USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 871 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 THR OG1 : rot -170:sc= 0.278 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot -15:sc= -1.76! USER MOD Single : A 13 SER OG : rot -170:sc= -0.345 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -137:sc= -0.0306 (180deg=-0.363) USER MOD Single : A 20 THR OG1 : rot -85:sc= 0.318 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0744 USER MOD Single : A 40 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00696) USER MOD Single : A 43 HIS : no HD1:sc= -1.67 K(o=-1.7,f=-4.4) USER MOD Single : A 46 SER OG : rot 96:sc= 0.185 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 144:sc= -0.18 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -35:sc= -2.05 USER MOD Single : A 66 GLN : amide:sc= -2.08 K(o=-2.1,f=-3.2) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.65 K(o=-0.65,f=-2.8!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 124:sc= -0.694 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ -127:sc= 0.461 (180deg=-0.25) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 149:sc= -0.243 (180deg=-1.35!) USER MOD Single : A 130 SER OG : rot 91:sc= 1.19 USER MOD ----------------------------------------------------------------- ATOM 18 N LEU A 2 4.667 1.085 -2.265 1.00 0.00 N ATOM 19 CA LEU A 2 5.455 0.622 -1.128 1.00 0.00 C ATOM 20 C LEU A 2 6.315 1.749 -0.566 1.00 0.00 C ATOM 21 O LEU A 2 6.030 2.286 0.506 1.00 0.00 O ATOM 22 CB LEU A 2 6.342 -0.554 -1.541 1.00 0.00 C ATOM 23 CG LEU A 2 6.083 -1.133 -2.933 1.00 0.00 C ATOM 24 CD1 LEU A 2 6.760 -0.285 -3.998 1.00 0.00 C ATOM 25 CD2 LEU A 2 6.566 -2.574 -3.009 1.00 0.00 C ATOM 0 HA LEU A 2 4.766 0.293 -0.350 1.00 0.00 H new ATOM 0 HB2 LEU A 2 7.383 -0.234 -1.490 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.218 -1.352 -0.809 1.00 0.00 H new ATOM 0 HG LEU A 2 5.009 -1.121 -3.117 1.00 0.00 H new ATOM 0 HD11 LEU A 2 6.565 -0.712 -4.982 1.00 0.00 H new ATOM 0 HD12 LEU A 2 6.366 0.731 -3.959 1.00 0.00 H new ATOM 0 HD13 LEU A 2 7.835 -0.265 -3.818 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.374 -2.970 -4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 2 7.636 -2.610 -2.804 1.00 0.00 H new ATOM 0 HD23 LEU A 2 6.035 -3.175 -2.271 1.00 0.00 H new ATOM 37 N LEU A 3 7.366 2.104 -1.296 1.00 0.00 N ATOM 38 CA LEU A 3 8.267 3.170 -0.871 1.00 0.00 C ATOM 39 C LEU A 3 9.437 3.313 -1.840 1.00 0.00 C ATOM 40 O LEU A 3 9.948 4.412 -2.054 1.00 0.00 O ATOM 41 CB LEU A 3 8.790 2.892 0.539 1.00 0.00 C ATOM 42 CG LEU A 3 8.509 3.973 1.584 1.00 0.00 C ATOM 43 CD1 LEU A 3 7.579 3.442 2.664 1.00 0.00 C ATOM 44 CD2 LEU A 3 9.809 4.473 2.196 1.00 0.00 C ATOM 0 H LEU A 3 7.616 1.670 -2.185 1.00 0.00 H new ATOM 0 HA LEU A 3 7.706 4.105 -0.866 1.00 0.00 H new ATOM 0 HB2 LEU A 3 8.355 1.955 0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 3 9.868 2.741 0.482 1.00 0.00 H new ATOM 0 HG LEU A 3 8.017 4.811 1.090 1.00 0.00 H new ATOM 0 HD11 LEU A 3 7.390 4.225 3.399 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.636 3.133 2.213 1.00 0.00 H new ATOM 0 HD13 LEU A 3 8.043 2.587 3.156 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.590 5.242 2.937 1.00 0.00 H new ATOM 0 HD22 LEU A 3 10.328 3.643 2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 3 10.442 4.893 1.414 1.00 0.00 H new ATOM 56 N ILE A 4 9.854 2.194 -2.424 1.00 0.00 N ATOM 57 CA ILE A 4 10.961 2.195 -3.373 1.00 0.00 C ATOM 58 C ILE A 4 10.568 2.884 -4.675 1.00 0.00 C ATOM 59 O ILE A 4 9.385 3.090 -4.950 1.00 0.00 O ATOM 60 CB ILE A 4 11.436 0.764 -3.685 1.00 0.00 C ATOM 61 CG1 ILE A 4 10.294 -0.055 -4.289 1.00 0.00 C ATOM 62 CG2 ILE A 4 11.967 0.096 -2.426 1.00 0.00 C ATOM 63 CD1 ILE A 4 10.765 -1.234 -5.111 1.00 0.00 C ATOM 0 H ILE A 4 9.442 1.276 -2.257 1.00 0.00 H new ATOM 0 HA ILE A 4 11.777 2.746 -2.906 1.00 0.00 H new ATOM 0 HB ILE A 4 12.245 0.816 -4.413 1.00 0.00 H new ATOM 0 HG12 ILE A 4 9.652 -0.416 -3.485 1.00 0.00 H new ATOM 0 HG13 ILE A 4 9.684 0.595 -4.917 1.00 0.00 H new ATOM 0 HG21 ILE A 4 12.299 -0.915 -2.663 1.00 0.00 H new ATOM 0 HG22 ILE A 4 12.806 0.671 -2.035 1.00 0.00 H new ATOM 0 HG23 ILE A 4 11.177 0.052 -1.676 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.902 -1.769 -5.508 1.00 0.00 H new ATOM 0 HD12 ILE A 4 11.383 -0.879 -5.936 1.00 0.00 H new ATOM 0 HD13 ILE A 4 11.350 -1.905 -4.482 1.00 0.00 H new ATOM 75 N THR A 5 11.568 3.238 -5.477 1.00 0.00 N ATOM 76 CA THR A 5 11.328 3.902 -6.751 1.00 0.00 C ATOM 77 C THR A 5 11.683 2.993 -7.921 1.00 0.00 C ATOM 78 O THR A 5 12.447 2.036 -7.786 1.00 0.00 O ATOM 79 CB THR A 5 12.138 5.207 -6.866 1.00 0.00 C ATOM 80 OG1 THR A 5 13.332 4.978 -7.623 1.00 0.00 O ATOM 81 CG2 THR A 5 12.500 5.742 -5.488 1.00 0.00 C ATOM 0 H THR A 5 12.552 3.075 -5.266 1.00 0.00 H new ATOM 0 HA THR A 5 10.265 4.138 -6.788 1.00 0.00 H new ATOM 0 HB THR A 5 11.522 5.947 -7.376 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.915 5.763 -7.559 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.072 6.664 -5.594 1.00 0.00 H new ATOM 0 HG22 THR A 5 11.589 5.943 -4.925 1.00 0.00 H new ATOM 0 HG23 THR A 5 13.099 5.003 -4.957 1.00 0.00 H new ATOM 89 N PRO A 6 11.118 3.295 -9.100 1.00 0.00 N ATOM 90 CA PRO A 6 11.363 2.517 -10.318 1.00 0.00 C ATOM 91 C PRO A 6 12.784 2.692 -10.843 1.00 0.00 C ATOM 92 O PRO A 6 13.235 1.938 -11.705 1.00 0.00 O ATOM 93 CB PRO A 6 10.351 3.089 -11.313 1.00 0.00 C ATOM 94 CG PRO A 6 10.088 4.474 -10.833 1.00 0.00 C ATOM 95 CD PRO A 6 10.198 4.420 -9.334 1.00 0.00 C ATOM 0 HA PRO A 6 11.254 1.446 -10.146 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.751 3.091 -12.327 1.00 0.00 H new ATOM 0 HB3 PRO A 6 9.436 2.496 -11.332 1.00 0.00 H new ATOM 0 HG2 PRO A 6 10.809 5.176 -11.252 1.00 0.00 H new ATOM 0 HG3 PRO A 6 9.098 4.812 -11.140 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.590 5.352 -8.926 1.00 0.00 H new ATOM 0 HD3 PRO A 6 9.228 4.250 -8.866 1.00 0.00 H new ATOM 103 N ASP A 7 13.484 3.691 -10.317 1.00 0.00 N ATOM 104 CA ASP A 7 14.856 3.964 -10.732 1.00 0.00 C ATOM 105 C ASP A 7 15.829 3.001 -10.060 1.00 0.00 C ATOM 106 O ASP A 7 16.874 2.671 -10.618 1.00 0.00 O ATOM 107 CB ASP A 7 15.234 5.408 -10.396 1.00 0.00 C ATOM 108 CG ASP A 7 15.327 6.283 -11.630 1.00 0.00 C ATOM 109 OD1 ASP A 7 16.264 7.106 -11.706 1.00 0.00 O ATOM 110 OD2 ASP A 7 14.463 6.145 -12.522 1.00 0.00 O ATOM 0 H ASP A 7 13.125 4.325 -9.603 1.00 0.00 H new ATOM 0 HA ASP A 7 14.919 3.821 -11.811 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.494 5.825 -9.713 1.00 0.00 H new ATOM 0 HB3 ASP A 7 16.191 5.418 -9.874 1.00 0.00 H new ATOM 115 N GLU A 8 15.477 2.555 -8.858 1.00 0.00 N ATOM 116 CA GLU A 8 16.321 1.631 -8.109 1.00 0.00 C ATOM 117 C GLU A 8 16.259 0.229 -8.710 1.00 0.00 C ATOM 118 O GLU A 8 17.227 -0.530 -8.645 1.00 0.00 O ATOM 119 CB GLU A 8 15.892 1.588 -6.641 1.00 0.00 C ATOM 120 CG GLU A 8 16.422 2.750 -5.818 1.00 0.00 C ATOM 121 CD GLU A 8 17.361 2.304 -4.714 1.00 0.00 C ATOM 122 OE1 GLU A 8 16.908 2.207 -3.554 1.00 0.00 O ATOM 123 OE2 GLU A 8 18.547 2.051 -5.010 1.00 0.00 O ATOM 0 H GLU A 8 14.614 2.818 -8.382 1.00 0.00 H new ATOM 0 HA GLU A 8 17.349 1.989 -8.169 1.00 0.00 H new ATOM 0 HB2 GLU A 8 14.803 1.584 -6.589 1.00 0.00 H new ATOM 0 HB3 GLU A 8 16.236 0.653 -6.198 1.00 0.00 H new ATOM 0 HG2 GLU A 8 16.944 3.447 -6.474 1.00 0.00 H new ATOM 0 HG3 GLU A 8 15.584 3.292 -5.380 1.00 0.00 H new ATOM 130 N LEU A 9 15.114 -0.108 -9.293 1.00 0.00 N ATOM 131 CA LEU A 9 14.924 -1.418 -9.905 1.00 0.00 C ATOM 132 C LEU A 9 15.918 -1.639 -11.040 1.00 0.00 C ATOM 133 O LEU A 9 16.610 -2.656 -11.086 1.00 0.00 O ATOM 134 CB LEU A 9 13.494 -1.555 -10.431 1.00 0.00 C ATOM 135 CG LEU A 9 13.279 -2.597 -11.529 1.00 0.00 C ATOM 136 CD1 LEU A 9 13.886 -3.931 -11.124 1.00 0.00 C ATOM 137 CD2 LEU A 9 11.796 -2.753 -11.833 1.00 0.00 C ATOM 0 H LEU A 9 14.303 0.508 -9.355 1.00 0.00 H new ATOM 0 HA LEU A 9 15.098 -2.176 -9.141 1.00 0.00 H new ATOM 0 HB2 LEU A 9 12.842 -1.800 -9.593 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.174 -0.585 -10.811 1.00 0.00 H new ATOM 0 HG LEU A 9 13.780 -2.253 -12.434 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.723 -4.661 -11.917 1.00 0.00 H new ATOM 0 HD12 LEU A 9 14.956 -3.808 -10.958 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.414 -4.282 -10.206 1.00 0.00 H new ATOM 0 HD21 LEU A 9 11.662 -3.499 -12.617 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.272 -3.074 -10.933 1.00 0.00 H new ATOM 0 HD23 LEU A 9 11.391 -1.798 -12.167 1.00 0.00 H new ATOM 149 N LYS A 10 15.987 -0.677 -11.955 1.00 0.00 N ATOM 150 CA LYS A 10 16.900 -0.762 -13.089 1.00 0.00 C ATOM 151 C LYS A 10 18.345 -0.571 -12.640 1.00 0.00 C ATOM 152 O LYS A 10 19.272 -1.091 -13.261 1.00 0.00 O ATOM 153 CB LYS A 10 16.537 0.288 -14.141 1.00 0.00 C ATOM 154 CG LYS A 10 16.966 1.696 -13.768 1.00 0.00 C ATOM 155 CD LYS A 10 18.298 2.060 -14.403 1.00 0.00 C ATOM 156 CE LYS A 10 18.580 3.550 -14.292 1.00 0.00 C ATOM 157 NZ LYS A 10 19.393 4.047 -15.436 1.00 0.00 N ATOM 0 H LYS A 10 15.421 0.171 -11.933 1.00 0.00 H new ATOM 0 HA LYS A 10 16.804 -1.755 -13.528 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.000 0.015 -15.089 1.00 0.00 H new ATOM 0 HB3 LYS A 10 15.458 0.275 -14.298 1.00 0.00 H new ATOM 0 HG2 LYS A 10 16.203 2.406 -14.088 1.00 0.00 H new ATOM 0 HG3 LYS A 10 17.044 1.778 -12.684 1.00 0.00 H new ATOM 0 HD2 LYS A 10 19.098 1.500 -13.919 1.00 0.00 H new ATOM 0 HD3 LYS A 10 18.294 1.767 -15.453 1.00 0.00 H new ATOM 0 HE2 LYS A 10 17.637 4.096 -14.252 1.00 0.00 H new ATOM 0 HE3 LYS A 10 19.105 3.752 -13.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 19.564 5.067 -15.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 20.303 3.544 -15.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 18.881 3.878 -16.325 1.00 0.00 H new ATOM 171 N SER A 11 18.529 0.178 -11.558 1.00 0.00 N ATOM 172 CA SER A 11 19.862 0.440 -11.027 1.00 0.00 C ATOM 173 C SER A 11 20.419 -0.794 -10.324 1.00 0.00 C ATOM 174 O SER A 11 21.626 -1.038 -10.338 1.00 0.00 O ATOM 175 CB SER A 11 19.824 1.622 -10.056 1.00 0.00 C ATOM 176 OG SER A 11 21.109 2.202 -9.908 1.00 0.00 O ATOM 0 H SER A 11 17.772 0.614 -11.032 1.00 0.00 H new ATOM 0 HA SER A 11 20.517 0.687 -11.862 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.122 2.373 -10.419 1.00 0.00 H new ATOM 0 HB3 SER A 11 19.458 1.288 -9.085 1.00 0.00 H new ATOM 0 HG SER A 11 21.058 2.956 -9.284 1.00 0.00 H new ATOM 182 N TYR A 12 19.532 -1.568 -9.711 1.00 0.00 N ATOM 183 CA TYR A 12 19.933 -2.776 -9.000 1.00 0.00 C ATOM 184 C TYR A 12 19.935 -3.983 -9.933 1.00 0.00 C ATOM 185 O TYR A 12 20.905 -4.739 -9.987 1.00 0.00 O ATOM 186 CB TYR A 12 18.997 -3.033 -7.818 1.00 0.00 C ATOM 187 CG TYR A 12 19.214 -4.373 -7.153 1.00 0.00 C ATOM 188 CD1 TYR A 12 18.383 -5.452 -7.433 1.00 0.00 C ATOM 189 CD2 TYR A 12 20.248 -4.562 -6.245 1.00 0.00 C ATOM 190 CE1 TYR A 12 18.577 -6.678 -6.828 1.00 0.00 C ATOM 191 CE2 TYR A 12 20.450 -5.785 -5.637 1.00 0.00 C ATOM 192 CZ TYR A 12 19.612 -6.840 -5.931 1.00 0.00 C ATOM 193 OH TYR A 12 19.809 -8.060 -5.326 1.00 0.00 O ATOM 0 H TYR A 12 18.530 -1.381 -9.692 1.00 0.00 H new ATOM 0 HA TYR A 12 20.946 -2.627 -8.627 1.00 0.00 H new ATOM 0 HB2 TYR A 12 19.134 -2.244 -7.079 1.00 0.00 H new ATOM 0 HB3 TYR A 12 17.965 -2.971 -8.163 1.00 0.00 H new ATOM 0 HD1 TYR A 12 17.572 -5.329 -8.136 1.00 0.00 H new ATOM 0 HD2 TYR A 12 20.905 -3.738 -6.011 1.00 0.00 H new ATOM 0 HE1 TYR A 12 17.922 -7.506 -7.056 1.00 0.00 H new ATOM 0 HE2 TYR A 12 21.260 -5.915 -4.935 1.00 0.00 H new ATOM 0 HH TYR A 12 19.012 -8.617 -5.447 1.00 0.00 H new ATOM 203 N SER A 13 18.841 -4.156 -10.668 1.00 0.00 N ATOM 204 CA SER A 13 18.713 -5.272 -11.598 1.00 0.00 C ATOM 205 C SER A 13 19.716 -5.144 -12.740 1.00 0.00 C ATOM 206 O SER A 13 20.190 -4.050 -13.047 1.00 0.00 O ATOM 207 CB SER A 13 17.291 -5.337 -12.157 1.00 0.00 C ATOM 208 OG SER A 13 17.121 -6.472 -12.988 1.00 0.00 O ATOM 0 H SER A 13 18.030 -3.538 -10.637 1.00 0.00 H new ATOM 0 HA SER A 13 18.924 -6.193 -11.054 1.00 0.00 H new ATOM 0 HB2 SER A 13 16.575 -5.373 -11.336 1.00 0.00 H new ATOM 0 HB3 SER A 13 17.078 -4.431 -12.725 1.00 0.00 H new ATOM 0 HG SER A 13 16.262 -6.409 -13.456 1.00 0.00 H new ATOM 214 N VAL A 14 20.034 -6.272 -13.368 1.00 0.00 N ATOM 215 CA VAL A 14 20.979 -6.288 -14.479 1.00 0.00 C ATOM 216 C VAL A 14 20.266 -6.528 -15.804 1.00 0.00 C ATOM 217 O VAL A 14 20.796 -6.218 -16.872 1.00 0.00 O ATOM 218 CB VAL A 14 22.056 -7.372 -14.284 1.00 0.00 C ATOM 219 CG1 VAL A 14 22.794 -7.162 -12.971 1.00 0.00 C ATOM 220 CG2 VAL A 14 21.431 -8.758 -14.338 1.00 0.00 C ATOM 0 H VAL A 14 19.651 -7.186 -13.127 1.00 0.00 H new ATOM 0 HA VAL A 14 21.459 -5.309 -14.500 1.00 0.00 H new ATOM 0 HB VAL A 14 22.779 -7.292 -15.096 1.00 0.00 H new ATOM 0 HG11 VAL A 14 23.551 -7.937 -12.851 1.00 0.00 H new ATOM 0 