USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1053 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 CYS SG : rot 180:sc= -0.361 USER MOD Set 1.2: A 23 SER OG : rot 98:sc= 1.31 USER MOD Set 2.1: A 20 TYR OH : rot 137:sc= 0.419 USER MOD Set 2.2: A 77 SER OG : rot -160:sc= 1.15 USER MOD Set 3.1: A 19 CYS SG : rot 154:sc= -0.87 USER MOD Set 3.2: A 80 TYR OH : rot 120:sc= 0.503 USER MOD Set 3.3: A 89 GLN : amide:sc= -2.55! C(o=-2.9!,f=-14!) USER MOD Single : A 10 MET CE :methyl 162:sc= -2.25 (180deg=-2.59!) USER MOD Single : A 26 GLN : amide:sc= -0.189 K(o=-0.19,f=-1) USER MOD Single : A 29 GLN :FLIP amide:sc= -1.02 F(o=-2.2,f=-1) USER MOD Single : A 31 MET CE :methyl -136:sc= -3.48 (180deg=-8.49!) USER MOD Single : A 34 GLN : amide:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 37 GLN : amide:sc= -1.4 K(o=-1.4,f=-6.2!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 CYS SG : rot 133:sc= -1.29 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 150:sc= -1.3 USER MOD Single : A 72 MET CE :methyl 150:sc= -3.41! (180deg=-5.82!) USER MOD Single : A 82 GLN :FLIP amide:sc= -0.888 F(o=-1.5,f=-0.89) USER MOD Single : A 83 SER OG : rot 160:sc= -0.914 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot 107:sc= 0.884 USER MOD Single : A 90 THR OG1 : rot 90:sc= 1.08 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -43:sc= 1.17 USER MOD Single : A 97 SER OG : rot 180:sc= -0.873 USER MOD Single : A 101 HIS : no HD1:sc= -0.325 X(o=-0.32,f=-0.074) USER MOD Single : A 102 GLN : amide:sc= -0.177 K(o=-0.18,f=-2.5) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ -164:sc=-0.00487 (180deg=-0.116) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -156:sc=-0.00409 (180deg=-0.298) USER MOD Single : A 113 MET CE :methyl -105:sc= -4.48! (180deg=-9.99!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= -1.28! (180deg=-2.85!) USER MOD Single : A 119 SER OG : rot 180:sc= 0.0863 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot -140:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.397 USER MOD Single : A 131 ASN : amide:sc= -1.34 K(o=-1.3,f=-3.5!) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 31:sc= -0.531! USER MOD Single : A 135 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00394) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N MET A 10 -7.560 -11.446 -13.012 1.00 0.00 N ATOM 20 CA MET A 10 -7.038 -11.500 -11.651 1.00 0.00 C ATOM 21 C MET A 10 -6.288 -12.811 -11.406 1.00 0.00 C ATOM 22 O MET A 10 -6.903 -13.873 -11.304 1.00 0.00 O ATOM 23 CB MET A 10 -8.186 -11.353 -10.646 1.00 0.00 C ATOM 24 CG MET A 10 -7.757 -11.469 -9.192 1.00 0.00 C ATOM 25 SD MET A 10 -9.013 -12.243 -8.157 1.00 0.00 S ATOM 26 CE MET A 10 -9.844 -10.803 -7.492 1.00 0.00 C ATOM 0 HA MET A 10 -6.336 -10.676 -11.518 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.664 -10.385 -10.796 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.937 -12.115 -10.854 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.836 -12.049 -9.134 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.533 -10.476 -8.803 1.00 0.00 H new ATOM 0 HE1 MET A 10 -10.819 -11.094 -7.102 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.244 -10.376 -6.688 1.00 0.00 H new ATOM 0 HE3 MET A 10 -9.975 -10.062 -8.281 1.00 0.00 H new ATOM 36 N PRO A 11 -4.947 -12.757 -11.304 1.00 0.00 N ATOM 37 CA PRO A 11 -4.127 -13.951 -11.066 1.00 0.00 C ATOM 38 C PRO A 11 -4.352 -14.537 -9.677 1.00 0.00 C ATOM 39 O PRO A 11 -5.301 -14.173 -8.984 1.00 0.00 O ATOM 40 CB PRO A 11 -2.692 -13.436 -11.203 1.00 0.00 C ATOM 41 CG PRO A 11 -2.782 -11.982 -10.897 1.00 0.00 C ATOM 42 CD PRO A 11 -4.123 -11.538 -11.408 1.00 0.00 C ATOM 0 HA PRO A 11 -4.370 -14.756 -11.760 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -2.021 -13.945 -10.512 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -2.304 -13.606 -12.207 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.693 -11.802 -9.826 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.977 -11.430 -11.381 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -4.532 -10.724 -10.810 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.063 -11.179 -12.436 1.00 0.00 H new ATOM 50 N GLU A 12 -3.471 -15.448 -9.275 1.00 0.00 N ATOM 51 CA GLU A 12 -3.575 -16.085 -7.968 1.00 0.00 C ATOM 52 C GLU A 12 -2.531 -15.528 -7.005 1.00 0.00 C ATOM 53 O GLU A 12 -2.755 -15.471 -5.796 1.00 0.00 O ATOM 54 CB GLU A 12 -3.405 -17.600 -8.099 1.00 0.00 C ATOM 55 CG GLU A 12 -4.318 -18.226 -9.141 1.00 0.00 C ATOM 56 CD GLU A 12 -5.661 -18.632 -8.570 1.00 0.00 C ATOM 57 OE1 GLU A 12 -6.508 -17.742 -8.350 1.00 0.00 O ATOM 58 OE2 GLU A 12 -5.867 -19.843 -8.343 1.00 0.00 O ATOM 0 H GLU A 12 -2.678 -15.761 -9.835 1.00 0.00 H new ATOM 0 HA GLU A 12 -4.565 -15.870 -7.567 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -2.369 -17.820 -8.356 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.599 -18.064 -7.132 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.473 -17.518 -9.955 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.829 -19.102 -9.568 1.00 0.00 H new ATOM 65 N ARG A 13 -1.387 -15.122 -7.547 1.00 0.00 N ATOM 66 CA ARG A 13 -0.309 -14.571 -6.734 1.00 0.00 C ATOM 67 C ARG A 13 -0.133 -13.078 -6.996 1.00 0.00 C ATOM 68 O ARG A 13 0.026 -12.654 -8.141 1.00 0.00 O ATOM 69 CB ARG A 13 1.001 -15.308 -7.020 1.00 0.00 C ATOM 70 CG ARG A 13 0.872 -16.823 -6.965 1.00 0.00 C ATOM 71 CD ARG A 13 0.574 -17.409 -8.337 1.00 0.00 C ATOM 72 NE ARG A 13 1.734 -18.093 -8.902 1.00 0.00 N ATOM 73 CZ ARG A 13 1.745 -18.660 -10.107 1.00 0.00 C ATOM 74 NH1 ARG A 13 0.661 -18.627 -10.874 1.00 0.00 N ATOM 75 NH2 ARG A 13 2.840 -19.263 -10.546 1.00 0.00 N ATOM 0 H ARG A 13 -1.183 -15.164 -8.545 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.575 -14.707 -5.686 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.363 -15.018 -8.006 1.00 0.00 H new ATOM 0 HB3 ARG A 13 1.753 -14.989 -6.298 1.00 0.00 H new ATOM 0 HG2 ARG A 13 1.795 -17.254 -6.577 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.077 -17.096 -6.271 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -0.258 -18.109 -8.260 1.00 0.00 H new ATOM 0 HD3 ARG A 13 0.259 -16.613 -9.011 1.00 0.00 H new ATOM 0 HE ARG A 13 2.585 -18.139 -8.341 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -0.186 -18.166 -10.541 1.00 0.00 H new ATOM 0 HH12 ARG A 13 0.675 -19.063 -11.796 1.00 0.00 H new ATOM 0 HH21 ARG A 13 3.675 -19.293 -9.961 1.00 0.00 H new ATOM 0 HH22 ARG A 13 2.848 -19.697 -11.469 1.00 0.00 H new ATOM 89 N PHE A 14 -0.160 -12.287 -5.928 1.00 0.00 N ATOM 90 CA PHE A 14 -0.002 -10.843 -6.042 1.00 0.00 C ATOM 91 C PHE A 14 1.185 -10.361 -5.217 1.00 0.00 C ATOM 92 O PHE A 14 1.690 -11.081 -4.357 1.00 0.00 O ATOM 93 CB PHE A 14 -1.278 -10.133 -5.593 1.00 0.00 C ATOM 94 CG PHE A 14 -2.426 -10.312 -6.546 1.00 0.00 C ATOM 95 CD1 PHE A 14 -2.450 -9.637 -7.756 1.00 0.00 C ATOM 96 CD2 PHE A 14 -3.478 -11.157 -6.232 1.00 0.00 C ATOM 97 CE1 PHE A 14 -3.502 -9.803 -8.635 1.00 0.00 C ATOM 98 CE2 PHE A 14 -4.533 -11.326 -7.107 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.546 -10.647 -8.310 1.00 0.00 C ATOM 0 H PHE A 14 -0.290 -12.623 -4.974 1.00 0.00 H new ATOM 0 HA PHE A 14 0.187 -10.603 -7.088 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.568 -10.508 -4.612 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -1.072 -9.069 -5.479 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.637 -8.974 -8.014 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -3.473 -11.690 -5.292 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -3.508 -9.273 -9.576 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -5.347 -11.988 -6.851 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.371 -10.776 -8.995 1.00 0.00 H new ATOM 109 N ASP A 15 1.630 -9.139 -5.489 1.00 0.00 N ATOM 110 CA ASP A 15 2.762 -8.564 -4.775 1.00 0.00 C ATOM 111 C ASP A 15 2.301 -7.744 -3.577 1.00 0.00 C ATOM 112 O ASP A 15 2.527 -8.127 -2.429 1.00 0.00 O ATOM 113 CB ASP A 15 3.596 -7.692 -5.713 1.00 0.00 C ATOM 114 CG ASP A 15 4.545 -8.508 -6.571 1.00 0.00 C ATOM 115 OD1 ASP A 15 5.374 -9.246 -6.000 1.00 0.00 O ATOM 116 OD2 ASP A 15 4.457 -8.409 -7.812 1.00 0.00 O ATOM 0 H ASP A 15 1.224 -8.529 -6.198 1.00 0.00 H new ATOM 0 HA ASP A 15 3.377 -9.386 -4.410 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.931 -7.117 -6.358 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.168 -6.975 -5.125 1.00 0.00 H new ATOM 121 N ALA A 16 1.659 -6.610 -3.846 1.00 0.00 N ATOM 122 CA ALA A 16 1.181 -5.743 -2.774 1.00 0.00 C ATOM 123 C ALA A 16 -0.248 -5.269 -3.013 1.00 0.00 C ATOM 124 O ALA A 16 -0.834 -5.516 -4.066 1.00 0.00 O ATOM 125 CB ALA A 16 2.106 -4.542 -2.612 1.00 0.00 C ATOM 0 H ALA A 16 1.459 -6.273 -4.788 1.00 0.00 H new ATOM 0 HA ALA A 16 1.185 -6.332 -1.857 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.737 -3.904 -1.809 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.111 -4.887 -2.369 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.132 -3.975 -3.543 1.00 0.00 H new ATOM 131 N PHE A 17 -0.798 -4.578 -2.018 1.00 0.00 N ATOM 132 CA PHE A 17 -2.156 -4.053 -2.105 1.00 0.00 C ATOM 133 C PHE A 17 -2.198 -2.584 -1.686 1.00 0.00 C ATOM 134 O PHE A 17 -1.766 -2.228 -0.589 1.00 0.00 O ATOM 135 CB PHE A 17 -3.098 -4.878 -1.222 1.00 0.00 C ATOM 136 CG PHE A 17 -4.524 -4.398 -1.239 1.00 0.00 C ATOM 137 CD1 PHE A 17 -4.879 -3.218 -0.606 1.00 0.00 C ATOM 138 CD2 PHE A 17 -5.507 -5.130 -1.887 1.00 0.00 C ATOM 139 CE1 PHE A 17 -6.189 -2.775 -0.618 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.819 -4.692 -1.901 1.00 0.00 C ATOM 141 CZ PHE A 17 -7.159 -3.515 -1.266 1.00 0.00 C ATOM 0 H PHE A 17 -0.322 -4.369 -1.140 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.485 -4.125 -3.142 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -3.071 -5.917 -1.550 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.730 -4.857 -0.196 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -4.124 -2.637 -0.097 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -5.246 -6.052 -2.386 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -6.453 -1.853 -0.122 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.577 -5.271 -2.408 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.183 -3.172 -1.276 1.00 0.00 H new ATOM 151 N ILE A 18 -2.721 -1.736 -2.567 1.00 0.00 N ATOM 152 CA ILE A 18 -2.822 -0.306 -2.290 1.00 0.00 C ATOM 153 C ILE A 18 -4.086 0.015 -1.494 1.00 0.00 C ATOM 154 O ILE A 18 -5.201 -0.195 -1.971 1.00 0.00 O ATOM 155 CB ILE A 18 -2.828 0.518 -3.597 1.00 0.00 C ATOM 156 CG1 ILE A 18 -1.557 0.243 -4.407 1.00 0.00 C ATOM 157 CG2 ILE A 18 -2.961 2.006 -3.296 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.296 0.788 -3.769 1.00 0.00 C ATOM 0 H ILE A 18 -3.082 -2.014 -3.480 1.00 0.00 H new ATOM 0 HA ILE A 18 -1.947 -0.035 -1.699 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.690 0.214 -4.191 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.449 -0.833 -4.542 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -1.669 0.679 -5.400 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.963 2.567 -4.230 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -3.894 2.187 -2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.122 2.329 -2.680 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.561 0.554 -4.400 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.382 1.869 -3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.159 0.333 -2.788 1.00 0.00 H new ATOM 170 N CYS A 19 -3.905 0.524 -0.278 1.00 0.00 N ATOM 171 CA CYS A 19 -5.034 0.872 0.580 1.00 0.00 C ATOM 172 C CYS A 19 -5.182 2.388 0.723 1.00 0.00 C ATOM 173 O CYS A 19 -4.438 3.027 1.471 1.00 0.00 O ATOM 174 CB CYS A 19 -4.868 0.231 1.959 1.00 0.00 C ATOM 175 SG CYS A 19 -6.314 -0.696 2.521 1.00 0.00 S ATOM 0 H CYS A 19 -2.990 0.704 0.135 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.939 0.487 0.110 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -4.008 -0.438 1.936 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -4.645 1.012 2.686 1.00 0.00 H new ATOM 0 HG CYS A 19 -5.940 -1.617 3.359 1.00 0.00 H new ATOM 181 N TYR A 20 -6.149 2.956 0.004 1.00 0.00 N ATOM 182 CA TYR A 20 -6.403 4.394 0.052 1.00 0.00 C ATOM 183 C TYR A 20 -7.895 4.699 -0.105 1.00 0.00 C ATOM 184 O TYR A 20 -8.681 3.826 -0.475 1.00 0.00 O ATOM 185 CB TYR A 20 -5.604 5.112 -1.040 1.00 0.00 C ATOM 186 CG TYR A 20 -5.508 6.611 -0.842 1.00 0.00 C ATOM 187 CD1 TYR A 20 -5.290 7.156 0.417 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.631 7.480 -1.917 1.00 0.00 C ATOM 189 CE1 TYR A 20 -5.198 8.522 0.599 1.00 0.00 C ATOM 190 CE2 TYR A 20 -5.540 8.847 -1.744 1.00 0.00 C ATOM 191 CZ TYR A 20 -5.324 9.363 -0.485 1.00 0.00 C ATOM 192 OH TYR A 20 -5.234 10.726 -0.307 1.00 0.00 O ATOM 0 H TYR A 20 -6.770 2.441 -0.620 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.082 4.758 1.028 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.598 4.694 -1.075 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -6.066 4.911 -2.007 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -5.191 6.500 1.269 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.801 7.080 -2.906 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -5.028 8.928 1.585 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.638 9.509 -2.592 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.686 11.114 -1.021 1.00 0.00 H new ATOM 202 N CYS A 21 -8.272 5.943 0.180 1.00 0.00 N ATOM 203 CA CYS A 21 -9.661 6.378 0.076 1.00 0.00 C ATOM 204 C CYS A 21 -9.935 6.988 -1.303 1.00 0.00 C ATOM 205 O CYS A 21 -9.084 7.679 -1.862 1.00 0.00 O ATOM 206 CB CYS A 21 -9.965 7.397 1.183 1.00 0.00 C ATOM 207 SG CYS A 21 -11.584 8.197 1.061 1.00 0.00 S ATOM 0 H CYS A 21 -7.628 6.672 0.487 1.00 0.00 H new ATOM 0 HA CYS A 21 -10.313 5.513 0.198 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -9.896 6.894 2.148 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -9.194 8.167 1.169 1.00 0.00 H new ATOM 0 HG CYS A 21 -11.730 9.033 2.046 1.00 0.00 H new ATOM 213 N PRO A 22 -11.132 6.736 -1.874 1.00 0.00 N ATOM 214 CA PRO A 22 -11.513 7.259 -3.200 1.00 0.00 C ATOM 215 C PRO A 22 -11.589 8.788 -3.265 1.00 0.00 C ATOM 216 O PRO A 22 -11.949 9.347 -4.301 1.00 0.00 O ATOM 217 CB PRO A 22 -12.903 6.657 -3.436 1.00 0.00 C ATOM 218 CG PRO A 22 -13.411 6.323 -2.077 1.00 0.00 C ATOM 219 CD PRO A 22 -12.204 5.911 -1.287 1.00 0.00 C ATOM 0 HA PRO A 22 -10.768 6.991 -3.949 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -13.560 7.366 -3.940 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -12.847 5.769 -4.066 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -13.904 7.181 -1.621 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.145 5.519 -2.119 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.330 6.109 -0.223 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -11.997 4.846 -1.390 1.00 0.00 H new ATOM 227 N SER A 23 -11.248 9.465 -2.171 1.00 0.00 N ATOM 228 CA SER A 23 -11.282 10.919 -2.136 1.00 0.00 C ATOM 229 C SER A 23 -10.178 11.487 -3.012 1.00 0.00 C ATOM 230 O SER A 23 -10.362 12.495 -3.692 1.00 0.00 O ATOM 231 CB SER A 23 -11.128 11.425 -0.701 1.00 0.00 C ATOM 232 OG SER A 23 -12.189 10.968 0.119 1.00 0.00 O ATOM 0 H SER A 23 -10.946 9.028 -1.300 1.00 0.00 H new ATOM 0 HA SER A 23 -12.246 11.253 -2.519 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.176 11.085 -0.293 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.105 12.515 -0.697 1.00 0.00 H new ATOM 0 HG SER A 23 -11.899 10.175 0.617 1.00 0.00 H new ATOM 238 N ASP A 24 -9.028 10.822 -2.994 1.00 0.00 N ATOM 239 CA ASP A 24 -7.892 11.250 -3.791 1.00 0.00 C ATOM 240 C ASP A 24 -7.203 10.055 -4.444 1.00 0.00 C ATOM 241 O ASP A 24 -5.998 10.079 -4.695 1.00 0.00 O ATOM 242 CB ASP A 24 -6.895 12.027 -2.929 1.00 0.00 C ATOM 243 CG ASP A 24 -5.899 12.811 -3.761 1.00 0.00 C ATOM 244 OD1 ASP A 24 -6.336 13.556 -4.663 1.00 0.00 O ATOM 245 OD2 ASP A 24 -4.683 12.680 -3.511 1.00 0.00 O ATOM 0 H ASP A 24 -8.861 9.985 -2.435 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.261 11.906 -4.579 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.438 12.711 -2.278 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.358 