USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 732 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 154 THR OG1 : rot 144:sc= 1.41 USER MOD Set 1.2: A 156 LYS NZ :NH3+ -161:sc= 1.03 (180deg=-0.5) USER MOD Set 2.1: A 113 SER OG : rot 180:sc= 0.186 USER MOD Set 2.2: A 117 LYS NZ :NH3+ 145:sc= 0.194 (180deg=-0.0878) USER MOD Set 3.1: A 105 SER OG : rot 163:sc= 1.05 USER MOD Set 3.2: A 111 SER OG : rot -149:sc= 1.04 USER MOD Set 4.1: A 93 TYR OH : rot -142:sc= 0.91 USER MOD Set 4.2: A 150 HIS : no HE2:sc= 0.308 K(o=1.2,f=-3.6) USER MOD Set 5.1: A 90 TYR OH : rot 180:sc= 1.08 USER MOD Set 5.2: A 115 HIS : no HD1:sc= 0.779 K(o=1.9,f=-8.6!) USER MOD Single : A 67 LYS NZ :NH3+ -157:sc= 1.21 (180deg=1.01) USER MOD Single : A 68 SER OG : rot -20:sc= 0.357 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0185 USER MOD Single : A 72 THR OG1 : rot -138:sc= -0.833! USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0.0372 USER MOD Single : A 87 SER OG : rot 17:sc= 0.214 USER MOD Single : A 95 LYS NZ :NH3+ 143:sc= -0.4 (180deg=-2.1!) USER MOD Single : A 96 SER OG : rot 95:sc= 1.25 USER MOD Single : A 100 GLN : amide:sc= 0.778 K(o=0.78,f=-0.69) USER MOD Single : A 107 ASN : amide:sc= -0.212 K(o=-0.21,f=-3.1!) USER MOD Single : A 118 SER OG : rot 79:sc= 1.13 USER MOD Single : A 123 CYS SG : rot 180:sc= -4.73! USER MOD Single : A 125 SER OG : rot 126:sc= 1.26 USER MOD Single : A 127 LYS NZ :NH3+ 152:sc= 0.518 (180deg=0.222) USER MOD Single : A 136 LYS NZ :NH3+ -168:sc= -0.0209 (180deg=-0.184) USER MOD Single : A 140 THR OG1 : rot 83:sc= 1.27 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 LYS NZ :NH3+ -153:sc= 1.11 (180deg=0.924) USER MOD Single : A 152 LYS NZ :NH3+ -173:sc= 1.44 (180deg=1.29) USER MOD Single : A 161 ASN : amide:sc= -3.37! K(o=-3.4!,f=-1) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 67 -4.875 3.855 -13.719 1.00 0.00 N ATOM 68 CA LYS A 67 -3.799 2.911 -13.836 1.00 0.00 C ATOM 69 C LYS A 67 -2.546 3.609 -13.350 1.00 0.00 C ATOM 70 O LYS A 67 -1.771 3.069 -12.586 1.00 0.00 O ATOM 71 CB LYS A 67 -3.556 2.414 -15.291 1.00 0.00 C ATOM 72 CG LYS A 67 -4.751 1.776 -16.014 1.00 0.00 C ATOM 73 CD LYS A 67 -5.725 2.809 -16.574 1.00 0.00 C ATOM 74 CE LYS A 67 -5.085 3.630 -17.692 1.00 0.00 C ATOM 75 NZ LYS A 67 -5.994 4.662 -18.204 1.00 0.00 N ATOM 0 HA LYS A 67 -4.057 2.030 -13.249 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.212 3.260 -15.886 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.744 1.687 -15.270 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.385 1.150 -16.828 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -5.281 1.122 -15.322 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.614 2.305 -16.954 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.053 3.473 -15.774 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -4.174 4.100 -17.321 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -4.792 2.968 -18.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -5.711 4.926 -19.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.966 4.293 -18.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -5.950 5.500 -17.589 1.00 0.00 H new ATOM 89 N SER A 68 -2.399 4.846 -13.756 1.00 0.00 N ATOM 90 CA SER A 68 -1.230 5.618 -13.456 1.00 0.00 C ATOM 91 C SER A 68 -1.562 6.837 -12.587 1.00 0.00 C ATOM 92 O SER A 68 -2.687 7.338 -12.610 1.00 0.00 O ATOM 93 CB SER A 68 -0.578 6.039 -14.769 1.00 0.00 C ATOM 94 OG SER A 68 -1.527 6.665 -15.648 1.00 0.00 O ATOM 0 H SER A 68 -3.096 5.345 -14.308 1.00 0.00 H new ATOM 0 HA SER A 68 -0.536 5.008 -12.878 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.242 6.728 -14.566 1.00 0.00 H new ATOM 0 HB3 SER A 68 -0.146 5.166 -15.259 1.00 0.00 H new ATOM 0 HG SER A 68 -2.436 6.410 -15.383 1.00 0.00 H new ATOM 100 N LEU A 69 -0.562 7.333 -11.861 1.00 0.00 N ATOM 101 CA LEU A 69 -0.700 8.488 -10.954 1.00 0.00 C ATOM 102 C LEU A 69 -1.044 9.782 -11.674 1.00 0.00 C ATOM 103 O LEU A 69 -1.445 10.781 -11.043 1.00 0.00 O ATOM 104 CB LEU A 69 0.560 8.651 -10.126 1.00 0.00 C ATOM 105 CG LEU A 69 0.651 7.765 -8.900 1.00 0.00 C ATOM 106 CD1 LEU A 69 2.065 7.716 -8.388 1.00 0.00 C ATOM 107 CD2 LEU A 69 -0.255 8.311 -7.816 1.00 0.00 C ATOM 0 H LEU A 69 0.381 6.945 -11.881 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.544 8.276 -10.298 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.422 8.451 -10.763 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.634 9.691 -9.808 1.00 0.00 H new ATOM 0 HG LEU A 69 0.340 6.757 -9.173 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.111 7.075 -7.507 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.719 7.316 -9.163 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.391 8.722 -8.122 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.191 7.675 -6.933 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.056 9.323 -7.557 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.284 8.329 -8.176 1.00 0.00 H new ATOM 119 N THR A 70 -0.902 9.762 -12.970 1.00 0.00 N ATOM 120 CA THR A 70 -1.255 10.863 -13.820 1.00 0.00 C ATOM 121 C THR A 70 -2.798 11.036 -13.833 1.00 0.00 C ATOM 122 O THR A 70 -3.322 12.124 -14.079 1.00 0.00 O ATOM 123 CB THR A 70 -0.750 10.548 -15.238 1.00 0.00 C ATOM 124 OG1 THR A 70 0.593 10.046 -15.132 1.00 0.00 O ATOM 125 CG2 THR A 70 -0.736 11.792 -16.099 1.00 0.00 C ATOM 0 H THR A 70 -0.528 8.959 -13.476 1.00 0.00 H new ATOM 0 HA THR A 70 -0.805 11.787 -13.457 1.00 0.00 H new ATOM 0 HB THR A 70 -1.414 9.816 -15.699 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.935 9.836 -16.026 1.00 0.00 H new ATOM 0 HG21 THR A 70 -0.375 11.540 -17.096 1.00 0.00 H new ATOM 0 HG22 THR A 70 -1.746 12.197 -16.170 1.00 0.00 H new ATOM 0 HG23 THR A 70 -0.078 12.537 -15.652 1.00 0.00 H new ATOM 133 N GLU A 71 -3.505 9.961 -13.505 1.00 0.00 N ATOM 134 CA GLU A 71 -4.966 9.949 -13.508 1.00 0.00 C ATOM 135 C GLU A 71 -5.486 10.077 -12.080 1.00 0.00 C ATOM 136 O GLU A 71 -6.679 9.954 -11.831 1.00 0.00 O ATOM 137 CB GLU A 71 -5.438 8.612 -14.054 1.00 0.00 C ATOM 138 CG GLU A 71 -4.890 8.253 -15.412 1.00 0.00 C ATOM 139 CD GLU A 71 -5.092 6.802 -15.710 1.00 0.00 C ATOM 140 OE1 GLU A 71 -6.144 6.430 -16.257 1.00 0.00 O ATOM 141 OE2 GLU A 71 -4.193 5.992 -15.379 1.00 0.00 O ATOM 0 H GLU A 71 -3.084 9.074 -13.230 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.332 10.776 -14.116 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.161 7.829 -13.348 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.527 8.622 -14.108 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.381 8.856 -16.176 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.827 8.491 -15.453 1.00 0.00 H new ATOM 148 N THR A 72 -4.594 10.310 -11.154 1.00 0.00 N ATOM 149 CA THR A 72 -4.943 10.299 -9.767 1.00 0.00 C ATOM 150 C THR A 72 -5.047 11.719 -9.180 1.00 0.00 C ATOM 151 O THR A 72 -4.195 12.580 -9.469 1.00 0.00 O ATOM 152 CB THR A 72 -3.880 9.515 -9.025 1.00 0.00 C ATOM 153 OG1 THR A 72 -3.606 8.331 -9.767 1.00 0.00 O ATOM 154 CG2 THR A 72 -4.364 9.130 -7.665 1.00 0.00 C ATOM 0 H THR A 72 -3.612 10.511 -11.343 1.00 0.00 H new ATOM 0 HA THR A 72 -5.925 9.838 -9.657 1.00 0.00 H new ATOM 0 HB THR A 72 -2.986 10.129 -8.917 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.522 7.572 -9.153 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.587 8.568 -7.148 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.602 10.029 -7.096 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.257 8.512 -7.758 1.00 0.00 H new ATOM 162 N GLU A 73 -6.075 11.952 -8.363 1.00 0.00 N ATOM 163 CA GLU A 73 -6.286 13.241 -7.717 1.00 0.00 C ATOM 164 C GLU A 73 -5.434 13.344 -6.438 1.00 0.00 C ATOM 165 O GLU A 73 -4.994 12.316 -5.888 1.00 0.00 O ATOM 166 CB GLU A 73 -7.775 13.473 -7.406 1.00 0.00 C ATOM 167 CG GLU A 73 -8.381 12.518 -6.383 1.00 0.00 C ATOM 168 CD GLU A 73 -9.822 12.852 -6.075 1.00 0.00 C ATOM 169 OE1 GLU A 73 -10.140 14.053 -5.891 1.00 0.00 O ATOM 170 OE2 GLU A 73 -10.669 11.943 -6.019 1.00 0.00 O ATOM 0 H GLU A 73 -6.781 11.253 -8.133 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.970 14.023 -8.408 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.899 14.494 -7.045 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -8.341 13.392 -8.334 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -8.319 11.497 -6.760 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.797 12.554 -5.464 1.00 0.00 H new ATOM 177 N LEU A 74 -5.221 14.564 -5.969 1.00 0.00 N ATOM 178 CA LEU A 74 -4.340 14.838 -4.851 1.00 0.00 C ATOM 179 C LEU A 74 -5.125 15.446 -3.683 1.00 0.00 C ATOM 180 O LEU A 74 -5.894 16.385 -3.863 1.00 0.00 O ATOM 181 CB LEU A 74 -3.216 15.798 -5.360 1.00 0.00 C ATOM 182 CG LEU A 74 -2.035 16.180 -4.423 1.00 0.00 C ATOM 183 CD1 LEU A 74 -2.438 17.138 -3.307 1.00 0.00 C ATOM 184 CD2 LEU A 74 -1.380 14.935 -3.859 1.00 0.00 C ATOM 0 H LEU A 74 -5.660 15.398 -6.360 1.00 0.00 H new ATOM 0 HA LEU A 74 -3.891 13.918 -4.476 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.787 15.348 -6.255 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.698 16.726 -5.669 1.00 0.00 H new ATOM 0 HG LEU A 74 -1.311 16.717 -5.036 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.568 17.364 -2.690 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.825 18.060 -3.741 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -3.209 16.675 -2.691 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -0.556 15.222 -3.206 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.113 14.364 -3.289 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.999 14.322 -4.676 1.00 0.00 H new ATOM 196 N LEU A 75 -4.936 14.894 -2.509 1.00 0.00 N ATOM 197 CA LEU A 75 -5.544 15.395 -1.292 1.00 0.00 C ATOM 198 C LEU A 75 -4.452 15.616 -0.250 1.00 0.00 C ATOM 199 O LEU A 75 -3.706 14.697 0.049 1.00 0.00 O ATOM 200 CB LEU A 75 -6.577 14.395 -0.695 1.00 0.00 C ATOM 201 CG LEU A 75 -7.896 14.123 -1.451 1.00 0.00 C ATOM 202 CD1 LEU A 75 -8.647 15.402 -1.728 1.00 0.00 C ATOM 203 CD2 LEU A 75 -7.683 13.315 -2.722 1.00 0.00 C ATOM 0 H LEU A 75 -4.348 14.073 -2.366 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.062 16.321 -1.541 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.070 13.438 -0.568 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -6.839 14.752 0.301 1.00 0.00 H new ATOM 0 HG LEU A 75 -8.513 13.511 -0.793 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.570 15.174 -2.261 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.885 15.896 -0.786 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.030 16.062 -2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.642 13.152 -3.215 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.019 13.860 -3.393 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.236 12.353 -2.471 1.00 0.00 H new ATOM 215 N PRO A 76 -4.275 16.836 0.256 1.00 0.00 N ATOM 216 CA PRO A 76 -3.363 17.088 1.382 1.00 0.00 C ATOM 217 C PRO A 76 -3.836 16.303 2.613 1.00 0.00 C ATOM 218 O PRO A 76 -5.035 16.250 2.889 1.00 