HG12 VAL A 14 23.275 -6.184 -12.976 1.00 0.00 H new ATOM 0 HG13 VAL A 14 22.086 -7.214 -12.144 1.00 0.00 H new ATOM 0 HG21 VAL A 14 22.206 -9.512 -14.199 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.686 -8.852 -13.548 1.00 0.00 H new ATOM 0 HG23 VAL A 14 20.953 -8.904 -15.307 1.00 0.00 H new ATOM 230 N PHE A 15 19.060 -7.081 -15.729 1.00 0.00 N ATOM 231 CA PHE A 15 18.273 -7.363 -16.924 1.00 0.00 C ATOM 232 C PHE A 15 18.160 -6.124 -17.807 1.00 0.00 C ATOM 233 O PHE A 15 17.755 -5.057 -17.347 1.00 0.00 O ATOM 234 CB PHE A 15 16.877 -7.855 -16.536 1.00 0.00 C ATOM 235 CG PHE A 15 16.740 -9.350 -16.559 1.00 0.00 C ATOM 236 CD1 PHE A 15 16.923 -10.094 -15.405 1.00 0.00 C ATOM 237 CD2 PHE A 15 16.428 -10.012 -17.736 1.00 0.00 C ATOM 238 CE1 PHE A 15 16.798 -11.471 -15.423 1.00 0.00 C ATOM 239 CE2 PHE A 15 16.301 -11.388 -17.760 1.00 0.00 C ATOM 240 CZ PHE A 15 16.487 -12.119 -16.602 1.00 0.00 C ATOM 0 H PHE A 15 18.606 -7.343 -14.854 1.00 0.00 H new ATOM 0 HA PHE A 15 18.783 -8.144 -17.488 1.00 0.00 H new ATOM 0 HB2 PHE A 15 16.637 -7.492 -15.537 1.00 0.00 H new ATOM 0 HB3 PHE A 15 16.145 -7.421 -17.217 1.00 0.00 H new ATOM 0 HD1 PHE A 15 17.166 -9.592 -14.480 1.00 0.00 H new ATOM 0 HD2 PHE A 15 16.283 -9.446 -18.644 1.00 0.00 H new ATOM 0 HE1 PHE A 15 16.943 -12.039 -14.516 1.00 0.00 H new ATOM 0 HE2 PHE A 15 16.056 -11.892 -18.683 1.00 0.00 H new ATOM 0 HZ PHE A 15 16.389 -13.194 -16.619 1.00 0.00 H new ATOM 250 N GLU A 16 18.523 -6.274 -19.077 1.00 0.00 N ATOM 251 CA GLU A 16 18.464 -5.167 -20.024 1.00 0.00 C ATOM 252 C GLU A 16 17.018 -4.784 -20.324 1.00 0.00 C ATOM 253 O GLU A 16 16.726 -3.637 -20.663 1.00 0.00 O ATOM 254 CB GLU A 16 19.185 -5.538 -21.321 1.00 0.00 C ATOM 255 CG GLU A 16 18.496 -6.640 -22.107 1.00 0.00 C ATOM 256 CD GLU A 16 19.151 -6.896 -23.451 1.00 0.00 C ATOM 257 OE1 GLU A 16 19.201 -5.958 -24.273 1.00 0.00 O ATOM 258 OE2 GLU A 16 19.612 -8.034 -23.680 1.00 0.00 O ATOM 0 H GLU A 16 18.861 -7.151 -19.474 1.00 0.00 H new ATOM 0 HA GLU A 16 18.962 -4.309 -19.573 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.264 -4.651 -21.949 1.00 0.00 H new ATOM 0 HB3 GLU A 16 20.201 -5.853 -21.084 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.506 -7.559 -21.521 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.451 -6.372 -22.262 1.00 0.00 H new ATOM 265 N SER A 17 16.117 -5.753 -20.198 1.00 0.00 N ATOM 266 CA SER A 17 14.702 -5.520 -20.460 1.00 0.00 C ATOM 267 C SER A 17 14.108 -4.567 -19.427 1.00 0.00 C ATOM 268 O SER A 17 13.465 -3.576 -19.776 1.00 0.00 O ATOM 269 CB SER A 17 13.934 -6.843 -20.450 1.00 0.00 C ATOM 270 OG SER A 17 13.029 -6.916 -21.537 1.00 0.00 O ATOM 0 H SER A 17 16.342 -6.707 -19.916 1.00 0.00 H new ATOM 0 HA SER A 17 14.611 -5.063 -21.446 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.636 -7.675 -20.501 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.389 -6.943 -19.512 1.00 0.00 H new ATOM 0 HG SER A 17 12.552 -7.772 -21.509 1.00 0.00 H new ATOM 276 N VAL A 18 14.328 -4.873 -18.153 1.00 0.00 N ATOM 277 CA VAL A 18 13.816 -4.044 -17.068 1.00 0.00 C ATOM 278 C VAL A 18 14.366 -2.625 -17.154 1.00 0.00 C ATOM 279 O VAL A 18 13.667 -1.657 -16.855 1.00 0.00 O ATOM 280 CB VAL A 18 14.172 -4.638 -15.692 1.00 0.00 C ATOM 281 CG1 VAL A 18 13.574 -3.796 -14.575 1.00 0.00 C ATOM 282 CG2 VAL A 18 13.698 -6.081 -15.596 1.00 0.00 C ATOM 0 H VAL A 18 14.857 -5.689 -17.846 1.00 0.00 H new ATOM 0 HA VAL A 18 12.732 -4.017 -17.175 1.00 0.00 H new ATOM 0 HB VAL A 18 15.256 -4.627 -15.581 1.00 0.00 H new ATOM 0 HG11 VAL A 18 13.836 -4.231 -13.611 1.00 0.00 H new ATOM 0 HG12 VAL A 18 13.967 -2.781 -14.634 1.00 0.00 H new ATOM 0 HG13 VAL A 18 12.489 -3.771 -14.679 1.00 0.00 H new ATOM 0 HG21 VAL A 18 13.958 -6.485 -14.618 1.00 0.00 H new ATOM 0 HG22 VAL A 18 12.617 -6.118 -15.729 1.00 0.00 H new ATOM 0 HG23 VAL A 18 14.180 -6.675 -16.373 1.00 0.00 H new ATOM 292 N LYS A 19 15.625 -2.508 -17.564 1.00 0.00 N ATOM 293 CA LYS A 19 16.270 -1.207 -17.692 1.00 0.00 C ATOM 294 C LYS A 19 15.753 -0.461 -18.918 1.00 0.00 C ATOM 295 O LYS A 19 15.360 0.703 -18.830 1.00 0.00 O ATOM 296 CB LYS A 19 17.788 -1.375 -17.788 1.00 0.00 C ATOM 297 CG LYS A 19 18.409 -2.003 -16.552 1.00 0.00 C ATOM 298 CD LYS A 19 19.746 -2.654 -16.869 1.00 0.00 C ATOM 299 CE LYS A 19 20.800 -2.294 -15.834 1.00 0.00 C ATOM 300 NZ LYS A 19 21.110 -0.838 -15.840 1.00 0.00 N ATOM 0 H LYS A 19 16.219 -3.299 -17.813 1.00 0.00 H new ATOM 0 HA LYS A 19 16.030 -0.622 -16.804 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.023 -1.991 -18.656 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.243 -0.399 -17.958 1.00 0.00 H new ATOM 0 HG2 LYS A 19 18.547 -1.240 -15.786 1.00 0.00 H new ATOM 0 HG3 LYS A 19 17.729 -2.749 -16.141 1.00 0.00 H new ATOM 0 HD2 LYS A 19 19.625 -3.737 -16.905 1.00 0.00 H new ATOM 0 HD3 LYS A 19 20.081 -2.337 -17.857 1.00 0.00 H new ATOM 0 HE2 LYS A 19 20.451 -2.587 -14.844 1.00 0.00 H new ATOM 0 HE3 LYS A 19 21.711 -2.860 -16.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 22.138 -0.702 -15.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 20.766 -0.414 -16.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 20.642 -0.380 -15.032 1.00 0.00 H new ATOM 314 N THR A 20 15.753 -1.139 -20.062 1.00 0.00 N ATOM 315 CA THR A 20 15.284 -0.541 -21.305 1.00 0.00 C ATOM 316 C THR A 20 13.854 -0.032 -21.165 1.00 0.00 C ATOM 317 O THR A 20 13.527 1.065 -21.620 1.00 0.00 O ATOM 318 CB THR A 20 15.347 -1.545 -22.471 1.00 0.00 C ATOM 319 OG1 THR A 20 14.736 -2.782 -22.086 1.00 0.00 O ATOM 320 CG2 THR A 20 16.787 -1.795 -22.893 1.00 0.00 C ATOM 0 H THR A 20 16.073 -2.103 -20.153 1.00 0.00 H new ATOM 0 HA THR A 20 15.946 0.297 -21.521 1.00 0.00 H new ATOM 0 HB THR A 20 14.806 -1.120 -23.316 1.00 0.00 H new ATOM 0 HG1 THR A 20 15.394 -3.342 -21.624 1.00 0.00 H new ATOM 0 HG21 THR A 20 16.806 -2.507 -23.718 1.00 0.00 H new ATOM 0 HG22 THR A 20 17.240 -0.857 -23.213 1.00 0.00 H new ATOM 0 HG23 THR A 20 17.348 -2.200 -22.051 1.00 0.00 H new ATOM 328 N ARG A 21 13.004 -0.834 -20.531 1.00 0.00 N ATOM 329 CA ARG A 21 11.608 -0.465 -20.331 1.00 0.00 C ATOM 330 C ARG A 21 11.498 0.922 -19.704 1.00 0.00 C ATOM 331 O ARG A 21 12.403 1.392 -19.015 1.00 0.00 O ATOM 332 CB ARG A 21 10.908 -1.495 -19.445 1.00 0.00 C ATOM 333 CG ARG A 21 10.785 -1.066 -17.992 1.00 0.00 C ATOM 334 CD ARG A 21 10.598 -2.262 -17.071 1.00 0.00 C ATOM 335 NE ARG A 21 10.086 -3.428 -17.786 1.00 0.00 N ATOM 336 CZ ARG A 21 8.802 -3.608 -18.072 1.00 0.00 C ATOM 337 NH1 ARG A 21 7.904 -2.703 -17.707 1.00 0.00 N ATOM 338 NH2 ARG A 21 8.413 -4.696 -18.726 1.00 0.00 N ATOM 0 H ARG A 21 13.258 -1.744 -20.147 1.00 0.00 H new ATOM 0 HA ARG A 21 11.120 -0.444 -21.305 1.00 0.00 H new ATOM 0 HB2 ARG A 21 9.912 -1.687 -19.844 1.00 0.00 H new ATOM 0 HB3 ARG A 21 11.457 -2.435 -19.492 1.00 0.00 H new ATOM 0 HG2 ARG A 21 11.678 -0.515 -17.698 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.940 -0.386 -17.883 1.00 0.00 H new ATOM 0 HD2 ARG A 21 11.551 -2.512 -16.604 1.00 0.00 H new ATOM 0 HD3 ARG A 21 9.909 -1.998 -16.269 1.00 0.00 H new ATOM 0 HE ARG A 21 10.751 -4.143 -18.082 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.199 -1.866 -17.205 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.918 -2.844 -17.928 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.101 -5.394 -19.009 1.00 0.00 H new ATOM 0 HH22 ARG A 21 7.426 -4.834 -18.945 1.00 0.00 H new ATOM 352 N PRO A 22 10.362 1.592 -19.946 1.00 0.00 N ATOM 353 CA PRO A 22 10.106 2.934 -19.414 1.00 0.00 C ATOM 354 C PRO A 22 9.895 2.928 -17.904 1.00 0.00 C ATOM 355 O PRO A 22 9.456 1.929 -17.333 1.00 0.00 O ATOM 356 CB PRO A 22 8.823 3.361 -20.131 1.00 0.00 C ATOM 357 CG PRO A 22 8.143 2.084 -20.484 1.00 0.00 C ATOM 358 CD PRO A 22 9.240 1.093 -20.758 1.00 0.00 C ATOM 0 HA PRO A 22 10.948 3.606 -19.581 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.196 3.978 -19.487 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.044 3.951 -21.021 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.504 1.744 -19.669 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.504 2.211 -21.358 1.00 0.00 H new ATOM 0 HD2 PRO A 22 8.951 0.083 -20.467 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.495 1.058 -21.817 1.00 0.00 H new ATOM 366 N ASP A 23 10.210 4.048 -17.263 1.00 0.00 N ATOM 367 CA ASP A 23 10.053 4.172 -15.818 1.00 0.00 C ATOM 368 C ASP A 23 8.582 4.096 -15.422 1.00 0.00 C ATOM 369 O ASP A 23 8.228 3.449 -14.437 1.00 0.00 O ATOM 370 CB ASP A 23 10.658 5.489 -15.329 1.00 0.00 C ATOM 371 CG ASP A 23 12.128 5.616 -15.678 1.00 0.00 C ATOM 372 OD1 ASP A 23 12.729 4.603 -16.092 1.00 0.00 O ATOM 373 OD2 ASP A 23 12.676 6.729 -15.538 1.00 0.00 O ATOM 0 H ASP A 23 10.576 4.883 -17.721 1.00 0.00 H new ATOM 0 HA ASP A 23 10.580 3.342 -15.348 1.00 0.00 H new ATOM 0 HB2 ASP A 23 10.110 6.322 -15.768 1.00 0.00 H new ATOM 0 HB3 ASP A 23 10.537 5.562 -14.248 1.00 0.00 H new ATOM 378 N GLU A 24 7.730 4.761 -16.197 1.00 0.00 N ATOM 379 CA GLU A 24 6.298 4.769 -15.925 1.00 0.00 C ATOM 380 C GLU A 24 5.763 3.347 -15.781 1.00 0.00 C ATOM 381 O GLU A 24 4.780 3.109 -15.079 1.00 0.00 O ATOM 382 CB GLU A 24 5.548 5.497 -17.042 1.00 0.00 C ATOM 383 CG GLU A 24 5.494 4.719 -18.346 1.00 0.00 C ATOM 384 CD GLU A 24 5.108 5.587 -19.528 1.00 0.00 C ATOM 385 OE1 GLU A 24 5.665 6.698 -19.655 1.00 0.00 O ATOM 386 OE2 GLU A 24 4.249 5.157 -20.326 1.00 0.00 O ATOM 0 H GLU A 24 8.007 5.300 -17.017 1.00 0.00 H new ATOM 0 HA GLU A 24 6.136 5.296 -14.985 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.531 5.704 -16.710 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.027 6.459 -17.222 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.467 4.266 -18.535 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.777 3.904 -18.249 1.00 0.00 H new ATOM 393 N LEU A 25 6.417 2.405 -16.453 1.00 0.00 N ATOM 394 CA LEU A 25 6.008 1.006 -16.401 1.00 0.00 C ATOM 395 C LEU A 25 6.675 0.286 -15.233 1.00 0.00 C ATOM 396 O LEU A 25 6.101 -0.634 -14.648 1.00 0.00 O ATOM 397 CB LEU A 25 6.358 0.304 -17.714 1.00 0.00 C ATOM 398 CG LEU A 25 5.390 0.532 -18.876 1.00 0.00 C ATOM 399 CD1 LEU A 25 5.872 -0.194 -20.123 1.00 0.00 C ATOM 400 CD2 LEU A 25 3.988 0.077 -18.500 1.00 0.00 C ATOM 0 H LEU A 25 7.232 2.585 -17.040 1.00 0.00 H new ATOM 0 HA LEU A 25 4.928 0.974 -16.254 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.350 0.631 -18.024 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.421 -0.768 -17.524 1.00 0.00 H new ATOM 0 HG LEU A 25 5.358 1.600 -19.092 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.171 -0.020 -20.939 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.856 0.180 -20.404 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.935 -1.263 -19.920 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.313 0.247 -19.339 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.003 -0.985 -18.256 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.642 0.643 -17.635 1.00 0.00 H new ATOM 412 N LEU A 26 7.887 0.712 -14.897 1.00 0.00 N ATOM 413 CA LEU A 26 8.632 0.110 -13.797 1.00 0.00 C ATOM 414 C LEU A 26 7.803 0.107 -12.516 1.00 0.00 C ATOM 415 O LEU A 26 7.763 -0.888 -11.792 1.00 0.00 O ATOM 416 CB LEU A 26 9.942 0.865 -13.568 1.00 0.00 C ATOM 417 CG LEU A 26 11.069 0.568 -14.558 1.00 0.00 C ATOM 418 CD1 LEU A 26 12.202 1.569 -14.393 1.00 0.00 C ATOM 419 CD2 LEU A 26 11.580 -0.854 -14.373 1.00 0.00 C ATOM 0 H LEU A 26 8.375 1.472 -15.370 1.00 0.00 H new ATOM 0 HA LEU A 26 8.857 -0.922 -14.065 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.732 1.934 -13.597 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.298 0.638 -12.563 1.00 0.00 H new ATOM 0 HG LEU A 26 10.673 0.662 -15.569 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.995 1.342 -15.106 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.827 2.576 -14.576 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.597 1.507 -13.379 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.382 -1.048 -15.086 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.959 -0.975 -13.358 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.765 -1.558 -14.542 1.00 0.00 H new ATOM 431 N LYS A 27 7.142 1.227 -12.243 1.00 0.00 N ATOM 432 CA LYS A 27 6.311 1.354 -11.051 1.00 0.00 C ATOM 433 C LYS A 27 5.233 0.275 -11.022 1.00 0.00 C ATOM 434 O LYS A 27 5.091 -0.446 -10.035 1.00 0.00 O ATOM 435 CB LYS A 27 5.662 2.739 -11.002 1.00 0.00 C ATOM 436 CG LYS A 27 6.659 3.881 -11.098 1.00 0.00 C ATOM 437 CD LYS A 27 6.181 4.960 -12.054 1.00 0.00 C ATOM 438 CE LYS A 27 5.301 5.981 -11.349 1.00 0.00 C ATOM 439 NZ LYS A 27 5.669 7.377 -11.713 1.00 0.00 N ATOM 0 H LYS A 27 7.166 2.060 -12.831 1.00 0.00 H new ATOM 0 HA LYS A 27 6.951 1.228 -10.177 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.945 2.824 -11.818 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.100 2.835 -10.073 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.815 4.313 -10.109 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.622 3.497 -11.434 1.00 0.00 H new ATOM 0 HD2 LYS A 27 7.041 5.463 -12.496 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.625 4.502 -12.872 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.258 5.801 -11.608 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.388 5.852 -10.