11.332 -2.284 1.00 0.00 H new ATOM 250 N ILE A 25 -7.979 9.010 -4.716 1.00 0.00 N ATOM 251 CA ILE A 25 -7.454 7.799 -5.338 1.00 0.00 C ATOM 252 C ILE A 25 -6.719 8.114 -6.639 1.00 0.00 C ATOM 253 O ILE A 25 -5.632 7.591 -6.886 1.00 0.00 O ATOM 254 CB ILE A 25 -8.583 6.792 -5.632 1.00 0.00 C ATOM 255 CG1 ILE A 25 -8.022 5.518 -6.271 1.00 0.00 C ATOM 256 CG2 ILE A 25 -9.628 7.426 -6.538 1.00 0.00 C ATOM 257 CD1 ILE A 25 -6.856 4.922 -5.513 1.00 0.00 C ATOM 0 H ILE A 25 -8.978 8.978 -4.514 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.752 7.359 -4.630 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.056 6.518 -4.689 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -8.817 4.776 -6.340 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -7.706 5.742 -7.290 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.421 6.705 -6.739 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.051 8.303 -6.048 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.162 7.724 -7.477 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.511 4.023 -6.024 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -6.043 5.647 -5.467 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.172 4.666 -4.502 1.00 0.00 H new ATOM 269 N GLN A 26 -7.326 8.962 -7.465 1.00 0.00 N ATOM 270 CA GLN A 26 -6.742 9.348 -8.751 1.00 0.00 C ATOM 271 C GLN A 26 -5.238 9.583 -8.633 1.00 0.00 C ATOM 272 O GLN A 26 -4.457 9.117 -9.464 1.00 0.00 O ATOM 273 CB GLN A 26 -7.424 10.609 -9.282 1.00 0.00 C ATOM 274 CG GLN A 26 -8.694 10.326 -10.070 1.00 0.00 C ATOM 275 CD GLN A 26 -8.519 10.549 -11.559 1.00 0.00 C ATOM 276 OE1 GLN A 26 -7.792 11.446 -11.984 1.00 0.00 O ATOM 277 NE2 GLN A 26 -9.187 9.729 -12.363 1.00 0.00 N ATOM 0 H GLN A 26 -8.227 9.398 -7.267 1.00 0.00 H new ATOM 0 HA GLN A 26 -6.903 8.527 -9.449 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -7.664 11.263 -8.444 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -6.724 11.150 -9.918 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.004 9.296 -9.895 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -9.496 10.967 -9.702 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -9.779 8.998 -11.968 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -9.108 9.830 -13.375 1.00 0.00 H new ATOM 286 N PHE A 27 -4.845 10.303 -7.593 1.00 0.00 N ATOM 287 CA PHE A 27 -3.439 10.602 -7.360 1.00 0.00 C ATOM 288 C PHE A 27 -2.636 9.322 -7.154 1.00 0.00 C ATOM 289 O PHE A 27 -1.690 9.046 -7.891 1.00 0.00 O ATOM 290 CB PHE A 27 -3.287 11.516 -6.143 1.00 0.00 C ATOM 291 CG PHE A 27 -2.096 12.430 -6.227 1.00 0.00 C ATOM 292 CD1 PHE A 27 -2.177 13.631 -6.914 1.00 0.00 C ATOM 293 CD2 PHE A 27 -0.898 12.086 -5.624 1.00 0.00 C ATOM 294 CE1 PHE A 27 -1.084 14.472 -6.996 1.00 0.00 C ATOM 295 CE2 PHE A 27 0.200 12.922 -5.702 1.00 0.00 C ATOM 296 CZ PHE A 27 0.106 14.117 -6.389 1.00 0.00 C ATOM 0 H PHE A 27 -5.480 10.692 -6.896 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.051 11.113 -8.241 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.190 12.117 -6.034 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.202 10.903 -5.246 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -3.105 13.912 -7.390 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.820 11.153 -5.086 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -1.159 15.406 -7.534 1.00 0.00 H new ATOM 0 HE2 PHE A 27 1.129 12.642 -5.227 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.962 14.773 -6.452 1.00 0.00 H new ATOM 306 N VAL A 28 -3.020 8.543 -6.149 1.00 0.00 N ATOM 307 CA VAL A 28 -2.337 7.291 -5.848 1.00 0.00 C ATOM 308 C VAL A 28 -2.343 6.358 -7.054 1.00 0.00 C ATOM 309 O VAL A 28 -1.291 5.962 -7.547 1.00 0.00 O ATOM 310 CB VAL A 28 -2.980 6.574 -4.646 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.187 5.329 -4.276 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.087 7.519 -3.460 1.00 0.00 C ATOM 0 H VAL A 28 -3.801 8.757 -5.529 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.307 7.544 -5.597 1.00 0.00 H new ATOM 0 HB VAL A 28 -3.986 6.262 -4.927 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.658 4.837 -3.425 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.167 4.645 -5.124 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.168 5.612 -4.013 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.543 6.997 -2.619 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.092 7.862 -3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -3.703 8.376 -3.732 1.00 0.00 H new ATOM 322 N GLN A 29 -3.534 6.009 -7.530 1.00 0.00 N ATOM 323 CA GLN A 29 -3.664 5.123 -8.680 1.00 0.00 C ATOM 324 C GLN A 29 -2.750 5.561 -9.823 1.00 0.00 C ATOM 325 O GLN A 29 -2.318 4.741 -10.633 1.00 0.00 O ATOM 326 CB GLN A 29 -5.119 5.081 -9.148 1.00 0.00 C ATOM 327 CG GLN A 29 -5.585 6.363 -9.819 1.00 0.00 C ATOM 328 CD GLN A 29 -6.915 6.200 -10.527 1.00 0.00 C ATOM 329 OE1 GLN A 29 -8.001 6.524 -9.833 1.00 0.00 O flip ATOM 330 NE2 GLN A 29 -6.967 5.786 -11.685 1.00 0.00 N flip ATOM 0 H GLN A 29 -4.421 6.326 -7.138 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.359 4.122 -8.374 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.243 4.252 -9.844 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.761 4.876 -8.291 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.670 7.150 -9.070 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.832 6.687 -10.538 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.108 5.549 -12.181 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.869 5.680 -12.149 1.00 0.00 H new ATOM 339 N GLU A 30 -2.459 6.858 -9.882 1.00 0.00 N ATOM 340 CA GLU A 30 -1.595 7.401 -10.927 1.00 0.00 C ATOM 341 C GLU A 30 -0.147 6.956 -10.728 1.00 0.00 C ATOM 342 O GLU A 30 0.471 6.400 -11.638 1.00 0.00 O ATOM 343 CB GLU A 30 -1.676 8.930 -10.941 1.00 0.00 C ATOM 344 CG GLU A 30 -2.177 9.499 -12.259 1.00 0.00 C ATOM 345 CD GLU A 30 -1.791 10.953 -12.449 1.00 0.00 C ATOM 346 OE1 GLU A 30 -0.832 11.404 -11.788 1.00 0.00 O ATOM 347 OE2 GLU A 30 -2.450 11.640 -13.258 1.00 0.00 O ATOM 0 H GLU A 30 -2.808 7.551 -9.220 1.00 0.00 H new ATOM 0 HA GLU A 30 -1.943 7.016 -11.886 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.336 9.258 -10.138 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.689 9.340 -10.729 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.774 8.909 -13.082 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.262 9.406 -12.302 1.00 0.00 H new ATOM 354 N MET A 31 0.390 7.205 -9.540 1.00 0.00 N ATOM 355 CA MET A 31 1.769 6.828 -9.235 1.00 0.00 C ATOM 356 C MET A 31 1.910 5.311 -9.147 1.00 0.00 C ATOM 357 O MET A 31 2.909 4.746 -9.593 1.00 0.00 O ATOM 358 CB MET A 31 2.251 7.483 -7.935 1.00 0.00 C ATOM 359 CG MET A 31 1.161 7.677 -6.893 1.00 0.00 C ATOM 360 SD MET A 31 1.819 7.873 -5.228 1.00 0.00 S ATOM 361 CE MET A 31 1.320 6.318 -4.499 1.00 0.00 C ATOM 0 H MET A 31 -0.103 7.664 -8.774 1.00 0.00 H new ATOM 0 HA MET A 31 2.396 7.189 -10.050 1.00 0.00 H new ATOM 0 HB2 MET A 31 3.044 6.871 -7.505 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.689 8.453 -8.171 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.569 8.555 -7.151 1.00 0.00 H new ATOM 0 HG3 MET A 31 0.487 6.821 -6.914 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.915 6.496 -3.503 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.557 5.852 -5.123 1.00 0.00 H new ATOM 0 HE3 MET A 31 2.183 5.656 -4.427 1.00 0.00 H new ATOM 371 N ILE A 32 0.903 4.654 -8.580 1.00 0.00 N ATOM 372 CA ILE A 32 0.923 3.202 -8.449 1.00 0.00 C ATOM 373 C ILE A 32 0.868 2.537 -9.820 1.00 0.00 C ATOM 374 O ILE A 32 1.747 1.749 -10.172 1.00 0.00 O ATOM 375 CB ILE A 32 -0.254 2.692 -7.588 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.238 3.348 -6.204 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.210 1.174 -7.462 1.00 0.00 C ATOM 378 CD1 ILE A 32 1.126 3.350 -5.544 1.00 0.00 C ATOM 0 H ILE A 32 0.067 5.102 -8.206 1.00 0.00 H new ATOM 0 HA ILE A 32 1.857 2.938 -7.952 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.184 2.968 -8.086 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.589 4.376 -6.295 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.944 2.827 -5.557 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.047 0.835 -6.852 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.278 0.725 -8.453 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.726 0.875 -6.991 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.057 3.831 -4.568 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.471 2.324 -5.419 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.832 3.897 -6.169 1.00 0.00 H new ATOM 390 N ARG A 33 -0.164 2.861 -10.596 1.00 0.00 N ATOM 391 CA ARG A 33 -0.320 2.294 -11.928 1.00 0.00 C ATOM 392 C ARG A 33 0.915 2.577 -12.779 1.00 0.00 C ATOM 393 O ARG A 33 1.248 1.810 -13.685 1.00 0.00 O ATOM 394 CB ARG A 33 -1.578 2.856 -12.600 1.00 0.00 C ATOM 395 CG ARG A 33 -1.412 4.266 -13.146 1.00 0.00 C ATOM 396 CD ARG A 33 -0.929 4.252 -14.588 1.00 0.00 C ATOM 397 NE ARG A 33 -2.017 4.502 -15.531 1.00 0.00 N ATOM 398 CZ ARG A 33 -2.686 5.651 -15.603 1.00 0.00 C ATOM 399 NH1 ARG A 33 -2.383 6.657 -14.792 1.00 0.00 N ATOM 400 NH2 ARG A 33 -3.662 5.796 -16.490 1.00 0.00 N ATOM 0 H ARG A 33 -0.901 3.511 -10.324 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.430 1.214 -11.835 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.868 2.194 -13.416 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.395 2.851 -11.879 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.363 4.795 -13.085 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.701 4.815 -12.528 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.155 5.008 -14.719 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.473 3.287 -14.808 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.279 3.753 -16.171 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.633 6.553 -14.108 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.900 7.534 -14.853 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.900 5.027 -17.117 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.174 6.676 -16.545 1.00 0.00 H new ATOM 414 N GLN A 34 1.599 3.676 -12.471 1.00 0.00 N ATOM 415 CA GLN A 34 2.804 4.054 -13.191 1.00 0.00 C ATOM 416 C GLN A 34 3.976 3.184 -12.753 1.00 0.00 C ATOM 417 O GLN A 34 4.924 2.970 -13.507 1.00 0.00 O ATOM 418 CB GLN A 34 3.131 5.528 -12.943 1.00 0.00 C ATOM 419 CG GLN A 34 2.482 6.475 -13.941 1.00 0.00 C ATOM 420 CD GLN A 34 3.223 7.792 -14.061 1.00 0.00 C ATOM 421 OE1 GLN A 34 3.408 8.316 -15.158 1.00 0.00 O ATOM 422 NE2 GLN A 34 3.653 8.333 -12.928 1.00 0.00 N ATOM 0 H GLN A 34 1.335 4.320 -11.725 1.00 0.00 H new ATOM 0 HA GLN A 34 2.630 3.905 -14.257 1.00 0.00 H new ATOM 0 HB2 GLN A 34 2.809 5.798 -11.937 1.00 0.00 H new ATOM 0 HB3 GLN A 34 4.212 5.662 -12.979 1.00 0.00 H new ATOM 0 HG2 GLN A 34 2.441 5.995 -14.919 1.00 0.00 H new ATOM 0 HG3 GLN A 34 1.453 6.668 -13.637 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.477 7.863 -12.040 1.00 0.00 H new ATOM 0 HE22 GLN A 34 4.159 9.218 -12.945 1.00 0.00 H new ATOM 431 N LEU A 35 3.901 2.688 -11.521 1.00 0.00 N ATOM 432 CA LEU A 35 4.948 1.845 -10.967 1.00 0.00 C ATOM 433 C LEU A 35 4.828 0.409 -11.475 1.00 0.00 C ATOM 434 O LEU A 35 5.822 -0.212 -11.849 1.00 0.00 O ATOM 435 CB LEU A 35 4.874 1.859 -9.440 1.00 0.00 C ATOM 436 CG LEU A 35 5.399 3.129 -8.775 1.00 0.00 C ATOM 437 CD1 LEU A 35 5.001 3.167 -7.308 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.911 3.219 -8.919 1.00 0.00 C ATOM 0 H LEU A 35 3.120 2.858 -10.887 1.00 0.00 H new ATOM 0 HA LEU A 35 5.910 2.243 -11.291 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.836 1.714 -9.141 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.437 1.008 -9.057 1.00 0.00 H new ATOM 0 HG LEU A 35 4.953 3.989 -9.275 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.384 4.079 -6.851 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.914 3.148 -7.225 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.419 2.301 -6.795 1.00 0.00 H new ATOM 0 HD21 LEU A 35 7.269 4.130 -8.439 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.374 2.354 -8.445 1.00 0.00 H new ATOM 0 HD23 LEU A 35 7.175 3.238 -9.976 1.00 0.00 H new ATOM 450 N GLU A 36 3.606 -0.115 -11.471 1.00 0.00 N ATOM 451 CA GLU A 36 3.356 -1.481 -11.919 1.00 0.00 C ATOM 452 C GLU A 36 3.645 -1.643 -13.408 1.00 0.00 C ATOM 453 O GLU A 36 4.177 -2.667 -13.838 1.00 0.00 O ATOM 454 CB GLU A 36 1.911 -1.882 -11.622 1.00 0.00 C ATOM 455 CG GLU A 36 0.882 -0.911 -12.178 1.00 0.00 C ATOM 456 CD GLU A 36 0.257 -1.399 -13.470 1.00 0.00 C ATOM 457 OE1 GLU A 36 1.008 -1.869 -14.350 1.00 0.00 O ATOM 458 OE2 GLU A 36 -0.981 -1.311 -13.602 1.00 0.00 O ATOM 0 H GLU A 36 2.773 0.386 -11.162 1.00 0.00 H new ATOM 0 HA GLU A 36 4.032 -2.137 -11.370 1.00 0.00 H new ATOM 0 HB2 GLU A 36 1.725 -2.872 -12.038 1.00 0.00 H new ATOM 0 HB3 GLU A 36 1.779 -1.959 -10.543 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.099 -0.754 -11.437 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.356 0.055 -12.350 1.00 0.00 H new ATOM 465 N GLN A 37 3.289 -0.632 -14.192 1.00 0.00 N ATOM 466 CA GLN A 37 3.506 -0.670 -15.629 1.00 0.00 C ATOM 467 C GLN A 37 4.988 -0.821 -15.961 1.00 0.00 C ATOM 468 O GLN A 37 5.348 -1.432 -16.967 1.00 0.00 O ATOM 469 CB GLN A 37 2.955 0.602 -16.270 1.00 0.00 C ATOM 470 CG GLN A 37 3.602 1.873 -15.750 1.00 0.00 C ATOM 471 CD GLN A 37 3.525 3.016 -16.744 1.00 0.00 C ATOM 472 OE1 GLN A 37 3.022 4.094 -16.430 1.00 0.00 O ATOM 473 NE2 GLN A 37 4.023 2.784 -17.952 1.00 0.00 N ATOM 0 H GLN A 37 2.849 0.224 -13.854 1.00 0.00 H new ATOM 0 HA GLN A 37 2.980 -1.537 -16.030 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.098 0.547 -17.349 1.00 0.00 H new ATOM 0 HB3 GLN A 37 1.881 0.652 -16.093 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.115 2.171 -14.821 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.647 1.673 -15.512 1.00 0.00 H new ATOM 0 HE21 GLN A 37 4.431 1.875 -18.169 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.998 3.515 -18.663 1.00 0.00 H new ATOM 555 N LEU A 42 6.214 -5.908 -10.542 1.00 0.00 N ATOM 556 CA LEU A 42 5.372 -5.312 -9.511 1.00 0.00 C ATOM 557 C LEU A 42 3.897 -5.575 -9.796 1.00 0.00 C ATOM 558 O LEU A 42 3.382 -5.205 -10.851 1.00 0.00 O ATOM 559 CB LEU A 42 5.628 -3.805 -9.422 1.00 0.00 C ATOM 560 CG LEU A 42 5.063 -3.126 -8.173 1.00 0.00 C ATOM 561 CD1 LEU A 42 5.964 -3.376 -6.975 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.893 -1.633 -8.412 1.00 0.00 C ATOM 0 HA LEU A 42 5.626 -5.773 -8.556 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.704 -3.632 -9.456 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.200 -3.326 -10.303 1.00 0.00 H new ATOM 0 HG LEU A 42 4.084 -3.555 -7.960 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.546 -2.885 -6.096 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.037 -4.448 -6.792 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.957 -2.974 -7.176 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.490 -1.164 -7.514 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.860 -1.190 -8.650 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.207 -1.473 -9.244 1.00 0.00 H new ATOM 574 N LYS A 43 3.223 -6.218 -8.848 1.00 0.00 N ATOM 575 CA LYS A 43 1.807 -6.534 -8.997 1.00 0.00 C ATOM 576 C LYS A 43 1.005 -6.026 -7.803 1.00 0.00 C ATOM 577 O LYS A 43 0.796 -6.750 -6.828 1.00 0.00 O ATOM 578 CB LYS A 43 1.615 -8.045 -9.144 1.00 0.00 C ATOM 579 CG LYS A 43 2.590 -8.692 -10.116 1.00 0.00 C ATOM 580 CD LYS A 43 2.067 -8.648 -11.545 1.00 0.00 C ATOM 581 CE LYS A 43 3.049 -7.958 -12.478 1.00 0.00 C ATOM 582 NZ LYS A 43 4.008 -8.923 -13.086 1.00 0.00 N ATOM 0 H LYS A 43 3.635 -6.530 -7.969 1.00 0.00 H new ATOM 0 HA LYS A 43 1.443 -6.035 -9.895 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.725 -8.514 -8.166 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.597 -8.242 -9.479 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.551 -8.180 -10.063 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.764 -9.727 -9.823 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.881 -9.663 -11.897 1.00 0.00 H new ATOM 0 HD3 LYS A 43 1.112 -8.123 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.500 -7.445 -13.268 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.600 -7.197 -11.