -3.421 -5.179 3.103 1.00 0.00 C ATOM 437 C ARG A 29 -2.471 -5.279 4.293 1.00 0.00 C ATOM 438 O ARG A 29 -1.575 -4.451 4.455 1.00 0.00 O ATOM 439 CB ARG A 29 -3.216 -6.376 2.172 1.00 0.00 C ATOM 440 CG ARG A 29 -1.787 -6.524 1.676 1.00 0.00 C ATOM 441 CD ARG A 29 -1.564 -5.758 0.382 1.00 0.00 C ATOM 442 NE ARG A 29 -0.435 -6.286 -0.380 1.00 0.00 N ATOM 443 CZ ARG A 29 -0.432 -7.484 -0.954 1.00 0.00 C ATOM 444 NH1 ARG A 29 -1.493 -8.273 -0.854 1.00 0.00 N ATOM 445 NH2 ARG A 29 0.633 -7.894 -1.630 1.00 0.00 N ATOM 0 H ARG A 29 -2.239 -3.718 2.174 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.445 -5.188 3.476 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.506 -7.287 2.696 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -3.881 -6.276 1.314 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.097 -6.162 2.438 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -1.563 -7.579 1.519 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -2.466 -5.806 -0.227 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.388 -4.707 0.609 1.00 0.00 H new ATOM 0 HE ARG A 29 0.396 -5.703 -0.477 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -2.314 -7.960 -0.335 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -1.488 -9.192 -1.296 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.451 -7.289 -1.709 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.634 -8.814 -2.070 1.00 0.00 H new ATOM 459 N TRP A 30 -2.673 -6.297 5.121 1.00 0.00 N ATOM 460 CA TRP A 30 -1.835 -6.505 6.296 1.00 0.00 C ATOM 461 C TRP A 30 -0.539 -7.215 5.922 1.00 0.00 C ATOM 462 O TRP A 30 -0.554 -8.373 5.505 1.00 0.00 O ATOM 463 CB TRP A 30 -2.590 -7.317 7.350 1.00 0.00 C ATOM 464 CG TRP A 30 -3.540 -6.493 8.166 1.00 0.00 C ATOM 465 CD1 TRP A 30 -4.896 -6.635 8.236 1.00 0.00 C ATOM 466 CD2 TRP A 30 -3.204 -5.399 9.027 1.00 0.00 C ATOM 467 NE1 TRP A 30 -5.424 -5.695 9.088 1.00 0.00 N ATOM 468 CE2 TRP A 30 -4.406 -4.925 9.587 1.00 0.00 C ATOM 469 CE3 TRP A 30 -2.004 -4.776 9.381 1.00 0.00 C ATOM 470 CZ2 TRP A 30 -4.441 -3.857 10.479 1.00 0.00 C ATOM 471 CZ3 TRP A 30 -2.040 -3.715 10.266 1.00 0.00 C ATOM 472 CH2 TRP A 30 -3.252 -3.265 10.808 1.00 0.00 C ATOM 0 H TRP A 30 -3.410 -6.992 5.001 1.00 0.00 H new ATOM 0 HA TRP A 30 -1.586 -5.528 6.710 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -3.144 -8.115 6.855 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -1.870 -7.794 8.015 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -5.469 -7.377 7.700 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -6.413 -5.588 9.313 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -1.065 -5.118 8.970 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -5.374 -3.508 10.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -1.119 -3.224 10.545 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -3.247 -2.435 11.499 1.00 0.00 H new ATOM 483 N GLU A 31 0.580 -6.515 6.074 1.00 0.00 N ATOM 484 CA GLU A 31 1.885 -7.080 5.751 1.00 0.00 C ATOM 485 C GLU A 31 2.286 -8.142 6.771 1.00 0.00 C ATOM 486 O GLU A 31 2.505 -9.302 6.422 1.00 0.00 O ATOM 487 CB GLU A 31 2.945 -5.978 5.701 1.00 0.00 C ATOM 488 CG GLU A 31 3.109 -5.353 4.326 1.00 0.00 C ATOM 489 CD GLU A 31 3.770 -6.289 3.334 1.00 0.00 C ATOM 490 OE1 GLU A 31 3.194 -7.362 3.057 1.00 0.00 O ATOM 491 OE2 GLU A 31 4.863 -5.950 2.834 1.00 0.00 O ATOM 0 H GLU A 31 0.609 -5.556 6.419 1.00 0.00 H new ATOM 0 HA GLU A 31 1.816 -7.551 4.771 1.00 0.00 H new ATOM 0 HB2 GLU A 31 2.681 -5.199 6.416 1.00 0.00 H new ATOM 0 HB3 GLU A 31 3.902 -6.391 6.019 1.00 0.00 H new ATOM 0 HG2 GLU A 31 2.131 -5.059 3.946 1.00 0.00 H new ATOM 0 HG3 GLU A 31 3.704 -4.444 4.413 1.00 0.00 H new ATOM 498 N ASP A 32 2.380 -7.735 8.032 1.00 0.00 N ATOM 499 CA ASP A 32 2.754 -8.651 9.104 1.00 0.00 C ATOM 500 C ASP A 32 1.845 -8.469 10.316 1.00 0.00 C ATOM 501 O ASP A 32 2.262 -7.937 11.345 1.00 0.00 O ATOM 502 CB ASP A 32 4.212 -8.428 9.508 1.00 0.00 C ATOM 503 CG ASP A 32 5.184 -9.126 8.576 1.00 0.00 C ATOM 504 OD1 ASP A 32 5.198 -8.790 7.373 1.00 0.00 O ATOM 505 OD2 ASP A 32 5.930 -10.008 9.050 1.00 0.00 O ATOM 0 H ASP A 32 2.203 -6.778 8.337 1.00 0.00 H new ATOM 0 HA ASP A 32 2.638 -9.670 8.735 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.424 -7.359 9.516 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.364 -8.791 10.525 1.00 0.00 H new ATOM 510 N LYS A 33 0.599 -8.913 10.186 1.00 0.00 N ATOM 511 CA LYS A 33 -0.370 -8.801 11.269 1.00 0.00 C ATOM 512 C LYS A 33 0.282 -9.096 12.616 1.00 0.00 C ATOM 513 O LYS A 33 -0.139 -8.572 13.647 1.00 0.00 O ATOM 514 CB LYS A 33 -1.540 -9.760 11.036 1.00 0.00 C ATOM 515 CG LYS A 33 -2.616 -9.196 10.123 1.00 0.00 C ATOM 516 CD LYS A 33 -3.986 -9.755 10.466 1.00 0.00 C ATOM 517 CE LYS A 33 -4.946 -9.637 9.291 1.00 0.00 C ATOM 518 NZ LYS A 33 -6.007 -10.680 9.335 1.00 0.00 N ATOM 0 H LYS A 33 0.237 -9.354 9.341 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.744 -7.777 11.283 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -1.159 -10.687 10.606 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -1.987 -10.015 11.997 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.634 -8.109 10.208 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -2.375 -9.431 9.086 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.891 -10.801 10.756 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.393 -9.222 11.325 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.407 -8.649 9.297 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.390 -9.724 8.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.640 -10.566 8.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.569 -11.623 9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.554 -10.582 10.214 1.00 0.00 H new ATOM 532 N GLU A 34 1.311 -9.937 12.599 1.00 0.00 N ATOM 533 CA GLU A 34 2.021 -10.300 13.820 1.00 0.00 C ATOM 534 C GLU A 34 2.247 -9.076 14.702 1.00 0.00 C ATOM 535 O GLU A 34 1.999 -9.111 15.907 1.00 0.00 O ATOM 536 CB GLU A 34 3.362 -10.954 13.481 1.00 0.00 C ATOM 537 CG GLU A 34 3.226 -12.282 12.756 1.00 0.00 C ATOM 538 CD GLU A 34 4.565 -12.856 12.335 1.00 0.00 C ATOM 539 OE1 GLU A 34 5.491 -12.064 12.064 1.00 0.00 O ATOM 540 OE2 GLU A 34 4.686 -14.098 12.276 1.00 0.00 O ATOM 0 H GLU A 34 1.672 -10.380 11.754 1.00 0.00 H new ATOM 0 HA GLU A 34 1.406 -11.013 14.369 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.944 -10.270 12.863 1.00 0.00 H new ATOM 0 HB3 GLU A 34 3.924 -11.108 14.402 1.00 0.00 H new ATOM 0 HG2 GLU A 34 2.717 -12.995 13.404 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.599 -12.148 11.875 1.00 0.00 H new ATOM 547 N SER A 35 2.721 -7.994 14.092 1.00 0.00 N ATOM 548 CA SER A 35 2.986 -6.759 14.822 1.00 0.00 C ATOM 549 C SER A 35 2.101 -5.626 14.311 1.00 0.00 C ATOM 550 O SER A 35 2.412 -4.449 14.495 1.00 0.00 O ATOM 551 CB SER A 35 4.459 -6.370 14.690 1.00 0.00 C ATOM 552 OG SER A 35 5.236 -6.954 15.721 1.00 0.00 O ATOM 0 H SER A 35 2.929 -7.947 13.095 1.00 0.00 H new ATOM 0 HA SER A 35 2.756 -6.931 15.874 1.00 0.00 H new ATOM 0 HB2 SER A 35 4.837 -6.691 13.719 1.00 0.00 H new ATOM 0 HB3 SER A 35 4.556 -5.285 14.727 1.00 0.00 H new ATOM 0 HG SER A 35 6.174 -6.691 15.613 1.00 0.00 H new ATOM 558 N LYS A 36 0.996 -5.990 13.669 1.00 0.00 N ATOM 559 CA LYS A 36 0.064 -5.006 13.132 1.00 0.00 C ATOM 560 C LYS A 36 0.752 -4.104 12.112 1.00 0.00 C ATOM 561 O LYS A 36 0.632 -2.880 12.172 1.00 0.00 O ATOM 562 CB LYS A 36 -0.524 -4.160 14.263 1.00 0.00 C ATOM 563 CG LYS A 36 -1.668 -4.836 14.998 1.00 0.00 C ATOM 564 CD LYS A 36 -2.150 -3.999 16.171 1.00 0.00 C ATOM 565 CE LYS A 36 -1.188 -4.079 17.346 1.00 0.00 C ATOM 566 NZ LYS A 36 -1.350 -5.346 18.111 1.00 0.00 N ATOM 0 H LYS A 36 0.724 -6.960 13.508 1.00 0.00 H new ATOM 0 HA LYS A 36 -0.742 -5.542 12.631 1.00 0.00 H new ATOM 0 HB2 LYS A 36 0.265 -3.924 14.976 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -0.876 -3.214 13.852 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.494 -5.007 14.308 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.344 -5.813 15.356 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.258 -2.960 15.858 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.136 -4.342 16.483 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.163 -4.003 16.982 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.354 -3.230 18.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.676 -5.362 18.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.320 -5.407 18.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.166 -6.156 17.485 1.00 0.00 H new ATOM 580 N ILE A 37 1.470 -4.717 11.177 1.00 0.00 N ATOM 581 CA ILE A 37 2.175 -3.968 10.144 1.00 0.00 C ATOM 582 C ILE A 37 1.391 -3.968 8.835 1.00 0.00 C ATOM 583 O ILE A 37 1.036 -5.024 8.312 1.00 0.00 O ATOM 584 CB ILE A 37 3.579 -4.547 9.888 1.00 0.00 C ATOM 585 CG1 ILE A 37 4.461 -4.368 11.125 1.00 0.00 C ATOM 586 CG2 ILE A 37 4.214 -3.879 8.677 1.00 0.00 C ATOM 587 CD1 ILE A 37 5.708 -5.224 11.107 1.00 0.00 C ATOM 0 H ILE A 37 1.579 -5.729 11.113 1.00 0.00 H new ATOM 0 HA ILE A 37 2.274 -2.945 10.507 1.00 0.00 H new ATOM 0 HB ILE A 37 3.485 -5.613 9.683 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.750 -3.320 11.206 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.878 -4.608 12.014 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.206 -4.298 8.508 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.593 -4.052 7.798 1.00 0.00 H new ATOM 0 HG23 ILE A 37 4.299 -2.807 8.856 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.285 -5.045 12.014 1.00 0.00 H new ATOM 0 HD12 ILE A 37 5.427 -6.276 11.057 1.00 0.00 H new ATOM 0 HD13 ILE A 37 6.312 -4.968 10.237 1.00 0.00 H new ATOM 599 N PHE A 38 1.127 -2.776 8.311 1.00 0.00 N ATOM 600 CA PHE A 38 0.386 -2.637 7.062 1.00 0.00 C ATOM 601 C PHE A 38 1.249 -1.980 5.988 1.00 0.00 C ATOM 602 O PHE A 38 2.336 -1.477 6.272 1.00 0.00 O ATOM 603 CB PHE A 38 -0.884 -1.813 7.287 1.00 0.00 C ATOM 604 CG PHE A 38 -0.631 -0.492 7.954 1.00 0.00 C ATOM 605 CD1 PHE A 38 -0.189 -0.436 9.266 1.00 0.00 C ATOM 606 CD2 PHE A 38 -0.835 0.695 7.269 1.00 0.00 C ATOM 607 CE1 PHE A 38 0.043 0.779 9.883 1.00 0.00 C ATOM 608 CE2 PHE A 38 -0.603 1.913 7.880 1.00 0.00 C ATOM 609 CZ PHE A 38 -0.163 1.955 9.188 1.00 0.00 C ATOM 0 H PHE A 38 1.415 -1.892 8.731 1.00 0.00 H new ATOM 0 HA PHE A 38 0.108 -3.634 6.720 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.369 -1.639 6.327 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.579 -2.391 7.896 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.024 -1.352 9.813 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.179 0.668 6.246 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.385 0.809 10.907 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -0.766 2.831 7.335 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.020 2.906 9.667 1.00 0.00 H new ATOM 619 N ARG A 39 0.755 -1.988 4.754 1.00 0.00 N ATOM 620 CA ARG A 39 1.481 -1.396 3.637 1.00 0.00 C ATOM 621 C ARG A 39 0.517 -0.929 2.550 1.00 0.00 C ATOM 622 O ARG A 39 -0.356 -1.682 2.117 1.00 0.00 O ATOM 623 CB ARG A 39 2.475 -2.402 3.056 1.00 0.00 C ATOM 624 CG ARG A 39 3.185 -1.905 1.807 1.00 0.00 C ATOM 625 