0.00 O ATOM 219 CB PRO A 76 -3.502 18.595 1.603 1.00 0.00 C ATOM 220 CG PRO A 76 -3.902 19.090 0.264 1.00 0.00 C ATOM 221 CD PRO A 76 -4.883 18.078 -0.231 1.00 0.00 C ATOM 0 HA PRO A 76 -2.333 16.782 1.199 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.252 18.825 2.360 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -2.566 19.043 1.936 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -4.351 20.081 0.325 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -3.043 19.170 -0.403 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -5.881 18.237 0.178 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -4.978 18.092 -1.317 1.00 0.00 H new ATOM 229 N ILE A 77 -2.905 15.735 3.369 1.00 0.00 N ATOM 230 CA ILE A 77 -3.250 14.790 4.468 1.00 0.00 C ATOM 231 C ILE A 77 -4.046 15.433 5.614 1.00 0.00 C ATOM 232 O ILE A 77 -4.565 14.733 6.480 1.00 0.00 O ATOM 233 CB ILE A 77 -2.010 14.050 5.062 1.00 0.00 C ATOM 234 CG1 ILE A 77 -1.182 14.934 6.035 1.00 0.00 C ATOM 235 CG2 ILE A 77 -1.132 13.493 3.948 1.00 0.00 C ATOM 236 CD1 ILE A 77 -0.598 16.204 5.452 1.00 0.00 C ATOM 0 H ILE A 77 -1.905 15.900 3.256 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.892 14.058 3.977 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.395 13.221 5.656 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.818 15.205 6.877 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.365 14.332 6.433 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.273 12.981 4.383 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.709 12.789 3.348 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.785 14.310 3.315 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.042 16.737 6.224 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.073 15.952 4.630 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.403 16.838 5.082 1.00 0.00 H new ATOM 248 N THR A 78 -4.116 16.745 5.622 1.00 0.00 N ATOM 249 CA THR A 78 -4.847 17.463 6.633 1.00 0.00 C ATOM 250 C THR A 78 -6.364 17.195 6.509 1.00 0.00 C ATOM 251 O THR A 78 -7.067 17.023 7.525 1.00 0.00 O ATOM 252 CB THR A 78 -4.530 18.991 6.582 1.00 0.00 C ATOM 253 OG1 THR A 78 -5.319 19.706 7.539 1.00 0.00 O ATOM 254 CG2 THR A 78 -4.763 19.563 5.188 1.00 0.00 C ATOM 0 H THR A 78 -3.667 17.341 4.927 1.00 0.00 H new ATOM 0 HA THR A 78 -4.523 17.097 7.607 1.00 0.00 H new ATOM 0 HB THR A 78 -3.475 19.112 6.830 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.104 20.661 7.492 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.533 20.628 5.189 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.118 19.053 4.473 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.805 19.417 4.904 1.00 0.00 H new ATOM 262 N GLU A 79 -6.848 17.058 5.279 1.00 0.00 N ATOM 263 CA GLU A 79 -8.254 16.834 5.037 1.00 0.00 C ATOM 264 C GLU A 79 -8.561 15.332 5.013 1.00 0.00 C ATOM 265 O GLU A 79 -9.133 14.795 4.074 1.00 0.00 O ATOM 266 CB GLU A 79 -8.759 17.605 3.784 1.00 0.00 C ATOM 267 CG GLU A 79 -8.047 17.301 2.473 1.00 0.00 C ATOM 268 CD GLU A 79 -8.507 18.209 1.350 1.00 0.00 C ATOM 269 OE1 GLU A 79 -9.584 17.969 0.750 1.00 0.00 O ATOM 270 OE2 GLU A 79 -7.803 19.186 1.045 1.00 0.00 O ATOM 0 H GLU A 79 -6.277 17.100 4.435 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.824 17.252 5.867 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.820 17.391 3.655 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.671 18.673 3.981 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.971 17.412 2.611 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -8.227 16.262 2.196 1.00 0.00 H new ATOM 277 N ALA A 80 -8.153 14.666 6.091 1.00 0.00 N ATOM 278 CA ALA A 80 -8.286 13.218 6.266 1.00 0.00 C ATOM 279 C ALA A 80 -9.751 12.751 6.231 1.00 0.00 C ATOM 280 O ALA A 80 -10.044 11.577 5.978 1.00 0.00 O ATOM 281 CB ALA A 80 -7.619 12.784 7.558 1.00 0.00 C ATOM 0 H ALA A 80 -7.710 15.127 6.886 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.784 12.744 5.423 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.724 11.706 7.677 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -6.561 13.044 7.526 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.092 13.290 8.400 1.00 0.00 H new ATOM 287 N ASP A 81 -10.661 13.675 6.465 1.00 0.00 N ATOM 288 CA ASP A 81 -12.098 13.383 6.422 1.00 0.00 C ATOM 289 C ASP A 81 -12.564 13.321 4.974 1.00 0.00 C ATOM 290 O ASP A 81 -13.549 12.673 4.647 1.00 0.00 O ATOM 291 CB ASP A 81 -12.876 14.475 7.149 1.00 0.00 C ATOM 292 CG ASP A 81 -14.359 14.202 7.231 1.00 0.00 C ATOM 293 OD1 ASP A 81 -14.790 13.530 8.183 1.00 0.00 O ATOM 294 OD2 ASP A 81 -15.124 14.674 6.365 1.00 0.00 O ATOM 0 H ASP A 81 -10.438 14.645 6.689 1.00 0.00 H new ATOM 0 HA ASP A 81 -12.277 12.425 6.910 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.478 14.584 8.158 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -12.717 15.425 6.639 1.00 0.00 H new ATOM 299 N SER A 82 -11.815 13.962 4.115 1.00 0.00 N ATOM 300 CA SER A 82 -12.139 14.056 2.717 1.00 0.00 C ATOM 301 C SER A 82 -11.493 12.912 1.930 1.00 0.00 C ATOM 302 O SER A 82 -11.644 12.815 0.707 1.00 0.00 O ATOM 303 CB SER A 82 -11.652 15.400 2.202 1.00 0.00 C ATOM 304 OG SER A 82 -12.137 16.451 3.037 1.00 0.00 O ATOM 0 H SER A 82 -10.951 14.440 4.371 1.00 0.00 H new ATOM 0 HA SER A 82 -13.218 13.976 2.584 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.562 15.416 2.180 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.994 15.551 1.178 1.00 0.00 H new ATOM 0 HG SER A 82 -11.816 17.313 2.698 1.00 0.00 H new ATOM 310 N ILE A 83 -10.775 12.055 2.632 1.00 0.00 N ATOM 311 CA ILE A 83 -10.139 10.915 2.017 1.00 0.00 C ATOM 312 C ILE A 83 -11.196 9.836 1.805 1.00 0.00 C ATOM 313 O ILE A 83 -11.862 9.429 2.764 1.00 0.00 O ATOM 314 CB ILE A 83 -8.988 10.351 2.896 1.00 0.00 C ATOM 315 CG1 ILE A 83 -8.016 11.468 3.298 1.00 0.00 C ATOM 316 CG2 ILE A 83 -8.241 9.231 2.173 1.00 0.00 C ATOM 317 CD1 ILE A 83 -7.363 12.200 2.152 1.00 0.00 C ATOM 0 H ILE A 83 -10.620 12.132 3.637 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.702 11.227 1.068 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.432 9.934 3.800 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.554 12.192 3.910 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.235 11.039 3.925 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.441 8.856 2.812 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.933 8.421 1.944 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.815 9.617 1.247 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.696 12.968 2.544 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.790 11.495 1.549 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.130 12.667 1.534 1.00 0.00 H new ATOM 329 N PRO A 84 -11.398 9.409 0.549 1.00 0.00 N ATOM 330 CA PRO A 84 -12.402 8.401 0.185 1.00 0.00 C ATOM 331 C PRO A 84 -12.328 7.117 1.008 1.00 0.00 C ATOM 332 O PRO A 84 -11.254 6.492 1.165 1.00 0.00 O ATOM 333 CB PRO A 84 -12.058 8.087 -1.265 1.00 0.00 C ATOM 334 CG PRO A 84 -11.492 9.355 -1.776 1.00 0.00 C ATOM 335 CD PRO A 84 -10.684 9.908 -0.646 1.00 0.00 C ATOM 0 HA PRO A 84 -13.409 8.780 0.359 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -11.340 7.270 -1.338 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -12.941 7.787 -1.830 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -10.872 9.183 -2.656 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -12.280 10.047 -2.072 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -9.653 9.555 -0.677 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -10.649 10.997 -0.670 1.00 0.00 H new ATOM 343 N SER A 85 -13.457 6.719 1.512 1.00 0.00 N ATOM 344 CA SER A 85 -13.577 5.506 2.226 1.00 0.00 C ATOM 345 C SER A 85 -13.960 4.384 1.255 1.00 0.00 C ATOM 346 O SER A 85 -15.131 4.021 1.094 1.00 0.00 O ATOM 347 CB SER A 85 -14.570 5.692 3.375 1.00 0.00 C ATOM 348 OG SER A 85 -15.734 6.397 2.930 1.00 0.00 O ATOM 0 H SER A 85 -14.328 7.244 1.432 1.00 0.00 H new ATOM 0 HA SER A 85 -12.628 5.217 2.678 1.00 0.00 H new ATOM 0 HB2 SER A 85 -14.858 4.719 3.774 1.00 0.00 H new ATOM 0 HB3 SER A 85 -14.095 6.241 4.188 1.00 0.00 H new ATOM 0 HG SER A 85 -16.357 6.504 3.678 1.00 0.00 H new ATOM 354 N ALA A 86 -12.973 3.932 0.514 1.00 0.00 N ATOM 355 CA ALA A 86 -13.169 2.910 -0.482 1.00 0.00 C ATOM 356 C ALA A 86 -11.915 2.084 -0.610 1.00 0.00 C ATOM 357 O ALA A 86 -10.912 2.387 0.033 1.00 0.00 O ATOM 358 CB ALA A 86 -13.489 3.563 -1.804 1.00 0.00 C ATOM 0 H ALA A 86 -12.012 4.265 0.587 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.994 2.261 -0.188 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -13.639 2.795 -2.563 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -14.397 4.158 -1.706 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.663 4.209 -2.100 1.00 0.00 H new ATOM 364 N SER A 87 -11.962 1.063 -1.425 1.00 0.00 N ATOM 365 CA SER A 87 -10.829 0.211 -1.643 1.00 0.00 C ATOM 366 C SER A 87 -10.059 0.750 -2.837 1.00 0.00 C ATOM 367 O SER A 87 -10.650 1.341 -3.751 1.00 0.00 O ATOM 368 CB SER A 87 -11.297 -1.245 -1.890 1.00 0.00 C ATOM 369 OG SER A 87 -10.218 -2.176 -1.875 1.00 0.00 O ATOM 0 H SER A 87 -12.792 0.800 -1.957 1.00 0.00 H new ATOM 0 HA SER A 87 -10.182 0.201 -0.766 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.024 -1.524 -1.127 1.00 0.00 H new ATOM 0 HB3 SER A 87 -11.807 -1.301 -2.852 1.00 0.00 H new ATOM 0 HG SER A 87 -9.435 -1.763 -1.455 1.00 0.00 H new ATOM 375 N GLY A 88 -8.774 0.594 -2.819 1.00 0.00 N ATOM 376 CA GLY A 88 -7.986 1.069 -3.894 1.00 0.00 C ATOM 377 C GLY A 88 -6.569 1.219 -3.487 1.00 0.00 C ATOM 378 O GLY A 88 -6.117 0.564 -2.532 1.00 0.00 O ATOM 0 H GLY A 88 -8.254 0.140 -2.068 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -8.056 0.378 -4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.373 2.028 -4.237 1.00 0.00 H new ATOM 382 N VAL A 89 -5.888 2.091 -4.151 1.00 0.00 N ATOM 383 CA VAL A 89 -4.492 2.320 -3.932 1.00 0.00 C ATOM 384 C VAL A 89 -4.275 3.795 -3.602 1.00 0.00 C ATOM 385 O VAL A 89 -5.031 4.660 -4.064 1.00 0.00 O ATOM 386 CB VAL A 89 -3.664 1.862 -5.188 1.00 0.00 C ATOM 387 CG1 VAL A 89 -4.128 2.554 -6.456 1.00 0.00 C ATOM 388 CG2 VAL A 89 -2.159 2.025 -4.989 1.00 0.00 C ATOM 0 H VAL A 89 -6.292 2.680 -4.879 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.140 1.729 -3.087 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.856 0.795 -5.305 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.529 2.209 -7.299 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.177 2.319 -6.636 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.011 3.632 -6.346 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -1.635 1.694 -5.886 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.928 3.073 -4.800 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.837 1.424 -4.139 1.00 0.00 H new ATOM 398 N TYR A 90 -3.311 4.076 -2.771 1.00 0.00 N ATOM 399 CA TYR A 90 -3.014 5.425 -2.387 1.00 0.00 C ATOM 400 C TYR A 90 -1.511 5.661 -2.403 1.00 0.00 C ATOM 401 O TYR A 90 -0.720 4.729 -2.178 