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.661 -8.414 -13.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.550 -9.395 -12.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.484 -9.635 -13.634 1.00 0.00 H new ATOM 596 N LEU A 44 0.549 -4.780 -7.888 1.00 0.00 N ATOM 597 CA LEU A 44 -0.236 -4.182 -6.815 1.00 0.00 C ATOM 598 C LEU A 44 -1.726 -4.405 -7.056 1.00 0.00 C ATOM 599 O LEU A 44 -2.144 -4.686 -8.179 1.00 0.00 O ATOM 600 CB LEU A 44 0.060 -2.685 -6.703 1.00 0.00 C ATOM 601 CG LEU A 44 1.326 -2.338 -5.919 1.00 0.00 C ATOM 602 CD1 LEU A 44 1.850 -0.972 -6.326 1.00 0.00 C ATOM 603 CD2 LEU A 44 1.051 -2.380 -4.426 1.00 0.00 C ATOM 0 H LEU A 44 0.709 -4.167 -8.687 1.00 0.00 H new ATOM 0 HA LEU A 44 0.043 -4.664 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.146 -2.270 -7.707 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.790 -2.196 -6.228 1.00 0.00 H new ATOM 0 HG LEU A 44 2.090 -3.080 -6.152 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.751 -0.744 -5.757 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.084 -0.974 -7.391 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.091 -0.216 -6.123 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.962 -2.131 -3.881 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.272 -1.659 -4.179 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.722 -3.380 -4.145 1.00 0.00 H new ATOM 615 N CYS A 45 -2.523 -4.289 -5.999 1.00 0.00 N ATOM 616 CA CYS A 45 -3.962 -4.489 -6.116 1.00 0.00 C ATOM 617 C CYS A 45 -4.732 -3.595 -5.152 1.00 0.00 C ATOM 618 O CYS A 45 -4.153 -2.999 -4.246 1.00 0.00 O ATOM 619 CB CYS A 45 -4.310 -5.955 -5.861 1.00 0.00 C ATOM 620 SG CYS A 45 -4.191 -7.010 -7.340 1.00 0.00 S ATOM 0 H CYS A 45 -2.200 -4.059 -5.059 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.255 -4.218 -7.130 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.645 -6.348 -5.092 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.324 -6.014 -5.465 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.538 -8.095 -7.047 1.00 0.00 H new ATOM 625 N VAL A 46 -6.042 -3.507 -5.356 1.00 0.00 N ATOM 626 CA VAL A 46 -6.897 -2.687 -4.506 1.00 0.00 C ATOM 627 C VAL A 46 -8.216 -3.393 -4.211 1.00 0.00 C ATOM 628 O VAL A 46 -8.433 -4.526 -4.640 1.00 0.00 O ATOM 629 CB VAL A 46 -7.192 -1.323 -5.158 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.912 -0.515 -5.313 1.00 0.00 C ATOM 631 CG2 VAL A 46 -7.877 -1.509 -6.504 1.00 0.00 C ATOM 0 H VAL A 46 -6.535 -3.994 -6.104 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.357 -2.526 -3.573 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.867 -0.770 -4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.141 0.445 -5.775 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.466 -0.348 -4.332 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.210 -1.062 -5.942 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.077 -0.534 -6.948 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.229 -2.083 -7.166 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.817 -2.043 -6.363 1.00 0.00 H new ATOM 641 N SER A 47 -9.095 -2.716 -3.479 1.00 0.00 N ATOM 642 CA SER A 47 -10.394 -3.279 -3.131 1.00 0.00 C ATOM 643 C SER A 47 -11.293 -3.365 -4.361 1.00 0.00 C ATOM 644 O SER A 47 -10.977 -2.809 -5.413 1.00 0.00 O ATOM 645 CB SER A 47 -11.067 -2.434 -2.049 1.00 0.00 C ATOM 646 OG SER A 47 -11.727 -3.254 -1.098 1.00 0.00 O ATOM 0 H SER A 47 -8.931 -1.777 -3.116 1.00 0.00 H new ATOM 0 HA SER A 47 -10.236 -4.287 -2.746 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.321 -1.818 -1.547 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.785 -1.754 -2.508 1.00 0.00 H new ATOM 0 HG SER A 47 -12.148 -2.690 -0.416 1.00 0.00 H new ATOM 781 N VAL A 57 -8.432 -1.222 -14.066 1.00 0.00 N ATOM 782 CA VAL A 57 -7.154 -1.188 -13.366 1.00 0.00 C ATOM 783 C VAL A 57 -6.936 -2.468 -12.562 1.00 0.00 C ATOM 784 O VAL A 57 -7.717 -3.413 -12.659 1.00 0.00 O ATOM 785 CB VAL A 57 -7.071 0.024 -12.420 1.00 0.00 C ATOM 786 CG1 VAL A 57 -7.151 1.323 -13.207 1.00 0.00 C ATOM 787 CG2 VAL A 57 -8.171 -0.040 -11.368 1.00 0.00 C ATOM 0 HA VAL A 57 -6.374 -1.103 -14.123 1.00 0.00 H new ATOM 0 HB VAL A 57 -6.109 -0.005 -11.908 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -7.091 2.168 -12.521 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.324 1.371 -13.915 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.096 1.362 -13.749 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -8.095 0.825 -10.709 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.144 -0.038 -11.859 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.062 -0.953 -10.782 1.00 0.00 H new ATOM 797 N TRP A 58 -5.872 -2.489 -11.766 1.00 0.00 N ATOM 798 CA TRP A 58 -5.553 -3.650 -10.947 1.00 0.00 C ATOM 799 C TRP A 58 -6.381 -3.648 -9.664 1.00 0.00 C ATOM 800 O TRP A 58 -6.250 -2.751 -8.830 1.00 0.00 O ATOM 801 CB TRP A 58 -4.059 -3.660 -10.608 1.00 0.00 C ATOM 802 CG TRP A 58 -3.369 -4.924 -11.016 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.770 -6.198 -10.740 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.156 -5.037 -11.769 1.00 0.00 C ATOM 805 NE1 TRP A 58 -2.882 -7.099 -11.275 1.00 0.00 N ATOM 806 CE2 TRP A 58 -1.882 -6.410 -11.912 1.00 0.00 C ATOM 807 CE3 TRP A 58 -1.276 -4.112 -12.338 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -0.765 -6.880 -12.598 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -0.167 -4.579 -13.021 1.00 0.00 C ATOM 810 CH2 TRP A 58 0.079 -5.953 -13.147 1.00 0.00 C ATOM 0 H TRP A 58 -5.216 -1.714 -11.672 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.796 -4.549 -11.513 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.576 -2.815 -11.100 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -3.936 -3.517 -9.534 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.657 -6.460 -10.182 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -2.954 -8.114 -11.209 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -1.458 -3.051 -12.246 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -0.572 -7.938 -12.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 0.520 -3.873 -13.464 1.00 0.00 H new ATOM 0 HH2 TRP A 58 0.952 -6.287 -13.688 1.00 0.00 H new ATOM 821 N SER A 59 -7.234 -4.655 -9.516 1.00 0.00 N ATOM 822 CA SER A 59 -8.087 -4.770 -8.338 1.00 0.00 C ATOM 823 C SER A 59 -8.045 -6.186 -7.773 1.00 0.00 C ATOM 824 O SER A 59 -7.583 -7.115 -8.435 1.00 0.00 O ATOM 825 CB SER A 59 -9.526 -4.387 -8.685 1.00 0.00 C ATOM 826 OG SER A 59 -9.564 -3.470 -9.766 1.00 0.00 O ATOM 0 H SER A 59 -7.354 -5.404 -10.197 1.00 0.00 H new ATOM 0 HA SER A 59 -7.711 -4.085 -7.579 1.00 0.00 H new ATOM 0 HB2 SER A 59 -10.092 -5.282 -8.944 1.00 0.00 H new ATOM 0 HB3 SER A 59 -10.009 -3.946 -7.813 1.00 0.00 H new ATOM 0 HG SER A 59 -10.495 -3.242 -9.969 1.00 0.00 H new ATOM 832 N ILE A 60 -8.533 -6.346 -6.547 1.00 0.00 N ATOM 833 CA ILE A 60 -8.552 -7.652 -5.900 1.00 0.00 C ATOM 834 C ILE A 60 -9.522 -7.675 -4.722 1.00 0.00 C ATOM 835 O ILE A 60 -9.842 -6.634 -4.147 1.00 0.00 O ATOM 836 CB ILE A 60 -7.141 -8.059 -5.406 1.00 0.00 C ATOM 837 CG1 ILE A 60 -6.944 -9.572 -5.545 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.918 -7.615 -3.963 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.826 -10.125 -4.684 1.00 0.00 C ATOM 0 H ILE A 60 -8.920 -5.589 -5.983 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.886 -8.369 -6.650 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.402 -7.555 -6.029 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.875 -10.076 -5.283 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.737 -9.808 -6.589 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.920 -7.913 -3.641 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -7.012 -6.531 -3.897 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.662 -8.084 -3.319 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.748 -11.201 -4.837 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.885 -9.650 -4.960 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.040 -9.922 -3.635 1.00 0.00 H new ATOM 851 N ALA A 61 -9.966 -8.871 -4.356 1.00 0.00 N ATOM 852 CA ALA A 61 -10.878 -9.032 -3.234 1.00 0.00 C ATOM 853 C ALA A 61 -10.125 -8.870 -1.916 1.00 0.00 C ATOM 854 O ALA A 61 -8.992 -9.329 -1.779 1.00 0.00 O ATOM 855 CB ALA A 61 -11.559 -10.391 -3.300 1.00 0.00 C ATOM 0 H ALA A 61 -9.709 -9.742 -4.820 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.646 -8.260 -3.290 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.239 -10.499 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -12.121 -10.471 -4.230 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.806 -11.178 -3.262 1.00 0.00 H new ATOM 861 N SER A 62 -10.755 -8.205 -0.955 1.00 0.00 N ATOM 862 CA SER A 62 -10.135 -7.974 0.346 1.00 0.00 C ATOM 863 C SER A 62 -9.827 -9.287 1.066 1.00 0.00 C ATOM 864 O SER A 62 -9.064 -9.305 2.033 1.00 0.00 O ATOM 865 CB SER A 62 -11.041 -7.101 1.216 1.00 0.00 C ATOM 866 OG SER A 62 -10.309 -6.049 1.821 1.00 0.00 O ATOM 0 H SER A 62 -11.693 -7.816 -1.051 1.00 0.00 H new ATOM 0 HA SER A 62 -9.191 -7.457 0.174 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.844 -6.686 0.607 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.509 -7.713 1.987 1.00 0.00 H new ATOM 0 HG SER A 62 -10.911 -5.505 2.370 1.00 0.00 H new ATOM 872 N GLU A 63 -10.421 -10.381 0.600 1.00 0.00 N ATOM 873 CA GLU A 63 -10.202 -11.685 1.213 1.00 0.00 C ATOM 874 C GLU A 63 -8.960 -12.367 0.639 1.00 0.00 C ATOM 875 O GLU A 63 -8.427 -13.302 1.238 1.00 0.00 O ATOM 876 CB GLU A 63 -11.427 -12.581 1.012 1.00 0.00 C ATOM 877 CG GLU A 63 -11.963 -12.571 -0.411 1.00 0.00 C ATOM 878 CD GLU A 63 -12.575 -13.898 -0.812 1.00 0.00 C ATOM 879 OE1 GLU A 63 -12.073 -14.945 -0.356 1.00 0.00 O ATOM 880 OE2 GLU A 63 -13.558 -13.889 -1.584 1.00 0.00 O ATOM 0 H GLU A 63 -11.056 -10.390 -0.198 1.00 0.00 H new ATOM 0 HA GLU A 63 -10.043 -11.528 2.280 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -11.167 -13.604 1.286 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.217 -12.260 1.691 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.712 -11.785 -0.508 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.154 -12.326 -1.099 1.00 0.00 H new ATOM 887 N LEU A 64 -8.506 -11.902 -0.522 1.00 0.00 N ATOM 888 CA LEU A 64 -7.336 -12.475 -1.164 1.00 0.00 C ATOM 889 C LEU A 64 -6.064 -11.718 -0.789 1.00 0.00 C ATOM 890 O LEU A 64 -4.979 -12.042 -1.272 1.00 0.00 O ATOM 891 CB LEU A 64 -7.514 -12.464 -2.681 1.00 0.00 C ATOM 892 CG LEU A 64 -8.961 -12.486 -3.169 1.00 0.00 C ATOM 893 CD1 LEU A 64 -9.015 -12.526 -4.688 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.700 -13.673 -2.577 1.00 0.00 C ATOM 0 H LEU A 64 -8.933 -11.130 -1.034 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.234 -13.502 -0.814 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.027 -11.575 -3.081 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.994 -13.327 -3.097 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.451 -11.571 -2.835 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.055 -12.541 -5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.520 -11.643 -5.093 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.509 -13.422 -5.047 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.730 -13.675 -2.934 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.208 -14.597 -2.882 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.693 -13.600 -1.489 1.00 0.00 H new ATOM 906 N ILE A 65 -6.199 -10.709 0.066 1.00 0.00 N ATOM 907 CA ILE A 65 -5.052 -9.916 0.485 1.00 0.00 C ATOM 908 C ILE A 65 -4.135 -10.711 1.409 1.00 0.00 C ATOM 909 O ILE A 65 -2.965 -10.934 1.099 1.00 0.00 O ATOM 910 CB ILE A 65 -5.492 -8.624 1.200 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.538 -7.884 0.364 1.00 0.00 C ATOM 912 CG2 ILE A 65 -4.290 -7.732 1.469 1.00 0.00 C ATOM 913 CD1 ILE A 65 -7.007 -6.589 0.990 1.00 0.00 C ATOM 0 H ILE A 65 -7.087 -10.423 0.479 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.505 -9.653 -0.421 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.942 -8.890 2.156 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -6.121 -7.672 -0.620 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.398 -8.537 0.212 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.617 -6.823 1.974 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.578 -8.262 2.101 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.813 -7.470 0.525 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.747 -6.119 0.342 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.454 -6.796 1.962 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.158 -5.918 1.117 1.00 0.00 H new ATOM 925 N GLU A 66 -4.673 -11.133 2.548 1.00 0.00 N ATOM 926 CA GLU A 66 -3.905 -11.899 3.519 1.00 0.00 C ATOM 927 C GLU A 66 -3.470 -13.250 2.954 1.00 0.00 C ATOM 928 O GLU A 66 -2.580 -13.901 3.503 1.00 0.00 O ATOM 929 CB GLU A 66 -4.734 -12.110 4.789 1.00 0.00 C ATOM 930 CG GLU A 66 -6.162 -12.551 4.517 1.00 0.00 C ATOM 931 CD GLU A 66 -6.794 -13.244 5.707 1.00 0.00 C ATOM 932 OE1 GLU A 66 -6.525 -14.448 5.904 1.00 0.00 O ATOM 933 OE2 GLU A 66 -7.559 -12.585 6.443 1.00 0.00 O ATOM 0 H GLU A 66 -5.640 -10.956 2.821 1.00 0.00 H new ATOM 0 HA GLU A 66 -3.006 -11.330 3.757 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.244 -12.858 5.412 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.752 -11.181 5.360 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.762 -11.682 4.247 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.173 -13.225 3.660 1.00 0.00 H new ATOM 940 N LYS A 67 -4.100 -13.673 1.863 1.00 0.00 N ATOM 941 CA LYS A 67 -3.772 -14.953 1.242 1.00 0.00 C ATOM 942 C LYS A 67 -2.851 -14.767 0.037 1.00 0.00 C ATOM 943 O LYS A 67 -1.764 -15.344 -0.018 1.00 0.00 O ATOM 944 CB LYS A 67 -5.049 -15.676 0.814 1.00 0.00 C ATOM 945 CG LYS A 67 -6.074 -15.812 1.929 1.00 0.00 C ATOM 946 CD LYS A 67 -6.413 -17.269 2.205 1.00 0.00 C ATOM 947 CE LYS A 67 -7.568 -17.746 1.341 1.00 0.00 C ATOM 948 NZ LYS A 67 -7.706 -19.228 1.365 1.00 0.00 N ATOM 0 H LYS A 67 -4.838 -13.151 1.391 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.246 -15.557 1.981 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.500 -15.137 -0.019 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.789 -16.669 0.448 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.688 -15.350 2.837 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.981 -15.272 1.658 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.537 -17.889 2.017 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.670 -17.391 3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.494 -17.290 1.690 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.415 -17.412 0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.505 -19.512 0.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.832 -19.664 1.