CD ARG A 39 4.066 -2.985 1.199 1.00 0.00 C ATOM 626 NE ARG A 39 5.118 -2.423 0.357 1.00 0.00 N ATOM 627 CZ ARG A 39 4.939 -2.083 -0.915 1.00 0.00 C ATOM 628 NH1 ARG A 39 3.754 -2.246 -1.487 1.00 0.00 N ATOM 629 NH2 ARG A 39 5.946 -1.578 -1.616 1.00 0.00 N ATOM 0 H ARG A 39 -0.145 -2.398 4.503 1.00 0.00 H new ATOM 0 HA ARG A 39 2.029 -0.530 4.009 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.219 -2.644 3.815 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.948 -3.326 2.820 1.00 0.00 H new ATOM 0 HG2 ARG A 39 2.448 -1.580 1.073 1.00 0.00 H new ATOM 0 HG3 ARG A 39 3.793 -1.035 2.055 1.00 0.00 H new ATOM 0 HD2 ARG A 39 4.517 -3.576 1.996 1.00 0.00 H new ATOM 0 HD3 ARG A 39 3.452 -3.663 0.607 1.00 0.00 H new ATOM 0 HE ARG A 39 6.041 -2.284 0.768 1.00 0.00 H new ATOM 0 HH11 ARG A 39 2.978 -2.633 -0.950 1.00 0.00 H new ATOM 0 HH12 ARG A 39 3.619 -1.984 -2.464 1.00 0.00 H new ATOM 0 HH21 ARG A 39 6.859 -1.450 -1.179 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.808 -1.317 -2.592 1.00 0.00 H new ATOM 643 N ILE A 40 0.683 0.315 2.114 1.00 0.00 N ATOM 644 CA ILE A 40 -0.172 0.880 1.077 1.00 0.00 C ATOM 645 C ILE A 40 0.217 0.356 -0.302 1.00 0.00 C ATOM 646 O ILE A 40 1.076 0.926 -0.975 1.00 0.00 O ATOM 647 CB ILE A 40 -0.103 2.418 1.067 1.00 0.00 C ATOM 648 CG1 ILE A 40 -0.875 2.993 2.257 1.00 0.00 C ATOM 649 CG2 ILE A 40 -0.653 2.965 -0.242 1.00 0.00 C ATOM 650 CD1 ILE A 40 -0.745 4.494 2.393 1.00 0.00 C ATOM 0 H ILE A 40 1.401 0.950 2.462 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.192 0.572 1.306 1.00 0.00 H new ATOM 0 HB ILE A 40 0.941 2.720 1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -1.929 2.736 2.155 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.519 2.521 3.173 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.597 4.054 -0.233 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.064 2.578 -1.074 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.692 2.656 -0.358 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -1.317 4.832 3.257 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.304 4.758 2.527 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.128 4.975 1.493 1.00 0.00 H new ATOM 662 N VAL A 41 -0.423 -0.732 -0.717 1.00 0.00 N ATOM 663 CA VAL A 41 -0.147 -1.332 -2.017 1.00 0.00 C ATOM 664 C VAL A 41 0.026 -0.263 -3.090 1.00 0.00 C ATOM 665 O VAL A 41 0.952 -0.324 -3.899 1.00 0.00 O ATOM 666 CB VAL A 41 -1.273 -2.293 -2.443 1.00 0.00 C ATOM 667 CG1 VAL A 41 -0.969 -2.903 -3.803 1.00 0.00 C ATOM 668 CG2 VAL A 41 -1.470 -3.378 -1.395 1.00 0.00 C ATOM 0 H VAL A 41 -1.136 -1.216 -0.172 1.00 0.00 H new ATOM 0 HA VAL A 41 0.781 -1.894 -1.915 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.200 -1.726 -2.526 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.776 -3.579 -4.087 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.881 -2.110 -4.546 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.032 -3.458 -3.752 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.269 -4.049 -1.711 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -0.546 -3.944 -1.279 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -1.737 -2.920 -0.443 1.00 0.00 H new ATOM 678 N ASP A 42 -0.872 0.717 -3.091 1.00 0.00 N ATOM 679 CA ASP A 42 -0.818 1.802 -4.064 1.00 0.00 C ATOM 680 C ASP A 42 -1.313 3.108 -3.449 1.00 0.00 C ATOM 681 O ASP A 42 -2.469 3.232 -3.043 1.00 0.00 O ATOM 682 CB ASP A 42 -1.656 1.454 -5.295 1.00 0.00 C ATOM 683 CG ASP A 42 -0.953 0.476 -6.216 1.00 0.00 C ATOM 684 OD1 ASP A 42 0.192 0.764 -6.624 1.00 0.00 O ATOM 685 OD2 ASP A 42 -1.547 -0.576 -6.530 1.00 0.00 O ATOM 0 H ASP A 42 -1.645 0.782 -2.429 1.00 0.00 H new ATOM 0 HA ASP A 42 0.221 1.934 -4.367 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -2.607 1.028 -4.975 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.885 2.367 -5.845 1.00 0.00 H new ATOM 690 N PRO A 43 -0.419 4.105 -3.378 1.00 0.00 N ATOM 691 CA PRO A 43 -0.742 5.419 -2.814 1.00 0.00 C ATOM 692 C PRO A 43 -1.700 6.210 -3.698 1.00 0.00 C ATOM 693 O PRO A 43 -2.489 7.016 -3.208 1.00 0.00 O ATOM 694 CB PRO A 43 0.618 6.118 -2.741 1.00 0.00 C ATOM 695 CG PRO A 43 1.440 5.456 -3.793 1.00 0.00 C ATOM 696 CD PRO A 43 0.976 4.027 -3.844 1.00 0.00 C ATOM 0 HA PRO A 43 -1.246 5.336 -1.851 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.524 7.188 -2.927 1.00 0.00 H new ATOM 0 HB3 PRO A 43 1.069 6.004 -1.755 1.00 0.00 H new ATOM 0 HG2 PRO A 43 1.305 5.944 -4.758 1.00 0.00 H new ATOM 0 HG3 PRO A 43 2.502 5.513 -3.552 1.00 0.00 H new ATOM 0 HD2 PRO A 43 1.041 3.619 -4.853 1.00 0.00 H new ATOM 0 HD3 PRO A 43 1.579 3.385 -3.202 1.00 0.00 H new ATOM 704 N ASN A 44 -1.626 5.972 -5.004 1.00 0.00 N ATOM 705 CA ASN A 44 -2.488 6.663 -5.956 1.00 0.00 C ATOM 706 C ASN A 44 -3.929 6.177 -5.838 1.00 0.00 C ATOM 707 O ASN A 44 -4.871 6.956 -5.972 1.00 0.00 O ATOM 708 CB ASN A 44 -1.981 6.448 -7.384 1.00 0.00 C ATOM 709 CG ASN A 44 -2.412 7.558 -8.324 1.00 0.00 C ATOM 710 OD1 ASN A 44 -3.511 7.526 -8.876 1.00 0.00 O ATOM 711 ND2 ASN A 44 -1.545 8.546 -8.509 1.00 0.00 N ATOM 0 H ASN A 44 -0.979 5.307 -5.427 1.00 0.00 H new ATOM 0 HA ASN A 44 -2.462 7.728 -5.724 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -0.893 6.386 -7.375 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -2.352 5.494 -7.759 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -1.779 9.320 -9.130 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -0.645 8.531 -8.030 1.00 0.00 H new ATOM 718 N GLY A 45 -4.092 4.881 -5.586 1.00 0.00 N ATOM 719 CA GLY A 45 -5.421 4.313 -5.454 1.00 0.00 C ATOM 720 C GLY A 45 -5.961 4.424 -4.042 1.00 0.00 C ATOM 721 O GLY A 45 -7.169 4.556 -3.840 1.00 0.00 O ATOM 0 H GLY A 45 -3.328 4.215 -5.471 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.099 4.820 -6.140 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.395 3.264 -5.749 1.00 0.00 H new ATOM 725 N LEU A 46 -5.066 4.370 -3.062 1.00 0.00 N ATOM 726 CA LEU A 46 -5.459 4.464 -1.660 1.00 0.00 C ATOM 727 C LEU A 46 -5.917 5.878 -1.317 1.00 0.00 C ATOM 728 O LEU A 46 -6.993 6.072 -0.752 1.00 0.00 O ATOM 729 CB LEU A 46 -4.295 4.058 -0.755 1.00 0.00 C ATOM 730 CG LEU A 46 -4.632 3.859 0.723 1.00 0.00 C ATOM 731 CD1 LEU A 46 -5.272 5.113 1.299 1.00 0.00 C ATOM 732 CD2 LEU A 46 -5.549 2.659 0.904 1.00 0.00 C ATOM 0 H LEU A 46 -4.063 4.262 -3.212 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.293 3.782 -1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.869 3.130 -1.138 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -3.519 4.820 -0.831 1.00 0.00 H new ATOM 0 HG LEU A 46 -3.705 3.668 1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.505 4.952 2.352 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.581 5.951 1.204 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.190 5.336 0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.778 2.533 1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.473 2.820 0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -5.053 1.763 0.531 1.00 0.00 H new ATOM 744 N ALA A 47 -5.094 6.861 -1.664 1.00 0.00 N ATOM 745 CA ALA A 47 -5.416 8.257 -1.397 1.00 0.00 C ATOM 746 C ALA A 47 -6.795 8.616 -1.939 1.00 0.00 C ATOM 747 O ALA A 47 -7.625 9.180 -1.225 1.00 0.00 O ATOM 748 CB ALA A 47 -4.357 9.168 -1.999 1.00 0.00 C ATOM 0 H ALA A 47 -4.199 6.717 -2.131 1.00 0.00 H new ATOM 0 HA ALA A 47 -5.431 8.400 -0.316 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.611 10.208 -1.792 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.386 8.937 -1.560 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -4.314 9.013 -3.077 1.00 0.00 H new ATOM 754 N ARG A 48 -7.033 8.286 -3.204 1.00 0.00 N ATOM 755 CA ARG A 48 -8.312 8.575 -3.841 1.00 0.00 C ATOM 756 C ARG A 48 -9.466 8.361 -2.867 1.00 0.00 C ATOM 757 O ARG A 48 -10.264 9.267 -2.624 1.00 0.00 O ATOM 758 CB ARG A 48 -8.502 7.693 -5.076 1.00 0.00 C ATOM 759 CG ARG A 48 -7.821 8.234 -6.323 1.00 0.00 C ATOM 760 CD ARG A 48 -7.841 7.218 -7.454 1.00 0.00 C ATOM 761 NE ARG A 48 -7.574 7.837 -8.750 1.00 0.00 N ATOM 762 CZ ARG A 48 -8.496 8.474 -9.464 1.00 0.00 C ATOM 763 NH1 ARG A 48 -9.738 8.575 -9.011 1.00 0.00 N ATOM 764 NH2 ARG A 48 -8.176 9.011 -10.635 1.00 0.00 N ATOM 0 H ARG A 48 -6.357 7.818 -3.808 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.308 9.621 -4.147 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.114 6.697 -4.864 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.568 7.584 -5.273 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.321 9.148 -6.644 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.790 8.500 -6.090 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -7.097 6.446 -7.261 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -8.813 6.725 -7.481 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.628 7.777 -9.127 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.988 8.163 -8.112 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -10.443 9.065 -9.561 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.222 8.935 -10.987 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.884 9.500 -11.183 1.00 0.00 H new ATOM 778 N LEU A 49 -9.549 7.156 -2.313 1.00 0.00 N ATOM 779 CA LEU A 49 -10.606 6.821 -1.365 1.00 0.00 C ATOM 780 C LEU A 49 -10.560 7.742 -0.150 1.00 0.00 C ATOM 781 O LEU A 49 -11.597 8.165 0.361 1.00 0.00 O ATOM 782 CB LEU A 49 -10.476 5.364 -0.919 1.00 0.00 C ATOM 783 CG LEU A 49 -10.529 4.315 -2.031 1.00 0.00 C ATOM 784 CD1 LEU A 49 -9.746 3.074 -1.631 1.00 0.00 C ATOM 785 CD2 LEU A 49 -11.971 3.956 -2.357 1.00 0.00 C ATOM 0 H LEU A 49 -8.897 6.395 -2.504 1.00 0.00 H new ATOM 0 HA LEU A 49 -11.565 6.957 -1.865 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -9.533 5.251 -0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -11.273 5.150 -0.207 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.070 4.737 -2.925 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -9.795 2.339 -2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.706 3.343 -1.448 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -10.176 2.649 -0.724 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.989 3.209 -3.150 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -12.456 3.553 -1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -12.502 4.849 -2.687 1.00 0.00 H new ATOM 797 N TRP A 50 -9.352 8.051 0.306 1.00 0.00 N ATOM 798 CA TRP A 50 -9.170 8.924 1.461 1.00 0.00 C ATOM 799 C TRP A 50 -9.635 10.342 1.149 1.00 0.00 C ATOM 800 O TRP A 50 -10.128 11.050 2.025 1.00 0.00 O ATOM 801 CB TRP A 50 -7.702 8.938 1.889 1.00 0.00 C ATOM 802 CG TRP A 50 -7.304 10.194 2.604 1.00 0.00 C ATOM 803 CD1 TRP A 50 -6.621 11.254 2.080 1.00 0.00 C ATOM 804 CD2 TRP A 50 -7.563 10.519 3.974 1.00 0.00 C ATOM 805 NE1 TRP A 50 -6.441 12.219 3.042 1.00 0.00 N ATOM 806 CE2 TRP A 50 -7.010 11.792 4.213 1.00 0.00 C ATOM 807 CE3 TRP A 50 -8.211 9.859 5.023 1.00 0.00 C ATOM 808 CZ2 TRP A 50 -7.085 12.415 5.456 1.00 0.00 C ATOM 809 CZ3 TRP A 50 -8.284 10.479 6.256 1.00 0.00 C ATOM 810 CH2 TRP A 50 -7.724 11.746 6.464 1.00 0.00 C ATOM 0 H TRP A 50 -8.483 7.710 -0.106 1.00 0.00 H new ATOM 0 HA TRP A 50 -9.776 8.534 2.279 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -7.512 