1.00 0.00 O ATOM 402 CB TYR A 90 -3.618 5.756 -1.006 1.00 0.00 C ATOM 403 CG TYR A 90 -3.109 4.895 0.140 1.00 0.00 C ATOM 404 CD1 TYR A 90 -1.962 5.248 0.839 1.00 0.00 C ATOM 405 CD2 TYR A 90 -3.777 3.733 0.525 1.00 0.00 C ATOM 406 CE1 TYR A 90 -1.494 4.478 1.874 1.00 0.00 C ATOM 407 CE2 TYR A 90 -3.311 2.957 1.568 1.00 0.00 C ATOM 408 CZ TYR A 90 -2.168 3.336 2.238 1.00 0.00 C ATOM 409 OH TYR A 90 -1.689 2.575 3.284 1.00 0.00 O ATOM 0 H TYR A 90 -2.709 3.374 -2.341 1.00 0.00 H new ATOM 0 HA TYR A 90 -3.472 6.097 -3.112 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.410 6.801 -0.776 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -4.701 5.652 -1.065 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.428 6.145 0.563 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -4.672 3.435 -0.000 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.598 4.768 2.402 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.838 2.060 1.856 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.275 1.801 3.421 1.00 0.00 H new ATOM 419 N ALA A 91 -1.130 6.875 -2.672 1.00 0.00 N ATOM 420 CA ALA A 91 0.253 7.265 -2.745 1.00 0.00 C ATOM 421 C ALA A 91 0.530 8.366 -1.742 1.00 0.00 C ATOM 422 O ALA A 91 -0.128 9.405 -1.763 1.00 0.00 O ATOM 423 CB ALA A 91 0.585 7.728 -4.148 1.00 0.00 C ATOM 0 H ALA A 91 -1.782 7.639 -2.851 1.00 0.00 H new ATOM 0 HA ALA A 91 0.882 6.408 -2.505 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.634 8.022 -4.196 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.403 6.916 -4.852 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.043 8.580 -4.408 1.00 0.00 H new ATOM 429 N VAL A 92 1.494 8.136 -0.884 1.00 0.00 N ATOM 430 CA VAL A 92 1.839 9.052 0.178 1.00 0.00 C ATOM 431 C VAL A 92 3.027 9.925 -0.218 1.00 0.00 C ATOM 432 O VAL A 92 4.151 9.417 -0.493 1.00 0.00 O ATOM 433 CB VAL A 92 2.171 8.290 1.491 1.00 0.00 C ATOM 434 CG1 VAL A 92 2.527 9.255 2.611 1.00 0.00 C ATOM 435 CG2 VAL A 92 1.008 7.410 1.909 1.00 0.00 C ATOM 0 H VAL A 92 2.070 7.295 -0.904 1.00 0.00 H new ATOM 0 HA VAL A 92 0.971 9.689 0.351 1.00 0.00 H new ATOM 0 HB VAL A 92 3.037 7.657 1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.754 8.693 3.517 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.397 9.844 2.321 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.685 9.921 2.799 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.261 6.886 2.830 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.125 8.028 2.074 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.801 6.684 1.123 1.00 0.00 H new ATOM 445 N TYR A 93 2.772 11.207 -0.245 1.00 0.00 N ATOM 446 CA TYR A 93 3.734 12.219 -0.565 1.00 0.00 C ATOM 447 C TYR A 93 3.991 13.049 0.677 1.00 0.00 C ATOM 448 O TYR A 93 3.080 13.263 1.481 1.00 0.00 O ATOM 449 CB TYR A 93 3.193 13.136 -1.677 1.00 0.00 C ATOM 450 CG TYR A 93 2.973 12.454 -3.001 1.00 0.00 C ATOM 451 CD1 TYR A 93 1.777 11.820 -3.309 1.00 0.00 C ATOM 452 CD2 TYR A 93 3.971 12.441 -3.942 1.00 0.00 C ATOM 453 CE1 TYR A 93 1.607 11.191 -4.526 1.00 0.00 C ATOM 454 CE2 TYR A 93 3.810 11.827 -5.149 1.00 0.00 C ATOM 455 CZ TYR A 93 2.635 11.202 -5.442 1.00 0.00 C ATOM 456 OH TYR A 93 2.499 10.564 -6.650 1.00 0.00 O ATOM 0 H TYR A 93 1.849 11.586 -0.035 1.00 0.00 H new ATOM 0 HA TYR A 93 4.654 11.748 -0.911 1.00 0.00 H new ATOM 0 HB2 TYR A 93 2.249 13.569 -1.345 1.00 0.00 H new ATOM 0 HB3 TYR A 93 3.890 13.962 -1.820 1.00 0.00 H new ATOM 0 HD1 TYR A 93 0.972 11.819 -2.589 1.00 0.00 H new ATOM 0 HD2 TYR A 93 4.908 12.930 -3.721 1.00 0.00 H new ATOM 0 HE1 TYR A 93 0.676 10.695 -4.758 1.00 0.00 H new ATOM 0 HE2 TYR A 93 4.613 11.836 -5.872 1.00 0.00 H new ATOM 0 HH TYR A 93 3.350 10.145 -6.896 1.00 0.00 H new ATOM 466 N ASP A 94 5.197 13.507 0.846 1.00 0.00 N ATOM 467 CA ASP A 94 5.527 14.344 1.995 1.00 0.00 C ATOM 468 C ASP A 94 5.290 15.814 1.614 1.00 0.00 C ATOM 469 O ASP A 94 4.692 16.088 0.579 1.00 0.00 O ATOM 470 CB ASP A 94 6.983 14.126 2.432 1.00 0.00 C ATOM 471 CG ASP A 94 7.991 14.774 1.516 1.00 0.00 C ATOM 472 OD1 ASP A 94 8.166 14.321 0.364 1.00 0.00 O ATOM 473 OD2 ASP A 94 8.615 15.776 1.935 1.00 0.00 O ATOM 0 H ASP A 94 5.976 13.324 0.213 1.00 0.00 H new ATOM 0 HA ASP A 94 4.890 14.074 2.837 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.114 14.520 3.440 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.183 13.056 2.480 1.00 0.00 H new ATOM 478 N LYS A 95 5.757 16.762 2.427 1.00 0.00 N ATOM 479 CA LYS A 95 5.547 18.196 2.139 1.00 0.00 C ATOM 480 C LYS A 95 6.358 18.650 0.927 1.00 0.00 C ATOM 481 O LYS A 95 6.079 19.684 0.342 1.00 0.00 O ATOM 482 CB LYS A 95 5.879 19.089 3.343 1.00 0.00 C ATOM 483 CG LYS A 95 5.095 18.781 4.609 1.00 0.00 C ATOM 484 CD LYS A 95 3.560 18.915 4.458 1.00 0.00 C ATOM 485 CE LYS A 95 3.026 20.353 4.428 1.00 0.00 C ATOM 486 NZ LYS A 95 3.379 21.093 3.198 1.00 0.00 N ATOM 0 H LYS A 95 6.279 16.574 3.283 1.00 0.00 H new ATOM 0 HA LYS A 95 4.485 18.305 1.917 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.943 18.997 3.562 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.699 20.128 3.066 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.329 17.766 4.929 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.430 19.450 5.401 1.00 0.00 H new ATOM 0 HD2 LYS A 95 3.257 18.413 3.539 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.083 18.385 5.282 1.00 0.00 H new ATOM 0 HE2 LYS A 95 1.941 20.330 4.529 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.415 20.894 5.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.586 21.706 2.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 4.223 21.676 3.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.577 20.418 2.432 1.00 0.00 H new ATOM 500 N SER A 96 7.358 17.878 0.559 1.00 0.00 N ATOM 501 CA SER A 96 8.149 18.172 -0.621 1.00 0.00 C ATOM 502 C SER A 96 7.441 17.581 -1.852 1.00 0.00 C ATOM 503 O SER A 96 7.915 17.712 -2.994 1.00 0.00 O ATOM 504 CB SER A 96 9.520 17.545 -0.454 1.00 0.00 C ATOM 505 OG SER A 96 9.994 17.764 0.866 1.00 0.00 O ATOM 0 H SER A 96 7.645 17.038 1.061 1.00 0.00 H new ATOM 0 HA SER A 96 8.258 19.248 -0.754 1.00 0.00 H new ATOM 0 HB2 SER A 96 9.468 16.476 -0.658 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.216 17.974 -1.175 1.00 0.00 H new ATOM 0 HG SER A 96 9.778 16.988 1.424 1.00 0.00 H new ATOM 511 N ASP A 97 6.310 16.921 -1.579 1.00 0.00 N ATOM 512 CA ASP A 97 5.441 16.288 -2.561 1.00 0.00 C ATOM 513 C ASP A 97 6.119 15.206 -3.354 1.00 0.00 C ATOM 514 O ASP A 97 5.802 14.987 -4.535 1.00 0.00 O ATOM 515 CB ASP A 97 4.705 17.290 -3.464 1.00 0.00 C ATOM 516 CG ASP A 97 3.493 17.918 -2.791 1.00 0.00 C ATOM 517 OD1 ASP A 97 2.494 17.201 -2.552 1.00 0.00 O ATOM 518 OD2 ASP A 97 3.489 19.144 -2.542 1.00 0.00 O ATOM 0 H ASP A 97 5.966 16.812 -0.625 1.00 0.00 H new ATOM 0 HA ASP A 97 4.673 15.793 -1.966 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.397 18.078 -3.763 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.386 16.784 -4.375 1.00 0.00 H new ATOM 523 N GLU A 98 7.025 14.498 -2.713 1.00 0.00 N ATOM 524 CA GLU A 98 7.645 13.370 -3.334 1.00 0.00 C ATOM 525 C GLU A 98 7.097 12.095 -2.769 1.00 0.00 C ATOM 526 O GLU A 98 6.596 12.063 -1.637 1.00 0.00 O ATOM 527 CB GLU A 98 9.161 13.419 -3.304 1.00 0.00 C ATOM 528 CG GLU A 98 9.704 14.510 -4.187 1.00 0.00 C ATOM 529 CD GLU A 98 11.187 14.455 -4.367 1.00 0.00 C ATOM 530 OE1 GLU A 98 11.671 13.606 -5.157 1.00 0.00 O ATOM 531 OE2 GLU A 98 11.891 15.316 -3.791 1.00 0.00 O ATOM 0 H GLU A 98 7.342 14.692 -1.763 1.00 0.00 H new ATOM 0 HA GLU A 98 7.391 13.407 -4.393 1.00 0.00 H new ATOM 0 HB2 GLU A 98 9.499 13.579 -2.280 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.562 12.458 -3.626 1.00 0.00 H new ATOM 0 HG2 GLU A 98 9.226 14.446 -5.164 1.00 0.00 H new ATOM 0 HG3 GLU A 98 9.434 15.477 -3.763 1.00 0.00 H new ATOM 538 N LEU A 99 7.171 11.063 -3.556 1.00 0.00 N ATOM 539 CA LEU A 99 6.555 9.811 -3.242 1.00 0.00 C ATOM 540 C LEU A 99 7.524 8.903 -2.541 1.00 0.00 C ATOM 541 O LEU A 99 8.511 8.474 -3.119 1.00 0.00 O ATOM 542 CB LEU A 99 6.015 9.185 -4.548 1.00 0.00 C ATOM 543 CG LEU A 99 5.188 7.879 -4.490 1.00 0.00 C ATOM 544 CD1 LEU A 99 6.058 6.644 -4.251 1.00 0.00 C ATOM 545 CD2 LEU A 99 4.120 7.998 -3.431 1.00 0.00 C ATOM 0 H LEU A 99 7.668 11.069 -4.446 1.00 0.00 H new ATOM 0 HA LEU A 99 5.722 9.965 -2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.399 9.938 -5.039 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.870 9.000 -5.198 1.00 0.00 H new ATOM 0 HG LEU A 99 4.719 7.742 -5.464 1.00 0.00 H new ATOM 0 HD11 LEU A 99 5.428 5.755 -4.219 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.782 6.547 -5.060 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.586 6.749 -3.303 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.540 7.076 -3.394 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.587 8.172 -2.462 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.460 8.832 -3.671 1.00 0.00 H new ATOM 557 N GLN A 100 7.236 8.631 -1.308 1.00 0.00 N ATOM 558 CA GLN A 100 8.032 7.713 -0.533 1.00 0.00 C ATOM 559 C GLN A 100 7.293 6.392 -0.309 1.00 0.00 C ATOM 560 O GLN A 100 7.912 5.337 -0.191 1.00 0.00 O ATOM 561 CB GLN A 100 8.466 8.307 0.825 1.00 0.00 C ATOM 562 CG GLN A 100 9.625 9.325 0.804 1.00 0.00 C ATOM 563 CD GLN A 100 9.330 10.629 0.083 1.00 0.00 C ATOM 564 OE1 GLN A 100 9.598 10.779 -1.105 1.00 0.00 O ATOM 565 NE2 GLN A 100 8.793 11.581 0.803 1.00 0.00 N ATOM 0 H GLN A 100 6.446 9.034 -0.804 1.00 0.00 H new ATOM 0 HA GLN A 100 8.933 7.524 -1.116 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.599 8.789 1.277 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.750 7.483 1.480 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.905 9.553 1.832 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.490 8.857 0.334 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.584 11.419 1.788 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.583 12.485 0.379 1.00 0.00 H new ATOM 574 N PHE A 101 5.974 6.423 -0.267 1.00 0.00 N ATOM 575 CA PHE A 101 5.242 5.204 0.034 1.00 0.00 C ATOM 576 C PHE A 101 3.946 5.104 -0.750 1.00 0.00 C ATOM 577 O PHE A 101 3.240 6.079 -0.910 1.00 0.00 O ATOM 578 CB PHE A 101 4.971 5.115 1.562 1.00 0.00 C ATOM 579 CG PHE A 101 4.130 3.930 1.997 1.00 0.00 C ATOM 580 CD1 PHE A 101 4.709 2.696 2.202 1.00 0.00 C ATOM 581 CD2 PHE A 101 2.760 4.061 2.195 1.00 0.00 C ATOM 582 CE1 PHE A 101 3.948 1.610 2.595 1.00 0.00 C ATOM 583 CE2 PHE A 101 1.993 2.980 2.586 1.00 0.00 C ATOM 584 CZ PHE A 101 2.588 1.752 2.786 1.00 0.00 C ATOM 0 H PHE A 101 5.401 7.250 -0.432 1.00 0.00 H new ATOM 0 HA PHE A 101 5.860 4.360 -0.272 1.00 0.00 H new ATOM 0 HB2 PHE A 101 5.927 5.073 2.083 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.474 6.031 1.881 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.772 2.575 2.054 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.289 5.021 2.041 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.418 0.650 2.753 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.930 