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 5.046 8.042 -11.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 6.657 7.557 -11.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.561 7.508 -12.739 1.00 0.00 H new ATOM 453 N GLN A 28 4.478 0.169 -12.111 1.00 0.00 N ATOM 454 CA GLN A 28 3.414 -0.823 -12.209 1.00 0.00 C ATOM 455 C GLN A 28 3.950 -2.225 -11.937 1.00 0.00 C ATOM 456 O GLN A 28 3.229 -3.090 -11.441 1.00 0.00 O ATOM 457 CB GLN A 28 2.766 -0.771 -13.594 1.00 0.00 C ATOM 458 CG GLN A 28 1.679 0.284 -13.718 1.00 0.00 C ATOM 459 CD GLN A 28 0.671 -0.041 -14.802 1.00 0.00 C ATOM 460 OE1 GLN A 28 -0.420 -0.538 -14.523 1.00 0.00 O ATOM 461 NE2 GLN A 28 1.031 0.240 -16.049 1.00 0.00 N ATOM 0 H GLN A 28 4.583 0.758 -12.937 1.00 0.00 H new ATOM 0 HA GLN A 28 2.662 -0.589 -11.455 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.537 -0.576 -14.339 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.340 -1.748 -13.824 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.162 0.381 -12.764 1.00 0.00 H new ATOM 0 HG3 GLN A 28 2.138 1.249 -13.931 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.945 0.652 -16.235 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.393 0.044 -16.820 1.00 0.00 H new ATOM 470 N ASP A 29 5.219 -2.442 -12.267 1.00 0.00 N ATOM 471 CA ASP A 29 5.852 -3.738 -12.057 1.00 0.00 C ATOM 472 C ASP A 29 6.213 -3.936 -10.588 1.00 0.00 C ATOM 473 O ASP A 29 6.211 -5.060 -10.084 1.00 0.00 O ATOM 474 CB ASP A 29 7.105 -3.864 -12.925 1.00 0.00 C ATOM 475 CG ASP A 29 6.881 -3.372 -14.341 1.00 0.00 C ATOM 476 OD1 ASP A 29 5.772 -3.584 -14.874 1.00 0.00 O ATOM 477 OD2 ASP A 29 7.814 -2.774 -14.916 1.00 0.00 O ATOM 0 H ASP A 29 5.829 -1.737 -12.681 1.00 0.00 H new ATOM 0 HA ASP A 29 5.141 -4.512 -12.344 1.00 0.00 H new ATOM 0 HB2 ASP A 29 7.917 -3.296 -12.470 1.00 0.00 H new ATOM 0 HB3 ASP A 29 7.421 -4.907 -12.952 1.00 0.00 H new ATOM 482 N ILE A 30 6.523 -2.838 -9.908 1.00 0.00 N ATOM 483 CA ILE A 30 6.886 -2.891 -8.497 1.00 0.00 C ATOM 484 C ILE A 30 5.650 -3.043 -7.616 1.00 0.00 C ATOM 485 O ILE A 30 5.589 -3.927 -6.761 1.00 0.00 O ATOM 486 CB ILE A 30 7.657 -1.630 -8.066 1.00 0.00 C ATOM 487 CG1 ILE A 30 8.927 -1.471 -8.905 1.00 0.00 C ATOM 488 CG2 ILE A 30 7.999 -1.698 -6.585 1.00 0.00 C ATOM 489 CD1 ILE A 30 9.437 -0.048 -8.965 1.00 0.00 C ATOM 0 H ILE A 30 6.530 -1.901 -10.311 1.00 0.00 H new ATOM 0 HA ILE A 30 7.529 -3.762 -8.370 1.00 0.00 H new ATOM 0 HB ILE A 30 7.022 -0.759 -8.232 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.707 -2.111 -8.493 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.730 -1.821 -9.918 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.544 -0.799 -6.296 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.081 -1.769 -6.002 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.618 -2.575 -6.394 1.00 0.00 H new ATOM 0 HD11 ILE A 30 10.339 -0.010 -9.576 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.674 0.594 -9.405 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.667 0.299 -7.958 1.00 0.00 H new ATOM 501 N LEU A 31 4.666 -2.177 -7.833 1.00 0.00 N ATOM 502 CA LEU A 31 3.429 -2.215 -7.060 1.00 0.00 C ATOM 503 C LEU A 31 2.683 -3.525 -7.293 1.00 0.00 C ATOM 504 O LEU A 31 1.944 -3.991 -6.426 1.00 0.00 O ATOM 505 CB LEU A 31 2.535 -1.032 -7.433 1.00 0.00 C ATOM 506 CG LEU A 31 3.212 0.339 -7.459 1.00 0.00 C ATOM 507 CD1 LEU A 31 2.172 1.448 -7.428 1.00 0.00 C ATOM 508 CD2 LEU A 31 4.178 0.479 -6.292 1.00 0.00 C ATOM 0 H LEU A 31 4.701 -1.440 -8.538 1.00 0.00 H new ATOM 0 HA LEU A 31 3.687 -2.148 -6.003 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.107 -1.222 -8.417 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.706 -0.992 -6.727 1.00 0.00 H new ATOM 0 HG LEU A 31 3.779 0.426 -8.386 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.672 2.416 -7.447 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.520 1.359 -8.297 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.578 1.364 -6.518 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.651 1.461 -6.327 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.633 0.371 -5.354 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.943 -0.294 -6.358 1.00 0.00 H new ATOM 520 N GLU A 32 2.883 -4.114 -8.467 1.00 0.00 N ATOM 521 CA GLU A 32 2.229 -5.371 -8.812 1.00 0.00 C ATOM 522 C GLU A 32 2.952 -6.553 -8.173 1.00 0.00 C ATOM 523 O GLU A 32 2.360 -7.609 -7.949 1.00 0.00 O ATOM 524 CB GLU A 32 2.183 -5.548 -10.331 1.00 0.00 C ATOM 525 CG GLU A 32 1.407 -6.776 -10.778 1.00 0.00 C ATOM 526 CD GLU A 32 -0.088 -6.628 -10.572 1.00 0.00 C ATOM 527 OE1 GLU A 32 -0.798 -6.354 -11.562 1.00 0.00 O ATOM 528 OE2 GLU A 32 -0.547 -6.786 -9.422 1.00 0.00 O ATOM 0 H GLU A 32 3.492 -3.741 -9.195 1.00 0.00 H new ATOM 0 HA GLU A 32 1.210 -5.339 -8.427 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.733 -4.662 -10.778 1.00 0.00 H new ATOM 0 HB3 GLU A 32 3.202 -5.614 -10.712 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.608 -6.964 -11.833 1.00 0.00 H new ATOM 0 HG3 GLU A 32 1.762 -7.646 -10.226 1.00 0.00 H new ATOM 535 N ALA A 33 4.236 -6.368 -7.883 1.00 0.00 N ATOM 536 CA ALA A 33 5.039 -7.417 -7.268 1.00 0.00 C ATOM 537 C ALA A 33 4.728 -7.548 -5.781 1.00 0.00 C ATOM 538 O ALA A 33 4.679 -8.654 -5.241 1.00 0.00 O ATOM 539 CB ALA A 33 6.520 -7.138 -7.477 1.00 0.00 C ATOM 0 H ALA A 33 4.742 -5.501 -8.064 1.00 0.00 H new ATOM 0 HA ALA A 33 4.786 -8.362 -7.749 1.00 0.00 H new ATOM 0 HB1 ALA A 33 7.108 -7.929 -7.013 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.737 -7.104 -8.545 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.777 -6.181 -7.024 1.00 0.00 H new ATOM 545 N THR A 34 4.518 -6.412 -5.123 1.00 0.00 N ATOM 546 CA THR A 34 4.213 -6.400 -3.698 1.00 0.00 C ATOM 547 C THR A 34 2.985 -7.249 -3.391 1.00 0.00 C ATOM 548 O THR A 34 2.800 -7.705 -2.263 1.00 0.00 O ATOM 549 CB THR A 34 3.973 -4.966 -3.187 1.00 0.00 C ATOM 550 OG1 THR A 34 4.016 -4.943 -1.756 1.00 0.00 O ATOM 551 CG2 THR A 34 2.630 -4.439 -3.669 1.00 0.00 C ATOM 0 H THR A 34 4.554 -5.488 -5.555 1.00 0.00 H new ATOM 0 HA THR A 34 5.079 -6.820 -3.186 1.00 0.00 H new ATOM 0 HB THR A 34 4.760 -4.325 -3.583 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.864 -4.028 -1.439 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.482 -3.425 -3.296 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.612 -4.431 -4.759 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.832 -5.082 -3.298 1.00 0.00 H new ATOM 559 N ALA A 35 2.149 -7.459 -4.402 1.00 0.00 N ATOM 560 CA ALA A 35 0.939 -8.256 -4.240 1.00 0.00 C ATOM 561 C ALA A 35 1.278 -9.710 -3.927 1.00 0.00 C ATOM 562 O ALA A 35 0.515 -10.403 -3.254 1.00 0.00 O ATOM 563 CB ALA A 35 0.079 -8.170 -5.492 1.00 0.00 C ATOM 0 H ALA A 35 2.287 -7.088 -5.342 1.00 0.00 H new ATOM 0 HA ALA A 35 0.377 -7.852 -3.398 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -0.821 -8.770 -5.357 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.200 -7.132 -5.671 1.00 0.00 H new ATOM 0 HB3 ALA A 35 0.641 -8.547 -6.346 1.00 0.00 H new ATOM 569 N ASP A 36 2.424 -10.164 -4.420 1.00 0.00 N ATOM 570 CA ASP A 36 2.864 -11.536 -4.193 1.00 0.00 C ATOM 571 C ASP A 36 3.421 -11.701 -2.782 1.00 0.00 C ATOM 572 O ASP A 36 3.006 -12.592 -2.041 1.00 0.00 O ATOM 573 CB ASP A 36 3.923 -11.932 -5.223 1.00 0.00 C ATOM 574 CG ASP A 36 4.066 -13.435 -5.358 1.00 0.00 C ATOM 575 OD1 ASP A 36 5.201 -13.939 -5.224 1.00 0.00 O ATOM 576 OD2 ASP A 36 3.042 -14.108 -5.598 1.00 0.00 O ATOM 0 H ASP A 36 3.066 -9.602 -4.980 1.00 0.00 H new ATOM 0 HA ASP A 36 2.000 -12.192 -4.302 1.00 0.00 H new ATOM 0 HB2 ASP A 36 3.660 -11.507 -6.192 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.883 -11.503 -4.936 1.00 0.00 H new ATOM 581 N ILE A 37 4.364 -10.838 -2.420 1.00 0.00 N ATOM 582 CA ILE A 37 4.978 -10.889 -1.098 1.00 0.00 C ATOM 583 C ILE A 37 3.929 -10.753 0.000 1.00 0.00 C ATOM 584 O ILE A 37 3.864 -11.575 0.915 1.00 0.00 O ATOM 585 CB ILE A 37 6.034 -9.781 -0.925 1.00 0.00 C ATOM 586 CG1 ILE A 37 7.059 -9.841 -2.059 1.00 0.00 C ATOM 587 CG2 ILE A 37 6.721 -9.911 0.426 1.00 0.00 C ATOM 588 CD1 ILE A 37 8.134 -8.782 -1.958 1.00 0.00 C ATOM 0 H ILE A 37 4.720 -10.096 -3.022 1.00 0.00 H new ATOM 0 HA ILE A 37 5.466 -11.860 -1.013 1.00 0.00 H new ATOM 0 HB ILE A 37 5.534 -8.813 -0.965 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.528 -10.825 -2.062 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.541 -9.732 -3.012 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.464 -9.121 0.534 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.980 -9.823 1.221 1.00 0.00 H new ATOM 0 HG23 ILE A 37 7.211 -10.882 0.493 1.00 0.00 H new ATOM 0 HD11 ILE A 37 8.825 -8.885 -2.794 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.675 -7.794 -1.986 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.677 -8.903 -1.021 1.00 0.00 H new ATOM 600 N ILE A 38 3.110 -9.711 -0.097 1.00 0.00 N ATOM 601 CA ILE A 38 2.063 -9.469 0.887 1.00 0.00 C ATOM 602 C ILE A 38 1.136 -10.674 1.010 1.00 0.00 C ATOM 603 O ILE A 38 0.641 -10.982 2.096 1.00 0.00 O ATOM 604 CB ILE A 38 1.227 -8.227 0.526 1.00 0.00 C ATOM 605 CG1 ILE A 38 2.111 -6.979 0.505 1.00 0.00 C ATOM 606 CG2 ILE A 38 0.081 -8.055 1.512 1.00 0.00 C ATOM 607 CD1 ILE A 38 1.456 -5.786 -0.155 1.00 0.00 C ATOM 0 H ILE A 38 3.152 -9.021 -0.847 1.00 0.00 H new ATOM 0 HA ILE A 38 2.560 -9.297 1.841 1.00 0.00 H new ATOM 0 HB ILE A 38 0.806 -8.367 -0.469 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.379 -6.716 1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 38 3.039 -7.210 -0.018 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.501 -7.173 1.244 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.560 -8.936 1.482 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.482 -7.933 2.518 1.00 0.00 H new ATOM 0 HD11 ILE A 38 2.140 -4.938 -0.134 1.00 0.00 H new ATOM 0 HD12 ILE A 38 1.213 -6.030 -1.189 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.543 -5.529 0.382 1.00 0.00 H new ATOM 619 N LEU A 39 0.905 -11.353 -0.108 1.00 0.00 N ATOM 620 CA LEU A 39 0.039 -12.526 -0.126 1.00 0.00 C ATOM 621 C LEU A 39 0.626 -13.650 0.723 1.00 0.00 C ATOM 622 O LEU A 39 -0.094 -14.536 1.183 1.00 0.00 O ATOM 623 CB LEU A 39 -0.167 -13.011 -1.562 1.00 0.00 C ATOM 624 CG LEU A 39 -1.540 -12.729 -2.175 1.00 0.00 C ATOM 625 CD1 LEU A 39 -1.572 -13.162 -3.632 1.00 0.00 C ATOM 626 CD2 LEU A 39 -2.632 -13.434 -1.383 1.00 0.00 C ATOM 0 H LEU A 39 1.306 -11.111 -1.014 1.00 0.00 H new ATOM 0 HA LEU A 39 -0.925 -12.241 0.297 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.592 -12.549 -2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.007 -14.087 -1.590 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.723 -11.655 -2.132 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.556 -12.954 -4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.815 -12.612 -4.192 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.368 -14.231 -3.699 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.602 -13.222 -1.833 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.453 -14.509 -1.394 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.624 -13.076 -0.354 1.00 0.00 H new ATOM 638 N LYS A 40 1.938 -13.606 0.928 1.00 0.00 N ATOM 639 CA LYS A 40 2.623 -14.617 1.723 1.00 0.00 C ATOM 640 C LYS A 40 2.527 -14.296 3.211 1.00 0.00 C ATOM 641 O LYS A 40 2.207 -15.163 4.025 1.00 0.00 O ATOM 642 CB LYS A 40 4.092 -14.715 1.306 1.00 0.00 C ATOM 643 CG LYS A 40 4.391 -15.904 0.408 1.00 0.00 C ATOM 644 CD LYS A 40 5.627 -15.663 -0.442 1.00 0.00 C ATOM 645 CE LYS A 40 5.356 -15.945 -1.912 1.00 0.00 C ATOM 646 NZ LYS A 40 5.051 -17.382 -2.154 1.00 0.00 N ATOM 0 H LYS A 40 2.549 -12.880 0.554 1.00 0.00 H new ATOM 0 HA LYS A 40 2.136 -15.575 1.543 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.376 -13.799 0.788 1.00 0.00 H new ATOM 0 HB3 LYS A 40 4.711 -14.781 2.200 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.536 -16.795 1.019 1.00 0.00 H new ATOM 0 HG3 LYS A 40 3.535 -16.097 -0.239 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.956 -14.631 -0.323 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.440 -16.299 -0.092 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.519 -15.334 -2.251 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.224 -15.653 -2.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.889 -17.536 -3.