USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 961 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 161 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 171 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 54 THR OG1 : rot -3:sc= -0.749! USER MOD Set 2.2: A 110 SER OG : rot 18:sc= 0.859 USER MOD Set 3.1: A 66 MET CE :methyl 168:sc= -3.31 (180deg=-2.03) USER MOD Set 3.2: A 173 HIS : no HD1:sc= -1.43 K(o=-4.7,f=-6.7) USER MOD Set 4.1: A 32 LYS NZ :NH3+ -117:sc= -0.0432 (180deg=0) USER MOD Set 4.2: A 56 SER OG : rot 160:sc= -0.117 USER MOD Set 4.3: A 58 THR OG1 : rot -150:sc= -0.107 USER MOD Set 5.1: A 24 SER OG : rot 1:sc= 0.353 USER MOD Set 5.2: A 64 HIS : no HD1:sc= -2.21 K(o=-1.9,f=-3.2) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0294 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.177 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.488 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 ASN :FLIP amide:sc= -1.32 F(o=-2.4,f=-1.3) USER MOD Single : A 42 LYS NZ :NH3+ -155:sc= -0.024 (180deg=-0.316) USER MOD Single : A 43 TYR OH : rot 165:sc= -3.03 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0.27) USER MOD Single : A 48 HIS : no HE2:sc= -2.79! C(o=-2.8!,f=-5.3!) USER MOD Single : A 50 SER OG : rot 150:sc= -0.779 USER MOD Single : A 51 SER OG : rot 180:sc= -0.584 USER MOD Single : A 62 GLN : amide:sc= -1.23 K(o=-1.2,f=-1.9) USER MOD Single : A 65 THR OG1 : rot 180:sc= -1.69 USER MOD Single : A 67 TYR OH : rot 180:sc= -1.4! USER MOD Single : A 69 ASN : amide:sc= -2.35 X(o=-2.3,f=-2.6) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -129:sc= -6.79! (180deg=-15.6!) USER MOD Single : A 112 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0562) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -131:sc= -0.348 (180deg=-1.53!) USER MOD Single : A 121 GLN : amide:sc= -1.75 K(o=-1.8,f=-4.2!) USER MOD Single : A 123 GLN : amide:sc= -2.54! C(o=-2.5!,f=-2.7!) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 160:sc= -0.889 (180deg=-1.99!) USER MOD Single : A 136 LYS NZ :NH3+ -143:sc= -0.127 (180deg=-0.744) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= -0.353 K(o=-0.35,f=-4.9!) USER MOD Single : A 144 MET CE :methyl -164:sc= -5.05! (180deg=-5.89!) USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 THR OG1 : rot 180:sc= -0.769 USER MOD Single : A 160 TYR OH : rot 180:sc= -3.62! USER MOD Single : A 163 GLN : amide:sc= -0.0353 K(o=-0.035,f=-2.5) USER MOD Single : A 167 ASN : amide:sc= -0.526 K(o=-0.53,f=-2.2) USER MOD Single : A 169 ASN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 170 SER OG : rot -95:sc= -0.44 USER MOD Single : A 175 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 176 TYR OH : rot 158:sc= -1.49 USER MOD ----------------------------------------------------------------- ATOM 79 N GLU A 7 7.475 -0.609 10.676 1.00 0.00 N ATOM 80 CA GLU A 7 6.131 -0.431 11.211 1.00 0.00 C ATOM 81 C GLU A 7 5.395 -1.764 11.289 1.00 0.00 C ATOM 82 O GLU A 7 6.002 -2.826 11.152 1.00 0.00 O ATOM 83 CB GLU A 7 5.342 0.557 10.349 1.00 0.00 C ATOM 84 CG GLU A 7 6.071 1.868 10.102 1.00 0.00 C ATOM 85 CD GLU A 7 5.973 2.820 11.278 1.00 0.00 C ATOM 86 OE1 GLU A 7 6.124 2.359 12.429 1.00 0.00 O ATOM 87 OE2 GLU A 7 5.744 4.026 11.048 1.00 0.00 O ATOM 0 HA GLU A 7 6.218 -0.028 12.220 1.00 0.00 H new ATOM 0 HB2 GLU A 7 5.117 0.090 9.390 1.00 0.00 H new ATOM 0 HB3 GLU A 7 4.388 0.767 10.833 1.00 0.00 H new ATOM 0 HG2 GLU A 7 7.121 1.662 9.893 1.00 0.00 H new ATOM 0 HG3 GLU A 7 5.657 2.348 9.215 1.00 0.00 H new ATOM 94 N GLU A 8 4.082 -1.703 11.508 1.00 0.00 N ATOM 95 CA GLU A 8 3.264 -2.909 11.601 1.00 0.00 C ATOM 96 C GLU A 8 3.585 -3.865 10.457 1.00 0.00 C ATOM 97 O GLU A 8 3.693 -5.075 10.654 1.00 0.00 O ATOM 98 CB GLU A 8 1.778 -2.546 11.579 1.00 0.00 C ATOM 99 CG GLU A 8 1.209 -2.229 12.952 1.00 0.00 C ATOM 100 CD GLU A 8 1.230 -0.746 13.263 1.00 0.00 C ATOM 101 OE1 GLU A 8 0.538 0.019 12.558 1.00 0.00 O ATOM 102 OE2 GLU A 8 1.938 -0.348 14.212 1.00 0.00 O ATOM 0 H GLU A 8 3.564 -0.832 11.624 1.00 0.00 H new ATOM 0 HA GLU A 8 3.492 -3.406 12.544 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.633 -1.685 10.927 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.217 -3.373 11.144 1.00 0.00 H new ATOM 0 HG2 GLU A 8 0.184 -2.594 13.009 1.00 0.00 H new ATOM 0 HG3 GLU A 8 1.781 -2.764 13.711 1.00 0.00 H new ATOM 109 N PHE A 9 3.748 -3.308 9.263 1.00 0.00 N ATOM 110 CA PHE A 9 4.069 -4.103 8.087 1.00 0.00 C ATOM 111 C PHE A 9 5.520 -4.573 8.138 1.00 0.00 C ATOM 112 O PHE A 9 5.858 -5.631 7.609 1.00 0.00 O ATOM 113 CB PHE A 9 3.820 -3.291 6.813 1.00 0.00 C ATOM 114 CG PHE A 9 2.699 -3.830 5.972 1.00 0.00 C ATOM 115 CD1 PHE A 9 1.489 -4.178 6.550 1.00 0.00 C ATOM 116 CD2 PHE A 9 2.857 -3.992 4.606 1.00 0.00 C ATOM 117 CE1 PHE A 9 0.457 -4.678 5.781 1.00 0.00 C ATOM 118 CE2 PHE A 9 1.828 -4.492 3.831 1.00 0.00 C ATOM 119 CZ PHE A 9 0.626 -4.835 4.419 1.00 0.00 C ATOM 0 H PHE A 9 3.663 -2.307 9.085 1.00 0.00 H new ATOM 0 HA PHE A 9 3.421 -4.980 8.076 1.00 0.00 H new ATOM 0 HB2 PHE A 9 3.596 -2.260 7.086 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.734 -3.272 6.219 1.00 0.00 H new ATOM 0 HD1 PHE