8.083 2.538 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -7.073 8.815 1.008 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -6.273 11.324 1.060 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -5.961 13.109 2.906 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -8.647 8.882 4.872 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -6.654 13.392 5.619 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -8.781 9.978 7.073 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -7.798 12.204 7.439 1.00 0.00 H new ATOM 821 N GLY A 51 -9.475 10.750 -0.107 1.00 0.00 N ATOM 822 CA GLY A 51 -9.884 12.083 -0.511 1.00 0.00 C ATOM 823 C GLY A 51 -11.352 12.151 -0.880 1.00 0.00 C ATOM 824 O GLY A 51 -12.001 13.178 -0.685 1.00 0.00 O ATOM 0 H GLY A 51 -9.070 10.182 -0.851 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.684 12.783 0.300 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.283 12.402 -1.363 1.00 0.00 H new ATOM 828 N ASN A 52 -11.878 11.055 -1.417 1.00 0.00 N ATOM 829 CA ASN A 52 -13.279 10.996 -1.817 1.00 0.00 C ATOM 830 C ASN A 52 -14.187 11.484 -0.692 1.00 0.00 C ATOM 831 O ASN A 52 -14.819 12.535 -0.802 1.00 0.00 O ATOM 832 CB ASN A 52 -13.659 9.567 -2.211 1.00 0.00 C ATOM 833 CG ASN A 52 -15.073 9.472 -2.751 1.00 0.00 C ATOM 834 OD1 ASN A 52 -15.554 10.383 -3.426 1.00 0.00 O ATOM 835 ND2 ASN A 52 -15.746 8.367 -2.454 1.00 0.00 N ATOM 0 H ASN A 52 -11.355 10.196 -1.585 1.00 0.00 H new ATOM 0 HA ASN A 52 -13.413 11.651 -2.678 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -12.960 9.203 -2.964 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -13.560 8.915 -1.343 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -16.702 8.247 -2.788 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -15.307 7.638 -1.891 1.00 0.00 H new ATOM 842 N HIS A 53 -14.246 10.714 0.389 1.00 0.00 N ATOM 843 CA HIS A 53 -15.076 11.068 1.535 1.00 0.00 C ATOM 844 C HIS A 53 -14.673 12.428 2.098 1.00 0.00 C ATOM 845 O HIS A 53 -15.523 13.278 2.363 1.00 0.00 O ATOM 846 CB HIS A 53 -14.962 10.000 2.623 1.00 0.00 C ATOM 847 CG HIS A 53 -13.864 10.261 3.608 1.00 0.00 C ATOM 848 ND1 HIS A 53 -12.726 9.487 3.689 1.00 0.00 N ATOM 849 CD2 HIS A 53 -13.733 11.220 4.554 1.00 0.00 C ATOM 850 CE1 HIS A 53 -11.943 9.956 4.644 1.00 0.00 C ATOM 851 NE2 HIS A 53 -12.531 11.008 5.185 1.00 0.00 N ATOM 0 H HIS A 53 -13.729 9.841 0.496 1.00 0.00 H new ATOM 0 HA HIS A 53 -16.111 11.125 1.199 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -15.910 9.935 3.157 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -14.794 9.031 2.153 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -12.521 8.678 3.103 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -14.441 12.006 4.772 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -10.985 9.549 4.933 1.00 0.00 H new ATOM 860 N LYS A 54 -13.372 12.627 2.278 1.00 0.00 N ATOM 861 CA LYS A 54 -12.856 13.883 2.808 1.00 0.00 C ATOM 862 C LYS A 54 -13.325 15.064 1.964 1.00 0.00 C ATOM 863 O LYS A 54 -13.210 16.217 2.375 1.00 0.00 O ATOM 864 CB LYS A 54 -11.326 13.851 2.853 1.00 0.00 C ATOM 865 CG LYS A 54 -10.735 14.650 4.002 1.00 0.00 C ATOM 866 CD LYS A 54 -11.224 14.140 5.346 1.00 0.00 C ATOM 867 CE LYS A 54 -10.182 14.348 6.434 1.00 0.00 C ATOM 868 NZ LYS A 54 -10.601 13.741 7.728 1.00 0.00 N ATOM 0 H LYS A 54 -12.655 11.934 2.064 1.00 0.00 H new ATOM 0 HA LYS A 54 -13.241 14.007 3.820 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.995 12.816 2.933 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.935 14.239 1.912 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -9.647 14.593 3.964 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -11.003 15.701 3.891 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.145 14.656 5.619 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -11.464 13.080 5.269 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -9.235 13.911 6.118 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -10.010 15.415 6.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -9.864 13.905 8.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.492 14.176 8.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -10.741 12.718 7.603 1.00 0.00 H new ATOM 882 N ASN A 55 -13.855 14.766 0.781 1.00 0.00 N ATOM 883 CA ASN A 55 -14.342 15.804 -0.120 1.00 0.00 C ATOM 884 C ASN A 55 -13.185 16.621 -0.686 1.00 0.00 C ATOM 885 O ASN A 55 -13.230 17.851 -0.703 1.00 0.00 O ATOM 886 CB ASN A 55 -15.322 16.724 0.610 1.00 0.00 C ATOM 887 CG ASN A 55 -16.383 15.952 1.371 1.00 0.00 C ATOM 888 OD1 ASN A 55 -16.296 15.793 2.589 1.00 0.00 O ATOM 889 ND2 ASN A 55 -17.391 15.468 0.655 1.00 0.00 N ATOM 0 H ASN A 55 -13.958 13.816 0.425 1.00 0.00 H new ATOM 0 HA ASN A 55 -14.858 15.318 -0.948 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -14.771 17.359 1.304 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -15.804 17.383 -0.112 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -18.134 14.940 1.112 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -17.422 15.624 -0.352 1.00 0.00 H new ATOM 896 N ARG A 56 -12.149 15.929 -1.148 1.00 0.00 N ATOM 897 CA ARG A 56 -10.980 16.590 -1.714 1.00 0.00 C ATOM 898 C ARG A 56 -10.628 16.000 -3.077 1.00 0.00 C ATOM 899 O ARG A 56 -9.738 15.156 -3.189 1.00 0.00 O ATOM 900 CB ARG A 56 -9.786 16.460 -0.766 1.00 0.00 C ATOM 901 CG ARG A 56 -8.505 17.069 -1.314 1.00 0.00 C ATOM 902 CD ARG A 56 -8.485 18.579 -1.135 1.00 0.00 C ATOM 903 NE ARG A 56 -7.565 19.228 -2.064 1.00 0.00 N ATOM 904 CZ ARG A 56 -7.276 20.524 -2.028 1.00 0.00 C ATOM 905 NH1 ARG A 56 -7.832 21.305 -1.112 1.00 0.00 N ATOM 906 NH2 ARG A 56 -6.429 21.042 -2.908 1.00 0.00 N ATOM 0 H ARG A 56 -12.096 14.910 -1.141 1.00 0.00 H new ATOM 0 HA ARG A 56 -11.218 17.646 -1.845 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.031 16.941 0.181 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.615 15.405 -0.553 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.646 16.630 -0.807 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -8.409 16.826 -2.372 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.490 18.975 -1.284 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.196 18.819 -0.112 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.119 18.655 -2.780 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.483 20.911 -0.433 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -7.608 22.300 -1.086 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.998 20.445 -3.614 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -6.208 22.037 -2.879 1.00 0.00 H new ATOM 920 N THR A 57 -11.333 16.449 -4.111 1.00 0.00 N ATOM 921 CA THR A 57 -11.096 15.965 -5.465 1.00 0.00 C ATOM 922 C THR A 57 -9.605 15.906 -5.775 1.00 0.00 C ATOM 923 O THR A 57 -9.152 15.047 -6.530 1.00 0.00 O ATOM 924 CB THR A 57 -11.792 16.858 -6.510 1.00 0.00 C ATOM 925 OG1 THR A 57 -11.237 16.616 -7.807 1.00 0.00 O ATOM 926 CG2 THR A 57 -11.639 18.329 -6.153 1.00 0.00 C ATOM 0 H THR A 57 -12.073 17.147 -4.036 1.00 0.00 H new ATOM 0 HA THR A 57 -11.515 14.960 -5.520 1.00 0.00 H new ATOM 0 HB THR A 57 -12.854 16.612 -6.518 1.00 0.00 H new ATOM 0 HG1 THR A 57 -11.685 17.186 -8.466 1.00 0.00 H new ATOM 0 HG21 THR A 57 -12.138 18.940 -6.905 1.00 0.00 H new ATOM 0 HG22 THR A 57 -12.088 18.515 -5.178 1.00 0.00 H new ATOM 0 HG23 THR A 57 -10.581 18.587 -6.120 1.00 0.00 H new ATOM 934 N ASN A 58 -8.846 16.825 -5.187 1.00 0.00 N ATOM 935 CA ASN A 58 -7.404 16.877 -5.401 1.00 0.00 C ATOM 936 C ASN A 58 -6.654 16.364 -4.176 1.00 0.00 C ATOM 937 O ASN A 58 -5.828 17.072 -3.601 1.00 0.00 O ATOM 938 CB ASN A 58 -6.966 18.308 -5.720 1.00 0.00 C ATOM 939 CG ASN A 58 -7.451 18.771 -7.080 1.00 0.00 C ATOM 940 OD1 ASN A 58 -8.409 19.538 -7.182 1.00 0.00 O ATOM 941 ND2 ASN A 58 -6.789 18.307 -8.134 1.00 0.00 N ATOM 0 H ASN A 58 -9.205 17.544 -4.559 1.00 0.00 H new ATOM 0 HA ASN A 58 -7.164 16.234 -6.248 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -7.347 18.982 -4.953 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -5.878 18.369 -5.685 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -7.069 18.585 -9.075 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -6.001 17.673 -8.003 1.00 0.00 H new ATOM 948 N MET A 59 -6.946 15.129 -3.784 1.00 0.00 N ATOM 949 CA MET A 59 -6.297 14.520 -2.628 1.00 0.00 C ATOM 950 C MET A 59 -5.082 13.703 -3.055 1.00 0.00 C ATOM 951 O MET A 59 -5.217 12.628 -3.639 1.00 0.00 O ATOM 952 CB MET A 59 -7.285 13.630 -1.872 1.00 0.00 C ATOM 953 CG MET A 59 -6.673 12.926 -0.671 1.00 0.00 C ATOM 954 SD MET A 59 -5.986 14.079 0.533 1.00 0.00 S ATOM 955 CE MET A 59 -7.436 14.443 1.519 1.00 0.00 C ATOM 0 H MET A 59 -7.628 14.530 -4.249 1.00 0.00 H new ATOM 0 HA MET A 59 -5.961 15.320 -1.968 1.00 0.00 H new ATOM 0 HB2 MET A 59 -8.126 14.237 -1.537 1.00 0.00 H new ATOM 0 HB3 MET A 59 -7.685 12.882 -2.557 1.00 0.00 H new ATOM 0 HG2 MET A 59 -7.433 12.312 -0.188 1.00 0.00 H new ATOM 0 HG3 MET A 59 -5.888 12.251 -1.011 1.00 0.00 H new ATOM 0 HE1 MET A 59 -7.130 14.721 2.528 1.00 0.00 H new ATOM 0 HE2 MET A 59 -7.986 15.268 1.066 1.00 0.00 H new ATOM 0 HE3 MET A 59 -8.076 13.562 1.564 1.00 0.00 H new ATOM 965 N THR A 60 -3.893 14.220 -2.759 1.00 0.00 N ATOM 966 CA THR A 60 -2.654 13.540 -3.113 1.00 0.00 C ATOM 967 C THR A 60 -2.057 12.823 -1.908 1.00 0.00 C ATOM 968 O THR A 60 -2.348 13.166 -0.762 1.00 0.00 O ATOM 969 CB THR A 60 -1.614 14.525 -3.678 1.00 0.00 C ATOM 970 OG1 THR A 60 -0.452 13.812 -4.116 1.00 0.00 O ATOM 971 CG2 THR A 60 -1.218 15.554 -2.629 1.00 0.00 C ATOM 0 H THR A 60 -3.763 15.108 -2.275 1.00 0.00 H new ATOM 0 HA THR A 60 -2.904 12.808 -3.881 1.00 0.00 H new ATOM 0 HB THR A 60 -2.061 15.046 -4.525 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.204 14.445 -4.476 1.00 0.00 H new ATOM 0 HG21 THR A 60 -0.483 16.239 -3.051 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.100 16.115 -2.318 1.00 0.00 H new ATOM 0 HG23 THR A 60 -0.788 15.046 -1.766 1.00 0.00 H new ATOM 979 N TYR A 61 -1.220 11.826 -2.173 1.00 0.00 N ATOM 980 CA TYR A 61 -0.583 11.059 -1.109 1.00 0.00 C ATOM 981 C TYR A 61 0.443 11.908 -0.366 1.00 0.00 C ATOM 982 O TYR A 61 0.596 11.793 0.850 1.00 0.00 O ATOM 983 CB TYR A 61 0.091 9.812 -1.684 1.00 0.00 C ATOM 984 CG TYR A 61 0.900 9.038 -0.668 1.00 0.00 C ATOM 985 CD1 TYR A 61 0.277 8.355 0.370 1.00 0.00 C ATOM 986 CD2 TYR A 61 2.286 8.989 -0.745 1.00 0.00 C ATOM 987 CE1 TYR A 61 1.012 7.647 1.301 1.00 0.00 C ATOM 988 CE2 TYR A 61 3.029 8.282 0.180 1.00 0.00 C ATOM 989 CZ TYR A 61 2.387 7.614 1.202 1.00 0.00 C ATOM 990 OH TYR A 61 3.124 6.909 2.127 1.00 0.00 O ATOM 0 H TYR A 61 -0.967 11.530 -3.116 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.355 10.754 -0.403 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -0.673 9.157 -2.103 1.00 0.00 H new ATOM 0 HB3 TYR A 61 0.743 10.108 -2.506 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.800 8.378 0.450 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.792 9.513 -1.542 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.513 7.122 2.102 1.00 0.00 H new ATOM 0 HE2 TYR A 61 4.106 8.252 0.104 1.00 0.00 H new ATOM 0 HH TYR A 61 4.077 6.986 1.913 1.00 0.00 H new