3.097 2.735 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.992 0.904 3.091 1.00 0.00 H new ATOM 594 N VAL A 102 3.655 3.923 -1.236 1.00 0.00 N ATOM 595 CA VAL A 102 2.368 3.636 -1.877 1.00 0.00 C ATOM 596 C VAL A 102 1.806 2.388 -1.256 1.00 0.00 C ATOM 597 O VAL A 102 2.573 1.512 -0.805 1.00 0.00 O ATOM 598 CB VAL A 102 2.400 3.477 -3.448 1.00 0.00 C ATOM 599 CG1 VAL A 102 2.772 4.757 -4.134 1.00 0.00 C ATOM 600 CG2 VAL A 102 3.323 2.375 -3.895 1.00 0.00 C ATOM 0 H VAL A 102 4.292 3.127 -1.205 1.00 0.00 H new ATOM 0 HA VAL A 102 1.743 4.512 -1.705 1.00 0.00 H new ATOM 0 HB VAL A 102 1.384 3.208 -3.738 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.782 4.602 -5.213 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.043 5.528 -3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.762 5.073 -3.804 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.309 2.307 -4.983 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.337 2.591 -3.558 1.00 0.00 H new ATOM 0 HG23 VAL A 102 2.993 1.428 -3.468 1.00 0.00 H new ATOM 610 N GLY A 103 0.516 2.300 -1.190 1.00 0.00 N ATOM 611 CA GLY A 103 -0.089 1.162 -0.589 1.00 0.00 C ATOM 612 C GLY A 103 -1.484 0.941 -1.068 1.00 0.00 C ATOM 613 O GLY A 103 -2.102 1.840 -1.637 1.00 0.00 O ATOM 0 H GLY A 103 -0.134 3.001 -1.544 1.00 0.00 H new ATOM 0 HA2 GLY A 103 0.511 0.278 -0.805 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -0.095 1.286 0.494 1.00 0.00 H new ATOM 617 N ILE A 104 -1.970 -0.243 -0.842 1.00 0.00 N ATOM 618 CA ILE A 104 -3.309 -0.640 -1.216 1.00 0.00 C ATOM 619 C ILE A 104 -4.094 -1.001 0.030 1.00 0.00 C ATOM 620 O ILE A 104 -3.505 -1.425 1.033 1.00 0.00 O ATOM 621 CB ILE A 104 -3.294 -1.832 -2.215 1.00 0.00 C ATOM 622 CG1 ILE A 104 -2.377 -2.967 -1.704 1.00 0.00 C ATOM 623 CG2 ILE A 104 -2.865 -1.359 -3.591 1.00 0.00 C ATOM 624 CD1 ILE A 104 -2.305 -4.179 -2.617 1.00 0.00 C ATOM 0 H ILE A 104 -1.439 -0.983 -0.382 1.00 0.00 H new ATOM 0 HA ILE A 104 -3.789 0.199 -1.720 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.305 -2.233 -2.292 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.371 -2.570 -1.568 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.729 -3.287 -0.723 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.859 -2.203 -4.280 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.563 -0.603 -3.950 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.864 -0.931 -3.533 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -1.640 -4.924 -2.181 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.301 -4.606 -2.734 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.922 -3.878 -3.592 1.00 0.00 H new ATOM 636 N SER A 105 -5.391 -0.804 -0.008 1.00 0.00 N ATOM 637 CA SER A 105 -6.230 -1.079 1.136 1.00 0.00 C ATOM 638 C SER A 105 -7.679 -1.321 0.701 1.00 0.00 C ATOM 639 O SER A 105 -8.053 -1.092 -0.473 1.00 0.00 O ATOM 640 CB SER A 105 -6.159 0.103 2.133 1.00 0.00 C ATOM 641 OG SER A 105 -6.972 -0.119 3.287 1.00 0.00 O ATOM 0 H SER A 105 -5.891 -0.452 -0.824 1.00 0.00 H new ATOM 0 HA SER A 105 -5.867 -1.983 1.626 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.125 0.255 2.442 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.480 1.018 1.634 1.00 0.00 H new ATOM 0 HG SER A 105 -6.696 0.490 4.004 1.00 0.00 H new ATOM 647 N ARG A 106 -8.487 -1.776 1.647 1.00 0.00 N ATOM 648 CA ARG A 106 -9.898 -2.002 1.442 1.00 0.00 C ATOM 649 C ARG A 106 -10.671 -0.752 1.799 1.00 0.00 C ATOM 650 O ARG A 106 -11.777 -0.532 1.307 1.00 0.00 O ATOM 651 CB ARG A 106 -10.390 -3.195 2.256 1.00 0.00 C ATOM 652 CG ARG A 106 -9.771 -4.512 1.835 1.00 0.00 C ATOM 653 CD ARG A 106 -10.154 -4.849 0.410 1.00 0.00 C ATOM 654 NE ARG A 106 -9.569 -6.099 -0.050 1.00 0.00 N ATOM 655 CZ ARG A 106 -9.827 -6.648 -1.231 1.00 0.00 C ATOM 656 NH1 ARG A 106 -10.647 -6.041 -2.081 1.00 0.00 N ATOM 657 NH2 ARG A 106 -9.268 -7.799 -1.560 1.00 0.00 N ATOM 0 H ARG A 106 -8.170 -2.000 2.590 1.00 0.00 H new ATOM 0 HA ARG A 106 -10.064 -2.234 0.390 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -10.171 -3.021 3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -11.474 -3.266 2.163 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -8.686 -4.454 1.922 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -10.102 -5.306 2.504 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -11.240 -4.912 0.336 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -9.836 -4.040 -0.248 1.00 0.00 H new ATOM 0 HE ARG A 106 -8.922 -6.583 0.572 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -11.079 -5.153 -1.827 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -10.845 -6.463 -2.988 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -8.639 -8.265 -0.907 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -9.466 -8.221 -2.467 1.00 0.00 H new ATOM 671 N ASN A 107 -10.101 0.052 2.662 1.00 0.00 N ATOM 672 CA ASN A 107 -10.682 1.330 2.995 1.00 0.00 C ATOM 673 C ASN A 107 -9.552 2.322 3.184 1.00 0.00 C ATOM 674 O ASN A 107 -8.996 2.445 4.285 1.00 0.00 O ATOM 675 CB ASN A 107 -11.575 1.261 4.238 1.00 0.00 C ATOM 676 CG ASN A 107 -12.433 2.512 4.417 1.00 0.00 C ATOM 677 OD1 ASN A 107 -13.559 2.578 3.943 1.00 0.00 O ATOM 678 ND2 ASN A 107 -11.899 3.509 5.064 1.00 0.00 N ATOM 0 H ASN A 107 -9.230 -0.157 3.150 1.00 0.00 H new ATOM 0 HA ASN A 107 -11.334 1.649 2.182 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -12.223 0.388 4.167 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.951 1.124 5.121 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -12.422 4.376 5.187 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.958 3.423 5.447 1.00 0.00 H new ATOM 685 N ILE A 108 -9.205 2.978 2.088 1.00 0.00 N ATOM 686 CA ILE A 108 -8.068 3.903 1.963 1.00 0.00 C ATOM 687 C ILE A 108 -7.848 4.806 3.193 1.00 0.00 C ATOM 688 O ILE A 108 -6.801 4.714 3.840 1.00 0.00 O ATOM 689 CB ILE A 108 -8.192 4.761 0.660 1.00 0.00 C ATOM 690 CG1 ILE A 108 -8.156 3.845 -0.578 1.00 0.00 C ATOM 691 CG2 ILE A 108 -7.087 5.803 0.577 1.00 0.00 C ATOM 692 CD1 ILE A 108 -8.335 4.567 -1.902 1.00 0.00 C ATOM 0 H ILE A 108 -9.726 2.882 1.216 1.00 0.00 H new ATOM 0 HA ILE A 108 -7.182 3.272 1.900 1.00 0.00 H new ATOM 0 HB ILE A 108 -9.146 5.288 0.690 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -7.204 3.314 -0.594 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -8.939 3.093 -0.480 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.201 6.382 -0.339 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -7.150 6.469 1.438 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -6.117 5.305 0.573 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.296 3.845 -2.718 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.299 5.075 -1.912 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.538 5.300 -2.027 1.00 0.00 H new ATOM 704 N ALA A 109 -8.848 5.622 3.526 1.00 0.00 N ATOM 705 CA ALA A 109 -8.783 6.593 4.645 1.00 0.00 C ATOM 706 C ALA A 109 -8.266 5.988 5.957 1.00 0.00 C ATOM 707 O ALA A 109 -7.427 6.592 6.637 1.00 0.00 O ATOM 708 CB ALA A 109 -10.155 7.211 4.861 1.00 0.00 C ATOM 0 H ALA A 109 -9.739 5.636 3.029 1.00 0.00 H new ATOM 0 HA ALA A 109 -8.060 7.356 4.357 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -10.107 7.925 5.683 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -10.470 7.725 3.953 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -10.873 6.427 5.102 1.00 0.00 H new ATOM 714 N ALA A 110 -8.711 4.781 6.260 1.00 0.00 N ATOM 715 CA ALA A 110 -8.375 4.127 7.513 1.00 0.00 C ATOM 716 C ALA A 110 -6.894 3.803 7.577 1.00 0.00 C ATOM 717 O ALA A 110 -6.217 4.109 8.564 1.00 0.00 O ATOM 718 CB ALA A 110 -9.207 2.865 7.692 1.00 0.00 C ATOM 0 H ALA A 110 -9.312 4.229 5.648 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.605 4.814 8.328 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -8.944 2.386 8.635 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.265 3.125 7.700 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.008 2.178 6.869 1.00 0.00 H new ATOM 724 N SER A 111 -6.388 3.220 6.518 1.00 0.00 N ATOM 725 CA SER A 111 -5.003 2.850 6.457 1.00 0.00 C ATOM 726 C SER A 111 -4.112 4.088 6.343 1.00 0.00 C ATOM 727 O SER A 111 -3.067 4.163 7.001 1.00 0.00 O ATOM 728 CB SER A 111 -4.787 1.883 5.306 1.00 0.00 C ATOM 729 OG SER A 111 -5.676 0.777 5.435 1.00 0.00 O ATOM 0 H SER A 111 -6.924 2.991 5.681 1.00 0.00 H new ATOM 0 HA SER A 111 -4.721 2.346 7.382 1.00 0.00 H new ATOM 0 HB2 SER A 111 -4.957 2.390 4.356 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.755 1.533 5.301 1.00 0.00 H new ATOM 0 HG SER A 111 -5.258 -0.025 5.057 1.00 0.00 H new ATOM 735 N VAL A 112 -4.550 5.069 5.545 1.00 0.00 N ATOM 736 CA VAL A 112 -3.814 6.319 5.364 1.00 0.00 C ATOM 737 C VAL A 112 -3.575 7.003 6.701 1.00 0.00 C ATOM 738 O VAL A 112 -2.413 7.204 7.095 1.00 0.00 O ATOM 739 CB VAL A 112 -4.544 7.293 4.375 1.00 0.00 C ATOM 740 CG1 VAL A 112 -3.873 8.658 4.331 1.00 0.00 C ATOM 741 CG2 VAL A 112 -4.559 6.710 2.984 1.00 0.00 C ATOM 0 H VAL A 112 -5.418 5.017 5.012 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.851 6.063 4.922 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.564 7.419 4.740 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.408 9.304 3.635 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.889 9.104 5.326 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.840 8.545 4.001 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -5.069 7.396 2.307 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.535 6.557 2.642 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -5.084 5.755 2.995 1.00 0.00 H new ATOM 751 N SER A 113 -4.654 7.280 7.417 1.00 0.00 N ATOM 752 CA SER A 113 -4.574 7.980 8.681 1.00 0.00 C ATOM 753 C SER A 113 -3.726 7.203 9.701 1.00 0.00 C ATOM 754 O SER A 113 -2.808 7.769 10.284 1.00 0.00 O ATOM 755 CB SER A 113 -5.982 8.268 9.232 1.00 0.00 C ATOM 756 OG SER A 113 -5.948 9.088 10.401 1.00 0.00 O ATOM 0 H SER A 113 -5.601 7.026 7.137 1.00 0.00 H new ATOM 0 HA SER A 113 -4.076 8.934 8.505 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.577 8.760 8.463 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.478 7.326 9.466 1.00 0.00 H new ATOM 0 HG SER A 113 -6.862 9.247 10.716 1.00 0.00 H new ATOM 762 N ALA A 114 -3.975 5.890 9.828 1.00 0.00 N ATOM 763 CA ALA A 114 -3.300 5.041 10.831 1.00 0.00 C ATOM 764 C ALA A 114 -1.773 5.182 10.793 1.00 0.00 C ATOM 765 O ALA A 114 -1.127 5.500 11.815 1.00 0.00 O ATOM 766 CB ALA A 114 -3.700 3.582 10.650 1.00 0.00 C ATOM 0 H ALA A 114 -4.644 5.387 9.245 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.629 5.388 11.811 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -3.194 2.971 11.397 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.779 3.483 10.771 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.414 3.247 9.653 1.00 0.00 H new ATOM 772 N HIS A 115 -1.187 5.002 9.628 1.00 0.00 N ATOM 773 CA HIS A 115 0.257 5.097 9.551 1.00 0.00 C ATOM 774 C HIS A 115 0.768 6.518 9.450 1.00 