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.878 -19.545 2.341 1.00 0.00 H new ATOM 962 N ARG A 68 -3.295 -13.968 -0.927 1.00 0.00 N ATOM 963 CA ARG A 68 -2.514 -13.718 -2.134 1.00 0.00 C ATOM 964 C ARG A 68 -1.509 -12.592 -1.920 1.00 0.00 C ATOM 965 O ARG A 68 -0.298 -12.806 -1.996 1.00 0.00 O ATOM 966 CB ARG A 68 -3.438 -13.383 -3.304 1.00 0.00 C ATOM 967 CG ARG A 68 -4.598 -14.352 -3.458 1.00 0.00 C ATOM 968 CD ARG A 68 -5.324 -14.150 -4.778 1.00 0.00 C ATOM 969 NE ARG A 68 -6.376 -15.143 -4.983 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.143 -16.428 -5.234 1.00 0.00 C ATOM 971 NH1 ARG A 68 -4.899 -16.883 -5.316 1.00 0.00 N ATOM 972 NH2 ARG A 68 -7.159 -17.265 -5.404 1.00 0.00 N ATOM 0 H ARG A 68 -4.191 -13.482 -0.897 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.959 -14.627 -2.367 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.832 -12.376 -3.168 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.856 -13.376 -4.226 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -4.228 -15.376 -3.398 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.297 -14.217 -2.633 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.759 -13.151 -4.803 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.608 -14.206 -5.598 1.00 0.00 H new ATOM 0 HE ARG A 68 -7.346 -14.832 -4.931 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.113 -16.246 -5.186 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.729 -17.870 -5.509 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -8.118 -16.922 -5.342 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -6.981 -18.251 -5.597 1.00 0.00 H new ATOM 986 N CYS A 69 -2.013 -11.390 -1.659 1.00 0.00 N ATOM 987 CA CYS A 69 -1.153 -10.233 -1.439 1.00 0.00 C ATOM 988 C CYS A 69 -0.163 -10.496 -0.308 1.00 0.00 C ATOM 989 O CYS A 69 -0.526 -11.042 0.734 1.00 0.00 O ATOM 990 CB CYS A 69 -1.995 -8.996 -1.119 1.00 0.00 C ATOM 991 SG CYS A 69 -3.151 -8.532 -2.430 1.00 0.00 S ATOM 0 H CYS A 69 -3.012 -11.192 -1.595 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.590 -10.053 -2.355 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.556 -9.178 -0.202 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -1.328 -8.156 -0.923 1.00 0.00 H new ATOM 0 HG CYS A 69 -4.195 -7.962 -1.906 1.00 0.00 H new ATOM 997 N ARG A 70 1.090 -10.109 -0.522 1.00 0.00 N ATOM 998 CA ARG A 70 2.132 -10.309 0.477 1.00 0.00 C ATOM 999 C ARG A 70 2.400 -9.025 1.257 1.00 0.00 C ATOM 1000 O ARG A 70 2.437 -9.032 2.489 1.00 0.00 O ATOM 1001 CB ARG A 70 3.421 -10.798 -0.191 1.00 0.00 C ATOM 1002 CG ARG A 70 3.937 -12.111 0.373 1.00 0.00 C ATOM 1003 CD ARG A 70 5.138 -11.895 1.280 1.00 0.00 C ATOM 1004 NE ARG A 70 6.093 -12.996 1.195 1.00 0.00 N ATOM 1005 CZ ARG A 70 5.913 -14.181 1.775 1.00 0.00 C ATOM 1006 NH1 ARG A 70 4.816 -14.421 2.484 1.00 0.00 N ATOM 1007 NH2 ARG A 70 6.831 -15.129 1.646 1.00 0.00 N ATOM 0 H ARG A 70 1.408 -9.655 -1.378 1.00 0.00 H new ATOM 0 HA ARG A 70 1.785 -11.067 1.179 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.244 -10.916 -1.260 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.191 -10.035 -0.077 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.142 -12.605 0.932 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.213 -12.776 -0.445 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.634 -10.963 1.009 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.799 -11.788 2.310 1.00 0.00 H new ATOM 0 HE ARG A 70 6.949 -12.849 0.660 1.00 0.00 H new ATOM 0 HH11 ARG A 70 4.106 -13.696 2.586 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.683 -15.331 2.926 1.00 0.00 H new ATOM 0 HH21 ARG A 70 7.675 -14.951 1.102 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.693 -16.037 2.090 1.00 0.00 H new ATOM 1021 N ARG A 71 2.588 -7.922 0.537 1.00 0.00 N ATOM 1022 CA ARG A 71 2.853 -6.634 1.171 1.00 0.00 C ATOM 1023 C ARG A 71 1.659 -5.693 1.032 1.00 0.00 C ATOM 1024 O ARG A 71 0.828 -5.845 0.134 1.00 0.00 O ATOM 1025 CB ARG A 71 4.111 -5.980 0.581 1.00 0.00 C ATOM 1026 CG ARG A 71 4.459 -6.448 -0.826 1.00 0.00 C ATOM 1027 CD ARG A 71 5.080 -7.837 -0.817 1.00 0.00 C ATOM 1028 NE ARG A 71 6.347 -7.879 -1.541 1.00 0.00 N ATOM 1029 CZ ARG A 71 6.782 -8.939 -2.221 1.00 0.00 C ATOM 1030 NH1 ARG A 71 6.057 -10.051 -2.275 1.00 0.00 N ATOM 1031 NH2 ARG A 71 7.950 -8.891 -2.845 1.00 0.00 N ATOM 0 H ARG A 71 2.562 -7.894 -0.482 1.00 0.00 H new ATOM 0 HA ARG A 71 3.022 -6.821 2.232 1.00 0.00 H new ATOM 0 HB2 ARG A 71 3.972 -4.899 0.568 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.956 -6.185 1.239 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.559 -6.455 -1.441 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.152 -5.742 -1.284 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.241 -8.154 0.213 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.384 -8.547 -1.264 1.00 0.00 H new ATOM 0 HE ARG A 71 6.935 -7.046 -1.525 1.00 0.00 H new ATOM 0 HH11 ARG A 71 5.159 -10.098 -1.793 1.00 0.00 H new ATOM 0 HH12 ARG A 71 6.398 -10.857 -2.798 1.00 0.00 H new ATOM 0 HH21 ARG A 71 8.515 -8.043 -2.805 1.00 0.00 H new ATOM 0 HH22 ARG A 71 8.284 -9.702 -3.366 1.00 0.00 H new ATOM 1045 N MET A 72 1.577 -4.720 1.930 1.00 0.00 N ATOM 1046 CA MET A 72 0.488 -3.756 1.915 1.00 0.00 C ATOM 1047 C MET A 72 1.025 -2.334 1.789 1.00 0.00 C ATOM 1048 O MET A 72 2.076 -2.002 2.339 1.00 0.00 O ATOM 1049 CB MET A 72 -0.350 -3.892 3.187 1.00 0.00 C ATOM 1050 CG MET A 72 -1.478 -2.880 3.292 1.00 0.00 C ATOM 1051 SD MET A 72 -2.845 -3.245 2.173 1.00 0.00 S ATOM 1052 CE MET A 72 -3.198 -4.944 2.611 1.00 0.00 C ATOM 0 H MET A 72 2.254 -4.578 2.679 1.00 0.00 H new ATOM 0 HA MET A 72 -0.142 -3.962 1.050 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.771 -4.896 3.227 1.00 0.00 H new ATOM 0 HB3 MET A 72 0.303 -3.785 4.053 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.848 -2.859 4.317 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.090 -1.885 3.073 1.00 0.00 H new ATOM 0 HE1 MET A 72 -4.257 -5.148 2.451 1.00 0.00 H new ATOM 0 HE2 MET A 72 -2.602 -5.612 1.989 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.951 -5.108 3.660 1.00 0.00 H new ATOM 1062 N VAL A 73 0.291 -1.496 1.067 1.00 0.00 N ATOM 1063 CA VAL A 73 0.685 -0.110 0.872 1.00 0.00 C ATOM 1064 C VAL A 73 -0.404 0.824 1.378 1.00 0.00 C ATOM 1065 O VAL A 73 -1.367 1.114 0.669 1.00 0.00 O ATOM 1066 CB VAL A 73 0.964 0.188 -0.613 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.487 1.606 -0.787 1.00 0.00 C ATOM 1068 CG2 VAL A 73 1.946 -0.825 -1.182 1.00 0.00 C ATOM 0 H VAL A 73 -0.582 -1.755 0.607 1.00 0.00 H new ATOM 0 HA VAL A 73 1.602 0.056 1.438 1.00 0.00 H new ATOM 0 HB VAL A 73 0.028 0.104 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.678 1.796 -1.843 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.746 2.315 -0.419 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.413 1.724 -0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.133 -0.601 -2.232 1.00 0.00 H new ATOM 0 HG22 VAL A 73 2.883 -0.774 -0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.527 -1.827 -1.094 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.252 1.280 2.614 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.230 2.169 3.219 1.00 0.00 C ATOM 1080 C VAL A 74 -0.900 3.628 2.943 1.00 0.00 C ATOM 1081 O VAL A 74 0.262 4.029 2.982 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.318 1.956 4.743 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.523 2.683 5.315 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -1.373 0.472 5.075 1.00 0.00 C ATOM 0 H VAL A 74 0.539 1.048 3.215 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.192 1.927 2.767 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.421 2.372 5.201 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.568 2.521 6.392 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.434 3.750 5.112 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.432 2.300 4.852 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.435 0.343 6.156 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.250 0.026 4.606 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.474 -0.018 4.702 1.00 0.00 H new ATOM 1094 N VAL A 75 -1.929 4.416 2.669 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.749 5.835 2.396 1.00 0.00 C ATOM 1096 C VAL A 75 -2.425 6.672 3.480 1.00 0.00 C ATOM 1097 O VAL A 75 -3.617 6.965 3.400 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.317 6.214 1.012 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.273 7.720 0.794 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.556 5.490 -0.088 1.00 0.00 C ATOM 0 H VAL A 75 -2.897 4.097 2.630 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.679 6.042 2.395 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.361 5.903 0.977 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.679 7.957 -0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.867 8.216 1.562 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.241 8.066 0.853 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.968 5.767 -1.058 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.503 5.770 -0.047 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.651 4.413 0.052 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.656 7.038 4.503 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.181 7.822 5.615 1.00 0.00 C ATOM 1112 C VAL A 76 -2.263 9.306 5.271 1.00 0.00 C ATOM 1113 O VAL A 76 -1.294 10.049 5.425 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.324 7.644 6.883 1.00 0.00 C ATOM 1115 CG1 VAL A 76 0.106 8.104 6.640 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -1.944 8.390 8.057 1.00 0.00 C ATOM 0 H VAL A 76 -0.667 6.803 4.584 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.187 7.449 5.807 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.296 6.583 7.131 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.691 7.969 7.549 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.546 7.516 5.835 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.107 9.158 6.362 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.325 8.253 8.943 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.008 9.452 7.820 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.944 8.000 8.249 1.00 0.00 H new ATOM 1126 N SER A 77 -3.435 9.731 4.817 1.00 0.00 N ATOM 1127 CA SER A 77 -3.658 11.126 4.466 1.00 0.00 C ATOM 1128 C SER A 77 -4.927 11.651 5.128 1.00 0.00 C ATOM 1129 O SER A 77 -5.846 10.886 5.420 1.00 0.00 O ATOM 1130 CB SER A 77 -3.754 11.282 2.946 1.00 0.00 C ATOM 1131 OG SER A 77 -5.070 11.023 2.485 1.00 0.00 O ATOM 0 H SER A 77 -4.247 9.128 4.683 1.00 0.00 H new ATOM 0 HA SER A 77 -2.812 11.710 4.828 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.459 12.292 2.662 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.056 10.598 2.463 1.00 0.00 H new ATOM 0 HG SER A 77 -5.047 10.820 1.526 1.00 0.00 H new ATOM 1137 N ASP A 78 -4.971 12.959 5.362 1.00 0.00 N ATOM 1138 CA ASP A 78 -6.131 13.600 5.987 1.00 0.00 C ATOM 1139 C ASP A 78 -7.449 13.050 5.440 1.00 0.00 C ATOM 1140 O ASP A 78 -8.384 12.775 6.192 1.00 0.00 O ATOM 1141 CB ASP A 78 -6.080 15.110 5.738 1.00 0.00 C ATOM 1142 CG ASP A 78 -5.731 15.891 6.985 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.838 15.444 7.731 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -6.353 16.949 7.218 1.00 0.00 O ATOM 0 H ASP A 78 -4.214 13.602 5.128 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.089 13.387 7.055 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.344 15.322 4.962 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.046 15.446 5.361 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.514 12.926 4.121 1.00 0.00 N ATOM 1150 CA ASP A 79 -8.714 12.442 3.440 1.00 0.00 C ATOM 1151 C ASP A 79 -8.928 10.937 3.612 1.00 0.00 C ATOM 1152 O ASP A 79 -10.002 10.421 3.305 1.00 0.00 O ATOM 1153 CB ASP A 79 -8.637 12.781 1.951 1.00 0.00 C ATOM 1154 CG ASP A 79 -9.066 14.205 1.658 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -8.236 15.123 1.831 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -10.233 14.403 1.255 1.00 0.00 O ATOM 0 H ASP A 79 -6.743 13.156 3.494 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.565 12.944 3.901 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -7.616 12.633 1.600 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.269 12.092 1.391 1.00 0.00 H new ATOM 1161 N TYR A 80 -7.912 10.233 4.099 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.015 8.790 4.300 1.00 0.00 C ATOM 1163 C TYR A 80 -8.487 8.475 5.711 1.00 0.00 C ATOM 1164 O TYR A 80 -9.140 7.460 5.948 1.00 0.00 O ATOM 1165 CB TYR A 80 -6.666 8.120 4.043 1.00 0.00 C ATOM 1166 CG TYR A 80 -6.715 6.610 4.100 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -7.479 5.887 3.194 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -5.999 5.908 5.062 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -7.529 4.506 3.243 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -6.043 4.527 5.117 1.00 0.00 C ATOM 1171 CZ TYR A 80 -6.808 3.831 4.206 1.00 0.00 C ATOM 1172 OH TYR A 80 -6.854 2.457 4.258 1.00 0.00 O ATOM 0 H TYR A 80 -7.012 10.634 4.361 1.00 0.00 H new ATOM 0 HA TYR A 80 -8.747 8.400 3.592 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.300 8.426 3.063 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -5.946 8.479 4.779 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -8.044 6.412 2.438 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.399 6.450 5.778 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -8.129 3.959 2.531 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.480 3.996 5.871 1.00 0.00 H new ATOM 0 HH TYR A 80 -5.951 2.095 4.139 1.00 0.00 H new ATOM 1182 N LEU A 81 -8.148 9.354 6.644 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.526 9.179 8.031 1.00 0.00 C ATOM 1184 C LEU A 81 -9.965 9.621 8.261 1.00 0.00 C ATOM 1185 O LEU A 81 -10.710 8.984 9.008 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.589 9.985 8.919 1.00 0.00 C ATOM 1187 CG LEU A 81 -6.131 9.535 8.898 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -5.195 10.683 9.243 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.929 8.396 9.866 1.00 0.00 C ATOM 0 H LEU A 81 -7.608 10.199 6.459 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.449 8.121 8.282 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.635 11.031 8.615 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.954 9.936 9.945 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.895 9.198 7.889 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.164 10.331 9.220 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.321 11.486 8.517 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.429 11.056 10.240 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.886 8.081 9.845 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -6.189 8.724 10.873 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.567 7.559 9.581 1.00 0.00 H new ATOM 1201 N GLN A 82 -10.351 10.714 7.612 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.696 11.246 7.738 1.00 0.00 C ATOM 1203 C GLN A 82 -12.742 10.186 7.400 1.00 0.00 C ATOM 1204 O GLN A 82 -13.898 10.291 7.809 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.864 12.457 6.823 1.00 0.00 C ATOM 1206 CG GLN A 82 -11.671 12.136 5.349 1.00 0.00 C ATOM 1207 CD GLN A 82 -12.116 13.268 4.444 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -11.355 14.356 4.439 1.00 0.00 O flip ATOM 1209 NE2 GLN A 82 -13.132 13.164 3.756 1.00 0.00 N flip ATOM 0 H GLN A 82 -9.745 11.249 6.990 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.846 11.551 8.774 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.860 12.876 6.968 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -11.149 13.226 7.116 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.619 11.919 5.163 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -12.232 11.235 5.100 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -13.687 12.309 3.792 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -13.419 13.933 3.150 1.00 0.00 H new ATOM 1218 N SER A 83 -12.330 9.163 6.655 1.00 0.00 N ATOM 1219 CA SER A 83 -13.233 8.090 6.266 1.00 0.00 C ATOM 1220 C SER A 83 -13.141 6.922 7.242 1.00 0.00 C ATOM 1221 O SER A 83 -12.075 6.635 7.786 1.00 0.00 O ATOM 1222 CB SER A 83 -12.907 7.612 4.849 1.00 0.00 C ATOM 1223 OG SER A 83 -14.072 7.144 4.190 1.00 0.00 O ATOM 0 H SER A 83 -11.376 9.057 6.310 1.00 0.00 H new ATOM 0 HA SER A 83 -14.251 8.478 6.287 1.00 0.00 H new ATOM 0 HB2 SER A 83 -12.465 8.429 4.278 1.00 0.00 H new ATOM 0 HB3 SER A 83 -12.164 6.815 4.892 1.00 0.00 H new ATOM 0 HG SER A 83 -13.924 7.148 3.221 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.267 6.247 7.456 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.314 5.108 8.362 1.00 0.00 C ATOM 1231 C LYS A 84 -13.604 3.902 7.757 1.00 0.00 C ATOM 1232 O LYS A 84 -13.241 2.963 8.466 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.765 4.752 8.685 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.363 5.587 9.806 1.00 0.00 C ATOM 1235 CD LYS A 84 -16.275 7.075 9.507 1.00 0.00 C ATOM 1236 CE LYS A 84 -17.177 7.466 8.347 1.00 0.00 C ATOM 1237 NZ LYS A 84 -18.582 7.688 8.787 1.00 0.00 N ATOM 0 H LYS A 84 -15.158 6.471 7.013 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.800 5.383 9.283 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.370 4.879 7.787 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.819 3.699 8.960 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -17.406 5.306 9.952 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -15.841 5.372 10.738 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -16.556 7.642 10.394 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -15.244 7.339 9.272 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.795 8.374 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -17.153 6.683 7.