ATOM 1000 N GLU A 62 1.144 12.761 -1.106 1.00 0.00 N ATOM 1001 CA GLU A 62 2.156 13.630 -0.517 1.00 0.00 C ATOM 1002 C GLU A 62 1.588 14.400 0.672 1.00 0.00 C ATOM 1003 O GLU A 62 2.260 14.582 1.687 1.00 0.00 O ATOM 1004 CB GLU A 62 2.692 14.609 -1.564 1.00 0.00 C ATOM 1005 CG GLU A 62 3.923 15.374 -1.108 1.00 0.00 C ATOM 1006 CD GLU A 62 4.153 16.640 -1.911 1.00 0.00 C ATOM 1007 OE1 GLU A 62 3.347 17.584 -1.774 1.00 0.00 O ATOM 1008 OE2 GLU A 62 5.139 16.687 -2.676 1.00 0.00 O ATOM 0 H GLU A 62 1.030 12.869 -2.114 1.00 0.00 H new ATOM 0 HA GLU A 62 2.975 13.003 -0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 62 2.933 14.059 -2.474 1.00 0.00 H new ATOM 0 HB3 GLU A 62 1.907 15.320 -1.820 1.00 0.00 H new ATOM 0 HG2 GLU A 62 3.817 15.631 -0.054 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.798 14.730 -1.193 1.00 0.00 H new ATOM 1015 N LYS A 63 0.345 14.849 0.538 1.00 0.00 N ATOM 1016 CA LYS A 63 -0.317 15.599 1.599 1.00 0.00 C ATOM 1017 C LYS A 63 -0.916 14.657 2.638 1.00 0.00 C ATOM 1018 O LYS A 63 -1.299 15.082 3.728 1.00 0.00 O ATOM 1019 CB LYS A 63 -1.412 16.493 1.014 1.00 0.00 C ATOM 1020 CG LYS A 63 -0.888 17.544 0.051 1.00 0.00 C ATOM 1021 CD LYS A 63 -2.017 18.381 -0.529 1.00 0.00 C ATOM 1022 CE LYS A 63 -1.590 19.081 -1.810 1.00 0.00 C ATOM 1023 NZ LYS A 63 -0.996 20.419 -1.539 1.00 0.00 N ATOM 0 H LYS A 63 -0.225 14.706 -0.296 1.00 0.00 H new ATOM 0 HA LYS A 63 0.430 16.224 2.088 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.141 15.869 0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.939 16.989 1.829 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.181 18.193 0.568 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -0.342 17.058 -0.757 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.878 17.743 -0.731 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.335 19.123 0.204 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.865 18.462 -2.338 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -2.452 19.193 -2.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -0.718 20.864 -2.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -1.696 21.019 -1.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.158 20.310 -0.932 1.00 0.00 H new ATOM 1037 N MET A 64 -0.993 13.375 2.294 1.00 0.00 N ATOM 1038 CA MET A 64 -1.544 12.373 3.199 1.00 0.00 C ATOM 1039 C MET A 64 -0.482 11.884 4.179 1.00 0.00 C ATOM 1040 O MET A 64 -0.675 11.933 5.394 1.00 0.00 O ATOM 1041 CB MET A 64 -2.105 11.192 2.406 1.00 0.00 C ATOM 1042 CG MET A 64 -3.243 10.472 3.111 1.00 0.00 C ATOM 1043 SD MET A 64 -4.085 9.289 2.042 1.00 0.00 S ATOM 1044 CE MET A 64 -3.404 7.745 2.643 1.00 0.00 C ATOM 0 H MET A 64 -0.681 13.006 1.396 1.00 0.00 H new ATOM 0 HA MET A 64 -2.351 12.836 3.766 1.00 0.00 H new ATOM 0 HB2 MET A 64 -2.456 11.549 1.438 1.00 0.00 H new ATOM 0 HB3 MET A 64 -1.302 10.481 2.211 1.00 0.00 H new ATOM 0 HG2 MET A 64 -2.852 9.952 3.985 1.00 0.00 H new ATOM 0 HG3 MET A 64 -3.963 11.206 3.473 1.00 0.00 H new ATOM 0 HE1 MET A 64 -2.900 7.227 1.827 1.00 0.00 H new ATOM 0 HE2 MET A 64 -2.689 7.949 3.440 1.00 0.00 H new ATOM 0 HE3 MET A 64 -4.208 7.118 3.029 1.00 0.00 H new ATOM 1054 N SER A 65 0.639 11.411 3.643 1.00 0.00 N ATOM 1055 CA SER A 65 1.729 10.908 4.471 1.00 0.00 C ATOM 1056 C SER A 65 2.083 11.908 5.568 1.00 0.00 C ATOM 1057 O SER A 65 2.383 11.524 6.698 1.00 0.00 O ATOM 1058 CB SER A 65 2.960 10.621 3.610 1.00 0.00 C ATOM 1059 OG SER A 65 4.114 10.441 4.413 1.00 0.00 O ATOM 0 H SER A 65 0.816 11.366 2.639 1.00 0.00 H new ATOM 0 HA SER A 65 1.399 9.981 4.941 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.788 9.727 3.010 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.122 11.445 2.915 1.00 0.00 H new ATOM 0 HG SER A 65 4.887 10.257 3.839 1.00 0.00 H new ATOM 1065 N ARG A 66 2.046 13.191 5.225 1.00 0.00 N ATOM 1066 CA ARG A 66 2.364 14.246 6.179 1.00 0.00 C ATOM 1067 C ARG A 66 1.769 13.937 7.550 1.00 0.00 C ATOM 1068 O ARG A 66 2.413 14.146 8.578 1.00 0.00 O ATOM 1069 CB ARG A 66 1.841 15.593 5.676 1.00 0.00 C ATOM 1070 CG ARG A 66 2.821 16.331 4.779 1.00 0.00 C ATOM 1071 CD ARG A 66 3.730 17.248 5.583 1.00 0.00 C ATOM 1072 NE ARG A 66 4.942 17.598 4.848 1.00 0.00 N ATOM 1073 CZ ARG A 66 5.653 18.695 5.084 1.00 0.00 C ATOM 1074 NH1 ARG A 66 5.275 19.544 6.031 1.00 0.00 N ATOM 1075 NH2 ARG A 66 6.746 18.945 4.373 1.00 0.00 N ATOM 0 H ARG A 66 1.799 13.525 4.293 1.00 0.00 H new ATOM 0 HA ARG A 66 3.448 14.298 6.276 1.00 0.00 H new ATOM 0 HB2 ARG A 66 0.912 15.431 5.129 1.00 0.00 H new ATOM 0 HB3 ARG A 66 1.601 16.223 6.533 1.00 0.00 H new ATOM 0 HG2 ARG A 66 3.425 15.610 4.228 1.00 0.00 H new ATOM 0 HG3 ARG A 66 2.271 16.917 4.042 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.189 18.157 5.844 1.00 0.00 H new ATOM 0 HD3 ARG A 66 4.002 16.760 6.519 1.00 0.00 H new ATOM 0 HE ARG A 66 5.260 16.966 4.113 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.436 19.355 6.580 1.00 0.00 H new ATOM 0 HH12 ARG A 66 5.823 20.385 6.210 1.00 0.00 H new ATOM 0 HH21 ARG A 66 7.041 18.294 3.645 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.291 19.788 4.555 1.00 0.00 H new ATOM 1089 N ALA A 67 0.537 13.440 7.556 1.00 0.00 N ATOM 1090 CA ALA A 67 -0.144 13.101 8.799 1.00 0.00 C ATOM 1091 C ALA A 67 0.591 11.990 9.542 1.00 0.00 C ATOM 1092 O ALA A 67 1.156 12.214 10.614 1.00 0.00 O ATOM 1093 CB ALA A 67 -1.581 12.689 8.519 1.00 0.00 C ATOM 0 H ALA A 67 -0.010 13.263 6.714 1.00 0.00 H new ATOM 0 HA ALA A 67 -0.149 13.987 9.434 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -2.077 12.439 9.457 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.109 13.513 8.038 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.589 11.820 7.861 1.00 0.00 H new ATOM 1099 N LEU A 68 0.580 10.793 8.968 1.00 0.00 N ATOM 1100 CA LEU A 68 1.246 9.646 9.577 1.00 0.00 C ATOM 1101 C LEU A 68 2.511 10.077 10.311 1.00 0.00 C ATOM 1102 O LEU A 68 2.762 9.651 11.438 1.00 0.00 O ATOM 1103 CB LEU A 68 1.591 8.606 8.509 1.00 0.00 C ATOM 1104 CG LEU A 68 0.409 7.852 7.899 1.00 0.00 C ATOM 1105 CD1 LEU A 68 -0.610 7.500 8.971 1.00 0.00 C ATOM 1106 CD2 LEU A 68 -0.237 8.677 6.796 1.00 0.00 C ATOM 0 H LEU A 68 0.118 10.590 8.082 1.00 0.00 H new ATOM 0 HA LEU A 68 0.562 9.202 10.301 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.131 9.106 7.705 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.274 7.878 8.947 1.00 0.00 H new ATOM 0 HG LEU A 68 0.780 6.925 7.462 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.444 6.964 8.518 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.141 6.870 9.726 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.977 8.414 9.438 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.076 8.125 6.373 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.594 9.620 7.209 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.496 8.877 6.015 1.00 0.00 H new ATOM 1118 N ARG A 69 3.303 10.927 9.666 1.00 0.00 N ATOM 1119 CA ARG A 69 4.542 11.417 10.258 1.00 0.00 C ATOM 1120 C ARG A 69 4.277 12.068 11.612 1.00 0.00 C ATOM 1121 O ARG A 69 4.725 11.575 12.648 1.00 0.00 O ATOM 1122 CB ARG A 69 5.218 12.420 9.322 1.00 0.00 C ATOM 1123 CG ARG A 69 6.155 11.777 8.314 1.00 0.00 C ATOM 1124 CD ARG A 69 7.571 11.670 8.858 1.00 0.00 C ATOM 1125 NE ARG A 69 8.135 12.979 9.176 1.00 0.00 N ATOM 1126 CZ ARG A 69 9.440 13.227 9.215 1.00 0.00 C ATOM 1127 NH1 ARG A 69 10.310 12.261 8.958 1.00 0.00 N ATOM 1128 NH2 ARG A 69 9.876 14.445 9.512 1.00 0.00 N ATOM 0 H ARG A 69 3.109 11.291 8.733 1.00 0.00 H new ATOM 0 HA ARG A 69 5.206 10.565 10.407 1.00 0.00 H new ATOM 0 HB2 ARG A 69 4.450 12.979 8.787 1.00 0.00 H new ATOM 0 HB3 ARG A 69 5.778 13.140 9.918 1.00 0.00 H new ATOM 0 HG2 ARG A 69 5.787 10.784 8.056 1.00 0.00 H new ATOM 0 HG3 ARG A 69 6.161 12.363 7.395 1.00 0.00 H new ATOM 0 HD2 ARG A 69 7.569 11.049 9.754 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.204 11.171 8.125 1.00 0.00 H new ATOM 0 HE ARG A 69 7.492 13.745 9.379 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.979 11.324 8.729 1.00 0.00 H new ATOM 0 HH12 ARG A 69 11.311 12.455 8.989 1.00 0.00 H new ATOM 0 HH21 ARG A 69 9.209 15.191 9.710 1.00 0.00 H new ATOM 0 HH22 ARG A 69 10.878 14.635 9.542 1.00 0.00 H new ATOM 1142 N HIS A 70 3.545 13.177 11.597 1.00 0.00 N ATOM 1143 CA HIS A 70 3.220 13.896 12.824 1.00 0.00 C ATOM 1144 C HIS A 70 2.914 12.923 13.959 1.00 0.00 C ATOM 1145 O HIS A 70 3.270 13.166 15.112 1.00 0.00 O ATOM 1146 CB HIS A 70 2.026 14.823 12.596 1.00 0.00 C ATOM 1147 CG HIS A 70 2.413 16.200 12.152 1.00 0.00 C ATOM 1148 ND1 HIS A 70 2.939 17.146 13.006 1.00 0.00 N ATOM 1149 CD2 HIS A 70 2.349 16.789 10.935 1.00 0.00 C ATOM 1150 CE1 HIS A 70 3.181 18.257 12.334 1.00 0.00 C ATOM 1151 NE2 HIS A 70 2.832 18.067 11.075 1.00 0.00 N ATOM 0 H HIS A 70 3.165 13.598 10.749 1.00 0.00 H new ATOM 0 HA HIS A 70 4.086 14.494 13.105 1.00 0.00 H new ATOM 0 HB2 HIS A 70 1.370 14.380 11.847 1.00 0.00 H new ATOM 0 HB3 HIS A 70 1.452 14.896 13.519 1.00 0.00 H new ATOM 0 HD2 HIS A 70 1.986 16.338 10.023 1.00 0.00 H new ATOM 0 HE1 HIS A 70 3.594 19.166 12.745 1.00 0.00 H new ATOM 0 HE2 HIS A 70 2.909 18.757 10.328 1.00 0.00 H new ATOM 1160 N TYR A 71 2.251 11.821 13.624 1.00 0.00 N ATOM 1161 CA TYR A 71 1.894 10.813 14.615 1.00 0.00 C ATOM 1162 C TYR A 71 3.119 10.009 15.040 1.00 0.00 C ATOM 1163 O TYR A 71 3.263 9.646 16.208 1.00 0.00 O ATOM 1164 CB TYR A 71 0.824 9.875 14.056 1.00 0.00 C ATOM 1165 CG TYR A 71 -0.479 10.569 13.728 1.00 0.00 C ATOM 1166 CD1 TYR A 71 -1.083 11.422 14.643 1.00 0.00 C ATOM 1167 CD2 TYR A 71 -1.106 10.371 12.504 1.00 0.00 C ATOM 1168 CE1 TYR A 71 -2.274 12.058 14.349 1.00 0.00 C ATOM 1169 CE2 TYR A 71 -2.296 11.004 12.201 1.00 0.00 C ATOM 1170 CZ TYR A 71 -2.876 11.846 13.126 1.00 0.00 C ATOM 1171 OH TYR A 71 -4.062 12.477 12.828 1.00 0.00 O ATOM 0 H TYR A 71 1.950 11.604 12.674 1.00 0.00 H new ATOM 0 HA TYR A 71 1.497 11.326 15.491 1.00 0.00 H new ATOM 0 HB2 TYR A 71 1.208 9.396 13.155 1.00 0.00 H new ATOM 0 HB3 TYR A 71 0.632 9.084 14.781 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.614 11.591 15.601 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.656 9.711 11.777 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -2.731 12.717 15.072 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -2.770 10.840 11.244 1.00 0.00 H new ATOM 0 HH TYR A 71 -4.352 12.221 11.927 1.00 0.00 H new ATOM 1181 N TYR A 72 4.000 9.737 14.084 1.00 0.00 N ATOM 1182 CA TYR A 72 5.213 8.975 14.357 1.00 0.00 C ATOM 1183 C TYR A 72 5.874 9.447 15.648 1.00 0.00 C ATOM 1184 O TYR A 72 6.306 8.640 16.471 1.00 0.00 O ATOM 1185 CB TYR A 72 6.195 9.103 13.191 1.00 0.00 C ATOM 1186 CG TYR A 72 5.687 8.498 11.902 1.00 0.00 C ATOM 1187 CD1 TYR A 72 4.475 7.820 11.861 1.00 0.00 C ATOM 1188 CD2 TYR A 72 6.419 8.602 10.726 1.00 0.00 C ATOM 1189 CE1 TYR A 72 4.007 7.264 10.686 1.00 0.00 C ATOM 1190 CE2 TYR A 72 5.958 8.051 9.546 1.00 0.00 C ATOM 1191 CZ TYR A 72 4.752 7.383 9.531 1.00 0.00 C ATOM 1192 OH TYR A 72 4.290 6.831 8.358 1.00 0.00 O ATOM 0 H TYR A 72 3.897 10.033 13.113 1.00 0.00 H new ATOM 0 HA TYR A 72 4.935 7.928 14.475 1.00 0.00 H new ATOM 0 HB2 TYR A 72 6.414 10.158 13.026 1.00 0.00 H new ATOM 0 HB3 TYR A 72 7.134 8.621 13.463 1.00 0.00 H new ATOM 0 HD1 TYR A 72 3.889 7.726 12.763 1.00 0.00 H new ATOM 0 HD2 TYR A 72 7.365 9.123 10.734 1.00 0.00 H new ATOM 0 HE1 TYR A 72 3.063 6.739 10.672 1.00 0.00 H new ATOM 0 HE2 TYR A 72 6.539 8.143 8.640 1.00 0.00 H new ATOM 0 HH TYR A 72 4.473 5.868 8.355 1.00 0.00 H new ATOM 1202 N LYS A 73 5.950 10.763 15.819 1.00 0.00 N ATOM 1203 CA LYS A 73 6.557 11.347 17.009 1.00 0.00 C ATOM 1204 C LYS A 73 5.753 10.996 18.257 1.00 0.00 C ATOM 1205 O LYS A 73 6.304 10.890 19.354 1.00 0.00 O ATOM 1206 CB LYS A 73 6.655 12.867 16.863 1.00 0.00 C ATOM 1207 CG LYS A 73 7.870 13.326 16.077 1.00 0.00 C ATOM 1208 CD LYS A 73 7.620 13.266 14.579 1.00 0.00 C ATOM 1209 CE LYS A 73 8.448 14.302 13.834 1.00 0.00 C ATOM 1210 NZ LYS A 73 7.730 15.601 13.712 1.00 0.00 N ATOM 0 H LYS A 73 5.598 11.446 15.148 1.00 0.00 H new ATOM 0 HA LYS A 73 7.560 10.933 17.116 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.755 13.235 16.371 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.683 13.318 17.855 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.126 14.346 16.364 1.00 0.00 H new ATOM 0 HG3 LYS A 73 8.726 12.700 16.329 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.862 12.270 14.208 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.562 13.432 14.379 1.00 0.00 H new ATOM 0 HE2 LYS A 73 9.392 14.456 14.356 1.00 0.00 H new ATOM 0 HE3 LYS A 73 8.691 13.926 12.