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 5.853 -17.965 -1.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.198 -17.650 -1.623 1.00 0.00 H new ATOM 660 N VAL A 41 2.804 -13.043 3.561 1.00 0.00 N ATOM 661 CA VAL A 41 2.746 -12.607 4.951 1.00 0.00 C ATOM 662 C VAL A 41 1.303 -12.444 5.416 1.00 0.00 C ATOM 663 O VAL A 41 1.027 -12.403 6.614 1.00 0.00 O ATOM 664 CB VAL A 41 3.492 -11.275 5.152 1.00 0.00 C ATOM 665 CG1 VAL A 41 4.970 -11.436 4.830 1.00 0.00 C ATOM 666 CG2 VAL A 41 2.868 -10.181 4.299 1.00 0.00 C ATOM 0 H VAL A 41 3.071 -12.313 2.901 1.00 0.00 H new ATOM 0 HA VAL A 41 3.231 -13.380 5.546 1.00 0.00 H new ATOM 0 HB VAL A 41 3.403 -10.983 6.198 1.00 0.00 H new ATOM 0 HG11 VAL A 41 5.480 -10.484 4.978 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.406 -12.188 5.488 1.00 0.00 H new ATOM 0 HG13 VAL A 41 5.084 -11.752 3.793 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.408 -9.247 4.454 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.924 -10.463 3.248 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.824 -10.048 4.584 1.00 0.00 H new ATOM 676 N GLY A 42 0.385 -12.351 4.458 1.00 0.00 N ATOM 677 CA GLY A 42 -1.019 -12.194 4.790 1.00 0.00 C ATOM 678 C GLY A 42 -1.321 -10.844 5.410 1.00 0.00 C ATOM 679 O GLY A 42 -2.176 -10.734 6.289 1.00 0.00 O ATOM 0 H GLY A 42 0.589 -12.382 3.459 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.618 -12.318 3.888 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -1.316 -12.983 5.481 1.00 0.00 H new ATOM 683 N HIS A 43 -0.616 -9.814 4.954 1.00 0.00 N ATOM 684 CA HIS A 43 -0.812 -8.464 5.471 1.00 0.00 C ATOM 685 C HIS A 43 0.020 -7.455 4.685 1.00 0.00 C ATOM 686 O HIS A 43 1.172 -7.720 4.341 1.00 0.00 O ATOM 687 CB HIS A 43 -0.440 -8.405 6.953 1.00 0.00 C ATOM 688 CG HIS A 43 1.035 -8.469 7.204 1.00 0.00 C ATOM 689 ND1 HIS A 43 1.876 -7.390 7.031 1.00 0.00 N ATOM 690 CD2 HIS A 43 1.818 -9.492 7.619 1.00 0.00 C ATOM 691 CE1 HIS A 43 3.113 -7.747 7.327 1.00 0.00 C ATOM 692 NE2 HIS A 43 3.105 -9.018 7.688 1.00 0.00 N ATOM 0 H HIS A 43 0.096 -9.888 4.228 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.865 -8.207 5.357 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -0.833 -7.483 7.381 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -0.925 -9.231 7.474 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.491 -10.495 7.852 1.00 0.00 H new ATOM 0 HE1 HIS A 43 3.983 -7.109 7.282 1.00 0.00 H new ATOM 0 HE2 HIS A 43 3.922 -9.559 7.972 1.00 0.00 H new ATOM 700 N ASP A 44 -0.572 -6.299 4.405 1.00 0.00 N ATOM 701 CA ASP A 44 0.114 -5.250 3.660 1.00 0.00 C ATOM 702 C ASP A 44 0.586 -4.140 4.593 1.00 0.00 C ATOM 703 O ASP A 44 0.542 -4.282 5.816 1.00 0.00 O ATOM 704 CB ASP A 44 -0.808 -4.672 2.585 1.00 0.00 C ATOM 705 CG ASP A 44 -1.823 -3.701 3.155 1.00 0.00 C ATOM 706 OD1 ASP A 44 -2.166 -2.723 2.457 1.00 0.00 O ATOM 707 OD2 ASP A 44 -2.275 -3.918 4.298 1.00 0.00 O ATOM 0 H ASP A 44 -1.525 -6.065 4.683 1.00 0.00 H new ATOM 0 HA ASP A 44 0.987 -5.692 3.180 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.208 -4.164 1.830 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.330 -5.486 2.082 1.00 0.00 H new ATOM 712 N PHE A 45 1.039 -3.036 4.010 1.00 0.00 N ATOM 713 CA PHE A 45 1.522 -1.902 4.790 1.00 0.00 C ATOM 714 C PHE A 45 0.850 -0.608 4.341 1.00 0.00 C ATOM 715 O PHE A 45 1.520 0.351 3.957 1.00 0.00 O ATOM 716 CB PHE A 45 3.041 -1.774 4.656 1.00 0.00 C ATOM 717 CG PHE A 45 3.767 -3.082 4.793 1.00 0.00 C ATOM 718 CD1 PHE A 45 4.247 -3.743 3.674 1.00 0.00 C ATOM 719 CD2 PHE A 45 3.969 -3.650 6.040 1.00 0.00 C ATOM 720 CE1 PHE A 45 4.916 -4.947 3.796 1.00 0.00 C ATOM 721 CE2 PHE A 45 4.638 -4.853 6.169 1.00 0.00 C ATOM 722 CZ PHE A 45 5.110 -5.503 5.045 1.00 0.00 C ATOM 0 H PHE A 45 1.082 -2.902 3.000 1.00 0.00 H new ATOM 0 HA PHE A 45 1.270 -2.078 5.836 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.277 -1.337 3.686 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.408 -1.083 5.415 1.00 0.00 H new ATOM 0 HD1 PHE A 45 4.097 -3.313 2.695 1.00 0.00 H new ATOM 0 HD2 PHE A 45 3.600 -3.147 6.922 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.286 -5.452 2.916 1.00 0.00 H new ATOM 0 HE2 PHE A 45 4.791 -5.284 7.147 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.630 -6.445 5.143 1.00 0.00 H new ATOM 732 N SER A 46 -0.478 -0.589 4.391 1.00 0.00 N ATOM 733 CA SER A 46 -1.242 0.585 3.986 1.00 0.00 C ATOM 734 C SER A 46 -1.310 1.606 5.118 1.00 0.00 C ATOM 735 O SER A 46 -1.138 2.805 4.898 1.00 0.00 O ATOM 736 CB SER A 46 -2.655 0.179 3.564 1.00 0.00 C ATOM 737 OG SER A 46 -2.789 0.191 2.153 1.00 0.00 O ATOM 0 H SER A 46 -1.047 -1.374 4.708 1.00 0.00 H new ATOM 0 HA SER A 46 -0.735 1.043 3.137 1.00 0.00 H new ATOM 0 HB2 SER A 46 -2.880 -0.817 3.945 1.00 0.00 H new ATOM 0 HB3 SER A 46 -3.380 0.861 4.007 1.00 0.00 H new ATOM 0 HG SER A 46 -2.652 -0.714 1.804 1.00 0.00 H new ATOM 743 N ASP A 47 -1.564 1.121 6.328 1.00 0.00 N ATOM 744 CA ASP A 47 -1.654 1.990 7.496 1.00 0.00 C ATOM 745 C ASP A 47 -0.426 2.888 7.602 1.00 0.00 C ATOM 746 O ASP A 47 0.692 2.408 7.790 1.00 0.00 O ATOM 747 CB ASP A 47 -1.803 1.155 8.769 1.00 0.00 C ATOM 748 CG ASP A 47 -3.228 1.134 9.285 1.00 0.00 C ATOM 749 OD1 ASP A 47 -4.053 0.385 8.720 1.00 0.00 O ATOM 750 OD2 ASP A 47 -3.519 1.866 10.253 1.00 0.00 O ATOM 0 H ASP A 47 -1.711 0.131 6.526 1.00 0.00 H new ATOM 0 HA ASP A 47 -2.534 2.622 7.381 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -1.477 0.134 8.570 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -1.146 1.555 9.541 1.00 0.00 H new ATOM 755 N ALA A 48 -0.641 4.194 7.479 1.00 0.00 N ATOM 756 CA ALA A 48 0.448 5.159 7.563 1.00 0.00 C ATOM 757 C ALA A 48 1.177 5.050 8.897 1.00 0.00 C ATOM 758 O ALA A 48 2.329 5.466 9.021 1.00 0.00 O ATOM 759 CB ALA A 48 -0.081 6.571 7.361 1.00 0.00 C ATOM 0 H ALA A 48 -1.560 4.608 7.321 1.00 0.00 H new ATOM 0 HA ALA A 48 1.162 4.934 6.770 1.00 0.00 H new ATOM 0 HB1 ALA A 48 0.743 7.281 7.426 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.549 6.647 6.379 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -0.817 6.798 8.132 1.00 0.00 H new ATOM 765 N GLU A 49 0.498 4.489 9.893 1.00 0.00 N ATOM 766 CA GLU A 49 1.082 4.328 11.220 1.00 0.00 C ATOM 767 C GLU A 49 1.686 2.936 11.383 1.00 0.00 C ATOM 768 O GLU A 49 1.795 2.422 12.497 1.00 0.00 O ATOM 769 CB GLU A 49 0.025 4.568 12.300 1.00 0.00 C ATOM 770 CG GLU A 49 -1.021 3.469 12.382 1.00 0.00 C ATOM 771 CD GLU A 49 -2.119 3.783 13.379 1.00 0.00 C ATOM 772 OE1 GLU A 49 -2.847 2.847 13.773 1.00 0.00 O ATOM 773 OE2 GLU A 49 -2.251 4.963 13.766 1.00 0.00 O ATOM 0 H GLU A 49 -0.456 4.139 9.806 1.00 0.00 H new ATOM 0 HA GLU A 49 1.877 5.065 11.331 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.520 4.660 13.267 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.473 5.518 12.105 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.462 3.318 11.397 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.538 2.533 12.662 1.00 0.00 H new ATOM 780 N TYR A 50 2.075 2.332 10.267 1.00 0.00 N ATOM 781 CA TYR A 50 2.664 0.998 10.285 1.00 0.00 C ATOM 782 C TYR A 50 3.188 0.615 8.904 1.00 0.00 C ATOM 783 O TYR A 50 2.736 -0.363 8.306 1.00 0.00 O ATOM 784 CB TYR A 50 1.635 -0.030 10.756 1.00 0.00 C ATOM 785 CG TYR A 50 2.206 -1.419 10.938 1.00 0.00 C ATOM 786 CD1 TYR A 50 1.519 -2.538 10.484 1.00 0.00 C ATOM 787 CD2 TYR A 50 3.432 -1.611 11.563 1.00 0.00 C ATOM 788 CE1 TYR A 50 2.037 -3.809 10.648 1.00 0.00 C ATOM 789 CE2 TYR A 50 3.957 -2.878 11.730 1.00 0.00 C ATOM 790 CZ TYR A 50 3.256 -3.973 11.271 1.00 0.00 C ATOM 791 OH TYR A 50 3.775 -5.237 11.437 1.00 0.00 O ATOM 0 H TYR A 50 1.993 2.744 9.338 1.00 0.00 H new ATOM 0 HA TYR A 50 3.502 1.008 10.981 1.00 0.00 H new ATOM 0 HB2 TYR A 50 1.206 0.304 11.701 1.00 0.00 H new ATOM 0 HB3 TYR A 50 0.820 -0.073 10.034 1.00 0.00 H new ATOM 0 HD1 TYR A 50 0.564 -2.413 9.995 1.00 0.00 H new ATOM 0 HD2 TYR A 50 3.984 -0.756 11.924 1.00 0.00 H new ATOM 0 HE1 TYR A 50 1.490 -4.669 10.290 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.912 -3.010 12.218 1.00 0.00 H new ATOM 0 HH TYR A 50 4.641 -5.178 11.893 1.00 0.00 H new ATOM 801 N ILE A 51 4.142 1.392 8.403 1.00 0.00 N ATOM 802 CA ILE A 51 4.729 1.134 7.094 1.00 0.00 C ATOM 803 C ILE A 51 6.204 0.766 7.215 1.00 0.00 C ATOM 804 O ILE A 51 7.093 1.534 6.847 1.00 0.00 O ATOM 805 CB ILE A 51 4.590 2.354 6.165 1.00 0.00 C ATOM 806 CG1 ILE A 51 3.124 2.779 6.061 1.00 0.00 C ATOM 807 CG2 ILE A 51 5.155 2.038 4.788 1.00 0.00 C ATOM 808 CD1 ILE A 51 2.901 3.958 5.139 1.00 0.00 C ATOM 0 H ILE A 51 4.525 2.206 8.884 1.00 0.00 H new ATOM 0 HA ILE A 51 4.183 0.295 6.663 1.00 0.00 H new ATOM 0 HB ILE A 51 5.159 3.182 6.589 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.533 1.934 5.707 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.756 3.031 7.055 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.050 2.910 4.143 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.210 1.779 4.878 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.611 1.198 4.355 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.840 4.204 5.114 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.464 4.817 5.504 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.238 3.703 4.134 1.00 0.00 H new ATOM 820 N PRO A 52 6.472 -0.438 7.743 1.00 0.00 N ATOM 821 CA PRO A 52 7.838 -0.936 7.922 1.00 0.00 C ATOM 822 C PRO A 52 8.518 -1.257 6.596 1.00 0.00 C ATOM 823 O PRO A 52 7.860 -1.636 5.625 1.00 0.00 O ATOM 824 CB PRO A 52 7.645 -2.212 8.747 1.00 0.00 C ATOM 825 CG PRO A 52 6.259 -2.659 8.433 1.00 0.00 C ATOM 826 CD PRO A 52 5.461 -1.405 8.203 1.00 0.00 C ATOM 0 HA PRO A 52 8.482 -0.196 8.399 1.00 0.00 H new ATOM 0 HB2 PRO A 52 8.377 -2.973 8.477 1.00 0.00 H new ATOM 0 HB3 PRO A 52 7.766 -2.017 9.813 1.00 0.00 H new ATOM 0 HG2 PRO A 52 6.246 -3.297 7.550 1.00 0.00 H new ATOM 0 HG3 PRO A 52 5.842 -3.242 9.254 1.00 0.00 H new ATOM 0 HD2 PRO A 52 4.681 -1.556 7.457 1.00 0.00 H new ATOM 0 HD3 PRO A 52 4.969 -1.069 9.116 1.00 0.00 H new ATOM 834 N LEU A 53 9.837 -1.104 6.559 1.00 0.00 N ATOM 835 CA LEU A 53 10.606 -1.379 5.351 1.00 0.00 C ATOM 836 C LEU A 53 12.040 -1.769 5.695 1.00 0.00 C ATOM 837 O LEU A 53 12.971 -0.971 5.580 1.00 0.00 O ATOM 838 CB LEU A 53 10.605 -0.155 4.433 1.00 0.00 C ATOM 839 CG LEU A 53 10.803 -0.434 2.942 1.00 0.00 C ATOM 840 CD1 LEU A 53 9.731 -1.384 2.430 1.00 0.00 C ATOM 841 CD2 LEU A 53 10.789 0.866 2.150 1.00 0.00 C ATOM 0 H LEU A 53 10.396 -0.791 7.352 1.00 0.00 H new ATOM 0 HA LEU A 53 10.136 -2.215 4.833 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.658 0.370 4.561 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.392 0.523 4.763 1.00 0.00 H new ATOM 0 HG LEU A 53 11.775 -0.909 2.806 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.888 -1.571 1.368 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.788 -2.325 2.976 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.748 -0.937 2.579 1.00 0.00 H new ATOM 0 HD21 LEU A 53 10.931 0.649 1.091 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.832 1.368 2.292 1.00 0.00 H new ATOM 0 HD23 LEU A 53 11.594 1.513 2.499 1.00 0.00 H new ATOM 853 N PRO A 54 12.225 -3.026 6.125 1.00 0.00 N ATOM 854 CA PRO A 54 13.543 -3.552 6.492 1.00 0.00 C ATOM 855 C PRO A 54 14.454 -3.728 5.281 1.00 0.00 C ATOM 856 O PRO A 54 14.132 -3.280 4.181 1.00 0.00 O ATOM 857 CB PRO A 54 13.221 -4.909 7.121 1.00 0.00 C ATOM 858 CG PRO A 54 11.920 -5.308 6.515 1.00 0.00 C ATOM 859 CD PRO A 54 11.160 -4.031 6.286 1.00 0.00 C ATOM 0 HA PRO A 54 14.081 -2.876 7.157 1.00 0.00 H new ATOM 0 HB2 PRO A 54 14.000 -5.640 6.904 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.146 -4.835 8.206 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.074 -5.844 5.578 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.370 -5.976 7.177 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.528 -4.093 5.400 1.00 0.00 H new ATOM 0 HD3 PRO A 54 10.508 -3.795 7.127 1.00 0.00 H new ATOM 867 N GLU A 55 15.591 -4.384 5.493 1.00 0.00 N ATOM 868 CA GLU A 55 16.548 -4.618 4.418 1.00 0.00 C ATOM 869 C GLU A 55 16.173 -5.862 3.618 1.00 0.00 C ATOM 870 O GLU A 55 16.573 -6.017 2.463 1.00 0.00 O ATOM 871 CB GLU A 55 17.960 -4.770 4.986 1.00 0.00 C ATOM 872 CG GLU A 55 18.985 -5.221 3.959 1.00 0.00 C ATOM 873 CD GLU A 55 20.410 -5.094 4.462 1.00 0.00 C ATOM 874 OE1 GLU A 55 21.208 -4.391 3.809 1.00 0.00 O ATOM 875 OE2 GLU A 55 20.726 -5.699 5.507 1.00 0.00 O ATOM 0 H GLU A 55 15.871 -4.762 6.398 1.00 0.00 H new ATOM 0 HA GLU A 55 16.524 -3.757 3.751 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.277 -3.816 5.408 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.938 -5.490 5.804 1.00 0.00 H new ATOM 0 HG2 GLU A 55 18.790 -6.259 3.689 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.870 -4.628 3.052 1.00 0.00 H new ATOM 882 N THR A 56 15.402 -6.749 