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -19.165 7.953 7.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -18.956 6.814 9.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -18.608 8.452 9.492 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.404 3.934 6.441 1.00 0.00 N ATOM 1252 CA GLU A 85 -12.732 2.844 5.749 1.00 0.00 C ATOM 1253 C GLU A 85 -11.331 2.639 6.311 1.00 0.00 C ATOM 1254 O GLU A 85 -10.818 1.521 6.338 1.00 0.00 O ATOM 1255 CB GLU A 85 -12.661 3.126 4.246 1.00 0.00 C ATOM 1256 CG GLU A 85 -12.147 4.517 3.914 1.00 0.00 C ATOM 1257 CD GLU A 85 -11.555 4.599 2.521 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -12.325 4.812 1.561 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -10.322 4.452 2.389 1.00 0.00 O ATOM 0 H GLU A 85 -13.698 4.702 5.837 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.308 1.932 5.906 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.013 2.386 3.776 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -13.654 3.001 3.814 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.964 5.233 4.001 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.391 4.806 4.644 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.722 3.730 6.768 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.385 3.671 7.341 1.00 0.00 C ATOM 1268 C CYS A 86 -9.448 3.169 8.778 1.00 0.00 C ATOM 1269 O CYS A 86 -8.537 2.488 9.247 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.723 5.050 7.290 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.085 5.117 8.057 1.00 0.00 S ATOM 0 H CYS A 86 -11.134 4.663 6.752 1.00 0.00 H new ATOM 0 HA CYS A 86 -8.786 2.975 6.754 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -8.637 5.361 6.249 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.373 5.771 7.785 1.00 0.00 H new ATOM 0 HG CYS A 86 -6.176 5.205 7.132 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.535 3.502 9.472 1.00 0.00 N ATOM 1278 CA ASP A 87 -10.714 3.073 10.853 1.00 0.00 C ATOM 1279 C ASP A 87 -10.733 1.554 10.933 1.00 0.00 C ATOM 1280 O ASP A 87 -10.125 0.959 11.822 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.007 3.653 11.430 1.00 0.00 C ATOM 1282 CG ASP A 87 -11.746 4.661 12.533 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -11.475 5.837 12.210 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -11.813 4.276 13.719 1.00 0.00 O ATOM 0 H ASP A 87 -11.300 4.065 9.101 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.876 3.444 11.444 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.576 4.130 10.632 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.623 2.843 11.820 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.420 0.932 9.982 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.503 -0.520 9.928 1.00 0.00 C ATOM 1291 C PHE A 88 -10.163 -1.092 9.485 1.00 0.00 C ATOM 1292 O PHE A 88 -9.680 -2.080 10.038 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.608 -0.956 8.966 1.00 0.00 C ATOM 1294 CG PHE A 88 -12.926 -2.422 9.042 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -13.719 -2.919 10.065 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.434 -3.303 8.092 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -14.014 -4.269 10.137 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -12.724 -4.652 8.160 1.00 0.00 C ATOM 1299 CZ PHE A 88 -13.516 -5.135 9.184 1.00 0.00 C ATOM 0 H PHE A 88 -11.927 1.412 9.238 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.744 -0.899 10.921 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.511 -0.385 9.180 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.310 -0.710 7.947 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -14.110 -2.246 10.813 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.816 -2.930 7.288 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -14.633 -4.645 10.938 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.332 -5.328 7.414 1.00 0.00 H new ATOM 0 HZ PHE A 88 -13.745 -6.189 9.239 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.561 -0.443 8.493 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.265 -0.864 7.983 1.00 0.00 C ATOM 1311 C GLN A 89 -7.228 -0.796 9.095 1.00 0.00 C ATOM 1312 O GLN A 89 -6.316 -1.615 9.158 1.00 0.00 O ATOM 1313 CB GLN A 89 -7.836 0.019 6.810 1.00 0.00 C ATOM 1314 CG GLN A 89 -6.543 -0.430 6.151 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.521 0.687 6.043 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -4.992 0.958 4.966 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -5.239 1.342 7.165 1.00 0.00 N ATOM 0 H GLN A 89 -9.952 0.376 8.028 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.345 -1.892 7.629 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.630 0.028 6.064 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.718 1.044 7.162 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -6.116 -1.254 6.723 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.762 -0.814 5.155 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -5.702 1.084 8.036 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -4.560 2.103 7.154 1.00 0.00 H new ATOM 1326 N THR A 90 -7.394 0.182 9.981 1.00 0.00 N ATOM 1327 CA THR A 90 -6.496 0.362 11.110 1.00 0.00 C ATOM 1328 C THR A 90 -6.564 -0.829 12.039 1.00 0.00 C ATOM 1329 O THR A 90 -5.587 -1.543 12.193 1.00 0.00 O ATOM 1330 CB THR A 90 -6.847 1.642 11.868 1.00 0.00 C ATOM 1331 OG1 THR A 90 -6.837 2.760 10.999 1.00 0.00 O ATOM 1332 CG2 THR A 90 -5.898 1.942 13.006 1.00 0.00 C ATOM 0 H THR A 90 -8.150 0.866 9.935 1.00 0.00 H new ATOM 0 HA THR A 90 -5.478 0.446 10.729 1.00 0.00 H new ATOM 0 HB THR A 90 -7.842 1.469 12.279 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.730 2.883 10.613 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.204 2.863 13.502 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.918 1.121 13.722 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.887 2.059 12.616 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.717 -1.046 12.654 1.00 0.00 N ATOM 1341 CA LYS A 91 -7.877 -2.165 13.577 1.00 0.00 C ATOM 1342 C LYS A 91 -7.359 -3.463 12.971 1.00 0.00 C ATOM 1343 O LYS A 91 -6.912 -4.356 13.689 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.342 -2.321 13.989 1.00 0.00 C ATOM 1345 CG LYS A 91 -9.728 -1.485 15.198 1.00 0.00 C ATOM 1346 CD LYS A 91 -9.811 -0.008 14.851 1.00 0.00 C ATOM 1347 CE LYS A 91 -10.196 0.827 16.061 1.00 0.00 C ATOM 1348 NZ LYS A 91 -11.672 0.902 16.238 1.00 0.00 N ATOM 0 H LYS A 91 -8.550 -0.469 12.534 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.284 -1.946 14.465 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.978 -2.044 13.148 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.540 -3.371 14.206 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.690 -1.824 15.584 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.996 -1.633 15.992 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -8.850 0.331 14.465 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.543 0.140 14.057 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -9.745 0.399 16.956 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.792 1.833 15.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.892 1.480 17.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.101 1.334 15.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.055 -0.056 16.369 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.407 -3.559 11.651 1.00 0.00 N ATOM 1363 CA PHE A 92 -6.923 -4.748 10.967 1.00 0.00 C ATOM 1364 C PHE A 92 -5.460 -4.578 10.569 1.00 0.00 C ATOM 1365 O PHE A 92 -4.734 -5.557 10.395 1.00 0.00 O ATOM 1366 CB PHE A 92 -7.777 -5.041 9.732 1.00 0.00 C ATOM 1367 CG PHE A 92 -8.022 -6.506 9.503 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -7.048 -7.302 8.922 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -9.226 -7.087 9.869 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -7.270 -8.649 8.709 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -9.453 -8.433 9.660 1.00 0.00 C ATOM 1372 CZ PHE A 92 -8.473 -9.216 9.079 1.00 0.00 C ATOM 0 H PHE A 92 -7.774 -2.833 11.036 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.001 -5.592 11.652 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -8.736 -4.533 9.835 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.286 -4.622 8.854 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.104 -6.864 8.632 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -9.995 -6.480 10.323 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.503 -9.258 8.253 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -10.395 -8.874 9.950 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.648 -10.269 8.915 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.035 -3.326 10.427 1.00 0.00 N ATOM 1383 CA ALA A 93 -3.661 -3.020 10.050 1.00 0.00 C ATOM 1384 C ALA A 93 -2.769 -2.834 11.274 1.00 0.00 C ATOM 1385 O ALA A 93 -1.560 -3.058 11.212 1.00 0.00 O ATOM 1386 CB ALA A 93 -3.619 -1.776 9.179 1.00 0.00 C ATOM 0 H ALA A 93 -5.625 -2.506 10.568 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.277 -3.869 9.484 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.587 -1.559 8.905 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.207 -1.944 8.277 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.033 -0.932 9.730 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.370 -2.421 12.387 1.00 0.00 N ATOM 1393 CA LEU A 94 -2.633 -2.202 13.617 1.00 0.00 C ATOM 1394 C LEU A 94 -2.468 -3.508 14.366 1.00 0.00 C ATOM 1395 O LEU A 94 -1.379 -3.863 14.815 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.370 -1.185 14.481 1.00 0.00 C ATOM 1397 CG LEU A 94 -4.841 -1.487 14.792 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -4.965 -2.411 15.981 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -5.606 -0.195 15.046 1.00 0.00 C ATOM 0 H LEU A 94 -4.370 -2.232 12.457 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.643 -1.814 13.378 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.835 -1.089 15.426 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.319 -0.216 13.985 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.273 -1.987 13.926 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.018 -2.609 16.180 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.454 -3.350 15.767 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.513 -1.942 16.855 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.648 -0.426 15.265 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.164 0.329 15.894 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.554 0.439 14.161 1.00 0.00 H new ATOM 1411 N SER A 95 -3.573 -4.211 14.481 1.00 0.00 N ATOM 1412 CA SER A 95 -3.606 -5.499 15.165 1.00 0.00 C ATOM 1413 C SER A 95 -3.875 -6.622 14.170 1.00 0.00 C ATOM 1414 O SER A 95 -4.836 -7.379 14.309 1.00 0.00 O ATOM 1415 CB SER A 95 -4.675 -5.504 16.262 1.00 0.00 C ATOM 1416 OG SER A 95 -5.976 -5.442 15.708 1.00 0.00 O ATOM 0 H SER A 95 -4.474 -3.914 14.107 1.00 0.00 H new ATOM 0 HA SER A 95 -2.633 -5.662 15.628 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.576 -6.406 16.866 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.520 -4.656 16.929 1.00 0.00 H new ATOM 0 HG SER A 95 -5.991 -4.784 14.982 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.015 -6.719 13.163 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.152 -7.748 12.135 1.00 0.00 C ATOM 1424 C LEU A 96 -2.587 -9.079 12.620 1.00 0.00 C ATOM 1425 O LEU A 96 -3.329 -9.963 13.049 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.462 -7.332 10.824 1.00 0.00 C ATOM 1427 CG LEU A 96 -1.715 -5.996 10.850 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.366 -6.146 11.538 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -1.532 -5.471 9.437 1.00 0.00 C ATOM 0 H LEU A 96 -2.215 -6.099 13.035 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.217 -7.867 11.937 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.756 -8.114 10.545 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.216 -7.288 10.038 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.309 -5.280 11.417 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.148 -5.185 11.545 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.516 -6.485 12.563 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.238 -6.876 10.999 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.000 -4.520 9.468 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.957 -6.190 8.853 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.508 -5.325 8.974 1.00 0.00 H new ATOM 1441 N SER A 97 -1.267 -9.216 12.546 1.00 0.00 N ATOM 1442 CA SER A 97 -0.596 -10.437 12.972 1.00 0.00 C ATOM 1443 C SER A 97 0.395 -10.151 14.099 1.00 0.00 C ATOM 1444 O SER A 97 0.622 -8.995 14.457 1.00 0.00 O ATOM 1445 CB SER A 97 0.127 -11.084 11.788 1.00 0.00 C ATOM 1446 OG SER A 97 -0.307 -12.418 11.592 1.00 0.00 O ATOM 0 H SER A 97 -0.640 -8.493 12.194 1.00 0.00 H new ATOM 0 HA SER A 97 -1.352 -11.127 13.348 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.056 -10.502 10.884 1.00 0.00 H new ATOM 0 HB3 SER A 97 1.203 -11.070 11.963 1.00 0.00 H new ATOM 0 HG SER A 97 0.169 -12.808 10.829 1.00 0.00 H new ATOM 1452 N PRO A 98 0.996 -11.205 14.673 1.00 0.00 N ATOM 1453 CA PRO A 98 1.960 -11.069 15.765 1.00 0.00 C ATOM 1454 C PRO A 98 3.367 -10.748 15.267 1.00 0.00 C ATOM 1455 O PRO A 98 4.289 -11.548 15.424 1.00 0.00 O ATOM 1456 CB PRO A 98 1.922 -12.449 16.412 1.00 0.00 C ATOM 1457 CG PRO A 98 1.648 -13.380 15.281 1.00 0.00 C ATOM 1458 CD PRO A 98 0.778 -12.621 14.310 1.00 0.00 C ATOM 0 HA PRO A 98 1.713 -10.249 16.439 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.867 -12.685 16.901 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.145 -12.510 17.174 1.00 0.00 H new ATOM 0 HG2 PRO A 98 2.576 -13.698 14.805 1.00 0.00 H new ATOM 0 HG3 PRO A 98 1.145 -14.281 15.632 1.00 0.00 H new ATOM 0 HD2 PRO A 98 1.065 -12.818 13.277 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.271 -12.902 14.408 1.00 0.00 H new ATOM 1466 N GLY A 99 3.528 -9.572 14.667 1.00 0.00 N ATOM 1467 CA GLY A 99 4.827 -9.171 14.162 1.00 0.00 C ATOM 1468 C GLY A 99 4.771 -8.675 12.729 1.00 0.00 C ATOM 1469 O GLY A 99 5.626 -9.019 11.913 1.00 0.00 O ATOM 0 H GLY A 99 2.782 -8.891 14.522 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.233 -8.385 14.799 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.513 -10.016 14.223 1.00 0.00 H new ATOM 1473 N ALA A 100 3.764 -7.864 12.424 1.00 0.00 N ATOM 1474 CA ALA A 100 3.604 -7.319 11.080 1.00 0.00 C ATOM 1475 C ALA A 100 2.971 -5.932 11.120 1.00 0.00 C ATOM 1476 O ALA A 100 2.041 -5.642 10.367 1.00 0.00 O ATOM 1477 CB ALA A 100 2.769 -8.262 10.227 1.00 0.00 C ATOM 0 H ALA A 100 3.047 -7.570 13.087 1.00 0.00 H new ATOM 0 HA ALA A 100 4.593 -7.222 10.632 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.657 -7.844 9.226 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.266 -9.230 10.162 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.786 -8.388 10.680 1.00 0.00 H new ATOM 1483 N HIS A 101 3.478 -5.076 12.001 1.00 0.00 N ATOM 1484 CA HIS A 101 2.957 -3.719 12.132 1.00 0.00 C ATOM 1485 C HIS A 101 3.551 -2.804 11.069 1.00 0.00 C ATOM 1486 O HIS A 101 2.861 -1.947 10.516 1.00 0.00 O ATOM 1487 CB HIS A 101 3.260 -3.166 13.527 1.00 0.00 C ATOM 1488 CG HIS A 101 2.719 -1.789 13.755 1.00 0.00 C ATOM 1489 ND1 HIS A 101 3.497 -0.653 13.683 1.00 0.00 N ATOM 1490 CD2 HIS A 101 1.468 -1.367 14.053 1.00 0.00 C ATOM 1491 CE1 HIS A 101 2.749 0.408 13.927 1.00 0.00 C ATOM 1492 NE2 HIS A 101 1.514 0.002 14.154 1.00 0.00 N ATOM 0 H HIS A 101 4.247 -5.296 12.634 1.00 0.00 H new ATOM 0 HA HIS A 101 