0.00 C ATOM 775 O HIS A 115 1.901 6.767 9.778 1.00 0.00 O ATOM 776 CB HIS A 115 0.921 4.172 8.514 1.00 0.00 C ATOM 777 CG HIS A 115 0.456 4.304 7.106 1.00 0.00 C ATOM 778 ND1 HIS A 115 0.760 5.381 6.294 1.00 0.00 N ATOM 779 CD2 HIS A 115 -0.287 3.475 6.361 1.00 0.00 C ATOM 780 CE1 HIS A 115 0.211 5.194 5.113 1.00 0.00 C ATOM 781 NE2 HIS A 115 -0.423 4.045 5.134 1.00 0.00 N ATOM 0 H HIS A 115 -1.665 4.797 8.751 1.00 0.00 H new ATOM 0 HA HIS A 115 0.578 4.713 10.519 1.00 0.00 H new ATOM 0 HB2 HIS A 115 1.996 4.352 8.536 1.00 0.00 H new ATOM 0 HB3 HIS A 115 0.765 3.140 8.829 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -0.701 2.529 6.677 1.00 0.00 H new ATOM 0 HE1 HIS A 115 0.272 5.869 4.272 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -0.938 3.642 4.351 1.00 0.00 H new ATOM 790 N LEU A 116 -0.050 7.449 9.003 1.00 0.00 N ATOM 791 CA LEU A 116 0.389 8.850 8.951 1.00 0.00 C ATOM 792 C LEU A 116 0.396 9.489 10.322 1.00 0.00 C ATOM 793 O LEU A 116 1.184 10.380 10.588 1.00 0.00 O ATOM 794 CB LEU A 116 -0.412 9.693 7.958 1.00 0.00 C ATOM 795 CG LEU A 116 -0.113 9.452 6.477 1.00 0.00 C ATOM 796 CD1 LEU A 116 -1.021 10.302 5.624 1.00 0.00 C ATOM 797 CD2 LEU A 116 1.341 9.782 6.167 1.00 0.00 C ATOM 0 H LEU A 116 -1.001 7.280 8.676 1.00 0.00 H new ATOM 0 HA LEU A 116 1.415 8.825 8.584 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.473 9.509 8.128 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.232 10.745 8.178 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.289 8.400 6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.802 10.125 4.571 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.060 10.042 5.827 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.858 11.354 5.856 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.537 9.605 5.109 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.535 10.829 6.402 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.994 9.149 6.768 1.00 0.00 H new ATOM 809 N LYS A 117 -0.482 9.031 11.192 1.00 0.00 N ATOM 810 CA LYS A 117 -0.484 9.513 12.564 1.00 0.00 C ATOM 811 C LYS A 117 0.685 8.871 13.321 1.00 0.00 C ATOM 812 O LYS A 117 1.200 9.418 14.314 1.00 0.00 O ATOM 813 CB LYS A 117 -1.832 9.221 13.245 1.00 0.00 C ATOM 814 CG LYS A 117 -3.044 9.833 12.526 1.00 0.00 C ATOM 815 CD LYS A 117 -2.964 11.354 12.437 1.00 0.00 C ATOM 816 CE LYS A 117 -4.144 11.945 11.654 1.00 0.00 C ATOM 817 NZ LYS A 117 -5.461 11.597 12.244 1.00 0.00 N ATOM 0 H LYS A 117 -1.196 8.334 10.980 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.354 10.595 12.572 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -1.968 8.141 13.309 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.800 9.599 14.267 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.114 9.417 11.521 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -3.956 9.551 13.053 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.948 11.776 13.442 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -2.029 11.641 11.956 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -4.043 13.030 11.618 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.106 11.587 10.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -6.118 12.394 12.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -5.844 10.756 11.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -5.345 11.397 13.258 1.00 0.00 H new ATOM 831 N SER A 118 1.105 7.716 12.833 1.00 0.00 N ATOM 832 CA SER A 118 2.261 7.043 13.357 1.00 0.00 C ATOM 833 C SER A 118 3.547 7.744 12.846 1.00 0.00 C ATOM 834 O SER A 118 4.390 8.152 13.651 1.00 0.00 O ATOM 835 CB SER A 118 2.221 5.553 12.988 1.00 0.00 C ATOM 836 OG SER A 118 1.022 4.935 13.497 1.00 0.00 O ATOM 0 H SER A 118 0.649 7.226 12.063 1.00 0.00 H new ATOM 0 HA SER A 118 2.263 7.101 14.445 1.00 0.00 H new ATOM 0 HB2 SER A 118 2.263 5.440 11.905 1.00 0.00 H new ATOM 0 HB3 SER A 118 3.097 5.049 13.395 1.00 0.00 H new ATOM 0 HG SER A 118 0.268 5.152 12.911 1.00 0.00 H new ATOM 842 N VAL A 119 3.682 7.899 11.518 1.00 0.00 N ATOM 843 CA VAL A 119 4.798 8.626 10.932 1.00 0.00 C ATOM 844 C VAL A 119 4.367 9.920 10.243 1.00 0.00 C ATOM 845 O VAL A 119 4.046 9.949 9.043 1.00 0.00 O ATOM 846 CB VAL A 119 5.688 7.774 9.987 1.00 0.00 C ATOM 847 CG1 VAL A 119 6.436 6.785 10.796 1.00 0.00 C ATOM 848 CG2 VAL A 119 4.882 7.047 8.909 1.00 0.00 C ATOM 0 H VAL A 119 3.023 7.525 10.835 1.00 0.00 H new ATOM 0 HA VAL A 119 5.419 8.889 11.789 1.00 0.00 H new ATOM 0 HB VAL A 119 6.368 8.453 9.472 1.00 0.00 H new ATOM 0 HG11 VAL A 119 7.065 6.181 10.142 1.00 0.00 H new ATOM 0 HG12 VAL A 119 7.062 7.306 11.521 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.733 6.139 11.322 1.00 0.00 H new ATOM 0 HG21 VAL A 119 5.557 6.468 8.279 1.00 0.00 H new ATOM 0 HG22 VAL A 119 4.163 6.378 9.382 1.00 0.00 H new ATOM 0 HG23 VAL A 119 4.351 7.777 8.298 1.00 0.00 H new ATOM 858 N PRO A 120 4.356 11.031 10.987 1.00 0.00 N ATOM 859 CA PRO A 120 3.977 12.329 10.455 1.00 0.00 C ATOM 860 C PRO A 120 5.057 12.922 9.553 1.00 0.00 C ATOM 861 O PRO A 120 4.868 13.974 8.949 1.00 0.00 O ATOM 862 CB PRO A 120 3.773 13.202 11.702 1.00 0.00 C ATOM 863 CG PRO A 120 3.793 12.259 12.852 1.00 0.00 C ATOM 864 CD PRO A 120 4.652 11.116 12.420 1.00 0.00 C ATOM 0 HA PRO A 120 3.087 12.261 9.829 1.00 0.00 H new ATOM 0 HB2 PRO A 120 4.562 13.948 11.792 1.00 0.00 H new ATOM 0 HB3 PRO A 120 2.827 13.742 11.653 1.00 0.00 H new ATOM 0 HG2 PRO A 120 4.197 12.737 13.744 1.00 0.00 H new ATOM 0 HG3 PRO A 120 2.787 11.921 13.099 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.709 11.307 12.607 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.397 10.195 12.944 1.00 0.00 H new ATOM 872 N GLU A 121 6.179 12.234 9.453 1.00 0.00 N ATOM 873 CA GLU A 121 7.282 12.657 8.605 1.00 0.00 C ATOM 874 C GLU A 121 6.852 12.591 7.130 1.00 0.00 C ATOM 875 O GLU A 121 7.309 13.365 6.293 1.00 0.00 O ATOM 876 CB GLU A 121 8.513 11.768 8.848 1.00 0.00 C ATOM 877 CG GLU A 121 9.780 12.238 8.134 1.00 0.00 C ATOM 878 CD GLU A 121 10.234 13.608 8.597 1.00 0.00 C ATOM 879 OE1 GLU A 121 9.708 14.630 8.096 1.00 0.00 O ATOM 880 OE2 GLU A 121 11.112 13.689 9.482 1.00 0.00 O ATOM 0 H GLU A 121 6.353 11.365 9.957 1.00 0.00 H new ATOM 0 HA GLU A 121 7.550 13.685 8.851 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.709 11.724 9.919 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.283 10.753 8.524 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.579 11.517 8.306 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.599 12.263 7.059 1.00 0.00 H new ATOM 887 N LEU A 122 5.950 11.681 6.822 1.00 0.00 N ATOM 888 CA LEU A 122 5.460 11.563 5.464 1.00 0.00 C ATOM 889 C LEU A 122 4.122 12.248 5.306 1.00 0.00 C ATOM 890 O LEU A 122 3.453 12.089 4.304 1.00 0.00 O ATOM 891 CB LEU A 122 5.400 10.112 4.991 1.00 0.00 C ATOM 892 CG LEU A 122 6.743 9.381 4.876 1.00 0.00 C ATOM 893 CD1 LEU A 122 6.541 8.013 4.262 1.00 0.00 C ATOM 894 CD2 LEU A 122 7.743 10.186 4.056 1.00 0.00 C ATOM 0 H LEU A 122 5.545 11.020 7.485 1.00 0.00 H new ATOM 0 HA LEU A 122 6.179 12.072 4.822 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.764 9.554 5.678 1.00 0.00 H new ATOM 0 HB3 LEU A 122 4.913 10.089 4.016 1.00 0.00 H new ATOM 0 HG LEU A 122 7.151 9.264 5.880 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.501 7.503 4.185 1.00 0.00 H new ATOM 0 HD12 LEU A 122 5.869 7.428 4.890 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.107 8.121 3.268 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.685 9.641 3.993 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.347 10.344 3.053 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.913 11.150 4.535 1.00 0.00 H new ATOM 906 N CYS A 123 3.733 13.006 6.304 1.00 0.00 N ATOM 907 CA CYS A 123 2.535 13.803 6.195 1.00 0.00 C ATOM 908 C CYS A 123 2.764 14.975 5.263 1.00 0.00 C ATOM 909 O CYS A 123 3.502 15.906 5.595 1.00 0.00 O ATOM 910 CB CYS A 123 2.057 14.312 7.557 1.00 0.00 C ATOM 911 SG CYS A 123 1.377 13.039 8.638 1.00 0.00 S ATOM 0 H CYS A 123 4.224 13.087 7.194 1.00 0.00 H new ATOM 0 HA CYS A 123 1.756 13.158 5.787 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.894 14.792 8.065 1.00 0.00 H new ATOM 0 HB3 CYS A 123 1.298 15.078 7.398 1.00 0.00 H new ATOM 0 HG CYS A 123 1.006 13.577 9.762 1.00 0.00 H new ATOM 917 N GLY A 124 2.203 14.880 4.085 1.00 0.00 N ATOM 918 CA GLY A 124 2.231 15.967 3.158 1.00 0.00 C ATOM 919 C GLY A 124 1.006 15.972 2.295 1.00 0.00 C ATOM 920 O GLY A 124 0.081 16.764 2.503 1.00 0.00 O ATOM 0 H GLY A 124 1.718 14.048 3.748 1.00 0.00 H new ATOM 0 HA2 GLY A 124 2.301 16.910 3.700 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.120 15.892 2.532 1.00 0.00 H new ATOM 924 N SER A 125 0.957 15.070 1.389 1.00 0.00 N ATOM 925 CA SER A 125 -0.146 14.973 0.482 1.00 0.00 C ATOM 926 C SER A 125 -0.365 13.498 0.157 1.00 0.00 C ATOM 927 O SER A 125 0.540 12.697 0.306 1.00 0.00 O ATOM 928 CB SER A 125 0.149 15.762 -0.807 1.00 0.00 C ATOM 929 OG SER A 125 0.752 17.040 -0.556 1.00 0.00 O ATOM 0 H SER A 125 1.682 14.367 1.246 1.00 0.00 H new ATOM 0 HA SER A 125 -1.042 15.396 0.937 1.00 0.00 H new ATOM 0 HB2 SER A 125 0.810 15.173 -1.444 1.00 0.00 H new ATOM 0 HB3 SER A 125 -0.780 15.907 -1.359 1.00 0.00 H new ATOM 0 HG SER A 125 1.586 17.114 -1.065 1.00 0.00 H new ATOM 935 N VAL A 126 -1.542 13.136 -0.229 1.00 0.00 N ATOM 936 CA VAL A 126 -1.815 11.780 -0.594 1.00 0.00 C ATOM 937 C VAL A 126 -2.652 11.743 -1.876 1.00 0.00 C ATOM 938 O VAL A 126 -3.538 12.571 -2.078 1.00 0.00 O ATOM 939 CB VAL A 126 -2.517 10.992 0.580 1.00 0.00 C ATOM 940 CG1 VAL A 126 -3.855 11.602 0.971 1.00 0.00 C ATOM 941 CG2 VAL A 126 -2.674 9.508 0.257 1.00 0.00 C ATOM 0 H VAL A 126 -2.341 13.766 -0.301 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.867 11.277 -0.786 1.00 0.00 H new ATOM 0 HB VAL A 126 -1.854 11.081 1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -4.296 11.023 1.782 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.704 12.630 1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.525 11.591 0.111 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -3.161 9.004 1.091 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -3.281 9.393 -0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.692 9.066 0.090 1.00 0.00 H new ATOM 951 N LYS A 127 -2.328 10.845 -2.756 1.00 0.00 N ATOM 952 CA LYS A 127 -3.107 10.646 -3.952 1.00 0.00 C ATOM 953 C LYS A 127 -3.888 9.375 -3.807 1.00 0.00 C ATOM 954 O LYS A 127 -3.344 8.366 -3.370 1.00 0.00 O ATOM 955 CB LYS A 127 -2.249 10.596 -5.232 1.00 0.00 C ATOM 956 CG LYS A 127 -1.782 11.947 -5.756 1.00 0.00 C ATOM 957 CD LYS A 127 -1.214 11.811 -7.167 1.00 0.00 C ATOM 958 CE LYS A 127 -0.984 13.159 -7.832 1.00 0.00 C ATOM 959 NZ LYS A 127 -0.568 13.009 -9.251 1.00 0.00 N ATOM 0 H LYS A 127 -1.520 10.229 -2.671 1.00 0.00 H new ATOM 0 HA LYS A 127 -3.772 11.503 -4.063 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -1.373 9.977 -5.038 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -2.823 10.100 -6.015 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -2.616 12.649 -5.760 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.023 12.358 -5.091 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -0.272 11.264 -7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -1.899 11.221 -7.776 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.898 13.750 -7.782 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -0.218 13.709 -7.