4.240 1.00 0.00 N ATOM 883 CA THR A 56 14.974 -7.980 3.588 1.00 0.00 C ATOM 884 C THR A 56 13.878 -7.708 2.564 1.00 0.00 C ATOM 885 O THR A 56 13.949 -8.173 1.426 1.00 0.00 O ATOM 886 CB THR A 56 14.460 -9.009 4.613 1.00 0.00 C ATOM 887 OG1 THR A 56 13.201 -8.581 5.146 1.00 0.00 O ATOM 888 CG2 THR A 56 15.460 -9.192 5.744 1.00 0.00 C ATOM 0 H THR A 56 15.061 -6.637 5.195 1.00 0.00 H new ATOM 0 HA THR A 56 15.848 -8.389 3.080 1.00 0.00 H new ATOM 0 HB THR A 56 14.333 -9.965 4.104 1.00 0.00 H new ATOM 0 HG1 THR A 56 12.625 -9.361 5.292 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.075 -9.923 6.455 1.00 0.00 H new ATOM 0 HG22 THR A 56 16.408 -9.545 5.338 1.00 0.00 H new ATOM 0 HG23 THR A 56 15.615 -8.239 6.251 1.00 0.00 H new ATOM 896 N VAL A 57 12.866 -6.952 2.974 1.00 0.00 N ATOM 897 CA VAL A 57 11.755 -6.616 2.091 1.00 0.00 C ATOM 898 C VAL A 57 12.245 -5.887 0.845 1.00 0.00 C ATOM 899 O VAL A 57 11.859 -6.224 -0.275 1.00 0.00 O ATOM 900 CB VAL A 57 10.713 -5.738 2.809 1.00 0.00 C ATOM 901 CG1 VAL A 57 9.614 -5.317 1.845 1.00 0.00 C ATOM 902 CG2 VAL A 57 10.130 -6.474 4.006 1.00 0.00 C ATOM 0 H VAL A 57 12.792 -6.560 3.913 1.00 0.00 H new ATOM 0 HA VAL A 57 11.287 -7.556 1.799 1.00 0.00 H new ATOM 0 HB VAL A 57 11.210 -4.838 3.171 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.887 -4.697 2.370 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.049 -4.748 1.023 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.117 -6.203 1.450 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.396 -5.839 4.501 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.648 -7.392 3.669 1.00 0.00 H new ATOM 0 HG23 VAL A 57 10.928 -6.720 4.706 1.00 0.00 H new ATOM 912 N ARG A 58 13.097 -4.888 1.047 1.00 0.00 N ATOM 913 CA ARG A 58 13.640 -4.111 -0.061 1.00 0.00 C ATOM 914 C ARG A 58 14.241 -5.026 -1.124 1.00 0.00 C ATOM 915 O ARG A 58 14.026 -4.829 -2.321 1.00 0.00 O ATOM 916 CB ARG A 58 14.703 -3.134 0.446 1.00 0.00 C ATOM 917 CG ARG A 58 14.416 -1.684 0.091 1.00 0.00 C ATOM 918 CD ARG A 58 15.553 -0.770 0.518 1.00 0.00 C ATOM 919 NE ARG A 58 15.110 0.251 1.463 1.00 0.00 N ATOM 920 CZ ARG A 58 14.483 1.364 1.101 1.00 0.00 C ATOM 921 NH1 ARG A 58 14.226 1.599 -0.179 1.00 0.00 N ATOM 922 NH2 ARG A 58 14.110 2.246 2.020 1.00 0.00 N ATOM 0 H ARG A 58 13.426 -4.597 1.968 1.00 0.00 H new ATOM 0 HA ARG A 58 12.823 -3.547 -0.511 1.00 0.00 H new ATOM 0 HB2 ARG A 58 14.781 -3.225 1.529 1.00 0.00 H new ATOM 0 HB3 ARG A 58 15.671 -3.416 0.032 1.00 0.00 H new ATOM 0 HG2 ARG A 58 14.261 -1.595 -0.984 1.00 0.00 H new ATOM 0 HG3 ARG A 58 13.492 -1.366 0.574 1.00 0.00 H new ATOM 0 HD2 ARG A 58 16.345 -1.365 0.973 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.981 -0.289 -0.361 1.00 0.00 H new ATOM 0 HE ARG A 58 15.292 0.101 2.455 1.00 0.00 H new ATOM 0 HH11 ARG A 58 14.510 0.924 -0.889 1.00 0.00 H new ATOM 0 HH12 ARG A 58 13.744 2.455 -0.454 1.00 0.00 H new ATOM 0 HH21 ARG A 58 14.305 2.069 3.005 1.00 0.00 H new ATOM 0 HH22 ARG A 58 13.628 3.101 1.741 1.00 0.00 H new ATOM 936 N LEU A 59 14.993 -6.026 -0.680 1.00 0.00 N ATOM 937 CA LEU A 59 15.626 -6.972 -1.592 1.00 0.00 C ATOM 938 C LEU A 59 14.596 -7.926 -2.189 1.00 0.00 C ATOM 939 O LEU A 59 14.587 -8.171 -3.395 1.00 0.00 O ATOM 940 CB LEU A 59 16.711 -7.767 -0.864 1.00 0.00 C ATOM 941 CG LEU A 59 17.608 -8.639 -1.742 1.00 0.00 C ATOM 942 CD1 LEU A 59 18.213 -7.818 -2.870 1.00 0.00 C ATOM 943 CD2 LEU A 59 18.703 -9.289 -0.907 1.00 0.00 C ATOM 0 H LEU A 59 15.180 -6.203 0.307 1.00 0.00 H new ATOM 0 HA LEU A 59 16.083 -6.405 -2.403 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.342 -7.066 -0.318 1.00 0.00 H new ATOM 0 HB3 LEU A 59 16.230 -8.406 -0.124 1.00 0.00 H new ATOM 0 HG LEU A 59 16.997 -9.427 -2.181 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.848 -8.456 -3.484 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.415 -7.401 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.810 -7.008 -2.451 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.332 -9.906 -1.549 1.00 0.00 H new ATOM 0 HD22 LEU A 59 19.311 -8.515 -0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 59 18.251 -9.912 -0.135 1.00 0.00 H new ATOM 955 N ALA A 60 13.727 -8.459 -1.336 1.00 0.00 N ATOM 956 CA ALA A 60 12.690 -9.382 -1.779 1.00 0.00 C ATOM 957 C ALA A 60 11.898 -8.799 -2.945 1.00 0.00 C ATOM 958 O ALA A 60 11.635 -9.484 -3.934 1.00 0.00 O ATOM 959 CB ALA A 60 11.759 -9.723 -0.625 1.00 0.00 C ATOM 0 H ALA A 60 13.721 -8.267 -0.334 1.00 0.00 H new ATOM 0 HA ALA A 60 13.174 -10.296 -2.123 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.989 -10.413 -0.970 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.330 -10.189 0.178 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.289 -8.812 -0.255 1.00 0.00 H new ATOM 965 N LEU A 61 11.520 -7.532 -2.822 1.00 0.00 N ATOM 966 CA LEU A 61 10.757 -6.856 -3.866 1.00 0.00 C ATOM 967 C LEU A 61 11.629 -6.584 -5.088 1.00 0.00 C ATOM 968 O LEU A 61 11.183 -6.730 -6.227 1.00 0.00 O ATOM 969 CB LEU A 61 10.179 -5.544 -3.335 1.00 0.00 C ATOM 970 CG LEU A 61 8.855 -5.094 -3.954 1.00 0.00 C ATOM 971 CD1 LEU A 61 8.975 -5.011 -5.468 1.00 0.00 C ATOM 972 CD2 LEU A 61 7.732 -6.040 -3.557 1.00 0.00 C ATOM 0 H LEU A 61 11.729 -6.951 -2.010 1.00 0.00 H new ATOM 0 HA LEU A 61 9.939 -7.511 -4.165 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.039 -5.641 -2.258 1.00 0.00 H new ATOM 0 HB3 LEU A 61 10.916 -4.756 -3.491 1.00 0.00 H new ATOM 0 HG LEU A 61 8.617 -4.101 -3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 61 8.023 -4.689 -5.891 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.751 -4.293 -5.733 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.236 -5.991 -5.867 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.797 -5.704 -4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.963 -7.046 -3.908 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.630 -6.049 -2.472 1.00 0.00 H new ATOM 984 N LEU A 62 12.873 -6.190 -4.844 1.00 0.00 N ATOM 985 CA LEU A 62 13.810 -5.899 -5.924 1.00 0.00 C ATOM 986 C LEU A 62 13.971 -7.104 -6.845 1.00 0.00 C ATOM 987 O LEU A 62 14.120 -6.958 -8.058 1.00 0.00 O ATOM 988 CB LEU A 62 15.169 -5.494 -5.352 1.00 0.00 C ATOM 989 CG LEU A 62 15.293 -4.047 -4.873 1.00 0.00 C ATOM 990 CD1 LEU A 62 16.455 -3.903 -3.903 1.00 0.00 C ATOM 991 CD2 LEU A 62 15.464 -3.106 -6.057 1.00 0.00 C ATOM 0 H LEU A 62 13.257 -6.064 -3.908 1.00 0.00 H new ATOM 0 HA LEU A 62 13.408 -5.071 -6.507 1.00 0.00 H new ATOM 0 HB2 LEU A 62 15.399 -6.153 -4.515 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.928 -5.669 -6.114 1.00 0.00 H new ATOM 0 HG LEU A 62 14.375 -3.778 -4.350 1.00 0.00 H new ATOM 0 HD11 LEU A 62 16.527 -2.867 -3.573 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.290 -4.548 -3.040 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.381 -4.191 -4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.551 -2.081 -5.697 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.365 -3.375 -6.608 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.599 -3.188 -6.715 1.00 0.00 H new ATOM 1003 N LYS A 63 13.937 -8.297 -6.260 1.00 0.00 N ATOM 1004 CA LYS A 63 14.075 -9.530 -7.027 1.00 0.00 C ATOM 1005 C LYS A 63 12.812 -9.813 -7.834 1.00 0.00 C ATOM 1006 O LYS A 63 12.883 -10.201 -9.001 1.00 0.00 O ATOM 1007 CB LYS A 63 14.370 -10.705 -6.092 1.00 0.00 C ATOM 1008 CG LYS A 63 15.783 -10.700 -5.535 1.00 0.00 C ATOM 1009 CD LYS A 63 16.659 -11.729 -6.229 1.00 0.00 C ATOM 1010 CE LYS A 63 17.949 -11.972 -5.459 1.00 0.00 C ATOM 1011 NZ LYS A 63 18.713 -13.127 -6.008 1.00 0.00 N ATOM 0 H LYS A 63 13.815 -8.436 -5.257 1.00 0.00 H new ATOM 0 HA LYS A 63 14.907 -9.407 -7.720 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.662 -10.686 -5.264 1.00 0.00 H new ATOM 0 HB3 LYS A 63 14.204 -11.638 -6.631 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.219 -9.708 -5.656 1.00 0.00 H new ATOM 0 HG3 LYS A 63 15.754 -10.907 -4.465 1.00 0.00 H new ATOM 0 HD2 LYS A 63 16.112 -12.666 -6.329 1.00 0.00 H new ATOM 0 HD3 LYS A 63 16.894 -11.388 -7.237 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.569 -11.076 -5.496 1.00 0.00 H new ATOM 0 HE3 LYS A 63 17.717 -12.156 -4.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.585 -13.260 -5.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 18.132 -13.987 -5.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 18.957 -12.941 -7.002 1.00 0.00 H new ATOM 1025 N LEU A 64 11.658 -9.615 -7.207 1.00 0.00 N ATOM 1026 CA LEU A 64 10.379 -9.848 -7.869 1.00 0.00 C ATOM 1027 C LEU A 64 10.154 -8.839 -8.990 1.00 0.00 C ATOM 1028 O LEU A 64 9.602 -9.174 -10.038 1.00 0.00 O ATOM 1029 CB LEU A 64 9.236 -9.763 -6.855 1.00 0.00 C ATOM 1030 CG LEU A 64 8.596 -11.093 -6.453 1.00 0.00 C ATOM 1031 CD1 LEU A 64 7.916 -10.970 -5.099 1.00 0.00 C ATOM 1032 CD2 LEU A 64 7.601 -11.547 -7.512 1.00 0.00 C ATOM 0 H LEU A 64 11.581 -9.294 -6.242 1.00 0.00 H new ATOM 0 HA LEU A 64 10.399 -10.847 -8.304 1.00 0.00 H new ATOM 0 HB2 LEU A 64 9.611 -9.276 -5.955 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.459 -9.118 -7.266 1.00 0.00 H new ATOM 0 HG LEU A 64 9.382 -11.844 -6.375 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.466 -11.926 -4.830 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.653 -10.690 -4.346 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.141 -10.206 -5.149 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.155 -12.495 -7.210 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.818 -10.796 -7.621 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.116 -11.676 -8.464 1.00 0.00 H new ATOM 1044 N SER A 65 10.588 -7.603 -8.764 1.00 0.00 N ATOM 1045 CA SER A 65 10.434 -6.545 -9.755 1.00 0.00 C ATOM 1046 C SER A 65 11.087 -6.938 -11.076 1.00 0.00 C ATOM 1047 O SER A 65 10.552 -6.666 -12.150 1.00 0.00 O ATOM 1048 CB SER A 65 11.044 -5.241 -9.239 1.00 0.00 C ATOM 1049 OG SER A 65 10.146 -4.157 -9.402 1.00 0.00 O ATOM 0 H SER A 65 11.049 -7.310 -7.903 1.00 0.00 H new ATOM 0 HA SER A 65 9.368 -6.396 -9.928 1.00 0.00 H new ATOM 0 HB2 SER A 65 11.301 -5.348 -8.185 1.00 0.00 H new ATOM 0 HB3 SER A 65 11.971 -5.033 -9.774 1.00 0.00 H new ATOM 0 HG SER A 65 9.633 -4.278 -10.228 1.00 0.00 H new ATOM 1055 N GLN A 66 12.248 -7.579 -10.987 1.00 0.00 N ATOM 1056 CA GLN A 66 12.976 -8.009 -12.175 1.00 0.00 C ATOM 1057 C GLN A 66 12.243 -9.145 -12.881 1.00 0.00 C ATOM 1058 O GLN A 66 12.161 -9.176 -14.109 1.00 0.00 O ATOM 1059 CB GLN A 66 14.390 -8.455 -11.799 1.00 0.00 C ATOM 1060 CG GLN A 66 15.140 -9.125 -12.939 1.00 0.00 C ATOM 1061 CD GLN A 66 15.420 -10.591 -12.673 1.00 0.00 C ATOM 1062 OE1 GLN A 66 14.833 -11.471 -13.302 1.00 0.00 O ATOM 1063 NE2 GLN A 66 16.321 -10.861 -11.735 1.00 0.00 N ATOM 0 H GLN A 66 12.704 -7.812 -10.105 1.00 0.00 H new ATOM 0 HA GLN A 66 13.039 -7.162 -12.858 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.958 -7.588 -11.462 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.333 -9.145 -10.958 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.558 -9.031 -13.856 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.083 -8.603 -13.105 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.784 -10.100 -11.238 1.00 0.00 H new ATOM 0 HE22 GLN A 66 16.550 -11.830 -11.512 1.00 0.00 H new ATOM 1072 N PHE A 67 11.712 -10.077 -12.097 1.00 0.00 N ATOM 1073 CA PHE A 67 10.986 -11.216 -12.648 1.00 0.00 C ATOM 1074 C PHE A 67 9.813 -10.751 -13.505 1.00 0.00 C ATOM 1075 O PHE A 67 9.630 -11.214 -14.631 1.00 0.00 O ATOM 1076 CB PHE A 67 10.482 -12.120 -11.520 1.00 0.00 C ATOM 1077 CG PHE A 67 9.564 -13.211 -11.992 1.00 0.00 C ATOM 1078 CD1 PHE A 67 10.065 -14.457 -12.334 1.00 0.00 C ATOM 1079 CD2 PHE A 67 8.200 -12.990 -12.093 1.00 0.00 C ATOM 1080 CE1 PHE A 67 9.222 -15.463 -12.768 1.00 0.00 C ATOM 1081 CE2 PHE A 67 7.352 -13.993 -12.526 1.00 0.00 C ATOM 1082 CZ PHE A 67 7.864 -15.230 -12.865 1.00 0.00 C ATOM 0 H PHE A 67 11.770 -10.066 -11.079 1.00 0.00 H new ATOM 0 HA PHE A 67 11.672 -11.781 -13.279 1.00 0.00 H new ATOM 0 HB2 PHE A 67 11.337 -12.569 -11.015 1.00 0.00 H new ATOM 0 HB3 PHE A 67 9.960 -11.511 -10.782 1.00 0.00 H new ATOM 0 HD1 PHE A 67 11.126 -14.644 -12.261 1.00 0.00 H new ATOM 0 HD2 PHE A 67 7.795 -12.024 -11.831 1.00 0.00 H new ATOM 0 HE1 PHE A 67 9.625 -16.430 -13.031 1.00 0.00 H new ATOM 0 HE2 PHE A 67 6.290 -13.809 -12.599 1.00 0.00 H new ATOM 0 HZ PHE A 67 7.204 -16.014 -13.205 1.00 0.00 H new ATOM 1092 N TYR A 68 9.019 -9.834 -12.963 1.00 0.00 N ATOM 1093 CA TYR A 68 7.861 -9.307 -13.676 1.00 0.00 C ATOM 1094 C TYR A 68 8.293 -8.372 -14.801 1.00 0.00 C ATOM 1095 O TYR A 68 7.870 -8.525 -15.947 1.00 0.00 O ATOM 1096 CB TYR A 68 6.935 -8.567 -12.710 1.00 0.00 C ATOM 1097 CG TYR A 68 5.876 -9.450 -12.089 1.00 0.00 C ATOM 1098 CD1 TYR A 68 5.028 -10.213 -12.883 1.00 0.00 C ATOM 1099 CD2 TYR A 68 5.723 -9.521 -10.710 1.00 0.00 C ATOM 