1.877 -3.756 11.991 1.00 0.00 H new ATOM 0 HB2 HIS A 101 2.842 -3.840 14.275 1.00 0.00 H new ATOM 0 HB3 HIS A 101 4.340 -3.153 13.677 1.00 0.00 H new ATOM 0 HD2 HIS A 101 0.596 -1.990 14.186 1.00 0.00 H new ATOM 0 HE1 HIS A 101 3.090 1.433 13.939 1.00 0.00 H new ATOM 0 HE2 HIS A 101 0.722 0.607 14.370 1.00 0.00 H new ATOM 1501 N GLN A 102 4.834 -2.991 10.789 1.00 0.00 N ATOM 1502 CA GLN A 102 5.525 -2.184 9.790 1.00 0.00 C ATOM 1503 C GLN A 102 6.493 -3.038 8.978 1.00 0.00 C ATOM 1504 O GLN A 102 7.499 -2.541 8.471 1.00 0.00 O ATOM 1505 CB GLN A 102 6.278 -1.036 10.463 1.00 0.00 C ATOM 1506 CG GLN A 102 7.184 -1.483 11.598 1.00 0.00 C ATOM 1507 CD GLN A 102 8.032 -0.352 12.148 1.00 0.00 C ATOM 1508 OE1 GLN A 102 8.196 0.685 11.506 1.00 0.00 O ATOM 1509 NE2 GLN A 102 8.574 -0.547 13.344 1.00 0.00 N ATOM 0 H GLN A 102 5.418 -3.695 11.240 1.00 0.00 H new ATOM 0 HA GLN A 102 4.778 -1.770 9.113 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.877 -0.518 9.714 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.556 -0.316 10.848 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.576 -1.900 12.401 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.836 -2.282 11.244 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.411 -1.423 13.841 1.00 0.00 H new ATOM 0 HE22 GLN A 102 9.153 0.179 13.766 1.00 0.00 H new ATOM 1518 N LYS A 103 6.181 -4.323 8.857 1.00 0.00 N ATOM 1519 CA LYS A 103 7.019 -5.248 8.107 1.00 0.00 C ATOM 1520 C LYS A 103 6.401 -5.566 6.750 1.00 0.00 C ATOM 1521 O LYS A 103 7.108 -5.887 5.794 1.00 0.00 O ATOM 1522 CB LYS A 103 7.219 -6.539 8.902 1.00 0.00 C ATOM 1523 CG LYS A 103 8.416 -6.501 9.839 1.00 0.00 C ATOM 1524 CD LYS A 103 8.181 -5.554 11.007 1.00 0.00 C ATOM 1525 CE LYS A 103 8.363 -6.257 12.342 1.00 0.00 C ATOM 1526 NZ LYS A 103 7.746 -5.493 13.461 1.00 0.00 N ATOM 0 H LYS A 103 5.351 -4.748 9.270 1.00 0.00 H new ATOM 0 HA LYS A 103 7.986 -4.773 7.942 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.320 -6.740 9.484 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.340 -7.369 8.206 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.615 -7.504 10.217 1.00 0.00 H new ATOM 0 HG3 LYS A 103 9.302 -6.186 9.287 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.873 -4.714 10.940 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.173 -5.143 10.946 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.918 -7.251 12.292 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.426 -6.393 12.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.892 -6.006 14.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 8.188 -4.554 13.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 6.726 -5.385 13.287 1.00 0.00 H new ATOM 1540 N ARG A 104 5.076 -5.479 6.674 1.00 0.00 N ATOM 1541 CA ARG A 104 4.361 -5.763 5.435 1.00 0.00 C ATOM 1542 C ARG A 104 3.619 -4.527 4.936 1.00 0.00 C ATOM 1543 O ARG A 104 3.598 -4.247 3.738 1.00 0.00 O ATOM 1544 CB ARG A 104 3.375 -6.912 5.649 1.00 0.00 C ATOM 1545 CG ARG A 104 4.003 -8.138 6.292 1.00 0.00 C ATOM 1546 CD ARG A 104 2.969 -9.218 6.560 1.00 0.00 C ATOM 1547 NE ARG A 104 3.545 -10.366 7.254 1.00 0.00 N ATOM 1548 CZ ARG A 104 2.826 -11.270 7.915 1.00 0.00 C ATOM 1549 NH1 ARG A 104 1.504 -11.163 7.973 1.00 0.00 N ATOM 1550 NH2 ARG A 104 3.429 -12.285 8.518 1.00 0.00 N ATOM 0 H ARG A 104 4.477 -5.214 7.456 1.00 0.00 H new ATOM 0 HA ARG A 104 5.092 -6.052 4.680 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.554 -6.564 6.275 1.00 0.00 H new ATOM 0 HB3 ARG A 104 2.945 -7.195 4.688 1.00 0.00 H new ATOM 0 HG2 ARG A 104 4.782 -8.533 5.640 1.00 0.00 H new ATOM 0 HG3 ARG A 104 4.484 -7.853 7.228 1.00 0.00 H new ATOM 0 HD2 ARG A 104 2.158 -8.803 7.158 1.00 0.00 H new ATOM 0 HD3 ARG A 104 2.534 -9.546 5.616 1.00 0.00 H new ATOM 0 HE ARG A 104 4.558 -10.482 7.231 1.00 0.00 H new ATOM 0 HH11 ARG A 104 1.034 -10.385 7.510 1.00 0.00 H new ATOM 0 HH12 ARG A 104 0.958 -11.859 8.481 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.444 -12.373 8.475 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.878 -12.978 9.025 1.00 0.00 H new ATOM 1564 N LEU A 105 3.010 -3.793 5.859 1.00 0.00 N ATOM 1565 CA LEU A 105 2.265 -2.588 5.509 1.00 0.00 C ATOM 1566 C LEU A 105 3.105 -1.340 5.751 1.00 0.00 C ATOM 1567 O LEU A 105 3.743 -1.201 6.794 1.00 0.00 O ATOM 1568 CB LEU A 105 0.967 -2.500 6.320 1.00 0.00 C ATOM 1569 CG LEU A 105 1.021 -3.122 7.718 1.00 0.00 C ATOM 1570 CD1 LEU A 105 0.050 -2.418 8.652 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.714 -4.609 7.647 1.00 0.00 C ATOM 0 H LEU A 105 3.017 -4.010 6.856 1.00 0.00 H new ATOM 0 HA LEU A 105 2.019 -2.646 4.449 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.691 -1.450 6.419 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.172 -2.987 5.755 1.00 0.00 H new ATOM 0 HG LEU A 105 2.028 -2.997 8.115 1.00 0.00 H new ATOM 0 HD11 LEU A 105 0.102 -2.873 9.641 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.314 -1.363 8.724 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.963 -2.512 8.262 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.756 -5.037 8.648 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.283 -4.755 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.448 -5.102 7.010 1.00 0.00 H new ATOM 1583 N ILE A 106 3.100 -0.432 4.779 1.00 0.00 N ATOM 1584 CA ILE A 106 3.863 0.804 4.889 1.00 0.00 C ATOM 1585 C ILE A 106 2.997 2.021 4.559 1.00 0.00 C ATOM 1586 O ILE A 106 2.438 2.113 3.465 1.00 0.00 O ATOM 1587 CB ILE A 106 5.092 0.801 3.960 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.725 0.246 2.576 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.231 0.006 4.587 1.00 0.00 C ATOM 1590 CD1 ILE A 106 4.789 -1.266 2.478 1.00 0.00 C ATOM 0 H ILE A 106 2.577 -0.530 3.909 1.00 0.00 H new ATOM 0 HA ILE A 106 4.201 0.867 5.923 1.00 0.00 H new ATOM 0 HB ILE A 106 5.430 1.829 3.828 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.717 0.574 2.321 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.398 0.676 1.834 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.092 0.014 3.918 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.508 0.457 5.540 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.909 -1.022 4.752 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.516 -1.577 1.470 1.00 0.00 H new ATOM 0 HD12 ILE A 106 5.802 -1.602 2.700 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.095 -1.707 3.194 1.00 0.00 H new ATOM 1602 N PRO A 107 2.868 2.968 5.505 1.00 0.00 N ATOM 1603 CA PRO A 107 2.066 4.182 5.310 1.00 0.00 C ATOM 1604 C PRO A 107 2.712 5.151 4.325 1.00 0.00 C ATOM 1605 O PRO A 107 3.936 5.217 4.214 1.00 0.00 O ATOM 1606 CB PRO A 107 2.017 4.802 6.707 1.00 0.00 C ATOM 1607 CG PRO A 107 3.257 4.318 7.372 1.00 0.00 C ATOM 1608 CD PRO A 107 3.486 2.930 6.843 1.00 0.00 C ATOM 0 HA PRO A 107 1.085 3.958 4.891 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.992 5.891 6.658 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.126 4.487 7.250 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.102 4.968 7.145 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.143 4.310 8.456 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.548 2.691 6.788 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.022 2.176 7.479 1.00 0.00 H new ATOM 1616 N ILE A 108 1.879 5.901 3.611 1.00 0.00 N ATOM 1617 CA ILE A 108 2.361 6.870 2.632 1.00 0.00 C ATOM 1618 C ILE A 108 1.390 8.043 2.516 1.00 0.00 C ATOM 1619 O ILE A 108 0.222 7.936 2.894 1.00 0.00 O ATOM 1620 CB ILE A 108 2.556 6.209 1.246 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.739 5.240 1.286 1.00 0.00 C ATOM 1622 CG2 ILE A 108 2.769 7.255 0.159 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.337 3.804 1.540 1.00 0.00 C ATOM 0 H ILE A 108 0.863 5.856 3.692 1.00 0.00 H new ATOM 0 HA ILE A 108 3.326 7.241 2.977 1.00 0.00 H new ATOM 0 HB ILE A 108 1.648 5.655 1.006 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.276 5.296 0.339 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.432 5.558 2.065 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.903 6.759 -0.802 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.900 7.912 0.111 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.657 7.844 0.390 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.227 3.174 1.555 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.826 3.734 2.500 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.668 3.468 0.748 1.00 0.00 H new ATOM 1635 N LYS A 109 1.878 9.163 1.992 1.00 0.00 N ATOM 1636 CA LYS A 109 1.049 10.351 1.826 1.00 0.00 C ATOM 1637 C LYS A 109 1.753 11.389 0.960 1.00 0.00 C ATOM 1638 O LYS A 109 2.977 11.515 0.993 1.00 0.00 O ATOM 1639 CB LYS A 109 0.703 10.953 3.189 1.00 0.00 C ATOM 1640 CG LYS A 109 1.910 11.474 3.950 1.00 0.00 C ATOM 1641 CD LYS A 109 2.475 10.422 4.891 1.00 0.00 C ATOM 1642 CE LYS A 109 2.025 10.655 6.325 1.00 0.00 C ATOM 1643 NZ LYS A 109 2.684 11.847 6.927 1.00 0.00 N ATOM 0 H LYS A 109 2.842 9.272 1.676 1.00 0.00 H new ATOM 0 HA LYS A 109 0.128 10.053 1.326 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.006 11.769 3.047 1.00 0.00 H new ATOM 0 HB3 LYS A 109 0.202 10.197 3.794 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.681 11.783 3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.627 12.359 4.520 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.156 9.432 4.565 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.564 10.437 4.844 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.943 10.787 6.349 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.252 9.773 6.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.571 11.821 7.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 3.696 11.841 6.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.245 12.712 6.553 1.00 0.00 H new ATOM 1657 N TYR A 110 0.971 12.135 0.189 1.00 0.00 N ATOM 1658 CA TYR A 110 1.518 13.168 -0.684 1.00 0.00 C ATOM 1659 C TYR A 110 1.689 14.490 0.064 1.00 0.00 C ATOM 1660 O TYR A 110 2.076 15.499 -0.524 1.00 0.00 O ATOM 1661 CB TYR A 110 0.609 13.372 -1.898 1.00 0.00 C ATOM 1662 CG TYR A 110 1.160 14.351 -2.910 1.00 0.00 C ATOM 1663 CD1 TYR A 110 2.384 14.127 -3.527 1.00 0.00 C ATOM 1664 CD2 TYR A 110 0.456 15.499 -3.248 1.00 0.00 C ATOM 1665 CE1 TYR A 110 2.892 15.019 -4.453 1.00 0.00 C ATOM 1666 CE2 TYR A 110 0.956 16.397 -4.173 1.00 0.00 C ATOM 1667 CZ TYR A 110 2.174 16.152 -4.772 1.00 0.00 C ATOM 1668 OH TYR A 110 2.675 17.043 -5.692 1.00 0.00 O ATOM 0 H TYR A 110 -0.044 12.044 0.150 1.00 0.00 H new ATOM 0 HA TYR A 110 2.500 12.836 -1.021 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.447 12.411 -2.386 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -0.365 13.724 -1.557 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.949 13.240 -3.279 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.498 15.694 -2.781 1.00 0.00 H new ATOM 0 HE1 TYR A 110 3.845 14.830 -4.924 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.396 17.285 -4.425 1.00 0.00 H new ATOM 0 HH TYR A 110 2.046 17.786 -5.804 1.00 0.00 H new ATOM 1678 N LYS A 111 1.399 14.478 1.362 1.00 0.00 N ATOM 1679 CA LYS A 111 1.521 15.674 2.186 1.00 0.00 C ATOM 1680 C LYS A 111 1.184 15.361 3.638 1.00 0.00 C ATOM 1681 O LYS A 111 0.689 14.280 3.952 1.00 0.00 O ATOM 1682 CB LYS A 111 0.605 16.785 1.660 1.00 0.00 C ATOM 1683 CG LYS A 111 -0.731 16.286 1.132 1.00 0.00 C ATOM 1684 CD LYS A 111 -1.715 16.020 2.261 1.00 0.00 C ATOM 1685 CE LYS A 111 -2.416 14.682 2.087 1.00 0.00 C ATOM 1686 NZ LYS A 111 -3.074 14.569 0.756 1.00 0.00 N ATOM 0 H LYS A 111 1.077 13.651 1.865 1.00 0.00 H new ATOM 0 HA LYS A 111 2.554 16.019 2.135 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.423 17.501 2.461 1.00 0.00 H new ATOM 0 HB3 LYS A 111 1.121 17.321 0.864 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.151 17.024 0.449 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.578 15.371 0.559 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.188 16.034 3.215 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.456 16.818 2.294 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.693 13.875 2.204 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.162 14.558 2.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -3.848 13.876 0.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.457 15.495 0.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -2.377 14.257 0.050 1.00 0.00 H new ATOM 1700 N ALA A 112 1.463 16.310 4.524 1.00 0.00 N ATOM 1701 CA ALA A 112 1.198 16.129 5.945 1.00 0.00 C ATOM 1702 C ALA A 112 -0.294 16.201 6.251 1.00 0.00 C ATOM 1703 O ALA A 112 -1.038 16.942 5.609 1.00 0.00 O ATOM 1704 CB ALA A 112 1.953 17.170 6.759 1.00 0.00 C ATOM 0 H ALA A 112 1.873 17.212 4.283 1.00 0.00 H new ATOM 0 HA ALA A 112 1.547 15.135 6.224 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.746 17.023 7.819 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.023 17.065 6.580 1.00 0.00 H new ATOM 0 HB3 ALA A 112 1.631 18.168 6.461 1.00 0.00 H new ATOM 1710 N MET A 113 -0.723 15.423 7.241 1.00 0.00 N ATOM 1711 CA MET A 113 -2.121 15.389 7.647 1.00 0.00 C ATOM 1712 C MET A 113 -2.425 16.518 8.628 1.00 0.00 C ATOM 1713 O MET A 113 -1.858 16.579 9.719 1.00 0.00 O ATOM 1714 CB MET A 113 -2.442 14.037 8.288 1.00 0.00 C ATOM 1715 CG MET A 113 -2.125 12.852 7.388 1.00 0.00 C ATOM 1716 SD MET A 113 -1.051 11.640 8.183 1.00 0.00 S ATOM 1717 CE MET A 113 -1.954 11.339 9.699 1.00 0.00 C ATOM 0 H MET A 113 -0.116 14.804 7.779 1.00 0.00 H new ATOM 0 HA MET A 113 -2.744 15.525 6.763 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.878 13.940 9.216 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.499 14.010 8.553 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.055 12.367 7.091 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.648 13.211 6.476 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.451 11.838 10.527 1.00 0.00 H new ATOM 0 HE2 MET A 113 -2.968 11.728 9.602 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.994 10.267 9.892 1.00 0.00 H new ATOM 1727 N LYS A 114 -3.326 17.409 8.228 1.00 0.00 N ATOM 1728 CA LYS A 114 -3.712 18.540 9.062 1.00 0.00 C ATOM 1729 C LYS A 114 -4.302 18.074 10.392 1.00 0.00 C ATOM 1730 O LYS A 114 -4.400 18.854 11.340 1.00 0.00 O ATOM 1731 CB LYS A 114 -4.718 19.424 8.323 1.00 0.00 C ATOM 1732 CG LYS A 114 -4.308 20.888 8.255 1.00 0.00 C ATOM 1733 CD LYS A 114 -4.277 21.397 6.824 1.00 0.00 C ATOM 1734 CE LYS A 114 -3.058 20.885 6.074 1.00 0.00 C ATOM 1735 NZ LYS A 114 -3.286 20.845 4.603 1.00 0.00 N ATOM 0 H LYS A 114 -3.804 17.369 7.328 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.814 19.120 9.275 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.847 19.044 7.310 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.687 19.349 8.817 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -5.005 21.489 8.840 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.324 21.012 8.707 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.183 21.082 6.306 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.273 22.487 6.825 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.203 21.525 6.291 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.807 19.886 6.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.431 20.490 4.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.086 20.214 4.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.501 21.803 4.259 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.692 16.802 10.466 1.00 0.00 N ATOM 1750 CA LYS A 115 -5.263 16.258 11.696 1.00 0.00 C ATOM 1751 C LYS A 115 -4.294 15.279 12.362 1.00 0.00 C ATOM 1752 O LYS A 115 -3.092 15.320 12.102 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.634 15.620 11.437 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.789 15.002 10.066 1.00 0.00 C ATOM 1755 CD LYS A 115 -6.284 13.578 10.060 1.00 0.00 C ATOM 1756 CE LYS A 115 -7.252 12.657 10.784 1.00 0.00 C ATOM 1757 NZ LYS A 115 -6.915 12.504 12.224 1.00 0.00 N ATOM 0 H LYS A 115 -4.624 16.135 9.697 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.421 17.083 12.391 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.811 14.852 12.190 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.405 16.379 11.569 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.838 15.022 9.769 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.239 15.591 9.332 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.152 13.239 9.033 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.306 13.533 10.538 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -8.264 13.051 10.690 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.245 11.678 10.