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.327 16.281 13.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.841 15.459 13.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.520 15.972 14.661 1.00 0.00 H new ATOM 1224 N LEU A 74 4.448 10.815 18.083 1.00 0.00 N ATOM 1225 CA LEU A 74 3.568 10.475 19.196 1.00 0.00 C ATOM 1226 C LEU A 74 3.708 9.003 19.570 1.00 0.00 C ATOM 1227 O LEU A 74 2.955 8.487 20.395 1.00 0.00 O ATOM 1228 CB LEU A 74 2.114 10.784 18.835 1.00 0.00 C ATOM 1229 CG LEU A 74 1.662 12.229 19.053 1.00 0.00 C ATOM 1230 CD1 LEU A 74 0.546 12.590 18.084 1.00 0.00 C ATOM 1231 CD2 LEU A 74 1.209 12.435 20.491 1.00 0.00 C ATOM 0 H LEU A 74 3.976 10.898 17.182 1.00 0.00 H new ATOM 0 HA LEU A 74 3.859 11.079 20.055 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.959 10.530 17.786 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.468 10.130 19.421 1.00 0.00 H new ATOM 0 HG LEU A 74 2.509 12.888 18.862 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.237 13.621 18.253 1.00 0.00 H new ATOM 0 HD12 LEU A 74 0.904 12.482 17.060 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.303 11.926 18.243 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.891 13.469 20.628 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.376 11.767 20.709 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.035 12.217 21.168 1.00 0.00 H new ATOM 1243 N ASN A 75 4.679 8.332 18.958 1.00 0.00 N ATOM 1244 CA ASN A 75 4.920 6.919 19.229 1.00 0.00 C ATOM 1245 C ASN A 75 3.692 6.082 18.882 1.00 0.00 C ATOM 1246 O ASN A 75 3.299 5.196 19.641 1.00 0.00 O ATOM 1247 CB ASN A 75 5.291 6.716 20.699 1.00 0.00 C ATOM 1248 CG ASN A 75 6.678 7.237 21.022 1.00 0.00 C ATOM 1249 OD1 ASN A 75 6.829 8.257 21.695 1.00 0.00 O ATOM 1250 ND2 ASN A 75 7.700 6.536 20.543 1.00 0.00 N ATOM 0 H ASN A 75 5.311 8.744 18.272 1.00 0.00 H new ATOM 0 HA ASN A 75 5.750 6.591 18.604 1.00 0.00 H new ATOM 0 HB2 ASN A 75 4.560 7.223 21.329 1.00 0.00 H new ATOM 0 HB3 ASN A 75 5.239 5.654 20.941 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.657 6.837 20.729 1.00 0.00 H new ATOM 0 HD22 ASN A 75 7.528 5.696 19.990 1.00 0.00 H new ATOM 1257 N ILE A 76 3.093 6.369 17.731 1.00 0.00 N ATOM 1258 CA ILE A 76 1.912 5.642 17.284 1.00 0.00 C ATOM 1259 C ILE A 76 2.238 4.738 16.100 1.00 0.00 C ATOM 1260 O ILE A 76 1.808 3.586 16.049 1.00 0.00 O ATOM 1261 CB ILE A 76 0.777 6.604 16.883 1.00 0.00 C ATOM 1262 CG1 ILE A 76 0.487 7.587 18.020 1.00 0.00 C ATOM 1263 CG2 ILE A 76 -0.476 5.822 16.519 1.00 0.00 C ATOM 1264 CD1 ILE A 76 -0.552 8.627 17.668 1.00 0.00 C ATOM 0 H ILE A 76 3.406 7.099 17.092 1.00 0.00 H new ATOM 0 HA ILE A 76 1.581 5.032 18.124 1.00 0.00 H new ATOM 0 HB ILE A 76 1.094 7.172 16.008 1.00 0.00 H new ATOM 0 HG12 ILE A 76 0.150 7.030 18.894 1.00 0.00 H new ATOM 0 HG13 ILE A 76 1.413 8.090 18.300 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.269 6.515 16.238 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -0.260 5.159 15.681 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.798 5.231 17.376 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -0.707 9.289 18.520 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -0.209 9.210 16.813 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -1.491 8.133 17.417 1.00 0.00 H new ATOM 1276 N ILE A 77 3.003 5.268 15.151 1.00 0.00 N ATOM 1277 CA ILE A 77 3.391 4.508 13.970 1.00 0.00 C ATOM 1278 C ILE A 77 4.887 4.628 13.704 1.00 0.00 C ATOM 1279 O ILE A 77 5.504 5.646 14.020 1.00 0.00 O ATOM 1280 CB ILE A 77 2.620 4.977 12.721 1.00 0.00 C ATOM 1281 CG1 ILE A 77 1.112 4.844 12.945 1.00 0.00 C ATOM 1282 CG2 ILE A 77 3.052 4.178 11.501 1.00 0.00 C ATOM 1283 CD1 ILE A 77 0.287 5.737 12.046 1.00 0.00 C ATOM 0 H ILE A 77 3.366 6.221 15.178 1.00 0.00 H new ATOM 0 HA ILE A 77 3.143 3.466 14.171 1.00 0.00 H new ATOM 0 HB ILE A 77 2.850 6.027 12.544 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.819 3.807 12.782 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.885 5.080 13.985 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.499 4.521 10.627 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.120 4.319 11.333 1.00 0.00 H new ATOM 0 HG23 ILE A 77 2.848 3.120 11.668 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.772 5.590 12.260 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.552 6.779 12.225 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.485 5.487 11.004 1.00 0.00 H new ATOM 1295 N ARG A 78 5.465 3.583 13.121 1.00 0.00 N ATOM 1296 CA ARG A 78 6.890 3.572 12.813 1.00 0.00 C ATOM 1297 C ARG A 78 7.122 3.325 11.325 1.00 0.00 C ATOM 1298 O ARG A 78 6.508 2.441 10.728 1.00 0.00 O ATOM 1299 CB ARG A 78 7.603 2.498 13.636 1.00 0.00 C ATOM 1300 CG ARG A 78 9.078 2.786 13.867 1.00 0.00 C ATOM 1301 CD ARG A 78 9.792 1.587 14.472 1.00 0.00 C ATOM 1302 NE ARG A 78 10.213 0.630 13.453 1.00 0.00 N ATOM 1303 CZ ARG A 78 11.332 0.752 12.747 1.00 0.00 C ATOM 1304 NH1 ARG A 78 12.137 1.786 12.949 1.00 0.00 N ATOM 1305 NH2 ARG A 78 11.647 -0.161 11.837 1.00 0.00 N ATOM 0 H ARG A 78 4.969 2.733 12.853 1.00 0.00 H new ATOM 0 HA ARG A 78 7.300 4.549 13.070 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.105 2.401 14.601 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.504 1.538 13.129 1.00 0.00 H new ATOM 0 HG2 ARG A 78 9.550 3.053 12.921 1.00 0.00 H new ATOM 0 HG3 ARG A 78 9.183 3.645 14.529 1.00 0.00 H new ATOM 0 HD2 ARG A 78 10.663 1.928 15.031 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.131 1.092 15.183 1.00 0.00 H new ATOM 0 HE ARG A 78 9.615 -0.177 13.273 1.00 0.00 H new ATOM 0 HH11 ARG A 78 11.898 2.490 13.648 1.00 0.00 H new ATOM 0 HH12 ARG A 78 12.996 1.878 12.406 1.00 0.00 H new ATOM 0 HH21 ARG A 78 11.030 -0.958 11.679 1.00 0.00 H new ATOM 0 HH22 ARG A 78 12.506 -0.066 11.296 1.00 0.00 H new ATOM 1319 N LYS A 79 8.013 4.113 10.732 1.00 0.00 N ATOM 1320 CA LYS A 79 8.327 3.982 9.314 1.00 0.00 C ATOM 1321 C LYS A 79 9.592 3.153 9.113 1.00 0.00 C ATOM 1322 O LYS A 79 10.676 3.543 9.545 1.00 0.00 O ATOM 1323 CB LYS A 79 8.504 5.363 8.679 1.00 0.00 C ATOM 1324 CG LYS A 79 8.222 5.386 7.187 1.00 0.00 C ATOM 1325 CD LYS A 79 8.400 6.780 6.608 1.00 0.00 C ATOM 1326 CE LYS A 79 8.136 6.799 5.110 1.00 0.00 C ATOM 1327 NZ LYS A 79 9.192 6.074 4.352 1.00 0.00 N ATOM 0 H LYS A 79 8.531 4.849 11.212 1.00 0.00 H new ATOM 0 HA LYS A 79 7.496 3.470 8.829 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.841 6.070 9.177 1.00 0.00 H new ATOM 0 HB3 LYS A 79 9.524 5.706 8.853 1.00 0.00 H new ATOM 0 HG2 LYS A 79 8.891 4.692 6.678 1.00 0.00 H new ATOM 0 HG3 LYS A 79 7.204 5.041 7.003 1.00 0.00 H new ATOM 0 HD2 LYS A 79 7.721 7.472 7.107 1.00 0.00 H new ATOM 0 HD3 LYS A 79 9.413 7.130 6.804 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.166 6.345 4.906 1.00 0.00 H new ATOM 0 HE3 LYS A 79 8.084 7.831 4.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 9.052 6.223 3.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 10.127 6.434 4.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 9.135 5.057 4.564 1.00 0.00 H new ATOM 1341 N GLU A 80 9.445 2.008 8.452 1.00 0.00 N ATOM 1342 CA GLU A 80 10.577 1.126 8.194 1.00 0.00 C ATOM 1343 C GLU A 80 11.669 1.855 7.416 1.00 0.00 C ATOM 1344 O GLU A 80 11.403 2.752 6.615 1.00 0.00 O ATOM 1345 CB GLU A 80 10.121 -0.110 7.416 1.00 0.00 C ATOM 1346 CG GLU A 80 9.237 -1.045 8.223 1.00 0.00 C ATOM 1347 CD GLU A 80 8.271 -0.302 9.125 1.00 0.00 C ATOM 1348 OE1 GLU A 80 7.382 0.398 8.594 1.00 0.00 O ATOM 1349 OE2 GLU A 80 8.403 -0.420 10.361 1.00 0.00 O ATOM 0 H GLU A 80 8.555 1.671 8.086 1.00 0.00 H new ATOM 0 HA GLU A 80 10.987 0.812 9.154 1.00 0.00 H new ATOM 0 HB2 GLU A 80 9.579 0.211 6.526 1.00 0.00 H new ATOM 0 HB3 GLU A 80 10.999 -0.658 7.074 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.674 -1.684 7.543 1.00 0.00 H new ATOM 0 HG3 GLU A 80 9.864 -1.699 8.829 1.00 0.00 H new ATOM 1356 N PRO A 81 12.929 1.464 7.657 1.00 0.00 N ATOM 1357 CA PRO A 81 14.087 2.066 6.991 1.00 0.00 C ATOM 1358 C PRO A 81 14.155 1.708 5.510 1.00 0.00 C ATOM 1359 O PRO A 81 14.284 2.582 4.655 1.00 0.00 O ATOM 1360 CB PRO A 81 15.279 1.468 7.741 1.00 0.00 C ATOM 1361 CG PRO A 81 14.774 0.178 8.288 1.00 0.00 C ATOM 1362 CD PRO A 81 13.320 0.401 8.599 1.00 0.00 C ATOM 0 HA PRO A 81 14.052 3.155 7.019 1.00 0.00 H new ATOM 0 HB2 PRO A 81 16.127 1.310 7.075 1.00 0.00 H new ATOM 0 HB3 PRO A 81 15.618 2.130 8.538 1.00 0.00 H new ATOM 0 HG2 PRO A 81 14.899 -0.628 7.565 1.00 0.00 H new ATOM 0 HG3 PRO A 81 15.325 -0.109 9.184 1.00 0.00 H new ATOM 0 HD2 PRO A 81 12.733 -0.505 8.448 1.00 0.00 H new ATOM 0 HD3 PRO A 81 13.173 0.708 9.635 1.00 0.00 H new ATOM 1370 N GLY A 82 14.067 0.414 5.214 1.00 0.00 N ATOM 1371 CA GLY A 82 14.120 -0.037 3.836 1.00 0.00 C ATOM 1372 C GLY A 82 13.010 0.554 2.989 1.00 0.00 C ATOM 1373 O GLY A 82 13.158 1.643 2.435 1.00 0.00 O ATOM 0 H GLY A 82 13.960 -0.329 5.904 1.00 0.00 H new ATOM 0 HA2 GLY A 82 15.084 0.233 3.405 1.00 0.00 H new ATOM 0 HA3 GLY A 82 14.053 -1.125 3.810 1.00 0.00 H new ATOM 1377 N GLN A 83 11.898 -0.165 2.888 1.00 0.00 N ATOM 1378 CA GLN A 83 10.760 0.294 2.100 1.00 0.00 C ATOM 1379 C GLN A 83 10.421 1.744 2.429 1.00 0.00 C ATOM 1380 O GLN A 83 10.987 2.330 3.352 1.00 0.00 O ATOM 1381 CB GLN A 83 9.543 -0.597 2.355 1.00 0.00 C ATOM 1382 CG GLN A 83 9.804 -2.072 2.091 1.00 0.00 C ATOM 1383 CD GLN A 83 10.502 -2.314 0.768 1.00 0.00 C ATOM 1384 OE1 GLN A 83 11.681 -1.996 0.607 1.00 0.00 O ATOM 1385 NE2 GLN A 83 9.776 -2.880 -0.189 1.00 0.00 N ATOM 0 H GLN A 83 11.760 -1.068 3.342 1.00 0.00 H new ATOM 0 HA GLN A 83 11.031 0.233 1.046 1.00 0.00 H new ATOM 0 HB2 GLN A 83 9.222 -0.473 3.389 1.00 0.00 H new ATOM 0 HB3 GLN A 83 8.720 -0.263 1.723 1.00 0.00 H new ATOM 0 HG2 GLN A 83 10.413 -2.479 