A 9 1.351 -4.057 7.614 1.00 0.00 H new ATOM 0 HD2 PHE A 9 3.795 -3.725 4.141 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.481 -4.946 6.244 1.00 0.00 H new ATOM 0 HE2 PHE A 9 1.963 -4.615 2.767 1.00 0.00 H new ATOM 0 HZ PHE A 9 -0.180 -5.225 3.815 1.00 0.00 H new ATOM 129 N ALA A 10 6.371 -3.777 8.785 1.00 0.00 N ATOM 130 CA ALA A 10 7.789 -4.104 8.919 1.00 0.00 C ATOM 131 C ALA A 10 8.378 -4.618 7.607 1.00 0.00 C ATOM 132 O ALA A 10 8.308 -5.811 7.309 1.00 0.00 O ATOM 133 CB ALA A 10 7.988 -5.127 10.027 1.00 0.00 C ATOM 0 H ALA A 10 6.101 -2.898 9.226 1.00 0.00 H new ATOM 0 HA ALA A 10 8.319 -3.187 9.179 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.048 -5.363 10.118 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.625 -4.717 10.970 1.00 0.00 H new ATOM 0 HB3 ALA A 10 7.433 -6.034 9.788 1.00 0.00 H new ATOM 139 N VAL A 11 8.960 -3.712 6.828 1.00 0.00 N ATOM 140 CA VAL A 11 9.563 -4.078 5.551 1.00 0.00 C ATOM 141 C VAL A 11 11.066 -4.282 5.689 1.00 0.00 C ATOM 142 O VAL A 11 11.733 -3.566 6.435 1.00 0.00 O ATOM 143 CB VAL A 11 9.310 -3.011 4.470 1.00 0.00 C ATOM 144 CG1 VAL A 11 7.907 -3.149 3.898 1.00 0.00 C ATOM 145 CG2 VAL A 11 9.531 -1.613 5.029 1.00 0.00 C ATOM 0 H VAL A 11 9.027 -2.721 7.058 1.00 0.00 H new ATOM 0 HA VAL A 11 9.091 -5.012 5.247 1.00 0.00 H new ATOM 0 HB VAL A 11 10.024 -3.168 3.662 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.748 -2.386 3.136 1.00 0.00 H new ATOM 0 HG12 VAL A 11 7.791 -4.137 3.452 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.175 -3.023 4.696 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.347 -0.875 4.248 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.846 -1.441 5.860 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.559 -1.520 5.381 1.00 0.00 H new ATOM 155 N GLU A 12 11.593 -5.258 4.959 1.00 0.00 N ATOM 156 CA GLU A 12 13.019 -5.550 4.996 1.00 0.00 C ATOM 157 C GLU A 12 13.581 -5.692 3.587 1.00 0.00 C ATOM 158 O GLU A 12 13.310 -6.674 2.896 1.00 0.00 O ATOM 159 CB GLU A 12 13.282 -6.827 5.797 1.00 0.00 C ATOM 160 CG GLU A 12 14.566 -6.783 6.608 1.00 0.00 C ATOM 161 CD GLU A 12 14.406 -7.391 7.987 1.00 0.00 C ATOM 162 OE1 GLU A 12 13.369 -7.131 8.634 1.00 0.00 O ATOM 163 OE2 GLU A 12 15.316 -8.128 8.421 1.00 0.00 O ATOM 0 H GLU A 12 11.054 -5.859 4.335 1.00 0.00 H new ATOM 0 HA GLU A 12 13.522 -4.716 5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.443 -7.003 6.470 1.00 0.00 H new ATOM 0 HB3 GLU A 12 13.324 -7.674 5.112 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.350 -7.315 6.069 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.893 -5.748 6.707 1.00 0.00 H new ATOM 170 N ILE A 13 14.366 -4.706 3.165 1.00 0.00 N ATOM 171 CA ILE A 13 14.966 -4.726 1.837 1.00 0.00 C ATOM 172 C ILE A 13 16.288 -5.487 1.847 1.00 0.00 C ATOM 173 O ILE A 13 17.096 -5.334 2.762 1.00 0.00 O ATOM 174 CB ILE A 13 15.214 -3.300 1.307 1.00 0.00 C ATOM 175 CG1 ILE A 13 13.942 -2.458 1.424 1.00 0.00 C ATOM 176 CG2 ILE A 13 15.692 -3.345 -0.137 1.00 0.00 C ATOM 177 CD1 ILE A 13 13.766 -1.812 2.780 1.00 0.00 C ATOM 0 H ILE A 13 14.601 -3.885 3.723 1.00 0.00 H new ATOM 0 HA ILE A 13 14.259 -5.231 1.178 1.00 0.00 H new ATOM 0 HB ILE A 13 15.992 -2.836 1.913 1.00 0.00 H new ATOM 0 HG12 ILE A 13 13.959 -1.681 0.660 1.00 0.00 H new ATOM 0 HG13 ILE A 13 13.078 -3.089 1.217 1.00 0.00 H new ATOM 0 HG21 ILE A 13 15.862 -2.330 -0.496 1.00 0.00 H new ATOM 0 HG22 ILE A 13 16.622 -3.911 -0.195 1.00 0.00 H new ATOM 0 HG23 ILE A 13 14.935 -3.826 -0.756 1.00 0.00 H new ATOM 0 HD11 ILE A 13 12.844 -1.231 2.789 1.00 0.00 H new ATOM 0 HD12 ILE A 13 13.716 -2.585 3.547 1.00 0.00 H new ATOM 0 HD13 ILE A 13 14.611 -1.154 2.982 1.00 0.00 H new ATOM 189 N SER A 14 16.502 -6.306 0.823 1.00 0.00 N ATOM 190 CA SER A 14 17.727 -7.089 0.713 1.00 0.00 C ATOM 191 C SER A 14 18.235 -7.100 -0.725 1.00 0.00 C ATOM 192 O SER A 14 17.783 -7.898 -1.546 1.00 0.00 O ATOM 193 CB SER A 14 17.488 -8.522 1.193 1.00 0.00 C ATOM 194 OG SER A 14 16.750 -8.538 2.404 1.00 0.00 O ATOM 0 H SER A 14 15.843 -6.445 0.057 1.00 0.00 H new ATOM 0 HA SER A 14 18.484 -6.625 1.345 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.949 -9.080 0.428 1.00 0.00 H new ATOM 0 HB3 SER A 14 18.444 -9.024 1.340 1.00 0.00 H new ATOM 0 HG SER A 14 16.609 -9.465 2.689 1.00 0.00 H new ATOM 200 N GLY A 15 19.173 -6.207 -1.024 1.00 0.00 N ATOM 201 CA GLY A 15 19.721 -6.130 -2.366 1.00 0.00 C ATOM 202 C GLY A 15 18.653 -5.854 -3.406 1.00 0.00 C ATOM 203 O GLY A 15 18.083 -4.765 -3.446 1.00 0.00 O ATOM 0 H GLY A 15 19.563 -5.536 -0.362 1.00 0.00 H new ATOM 0 HA2 GLY A 15 20.475 -5.344 -2.404 1.00 0.00 H new ATOM 0 HA3 GLY A 15 20.225 -7.066 -2.605 1.00 0.00 H new ATOM 207 N THR A 16 18.377 -6.846 -4.246 1.00 0.00 N ATOM 208 CA THR A 16 17.364 -6.706 -5.286 1.00 0.00 C ATOM 209 C THR A 16 16.056 -7.378 -4.873 1.00 0.00 C ATOM 210 O THR A 16 15.146 -7.533 -5.688 1.00 0.00 O ATOM 211 CB THR A 16 17.865 -7.308 -6.600 1.00 0.00 C ATOM 212 OG1 THR A 16 18.747 -8.389 -6.353 1.00 0.00 O ATOM 213 CG2 THR A 16 18.592 -6.312 -7.477 1.00 0.00 C ATOM 0 H THR A 16 18.840 -7.755 -4.227 1.00 0.00 H new ATOM 0 HA THR A 16 17.174 -5.642 -5.428 1.00 0.00 H new ATOM 0 