1100 CE1 TYR A 68 4.058 -11.021 -12.321 1.00 0.00 C ATOM 1101 CE2 TYR A 68 4.757 -10.327 -10.140 1.00 0.00 C ATOM 1102 CZ TYR A 68 3.927 -11.075 -10.949 1.00 0.00 C ATOM 1103 OH TYR A 68 2.963 -11.878 -10.385 1.00 0.00 O ATOM 0 H TYR A 68 9.156 -9.440 -12.032 1.00 0.00 H new ATOM 0 HA TYR A 68 7.322 -10.147 -14.114 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.534 -8.120 -11.917 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.448 -7.749 -13.241 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.129 -10.174 -13.958 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.370 -8.936 -10.073 1.00 0.00 H new ATOM 0 HE1 TYR A 68 3.406 -11.607 -12.952 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.652 -10.371 -9.066 1.00 0.00 H new ATOM 0 HH TYR A 68 3.004 -11.802 -9.409 1.00 0.00 H new ATOM 1113 N ALA A 69 9.139 -7.404 -14.465 1.00 0.00 N ATOM 1114 CA ALA A 69 9.631 -6.445 -15.447 1.00 0.00 C ATOM 1115 C ALA A 69 10.238 -7.156 -16.652 1.00 0.00 C ATOM 1116 O ALA A 69 10.242 -6.623 -17.763 1.00 0.00 O ATOM 1117 CB ALA A 69 10.654 -5.516 -14.810 1.00 0.00 C ATOM 0 H ALA A 69 9.498 -7.263 -13.521 1.00 0.00 H new ATOM 0 HA ALA A 69 8.785 -5.852 -15.796 1.00 0.00 H new ATOM 0 HB1 ALA A 69 11.013 -4.805 -15.554 1.00 0.00 H new ATOM 0 HB2 ALA A 69 10.190 -4.975 -13.985 1.00 0.00 H new ATOM 0 HB3 ALA A 69 11.493 -6.102 -14.433 1.00 0.00 H new ATOM 1123 N LEU A 70 10.751 -8.360 -16.426 1.00 0.00 N ATOM 1124 CA LEU A 70 11.362 -9.144 -17.494 1.00 0.00 C ATOM 1125 C LEU A 70 10.298 -9.725 -18.420 1.00 0.00 C ATOM 1126 O LEU A 70 10.396 -9.611 -19.642 1.00 0.00 O ATOM 1127 CB LEU A 70 12.211 -10.272 -16.904 1.00 0.00 C ATOM 1128 CG LEU A 70 12.601 -11.393 -17.868 1.00 0.00 C ATOM 1129 CD1 LEU A 70 13.426 -10.842 -19.021 1.00 0.00 C ATOM 1130 CD2 LEU A 70 13.367 -12.484 -17.135 1.00 0.00 C ATOM 0 H LEU A 70 10.756 -8.815 -15.513 1.00 0.00 H new ATOM 0 HA LEU A 70 12.002 -8.482 -18.076 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.123 -9.837 -16.496 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.666 -10.712 -16.069 1.00 0.00 H new ATOM 0 HG LEU A 70 11.689 -11.829 -18.276 1.00 0.00 H new ATOM 0 HD11 LEU A 70 13.695 -11.654 -19.697 1.00 0.00 H new ATOM 0 HD12 LEU A 70 12.843 -10.097 -19.562 1.00 0.00 H new ATOM 0 HD13 LEU A 70 14.333 -10.380 -18.631 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.636 -13.274 -17.837 1.00 0.00 H new ATOM 0 HD22 LEU A 70 14.272 -12.062 -16.698 1.00 0.00 H new ATOM 0 HD23 LEU A 70 12.742 -12.899 -16.344 1.00 0.00 H new ATOM 1142 N ILE A 71 9.281 -10.344 -17.830 1.00 0.00 N ATOM 1143 CA ILE A 71 8.198 -10.939 -18.602 1.00 0.00 C ATOM 1144 C ILE A 71 7.017 -9.982 -18.720 1.00 0.00 C ATOM 1145 O ILE A 71 5.868 -10.408 -18.829 1.00 0.00 O ATOM 1146 CB ILE A 71 7.714 -12.258 -17.970 1.00 0.00 C ATOM 1147 CG1 ILE A 71 7.062 -11.989 -16.612 1.00 0.00 C ATOM 1148 CG2 ILE A 71 8.873 -13.232 -17.823 1.00 0.00 C ATOM 1149 CD1 ILE A 71 6.557 -13.239 -15.926 1.00 0.00 C ATOM 0 H ILE A 71 9.185 -10.446 -16.820 1.00 0.00 H new ATOM 0 HA ILE A 71 8.596 -11.146 -19.595 1.00 0.00 H new ATOM 0 HB ILE A 71 6.969 -12.707 -18.627 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.785 -11.495 -15.963 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.230 -11.298 -16.748 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.515 -14.159 -17.375 1.00 0.00 H new ATOM 0 HG22 ILE A 71 9.297 -13.444 -18.805 1.00 0.00 H new ATOM 0 HG23 ILE A 71 9.639 -12.792 -17.184 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.107 -12.973 -14.969 1.00 0.00 H new ATOM 0 HD12 ILE A 71 5.810 -13.723 -16.556 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.389 -13.923 -15.758 1.00 0.00 H new ATOM 1161 N ASN A 72 7.308 -8.685 -18.699 1.00 0.00 N ATOM 1162 CA ASN A 72 6.270 -7.666 -18.805 1.00 0.00 C ATOM 1163 C ASN A 72 6.408 -6.883 -20.107 1.00 0.00 C ATOM 1164 O ASN A 72 5.430 -6.350 -20.629 1.00 0.00 O ATOM 1165 CB ASN A 72 6.341 -6.711 -17.612 1.00 0.00 C ATOM 1166 CG ASN A 72 5.473 -7.167 -16.455 1.00 0.00 C ATOM 1167 OD1 ASN A 72 4.846 -8.224 -16.513 1.00 0.00 O ATOM 1168 ND2 ASN A 72 5.433 -6.367 -15.395 1.00 0.00 N ATOM 0 H ASN A 72 8.254 -8.315 -18.610 1.00 0.00 H new ATOM 0 HA ASN A 72 5.302 -8.167 -18.804 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.375 -6.629 -17.277 1.00 0.00 H new ATOM 0 HB3 ASN A 72 6.028 -5.716 -17.927 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.866 -6.620 -14.586 1.00 0.00 H new ATOM 0 HD22 ASN A 72 5.969 -5.499 -15.390 1.00 0.00 H new ATOM 1175 N GLY A 73 7.630 -6.818 -20.626 1.00 0.00 N ATOM 1176 CA GLY A 73 7.874 -6.098 -21.863 1.00 0.00 C ATOM 1177 C GLY A 73 8.447 -6.988 -22.948 1.00 0.00 C ATOM 1178 O GLY A 73 8.386 -6.652 -24.131 1.00 0.00 O ATOM 0 H GLY A 73 8.456 -7.251 -20.212 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.941 -5.658 -22.214 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.562 -5.275 -21.671 1.00 0.00 H new ATOM 1182 N ASP A 74 9.006 -8.124 -22.546 1.00 0.00 N ATOM 1183 CA ASP A 74 9.593 -9.064 -23.493 1.00 0.00 C ATOM 1184 C ASP A 74 8.607 -9.401 -24.607 1.00 0.00 C ATOM 1185 O ASP A 74 7.453 -9.740 -24.345 1.00 0.00 O ATOM 1186 CB ASP A 74 10.025 -10.343 -22.774 1.00 0.00 C ATOM 1187 CG ASP A 74 10.729 -11.318 -23.698 1.00 0.00 C ATOM 1188 OD1 ASP A 74 10.939 -12.479 -23.287 1.00 0.00 O ATOM 1189 OD2 ASP A 74 11.069 -10.920 -24.831 1.00 0.00 O ATOM 0 H ASP A 74 9.065 -8.416 -21.570 1.00 0.00 H new ATOM 0 HA ASP A 74 10.469 -8.593 -23.938 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.689 -10.086 -21.949 1.00 0.00 H new ATOM 0 HB3 ASP A 74 9.149 -10.826 -22.340 1.00 0.00 H new ATOM 1194 N GLU A 75 9.069 -9.304 -25.850 1.00 0.00 N ATOM 1195 CA GLU A 75 8.226 -9.596 -27.003 1.00 0.00 C ATOM 1196 C GLU A 75 8.396 -11.046 -27.447 1.00 0.00 C ATOM 1197 O GLU A 75 8.454 -11.338 -28.641 1.00 0.00 O ATOM 1198 CB GLU A 75 8.562 -8.654 -28.160 1.00 0.00 C ATOM 1199 CG GLU A 75 7.412 -8.450 -29.133 1.00 0.00 C ATOM 1200 CD GLU A 75 7.885 -8.094 -30.529 1.00 0.00 C ATOM 1201 OE1 GLU A 75 7.774 -8.953 -31.429 1.00 0.00 O ATOM 1202 OE2 GLU A 75 8.366 -6.958 -30.722 1.00 0.00 O ATOM 0 H GLU A 75 10.022 -9.026 -26.084 1.00 0.00 H new ATOM 0 HA GLU A 75 7.187 -9.443 -26.710 1.00 0.00 H new ATOM 0 HB2 GLU A 75 8.860 -7.687 -27.755 1.00 0.00 H new ATOM 0 HB3 GLU A 75 9.420 -9.051 -28.703 1.00 0.00 H new ATOM 0 HG2 GLU A 75 6.813 -9.360 -29.177 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.762 -7.658 -28.761 1.00 0.00 H new ATOM 1209 N SER A 76 8.476 -11.951 -26.476 1.00 0.00 N ATOM 1210 CA SER A 76 8.644 -13.370 -26.766 1.00 0.00 C ATOM 1211 C SER A 76 8.024 -14.226 -25.666 1.00 0.00 C ATOM 1212 O SER A 76 8.426 -15.371 -25.455 1.00 0.00 O ATOM 1213 CB SER A 76 10.128 -13.709 -26.917 1.00 0.00 C ATOM 1214 OG SER A 76 10.349 -14.540 -28.044 1.00 0.00 O ATOM 0 H SER A 76 8.427 -11.726 -25.482 1.00 0.00 H new ATOM 0 HA SER A 76 8.132 -13.587 -27.703 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.706 -12.790 -27.020 1.00 0.00 H new ATOM 0 HB3 SER A 76 10.483 -14.210 -26.017 1.00 0.00 H new ATOM 0 HG SER A 76 11.305 -14.741 -28.120 1.00 0.00 H new ATOM 1220 N ILE A 77 7.044 -13.663 -24.968 1.00 0.00 N ATOM 1221 CA ILE A 77 6.368 -14.374 -23.890 1.00 0.00 C ATOM 1222 C ILE A 77 4.870 -14.089 -23.898 1.00 0.00 C ATOM 1223 O ILE A 77 4.441 -12.979 -24.215 1.00 0.00 O ATOM 1224 CB ILE A 77 6.944 -13.991 -22.514 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.472 -14.072 -22.537 1.00 0.00 C ATOM 1226 CG2 ILE A 77 6.377 -14.896 -21.431 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.120 -13.634 -21.242 1.00 0.00 C ATOM 0 H ILE A 77 6.700 -12.716 -25.130 1.00 0.00 H new ATOM 0 HA ILE A 77 6.535 -15.438 -24.061 1.00 0.00 H new ATOM 0 HB ILE A 77 6.656 -12.964 -22.289 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.770 -15.098 -22.754 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.848 -13.452 -23.350 1.00 0.00 H new ATOM 0 HG21 ILE A 77 6.794 -14.612 -20.465 1.00 0.00 H new ATOM 0 HG22 ILE A 77 5.292 -14.794 -21.402 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.638 -15.932 -21.649 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.203 -13.718 -21.331 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.852 -12.598 -21.033 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.772 -14.270 -20.428 1.00 0.00 H new ATOM 1443 N TYR A 91 3.505 -17.416 -18.442 1.00 0.00 N ATOM 1444 CA TYR A 91 4.882 -16.969 -18.615 1.00 0.00 C ATOM 1445 C TYR A 91 5.723 -18.045 -19.296 1.00 0.00 C ATOM 1446 O TYR A 91 6.769 -18.448 -18.788 1.00 0.00 O ATOM 1447 CB TYR A 91 5.497 -16.608 -17.261 1.00 0.00 C ATOM 1448 CG TYR A 91 4.601 -15.746 -16.401 1.00 0.00 C ATOM 1449 CD1 TYR A 91 3.892 -14.683 -16.948 1.00 0.00 C ATOM 1450 CD2 TYR A 91 4.464 -15.993 -15.040 1.00 0.00 C ATOM 1451 CE1 TYR A 91 3.073 -13.893 -16.165 1.00 0.00 C ATOM 1452 CE2 TYR A 91 3.646 -15.208 -14.250 1.00 0.00 C ATOM 1453 CZ TYR A 91 2.953 -14.160 -14.817 1.00 0.00 C ATOM 1454 OH TYR A 91 2.138 -13.375 -14.033 1.00 0.00 O ATOM 0 HA TYR A 91 4.872 -16.084 -19.251 1.00 0.00 H new ATOM 0 HB2 TYR A 91 5.731 -17.526 -16.721 1.00 0.00 H new ATOM 0 HB3 TYR A 91 6.439 -16.086 -17.427 1.00 0.00 H new ATOM 0 HD1 TYR A 91 3.983 -14.471 -18.003 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.006 -16.813 -14.592 1.00 0.00 H new ATOM 0 HE1 TYR A 91 2.529 -13.071 -16.606 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.550 -15.414 -13.194 1.00 0.00 H new ATOM 0 HH TYR A 91 2.165 -13.697 -13.108 1.00 0.00 H new ATOM 1464 N THR A 92 5.257 -18.506 -20.453 1.00 0.00 N ATOM 1465 CA THR A 92 5.963 -19.534 -21.206 1.00 0.00 C ATOM 1466 C THR A 92 7.010 -18.920 -22.128 1.00 0.00 C ATOM 1467 O THR A 92 6.701 -18.506 -23.247 1.00 0.00 O ATOM 1468 CB THR A 92 4.991 -20.384 -22.046 1.00 0.00 C ATOM 1469 OG1 THR A 92 3.797 -20.645 -21.299 1.00 0.00 O ATOM 1470 CG2 THR A 92 5.636 -21.699 -22.456 1.00 0.00 C ATOM 0 H THR A 92 4.393 -18.183 -20.888 1.00 0.00 H new ATOM 0 HA THR A 92 6.457 -20.175 -20.476 1.00 0.00 H new ATOM 0 HB THR A 92 4.741 -19.824 -22.947 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.184 -21.184 -21.841 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.930 -22.281 -23.048 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.528 -21.497 -23.049 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.913 -22.262 -21.565 1.00 0.00 H new ATOM 1478 N LEU A 93 8.249 -18.863 -21.654 1.00 0.00 N ATOM 1479 CA LEU A 93 9.343 -18.299 -22.437 1.00 0.00 C ATOM 1480 C LEU A 93 9.528 -19.064 -23.744 1.00 0.00 C ATOM 1481 O LEU A 93 9.053 -20.190 -23.888 1.00 0.00 O ATOM 1482 CB LEU A 93 10.642 -18.325 -21.629 1.00 0.00 C ATOM 1483 CG LEU A 93 10.533 -17.883 -20.169 1.00 0.00 C ATOM 1484 CD1 LEU A 93 11.908 -17.836 -19.522 1.00 0.00 C ATOM 1485 CD2 LEU A 93 9.848 -16.528 -20.072 1.00 0.00 C ATOM 0 H LEU A 93 8.522 -19.200 -20.731 1.00 0.00 H new ATOM 0 HA LEU A 93 9.091 -17.265 -22.675 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.040 -19.339 -21.652 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.370 -17.685 -22.128 1.00 0.00 H new ATOM 0 HG LEU A 93 9.927 -18.613 -19.632 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.811 -17.520 -18.483 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.361 -18.827 -19.559 1.00 0.00 H new ATOM 0 HD13 LEU A 93 12.539 -17.128 -20.059 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.779 -16.229 -19.026 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.427 -15.787 -20.624 1.00 0.00 H new ATOM 0 HD23 LEU A 93 8.846 -16.595 -20.497 1.00 0.00 H new ATOM 1497 N GLY A 94 10.225 -18.445 -24.692 1.00 0.00 N ATOM 1498 CA GLY A 94 10.463 -19.084 -25.974 1.00 0.00 C ATOM 1499 C GLY A 94 11.249 -20.373 -25.842 1.00 0.00 C ATOM 1500 O GLY A 94 11.258 -21.198 -26.755 1.00 0.00 O ATOM 0 H GLY A 94 10.629 -17.513 -24.596 1.00 0.00 H new ATOM 0 HA2 GLY A 94 9.508 -19.292 -26.456 1.00 0.00 H new ATOM 0 HA3 GLY A 94 11.005 -18.397 -26.624 1.00 0.00 H new ATOM 1504 N ASP A 95 11.913 -20.545 -24.704 1.00 0.00 N ATOM 1505 CA ASP A 95 12.707 -21.743 -24.457 1.00 0.00 C ATOM 1506 C ASP A 95 11.900 -22.780 -23.682 1.00 0.00 C ATOM 1507 O ASP A 95 12.462 -23.645 -23.013 1.00 0.00 O ATOM 1508 CB ASP A 95 13.978 -21.387 -23.684 1.00 0.00 C ATOM 1509 CG ASP A 95 15.239 -21.725 -24.456 1.00 0.00 C ATOM 1510 OD1 ASP A 95 15.214 -22.701 -25.234 1.00 0.00 O ATOM 1511 OD2 ASP A 95 16.249 -21.012 -24.282 1.00 0.00 O ATOM 0 H ASP A 95 11.917 -19.871 -23.939 1.00 0.00 H new ATOM 0 HA ASP A 95 12.984 -22.171 -25.421 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.972 -20.322 -23.452 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.983 -21.921 -22.734 1.00 0.00 H new ATOM 1516 N GLY A 96 10.577 -22.685 -23.777 1.00 0.00 N ATOM 1517 CA GLY A 96 9.714 -23.620 -23.080 1.00 0.00 C ATOM 1518 C GLY A 96 10.047 -23.727 -21.605 1.00 0.00 C ATOM 1519 O GLY A 96 9.820 -24.765 -20.984 1.00 0.00 O ATOM 0 H GLY A 96 10.088 -21.977 -24.324 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.676 -23.306 -23.193 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.801 -24.604 -23.541 1.00 0.00 H new ATOM 1523 N SER A 97 10.590 -22.651 -21.043 1.00 0.00 N ATOM 1524 CA SER A 97 10.961 -22.631 -19.633 1.00 0.00 C ATOM 1525 C SER A 97 9.895 -21.924 -18.801 1.00 0.00 C ATOM 1526 O SER A 97 9.495 -20.801 -19.109 1.00 0.00 O ATOM 1527 CB SER A 97 12.311 -21.936 -19.449 1.00 0.00 C ATOM 1528 OG SER A 97 13.096 -22.027 -20.625 1.00 0.00 O ATOM 0 H SER A 97 10.782 -21.783 -21.542 1.00 0.00 H new ATOM 0 HA SER A 97 11.041 -23.662 -19.289 1.00 0.00 H new ATOM 0 HB2 SER A 97 12.152 -20.888 -19.194 1.00 0.00 H new ATOM 0 HB3 SER A 97 12.846 -22.389 -18.615 1.00 0.00 H new ATOM 0 HG SER A 97 13.351 -21.127 -20.919 1.00 0.00 H new ATOM 1534 N SER A 98 9.439 -22.590 -17.745 1.00 0.00 N ATOM 1535 CA SER A 98 8.417 -22.029 -16.870 1.00 0.00 C ATOM 1536 C SER A 98 9.035 -21.068 -15.859 1.00 0.00 C ATOM 1537 O SER A 98 9.271 -21.429 -14.705 1.00 0.00 O ATOM 1538 CB SER A 98 7.671 -23.147 -16.138 1.00 0.00 C ATOM 1539 OG SER A 98 7.369 -24.217 -17.016 1.00 0.00 O ATOM 0 H SER A 98 9.762 -23.519 -17.475 1.00 0.00 H new ATOM 0 HA SER A 98 7.710 -21.475 -17.488 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.278 -23.512 -15.310 1.00 0.00 H new ATOM 0 HB3 SER A 98 6.750 -22.753 -15.709 1.00 0.00 H new ATOM 0 HG SER A 98 6.894 -24.919 -16.525 1.00 0.00 H new ATOM 1545 N LEU A 99 9.295 -19.842 -16.300 1.00 0.00 N ATOM 1546 CA LEU A 99 9.886 -18.827 -15.435 1.00 0.00 C ATOM 1547 C LEU A 99 9.099 -18.694 -14.136 1.00 0.00 C ATOM 1548 O LEU A 99 8.025 -18.093 -14.109 1.00 0.00 O ATOM 1549 CB LEU A 99 9.933 -17.479 -16.157 1.00 0.00 C ATOM 1550 CG LEU A 99 10.973 -16.481 -15.647 1.00 0.00 C ATOM 1551 CD1 LEU A 99 12.256 -16.586 -16.456 1.00 0.00 C ATOM 1552 CD2 LEU A 99 10.422 -15.063 -15.698 1.00 0.00 C ATOM 0 H LEU A 99 9.106 -19.527 -17.251 1.00 0.00 H new ATOM 0 HA LEU A 99 10.902 -19.138 -15.192 1.00 0.00 H new ATOM 0 HB2 LEU A 99 10.123 -17.662 -17.215 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.949 -17.016 -16.085 1.00 0.00 H new ATOM 0 HG LEU A 99 11.202 -16.723 -14.609 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.984 -15.868 -16.078 1.00 0.00 H new ATOM 0 HD12 LEU A 99 12.661 -17.594 -16.367 1.00 0.00 H new ATOM 0 HD13 LEU A 99 12.044 -16.371 -17.503 1.00 0.00 H new ATOM 0 HD21 LEU A 99 11.176 -14.366 -15.331 1.00 0.00 H new ATOM 0 HD22 LEU A 99 10.164 -14.810 -16.726 1.00 0.00 H new ATOM 0 HD23 LEU A 99 9.531 -14.996 -15.073 1.00 0.00 H new ATOM 1564 N GLN A 100 9.642 -19.256 -13.061 1.00 0.00 N ATOM 1565 CA GLN A 100 8.990 -19.198 -11.758 1.00 0.00 C ATOM 1566 C GLN A 100 9.466 -17.985 -10.965 1.00 0.00 C ATOM 1567 O GLN A 100 10.571 -17.486 -11.177 1.00 0.00 O ATOM 1568 CB GLN A 100 9.267 -20.479 -10.968 1.00 0.00 C ATOM 1569 CG GLN A 100 8.008 -21.177 -10.480 1.00 0.00 C ATOM 1570 CD GLN A 100 7.552 -22.279 -11.415 1.00 0.00 C ATOM 1571 OE1 GLN A 100 8.163 -23.346 -11.480 1.00 0.00 O ATOM 1572 NE2 GLN A 100 6.472 -22.027 -12.145 1.00 0.00 N ATOM 0 H GLN A 100 10.531 -19.756 -13.066 1.00 0.00 H new ATOM 0 HA GLN A 100 7.916 -19.105 -11.921 1.00 0.00 H new ATOM 0 HB2 GLN A 100 9.834 -21.167 -11.595 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.895 -20.238 -10.110 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.190 -21.597 -9.491 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.209 -20.443 -10.372 1.00 0.00 H new ATOM 0 HE21 GLN A 100 5.997 -21.129 -12.059 1.00 0.00 H new ATOM 0 HE22 GLN A 100 6.118 -22.732 -12.792 1.00 0.00 H new ATOM 1581 N LYS A 101 8.624 -17.516 -10.050 1.00 0.00 N ATOM 1582 CA LYS A 101 8.957 -16.361 -9.224 1.00 0.00 C ATOM 1583 C LYS A 101 10.133 -16.672 -8.304 1.00 0.00 C ATOM 1584 O LYS A 101 10.450 -17.831 -8.032 1.00 0.00 O ATOM 1585 CB LYS A 101 7.744 -15.936 -8.394 1.00 0.00 C ATOM 1586 CG LYS A 101 6.801 -15.001 -9.130 1.00 0.00 C ATOM 1587 CD LYS A 101 5.916 -14.228 -8.166 1.00 0.00 C ATOM 1588 CE LYS A 101 4.517 -14.820 -8.096 1.00 0.00 C ATOM 1589 NZ LYS A 101 4.447 -15.969 -7.152 1.00 0.00 N ATOM 0 H LYS A 101 7.706 -17.918 -9.862 1.00 0.00 H new ATOM 0 HA LYS A 101 9.242 -15.542 -9.885 1.00 0.00 H new ATOM 0 HB2 LYS A 101 7.194 -16.826 -8.088 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.091 -15.446 -7.484 1.00 0.00 H new ATOM 0 HG2 LYS A 101 7.379 -14.302 -9.735 1.00 0.00 H new ATOM 0 HG3 LYS A 101 6.178 -15.576 -9.815 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.365 -14.235 -7.173 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.856 -13.186 -8.481 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.812 -14.050 -7.783 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.211 -15.147 -9.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 4.035 -16.792 -7.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.404 -16.205 -6.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.852 -15.714 -6.338 1.00 0.00 H new ATOM 1603 N PRO A 102 10.795 -15.616 -7.810 1.00 0.00 N ATOM 1604 CA PRO A 102 11.945 -15.751 -6.911 1.00 0.00 C ATOM 1605 C PRO A 102 11.545 -16.268 -5.533 1.00 0.00 C ATOM 1606 O PRO A 102 10.406 -16.093 -5.100 1.00 0.00 O ATOM 1607 CB PRO A 102 12.486 -14.323 -6.809 1.00 0.00 C ATOM 1608 CG PRO A 102 11.313 -13.452 -7.100 1.00 0.00 C ATOM 1609 CD PRO A 102 10.472 -14.207 -8.091 1.00 0.00 C ATOM 0 HA PRO A 102 12.673 -16.471 -7.286 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.891 -14.123 -5.817 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.292 -14.153 -7.523 1.00 0.00 H new ATOM 0 HG2 PRO A 102 10.749 -13.240 -6.191 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.631 -12.493 -7.509 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.410 -14.003 -7.954 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.719 -13.935 -9.117 1.00 0.00 H new ATOM 1617 N ASP A 103 12.489 -16.906 -4.849 1.00 0.00 N ATOM 1618 CA ASP A 103 12.235 -17.447 -3.519 1.00 0.00 C ATOM 1619 C ASP A 103 12.519 -16.403 -2.444 1.00 0.00 C ATOM 1620 O ASP A 103 13.544 -16.460 -1.764 1.00 0.00 O ATOM 1621 CB ASP A 103 13.093 -18.691 -3.279 1.00 0.00 C ATOM 1622 CG ASP A 103 12.480 -19.628 -2.257 1.00 0.00 C ATOM 1623 OD1 ASP A 103 12.853 -19.536 -1.068 1.00 0.00 O ATOM 1624 OD2 ASP A 103 11.627 -20.453 -2.646 1.00 0.00 O ATOM 0 H ASP A 103 13.436 -17.061 -5.194 1.00 0.00 H new ATOM 0 HA ASP A 103 11.182 -17.724 -3.461 1.00 0.00 H new ATOM 0 HB2 ASP A 103 13.228 -19.223 -4.221 1.00 0.00 H new ATOM 0 HB3 ASP A 103 14.083 -18.386 -2.940 1.00 0.00 H new ATOM 1629 N VAL A 104 11.606 -15.449 -2.296 1.00 0.00 N ATOM 1630 CA VAL A 104 11.758 -14.391 -1.304 1.00 0.00 C ATOM 1631 C VAL A 104 10.952 -14.697 -0.047 1.00 0.00 C ATOM 1632 O VAL A 104 10.607 -13.795 0.717 1.00 0.00 O ATOM 1633 CB VAL A 104 11.316 -13.027 -1.865 1.00 0.00 C ATOM 1634 CG1 VAL A 104 12.075 -12.704 -3.143 1.00 0.00 C ATOM 1635 CG2 VAL A 104 9.814 -13.013 -2.109 1.00 0.00 C ATOM 0 H VAL A 104 10.752 -15.387 -2.851 1.00 0.00 H new ATOM 0 HA VAL A 104 12.817 -14.345 -1.051 1.00 0.00 H new ATOM 0 HB VAL A 104 11.549 -12.258 -1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.749 -11.736 -3.525 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.144 -12.670 -2.933 1.00 0.00 H new ATOM 0 HG13 VAL A 104 11.876 -13.474 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 104 9.519 -12.041 -2.505 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.555 -13.792 -2.826 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.291 -13.196 -1.170 1.00 0.00 H new ATOM 1645 N TYR A 105 10.654 -15.974 0.163 1.00 0.00 N ATOM 1646 CA TYR A 105 9.886 -16.399 1.327 1.00 0.00 C ATOM 1647 C TYR A 105 10.714 -16.272 2.602 1.00 0.00 C ATOM 1648 O TYR A 105 10.226 -15.796 3.627 1.00 0.00 O ATOM 1649 CB TYR A 105 9.415 -17.845 1.154 1.00 0.00 C ATOM 1650 CG TYR A 105 8.666 -18.385 2.351 1.00 0.00 C ATOM 1651 CD1 TYR A 105 9.167 -19.455 3.083 1.00 0.00 C ATOM 1652 CD2 TYR A 105 7.458 -17.827 2.749 1.00 0.00 C ATOM 1653 CE1 TYR A 105 8.486 -19.953 4.177 1.00 0.00 C ATOM 1654 CE2 TYR A 105 6.771 -18.318 3.843 1.00 0.00 C ATOM 1655 CZ TYR A 105 7.289 -19.381 4.553 1.00 0.00 C ATOM 1656 OH TYR A 105 6.607 -19.873 5.642 1.00 0.00 O ATOM 0 H TYR A 105 10.933 -16.733 -0.458 1.00 0.00 H new ATOM 0 HA TYR A 105 9.016 -15.748 1.413 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.772 -17.906 0.276 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.280 -18.479 0.961 1.00 0.00 H new ATOM 0 HD1 TYR A 105 10.105 -19.905 2.792 1.00 0.00 H new ATOM 0 HD2 TYR A 105 7.049 -16.996 2.194 1.00 0.00 H new ATOM 0 HE1 TYR A 105 8.889 -20.786 4.735 1.00 0.00 H new ATOM 0 HE2 TYR A 105 5.834 -17.872 4.140 1.00 0.00 H new ATOM 0 HH TYR A 105 5.784 -19.358 5.772 1.00 0.00 H new ATOM 1666 N ALA A 106 11.970 -16.700 2.529 1.00 0.00 N ATOM 1667 CA ALA A 106 12.867 -16.632 3.676 1.00 0.00 C ATOM 1668 C ALA A 106 13.264 -15.190 3.977 1.00 0.00 C ATOM 1669 O ALA A 106 13.614 -14.856 5.110 1.00 0.00 O ATOM 1670 CB ALA A 106 14.105 -17.481 3.428 1.00 0.00 C ATOM 0 H ALA A 106 12.389 -17.097 1.688 1.00 0.00 H new ATOM 0 HA ALA A 106 12.338 -17.025 4.544 1.00 0.00 H new ATOM 0 HB1 ALA A 106 14.766 -17.421 4.292 1.00 0.00 H new ATOM 0 HB2 ALA A 106 13.809 -18.518 3.269 1.00 0.00 H new ATOM 0 HB3 ALA A 106 14.628 -17.113 2.545 1.00 0.00 H new ATOM 1676 N LEU A 107 13.209 -14.341 2.958 1.00 0.00 N ATOM 1677 CA LEU A 107 13.563 -12.934 3.113 1.00 0.00 C ATOM 1678 C LEU A 107 12.543 -12.209 3.985 1.00 0.00 C ATOM 1679 O LEU A 107 12.902 -11.562 4.969 1.00 0.00 O ATOM 1680 CB LEU A 107 13.656 -12.257 1.745 1.00 0.00 C ATOM 1681 CG LEU A 107 14.891 -12.597 0.910 1.00 0.00 C ATOM 1682 CD1 LEU A 107 14.854 -11.863 -0.421 1.00 0.00 C ATOM 1683 CD2 LEU A 107 16.162 -12.257 1.674 1.00 0.00 C ATOM 0 H LEU A 107 12.923 -14.602 2.014 1.00 0.00 H new ATOM 0 HA LEU A 107 14.535 -12.881 3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 107 12.769 -12.522 1.170 1.00 0.00 H new ATOM 0 HB3 LEU A 107 13.629 -11.178 1.894 1.00 0.00 H new ATOM 0 HG LEU A 107 14.887 -13.669 0.711 1.00 0.00 H new ATOM 0 HD11 LEU A 107 15.741 -12.117 -1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 107 13.962 -12.157 -0.974 1.00 0.00 H new ATOM 0 HD13 LEU A 107 14.833 -10.788 -0.243 1.00 0.00 H new ATOM 0 HD21 LEU A 107 17.031 -12.506 1.064 1.00 0.00 H new ATOM 0 HD22 LEU A 107 16.174 -11.192 1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 107 16.194 -12.830 2.601 1.00 0.00 H new ATOM 1695 N ILE A 108 11.272 -12.322 3.617 1.00 0.00 N ATOM 1696 CA ILE A 108 10.200 -11.680 4.367 1.00 0.00 C ATOM 1697 C ILE A 108 9.800 -12.515 5.579 1.00 0.00 C ATOM 1698 O ILE A 108 8.903 -12.142 6.336 1.00 0.00 O ATOM 1699 CB ILE A 108 8.958 -11.446 3.487 1.00 0.00 C ATOM 1700 CG1 ILE A 108 8.380 -12.782 3.017 1.00 0.00 C ATOM 1701 CG2 ILE A 108 9.311 -10.567 2.296 1.00 0.00 C ATOM 1702 CD1 ILE A 108 7.074 -12.645 2.266 1.00 0.00 C ATOM 0 H ILE A 108 10.959 -12.852 2.804 1.00 0.00 H new ATOM 0 HA ILE A 108 10.584 -10.717 4.703 1.00 0.00 H new ATOM 0 HB ILE A 108 8.201 -10.933 4.081 1.00 0.00 H new ATOM 0 HG12 ILE A 108 9.108 -13.278 2.375 1.00 0.00 H new ATOM 0 HG13 ILE A 108 8.226 -13.427 3.882 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.423 -10.411 1.683 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.681 -9.605 2.651 1.00 0.00 H new ATOM 0 HG23 ILE A 108 10.082 -11.055 1.700 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.723 -13.632 1.963 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.330 -12.178 2.912 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.226 -12.027 1.381 1.00 0.00 H new ATOM 1714 N LYS A 109 10.472 -13.647 5.758 1.00 0.00 N ATOM 1715 CA LYS A 109 10.191 -14.535 6.880 1.00 0.00 C ATOM 1716 C LYS A 109 10.311 -13.792 8.206 1.00 0.00 C ATOM 1717 O LYS A 109 9.725 -14.196 9.211 1.00 0.00 O ATOM 1718 CB LYS A 109 11.147 -15.730 6.864 1.00 0.00 C ATOM 1719 CG LYS A 109 10.922 -16.705 8.006 1.00 0.00 C ATOM 1720 CD LYS A 109 11.698 -17.995 7.800 1.00 0.00 C ATOM 1721 CE LYS A 109 10.906 -18.996 6.973 1.00 0.00 C ATOM 1722 NZ LYS A 109 10.959 -20.364 7.558 1.00 0.00 N ATOM 0 H LYS A 109 11.216 -13.971 5.140 1.00 0.00 H new ATOM 0 HA LYS A 109 9.167 -14.895 6.777 1.00 0.00 H new ATOM 0 HB2 LYS A 109 11.037 -16.260 5.918 1.00 0.00 H new ATOM 0 HB3 LYS A 109 12.173 -15.364 6.907 1.00 0.00 H new ATOM 0 HG2 LYS A 109 11.226 -16.243 8.945 1.00 0.00 H new ATOM 0 HG3 LYS A 109 9.859 -16.929 8.090 1.00 0.00 H new ATOM 0 HD2 LYS A 109 12.643 -17.777 7.302 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.941 -18.433 8.768 1.00 0.00 H new ATOM 0 HE2 LYS A 109 9.868 -18.670 6.905 1.00 0.00 H new ATOM 0 HE3 LYS A 109 11.300 -19.020 5.