2.898 1.00 0.00 H new ATOM 0 HG3 GLN A 83 8.857 -2.612 2.102 1.00 0.00 H new ATOM 0 HE21 GLN A 83 8.802 -3.127 -0.012 1.00 0.00 H new ATOM 0 HE22 GLN A 83 10.192 -3.068 -1.101 1.00 0.00 H new ATOM 1394 N ARG A 84 9.494 2.317 1.668 1.00 0.00 N ATOM 1395 CA ARG A 84 9.081 3.699 1.877 1.00 0.00 C ATOM 1396 C ARG A 84 7.592 3.778 2.203 1.00 0.00 C ATOM 1397 O ARG A 84 7.144 4.695 2.892 1.00 0.00 O ATOM 1398 CB ARG A 84 9.387 4.540 0.636 1.00 0.00 C ATOM 1399 CG ARG A 84 8.387 4.348 -0.492 1.00 0.00 C ATOM 1400 CD ARG A 84 8.816 3.233 -1.433 1.00 0.00 C ATOM 1401 NE ARG A 84 9.917 3.643 -2.301 1.00 0.00 N ATOM 1402 CZ ARG A 84 10.671 2.789 -2.984 1.00 0.00 C ATOM 1403 NH1 ARG A 84 10.444 1.486 -2.901 1.00 0.00 N ATOM 1404 NH2 ARG A 84 11.655 3.239 -3.752 1.00 0.00 N ATOM 0 H ARG A 84 9.015 1.845 0.901 1.00 0.00 H new ATOM 0 HA ARG A 84 9.643 4.095 2.723 1.00 0.00 H new ATOM 0 HB2 ARG A 84 9.407 5.593 0.917 1.00 0.00 H new ATOM 0 HB3 ARG A 84 10.384 4.288 0.273 1.00 0.00 H new ATOM 0 HG2 ARG A 84 7.407 4.117 -0.075 1.00 0.00 H new ATOM 0 HG3 ARG A 84 8.284 5.278 -1.051 1.00 0.00 H new ATOM 0 HD2 ARG A 84 9.118 2.363 -0.850 1.00 0.00 H new ATOM 0 HD3 ARG A 84 7.967 2.928 -2.044 1.00 0.00 H new ATOM 0 HE ARG A 84 10.118 4.639 -2.387 1.00 0.00 H new ATOM 0 HH11 ARG A 84 9.689 1.136 -2.311 1.00 0.00 H new ATOM 0 HH12 ARG A 84 11.025 0.833 -3.427 1.00 0.00 H new ATOM 0 HH21 ARG A 84 11.833 4.241 -3.818 1.00 0.00 H new ATOM 0 HH22 ARG A 84 12.234 2.583 -4.276 1.00 0.00 H new ATOM 1418 N LEU A 85 6.830 2.811 1.702 1.00 0.00 N ATOM 1419 CA LEU A 85 5.392 2.771 1.939 1.00 0.00 C ATOM 1420 C LEU A 85 5.041 1.713 2.980 1.00 0.00 C ATOM 1421 O LEU A 85 4.016 1.037 2.874 1.00 0.00 O ATOM 1422 CB LEU A 85 4.648 2.484 0.634 1.00 0.00 C ATOM 1423 CG LEU A 85 4.249 3.707 -0.194 1.00 0.00 C ATOM 1424 CD1 LEU A 85 5.208 3.898 -1.359 1.00 0.00 C ATOM 1425 CD2 LEU A 85 2.819 3.569 -0.695 1.00 0.00 C ATOM 0 H LEU A 85 7.185 2.045 1.129 1.00 0.00 H new ATOM 0 HA LEU A 85 5.084 3.745 2.319 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.274 1.840 0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.746 1.920 0.870 1.00 0.00 H new ATOM 0 HG LEU A 85 4.305 4.588 0.445 1.00 0.00 H new ATOM 0 HD11 LEU A 85 4.909 4.772 -1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.219 4.043 -0.978 1.00 0.00 H new ATOM 0 HD13 LEU A 85 5.185 3.015 -1.998 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.553 4.448 -1.282 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.736 2.678 -1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.142 3.482 0.155 1.00 0.00 H new ATOM 1437 N LEU A 86 5.896 1.575 3.987 1.00 0.00 N ATOM 1438 CA LEU A 86 5.676 0.600 5.050 1.00 0.00 C ATOM 1439 C LEU A 86 5.420 1.296 6.383 1.00 0.00 C ATOM 1440 O LEU A 86 6.157 2.202 6.774 1.00 0.00 O ATOM 1441 CB LEU A 86 6.882 -0.333 5.172 1.00 0.00 C ATOM 1442 CG LEU A 86 6.590 -1.745 5.679 1.00 0.00 C ATOM 1443 CD1 LEU A 86 5.736 -1.695 6.937 1.00 0.00 C ATOM 1444 CD2 LEU A 86 5.903 -2.568 4.599 1.00 0.00 C ATOM 0 H LEU A 86 6.748 2.126 4.090 1.00 0.00 H new ATOM 0 HA LEU A 86 4.795 0.012 4.793 1.00 0.00 H new ATOM 0 HB2 LEU A 86 7.356 -0.411 4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.607 0.129 5.842 1.00 0.00 H new ATOM 0 HG LEU A 86 7.537 -2.224 5.926 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.538 -2.710 7.283 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.265 -1.143 7.714 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.792 -1.197 6.716 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.703 -3.570 4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.963 -2.091 4.320 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.550 -2.633 3.724 1.00 0.00 H new ATOM 1456 N PHE A 87 4.372 0.867 7.078 1.00 0.00 N ATOM 1457 CA PHE A 87 4.019 1.448 8.368 1.00 0.00 C ATOM 1458 C PHE A 87 3.708 0.358 9.389 1.00 0.00 C ATOM 1459 O PHE A 87 2.896 -0.532 9.134 1.00 0.00 O ATOM 1460 CB PHE A 87 2.817 2.382 8.219 1.00 0.00 C ATOM 1461 CG PHE A 87 2.912 3.298 7.033 1.00 0.00 C ATOM 1462 CD1 PHE A 87 4.039 4.078 6.832 1.00 0.00 C ATOM 1463 CD2 PHE A 87 1.875 3.378 6.118 1.00 0.00 C ATOM 1464 CE1 PHE A 87 4.129 4.922 5.741 1.00 0.00 C ATOM 1465 CE2 PHE A 87 1.959 4.221 5.025 1.00 0.00 C ATOM 1466 CZ PHE A 87 3.088 4.993 4.836 1.00 0.00 C ATOM 0 H PHE A 87 3.752 0.118 6.769 1.00 0.00 H new ATOM 0 HA PHE A 87 4.874 2.022 8.726 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.910 1.783 8.133 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.719 2.982 9.124 1.00 0.00 H new ATOM 0 HD1 PHE A 87 4.857 4.026 7.536 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.990 2.775 6.260 1.00 0.00 H new ATOM 0 HE1 PHE A 87 5.013 5.526 5.596 1.00 0.00 H new ATOM 0 HE2 PHE A 87 1.143 4.275 4.320 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.157 5.651 3.982 1.00 0.00 H new ATOM 1476 N ARG A 88 4.360 0.434 10.544 1.00 0.00 N ATOM 1477 CA ARG A 88 4.154 -0.547 11.603 1.00 0.00 C ATOM 1478 C ARG A 88 3.446 0.084 12.799 1.00 0.00 C ATOM 1479 O ARG A 88 3.992 0.965 13.463 1.00 0.00 O ATOM 1480 CB ARG A 88 5.493 -1.141 12.045 1.00 0.00 C ATOM 1481 CG ARG A 88 5.370 -2.142 13.182 1.00 0.00 C ATOM 1482 CD ARG A 88 5.479 -1.461 14.538 1.00 0.00 C ATOM 1483 NE ARG A 88 5.694 -2.421 15.617 1.00 0.00 N ATOM 1484 CZ ARG A 88 6.882 -2.931 15.922 1.00 0.00 C ATOM 1485 NH1 ARG A 88 7.957 -2.573 15.232 1.00 0.00 N ATOM 1486 NH2 ARG A 88 6.998 -3.800 16.918 1.00 0.00 N ATOM 0 H ARG A 88 5.035 1.164 10.771 1.00 0.00 H new ATOM 0 HA ARG A 88 3.523 -1.343 11.208 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.963 -1.629 11.192 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.155 -0.332 12.354 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.414 -2.661 13.110 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.150 -2.897 13.089 1.00 0.00 H new ATOM 0 HD2 ARG A 88 6.302 -0.746 14.520 1.00 0.00 H new ATOM 0 HD3 ARG A 88 4.569 -0.894 14.733 1.00 0.00 H new ATOM 0 HE ARG A 88 4.887 -2.716 16.167 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.872 -1.905 14.466 1.00 0.00 H new ATOM 0 HH12 ARG A 88 8.868 -2.966 15.468 1.00 0.00 H new ATOM 0 HH21 ARG A 88 6.174 -4.078 17.451 1.00 0.00 H new ATOM 0 HH22 ARG A 88 7.911 -4.190 17.150 1.00 0.00 H new ATOM 1500 N PHE A 89 2.227 -0.373 13.066 1.00 0.00 N ATOM 1501 CA PHE A 89 1.443 0.147 14.181 1.00 0.00 C ATOM 1502 C PHE A 89 2.049 -0.275 15.516 1.00 0.00 C ATOM 1503 O PHE A 89 1.603 -1.242 16.133 1.00 0.00 O ATOM 1504 CB PHE A 89 -0.004 -0.342 14.086 1.00 0.00 C ATOM 1505 CG PHE A 89 -0.814 0.379 13.047 1.00 0.00 C ATOM 1506 CD1 PHE A 89 -0.834 1.763 13.003 1.00 0.00 C ATOM 1507 CD2 PHE A 89 -1.555 -0.329 12.114 1.00 0.00 C ATOM 1508 CE1 PHE A 89 -1.578 2.430 12.047 1.00 0.00 C ATOM 1509 CE2 PHE A 89 -2.300 0.332 11.156 1.00 0.00 C ATOM 1510 CZ PHE A 89 -2.313 1.713 11.123 1.00 0.00 C ATOM 0 H PHE A 89 1.761 -1.102 12.526 1.00 0.00 H new ATOM 0 HA PHE A 89 1.455 1.236 14.125 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.005 -1.408 13.860 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.484 -0.222 15.057 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.262 2.328 13.724 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.550 -1.409 12.136 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.584 3.510 12.023 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.872 -0.231 10.433 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.897 2.231 10.376 1.00 0.00 H new ATOM 1520 N MET A 90 3.068 0.457 15.955 1.00 0.00 N ATOM 1521 CA MET A 90 3.735 0.158 17.217 1.00 0.00 C ATOM 1522 C MET A 90 2.740 -0.368 18.246 1.00 0.00 C ATOM 1523 O MET A 90 2.707 -1.563 18.539 1.00 0.00 O ATOM 1524 CB MET A 90 4.432 1.408 17.757 1.00 0.00 C ATOM 1525 CG MET A 90 5.486 1.970 16.817 1.00 0.00 C ATOM 1526 SD MET A 90 7.104 1.211 17.054 1.00 0.00 S ATOM 1527 CE MET A 90 7.753 2.208 18.393 1.00 0.00 C ATOM 0 H MET A 90 3.449 1.261 15.456 1.00 0.00 H new ATOM 0 HA MET A 90 4.481 -0.615 17.032 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.683 2.176 17.951 1.00 0.00 H new ATOM 0 HB3 MET A 90 4.899 1.169 18.712 1.00 0.00 H new ATOM 0 HG2 MET A 90 5.166 1.819 15.786 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.568 3.046 16.971 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.752 1.860 18.655 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.803 3.251 18.079 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.100 2.121 19.261 1.00 0.00 H new ATOM 1537 N LYS A 91 1.930 0.532 18.794 1.00 0.00 N ATOM 1538 CA LYS A 91 0.933 0.159 19.790 1.00 0.00 C ATOM 1539 C LYS A 91 -0.449 0.031 19.156 1.00 0.00 C ATOM 1540 O LYS A 91 -0.640 0.364 17.986 1.00 0.00 O ATOM 1541 CB LYS A 91 0.895 1.195 20.916 1.00 0.00 C ATOM 1542 CG LYS A 91 0.177 0.711 22.164 1.00 0.00 C ATOM 1543 CD LYS A 91 0.646 1.457 23.402 1.00 0.00 C ATOM 1544 CE LYS A 91 -0.158 2.730 23.623 1.00 0.00 C ATOM 1545 NZ LYS A 91 0.305 3.476 24.825 1.00 0.00 N ATOM 0 H LYS A 91 1.945 1.526 18.565 1.00 0.00 H new ATOM 0 HA LYS A 91 1.214 -0.809 20.204 1.00 0.00 H new ATOM 0 HB2 LYS A 91 1.916 1.471 21.179 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.404 2.097 20.552 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.898 0.846 22.042 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.351 -0.357 22.294 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.553 0.811 24.275 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.702 1.705 23.300 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.075 3.369 22.744 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -1.213 2.479 23.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.267 4.337 24.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 0.202 2.875 25.