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.868 13.846 -9.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.467 12.917 -9.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -1.011 12.159 -9.655 1.00 0.00 H new ATOM 973 N VAL A 128 -5.150 9.419 -4.140 1.00 0.00 N ATOM 974 CA VAL A 128 -6.012 8.264 -3.972 1.00 0.00 C ATOM 975 C VAL A 128 -6.589 7.778 -5.298 1.00 0.00 C ATOM 976 O VAL A 128 -7.169 8.552 -6.077 1.00 0.00 O ATOM 977 CB VAL A 128 -7.156 8.504 -2.933 1.00 0.00 C ATOM 978 CG1 VAL A 128 -6.586 8.738 -1.543 1.00 0.00 C ATOM 979 CG2 VAL A 128 -8.039 9.678 -3.340 1.00 0.00 C ATOM 0 H VAL A 128 -5.611 10.241 -4.531 1.00 0.00 H new ATOM 0 HA VAL A 128 -5.370 7.479 -3.573 1.00 0.00 H new ATOM 0 HB VAL A 128 -7.771 7.604 -2.913 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -7.401 8.902 -0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -6.010 7.866 -1.234 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -5.938 9.614 -1.558 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -8.824 9.818 -2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -7.435 10.583 -3.404 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -8.491 9.474 -4.311 1.00 0.00 H new ATOM 989 N GLY A 129 -6.390 6.519 -5.565 1.00 0.00 N ATOM 990 CA GLY A 129 -6.901 5.927 -6.754 1.00 0.00 C ATOM 991 C GLY A 129 -7.890 4.858 -6.413 1.00 0.00 C ATOM 992 O GLY A 129 -7.514 3.776 -5.933 1.00 0.00 O ATOM 0 H GLY A 129 -5.870 5.881 -4.963 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.376 6.688 -7.373 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -6.084 5.504 -7.339 1.00 0.00 H new ATOM 996 N ILE A 130 -9.139 5.149 -6.620 1.00 0.00 N ATOM 997 CA ILE A 130 -10.183 4.224 -6.290 1.00 0.00 C ATOM 998 C ILE A 130 -10.560 3.430 -7.515 1.00 0.00 C ATOM 999 O ILE A 130 -11.086 3.972 -8.485 1.00 0.00 O ATOM 1000 CB ILE A 130 -11.470 4.904 -5.684 1.00 0.00 C ATOM 1001 CG1 ILE A 130 -11.191 5.627 -4.344 1.00 0.00 C ATOM 1002 CG2 ILE A 130 -12.579 3.877 -5.490 1.00 0.00 C ATOM 1003 CD1 ILE A 130 -10.385 6.907 -4.452 1.00 0.00 C ATOM 0 H ILE A 130 -9.463 6.029 -7.020 1.00 0.00 H new ATOM 0 HA ILE A 130 -9.784 3.574 -5.512 1.00 0.00 H new ATOM 0 HB ILE A 130 -11.788 5.659 -6.404 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -12.145 5.857 -3.869 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -10.663 4.940 -3.683 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.458 4.366 -5.071 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -12.835 3.432 -6.451 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.238 3.098 -4.809 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -10.246 7.334 -3.459 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.412 6.688 -4.893 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -10.917 7.620 -5.082 1.00 0.00 H new ATOM 1015 N VAL A 131 -10.253 2.175 -7.482 1.00 0.00 N ATOM 1016 CA VAL A 131 -10.613 1.289 -8.545 1.00 0.00 C ATOM 1017 C VAL A 131 -11.962 0.676 -8.175 1.00 0.00 C ATOM 1018 O VAL A 131 -12.214 0.389 -6.994 1.00 0.00 O ATOM 1019 CB VAL A 131 -9.512 0.202 -8.784 1.00 0.00 C ATOM 1020 CG1 VAL A 131 -9.279 -0.657 -7.554 1.00 0.00 C ATOM 1021 CG2 VAL A 131 -9.823 -0.655 -10.005 1.00 0.00 C ATOM 0 H VAL A 131 -9.745 1.732 -6.717 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.694 1.828 -9.489 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.583 0.737 -8.983 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -8.507 -1.396 -7.768 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.958 -0.026 -6.725 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -10.205 -1.166 -7.285 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.036 -1.398 -10.138 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -10.778 -1.160 -9.861 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.877 -0.021 -10.890 1.00 0.00 H new ATOM 1031 N GLU A 132 -12.839 0.536 -9.130 1.00 0.00 N ATOM 1032 CA GLU A 132 -14.162 0.040 -8.840 1.00 0.00 C ATOM 1033 C GLU A 132 -14.131 -1.463 -8.575 1.00 0.00 C ATOM 1034 O GLU A 132 -14.776 -1.952 -7.631 1.00 0.00 O ATOM 1035 CB GLU A 132 -15.146 0.432 -9.936 1.00 0.00 C ATOM 1036 CG GLU A 132 -15.179 1.932 -10.175 1.00 0.00 C ATOM 1037 CD GLU A 132 -16.264 2.364 -11.113 1.00 0.00 C ATOM 1038 OE1 GLU A 132 -16.106 2.227 -12.344 1.00 0.00 O ATOM 1039 OE2 GLU A 132 -17.279 2.889 -10.646 1.00 0.00 O ATOM 0 H GLU A 132 -12.667 0.756 -10.111 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.520 0.510 -7.924 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.875 -0.075 -10.862 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -16.144 0.088 -9.665 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -15.311 2.441 -9.220 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.216 2.249 -10.575 1.00 0.00 H new ATOM 1046 N GLU A 133 -13.407 -2.190 -9.406 1.00 0.00 N ATOM 1047 CA GLU A 133 -13.166 -3.593 -9.175 1.00 0.00 C ATOM 1048 C GLU A 133 -12.138 -3.718 -8.062 1.00 0.00 C ATOM 1049 O GLU A 133 -10.995 -3.334 -8.235 1.00 0.00 O ATOM 1050 CB GLU A 133 -12.624 -4.308 -10.432 1.00 0.00 C ATOM 1051 CG GLU A 133 -13.452 -4.139 -11.692 1.00 0.00 C ATOM 1052 CD GLU A 133 -13.207 -2.832 -12.388 1.00 0.00 C ATOM 1053 OE1 GLU A 133 -12.279 -2.747 -13.189 1.00 0.00 O ATOM 1054 OE2 GLU A 133 -13.942 -1.858 -12.136 1.00 0.00 O ATOM 0 H GLU A 133 -12.974 -1.823 -10.253 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.112 -4.064 -8.909 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -11.616 -3.943 -10.630 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.540 -5.373 -10.214 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.229 -4.956 -12.378 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.509 -4.216 -11.438 1.00 0.00 H new ATOM 1061 N PRO A 134 -12.512 -4.264 -6.919 1.00 0.00 N ATOM 1062 CA PRO A 134 -11.621 -4.371 -5.776 1.00 0.00 C ATOM 1063 C PRO A 134 -10.812 -5.671 -5.806 1.00 0.00 C ATOM 1064 O PRO A 134 -10.526 -6.271 -4.766 1.00 0.00 O ATOM 1065 CB PRO A 134 -12.605 -4.374 -4.614 1.00 0.00 C ATOM 1066 CG PRO A 134 -13.814 -5.072 -5.141 1.00 0.00 C ATOM 1067 CD PRO A 134 -13.835 -4.849 -6.632 1.00 0.00 C ATOM 0 HA PRO A 134 -10.875 -3.578 -5.732 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -12.194 -4.894 -3.749 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -12.842 -3.359 -4.294 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -13.776 -6.137 -4.911 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -14.719 -4.678 -4.679 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -13.986 -5.783 -7.174 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -14.642 -4.177 -6.925 1.00 0.00 H new ATOM 1075 N ASP A 135 -10.407 -6.069 -6.990 1.00 0.00 N ATOM 1076 CA ASP A 135 -9.676 -7.309 -7.165 1.00 0.00 C ATOM 1077 C ASP A 135 -8.260 -7.122 -6.659 1.00 0.00 C ATOM 1078 O ASP A 135 -7.617 -6.123 -6.972 1.00 0.00 O ATOM 1079 CB ASP A 135 -9.635 -7.719 -8.632 1.00 0.00 C ATOM 1080 CG ASP A 135 -9.159 -9.137 -8.799 1.00 0.00 C ATOM 1081 OD1 ASP A 135 -7.941 -9.360 -8.905 1.00 0.00 O ATOM 1082 OD2 ASP A 135 -10.002 -10.063 -8.825 1.00 0.00 O ATOM 0 H ASP A 135 -10.571 -5.550 -7.853 1.00 0.00 H new ATOM 0 HA ASP A 135 -10.182 -8.094 -6.603 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -10.629 -7.615 -9.067 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -8.975 -7.046 -9.180 1.00 0.00 H new ATOM 1087 N LYS A 136 -7.766 -8.074 -5.901 1.00 0.00 N ATOM 1088 CA LYS A 136 -6.441 -7.971 -5.305 1.00 0.00 C ATOM 1089 C LYS A 136 -5.344 -7.848 -6.372 1.00 0.00 C ATOM 1090 O LYS A 136 -4.319 -7.175 -6.147 1.00 0.00 O ATOM 1091 CB LYS A 136 -6.164 -9.165 -4.388 1.00 0.00 C ATOM 1092 CG LYS A 136 -4.915 -9.024 -3.517 1.00 0.00 C ATOM 1093 CD LYS A 136 -5.059 -7.869 -2.524 1.00 0.00 C ATOM 1094 CE LYS A 136 -3.838 -7.724 -1.627 1.00 0.00 C ATOM 1095 NZ LYS A 136 -3.568 -8.943 -0.831 1.00 0.00 N ATOM 0 H LYS A 136 -8.261 -8.937 -5.678 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.424 -7.060 -4.707 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -7.027 -9.316 -3.740 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -6.064 -10.061 -5.001 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -4.740 -9.953 -2.975 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -4.044 -8.856 -4.150 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -5.218 -6.940 -3.071 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -5.943 -8.031 -1.907 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -2.967 -7.495 -2.240 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -3.985 -6.880 -0.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -2.863 -8.729 -0.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -4.448 -9.266 -0.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.203 -9.691 -1.455 1.00 0.00 H new ATOM 1109 N ALA A 137 -5.574 -8.433 -7.538 1.00 0.00 N ATOM 1110 CA ALA A 137 -4.589 -8.393 -8.592 1.00 0.00 C ATOM 1111 C ALA A 137 -4.547 -7.019 -9.207 1.00 0.00 C ATOM 1112 O ALA A 137 -3.474 -6.476 -9.426 1.00 0.00 O ATOM 1113 CB ALA A 137 -4.860 -9.439 -9.649 1.00 0.00 C ATOM 0 H ALA A 137 -6.430 -8.936 -7.771 1.00 0.00 H new ATOM 0 HA ALA A 137 -3.617 -8.618 -8.152 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -4.097 -9.378 -10.425 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -4.837 -10.430 -9.195 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -5.842 -9.265 -10.090 1.00 0.00 H new ATOM 1119 N VAL A 138 -5.718 -6.420 -9.422 1.00 0.00 N ATOM 1120 CA VAL A 138 -5.773 -5.094 -10.023 1.00 0.00 C ATOM 1121 C VAL A 138 -5.229 -4.051 -9.038 1.00 0.00 C ATOM 1122 O VAL A 138 -4.605 -3.071 -9.443 1.00 0.00 O ATOM 1123 CB VAL A 138 -7.198 -4.701 -10.558 1.00 0.00 C ATOM 1124 CG1 VAL A 138 -7.737 -5.741 -11.525 1.00 0.00 C ATOM 1125 CG2 VAL A 138 -8.190 -4.421 -9.446 1.00 0.00 C ATOM 0 H VAL A 138 -6.625 -6.826 -9.193 1.00 0.00 H new ATOM 0 HA VAL A 138 -5.136 -5.118 -10.907 1.00 0.00 H new ATOM 0 HB VAL A 138 -7.070 -3.766 -11.103 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.724 -5.436 -11.874 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -7.062 -5.831 -12.376 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.813 -6.704 -11.019 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.155 -4.155 -9.878 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.302 -5.311 -8.826 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.827 -3.596 -8.834 1.00 0.00 H new ATOM 1135 N LEU A 139 -5.423 -4.314 -7.737 1.00 0.00 N ATOM 1136 CA LEU A 139 -4.882 -3.465 -6.682 1.00 0.00 C ATOM 1137 C LEU A 139 -3.361 -3.498 -6.717 1.00 0.00 C ATOM 1138 O LEU A 139 -2.709 -2.456 -6.738 1.00 0.00 O ATOM 1139 CB LEU A 139 -5.371 -3.919 -5.288 1.00 0.00 C ATOM 1140 CG LEU A 139 -6.872 -3.791 -4.991 1.00 0.00 C ATOM 1141 CD1 LEU A 139 -7.185 -4.332 -3.604 1.00 0.00 C ATOM 1142 CD2 LEU A 139 -7.312 -2.345 -5.088 1.00 0.00 C ATOM 0 H LEU A 139 -5.955 -5.115 -7.396 1.00 0.00 H new ATOM 0 HA LEU A 139 -5.235 -2.449 -6.858 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -5.089 -4.964 -5.156 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -4.829 -3.345 -4.537 1.00 0.00 H new ATOM 0 HG LEU A 139 -7.417 -4.375 -5.732 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -8.253 -4.234 -3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -6.901 -5.383 -3.551 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -6.626 -3.767 -2.858 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.379 -2.274 -4.874 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -6.757 -1.746 -4.366 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -7.118 -1.972 -6.094 1.00 0.00 H new ATOM 1154 N THR A 140 -2.810 -4.698 -6.776 1.00 0.00 N ATOM 1155 CA THR A 140 -1.371 -4.879 -6.782 1.00 0.00 C ATOM 1156 C THR A 140 -0.770 -4.351 -8.096 1.00 0.00 C ATOM 1157 O THR A 140 0.334 -3.802 -8.119 1.00 0.00 O ATOM 1158 CB THR A 140 -1.014 -6.367 -6.592 1.00 0.00 C ATOM 1159 OG1 THR A 140 -1.717 -6.883 -5.434 1.00 0.00 O ATOM 1160 CG2 THR A 140 0.488 -6.544 -6.381 1.00 0.00 C ATOM 0 H THR A 140 -3.343 -5.567 -6.821 1.00 0.00 H new ATOM 0 HA THR A 140 -0.949 -4.312 -5.952 1.00 0.00 H new ATOM 0 HB THR A 140 -1.309 -6.911 -7.490 1.00 0.00 H new ATOM 0 HG1 THR A 140 -2.628 -7.136 -5.690 1.00 0.00 H new ATOM 0 HG21 THR A 140 0.715 -7.602 -6.249 1.00 0.00 H new ATOM 0 HG22 THR A 140 1.025 -6.163 -7.250 1.00 0.00 H new ATOM 0 HG23 THR A 140 0.798 -5.993 -5.493 1.00 0.00 H new ATOM 1168 N GLN A 141 -1.523 -4.500 -9.171 1.00 0.00 N ATOM 1169 CA GLN A 141 -1.120 -4.027 -10.476 1.00 0.00 C ATOM 1170 C GLN A 141 -0.973 -2.511 -10.460 1.00 0.00 C ATOM 1171 O GLN A 141 0.063 -1.984 -10.855 1.00 0.00 O ATOM 1172 CB GLN A 141 -2.146 -4.453 -11.517 1.00 0.00 C ATOM 1173 CG GLN A 141 -1.795 -4.077 -12.936 1.00 0.00 C ATOM 1174 CD GLN A 141 -2.858 -4.509 -13.908 1.00 0.00 C ATOM 1175 OE1 GLN A 141 -2.817 -5.624 -14.435 1.00 0.00 O ATOM 1176 NE2 GLN A 141 -3.820 -3.656 -14.151 1.00 0.00 N ATOM 0 H GLN A 141 -2.436 -4.955 -9.159 1.00 0.00 H new ATOM 0 HA GLN A 141 -0.156 -4.464 -10.735 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -2.272 -5.534 -11.462 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -3.108 -4.007 -11.264 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.659 -2.998 -13.003 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.845 -4.536 -13.209 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -3.819 -2.743 -13.696 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -4.571 -3.904 -14.796 1.00 0.00 H new ATOM 1185 N ALA A 142 -1.995 -1.826 -9.957 1.00 0.00 N ATOM 1186 CA ALA A 142 -1.983 -0.369 -9.870 1.00 0.00 C ATOM 1187 C ALA A 142 -0.849 0.097 -8.965 1.00 0.00 C ATOM 1188 O ALA A 142 -0.151 1.056 -9.282 1.00 0.00 O ATOM 1189 CB ALA A 142 -3.322 0.147 -9.366 1.00 0.00 C ATOM 0 H ALA A 142 -2.847 -2.259 -9.601 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.817 0.038 -10.867 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -3.294 1.235 -9.308 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -4.112 -0.159 -10.052 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -3.521 -0.264 -8.376 1.00 0.00 H new ATOM 1195 N TRP A 143 -0.661 -0.624 -7.862 1.00 0.00 N ATOM 1196 CA TRP A 143 0.420 -0.366 -6.912 1.00 0.00 C ATOM 1197 C TRP A 143 1.772 -0.403 -7.634 1.00 0.00 C ATOM 1198 O TRP A 143 2.601 0.503 -7.478 1.00 0.00 O ATOM 1199 CB TRP A 143 0.377 -1.432 -5.791 1.00 0.00 C ATOM 1200 CG TRP A 143 1.460 -1.308 -4.753 1.00 0.00 C ATOM 1201 CD1 TRP A 143 1.434 -0.537 -3.631 1.00 0.00 C ATOM 1202 CD2 TRP A 143 2.721 -1.999 -4.738 1.00 0.00 C ATOM 1203 NE1 TRP A 143 2.620 -0.673 -2.939 1.00 0.00 N ATOM 1204 CE2 TRP A 143 3.417 -1.572 -3.594 1.00 0.00 C ATOM 1205 CE3 TRP A 143 3.329 -2.928 -5.588 1.00 0.00 C ATOM 1206 CZ2 TRP A 143 4.688 -2.041 -3.278 1.00 0.00 C ATOM 1207 CZ3 TRP A 143 4.590 -3.393 -5.270 1.00 0.00 C ATOM 1208 CH2 TRP A 143 5.254 -2.950 -4.125 1.00 0.00 C ATOM 0 H TRP A 143 -1.258 -1.409 -7.600 1.00 0.00 H new ATOM 0 HA TRP A 143 0.292 0.623 -6.471 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -0.591 -1.375 -5.293 1.00 0.00 H new ATOM 0 HB3 TRP A 143 0.443 -2.420 -6.247 1.00 0.00 H new ATOM 0 HD1 TRP A 143 0.607 0.088 -3.328 1.00 0.00 H new ATOM 0 HE1 TRP A 143 2.863 -0.183 -2.078 1.00 0.00 H new ATOM 0 HE3 TRP A 143 2.822 -3.275 -6.476 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 5.208 -1.699 -2.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 5.070 -4.111 -5.918 1.00 0.00 H new ATOM 0 HH2 TRP A 143 6.238 -3.335 -3.904 1.00 0.00 H new ATOM 1219 N LYS A 144 1.955 -1.439 -8.443 1.00 0.00 N ATOM 1220 CA LYS A 144 3.177 -1.655 -9.202 1.00 0.00 C ATOM 1221 C LYS A 144 3.415 -0.521 -10.192 1.00 0.00 C ATOM 1222 O LYS A 144 4.536 -0.033 -10.329 1.00 0.00 O ATOM 1223 CB LYS A 144 3.108 -2.999 -9.943 1.00 0.00 C ATOM 1224 CG LYS A 144 4.359 -3.347 -10.731 1.00 0.00 C ATOM 1225 CD LYS A 144 4.212 -4.682 -11.434 1.00 0.00 C ATOM 1226 CE LYS A 144 5.476 -5.064 -12.194 1.00 0.00 C ATOM 1227 NZ LYS A 144 5.795 -4.115 -13.289 1.00 0.00 N ATOM 0 H LYS A 144 1.250 -2.161 -8.591 1.00 0.00 H new ATOM 0 HA LYS A 144 4.013 -1.675 -8.502 1.00 0.00 H new ATOM 0 HB2 LYS A 144 2.918 -3.790 -9.218 1.00 0.00 H new ATOM 0 HB3 LYS A 144 2.258 -2.981 -10.625 1.00 0.00 H new ATOM 0 HG2 LYS A 144 4.558 -2.567 -11.465 1.00 0.00 H new ATOM 0 HG3 LYS A 144 5.217 -3.379 -10.060 1.00 0.00 H new ATOM 0 HD2 LYS A 144 3.981 -5.455 -10.701 1.00 0.00 H new ATOM 0 HD3 LYS A 144 3.371 -4.638 -12.126 1.00 0.00 H new ATOM 0 HE2 LYS A 144 6.314 -5.105 -11.499 1.00 0.00 H new ATOM 0 HE3 LYS A 144 5.357 -6.065 -12.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 6.333 -4.608 -14.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 4.912 -3.742 -13.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 6.363 -3.329 -12.913 1.00 0.00 H new ATOM 1241 N LEU A 145 2.358 -0.100 -10.856 1.00 0.00 N ATOM 1242 CA LEU A 145 2.439 0.972 -11.830 1.00 0.00 C ATOM 1243 C LEU A 145 2.869 2.266 -11.137 1.00 0.00 C ATOM 1244 O LEU A 145 3.858 2.896 -11.519 1.00 0.00 O ATOM 1245 CB LEU A 145 1.080 1.169 -12.532 1.00 0.00 C ATOM 1246 CG LEU A 145 0.465 -0.075 -13.204 1.00 0.00 C ATOM 1247 CD1 LEU A 145 -0.863 0.245 -13.848 1.00 0.00 C ATOM 1248 CD2 LEU A 145 1.407 -0.677 -14.219 1.00 0.00 C ATOM 0 H LEU A 145 1.422 -0.488 -10.737 1.00 0.00 H new ATOM 0 HA LEU A 145 3.179 0.707 -12.585 1.00 0.00 H new ATOM 0 HB2 LEU A 145 0.368 1.547 -11.798 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.197 1.943 -13.290 1.00 0.00 H new ATOM 0 HG LEU A 145 0.295 -0.811 -12.418 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.268 -0.654 -14.312 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -1.557 0.606 -13.090 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -0.723 1.014 -14.608 1.00 0.00 H new ATOM 0 HD21 LEU A 145 0.942 -1.552 -14.673 1.00 0.00 H new ATOM 0 HD22 LEU A 145 1.628 0.059 -14.992 1.00 0.00 H new ATOM 0 HD23 LEU A 145 2.333 -0.974 -13.725 1.00 0.00 H new ATOM 1260 N TRP A 146 2.151 2.602 -10.081 1.00 0.00 N ATOM 1261 CA TRP A 146 2.386 3.805 -9.297 1.00 0.00 C ATOM 1262 C TRP A 146 3.803 3.897 -8.742 1.00 0.00 C ATOM 1263 O TRP A 146 4.464 4.953 -8.876 1.00 0.00 O ATOM 1264 CB TRP A 146 1.381 3.901 -8.159 1.00 0.00 C ATOM 1265 CG TRP A 146 -0.006 4.303 -8.572 1.00 0.00 C ATOM 1266 CD1 TRP A 146 -0.580 4.224 -9.816 1.00 0.00 C ATOM 1267 CD2 TRP A 146 -0.989 4.862 -7.719 1.00 0.00 C ATOM 1268 NE1 TRP A 146 -1.859 4.700 -9.769 1.00 0.00 N ATOM 1269 CE2 TRP A 146 -2.134 5.098 -8.491 1.00 0.00 C ATOM 1270 CE3 TRP A 146 -1.009 5.186 -6.368 1.00 0.00 C ATOM 1271 CZ2 TRP A 146 -3.284 5.649 -7.952 1.00 0.00 C ATOM 1272 CZ3 TRP A 146 -2.149 5.732 -5.838 1.00 0.00 C ATOM 1273 CH2 TRP A 146 -3.271 5.958 -6.625 1.00 0.00 C ATOM 0 H TRP A 146 1.374 2.038 -9.736 1.00 0.00 H new ATOM 0 HA TRP A 146 2.258 4.644 -9.981 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.329 2.935 -7.657 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.750 4.621 -7.428 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -0.093 3.842 -10.701 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -2.503 4.750 -10.558 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -0.143 5.011 -5.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -4.158 5.827 -8.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -2.175 5.991 -4.790 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -4.153 6.388 -6.175 1.00 0.00 H new ATOM 1284 N ILE A 147 4.284 2.813 -8.129 1.00 0.00 N ATOM 1285 CA ILE A 147 5.615 2.823 -7.546 1.00 0.00 C ATOM 1286 C ILE A 147 6.679 3.020 -8.631 1.00 0.00 C ATOM 1287 O ILE A 147 7.570 3.874 -8.488 1.00 0.00 O ATOM 1288 CB ILE A 147 5.925 1.560 -6.648 1.00 0.00 C ATOM 1289 CG1 ILE A 147 7.319 1.673 -6.005 1.00 0.00 C ATOM 1290 CG2 ILE A 147 5.799 0.253 -7.424 1.00 0.00 C ATOM 1291 CD1 ILE A 147 7.697 0.499 -5.120 1.00 0.00 C ATOM 0 H ILE A 147 3.777 1.934 -8.027 1.00 0.00 H new ATOM 0 HA ILE A 147 5.647 3.674 -6.866 1.00 0.00 H new ATOM 0 HB ILE A 147 5.174 1.541 -5.858 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.063 1.772 -6.795 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.360 2.587 -5.413 1.00 0.00 H new ATOM 0 HG21 ILE A 147 6.022 -0.585 -6.764 1.00 0.00 H new ATOM 0 HG22 ILE A 147 4.783 0.154 -7.807 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.502 0.255 -8.257 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.693 0.660 -4.708 1.00 0.00 H new ATOM 0 HD12 ILE A 147 6.977 0.410 -4.306 1.00 0.00 H new ATOM 0 HD13 ILE A 147 7.692 -0.418 -5.710 1.00 0.00 H new ATOM 1303 N GLU A 148 6.525 2.314 -9.752 1.00 0.00 N ATOM 1304 CA GLU A 148 7.485 2.388 -10.832 1.00 0.00 C ATOM 1305 C GLU A 148 7.543 3.740 -11.488 1.00 0.00 C ATOM 1306 O GLU A 148 8.598 4.128 -12.008 1.00 0.00 O ATOM 1307 CB GLU A 148 7.286 1.306 -11.870 1.00 0.00 C ATOM 1308 CG GLU A 148 7.714 -0.065 -11.413 1.00 0.00 C ATOM 1309 CD GLU A 148 7.574 -1.082 -12.496 1.00 0.00 C ATOM 1310 OE1 GLU A 148 8.488 -1.216 -13.347 1.00 0.00 O ATOM 1311 OE2 GLU A 148 6.559 -1.757 -12.550 1.00 0.00 O ATOM 0 H GLU A 148 5.740 1.686 -9.927 1.00 0.00 H new ATOM 0 HA GLU A 148 8.449 2.219 -10.353 1.00 0.00 H new ATOM 0 HB2 GLU A 148 6.233 1.273 -12.149 1.00 0.00 H new ATOM 0 HB3 GLU A 148 7.845 1.570 -12.768 1.00 0.00 H new ATOM 0 HG2 GLU A 148 8.751 -0.029 -11.081 1.00 0.00 H new ATOM 0 HG3 GLU A 148 7.114 -0.365 -10.554 1.00 0.00 H new ATOM 1318 N GLU A 149 6.441 4.464 -11.503 1.00 0.00 N ATOM 1319 CA GLU A 149 6.457 5.798 -12.084 1.00 0.00 C ATOM 1320 C GLU A 149 7.364 6.701 -11.281 1.00 0.00 C ATOM 1321 O GLU A 149 