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.290 11.599 12.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.882 12.520 12.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.337 13.286 12.764 1.00 0.00 H new ATOM 1771 N GLU A 116 -4.807 14.422 13.241 1.00 0.00 N ATOM 1772 CA GLU A 116 -3.968 13.470 13.953 1.00 0.00 C ATOM 1773 C GLU A 116 -3.676 12.230 13.121 1.00 0.00 C ATOM 1774 O GLU A 116 -4.228 12.045 12.036 1.00 0.00 O ATOM 1775 CB GLU A 116 -4.642 13.065 15.262 1.00 0.00 C ATOM 1776 CG GLU A 116 -4.618 14.153 16.322 1.00 0.00 C ATOM 1777 CD GLU A 116 -5.455 13.802 17.537 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -6.699 13.820 17.427 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -4.867 13.508 18.599 1.00 0.00 O ATOM 0 H GLU A 116 -5.798 14.369 13.475 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.017 13.960 14.159 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.677 12.791 15.058 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.149 12.176 15.655 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -3.588 14.329 16.633 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -4.984 15.084 15.890 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.806 11.382 13.653 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.425 10.145 12.988 1.00 0.00 C ATOM 1788 C PHE A 117 -2.994 8.939 13.731 1.00 0.00 C ATOM 1789 O PHE A 117 -3.093 8.946 14.959 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.900 10.028 12.903 1.00 0.00 C ATOM 1791 CG PHE A 117 -0.166 10.744 14.004 1.00 0.00 C ATOM 1792 CD1 PHE A 117 -0.271 10.311 15.317 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.624 11.848 13.726 1.00 0.00 C ATOM 1794 CE1 PHE A 117 0.401 10.967 16.331 1.00 0.00 C ATOM 1795 CE2 PHE A 117 1.298 12.507 14.736 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.186 12.065 16.041 1.00 0.00 C ATOM 0 H PHE A 117 -2.348 11.531 14.552 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.835 10.164 11.978 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.626 8.973 12.924 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.569 10.424 11.943 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.884 9.453 15.550 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.714 12.197 12.708 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.312 10.621 17.350 1.00 0.00 H new ATOM 0 HE2 PHE A 117 1.911 13.366 14.506 1.00 0.00 H new ATOM 0 HZ PHE A 117 1.712 12.578 16.833 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.375 7.883 12.997 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.930 6.668 13.589 1.00 0.00 C ATOM 1808 C PRO A 118 -2.855 5.753 14.148 1.00 0.00 C ATOM 1809 O PRO A 118 -1.704 5.812 13.718 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.635 6.006 12.409 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.844 6.421 11.218 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.288 7.788 11.527 1.00 0.00 C ATOM 0 HA PRO A 118 -4.583 6.882 14.435 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.652 4.921 12.515 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.671 6.335 12.331 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -3.041 5.711 11.020 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.471 6.450 10.327 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.259 7.889 11.180 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.866 8.574 11.041 1.00 0.00 H new ATOM 1820 N SER A 119 -3.237 4.884 15.086 1.00 0.00 N ATOM 1821 CA SER A 119 -2.294 3.930 15.662 1.00 0.00 C ATOM 1822 C SER A 119 -1.942 2.932 14.576 1.00 0.00 C ATOM 1823 O SER A 119 -2.341 1.768 14.615 1.00 0.00 O ATOM 1824 CB SER A 119 -2.908 3.216 16.869 1.00 0.00 C ATOM 1825 OG SER A 119 -4.320 3.161 16.766 1.00 0.00 O ATOM 0 H SER A 119 -4.185 4.823 15.459 1.00 0.00 H new ATOM 0 HA SER A 119 -1.401 4.446 16.015 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.506 2.205 16.941 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.627 3.736 17.785 1.00 0.00 H new ATOM 0 HG SER A 119 -4.687 2.699 17.548 1.00 0.00 H new ATOM 1831 N ILE A 120 -1.246 3.438 13.573 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.884 2.663 12.410 1.00 0.00 C ATOM 1833 C ILE A 120 0.450 3.141 11.848 1.00 0.00 C ATOM 1834 O ILE A 120 1.332 2.343 11.531 1.00 0.00 O ATOM 1835 CB ILE A 120 -2.003 2.828 11.357 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -3.162 1.888 11.676 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.499 2.607 9.947 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -2.825 0.431 11.483 1.00 0.00 C ATOM 0 H ILE A 120 -0.917 4.403 13.547 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.774 1.612 12.678 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.356 3.858 11.406 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -3.475 2.047 12.708 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.011 2.143 11.043 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.321 2.734 9.243 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.715 3.330 9.723 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -1.097 1.598 9.858 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -3.694 -0.179 11.728 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -2.541 0.258 10.445 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -1.996 0.160 12.136 1.00 0.00 H new ATOM 1850 N LEU A 121 0.581 4.457 11.736 1.00 0.00 N ATOM 1851 CA LEU A 121 1.798 5.069 11.222 1.00 0.00 C ATOM 1852 C LEU A 121 2.398 6.031 12.246 1.00 0.00 C ATOM 1853 O LEU A 121 3.023 7.028 11.882 1.00 0.00 O ATOM 1854 CB LEU A 121 1.523 5.799 9.898 1.00 0.00 C ATOM 1855 CG LEU A 121 0.288 6.720 9.860 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.990 5.917 9.651 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.186 7.568 11.120 1.00 0.00 C ATOM 0 H LEU A 121 -0.146 5.124 11.996 1.00 0.00 H new ATOM 0 HA LEU A 121 2.520 4.274 11.034 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.401 6.396 9.650 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.414 5.051 9.113 1.00 0.00 H new ATOM 0 HG LEU A 121 0.412 7.393 9.012 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.845 6.593 9.628 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.930 5.377 8.706 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.111 5.206 10.469 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.696 8.205 11.059 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.104 6.917 11.991 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.077 8.189 11.214 1.00 0.00 H new ATOM 1869 N ARG A 122 2.195 5.724 13.527 1.00 0.00 N ATOM 1870 CA ARG A 122 2.699 6.554 14.622 1.00 0.00 C ATOM 1871 C ARG A 122 4.099 7.093 14.338 1.00 0.00 C ATOM 1872 O ARG A 122 4.358 8.286 14.493 1.00 0.00 O ATOM 1873 CB ARG A 122 2.704 5.763 15.930 1.00 0.00 C ATOM 1874 CG ARG A 122 3.294 4.367 15.799 1.00 0.00 C ATOM 1875 CD ARG A 122 2.987 3.518 17.021 1.00 0.00 C ATOM 1876 NE ARG A 122 3.949 2.432 17.190 1.00 0.00 N ATOM 1877 CZ ARG A 122 3.849 1.491 18.126 1.00 0.00 C ATOM 1878 NH1 ARG A 122 2.829 1.497 18.977 1.00 0.00 N ATOM 1879 NH2 ARG A 122 4.768 0.539 18.211 1.00 0.00 N ATOM 0 H ARG A 122 1.680 4.899 13.834 1.00 0.00 H new ATOM 0 HA ARG A 122 2.027 7.407 14.714 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.270 6.318 16.678 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.682 5.682 16.299 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.893 3.883 14.908 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.373 4.438 15.665 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.992 4.148 17.910 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.983 3.102 16.930 1.00 0.00 H new ATOM 0 HE ARG A 122 4.745 2.392 16.553 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.117 2.225 18.915 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.757 0.773 19.692 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.552 0.527 17.559 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.691 -0.182 18.929 1.00 0.00 H new ATOM 1893 N PHE A 123 4.996 6.209 13.925 1.00 0.00 N ATOM 1894 CA PHE A 123 6.368 6.603 13.624 1.00 0.00 C ATOM 1895 C PHE A 123 7.075 5.535 12.799 1.00 0.00 C ATOM 1896 O PHE A 123 8.292 5.375 12.884 1.00 0.00 O ATOM 1897 CB PHE A 123 7.142 6.859 14.919 1.00 0.00 C ATOM 1898 CG PHE A 123 6.990 8.258 15.444 1.00 0.00 C ATOM 1899 CD1 PHE A 123 7.610 9.322 14.808 1.00 0.00 C ATOM 1900 CD2 PHE A 123 6.225 8.509 16.572 1.00 0.00 C ATOM 1901 CE1 PHE A 123 7.473 10.609 15.290 1.00 0.00 C ATOM 1902 CE2 PHE A 123 6.085 9.795 17.058 1.00 0.00 C ATOM 1903 CZ PHE A 123 6.708 10.846 16.416 1.00 0.00 C ATOM 0 H PHE A 123 4.801 5.217 13.790 1.00 0.00 H new ATOM 0 HA PHE A 123 6.334 7.522 13.039 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.804 6.156 15.680 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.199 6.658 14.746 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.207 9.143 13.926 1.00 0.00 H new ATOM 0 HD2 PHE A 123 5.733 7.691 17.077 1.00 0.00 H new ATOM 0 HE1 PHE A 123 7.963 11.429 14.787 1.00 0.00 H new ATOM 0 HE2 PHE A 123 5.488 9.978 17.940 1.00 0.00 H new ATOM 0 HZ PHE A 123 6.598 11.852 16.793 1.00 0.00 H new ATOM 1913 N ILE A 124 6.303 4.806 12.004 1.00 0.00 N ATOM 1914 CA ILE A 124 6.841 3.754 11.169 1.00 0.00 C ATOM 1915 C ILE A 124 7.309 4.306 9.823 1.00 0.00 C ATOM 1916 O ILE A 124 7.312 5.518 9.608 1.00 0.00 O ATOM 1917 CB ILE A 124 5.787 2.655 10.949 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.691 3.135 9.991 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.185 2.233 12.283 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.543 2.157 9.838 1.00 0.00 C ATOM 0 H ILE A 124 5.294 4.930 11.924 1.00 0.00 H new ATOM 0 HA ILE A 124 7.702 3.325 11.681 1.00 0.00 H new ATOM 0 HB ILE A 124 6.276 1.792 10.496 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.300 4.087 10.349 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.132 3.319 9.012 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.440 1.455 12.116 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.972 1.849 12.932 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.711 3.093 12.757 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.807 2.565 9.145 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.920 1.211 9.450 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.075 1.991 10.808 1.00 0.00 H new ATOM 1932 N THR A 125 7.703 3.412 8.921 1.00 0.00 N ATOM 1933 CA THR A 125 8.171 3.820 7.599 1.00 0.00 C ATOM 1934 C THR A 125 7.093 4.605 6.857 1.00 0.00 C ATOM 1935 O THR A 125 6.178 4.024 6.276 1.00 0.00 O ATOM 1936 CB THR A 125 8.581 2.591 6.781 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.671 1.924 7.391 1.00 0.00 O ATOM 1938 CG2 THR A 125 8.983 2.919 5.359 1.00 0.00 C ATOM 0 H THR A 125 7.708 2.404 9.079 1.00 0.00 H new ATOM 0 HA THR A 125 9.038 4.468 7.730 1.00 0.00 H new ATOM 0 HB THR A 125 7.694 1.958 6.752 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.917 1.141 6.855 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.261 2.002 4.839 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.146 3.389 4.843 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.832 3.602 5.369 1.00 0.00 H new ATOM 1946 N VAL A 126 7.206 5.928 6.880 1.00 0.00 N ATOM 1947 CA VAL A 126 6.241 6.789 6.212 1.00 0.00 C ATOM 1948 C VAL A 126 6.872 7.538 5.043 1.00 0.00 C ATOM 1949 O VAL A 126 7.989 8.046 5.147 1.00 0.00 O ATOM 1950 CB VAL A 126 5.634 7.806 7.198 1.00 0.00 C ATOM 1951 CG1 VAL A 126 6.690 8.787 7.684 1.00 0.00 C ATOM 1952 CG2 VAL A 126 4.467 8.541 6.556 1.00 0.00 C ATOM 0 H VAL A 126 7.958 6.427 7.355 1.00 0.00 H new ATOM 0 HA VAL A 126 5.452 6.142 5.828 1.00 0.00 H new ATOM 0 HB VAL A 126 5.260 7.260 8.064 1.00 0.00 H new ATOM 0 HG11 VAL A 126 6.237 9.495 8.379 1.00 0.00 H new ATOM 0 HG12 VAL A 126 7.488 8.242 8.189 1.00 0.00 H new ATOM 0 HG13 VAL A 126 7.103 9.328 6.833 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.051 9.255 7.267 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.815 9.072 5.670 1.00 0.00 H new ATOM 0 HG23 VAL A 126 3.698 7.823 6.270 1.00 0.00 H new ATOM 1962 N CYS A 127 6.149 7.604 3.930 1.00 0.00 N ATOM 1963 CA CYS A 127 6.633 8.292 2.739 1.00 0.00 C ATOM 1964 C CYS A 127 5.840 9.572 2.491 1.00 0.00 C ATOM 1965 O CYS A 127 4.700 9.527 2.029 1.00 0.00 O ATOM 1966 CB CYS A 127 6.537 7.375 1.519 1.00 0.00 C ATOM 1967 SG CYS A 127 7.414 5.804 1.705 1.00 0.00 S ATOM 0 H CYS A 127 5.223 7.188 3.828 1.00 0.00 H new ATOM 0 HA CYS A 127 7.677 8.558 2.903 1.00 0.00 H new ATOM 0 HB2 CYS A 127 5.486 7.170 1.314 1.00 0.00 H new ATOM 0 HB3 CYS A 127 6.935 7.900 0.651 1.00 0.00 H new ATOM 0 HG CYS A 127 8.005 5.502 0.587 1.00 0.00 H new ATOM 1973 N ASP A 128 6.451 10.711 2.803 1.00 0.00 N ATOM 1974 CA ASP A 128 5.799 12.004 2.614 1.00 0.00 C ATOM 1975 C ASP A 128 6.581 12.870 1.635 1.00 0.00 C ATOM 1976 O ASP A 128 7.800 13.000 1.743 1.00 0.00 O ATOM 1977 CB ASP A 128 5.658 12.729 3.953 1.00 0.00 C ATOM 1978 CG ASP A 128 4.788 13.966 3.850 1.00 0.00 C ATOM 1979 OD1 ASP A 128 3.745 13.905 3.167 1.00 0.00 O ATOM 1980 OD2 ASP A 128 5.150 14.998 4.455 1.00 0.00 O ATOM 0 H ASP A 128 7.394 10.766 3.187 1.00 0.00 H new ATOM 0 HA ASP A 128 4.807 11.824 2.200 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.231 12.048 4.689 1.00 0.00 H new ATOM 0 HB3 ASP A 128 6.646 13.012 4.316 1.00 0.00 H new ATOM 1985 N TYR A 129 5.871 13.465 0.680 1.00 0.00 N ATOM 1986 CA TYR A 129 6.507 14.321 -0.311 1.00 0.00 C ATOM 1987 C TYR A 129 6.800 15.695 0.274 1.00 0.00 C ATOM 1988 O TYR A 129 6.016 16.633 0.113 1.00 0.00 O ATOM 1989 CB TYR A 129 5.629 14.455 -1.555 1.00 0.00 C ATOM 1990 CG TYR A 129 5.542 13.187 -2.375 1.00 0.00 C ATOM 1991 CD1 TYR A 129 4.833 12.085 -1.913 1.00 0.00 C ATOM 1992 CD2 TYR A 129 6.171 13.092 -3.610 1.00 0.00 C ATOM 1993 CE1 TYR A 129 4.754 10.925 -2.660 1.00 0.00 C ATOM 1994 CE2 TYR A 129 6.095 11.934 -4.362 1.00 0.00 C ATOM 1995 CZ TYR A 129 5.386 10.854 -3.882 1.00 0.00 C ATOM 1996 OH TYR A 129 5.309 9.701 -4.627 1.00 0.00 O ATOM 0 H TYR A 129 4.861 13.370 0.573 1.00 0.00 H new ATOM 0 HA TYR A 129 7.450 13.857 -0.600 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.625 14.750 -1.251 1.00 0.00 H new ATOM 0 HB3 TYR A 129 6.021 15.256 -2.181 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.336 12.136 -0.955 1.00 0.00 H new ATOM 0 HD2 TYR A 129 6.728 13.936 -3.989 1.00 0.00 H new ATOM 0 HE1 TYR A 129 4.199 10.077 -2.287 1.00 0.00 H new ATOM 0 HE2 TYR A 129 6.589 11.876 -5.321 1.00 0.00 H new ATOM 0 HH TYR A 129 5.808 9.817 -5.462 1.00 0.00 H new ATOM 2006 N THR A 130 7.939 15.810 0.942 1.00 0.00 N ATOM 2007 CA THR A 130 8.352 17.073 1.544 1.00 0.00 C ATOM 2008 C THR A 130 9.032 17.938 0.496 1.00 0.00 C ATOM 2009 O THR A 130 8.655 19.089 0.274 1.00 0.00 O ATOM 2010 CB THR A 130 9.300 16.825 2.719 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.597 16.494 2.256 1.00 0.00 O ATOM 2012 CG2 THR A 130 8.842 15.710 3.635 1.00 0.00 C ATOM 0 H THR A 130 8.596 15.043 1.082 1.00 0.00 H new ATOM 0 HA THR A 130 7.469 17.589 1.921 1.00 0.00 H new ATOM 0 HB THR A 130 9.307 17.757 3.284 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.189 16.341 3.022 1.00 0.00 H new ATOM 0 HG21 THR A 130 9.560 15.588 4.446 1.00 0.00 H new ATOM 0 HG22 THR A 130 7.865 15.958 4.049 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.771 14.781 3.070 1.00 0.00 H new ATOM 2020 N ASN A 131 10.021 17.353 -0.167 1.00 0.00 N ATOM 2021 CA ASN A 131 10.752 18.030 -1.224 1.00 0.00 C ATOM 2022 C ASN A 131 10.588 17.245 -2.520 1.00 0.00 C ATOM 2023 O ASN A 131 11.564 16.769 -3.102 1.00 0.00 O ATOM 2024 CB ASN A 131 12.233 18.158 -0.862 1.00 0.00 C ATOM 2025 CG ASN A 131 12.967 19.135 -1.757 1.00 0.00 C ATOM 2026 OD1 