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.304 3.738 24.707 1.00 0.00 H new ATOM 1559 N THR A 92 -1.411 -0.452 19.936 1.00 0.00 N ATOM 1560 CA THR A 92 -2.774 -0.623 19.452 1.00 0.00 C ATOM 1561 C THR A 92 -3.465 0.723 19.267 1.00 0.00 C ATOM 1562 O THR A 92 -3.409 1.600 20.129 1.00 0.00 O ATOM 1563 CB THR A 92 -3.609 -1.488 20.415 1.00 0.00 C ATOM 1564 OG1 THR A 92 -3.146 -2.843 20.383 1.00 0.00 O ATOM 1565 CG2 THR A 92 -5.083 -1.442 20.045 1.00 0.00 C ATOM 0 H THR A 92 -1.270 -0.732 20.907 1.00 0.00 H new ATOM 0 HA THR A 92 -2.705 -1.129 18.489 1.00 0.00 H new ATOM 0 HB THR A 92 -3.491 -1.088 21.422 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.681 -3.386 20.999 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.652 -2.060 20.739 1.00 0.00 H new ATOM 0 HG22 THR A 92 -5.440 -0.413 20.099 1.00 0.00 H new ATOM 0 HG23 THR A 92 -5.216 -1.819 19.031 1.00 0.00 H new ATOM 1573 N PRO A 93 -4.135 0.892 18.117 1.00 0.00 N ATOM 1574 CA PRO A 93 -4.852 2.129 17.793 1.00 0.00 C ATOM 1575 C PRO A 93 -6.092 2.324 18.659 1.00 0.00 C ATOM 1576 O PRO A 93 -6.407 3.442 19.066 1.00 0.00 O ATOM 1577 CB PRO A 93 -5.247 1.937 16.327 1.00 0.00 C ATOM 1578 CG PRO A 93 -5.302 0.460 16.140 1.00 0.00 C ATOM 1579 CD PRO A 93 -4.245 -0.111 17.045 1.00 0.00 C ATOM 0 HA PRO A 93 -4.240 3.013 17.971 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -6.211 2.399 16.113 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -4.518 2.394 15.657 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -6.287 0.071 16.396 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.113 0.191 15.101 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -4.535 -1.086 17.436 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -3.298 -0.246 16.522 1.00 0.00 H new ATOM 1587 N ASP A 94 -6.792 1.229 18.935 1.00 0.00 N ATOM 1588 CA ASP A 94 -7.998 1.280 19.754 1.00 0.00 C ATOM 1589 C ASP A 94 -7.678 1.769 21.163 1.00 0.00 C ATOM 1590 O ASP A 94 -8.542 2.310 21.853 1.00 0.00 O ATOM 1591 CB ASP A 94 -8.656 -0.099 19.816 1.00 0.00 C ATOM 1592 CG ASP A 94 -10.167 -0.017 19.905 1.00 0.00 C ATOM 1593 OD1 ASP A 94 -10.793 0.475 18.942 1.00 0.00 O ATOM 1594 OD2 ASP A 94 -10.725 -0.444 20.938 1.00 0.00 O ATOM 0 H ASP A 94 -6.546 0.296 18.604 1.00 0.00 H new ATOM 0 HA ASP A 94 -8.691 1.984 19.294 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.378 -0.671 18.931 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.273 -0.642 20.680 1.00 0.00 H new ATOM 1599 N GLU A 95 -6.433 1.573 21.583 1.00 0.00 N ATOM 1600 CA GLU A 95 -6.000 1.993 22.911 1.00 0.00 C ATOM 1601 C GLU A 95 -5.973 3.515 23.019 1.00 0.00 C ATOM 1602 O GLU A 95 -6.339 4.081 24.049 1.00 0.00 O ATOM 1603 CB GLU A 95 -4.615 1.424 23.224 1.00 0.00 C ATOM 1604 CG GLU A 95 -4.654 0.063 23.899 1.00 0.00 C ATOM 1605 CD GLU A 95 -3.472 -0.166 24.820 1.00 0.00 C ATOM 1606 OE1 GLU A 95 -3.292 0.632 25.763 1.00 0.00 O ATOM 1607 OE2 GLU A 95 -2.727 -1.143 24.598 1.00 0.00 O ATOM 0 H GLU A 95 -5.706 1.126 21.024 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.716 1.607 23.637 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.046 1.344 22.297 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.081 2.124 23.867 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.578 -0.029 24.470 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.672 -0.716 23.137 1.00 0.00 H new ATOM 1614 N ILE A 96 -5.536 4.170 21.949 1.00 0.00 N ATOM 1615 CA ILE A 96 -5.461 5.625 21.922 1.00 0.00 C ATOM 1616 C ILE A 96 -6.835 6.242 21.683 1.00 0.00 C ATOM 1617 O ILE A 96 -7.252 7.151 22.400 1.00 0.00 O ATOM 1618 CB ILE A 96 -4.492 6.120 20.832 1.00 0.00 C ATOM 1619 CG1 ILE A 96 -3.080 5.593 21.098 1.00 0.00 C ATOM 1620 CG2 ILE A 96 -4.493 7.640 20.772 1.00 0.00 C ATOM 1621 CD1 ILE A 96 -2.795 4.266 20.431 1.00 0.00 C ATOM 0 H ILE A 96 -5.228 3.716 21.089 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.088 5.939 22.897 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.827 5.738 19.868 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -2.355 6.329 20.750 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -2.937 5.488 22.173 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.803 7.974 19.997 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.498 7.994 20.541 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.179 8.042 21.735 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.777 3.954 20.663 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -3.497 3.517 20.797 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.906 4.370 19.352 1.00 0.00 H new ATOM 1633 N MET A 97 -7.534 5.740 20.670 1.00 0.00 N ATOM 1634 CA MET A 97 -8.864 6.240 20.338 1.00 0.00 C ATOM 1635 C MET A 97 -9.620 6.651 21.597 1.00 0.00 C ATOM 1636 O MET A 97 -10.366 7.630 21.593 1.00 0.00 O ATOM 1637 CB MET A 97 -9.656 5.176 19.576 1.00 0.00 C ATOM 1638 CG MET A 97 -9.165 4.954 18.155 1.00 0.00 C ATOM 1639 SD MET A 97 -10.214 3.818 17.227 1.00 0.00 S ATOM 1640 CE MET A 97 -8.988 2.708 16.542 1.00 0.00 C ATOM 0 H MET A 97 -7.202 4.988 20.065 1.00 0.00 H new ATOM 0 HA MET A 97 -8.747 7.119 19.704 1.00 0.00 H new ATOM 0 HB2 MET A 97 -9.601 4.234 20.122 1.00 0.00 H new ATOM 0 HB3 MET A 97 -10.706 5.467 19.547 1.00 0.00 H new ATOM 0 HG2 MET A 97 -9.124 5.911 17.635 1.00 0.00 H new ATOM 0 HG3 MET A 97 -8.148 4.563 18.183 1.00 0.00 H new ATOM 0 HE1 MET A 97 -9.176 2.571 15.477 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.994 3.132 16.683 1.00 0.00 H new ATOM 0 HE3 MET A 97 -9.047 1.744 17.048 1.00 0.00 H new ATOM 1650 N SER A 98 -9.424 5.896 22.673 1.00 0.00 N ATOM 1651 CA SER A 98 -10.092 6.179 23.938 1.00 0.00 C ATOM 1652 C SER A 98 -9.136 6.853 24.918 1.00 0.00 C ATOM 1653 O SER A 98 -8.563 6.202 25.791 1.00 0.00 O ATOM 1654 CB SER A 98 -10.640 4.888 24.550 1.00 0.00 C ATOM 1655 OG SER A 98 -11.643 5.166 25.512 1.00 0.00 O ATOM 0 H SER A 98 -8.808 5.083 22.694 1.00 0.00 H new ATOM 0 HA SER A 98 -10.920 6.859 23.739 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.051 4.255 23.764 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.828 4.330 25.017 1.00 0.00 H new ATOM 0 HG SER A 98 -11.978 4.325 25.887 1.00 0.00 H new ATOM 1661 N GLY A 99 -8.969 8.163 24.765 1.00 0.00 N ATOM 1662 CA GLY A 99 -8.082 8.905 25.642 1.00 0.00 C ATOM 1663 C GLY A 99 -6.663 8.372 25.617 1.00 0.00 C ATOM 1664 O GLY A 99 -6.435 7.208 25.286 1.00 0.00 O ATOM 0 H GLY A 99 -9.432 8.724 24.050 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -8.078 9.954 25.347 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -8.465 8.862 26.662 1.00 0.00 H new ATOM 1668 N ARG A 100 -5.706 9.225 25.967 1.00 0.00 N ATOM 1669 CA ARG A 100 -4.301 8.835 25.980 1.00 0.00 C ATOM 1670 C ARG A 100 -3.438 9.931 26.597 1.00 0.00 C ATOM 1671 O ARG A 100 -3.777 11.113 26.535 1.00 0.00 O ATOM 1672 CB ARG A 100 -3.821 8.531 24.560 1.00 0.00 C ATOM 1673 CG ARG A 100 -2.758 7.446 24.495 1.00 0.00 C ATOM 1674 CD ARG A 100 -1.357 8.034 24.564 1.00 0.00 C ATOM 1675 NE ARG A 100 -1.010 8.764 23.347 1.00 0.00 N ATOM 1676 CZ ARG A 100 0.239 8.964 22.942 1.00 0.00 C ATOM 1677 NH1 ARG A 100 1.254 8.492 23.653 1.00 0.00 N ATOM 1678 NH2 ARG A 100 0.475 9.638 21.824 1.00 0.00 N ATOM 0 H ARG A 100 -5.878 10.191 26.245 1.00 0.00 H new ATOM 0 HA ARG A 100 -4.205 7.936 26.589 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -4.675 8.228 23.954 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -3.424 9.444 24.117 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -2.901 6.745 25.318 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -2.871 6.879 23.571 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -1.287 8.704 25.421 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -0.635 7.233 24.725 1.00 0.00 H new ATOM 0 HE ARG A 100 -1.768 9.140 22.778 1.00 0.00 H new ATOM 0 HH11 ARG A 100 1.077 7.974 24.513 1.00 0.00 H new ATOM 0 HH12 ARG A 100 2.212 8.647 23.339 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -0.303 10.003 21.275 1.00 0.00 H new ATOM 0 HH22 ARG A 100 1.435 9.791 21.514 1.00 0.00 H new ATOM 1692 N THR A 101 -2.319 9.531 27.194 1.00 0.00 N ATOM 1693 CA THR A 101 -1.408 10.478 27.823 1.00 0.00 C ATOM 1694 C THR A 101 -1.150 11.678 26.919 1.00 0.00 C ATOM 1695 O THR A 101 -0.743 12.742 27.384 1.00 0.00 O ATOM 1696 CB THR A 101 -0.062 9.815 28.173 1.00 0.00 C ATOM 1697 OG1 THR A 101 0.860 10.801 28.651 1.00 0.00 O ATOM 1698 CG2 THR A 101 0.525 9.109 26.961 1.00 0.00 C ATOM 0 H THR A 101 -2.023 8.557 27.255 1.00 0.00 H new ATOM 0 HA THR A 101 -1.889 10.815 28.741 1.00 0.00 H new ATOM 0 HB THR A 101 -0.239 9.075 28.954 1.00 0.00 H new ATOM 0 HG1 THR A 101 1.712 10.371 28.873 1.00 0.00 H new ATOM 0 HG21 THR A 101 1.475 8.649 27.233 1.00 0.00 H new ATOM 0 HG22 THR A 101 -0.166 8.339 26.618 1.00 0.00 H new ATOM 0 HG23 THR A 101 0.688 9.832 26.162 1.00 0.00 H new ATOM 1706 N ASP A 102 -1.390 11.499 25.624 1.00 0.00 N ATOM 1707 CA ASP A 102 -1.185 12.568 24.654 1.00 0.00 C ATOM 1708 C ASP A 102 -2.376 12.678 23.707 1.00 0.00 C ATOM 1709 O ASP A 102 -2.474 11.939 22.728 1.00 0.00 O ATOM 1710 CB ASP A 102 0.096 12.322 23.855 1.00 0.00 C ATOM 1711 CG ASP A 102 1.339 12.386 24.719 1.00 0.00 C ATOM 1712 OD1 ASP A 102 1.710 11.347 25.303 1.00 0.00 O ATOM 1713 OD2 ASP A 102 1.942 13.477 24.813 1.00 0.00 O ATOM 0 H ASP A 102 -1.727 10.624 25.222 1.00 0.00 H new ATOM 0 HA ASP A 102 -1.089 13.507 25.200 1.00 0.00 H new ATOM 0 HB2 ASP A 102 0.040 11.344 23.376 1.00 0.00 H new ATOM 0 HB3 ASP A 102 0.172 13.063 23.059 1.00 0.00 H new ATOM 1718 N ARG A 103 -3.280 13.605 24.008 1.00 0.00 N ATOM 1719 CA ARG A 103 -4.467 13.810 23.186 1.00 0.00 C ATOM 1720 C ARG A 103 -4.133 13.662 21.704 1.00 0.00 C ATOM 1721 O ARG A 103 -3.136 14.203 21.224 1.00 0.00 O ATOM 1722 CB ARG A 103 -5.063 15.194 23.450 1.00 0.00 C ATOM 1723 CG ARG A 103 -6.570 15.255 23.258 1.00 0.00 C ATOM 1724 CD ARG A 103 -7.139 16.580 23.738 1.00 0.00 C ATOM 1725 NE ARG A 103 -7.034 16.728 25.188 1.00 0.00 N ATOM 1726 CZ ARG A 103 -7.928 16.244 26.043 1.00 0.00 C ATOM 1727 NH1 ARG A 103 -8.988 15.584 25.596 1.00 0.00 N ATOM 1728 NH2 ARG A 103 -7.762 16.419 27.348 1.00 0.00 N ATOM 0 H ARG A 103 -3.213 14.226 24.815 1.00 0.00 H new ATOM 0 HA ARG A 103 -5.200 13.049 23.454 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -4.823 15.495 24.470 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -4.591 15.917 22.784 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -6.810 15.115 22.204 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -7.041 14.437 23.803 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -6.610 17.399 23.251 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -8.185 16.654 23.441 1.00 0.00 H new ATOM 0 HE ARG A 103 -6.230 17.231 25.564 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -9.118 15.447 24.594 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -9.673 15.213 26.255 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -6.948 16.925 27.695 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -8.449 16.047 28.004 1.00 0.00 H new ATOM 1742 N LEU A 104 -4.973 12.926 20.985 1.00 0.00 N ATOM 1743 CA LEU A 104 -4.768 12.707 19.557 1.00 0.00 C ATOM 1744 C LEU A 104 -5.867 13.377 18.739 1.00 0.00 C ATOM 1745 O LEU A 104 -5.754 13.510 17.522 1.00 0.00 O ATOM 1746 CB LEU A 104 -4.731 11.208 19.252 1.00 0.00 C ATOM 1747 CG LEU A 104 -4.351 10.824 17.822 1.00 0.00 C ATOM 1748 CD1 LEU A 104 -2.877 11.100 17.568 1.00 0.00 C ATOM 1749 CD2 LEU A 104 -4.674 9.360 17.559 1.00 0.00 C ATOM 0 H LEU A 104 -5.802 12.471 21.367 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.813 13.152 19.280 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.024 10.736 19.934 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.713 10.789 19.471 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.937 11.434 17.135 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.625 10.820 16.545 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.675 12.161 17.714 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.273 10.517 18.263 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.397 9.104 16.536 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.115 8.734 18.254 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.742 9.192 17.698 1.00 0.00 H new ATOM 1761 N GLU A 105 -6.930 13.798 19.418 1.00 0.00 N ATOM 1762 CA GLU A 105 -8.049 14.455 18.754 1.00 0.00 C ATOM 1763 C GLU A 105 -7.760 15.938 18.541 1.00 0.00 C ATOM 1764 O GLU A 105 -8.647 16.781 18.676 1.00 0.00 O ATOM 1765 CB GLU A 105 -9.329 14.287 19.575 1.00 0.00 C ATOM 1766 CG GLU A 105 -10.029 12.958 19.346 1.00 0.00 C ATOM 1767 CD GLU A 105 -10.994 