8.178 7.438 -11.834 1.00 0.00 O ATOM 1322 CB GLU A 149 5.061 6.400 -12.219 1.00 0.00 C ATOM 1323 CG GLU A 149 4.125 5.563 -13.068 1.00 0.00 C ATOM 1324 CD GLU A 149 4.755 5.158 -14.384 1.00 0.00 C ATOM 1325 OE1 GLU A 149 4.651 5.911 -15.364 1.00 0.00 O ATOM 1326 OE2 GLU A 149 5.374 4.083 -14.454 1.00 0.00 O ATOM 0 H GLU A 149 5.541 4.163 -11.129 1.00 0.00 H new ATOM 0 HA GLU A 149 6.848 5.707 -13.097 1.00 0.00 H new ATOM 0 HB2 GLU A 149 4.628 6.522 -11.226 1.00 0.00 H new ATOM 0 HB3 GLU A 149 5.143 7.396 -12.655 1.00 0.00 H new ATOM 0 HG2 GLU A 149 3.837 4.669 -12.515 1.00 0.00 H new ATOM 0 HG3 GLU A 149 3.212 6.126 -13.262 1.00 0.00 H new ATOM 1333 N HIS A 150 7.290 6.589 -9.974 1.00 0.00 N ATOM 1334 CA HIS A 150 8.154 7.387 -9.144 1.00 0.00 C ATOM 1335 C HIS A 150 9.560 6.865 -9.095 1.00 0.00 C ATOM 1336 O HIS A 150 10.489 7.643 -8.965 1.00 0.00 O ATOM 1337 CB HIS A 150 7.570 7.725 -7.787 1.00 0.00 C ATOM 1338 CG HIS A 150 6.564 8.831 -7.885 1.00 0.00 C ATOM 1339 ND1 HIS A 150 6.871 10.167 -7.692 1.00 0.00 N ATOM 1340 CD2 HIS A 150 5.251 8.797 -8.172 1.00 0.00 C ATOM 1341 CE1 HIS A 150 5.784 10.885 -7.859 1.00 0.00 C ATOM 1342 NE2 HIS A 150 4.791 10.084 -8.149 1.00 0.00 N ATOM 0 H HIS A 150 6.655 5.967 -9.474 1.00 0.00 H new ATOM 0 HA HIS A 150 8.223 8.353 -9.644 1.00 0.00 H new ATOM 0 HB2 HIS A 150 7.099 6.839 -7.361 1.00 0.00 H new ATOM 0 HB3 HIS A 150 8.370 8.018 -7.108 1.00 0.00 H new ATOM 0 HD1 HIS A 150 7.793 10.535 -7.458 1.00 0.00 H new ATOM 0 HD2 HIS A 150 4.666 7.914 -8.382 1.00 0.00 H new ATOM 0 HE1 HIS A 150 5.720 11.960 -7.771 1.00 0.00 H new ATOM 1351 N ILE A 151 9.725 5.561 -9.235 1.00 0.00 N ATOM 1352 CA ILE A 151 11.064 4.981 -9.379 1.00 0.00 C ATOM 1353 C ILE A 151 11.758 5.598 -10.607 1.00 0.00 C ATOM 1354 O ILE A 151 12.935 5.911 -10.574 1.00 0.00 O ATOM 1355 CB ILE A 151 11.035 3.420 -9.512 1.00 0.00 C ATOM 1356 CG1 ILE A 151 10.499 2.781 -8.223 1.00 0.00 C ATOM 1357 CG2 ILE A 151 12.428 2.865 -9.839 1.00 0.00 C ATOM 1358 CD1 ILE A 151 10.394 1.264 -8.272 1.00 0.00 C ATOM 0 H ILE A 151 8.962 4.884 -9.253 1.00 0.00 H new ATOM 0 HA ILE A 151 11.621 5.212 -8.471 1.00 0.00 H new ATOM 0 HB ILE A 151 10.367 3.167 -10.335 1.00 0.00 H new ATOM 0 HG12 ILE A 151 11.149 3.062 -7.395 1.00 0.00 H new ATOM 0 HG13 ILE A 151 9.514 3.195 -8.009 1.00 0.00 H new ATOM 0 HG21 ILE A 151 12.376 1.780 -9.925 1.00 0.00 H new ATOM 0 HG22 ILE A 151 12.776 3.288 -10.782 1.00 0.00 H new ATOM 0 HG23 ILE A 151 13.123 3.133 -9.043 1.00 0.00 H new ATOM 0 HD11 ILE A 151 10.007 0.895 -7.322 1.00 0.00 H new ATOM 0 HD12 ILE A 151 9.719 0.972 -9.077 1.00 0.00 H new ATOM 0 HD13 ILE A 151 11.380 0.837 -8.453 1.00 0.00 H new ATOM 1370 N LYS A 152 10.998 5.826 -11.653 1.00 0.00 N ATOM 1371 CA LYS A 152 11.544 6.409 -12.863 1.00 0.00 C ATOM 1372 C LYS A 152 11.737 7.932 -12.772 1.00 0.00 C ATOM 1373 O LYS A 152 12.811 8.433 -13.071 1.00 0.00 O ATOM 1374 CB LYS A 152 10.711 6.032 -14.096 1.00 0.00 C ATOM 1375 CG LYS A 152 10.754 4.540 -14.433 1.00 0.00 C ATOM 1376 CD LYS A 152 10.012 4.218 -15.731 1.00 0.00 C ATOM 1377 CE LYS A 152 8.502 4.391 -15.611 1.00 0.00 C ATOM 1378 NZ LYS A 152 7.906 3.412 -14.689 1.00 0.00 N ATOM 0 H LYS A 152 10.000 5.618 -11.693 1.00 0.00 H new ATOM 0 HA LYS A 152 12.539 5.979 -12.976 1.00 0.00 H new ATOM 0 HB2 LYS A 152 9.675 6.328 -13.929 1.00 0.00 H new ATOM 0 HB3 LYS A 152 11.070 6.600 -14.954 1.00 0.00 H new ATOM 0 HG2 LYS A 152 11.792 4.219 -14.521 1.00 0.00 H new ATOM 0 HG3 LYS A 152 10.313 3.972 -13.614 1.00 0.00 H new ATOM 0 HD2 LYS A 152 10.384 4.864 -16.526 1.00 0.00 H new ATOM 0 HD3 LYS A 152 10.233 3.192 -16.025 1.00 0.00 H new ATOM 0 HE2 LYS A 152 8.279 5.399 -15.262 1.00 0.00 H new ATOM 0 HE3 LYS A 152 8.046 4.286 -16.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 6.869 3.486 -14.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 8.195 2.452 -14.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 8.232 3.604 -13.720 1.00 0.00 H new ATOM 1392 N VAL A 153 10.719 8.663 -12.344 1.00 0.00 N ATOM 1393 CA VAL A 153 10.809 10.134 -12.351 1.00 0.00 C ATOM 1394 C VAL A 153 11.620 10.733 -11.183 1.00 0.00 C ATOM 1395 O VAL A 153 12.073 11.873 -11.262 1.00 0.00 O ATOM 1396 CB VAL A 153 9.426 10.834 -12.461 1.00 0.00 C ATOM 1397 CG1 VAL A 153 8.706 10.399 -13.728 1.00 0.00 C ATOM 1398 CG2 VAL A 153 8.560 10.576 -11.236 1.00 0.00 C ATOM 0 H VAL A 153 9.839 8.285 -11.994 1.00 0.00 H new ATOM 0 HA VAL A 153 11.370 10.344 -13.262 1.00 0.00 H new ATOM 0 HB VAL A 153 9.607 11.908 -12.511 1.00 0.00 H new ATOM 0 HG11 VAL A 153 7.740 10.900 -13.787 1.00 0.00 H new ATOM 0 HG12 VAL A 153 9.307 10.665 -14.598 1.00 0.00 H new ATOM 0 HG13 VAL A 153 8.555 9.320 -13.708 1.00 0.00 H new ATOM 0 HG21 VAL A 153 7.602 11.083 -11.354 1.00 0.00 H new ATOM 0 HG22 VAL A 153 8.392 9.504 -11.128 1.00 0.00 H new ATOM 0 HG23 VAL A 153 9.064 10.955 -10.347 1.00 0.00 H new ATOM 1408 N THR A 154 11.787 9.995 -10.108 1.00 0.00 N ATOM 1409 CA THR A 154 12.542 10.518 -8.979 1.00 0.00 C ATOM 1410 C THR A 154 13.492 9.459 -8.366 1.00 0.00 C ATOM 1411 O THR A 154 14.565 9.788 -7.856 1.00 0.00 O ATOM 1412 CB THR A 154 11.608 11.194 -7.898 1.00 0.00 C ATOM 1413 OG1 THR A 154 12.364 11.661 -6.786 1.00 0.00 O ATOM 1414 CG2 THR A 154 10.531 10.251 -7.404 1.00 0.00 C ATOM 0 H THR A 154 11.421 9.051 -9.987 1.00 0.00 H new ATOM 0 HA THR A 154 13.181 11.310 -9.370 1.00 0.00 H new ATOM 0 HB THR A 154 11.128 12.038 -8.393 1.00 0.00 H new ATOM 0 HG1 THR A 154 11.976 12.498 -6.455 1.00 0.00 H new ATOM 0 HG21 THR A 154 9.914 10.759 -6.663 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.908 9.939 -8.242 1.00 0.00 H new ATOM 0 HG23 THR A 154 10.995 9.375 -6.951 1.00 0.00 H new ATOM 1422 N GLY A 155 13.109 8.198 -8.427 1.00 0.00 N ATOM 1423 CA GLY A 155 13.956 7.139 -7.905 1.00 0.00 C ATOM 1424 C GLY A 155 13.696 6.876 -6.449 1.00 0.00 C ATOM 1425 O GLY A 155 14.444 6.152 -5.788 1.00 0.00 O ATOM 0 H GLY A 155 12.226 7.882 -8.828 1.00 0.00 H new ATOM 0 HA2 GLY A 155 13.786 6.225 -8.474 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.003 7.411 -8.043 1.00 0.00 H new ATOM 1429 N LYS A 156 12.632 7.447 -5.946 1.00 0.00 N ATOM 1430 CA LYS A 156 12.303 7.311 -4.556 1.00 0.00 C ATOM 1431 C LYS A 156 11.568 6.022 -4.310 1.00 0.00 C ATOM 1432 O LYS A 156 10.401 5.871 -4.673 1.00 0.00 O ATOM 1433 CB LYS A 156 11.492 8.503 -4.042 1.00 0.00 C ATOM 1434 CG LYS A 156 12.174 9.848 -4.214 1.00 0.00 C ATOM 1435 CD LYS A 156 13.491 9.929 -3.465 1.00 0.00 C ATOM 1436 CE LYS A 156 14.224 11.218 -3.791 1.00 0.00 C ATOM 1437 NZ LYS A 156 14.567 11.309 -5.225 1.00 0.00 N ATOM 0 H LYS A 156 11.977 8.013 -6.485 1.00 0.00 H new ATOM 0 HA LYS A 156 13.240 7.291 -3.999 1.00 0.00 H new ATOM 0 HB2 LYS A 156 10.534 8.526 -4.562 1.00 0.00 H new ATOM 0 HB3 LYS A 156 11.277 8.351 -2.984 1.00 0.00 H new ATOM 0 HG2 LYS A 156 12.350 10.030 -5.274 1.00 0.00 H new ATOM 0 HG3 LYS A 156 11.510 10.637 -3.861 1.00 0.00 H new ATOM 0 HD2 LYS A 156 13.307 9.872 -2.392 1.00 0.00 H new ATOM 0 HD3 LYS A 156 14.116 9.075 -3.727 1.00 0.00 H new ATOM 0 HE2 LYS A 156 13.603 12.069 -3.511 1.00 0.00 H new ATOM 0 HE3 LYS A 156 15.135 11.278 -3.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 15.322 12.011 -5.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 14.894 10.381 -5.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 13.727 11.598 -5.765 1.00 0.00 H new ATOM 1451 N VAL A 157 12.279 5.090 -3.763 1.00 0.00 N ATOM 1452 CA VAL A 157 11.734 3.826 -3.361 1.00 0.00 C ATOM 1453 C VAL A 157 12.366 3.402 -2.017 1.00 0.00 C ATOM 1454 O VAL A 157 13.320 2.615 -1.952 1.00 0.00 O ATOM 1455 CB VAL A 157 11.832 2.724 -4.481 1.00 0.00 C ATOM 1456 CG1 VAL A 157 13.253 2.556 -5.013 1.00 0.00 C ATOM 1457 CG2 VAL A 157 11.264 1.390 -4.002 1.00 0.00 C ATOM 0 H VAL A 157 13.278 5.185 -3.577 1.00 0.00 H new ATOM 0 HA VAL A 157 10.661 3.943 -3.208 1.00 0.00 H new ATOM 0 HB VAL A 157 11.221 3.073 -5.313 1.00 0.00 H new ATOM 0 HG11 VAL A 157 13.264 1.784 -5.783 1.00 0.00 H new ATOM 0 HG12 VAL A 157 13.596 3.499 -5.439 1.00 0.00 H new ATOM 0 HG13 VAL A 157 13.915 2.265 -4.197 1.00 0.00 H new ATOM 0 HG21 VAL A 157 11.347 0.652 -4.800 1.00 0.00 H new ATOM 0 HG22 VAL A 157 11.823 1.048 -3.131 1.00 0.00 H new ATOM 0 HG23 VAL A 157 10.215 1.517 -3.733 1.00 0.00 H new ATOM 1467 N PRO A 158 11.909 4.035 -0.931 1.00 0.00 N ATOM 1468 CA PRO A 158 12.407 3.774 0.413 1.00 0.00 C ATOM 1469 C PRO A 158 11.910 2.429 0.970 1.00 0.00 C ATOM 1470 O PRO A 158 10.892 1.882 0.497 1.00 0.00 O ATOM 1471 CB PRO A 158 11.835 4.947 1.242 1.00 0.00 C ATOM 1472 CG PRO A 158 11.327 5.914 0.237 1.00 0.00 C ATOM 1473 CD PRO A 158 10.889 5.080 -0.915 1.00 0.00 C ATOM 0 HA PRO A 158 13.495 3.707 0.438 1.00 0.00 H new ATOM 0 HB2 PRO A 158 11.038 4.610 1.905 1.00 0.00 H new ATOM 0 HB3 PRO A 158 12.603 5.398 1.871 1.00 0.00 H new ATOM 0 HG2 PRO A 158 10.500 6.500 0.637 1.00 0.00 H new ATOM 0 HG3 PRO A 158 12.103 6.619 -0.059 1.00 0.00 H new ATOM 0 HD2 PRO A 158 9.889 4.673 -0.768 1.00 0.00 H new ATOM 0 HD3 PRO A 158 10.869 5.647 -1.846 1.00 0.00 H new ATOM 1481 N PRO A 159 12.618 1.883 1.990 1.00 0.00 N ATOM 1482 CA PRO A 159 12.282 0.594 2.633 1.00 0.00 C ATOM 1483 C PRO A 159 10.825 0.506 3.138 1.00 0.00 C ATOM 1484 O PRO A 159 10.297 -0.581 3.288 1.00 0.00 O ATOM 1485 CB PRO A 159 13.230 0.545 3.827 1.00 0.00 C ATOM 1486 CG PRO A 159 14.404 1.341 3.399 1.00 0.00 C ATOM 1487 CD PRO A 159 13.849 2.467 2.581 1.00 0.00 C ATOM 0 HA PRO A 159 12.381 -0.228 1.924 1.00 0.00 H new ATOM 0 HB2 PRO A 159 12.767 0.967 4.719 1.00 0.00 H new ATOM 0 HB3 PRO A 159 13.512 -0.480 4.069 1.00 0.00 H new ATOM 0 HG2 PRO A 159 14.958 1.717 4.259 1.00 0.00 H new ATOM 0 HG3 PRO A 159 15.096 0.735 2.814 1.00 0.00 H new ATOM 0 HD2 PRO A 159 13.626 3.339 3.196 1.00 0.00 H new ATOM 0 HD3 PRO A 159 14.551 2.790 1.812 1.00 0.00 H new ATOM 1495 N GLY A 160 10.196 1.654 3.406 1.00 0.00 N ATOM 1496 CA GLY A 160 8.814 1.687 3.865 1.00 0.00 C ATOM 1497 C GLY A 160 7.868 1.051 2.894 1.00 0.00 C ATOM 1498 O GLY A 160 6.998 0.277 3.273 1.00 0.00 O ATOM 0 H GLY A 160 10.628 2.573 3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 160 8.742 1.175 4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 160 8.515 2.722 4.032 1.00 0.00 H new ATOM 1502 N ASN A 161 8.089 1.333 1.639 1.00 0.00 N ATOM 1503 CA ASN A 161 7.216 0.883 0.565 1.00 0.00 C ATOM 1504 C ASN A 161 7.482 -0.591 0.296 1.00 0.00 C ATOM 1505 O ASN A 161 6.586 -1.363 -0.030 1.00 0.00 O ATOM 1506 CB ASN A 161 7.546 1.709 -0.682 1.00 0.00 C ATOM 1507 CG ASN A 161 6.525 1.620 -1.798 1.00 0.00 C ATOM 1508 OD1 ASN A 161 5.803 0.658 -1.946 1.00 0.00 O ATOM 1509 ND2 ASN A 161 6.470 2.651 -2.594 1.00 0.00 N ATOM 0 H ASN A 161 8.885 1.886 1.320 1.00 0.00 H new ATOM 0 HA ASN A 161 6.167 1.010 0.833 1.00 0.00 H new ATOM 0 HB2 ASN A 161 7.652 2.754 -0.390 1.00 0.00 H new ATOM 0 HB3 ASN A 161 8.513 1.386 -1.068 1.00 0.00 H new ATOM 0 HD21 ASN A 161 5.806 2.663 -3.368 1.00 0.00 H new ATOM 0 HD22 ASN A 161 7.091 3.446 -2.443 1.00 0.00 H new