ASN A 131 12.450 19.554 -2.794 1.00 0.00 O ATOM 2027 ND2 ASN A 131 14.179 19.507 -1.362 1.00 0.00 N ATOM 0 H ASN A 131 10.336 16.400 0.014 1.00 0.00 H new ATOM 0 HA ASN A 131 10.352 19.036 -1.352 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.323 18.482 0.175 1.00 0.00 H new ATOM 0 HB3 ASN A 131 12.707 17.179 -0.933 1.00 0.00 H new ATOM 0 HD21 ASN A 131 14.719 20.164 -1.925 1.00 0.00 H new ATOM 0 HD22 ASN A 131 14.570 19.136 -0.496 1.00 0.00 H new ATOM 2034 N PRO A 132 9.334 17.082 -2.978 1.00 0.00 N ATOM 2035 CA PRO A 132 9.016 16.336 -4.193 1.00 0.00 C ATOM 2036 C PRO A 132 9.933 16.697 -5.353 1.00 0.00 C ATOM 2037 O PRO A 132 10.181 15.881 -6.242 1.00 0.00 O ATOM 2038 CB PRO A 132 7.561 16.732 -4.507 1.00 0.00 C ATOM 2039 CG PRO A 132 7.198 17.787 -3.512 1.00 0.00 C ATOM 2040 CD PRO A 132 8.120 17.601 -2.343 1.00 0.00 C ATOM 0 HA PRO A 132 9.149 15.264 -4.050 1.00 0.00 H new ATOM 0 HB2 PRO A 132 7.470 17.109 -5.526 1.00 0.00 H new ATOM 0 HB3 PRO A 132 6.896 15.872 -4.424 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.312 18.782 -3.942 1.00 0.00 H new ATOM 0 HG3 PRO A 132 6.157 17.690 -3.205 1.00 0.00 H new ATOM 0 HD2 PRO A 132 8.305 18.538 -1.819 1.00 0.00 H new ATOM 0 HD3 PRO A 132 7.713 16.902 -1.612 1.00 0.00 H new ATOM 2048 N CYS A 133 10.434 17.924 -5.335 1.00 0.00 N ATOM 2049 CA CYS A 133 11.330 18.404 -6.385 1.00 0.00 C ATOM 2050 C CYS A 133 12.481 17.425 -6.603 1.00 0.00 C ATOM 2051 O CYS A 133 12.896 17.179 -7.735 1.00 0.00 O ATOM 2052 CB CYS A 133 11.879 19.788 -6.024 1.00 0.00 C ATOM 2053 SG CYS A 133 11.618 21.040 -7.301 1.00 0.00 S ATOM 0 H CYS A 133 10.237 18.608 -4.605 1.00 0.00 H new ATOM 0 HA CYS A 133 10.760 18.480 -7.311 1.00 0.00 H new ATOM 0 HB2 CYS A 133 11.409 20.124 -5.099 1.00 0.00 H new ATOM 0 HB3 CYS A 133 12.948 19.703 -5.826 1.00 0.00 H new ATOM 0 HG CYS A 133 12.113 22.175 -6.904 1.00 0.00 H new ATOM 2059 N THR A 134 12.986 16.868 -5.508 1.00 0.00 N ATOM 2060 CA THR A 134 14.084 15.910 -5.572 1.00 0.00 C ATOM 2061 C THR A 134 13.628 14.530 -5.107 1.00 0.00 C ATOM 2062 O THR A 134 14.158 13.509 -5.547 1.00 0.00 O ATOM 2063 CB THR A 134 15.259 16.389 -4.718 1.00 0.00 C ATOM 2064 OG1 THR A 134 16.199 15.347 -4.529 1.00 0.00 O ATOM 2065 CG2 THR A 134 14.841 16.883 -3.349 1.00 0.00 C ATOM 0 H THR A 134 12.652 17.064 -4.564 1.00 0.00 H new ATOM 0 HA THR A 134 14.408 15.835 -6.610 1.00 0.00 H new ATOM 0 HB THR A 134 15.697 17.221 -5.270 1.00 0.00 H new ATOM 0 HG1 THR A 134 16.198 14.759 -5.313 1.00 0.00 H new ATOM 0 HG21 THR A 134 15.722 17.208 -2.795 1.00 0.00 H new ATOM 0 HG22 THR A 134 14.152 17.721 -3.459 1.00 0.00 H new ATOM 0 HG23 THR A 134 14.348 16.077 -2.806 1.00 0.00 H new ATOM 2073 N LYS A 135 12.639 14.507 -4.221 1.00 0.00 N ATOM 2074 CA LYS A 135 12.104 13.254 -3.700 1.00 0.00 C ATOM 2075 C LYS A 135 11.228 12.550 -4.736 1.00 0.00 C ATOM 2076 O LYS A 135 10.761 11.434 -4.508 1.00 0.00 O ATOM 2077 CB LYS A 135 11.297 13.512 -2.424 1.00 0.00 C ATOM 2078 CG LYS A 135 12.113 13.370 -1.150 1.00 0.00 C ATOM 2079 CD LYS A 135 12.646 14.712 -0.676 1.00 0.00 C ATOM 2080 CE LYS A 135 13.844 14.542 0.245 1.00 0.00 C ATOM 2081 NZ LYS A 135 15.130 14.771 -0.469 1.00 0.00 N ATOM 0 H LYS A 135 12.190 15.343 -3.848 1.00 0.00 H new ATOM 0 HA LYS A 135 12.947 12.603 -3.468 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.877 14.517 -2.467 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.458 12.817 -2.388 1.00 0.00 H new ATOM 0 HG2 LYS A 135 11.495 12.926 -0.369 1.00 0.00 H new ATOM 0 HG3 LYS A 135 12.945 12.688 -1.324 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.931 15.316 -1.537 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.858 15.254 -0.153 1.00 0.00 H new ATOM 0 HE2 LYS A 135 13.763 15.239 1.079 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.837 13.537 0.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 15.923 14.629 0.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 15.212 14.100 -1.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.155 15.744 -0.836 1.00 0.00 H new ATOM 2095 N SER A 136 11.006 13.207 -5.876 1.00 0.00 N ATOM 2096 CA SER A 136 10.182 12.642 -6.942 1.00 0.00 C ATOM 2097 C SER A 136 10.605 11.214 -7.285 1.00 0.00 C ATOM 2098 O SER A 136 9.813 10.434 -7.814 1.00 0.00 O ATOM 2099 CB SER A 136 10.262 13.521 -8.192 1.00 0.00 C ATOM 2100 OG SER A 136 9.725 12.855 -9.321 1.00 0.00 O ATOM 0 H SER A 136 11.386 14.131 -6.083 1.00 0.00 H new ATOM 0 HA SER A 136 9.153 12.611 -6.583 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.718 14.450 -8.022 1.00 0.00 H new ATOM 0 HB3 SER A 136 11.301 13.790 -8.385 1.00 0.00 H new ATOM 0 HG SER A 136 9.787 13.439 -10.106 1.00 0.00 H new ATOM 2106 N TRP A 137 11.856 10.875 -6.983 1.00 0.00 N ATOM 2107 CA TRP A 137 12.376 9.539 -7.264 1.00 0.00 C ATOM 2108 C TRP A 137 11.749 8.484 -6.349 1.00 0.00 C ATOM 2109 O TRP A 137 12.021 7.292 -6.496 1.00 0.00 O ATOM 2110 CB TRP A 137 13.897 9.513 -7.110 1.00 0.00 C ATOM 2111 CG TRP A 137 14.383 10.175 -5.857 1.00 0.00 C ATOM 2112 CD1 TRP A 137 13.883 10.014 -4.598 1.00 0.00 C ATOM 2113 CD2 TRP A 137 15.466 11.105 -5.743 1.00 0.00 C ATOM 2114 NE1 TRP A 137 14.588 10.786 -3.708 1.00 0.00 N ATOM 2115 CE2 TRP A 137 15.565 11.465 -4.387 1.00 0.00 C ATOM 2116 CE3 TRP A 137 16.361 11.667 -6.658 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 16.524 12.363 -3.922 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 17.313 12.556 -6.195 1.00 0.00 C ATOM 2119 CH2 TRP A 137 17.388 12.896 -4.839 1.00 0.00 C ATOM 0 H TRP A 137 12.527 11.505 -6.545 1.00 0.00 H new ATOM 0 HA TRP A 137 12.111 9.298 -8.294 1.00 0.00 H new ATOM 0 HB2 TRP A 137 14.237 8.478 -7.120 1.00 0.00 H new ATOM 0 HB3 TRP A 137 14.350 10.005 -7.971 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.053 9.373 -4.339 1.00 0.00 H new ATOM 0 HE1 TRP A 137 14.413 10.844 -2.705 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.310 11.412 -7.706 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 16.583 12.628 -2.877 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 18.011 12.996 -6.892 1.00 0.00 H new ATOM 0 HH2 TRP A 137 18.144 13.594 -4.510 1.00 0.00 H new ATOM 2130 N PHE A 138 10.911 8.920 -5.406 1.00 0.00 N ATOM 2131 CA PHE A 138 10.254 8.006 -4.476 1.00 0.00 C ATOM 2132 C PHE A 138 9.698 6.780 -5.201 1.00 0.00 C ATOM 2133 O PHE A 138 9.610 5.694 -4.628 1.00 0.00 O ATOM 2134 CB PHE A 138 9.127 8.726 -3.732 1.00 0.00 C ATOM 2135 CG PHE A 138 9.458 9.042 -2.301 1.00 0.00 C ATOM 2136 CD1 PHE A 138 9.675 8.025 -1.386 1.00 0.00 C ATOM 2137 CD2 PHE A 138 9.552 10.355 -1.871 1.00 0.00 C ATOM 2138 CE1 PHE A 138 9.980 8.311 -0.068 1.00 0.00 C ATOM 2139 CE2 PHE A 138 9.855 10.649 -0.556 1.00 0.00 C ATOM 2140 CZ PHE A 138 10.068 9.626 0.347 1.00 0.00 C ATOM 0 H PHE A 138 10.673 9.902 -5.268 1.00 0.00 H new ATOM 0 HA PHE A 138 11.001 7.667 -3.758 1.00 0.00 H new ATOM 0 HB2 PHE A 138 8.892 9.653 -4.255 1.00 0.00 H new ATOM 0 HB3 PHE A 138 8.230 8.107 -3.761 1.00 0.00 H new ATOM 0 HD1 PHE A 138 9.605 6.996 -1.706 1.00 0.00 H new ATOM 0 HD2 PHE A 138 9.386 11.159 -2.573 1.00 0.00 H new ATOM 0 HE1 PHE A 138 10.149 7.509 0.635 1.00 0.00 H new ATOM 0 HE2 PHE A 138 9.925 11.678 -0.234 1.00 0.00 H new ATOM 0 HZ PHE A 138 10.303 9.854 1.376 1.00 0.00 H new ATOM 2150 N TRP A 139 9.329 6.961 -6.468 1.00 0.00 N ATOM 2151 CA TRP A 139 8.787 5.870 -7.273 1.00 0.00 C ATOM 2152 C TRP A 139 9.694 4.643 -7.206 1.00 0.00 C ATOM 2153 O TRP A 139 9.221 3.507 -7.213 1.00 0.00 O ATOM 2154 CB TRP A 139 8.624 6.312 -8.728 1.00 0.00 C ATOM 2155 CG TRP A 139 7.521 7.308 -8.928 1.00 0.00 C ATOM 2156 CD1 TRP A 139 6.262 7.251 -8.404 1.00 0.00 C ATOM 2157 CD2 TRP A 139 7.579 8.505 -9.711 1.00 0.00 C ATOM 2158 NE1 TRP A 139 5.532 8.342 -8.813 1.00 0.00 N ATOM 2159 CE2 TRP A 139 6.319 9.127 -9.616 1.00 0.00 C ATOM 2160 CE3 TRP A 139 8.575 9.114 -10.481 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 6.029 10.324 -10.262 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 8.284 10.304 -11.122 1.00 0.00 C ATOM 2163 CH2 TRP A 139 7.022 10.898 -11.009 1.00 0.00 C ATOM 0 H TRP A 139 9.396 7.853 -6.958 1.00 0.00 H new ATOM 0 HA TRP A 139 7.810 5.605 -6.868 1.00 0.00 H new ATOM 0 HB2 TRP A 139 9.562 6.745 -9.076 1.00 0.00 H new ATOM 0 HB3 TRP A 139 8.429 5.436 -9.346 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.893 6.464 -7.762 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.563 8.536 -8.560 1.00 0.00 H new ATOM 0 HE3 TRP A 139 9.552 8.664 -10.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 5.056 10.784 -10.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 9.044 10.784 -11.721 1.00 0.00 H new ATOM 0 HH2 TRP A 139 6.828 11.828 -11.522 1.00 0.00 H new ATOM 2174 N THR A 140 10.999 4.887 -7.141 1.00 0.00 N ATOM 2175 CA THR A 140 11.977 3.808 -7.072 1.00 0.00 C ATOM 2176 C THR A 140 12.034 3.220 -5.666 1.00 0.00 C ATOM 2177 O THR A 140 12.171 2.008 -5.495 1.00 0.00 O ATOM 2178 CB THR A 140 13.357 4.322 -7.484 1.00 0.00 C ATOM 2179 OG1 THR A 140 13.321 4.864 -8.791 1.00 0.00 O ATOM 2180 CG2 THR A 140 14.428 3.252 -7.461 1.00 0.00 C ATOM 0 H THR A 140 11.404 5.823 -7.135 1.00 0.00 H new ATOM 0 HA THR A 140 11.671 3.021 -7.761 1.00 0.00 H new ATOM 0 HB THR A 140 13.611 5.084 -6.747 1.00 0.00 H new ATOM 0 HG1 THR A 140 14.213 5.189 -9.035 1.00 0.00 H new ATOM 0 HG21 THR A 140 15.381 3.685 -7.764 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.517 2.848 -6.453 1.00 0.00 H new ATOM 0 HG23 THR A 140 14.158 2.452 -8.150 1.00 0.00 H new ATOM 2188 N ARG A 141 11.929 4.085 -4.663 1.00 0.00 N ATOM 2189 CA ARG A 141 11.967 3.650 -3.271 1.00 0.00 C ATOM 2190 C ARG A 141 10.825 2.683 -2.979 1.00 0.00 C ATOM 2191 O ARG A 141 11.031 1.631 -2.372 1.00 0.00 O ATOM 2192 CB ARG A 141 11.885 4.855 -2.335 1.00 0.00 C ATOM 2193 CG ARG A 141 13.237 5.473 -2.018 1.00 0.00 C ATOM 2194 CD ARG A 141 13.992 4.658 -0.979 1.00 0.00 C ATOM 2195 NE ARG A 141 13.308 4.648 0.312 1.00 0.00 N ATOM 2196 CZ ARG A 141 13.897 4.319 1.460 1.00 0.00 C ATOM 2197 NH1 ARG A 141 15.177 3.974 1.482 1.00 0.00 N ATOM 2198 NH2 ARG A 141 13.202 4.336 2.589 1.00 0.00 N ATOM 0 H ARG A 141 11.817 5.091 -4.788 1.00 0.00 H new ATOM 0 HA ARG A 141 12.912 3.134 -3.100 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.246 5.613 -2.787 1.00 0.00 H new ATOM 0 HB3 ARG A 141 11.407 4.549 -1.404 1.00 0.00 H new ATOM 0 HG2 ARG A 141 13.830 5.541 -2.930 1.00 0.00 H new ATOM 0 HG3 ARG A 141 13.097 6.490 -1.652 1.00 0.00 H new ATOM 0 HD2 ARG A 141 14.108 3.635 -1.336 1.00 0.00 H new ATOM 0 HD3 ARG A 141 14.994 5.068 -0.855 1.00 0.00 H new ATOM 0 HE ARG A 141 12.322 4.908 0.335 1.00 0.00 H new ATOM 0 HH11 ARG A 141 15.716 3.960 0.616 1.00 0.00 H new ATOM 0 HH12 ARG A 141 15.622 3.723 2.365 1.00 0.00 H new ATOM 0 HH21 ARG A 141 12.217 4.601 2.578 1.00 0.00 H new ATOM 0 HH22 ARG A 141 13.652 4.084 3.469 1.00 0.00 H new ATOM 2212 N LEU A 142 9.624 3.043 -3.416 1.00 0.00 N ATOM 2213 CA LEU A 142 8.450 2.204 -3.204 1.00 0.00 C ATOM 2214 C LEU A 142 8.480 0.992 -4.130 1.00 0.00 C ATOM 2215 O LEU A 142 7.983 -0.079 -3.784 1.00 0.00 O ATOM 2216 CB LEU A 142 7.171 3.013 -3.437 1.00 0.00 C ATOM 2217 CG LEU A 142 6.139 2.929 -2.311 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.602 1.513 -2.181 1.00 0.00 C ATOM 2219 CD2 LEU A 142 6.749 3.392 -0.996 1.00 0.00 C ATOM 0 H LEU A 142 9.437 3.910 -3.919 1.00 0.00 H new ATOM 0 HA LEU A 142 8.462 1.852 -2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.442 4.059 -3.584 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.706 2.671 -4.362 1.00 0.00 H new ATOM 0 HG LEU A 142 5.307 3.589 -2.557 1.00 0.00 H new ATOM 0 HD11 LEU A 142 4.869 1.474 -1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 142 5.128 1.216 -3.117 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.423 0.832 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 142 6.002 3.326 -0.205 1.00 0.00 H new ATOM 0 HD22 LEU A 142 7.599 2.757 -0.746 1.00 0.00 H new ATOM 0 HD23 LEU A 142 7.084 4.425 -1.094 1.00 0.00 H new ATOM 2231 N ALA A 143 9.066 1.170 -5.309 1.00 0.00 N ATOM 2232 CA ALA A 143 9.164 0.094 -6.287 1.00 0.00 C ATOM 2233 C ALA A 143 10.065 -1.026 -5.780 1.00 0.00 C ATOM 2234 O ALA A 143 9.778 -2.207 -5.980 1.00 0.00 O ATOM 2235 CB ALA A 143 9.678 0.630 -7.612 1.00 0.00 C ATOM 0 H ALA A 143 9.481 2.052 -5.611 1.00 0.00 H new ATOM 0 HA ALA A 143 8.166 -0.318 -6.439 1.00 0.00 H new ATOM 0 HB1 ALA A 143 9.746 -0.185 -8.332 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.993 1.390 -7.987 1.00 0.00 H new ATOM 0 HB3 ALA A 143 10.665 1.070 -7.468 1.00 0.00 H new ATOM 2241 N LYS A 144 11.157 -0.649 -5.124 1.00 0.00 N ATOM 2242 CA LYS A 144 12.103 -1.621 -4.588 1.00 0.00 C ATOM 2243 C LYS A 144 11.698 -2.069 -3.184 1.00 0.00 C ATOM 2244 O LYS A 144 12.176 -3.089 -2.688 1.00 0.00 O ATOM 2245 CB LYS A 144 13.513 -1.030 -4.559 1.00 0.00 C ATOM 2246 CG LYS A 144 13.643 0.191 -3.664 1.00 0.00 C ATOM 2247 CD LYS A 144 14.814 0.060 -2.703 1.00 0.00 C ATOM 2248 CE LYS A 144 14.455 -0.794 -1.497 1.00 0.00 C ATOM 2249 NZ LYS A 144 14.422 0.003 -0.240 1.00 0.00 N ATOM 0 H LYS A 144 11.409 0.324 -4.950 1.00 0.00 H new ATOM 0 HA LYS A 144 12.093 -2.493 -5.242 1.00 0.00 H new ATOM 0 HB2 LYS A 144 14.211 -1.795 -4.220 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.805 -0.759 -5.574 1.00 0.00 H new ATOM 0 HG2 LYS A 144 13.775 1.081 -4.279 1.00 0.00 H new ATOM 0 HG3 LYS A 144 12.721 0.328 -3.098 1.00 0.00 H new ATOM 0 HD2 LYS A 144 15.664 -0.382 -3.223 1.00 0.00 H new ATOM 0 HD3 LYS A 144 15.124 1.050 -2.369 1.00 0.00 H new ATOM 0 HE2 LYS A 144 13.482 -1.258 -1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 144 15.180 -1.601 -1.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 14.174 -0.617 0.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 15.357 0.425 -0.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 13.712 0.758 -0.326 1.00 0.00 H new ATOM 2263 N ALA A 145 10.816 -1.303 -2.548 1.00 0.00 N ATOM 2264 CA ALA A 145 10.352 -1.628 -1.205 1.00 0.00 C ATOM 2265 C ALA A 145 9.234 -2.662 -1.251 1.00 0.00 C ATOM 2266 O ALA A 145 9.028 -3.412 -0.297 1.00 0.00 O ATOM 2267 CB ALA A 145 9.884 -0.370 -0.490 1.00 0.00 C ATOM 0 H ALA A 145 10.409 -0.454 -2.941 1.00 0.00 H new ATOM 0 HA ALA A 145 11.186 -2.057 -0.650 1.00 0.00 H new ATOM 0 HB1 ALA A 145 9.540 -0.627 0.512 1.00 0.00 H new ATOM 0 HB2 ALA A 145 10.710 0.337 -0.419 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.065 0.083 -1.049 1.00 0.00 H new ATOM 2273 N LEU A 146 8.515 -2.697 -2.368 1.00 0.00 N ATOM 2274 CA LEU A 146 7.422 -3.635 -2.545 1.00 0.00 C ATOM 2275 C LEU A 146 7.924 -4.948 -3.142 1.00 0.00 C ATOM 2276 O LEU A 146 7.257 -5.978 -3.049 1.00 0.00 O ATOM 2277 CB LEU A 146 6.357 -3.024 -3.452 1.00 0.00 C ATOM 2278 CG LEU A 146 5.561 -1.873 -2.837 1.00 0.00 C ATOM 2279 CD1 LEU A 146 4.535 -1.348 -3.831 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.882 -2.317 -1.550 1.00 0.00 C ATOM 0 H LEU A 146 8.674 -2.082 -3.166 1.00 0.00 H new ATOM 0 HA LEU A 146 6.987 -3.847 -1.568 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.839 -2.666 -4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 146 5.661 -3.809 -3.748 1.00 0.00 H new ATOM 0 HG LEU A 146 6.253 -1.066 -2.595 1.00 0.00 H new ATOM 0 HD11 LEU A 146 3.976 -0.529 -3.379 1.00 0.00 H new ATOM 0 HD12 LEU A 146 5.045 -0.989 -4.725 1.00 0.00 H new ATOM 0 HD13 LEU A 146 3.848 -2.150 -4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 146 4.321 -1.483 -1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 146 4.202 -3.141 -1.763 1.00 0.00 H new ATOM 0 HD23 LEU A 146 5.637 -2.645 -0.835 1.00 0.00 H new ATOM 2292 N SER A 147 9.105 -4.901 -3.756 1.00 0.00 N ATOM 2293 CA SER A 147 9.694 -6.083 -4.369 1.00 0.00 C ATOM 2294 C SER A 147 11.061 -6.389 -3.764 1.00 0.00 C ATOM 2295 O SER A 147 11.991 -6.773 -4.474 1.00 0.00 O ATOM 2296 CB SER A 147 9.821 -5.886 -5.880 1.00 0.00 C ATOM 2297 OG SER A 147 9.407 -7.046 -6.582 1.00 0.00 O ATOM 0 H SER A 147 9.670 -4.056 -3.840 1.00 0.00 H new ATOM 0 HA SER A 147 9.037 -6.930 -4.174 1.00 0.00 H new ATOM 0 HB2 SER A 147 9.217 -5.034 -6.191 1.00 0.00 H new ATOM 0 HB3 SER A 147 10.855 -5.653 -6.134 1.00 0.00 H new ATOM 0 HG SER A 147 9.496 -6.894 -7.546 1.00 0.00 H new