13.001 18.177 1.00 0.00 C ATOM 1768 OE1 GLU A 105 -10.526 13.113 17.025 1.00 0.00 O ATOM 1769 OE2 GLU A 105 -12.217 12.922 18.415 1.00 0.00 O ATOM 0 H GLU A 105 -7.039 13.696 20.427 1.00 0.00 H new ATOM 0 HA GLU A 105 -8.187 13.985 17.780 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.087 14.383 20.633 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.016 15.097 19.331 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.282 12.184 19.168 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.570 12.676 20.249 1.00 0.00 H new ATOM 1776 N HIS A 106 -6.511 16.250 18.208 1.00 0.00 N ATOM 1777 CA HIS A 106 -6.104 17.631 17.976 1.00 0.00 C ATOM 1778 C HIS A 106 -5.523 17.798 16.575 1.00 0.00 C ATOM 1779 O HIS A 106 -5.689 18.843 15.943 1.00 0.00 O ATOM 1780 CB HIS A 106 -5.076 18.064 19.022 1.00 0.00 C ATOM 1781 CG HIS A 106 -5.122 19.528 19.336 1.00 0.00 C ATOM 1782 ND1 HIS A 106 -6.080 20.092 20.152 1.00 0.00 N ATOM 1783 CD2 HIS A 106 -4.321 20.544 18.941 1.00 0.00 C ATOM 1784 CE1 HIS A 106 -5.866 21.393 20.244 1.00 0.00 C ATOM 1785 NE2 HIS A 106 -4.804 21.693 19.518 1.00 0.00 N ATOM 0 H HIS A 106 -5.764 15.565 18.093 1.00 0.00 H new ATOM 0 HA HIS A 106 -6.987 18.264 18.062 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -5.242 17.499 19.939 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.078 17.808 18.666 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.461 20.466 18.292 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -6.459 22.092 20.816 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -4.407 22.626 19.404 1.00 0.00 H new ATOM 1794 N LEU A 107 -4.841 16.764 16.095 1.00 0.00 N ATOM 1795 CA LEU A 107 -4.234 16.796 14.769 1.00 0.00 C ATOM 1796 C LEU A 107 -5.176 16.206 13.725 1.00 0.00 C ATOM 1797 O LEU A 107 -4.743 15.783 12.654 1.00 0.00 O ATOM 1798 CB LEU A 107 -2.912 16.027 14.773 1.00 0.00 C ATOM 1799 CG LEU A 107 -1.710 16.761 15.368 1.00 0.00 C ATOM 1800 CD1 LEU A 107 -1.616 16.506 16.864 1.00 0.00 C ATOM 1801 CD2 LEU A 107 -0.426 16.334 14.671 1.00 0.00 C ATOM 0 H LEU A 107 -4.694 15.893 16.605 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.041 17.837 14.510 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -3.056 15.099 15.327 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -2.672 15.751 13.746 1.00 0.00 H new ATOM 0 HG LEU A 107 -1.847 17.831 15.210 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -0.755 17.036 17.270 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -2.524 16.861 17.351 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.502 15.437 17.044 1.00 0.00 H new ATOM 0 HD21 LEU A 107 0.419 16.866 15.107 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.283 15.261 14.797 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -0.493 16.569 13.609 1.00 0.00 H new ATOM 1813 N GLU A 108 -6.467 16.183 14.045 1.00 0.00 N ATOM 1814 CA GLU A 108 -7.470 15.646 13.133 1.00 0.00 C ATOM 1815 C GLU A 108 -7.478 16.419 11.817 1.00 0.00 C ATOM 1816 O GLU A 108 -7.622 15.835 10.743 1.00 0.00 O ATOM 1817 CB GLU A 108 -8.857 15.700 13.776 1.00 0.00 C ATOM 1818 CG GLU A 108 -9.259 17.089 14.243 1.00 0.00 C ATOM 1819 CD GLU A 108 -10.524 17.081 15.078 1.00 0.00 C ATOM 1820 OE1 GLU A 108 -10.597 16.282 16.035 1.00 0.00 O ATOM 1821 OE2 GLU A 108 -11.441 17.872 14.775 1.00 0.00 O ATOM 0 H GLU A 108 -6.842 16.530 14.928 1.00 0.00 H new ATOM 0 HA GLU A 108 -7.214 14.607 12.924 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.595 15.340 13.059 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.880 15.019 14.627 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -8.446 17.521 14.826 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -9.405 17.732 13.375 1.00 0.00 H new ATOM 1828 N SER A 109 -7.322 17.735 11.909 1.00 0.00 N ATOM 1829 CA SER A 109 -7.316 18.589 10.727 1.00 0.00 C ATOM 1830 C SER A 109 -6.122 19.539 10.750 1.00 0.00 C ATOM 1831 O SER A 109 -6.259 20.731 10.473 1.00 0.00 O ATOM 1832 CB SER A 109 -8.617 19.389 10.643 1.00 0.00 C ATOM 1833 OG SER A 109 -8.728 20.298 11.724 1.00 0.00 O ATOM 0 H SER A 109 -7.198 18.234 12.790 1.00 0.00 H new ATOM 0 HA SER A 109 -7.234 17.950 9.848 1.00 0.00 H new ATOM 0 HB2 SER A 109 -8.652 19.935 9.700 1.00 0.00 H new ATOM 0 HB3 SER A 109 -9.468 18.707 10.648 1.00 0.00 H new ATOM 0 HG SER A 109 -9.567 20.798 11.646 1.00 0.00 H new ATOM 1839 N GLN A 110 -4.953 19.002 11.081 1.00 0.00 N ATOM 1840 CA GLN A 110 -3.735 19.802 11.141 1.00 0.00 C ATOM 1841 C GLN A 110 -3.048 19.849 9.780 1.00 0.00 C ATOM 1842 O GLN A 110 -2.688 20.921 9.294 1.00 0.00 O ATOM 1843 CB GLN A 110 -2.777 19.233 12.190 1.00 0.00 C ATOM 1844 CG GLN A 110 -1.624 20.163 12.528 1.00 0.00 C ATOM 1845 CD GLN A 110 -2.091 21.539 12.961 1.00 0.00 C ATOM 1846 OE1 GLN A 110 -1.674 22.554 12.402 1.00 0.00 O ATOM 1847 NE2 GLN A 110 -2.961 21.580 13.963 1.00 0.00 N ATOM 0 H GLN A 110 -4.823 18.017 11.312 1.00 0.00 H new ATOM 0 HA GLN A 110 -4.011 20.818 11.424 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -3.336 19.015 13.100 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -2.375 18.287 11.828 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -1.026 19.719 13.324 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -0.974 20.261 11.658 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -3.280 20.714 14.397 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -3.311 22.478 14.298 1.00 0.00 H new ATOM 1856 N GLU A 111 -2.869 18.681 9.172 1.00 0.00 N ATOM 1857 CA GLU A 111 -2.224 18.591 7.867 1.00 0.00 C ATOM 1858 C GLU A 111 -3.260 18.451 6.756 1.00 0.00 C ATOM 1859 O GLU A 111 -3.031 17.764 5.760 1.00 0.00 O ATOM 1860 CB GLU A 111 -1.259 17.403 7.832 1.00 0.00 C ATOM 1861 CG GLU A 111 -1.936 16.062 8.059 1.00 0.00 C ATOM 1862 CD GLU A 111 -2.062 15.714 9.530 1.00 0.00 C ATOM 1863 OE1 GLU A 111 -1.305 16.285 10.342 1.00 0.00 O ATOM 1864 OE2 GLU A 111 -2.919 14.871 9.868 1.00 0.00 O ATOM 0 H GLU A 111 -3.161 17.785 9.561 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.663 19.511 7.703 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -0.752 17.386 6.867 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -0.492 17.546 8.593 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -2.928 16.079 7.607 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -1.368 15.282 7.552 1.00 0.00 H new ATOM 1871 N LEU A 112 -4.401 19.108 6.934 1.00 0.00 N ATOM 1872 CA LEU A 112 -5.475 19.058 5.947 1.00 0.00 C ATOM 1873 C LEU A 112 -6.202 20.396 5.865 1.00 0.00 C ATOM 1874 O LEU A 112 -5.962 21.294 6.672 1.00 0.00 O ATOM 1875 CB LEU A 112 -6.466 17.947 6.298 1.00 0.00 C ATOM 1876 CG LEU A 112 -5.950 16.515 6.148 1.00 0.00 C ATOM 1877 CD1 LEU A 112 -6.772 15.560 6.999 1.00 0.00 C ATOM 1878 CD2 LEU A 112 -5.977 16.089 4.688 1.00 0.00 C ATOM 0 H LEU A 112 -4.607 19.681 7.752 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.031 18.846 4.974 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.790 18.089 7.329 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.348 18.062 5.668 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.918 16.483 6.496 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.390 14.546 6.880 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.701 15.853 8.046 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.814 15.595 6.682 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.607 15.068 4.600 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.000 16.138 4.314 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -5.344 16.756 4.103 1.00 0.00 H new ATOM 1890 N SER A 113 -7.092 20.521 4.886 1.00 0.00 N ATOM 1891 CA SER A 113 -7.853 21.750 4.697 1.00 0.00 C ATOM 1892 C SER A 113 -9.131 21.731 5.530 1.00 0.00 C ATOM 1893 O SER A 113 -9.313 22.552 6.427 1.00 0.00 O ATOM 1894 CB SER A 113 -8.197 21.940 3.218 1.00 0.00 C ATOM 1895 OG SER A 113 -9.030 23.072 3.030 1.00 0.00 O ATOM 0 H SER A 113 -7.304 19.786 4.211 1.00 0.00 H new ATOM 0 HA SER A 113 -7.236 22.585 5.029 1.00 0.00 H new ATOM 0 HB2 SER A 113 -7.280 22.059 2.640 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.698 21.049 2.840 1.00 0.00 H new ATOM 0 HG SER A 113 -9.234 23.173 2.077 1.00 0.00 H new ATOM 1901 N GLY A 114 -10.015 20.786 5.224 1.00 0.00 N ATOM 1902 CA GLY A 114 -11.265 20.676 5.953 1.00 0.00 C ATOM 1903 C GLY A 114 -11.971 22.010 6.098 1.00 0.00 C ATOM 1904 O GLY A 114 -11.518 23.035 5.587 1.00 0.00 O ATOM 0 H GLY A 114 -9.888 20.095 4.485 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -11.922 19.975 5.438 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -11.070 20.262 6.942 1.00 0.00 H new ATOM 1908 N PRO A 115 -13.108 22.008 6.809 1.00 0.00 N ATOM 1909 CA PRO A 115 -13.902 23.219 7.036 1.00 0.00 C ATOM 1910 C PRO A 115 -13.205 24.203 7.969 1.00 0.00 C ATOM 1911 O PRO A 115 -12.872 23.867 9.106 1.00 0.00 O ATOM 1912 CB PRO A 115 -15.184 22.687 7.681 1.00 0.00 C ATOM 1913 CG PRO A 115 -14.781 21.405 8.323 1.00 0.00 C ATOM 1914 CD PRO A 115 -13.706 20.824 7.448 1.00 0.00 C ATOM 0 HA PRO A 115 -14.071 23.774 6.113 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -15.579 23.390 8.414 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -15.965 22.529 6.937 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -14.412 21.574 9.335 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -15.629 20.725 8.403 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -12.971 20.268 8.030 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.117 20.134 6.711 1.00 0.00 H new ATOM 1922 N SER A 116 -12.987 25.421 7.482 1.00 0.00 N ATOM 1923 CA SER A 116 -12.326 26.453 8.272 1.00 0.00 C ATOM 1924 C SER A 116 -13.123 27.753 8.243 1.00 0.00 C ATOM 1925 O SER A 116 -12.899 28.613 7.391 1.00 0.00 O ATOM 1926 CB SER A 116 -10.910 26.698 7.748 1.00 0.00 C ATOM 1927 OG SER A 116 -10.200 27.588 8.592 1.00 0.00 O ATOM 0 H SER A 116 -13.259 25.717 6.544 1.00 0.00 H new ATOM 0 HA SER A 116 -12.269 26.105 9.303 1.00 0.00 H new ATOM 0 HB2 SER A 116 -10.375 25.751 7.681 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.958 27.109 6.740 1.00 0.00 H new ATOM 0 HG SER A 116 -9.298 27.727 8.236 1.00 0.00 H new ATOM 1933 N SER A 117 -14.056 27.890 9.180 1.00 0.00 N ATOM 1934 CA SER A 117 -14.891 29.083 9.260 1.00 0.00 C ATOM 1935 C SER A 117 -14.081 30.280 9.748 1.00 0.00 C ATOM 1936 O SER A 117 -13.710 30.358 10.918 1.00 0.00 O ATOM 1937 CB SER A 117 -16.076 28.840 10.196 1.00 0.00 C ATOM 1938 OG SER A 117 -17.004 27.937 9.620 1.00 0.00 O ATOM 0 H SER A 117 -14.253 27.189 9.895 1.00 0.00 H new ATOM 0 HA SER A 117 -15.266 29.302 8.260 1.00 0.00 H new ATOM 0 HB2 SER A 117 -15.718 28.442 11.145 1.00 0.00 H new ATOM 0 HB3 SER A 117 -16.572 29.786 10.414 1.00 0.00 H new ATOM 0 HG SER A 117 -17.751 27.797 10.238 1.00 0.00 H new ATOM 1944 N GLY A 118 -13.810 31.213 8.839 1.00 0.00 N ATOM 1945 CA GLY A 118 -13.046 32.394 9.194 1.00 0.00 C ATOM 1946 C GLY A 118 -13.810 33.325 10.115 1.00 0.00 C ATOM 1947 O GLY A 118 -15.034 33.427 10.028 1.00 0.00 O ATOM 0 H GLY A 118 -14.106 31.171 7.864 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -12.118 32.090 9.678 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.771 32.931 8.286 1.00 0.00 H new TER 1951 GLY A 118