HB THR A 16 16.969 -7.642 -7.124 1.00 0.00 H new ATOM 0 HG1 THR A 16 19.055 -8.761 -7.206 1.00 0.00 H new ATOM 0 HG21 THR A 16 18.920 -6.805 -8.392 1.00 0.00 H new ATOM 0 HG22 THR A 16 17.921 -5.490 -7.728 1.00 0.00 H new ATOM 0 HG23 THR A 16 19.459 -5.922 -6.944 1.00 0.00 H new ATOM 221 N THR A 17 15.965 -7.776 -3.606 1.00 0.00 N ATOM 222 CA THR A 17 14.767 -8.430 -3.095 1.00 0.00 C ATOM 223 C THR A 17 14.380 -7.870 -1.729 1.00 0.00 C ATOM 224 O THR A 17 15.199 -7.821 -0.812 1.00 0.00 O ATOM 225 CB THR A 17 14.990 -9.940 -2.995 1.00 0.00 C ATOM 226 OG1 THR A 17 15.320 -10.483 -4.262 1.00 0.00 O ATOM 227 CG2 THR A 17 13.784 -10.693 -2.475 1.00 0.00 C ATOM 0 H THR A 17 16.707 -7.656 -2.916 1.00 0.00 H new ATOM 0 HA THR A 17 13.952 -8.234 -3.791 1.00 0.00 H new ATOM 0 HB THR A 17 15.808 -10.063 -2.285 1.00 0.00 H new ATOM 0 HG1 THR A 17 15.460 -11.449 -4.177 1.00 0.00 H new ATOM 0 HG21 THR A 17 14.012 -11.758 -2.430 1.00 0.00 H new ATOM 0 HG22 THR A 17 13.533 -10.333 -1.477 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.938 -10.531 -3.143 1.00 0.00 H new ATOM 235 N VAL A 18 13.124 -7.456 -1.602 1.00 0.00 N ATOM 236 CA VAL A 18 12.621 -6.907 -0.348 1.00 0.00 C ATOM 237 C VAL A 18 11.373 -7.661 0.107 1.00 0.00 C ATOM 238 O VAL A 18 10.481 -7.943 -0.693 1.00 0.00 O ATOM 239 CB VAL A 18 12.305 -5.396 -0.473 1.00 0.00 C ATOM 240 CG1 VAL A 18 11.580 -5.099 -1.776 1.00 0.00 C ATOM 241 CG2 VAL A 18 11.488 -4.908 0.716 1.00 0.00 C ATOM 0 H VAL A 18 12.435 -7.490 -2.353 1.00 0.00 H new ATOM 0 HA VAL A 18 13.406 -7.030 0.398 1.00 0.00 H new ATOM 0 HB VAL A 18 13.253 -4.857 -0.478 1.00 0.00 H new ATOM 0 HG11 VAL A 18 11.369 -4.031 -1.840 1.00 0.00 H new ATOM 0 HG12 VAL A 18 12.207 -5.396 -2.617 1.00 0.00 H new ATOM 0 HG13 VAL A 18 10.644 -5.656 -1.807 1.00 0.00 H new ATOM 0 HG21 VAL A 18 11.280 -3.844 0.603 1.00 0.00 H new ATOM 0 HG22 VAL A 18 10.548 -5.458 0.762 1.00 0.00 H new ATOM 0 HG23 VAL A 18 12.050 -5.072 1.635 1.00 0.00 H new ATOM 251 N THR A 19 11.323 -7.990 1.394 1.00 0.00 N ATOM 252 CA THR A 19 10.190 -8.720 1.952 1.00 0.00 C ATOM 253 C THR A 19 9.370 -7.838 2.889 1.00 0.00 C ATOM 254 O THR A 19 9.901 -6.932 3.532 1.00 0.00 O ATOM 255 CB THR A 19 10.679 -9.960 2.701 1.00 0.00 C ATOM 256 OG1 THR A 19 11.491 -10.764 1.864 1.00 0.00 O ATOM 257 CG2 THR A 19 9.554 -10.828 3.220 1.00 0.00 C ATOM 0 H THR A 19 12.053 -7.763 2.069 1.00 0.00 H new ATOM 0 HA THR A 19 9.549 -9.027 1.125 1.00 0.00 H new ATOM 0 HB THR A 19 11.244 -9.579 3.552 1.00 0.00 H new ATOM 0 HG1 THR A 19 11.795 -11.551 2.362 1.00 0.00 H new ATOM 0 HG21 THR A 19 9.970 -11.690 3.741 1.00 0.00 H new ATOM 0 HG22 THR A 19 8.937 -10.251 3.909 1.00 0.00 H new ATOM 0 HG23 THR A 19 8.943 -11.169 2.385 1.00 0.00 H new ATOM 265 N ILE A 20 8.071 -8.115 2.962 1.00 0.00 N ATOM 266 CA ILE A 20 7.169 -7.356 3.822 1.00 0.00 C ATOM 267 C ILE A 20 6.372 -8.290 4.726 1.00 0.00 C ATOM 268 O ILE A 20 6.001 -9.388 4.319 1.00 0.00 O ATOM 269 CB ILE A 20 6.189 -6.502 2.996 1.00 0.00 C ATOM 270 CG1 ILE A 20 6.942 -5.709 1.924 1.00 0.00 C ATOM 271 CG2 ILE A 20 5.402 -5.568 3.904 1.00 0.00 C ATOM 272 CD1 ILE A 20 6.355 -5.861 0.538 1.00 0.00 C ATOM 0 H ILE A 20 7.619 -8.862 2.434 1.00 0.00 H new ATOM 0 HA ILE A 20 7.787 -6.696 4.431 1.00 0.00 H new ATOM 0 HB ILE A 20 5.485 -7.167 2.497 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.942 -4.654 2.197 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.982 -6.033 1.907 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.714 -4.972 3.304 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.837 -6.155 4.628 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.090 -4.907 4.431 1.00 0.00 H new ATOM 0 HD11 ILE A 20 6.938 -5.273 -0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 20 6.380 -6.911 0.245 1.00 0.00 H new ATOM 0 HD13 ILE A 20 5.323 -5.509 0.539 1.00 0.00 H new ATOM 284 N THR A 21 6.119 -7.853 5.955 1.00 0.00 N ATOM 285 CA THR A 21 5.373 -8.660 6.916 1.00 0.00 C ATOM 286 C THR A 21 3.924 -8.184 7.033 1.00 0.00 C ATOM 287 O THR A 21 3.653 -6.983 7.032 1.00 0.00 O ATOM 288 CB THR A 21 6.068 -8.609 8.284 1.00 0.00 C ATOM 289 OG1 THR A 21 7.142 -9.531 8.331 1.00 0.00 O ATOM 290 CG2 THR A 21 5.155 -8.915 9.455 1.00 0.00 C ATOM 0 H THR A 21 6.419 -6.945 6.310 1.00 0.00 H new ATOM 0 HA THR A 21 5.354 -9.690 6.561 1.00 0.00 H new ATOM 0 HB THR A 21 6.413 -7.580 8.383 1.00 0.00 H new ATOM 0 HG1 THR A 21 7.575 -9.484 9.209 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.723 -8.858 10.384 1.00 0.00 H new ATOM 0 HG22 THR A 21 4.342 -8.189 9.482 1.00 0.00 H new ATOM 0 HG23 THR A 21 4.743 -9.918 9.343 1.00 0.00 H new ATOM 298 N CYS A 22 2.998 -9.136 7.146 1.00 0.00 N ATOM 299 CA CYS A 22 1.580 -8.811 7.277 1.00 0.00 C ATOM 300 C CYS A 22 1.169 -8.776 8.750 1.00 0.00 C ATOM 301 O CYS A 22 1.167 -9.807 9.423 1.00 0.00 O ATOM 302 CB CYS A 22 0.713 -9.828 6.529 1.00 0.00 C ATOM 303 SG CYS A 22 -1.005 -9.276 6.279 1.00 0.00 S ATOM 0 H CYS A 22 3.204 -10.135 7.149 1.00 0.00 H new ATOM 0 HA CYS A 22 1.425 -7.826 6.838 1.00 0.00 H new ATOM 0 HB2 CYS A 22 1.165 -10.034 5.559 1.00 0.00 H new ATOM 0 HB3 CYS A 22 0.707 -10.766 7.084 1.00 0.00 H new ATOM 308 N PRO A 23 0.820 -7.588 9.276 1.00 0.00 N ATOM 309 CA PRO A 23 0.416 -7.432 10.674 1.00 0.00 C ATOM 310 C PRO A 23 -1.061 -7.739 10.911 1.00 0.00 C ATOM 311 O PRO A 23 -1.557 -7.601 12.030 1.00 0.00 O ATOM 312 CB PRO A 23 0.696 -5.956 10.935 1.00 0.00 C ATOM 313 CG PRO A 23 0.448 -5.292 9.623 1.00 0.00 C ATOM 314 CD PRO A 23 0.800 -6.299 8.556 1.00 0.00 C ATOM 0 HA PRO A 23 0.946 -8.122 11.331 1.00 0.00 H new ATOM 0 HB2 PRO A 23 0.042 -5.559 11.711 1.00 0.00 H new ATOM 0 HB3 PRO A 23 1.721 -5.800 11.272 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -0.594 -4.984 9.536 1.00 0.00 H new ATOM 0 HG3 PRO A 23 1.056 -4.393 9.523 1.00 0.00 H new ATOM 0 HD2 PRO A 23 0.064 -6.302 7.752 1.00 0.00 H new ATOM 0 HD3 PRO A 23 1.767 -6.079 8.103 1.00 0.00 H new ATOM 322 N SER A 24 -1.764 -8.148 9.860 1.00 0.00 N ATOM 323 CA SER A 24 -3.184 -8.462 9.972 1.00 0.00 C ATOM 324 C SER A 24 -3.423 -9.575 10.987 1.00 0.00 C ATOM 325 O SER A 24 -4.411 -9.558 11.720 1.00 0.00 O ATOM 326 CB SER A 24 -3.748 -8.860 8.608 1.00 0.00 C ATOM 327 OG SER A 24 -4.159 -7.720 7.874 1.00 0.00 O ATOM 0 H SER A 24 -1.376 -8.269 8.925 1.00 0.00 H new ATOM 0 HA SER A 24 -3.701 -7.568 10.322 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.992 -9.407 8.044 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.594 -9.534 8.743 1.00 0.00 H new ATOM 0 HG SER A 24 -3.978 -6.911 8.397 1.00 0.00 H new ATOM 333 N SER A 25 -2.509 -10.535 11.026 1.00 0.00 N ATOM 334 CA SER A 25 -2.613 -11.656 11.958 1.00 0.00 C ATOM 335 C SER A 25 -1.438 -12.619 11.794 1.00 0.00 C ATOM 336 O SER A 25 -0.452 -12.536 12.527 1.00 0.00 O ATOM 337 CB SER A 25 -3.938 -12.398 11.759 1.00 0.00 C ATOM 338 OG SER A 25 -3.986 -13.576 12.546 1.00 0.00 O ATOM 0 H SER A 25 -1.686 -10.562 10.424 1.00 0.00 H new ATOM 0 HA SER A 25 -2.584 -11.254 12.971 1.00 0.00 H new ATOM 0 HB2 SER A 25 -4.768 -11.744 12.026 1.00 0.00 H new ATOM 0 HB3 SER A 25 -4.060 -12.655 10.707 1.00 0.00 H new ATOM 0 HG SER A 25 -4.842 -14.031 12.403 1.00 0.00 H new ATOM 344 N GLY A 26 -1.545 -13.533 10.831 1.00 0.00 N ATOM 345 CA GLY A 26 -0.480 -14.493 10.599 1.00 0.00 C ATOM 346 C GLY A 26 -0.976 -15.927 10.585 1.00 0.00 C ATOM 347 O GLY A 26 -0.422 -16.788 11.269 1.00 0.00 O ATOM 0 H GLY A 26 -2.348 -13.625 10.209 1.00 0.00 H new ATOM 0 HA2 GLY A 26 0.003 -14.271 9.647 1.00 0.00 H new ATOM 0 HA3 GLY A 26 0.278 -14.383 11.374 1.00 0.00 H new ATOM 351 N ASP A 27 -2.022 -16.184 9.806 1.00 0.00 N ATOM 352 CA ASP A 27 -2.592 -17.524 9.707 1.00 0.00 C ATOM 353 C ASP A 27 -2.909 -17.879 8.256 1.00 0.00 C ATOM 354 O ASP A 27 -2.624 -18.986 7.800 1.00 0.00 O ATOM 355 CB ASP A 27 -3.859 -17.626 10.557 1.00 0.00 C ATOM 356 CG ASP A 27 -4.128 -19.043 11.026 1.00 0.00 C ATOM 357 OD1 ASP A 27 -4.384 -19.913 10.168 1.00 0.00 O ATOM 358 OD2 ASP A 27 -4.083 -19.281 12.251 1.00 0.00 O ATOM 0 H ASP A 27 -2.492 -15.483 9.234 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.853 -18.233 10.081 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.766 -16.971 11.423 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -4.711 -17.270 9.978 1.00 0.00 H new ATOM 363 N ASP A 28 -3.500 -16.930 7.537 1.00 0.00 N ATOM 364 CA ASP A 28 -3.858 -17.134 6.138 1.00 0.00 C ATOM 365 C ASP A 28 -4.047 -15.792 5.440 1.00 0.00 C ATOM 366 O ASP A 28 -5.155 -15.437 5.036 1.00 0.00 O ATOM 367 CB ASP A 28 -5.136 -17.969 6.030 1.00 0.00 C ATOM 368 CG ASP A 28 -6.324 -17.294 6.686 1.00 0.00 C ATOM 369 OD1 ASP A 28 -6.284 -17.085 7.917 1.00 0.00 O ATOM 370 OD2 ASP A 28 -7.296 -16.975 5.969 1.00 0.00 O ATOM 0 H ASP A 28 -3.742 -16.009 7.902 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.047 -17.673 5.648 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.360 -18.151 4.979 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.972 -18.941 6.494 1.00 0.00 H new ATOM 375 N ILE A 29 -2.956 -15.046 5.315 1.00 0.00 N ATOM 376 CA ILE A 29 -2.992 -13.735 4.683 1.00 0.00 C ATOM 377 C ILE A 29 -3.171 -13.844 3.172 1.00 0.00 C ATOM 378 O ILE A 29 -2.566 -14.695 2.520 1.00 0.00 O ATOM 379 CB ILE A 29 -1.714 -12.933 5.004 1.00 0.00 C ATOM 380 CG1 ILE A 29 -1.613 -12.721 6.513 1.00 0.00 C ATOM 381 CG2 ILE A 29 -1.707 -11.599 4.271 1.00 0.00 C ATOM 382 CD1 ILE A 29 -0.923 -13.851 7.240 1.00 0.00 C ATOM 0 H ILE A 29 -2.033 -15.329 5.645 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.853 -13.206 5.091 1.00 0.00 H new ATOM 0 HB ILE A 29 -0.847 -13.499 4.663 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.073 -11.794 6.705 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.616 -12.597 6.921 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.795 -11.054 4.515 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.748 -11.774 3.196 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -2.573 -11.012 4.576 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.889 -13.630 8.307 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.474 -14.778 7.079 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.092 -13.962 6.860 1.00 0.00 H new ATOM 394 N LYS A 30 -4.013 -12.971 2.629 1.00 0.00 N ATOM 395 CA LYS A 30 -4.288 -12.953 1.199 1.00 0.00 C ATOM 396 C LYS A 30 -3.905 -11.610 0.586 1.00 0.00 C ATOM 397 O LYS A 30 -4.490 -10.578 0.914 1.00 0.00 O ATOM 398 CB LYS A 30 -5.770 -13.230 0.948 1.00 0.00 C ATOM 399 CG LYS A 30 -6.150 -14.691 1.105 1.00 0.00 C ATOM 400 CD LYS A 30 -5.944 -15.463 -0.188 1.00 0.00 C ATOM 401 CE LYS A 30 -6.760 -16.745 -0.208 1.00 0.00 C ATOM 402 NZ LYS A 30 -7.119 -17.154 -1.595 1.00 0.00 N ATOM 0 H LYS A 30 -4.519 -12.264 3.162 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.688 -13.731 0.728 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.365 -12.632 1.639 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -6.027 -12.903 -0.059 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.552 -15.140 1.897 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.193 -14.766 1.412 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -6.226 -14.838 -1.035 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -4.887 -15.702 -0.306 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.193 -17.544 0.271 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.670 -16.605 0.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -7.675 -18.032 -1.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -7.682 -16.403 -2.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.251 -17.312 -2.146 1.00 0.00 H new ATOM 416 N TRP A 31 -2.924 -11.631 -0.309 1.00 0.00 N ATOM 417 CA TRP A 31 -2.471 -10.414 -0.970 1.00 0.00 C ATOM 418 C TRP A 31 -3.285 -10.158 -2.235 1.00 0.00 C ATOM 419 O TRP A 31 -4.063 -11.010 -2.663 1.00 0.00 O ATOM 420 CB TRP A 31 -0.980 -10.514 -1.298 1.00 0.00 C ATOM 421 CG TRP A 31 -0.127 -10.673 -0.076 1.00 0.00 C ATOM 422 CD1 TRP A 31 0.248 -11.846 0.513 1.00 0.00 C ATOM 423 CD2 TRP A 31 0.449 -9.625 0.714 1.00 0.00 C ATOM 424 NE1 TRP A 31 1.020 -11.593 1.620 1.00 0.00 N ATOM 425 CE2 TRP A 31 1.159 -10.238 1.764 1.00 0.00 C ATOM 426 CE3 TRP A 31 0.436 -8.229 0.635 1.00 0.00 C ATOM 427 CZ2 TRP A 31 1.847 -9.504 2.727 1.00 0.00 C ATOM 428 CZ3 TRP A 31 1.120 -7.502 1.591 1.00 0.00 C ATOM 429 CH2 TRP A 31 1.817 -8.140 2.625 1.00 0.00 C ATOM 0 H TRP A 31 -2.428 -12.476 -0.593 1.00 0.00 H new ATOM 0 HA TRP A 31 -2.620 -9.573 -0.293 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -0.815 -11.361 -1.964 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -0.670 -9.619 -1.838 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -0.023 -12.830 0.160 1.00 0.00 H new ATOM 0 HE1 TRP A 31 1.424 -12.299 2.235 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -0.099 -7.728 -0.158 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 2.385 -9.994 3.525 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 1.117 -6.423 1.540 1.00 0.00 H new ATOM 0 HH2 TRP A 31 2.341 -7.543 3.357 1.00 0.00 H new ATOM 440 N LYS A 32 -3.116 -8.978 -2.822 1.00 0.00 N ATOM 441 CA LYS A 32 -3.859 -8.621 -4.032 1.00 0.00 C ATOM 442 C LYS A 32 -2.962 -7.964 -5.084 1.00 0.00 C ATOM 443 O LYS A 32 -2.741 -8.535 -6.151 1.00 0.00 O ATOM 444 CB LYS A 32 -5.041 -7.697 -3.698 1.00 0.00 C ATOM 445 CG LYS A 32 -5.180 -7.370 -2.217 1.00 0.00 C ATOM 446 CD LYS A 32 -6.562 -6.824 -1.895 1.00 0.00 C ATOM 447 CE LYS A 32 -7.468 -7.902 -1.323 1.00 0.00 C ATOM 448 NZ LYS A 32 -7.531 -7.844 0.163 1.00 0.00 N ATOM 0 H LYS A 32 -2.478 -8.256 -2.486 1.00 0.00 H new ATOM 0 HA LYS A 32 -4.242 -9.550 -4.453 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -4.929 -6.767 -4.255 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.963 -8.166 -4.043 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.995 -8.267 -1.626 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -4.423 -6.639 -1.932 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.473 -6.005 -1.181 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.011 -6.412 -2.799 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.471 -7.788 -1.733 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.106 -8.882 -1.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.143 -8.723 0.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.973 -7.035 0.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.520 -7.734 0.464 1.00 0.00 H new ATOM 462 N PRO A 33 -2.442 -6.748 -4.806 1.00 0.00 N ATOM 463 CA PRO A 33 -1.581 -6.011 -5.731 1.00 0.00 C ATOM 464 C PRO A 33 -0.730 -6.915 -6.618 1.00 0.00 C ATOM 465 O PRO A 33 -0.547 -6.643 -7.805 1.00 0.00 O ATOM 466 CB PRO A 33 -0.696 -5.206 -4.785 1.00 0.00 C ATOM 467 CG PRO A 33 -1.522 -4.980 -3.556 1.00 0.00 C ATOM 468 CD PRO A 33 -2.658 -5.979 -3.570 1.00 0.00 C ATOM 0 HA PRO A 33 -2.158 -5.414 -6.436 1.00 0.00 H new ATOM 0 HB2 PRO A 33 0.219 -5.748 -4.548 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.398 -4.260 -5.237 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -0.915 -5.105 -2.660 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.910 -3.961 -3.539 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -2.634 -6.622 -2.691 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -3.627 -5.481 -3.574 1.00 0.00 H new ATOM 476 N ASP A 34 -0.215 -7.991 -6.036 1.00 0.00 N ATOM 477 CA ASP A 34 0.613 -8.935 -6.775 1.00 0.00 C ATOM 478 C ASP A 34 0.857 -10.198 -5.952 1.00 0.00 C ATOM 479 O ASP A 34 1.807 -10.270 -5.174 1.00 0.00 O ATOM 480 CB ASP A 34 1.946 -8.287 -7.156 1.00 0.00 C ATOM 481 CG ASP A 34 2.253 -8.424 -8.634 1.00 0.00 C ATOM 482 OD1 ASP A 34 2.018 -9.517 -9.191 1.00 0.00 O ATOM 483 OD2 ASP A 34 2.729 -7.438 -9.235 1.00 0.00 O ATOM 0 H ASP A 34 -0.356 -8.231 -5.055 1.00 0.00 H new ATOM 0 HA ASP A 34 0.084 -9.214 -7.686 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.923 -7.231 -6.889 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.748 -8.745 -6.577 1.00 0.00 H new ATOM 488 N PRO A 35 0.000 -11.217 -6.120 1.00 0.00 N ATOM 489 CA PRO A 35 0.127 -12.482 -5.395 1.00 0.00 C ATOM 490 C PRO A 35 1.397 -13.224 -5.784 1.00 0.00 C ATOM 491 O PRO A 35 1.910 -14.043 -5.022 1.00 0.00 O ATOM 492 CB PRO A 35 -1.117 -13.278 -5.816 1.00 0.00 C ATOM 493 CG PRO A 35 -2.033 -12.278 -6.438 1.00 0.00 C ATOM 494 CD PRO A 35 -1.148 -11.224 -7.032 1.00 0.00 C ATOM 0 HA PRO A 35 0.192 -12.333 -4.317 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.859 -14.067 -6.522 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -1.585 -13.759 -4.957 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -2.656 -12.742 -7.203 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -2.706 -11.850 -5.695 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -0.853 -11.470 -8.052 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -1.642 -10.253 -7.068 1.00 0.00 H new ATOM 502 N ALA A 36 1.904 -12.921 -6.974 1.00 0.00 N ATOM 503 CA ALA A 36 3.124 -13.549 -7.467 1.00 0.00 C ATOM 504 C ALA A 36 4.270 -13.343 -6.482 1.00 0.00 C ATOM 505 O ALA A 36 5.146 -14.197 -6.342 1.00 0.00 O ATOM 506 CB ALA A 36 3.491 -12.993 -8.834 1.00 0.00 C ATOM 0 H ALA A 36 1.489 -12.245 -7.615 1.00 0.00 H new ATOM 0 HA ALA A 36 2.945 -14.620 -7.565 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.404 -13.472 -9.188 1.00 0.00 H new ATOM 0 HB2 ALA A 36 2.681 -13.191 -9.537 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.651 -11.917 -8.758 1.00 0.00 H new ATOM 512 N LEU A 37 4.247 -12.206 -5.793 1.00 0.00 N ATOM 513 CA LEU A 37 5.274 -11.882 -4.809 1.00 0.00 C ATOM 514 C LEU A 37 4.650 -11.718 -3.427 1.00 0.00 C ATOM 515 O LEU A 37 4.964 -10.777 -2.698 1.00 0.00 O ATOM 516 CB LEU A 37 6.017 -10.602 -5.204 1.00 0.00 C ATOM 517 CG LEU A 37 5.190 -9.586 -5.992 1.00 0.00 C ATOM 518 CD1 LEU A 37 5.835 -8.209 -5.930 1.00 0.00 C ATOM 519 CD2 LEU A 37 5.028 -10.040 -7.435 1.00 0.00 C ATOM 0 H LEU A 37 3.526 -11.492 -5.899 1.00 0.00 H new ATOM 0 HA LEU A 37 5.990 -12.704 -4.779 1.00 0.00 H new ATOM 0 HB2 LEU A 37 6.387 -10.121 -4.298 1.00 0.00 H new ATOM 0 HB3 LEU A 37 6.889 -10.876 -5.798 1.00 0.00 H new ATOM 0 HG LEU A 37 4.201 -9.519 -5.540 1.00 0.00 H new ATOM 0 HD11 LEU A 37 5.232 -7.499 -6.497 1.00 0.00 H new ATOM 0 HD12 LEU A 37 5.899 -7.883 -4.892 1.00 0.00 H new ATOM 0 HD13 LEU A 37 6.837 -8.257 -6.357 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.437 -9.306 -7.983 1.00 0.00 H new ATOM 0 HD22 LEU A 37 6.010 -10.135 -7.899 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.521 -11.005 -7.458 1.00 0.00 H new ATOM 531 N GLY A 38 3.763 -12.642 -3.076 1.00 0.00 N ATOM 532 CA GLY A 38 3.103 -12.589 -1.786 1.00 0.00 C ATOM 533 C GLY A 38 3.144 -13.918 -1.064 1.00 0.00 C ATOM 534 O GLY A 38 2.533 -14.892 -1.505 1.00 0.00 O ATOM 0 H GLY A 38 3.489 -13.429 -3.664 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.579 -11.828 -1.168 1.00 0.00 H new ATOM 0 HA3 GLY A 38 2.065 -12.285 -1.924 1.00 0.00 H new ATOM 538 N ASP A 39 3.866 -13.960 0.050 1.00 0.00 N ATOM 539 CA ASP A 39 3.982 -15.185 0.834 1.00 0.00 C ATOM 540 C ASP A 39 3.000 -15.175 2.001 1.00 0.00 C ATOM 541 O ASP A 39 2.297 -14.190 2.222 1.00 0.00 O ATOM 542 CB ASP A 39 5.411 -15.348 1.356 1.00 0.00 C ATOM 543 CG ASP A 39 5.842 -16.801 1.414 1.00 0.00 C ATOM 544 OD1 ASP A 39 5.772 -17.483 0.370 1.00 0.00 O ATOM 545 OD2 ASP A 39 6.251 -17.255 2.503 1.00 0.00 O ATOM 0 H ASP A 39 4.378 -13.164 0.430 1.00 0.00 H new ATOM 0 HA ASP A 39 3.742 -16.028 0.186 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.095 -14.794 0.713 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.484 -14.910 2.352 1.00 0.00 H new ATOM 550 N ASN A 40 2.957 -16.270 2.753 1.00 0.00 N ATOM 551 CA ASN A 40 2.060 -16.356 3.897 1.00 0.00 C ATOM 552 C ASN A 40 2.550 -15.452 5.015 1.00 0.00 C ATOM 553 O ASN A 40 3.662 -15.613 5.519 1.00 0.00 O ATOM 554 CB ASN A 40 1.948 -17.790 4.402 1.00 0.00 C ATOM 555 CG ASN A 40 1.673 -18.780 3.288 1.00 0.00 C ATOM 556 OD1 ASN A 40 2.452 -19.705 3.057 1.00 0.00 O ATOM 557 ND2 ASN A 40 0.559 -18.591 2.590 1.00 0.00 N ATOM 0 H ASN A 40 3.526 -17.101 2.593 1.00 0.00 H new ATOM 0 HA ASN A 40 1.071 -16.029 3.575 1.00 0.00 H new ATOM 0 HB2 ASN A 40 2.873 -18.066 4.909 1.00 0.00 H new ATOM 0 HB3 ASN A 40 1.149 -17.850 5.141 1.00 0.00 H new ATOM 0 HD21 ASN A 40 0.321 -19.226 1.828 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -0.058 -17.811 2.816 1.00 0.00 H new ATOM 564 N ASN A 41 1.722 -14.487 5.383 1.00 0.00 N ATOM 565 CA ASN A 41 2.076 -13.536 6.426 1.00 0.00 C ATOM 566 C ASN A 41 3.308 -12.743 6.005 1.00 0.00 C ATOM 567 O ASN A 41 4.003 -12.160 6.837 1.00 0.00 O ATOM 568 CB ASN A 41 2.339 -14.267 7.747 1.00 0.00 C ATOM 569 CG ASN A 41 2.701 -13.324 8.879 1.00 0.00 C ATOM 570 OD1 ASN A 41 1.936 -12.249 9.024 1.00 0.00 O flip