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 10.407 -21.017 6.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 11.947 -20.686 7.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.560 -20.347 8.518 1.00 0.00 H new ATOM 1736 N ASP A 110 11.073 -12.704 8.202 1.00 0.00 N ATOM 1737 CA ASP A 110 11.268 -11.903 9.405 1.00 0.00 C ATOM 1738 C ASP A 110 9.980 -11.185 9.795 1.00 0.00 C ATOM 1739 O ASP A 110 9.813 -10.765 10.940 1.00 0.00 O ATOM 1740 CB ASP A 110 12.388 -10.884 9.189 1.00 0.00 C ATOM 1741 CG ASP A 110 13.766 -11.497 9.347 1.00 0.00 C ATOM 1742 OD1 ASP A 110 13.919 -12.403 10.193 1.00 0.00 O ATOM 1743 OD2 ASP A 110 14.691 -11.070 8.625 1.00 0.00 O ATOM 0 H ASP A 110 11.566 -12.356 7.379 1.00 0.00 H new ATOM 0 HA ASP A 110 11.549 -12.574 10.217 1.00 0.00 H new ATOM 0 HB2 ASP A 110 12.297 -10.454 8.192 1.00 0.00 H new ATOM 0 HB3 ASP A 110 12.273 -10.066 9.900 1.00 0.00 H new ATOM 1748 N TYR A 111 9.072 -11.047 8.835 1.00 0.00 N ATOM 1749 CA TYR A 111 7.800 -10.377 9.076 1.00 0.00 C ATOM 1750 C TYR A 111 6.636 -11.209 8.547 1.00 0.00 C ATOM 1751 O TYR A 111 5.705 -10.681 7.939 1.00 0.00 O ATOM 1752 CB TYR A 111 7.794 -8.996 8.419 1.00 0.00 C ATOM 1753 CG TYR A 111 8.784 -8.030 9.030 1.00 0.00 C ATOM 1754 CD1 TYR A 111 10.151 -8.197 8.845 1.00 0.00 C ATOM 1755 CD2 TYR A 111 8.353 -6.952 9.794 1.00 0.00 C ATOM 1756 CE1 TYR A 111 11.060 -7.318 9.402 1.00 0.00 C ATOM 1757 CE2 TYR A 111 9.255 -6.068 10.353 1.00 0.00 C ATOM 1758 CZ TYR A 111 10.607 -6.254 10.154 1.00 0.00 C ATOM 1759 OH TYR A 111 11.508 -5.376 10.711 1.00 0.00 O ATOM 0 H TYR A 111 9.194 -11.390 7.882 1.00 0.00 H new ATOM 0 HA TYR A 111 7.679 -10.260 10.153 1.00 0.00 H new ATOM 0 HB2 TYR A 111 8.015 -9.107 7.358 1.00 0.00 H new ATOM 0 HB3 TYR A 111 6.793 -8.572 8.493 1.00 0.00 H new ATOM 0 HD1 TYR A 111 10.509 -9.028 8.256 1.00 0.00 H new ATOM 0 HD2 TYR A 111 7.295 -6.803 9.953 1.00 0.00 H new ATOM 0 HE1 TYR A 111 12.119 -7.463 9.249 1.00 0.00 H new ATOM 0 HE2 TYR A 111 8.903 -5.235 10.943 1.00 0.00 H new ATOM 0 HH TYR A 111 11.025 -4.683 11.209 1.00 0.00 H new ATOM 1769 N VAL A 112 6.697 -12.516 8.782 1.00 0.00 N ATOM 1770 CA VAL A 112 5.648 -13.424 8.331 1.00 0.00 C ATOM 1771 C VAL A 112 4.964 -14.103 9.512 1.00 0.00 C ATOM 1772 O VAL A 112 5.624 -14.596 10.427 1.00 0.00 O ATOM 1773 CB VAL A 112 6.209 -14.503 7.386 1.00 0.00 C ATOM 1774 CG1 VAL A 112 5.185 -15.606 7.168 1.00 0.00 C ATOM 1775 CG2 VAL A 112 6.628 -13.884 6.061 1.00 0.00 C ATOM 0 H VAL A 112 7.461 -12.970 9.282 1.00 0.00 H new ATOM 0 HA VAL A 112 4.918 -12.822 7.790 1.00 0.00 H new ATOM 0 HB VAL A 112 7.091 -14.945 7.850 1.00 0.00 H new ATOM 0 HG11 VAL A 112 5.599 -16.359 6.498 1.00 0.00 H new ATOM 0 HG12 VAL A 112 4.938 -16.067 8.124 1.00 0.00 H new ATOM 0 HG13 VAL A 112 4.283 -15.183 6.726 1.00 0.00 H new ATOM 0 HG21 VAL A 112 7.022 -14.660 5.405 1.00 0.00 H new ATOM 0 HG22 VAL A 112 5.765 -13.415 5.590 1.00 0.00 H new ATOM 0 HG23 VAL A 112 7.398 -13.133 6.238 1.00 0.00 H new ATOM 1910 N ILE A 122 -13.311 -13.483 9.148 1.00 0.00 N ATOM 1911 CA ILE A 122 -14.711 -13.730 9.469 1.00 0.00 C ATOM 1912 C ILE A 122 -15.405 -12.450 9.923 1.00 0.00 C ATOM 1913 O ILE A 122 -14.806 -11.615 10.599 1.00 0.00 O ATOM 1914 CB ILE A 122 -14.856 -14.797 10.570 1.00 0.00 C ATOM 1915 CG1 ILE A 122 -14.194 -16.106 10.133 1.00 0.00 C ATOM 1916 CG2 ILE A 122 -16.325 -15.024 10.897 1.00 0.00 C ATOM 1917 CD1 ILE A 122 -13.128 -16.593 11.089 1.00 0.00 C ATOM 0 HA ILE A 122 -15.185 -14.094 8.557 1.00 0.00 H new ATOM 0 HB ILE A 122 -14.354 -14.440 11.469 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -14.960 -16.875 10.033 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -13.751 -15.968 9.147 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -16.411 -15.781 11.677 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -16.768 -14.091 11.246 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -16.849 -15.363 10.003 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -12.703 -17.525 10.716 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -12.342 -15.842 11.171 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -13.570 -16.764 12.071 1.00 0.00 H new ATOM 1929 N GLU A 123 -16.672 -12.305 9.548 1.00 0.00 N ATOM 1930 CA GLU A 123 -17.448 -11.128 9.918 1.00 0.00 C ATOM 1931 C GLU A 123 -16.846 -9.865 9.307 1.00 0.00 C ATOM 1932 O GLU A 123 -17.151 -8.751 9.731 1.00 0.00 O ATOM 1933 CB GLU A 123 -17.513 -10.990 11.440 1.00 0.00 C ATOM 1934 CG GLU A 123 -18.920 -10.779 11.973 1.00 0.00 C ATOM 1935 CD GLU A 123 -18.955 -9.865 13.182 1.00 0.00 C ATOM 1936 OE1 GLU A 123 -19.479 -10.291 14.233 1.00 0.00 O ATOM 1937 OE2 GLU A 123 -18.460 -8.723 13.078 1.00 0.00 O ATOM 0 H GLU A 123 -17.182 -12.988 8.988 1.00 0.00 H new ATOM 0 HA GLU A 123 -18.458 -11.254 9.528 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -17.092 -11.886 11.896 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -16.888 -10.152 11.747 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -19.543 -10.357 11.185 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -19.352 -11.744 12.239 1.00 0.00 H new ATOM 1944 N ALA A 124 -15.988 -10.050 8.309 1.00 0.00 N ATOM 1945 CA ALA A 124 -15.343 -8.927 7.638 1.00 0.00 C ATOM 1946 C ALA A 124 -16.079 -8.558 6.355 1.00 0.00 C ATOM 1947 O ALA A 124 -16.372 -7.388 6.109 1.00 0.00 O ATOM 1948 CB ALA A 124 -13.888 -9.256 7.339 1.00 0.00 C ATOM 0 H ALA A 124 -15.723 -10.966 7.947 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.379 -8.067 8.306 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.419 -8.409 6.838 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.363 -9.463 8.271 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -13.839 -10.132 6.693 1.00 0.00 H new ATOM 1954 N LYS A 125 -16.374 -9.564 5.538 1.00 0.00 N ATOM 1955 CA LYS A 125 -17.076 -9.347 4.279 1.00 0.00 C ATOM 1956 C LYS A 125 -18.554 -9.057 4.523 1.00 0.00 C ATOM 1957 O LYS A 125 -19.198 -8.359 3.740 1.00 0.00 O ATOM 1958 CB LYS A 125 -16.928 -10.569 3.371 1.00 0.00 C ATOM 1959 CG LYS A 125 -17.283 -10.296 1.919 1.00 0.00 C ATOM 1960 CD LYS A 125 -16.258 -10.897 0.972 1.00 0.00 C ATOM 1961 CE LYS A 125 -15.259 -9.853 0.496 1.00 0.00 C ATOM 1962 NZ LYS A 125 -14.481 -10.326 -0.681 1.00 0.00 N ATOM 0 H LYS A 125 -16.137 -10.538 5.726 1.00 0.00 H new ATOM 0 HA LYS A 125 -16.630 -8.482 3.788 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -15.900 -10.928 3.423 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -17.565 -11.370 3.747 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -18.268 -10.709 1.700 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -17.345 -9.220 1.755 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -15.728 -11.707 1.474 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -16.767 -11.333 0.113 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -15.788 -8.936 0.237 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -14.575 -9.608 1.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -13.812 -9.586 -0.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -13.956 -11.187 -0.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -15.131 -10.536 -1.465 1.00 0.00 H new ATOM 1976 N VAL A 126 -19.086 -9.598 5.614 1.00 0.00 N ATOM 1977 CA VAL A 126 -20.487 -9.396 5.963 1.00 0.00 C ATOM 1978 C VAL A 126 -20.823 -7.911 6.051 1.00 0.00 C ATOM 1979 O VAL A 126 -21.838 -7.461 5.519 1.00 0.00 O ATOM 1980 CB VAL A 126 -20.835 -10.070 7.303 1.00 0.00 C ATOM 1981 CG1 VAL A 126 -22.304 -9.863 7.640 1.00 0.00 C ATOM 1982 CG2 VAL A 126 -20.494 -11.552 7.258 1.00 0.00 C ATOM 0 H VAL A 126 -18.568 -10.180 6.272 1.00 0.00 H new ATOM 0 HA VAL A 126 -21.079 -9.853 5.171 1.00 0.00 H new ATOM 0 HB VAL A 126 -20.238 -9.606 8.088 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -22.531 -10.346 8.590 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -22.513 -8.796 7.717 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -22.922 -10.298 6.855 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -20.746 -12.013 8.213 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -21.063 -12.032 6.462 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -19.428 -11.674 7.067 1.00 0.00 H new ATOM 1992 N ARG A 127 -19.963 -7.155 6.725 1.00 0.00 N ATOM 1993 CA ARG A 127 -20.168 -5.720 6.884 1.00 0.00 C ATOM 1994 C ARG A 127 -20.127 -5.012 5.533 1.00 0.00 C ATOM 1995 O ARG A 127 -20.824 -4.021 5.319 1.00 0.00 O ATOM 1996 CB ARG A 127 -19.106 -5.131 7.814 1.00 0.00 C ATOM 1997 CG ARG A 127 -19.554 -5.027 9.262 1.00 0.00 C ATOM 1998 CD ARG A 127 -19.695 -3.577 9.699 1.00 0.00 C ATOM 1999 NE ARG A 127 -20.379 -3.456 10.984 1.00 0.00 N ATOM 2000 CZ ARG A 127 -21.695 -3.560 11.128 1.00 0.00 C ATOM 2001 NH1 ARG A 127 -22.465 -3.786 10.073 1.00 0.00 N ATOM 2002 NH2 ARG A 127 -22.243 -3.439 12.330 1.00 0.00 N ATOM 0 H ARG A 127 -19.117 -7.512 7.170 1.00 0.00 H new ATOM 0 HA ARG A 127 -21.153 -5.566 7.326 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -18.209 -5.748 7.764 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -18.831 -4.139 7.456 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -20.508 -5.540 9.387 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -18.833 -5.533 9.904 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -18.707 -3.122 9.770 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -20.247 -3.022 8.941 1.00 0.00 H new ATOM 0 HE ARG A 127 -19.815 -3.282 11.816 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -22.047 -3.881 9.147 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -23.476 -3.865 10.187 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.653 -3.266 13.144 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -23.254 -3.519 12.440 1.00 0.00 H new ATOM 2016 N MET A 128 -19.305 -5.529 4.625 1.00 0.00 N ATOM 2017 CA MET A 128 -19.173 -4.946 3.295 1.00 0.00 C ATOM 2018 C MET A 128 -20.415 -5.225 2.454 1.00 0.00 C ATOM 2019 O MET A 128 -21.135 -4.304 2.068 1.00 0.00 O ATOM 2020 CB MET A 128 -17.932 -5.501 2.593 1.00 0.00 C ATOM 2021 CG MET A 128 -17.753 -4.981 1.176 1.00 0.00 C ATOM 2022 SD MET A 128 -16.206 -4.081 0.957 1.00 0.00 S ATOM 2023 CE MET A 128 -15.024 -5.288 1.552 1.00 0.00 C ATOM 0 H MET A 128 -18.721 -6.350 4.786 1.00 0.00 H new ATOM 0 HA MET A 128 -19.066 -3.867 3.407 1.00 0.00 H new ATOM 0 HB2 MET A 128 -17.049 -5.247 3.179 1.00 0.00 H new ATOM 0 HB3 MET A 128 -17.995 -6.589 2.567 1.00 0.00 H new ATOM 0 HG2 MET A 128 -17.783 -5.819 0.479 1.00 0.00 H new ATOM 0 HG3 MET A 128 -18.588 -4.327 0.925 1.00 0.00 H new ATOM 0 HE1 MET A 128 -14.081 -5.168 1.018 1.00 0.00 H new ATOM 0 HE2 MET A 128 -14.858 -5.140 2.619 1.00 0.00 H new ATOM 0 HE3 MET A 128 -15.412 -6.292 1.381 1.00 0.00 H new ATOM 2033 N ARG A 129 -20.660 -6.501 2.173 1.00 0.00 N ATOM 2034 CA ARG A 129 -21.813 -6.900 1.376 1.00 0.00 C ATOM 2035 C ARG A 129 -23.107 -6.376 1.992 1.00 0.00 C ATOM 2036 O ARG A 129 -24.092 -6.145 1.290 1.00 0.00 O ATOM 2037 CB ARG A 129 -21.875 -8.424 1.256 1.00 0.00 C ATOM 2038 CG ARG A 129 -21.974 -9.137 2.595 1.00 0.00 C ATOM 2039 CD ARG A 129 -23.236 -9.981 2.684 1.00 0.00 C ATOM 2040 NE ARG A 129 -23.037 -11.322 2.142 1.00 0.00 N ATOM 2041 CZ ARG A 129 -24.023 -12.192 1.950 1.00 0.00 C ATOM 2042 NH1 ARG A 129 -25.270 -11.862 2.254 1.00 0.00 N ATOM 2043 NH2 ARG A 129 -23.762 -13.394 1.452 1.00 0.00 N ATOM 0 H ARG A 129 -20.075 -7.276 2.486 1.00 0.00 H new ATOM 0 HA ARG A 129 -21.702 -6.468 0.381 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -22.735 -8.697 0.644 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -20.986 -8.775 0.732 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -21.099 -9.772 2.736 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -21.968 -8.403 3.401 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -23.551 -10.054 3.725 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -24.042 -9.487 2.141 1.00 0.00 H new ATOM 0 HE ARG A 129 -22.089 -11.607 1.897 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -25.474 -10.939 2.636 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -26.025 -12.531 2.106 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -22.804 -13.651 1.216 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -24.520 -14.061 1.305 1.00 0.00 H new ATOM 2057 N SER A 130 -23.097 -6.191 3.308 1.00 0.00 N ATOM 2058 CA SER A 130 -24.271 -5.698 4.020 1.00 0.00 C ATOM 2059 C SER A 130 -24.050 -4.270 4.510 1.00 0.00 C ATOM 2060 O SER A 130 -24.197 -3.980 5.697 1.00 0.00 O ATOM 2061 CB SER A 130 -24.597 -6.610 5.204 1.00 0.00 C ATOM 2062 OG SER A 130 -24.343 -7.968 4.886 1.00 0.00 O ATOM 0 H SER A 130 -22.289 -6.375 3.903 1.00 0.00 H new ATOM 0 HA SER A 130 -25.112 -5.700 3.327 1.00 0.00 H new ATOM 0 HB2 SER A 130 -24.000 -6.318 6.068 1.00 0.00 H new ATOM 0 HB3 SER A 130 -25.643 -6.488 5.484 1.00 0.00 H new ATOM 0 HG SER A 130 -23.424 -8.197 5.139 1.00 0.00 H new