ATOM 571 ND2 ASN A 41 3.659 -13.561 9.615 1.00 0.00 N flip ATOM 0 H ASN A 41 0.799 -14.341 4.975 1.00 0.00 H new ATOM 0 HA ASN A 41 1.244 -12.847 6.574 1.00 0.00 H new ATOM 0 HB2 ASN A 41 1.452 -14.837 8.024 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.147 -14.984 7.605 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.220 -14.400 9.467 1.00 0.00 H new ATOM 0 HD22 ASN A 41 3.891 -12.919 10.372 1.00 0.00 H new ATOM 578 N LYS A 42 3.579 -12.733 4.699 1.00 0.00 N ATOM 579 CA LYS A 42 4.732 -12.024 4.173 1.00 0.00 C ATOM 580 C LYS A 42 4.564 -11.703 2.689 1.00 0.00 C ATOM 581 O LYS A 42 3.746 -12.306 1.999 1.00 0.00 O ATOM 582 CB LYS A 42 5.990 -12.868 4.381 1.00 0.00 C ATOM 583 CG LYS A 42 7.232 -12.053 4.702 1.00 0.00 C ATOM 584 CD LYS A 42 7.258 -11.621 6.161 1.00 0.00 C ATOM 585 CE LYS A 42 8.436 -12.231 6.904 1.00 0.00 C ATOM 586 NZ LYS A 42 8.421 -13.719 6.843 1.00 0.00 N ATOM 0 H LYS A 42 3.015 -13.207 3.994 1.00 0.00 H new ATOM 0 HA LYS A 42 4.824 -11.080 4.711 1.00 0.00 H new ATOM 0 HB2 LYS A 42 5.812 -13.575 5.191 1.00 0.00 H new ATOM 0 HB3 LYS A 42 6.175 -13.455 3.481 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.122 -12.643 4.481 1.00 0.00 H new ATOM 0 HG3 LYS A 42 7.266 -11.172 4.061 1.00 0.00 H new ATOM 0 HD2 LYS A 42 7.314 -10.534 6.218 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.328 -11.918 6.646 1.00 0.00 H new ATOM 0 HE2 LYS A 42 9.367 -11.860 6.476 1.00 0.00 H new ATOM 0 HE3 LYS A 42 8.414 -11.910 7.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 8.938 -14.105 7.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 7.438 -14.057 6.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 8.877 -14.035 5.963 1.00 0.00 H new ATOM 600 N TYR A 43 5.357 -10.752 2.206 1.00 0.00 N ATOM 601 CA TYR A 43 5.318 -10.350 0.803 1.00 0.00 C ATOM 602 C TYR A 43 6.734 -10.263 0.250 1.00 0.00 C ATOM 603 O TYR A 43 7.452 -9.297 0.505 1.00 0.00 O ATOM 604 CB TYR A 43 4.615 -9.000 0.659 1.00 0.00 C ATOM 605 CG TYR A 43 4.004 -8.751 -0.705 1.00 0.00 C ATOM 606 CD1 TYR A 43 2.884 -9.456 -1.130 1.00 0.00 C ATOM 607 CD2 TYR A 43 4.539 -7.796 -1.562 1.00 0.00 C ATOM 608 CE1 TYR A 43 2.318 -9.218 -2.369 1.00 0.00 C ATOM 609 CE2 TYR A 43 3.980 -7.554 -2.801 1.00 0.00 C ATOM 610 CZ TYR A 43 2.871 -8.266 -3.200 1.00 0.00 C ATOM 611 OH TYR A 43 2.310 -8.021 -4.432 1.00 0.00 O ATOM 0 H TYR A 43 6.038 -10.242 2.769 1.00 0.00 H new ATOM 0 HA TYR A 43 4.760 -11.096 0.238 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.830 -8.931 1.412 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.332 -8.207 0.872 1.00 0.00 H new ATOM 0 HD1 TYR A 43 2.449 -10.202 -0.482 1.00 0.00 H new ATOM 0 HD2 TYR A 43 5.407 -7.233 -1.253 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.448 -9.774 -2.684 1.00 0.00 H new ATOM 0 HE2 TYR A 43 4.411 -6.810 -3.454 1.00 0.00 H new ATOM 0 HH TYR A 43 2.658 -7.176 -4.788 1.00 0.00 H new ATOM 621 N ILE A 44 7.135 -11.286 -0.492 1.00 0.00 N ATOM 622 CA ILE A 44 8.473 -11.336 -1.065 1.00 0.00 C ATOM 623 C ILE A 44 8.541 -10.605 -2.401 1.00 0.00 C ATOM 624 O ILE A 44 8.119 -11.133 -3.429 1.00 0.00 O ATOM 625 CB ILE A 44 8.930 -12.792 -1.263 1.00 0.00 C ATOM 626 CG1 ILE A 44 8.668 -13.606 0.007 1.00 0.00 C ATOM 627 CG2 ILE A 44 10.403 -12.842 -1.640 1.00 0.00 C ATOM 628 CD1 ILE A 44 9.371 -13.061 1.231 1.00 0.00 C ATOM 0 H ILE A 44 6.552 -12.094 -0.712 1.00 0.00 H new ATOM 0 HA ILE A 44 9.138 -10.838 -0.360 1.00 0.00 H new ATOM 0 HB ILE A 44 8.355 -13.230 -2.079 1.00 0.00 H new ATOM 0 HG12 ILE A 44 7.595 -13.633 0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.989 -14.635 -0.158 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.709 -13.879 -1.776 1.00 0.00 H new ATOM 0 HG22 ILE A 44 10.560 -12.293 -2.568 1.00 0.00 H new ATOM 0 HG23 ILE A 44 10.997 -12.390 -0.846 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.140 -13.687 2.092 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.448 -13.060 1.062 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.033 -12.043 1.422 1.00 0.00 H new ATOM 640 N ILE A 45 9.083 -9.391 -2.380 1.00 0.00 N ATOM 641 CA ILE A 45 9.213 -8.592 -3.594 1.00 0.00 C ATOM 642 C ILE A 45 10.510 -8.917 -4.324 1.00 0.00 C ATOM 643 O ILE A 45 11.574 -9.001 -3.711 1.00 0.00 O ATOM 644 CB ILE A 45 9.183 -7.080 -3.298 1.00 0.00 C ATOM 645 CG1 ILE A 45 8.155 -6.757 -2.213 1.00 0.00 C ATOM 646 CG2 ILE A 45 8.876 -6.303 -4.569 1.00 0.00 C ATOM 647 CD1 ILE A 45 8.108 -5.289 -1.849 1.00 0.00 C ATOM 0 H ILE A 45 9.439 -8.940 -1.537 1.00 0.00 H new ATOM 0 HA ILE A 45 8.358 -8.845 -4.221 1.00 0.00 H new ATOM 0 HB ILE A 45 10.166 -6.782 -2.932 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.168 -7.072 -2.552 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.385 -7.338 -1.320 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.857 -5.236 -4.348 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.645 -6.506 -5.314 1.00 0.00 H new ATOM 0 HG23 ILE A 45 7.905 -6.610 -4.957 1.00 0.00 H new ATOM 0 HD11 ILE A 45 7.358 -5.130 -1.074 1.00 0.00 H new ATOM 0 HD12 ILE A 45 9.084 -4.974 -1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.848 -4.704 -2.731 1.00 0.00 H new ATOM 659 N GLN A 46 10.416 -9.098 -5.636 1.00 0.00 N ATOM 660 CA GLN A 46 11.583 -9.413 -6.447 1.00 0.00 C ATOM 661 C GLN A 46 11.498 -8.732 -7.807 1.00 0.00 C ATOM 662 O GLN A 46 10.420 -8.630 -8.394 1.00 0.00 O ATOM 663 CB GLN A 46 11.703 -10.923 -6.619 1.00 0.00 C ATOM 664 CG GLN A 46 12.204 -11.629 -5.372 1.00 0.00 C ATOM 665 CD GLN A 46 12.168 -13.139 -5.500 1.00 0.00 C ATOM 666 OE1 GLN A 46 11.170 -13.778 -5.168 1.00 0.00 O ATOM 667 NE2 GLN A 46 13.261 -13.718 -5.984 1.00 0.00 N ATOM 0 H GLN A 46 9.543 -9.032 -6.160 1.00 0.00 H new ATOM 0 HA GLN A 46 12.471 -9.040 -5.936 1.00 0.00 H new ATOM 0 HB2 GLN A 46 10.729 -11.330 -6.892 1.00 0.00 H new ATOM 0 HB3 GLN A 46 12.381 -11.135 -7.446 1.00 0.00 H new ATOM 0 HG2 GLN A 46 13.226 -11.310 -5.165 1.00 0.00 H new ATOM 0 HG3 GLN A 46 11.596 -11.326 -4.519 1.00 0.00 H new ATOM 0 HE21 GLN A 46 14.066 -13.149 -6.247 1.00 0.00 H new ATOM 0 HE22 GLN A 46 13.296 -14.732 -6.093 1.00 0.00 H new ATOM 676 N ASN A 47 12.638 -8.258 -8.301 1.00 0.00 N ATOM 677 CA ASN A 47 12.684 -7.577 -9.590 1.00 0.00 C ATOM 678 C ASN A 47 11.698 -6.412 -9.617 1.00 0.00 C ATOM 679 O ASN A 47 11.219 -6.013 -10.678 1.00 0.00 O ATOM 680 CB ASN A 47 12.368 -8.557 -10.721 1.00 0.00 C ATOM 681 CG ASN A 47 13.201 -8.297 -11.961 1.00 0.00 C ATOM 682 OD1 ASN A 47 13.005 -7.302 -12.658 1.00 0.00 O ATOM 683 ND2 ASN A 47 14.138 -9.196 -12.243 1.00 0.00 N ATOM 0 H ASN A 47 13.539 -8.333 -7.830 1.00 0.00 H new ATOM 0 HA ASN A 47 13.691 -7.185 -9.734 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.544 -9.576 -10.375 1.00 0.00 H new ATOM 0 HB3 ASN A 47 11.311 -8.485 -10.975 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.729 -9.076 -13.065 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.266 -10.007 -11.637 1.00 0.00 H new ATOM 690 N HIS A 48 11.397 -5.875 -8.437 1.00 0.00 N ATOM 691 CA HIS A 48 10.466 -4.761 -8.313 1.00 0.00 C ATOM 692 C HIS A 48 10.906 -3.580 -9.171 1.00 0.00 C ATOM 693 O HIS A 48 12.041 -3.531 -9.645 1.00 0.00 O ATOM 694 CB HIS A 48 10.354 -4.327 -6.851 1.00 0.00 C ATOM 695 CG HIS A 48 9.168 -3.458 -6.572 1.00 0.00 C ATOM 696 ND1 HIS A 48 7.887 -3.781 -6.966 1.00 0.00 N ATOM 697 CD2 HIS A 48 9.074 -2.269 -5.932 1.00 0.00 C ATOM 698 CE1 HIS A 48 7.056 -2.828 -6.582 1.00 0.00 C ATOM 699 NE2 HIS A 48 7.751 -1.900 -5.952 1.00 0.00 N ATOM 0 H HIS A 48 11.787 -6.196 -7.551 1.00 0.00 H new ATOM 0 HA HIS A 48 9.490 -5.097 -8.665 1.00 0.00 H new ATOM 0 HB2 HIS A 48 10.300 -5.215 -6.221 1.00 0.00 H new ATOM 0 HB3 HIS A 48 11.261 -3.791 -6.570 1.00 0.00 H new ATOM 0 HD1 HIS A 48 7.622 -4.624 -7.475 1.00 0.00 H new ATOM 0 HD2 HIS A 48 9.887 -1.714 -5.488 1.00 0.00 H new ATOM 0 HE1 HIS A 48 5.990 -2.811 -6.754 1.00 0.00 H new ATOM 707 N ASP A 49 9.998 -2.631 -9.364 1.00 0.00 N ATOM 708 CA ASP A 49 10.288 -1.448 -10.164 1.00 0.00 C ATOM 709 C ASP A 49 10.150 -0.180 -9.329 1.00 0.00 C ATOM 710 O ASP A 49 9.196 -0.029 -8.564 1.00 0.00 O ATOM 711 CB ASP A 49 9.352 -1.381 -11.372 1.00 0.00 C ATOM 712 CG ASP A 49 10.006 -0.730 -12.575 1.00 0.00 C ATOM 713 OD1 ASP A 49 10.324 0.475 -12.498 1.00 0.00 O ATOM 714 OD2 ASP A 49 10.200 -1.426 -13.594 1.00 0.00 O ATOM 0 H ASP A 49 9.055 -2.658 -8.977 1.00 0.00 H new ATOM 0 HA ASP A 49 11.318 -1.521 -10.515 1.00 0.00 H new ATOM 0 HB2 ASP A 49 9.032 -2.389 -11.637 1.00 0.00 H new ATOM 0 HB3 ASP A 49 8.455 -0.823 -11.103 1.00 0.00 H new ATOM 719 N SER A 50 11.106 0.731 -9.481 1.00 0.00 N ATOM 720 CA SER A 50 11.089 1.990 -8.743 1.00 0.00 C ATOM 721 C SER A 50 9.773 2.727 -8.960 1.00 0.00 C ATOM 722 O SER A 50 9.627 3.481 -9.923 1.00 0.00 O ATOM 723 CB SER A 50 12.257 2.876 -9.179 1.00 0.00 C ATOM 724 OG SER A 50 12.377 4.012 -8.340 1.00 0.00 O ATOM 0 H SER A 50 11.903 0.621 -10.109 1.00 0.00 H new ATOM 0 HA SER A 50 11.189 1.762 -7.682 1.00 0.00 H new ATOM 0 HB2 SER A 50 13.183 2.301 -9.153 1.00 0.00 H new ATOM 0 HB3 SER A 50 12.109 3.196 -10.211 1.00 0.00 H new ATOM 0 HG SER A 50 13.317 4.287 -8.294 1.00 0.00 H new ATOM 730 N SER A 51 8.812 2.504 -8.068 1.00 0.00 N ATOM 731 CA SER A 51 7.512 3.153 -8.185 1.00 0.00 C ATOM 732 C SER A 51 6.616 2.841 -6.995 1.00 0.00 C ATOM 733 O SER A 51 6.974 2.047 -6.123 1.00 0.00 O ATOM 734 CB SER A 51 6.826 2.728 -9.484 1.00 0.00 C ATOM 735 OG SER A 51 7.523 1.666 -10.110 1.00 0.00 O ATOM 0 H SER A 51 8.908 1.884 -7.263 1.00 0.00 H new ATOM 0 HA SER A 51 7.681 4.230 -8.200 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.802 2.419 -9.273 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.769 3.579 -10.163 1.00 0.00 H new ATOM 0 HG SER A 51 7.061 1.414 -10.937 1.00 0.00 H new ATOM 741 N PRO A 52 5.437 3.493 -6.946 1.00 0.00 N ATOM 742 CA PRO A 52 4.472 3.331 -5.867 1.00 0.00 C ATOM 743 C PRO A 52 3.446 2.236 -6.115 1.00 0.00 C ATOM 744 O PRO A 52 3.370 1.661 -7.202 1.00 0.00 O ATOM 745 CB PRO A 52 3.780 4.687 -5.854 1.00 0.00 C ATOM 746 CG PRO A 52 3.760 5.109 -7.282 1.00 0.00 C ATOM 747 CD PRO A 52 4.962 4.474 -7.942 1.00 0.00 C ATOM 0 HA PRO A 52 4.957 3.038 -4.936 1.00 0.00 H new ATOM 0 HB2 PRO A 52 2.771 4.614 -5.448 1.00 0.00 H new ATOM 0 HB3 PRO A 52 4.322 5.403 -5.236 1.00 0.00 H new ATOM 0 HG2 PRO A 52 2.838 4.788 -7.767 1.00 0.00 H new ATOM 0 HG3 PRO A 52 3.802 6.195 -7.365 1.00 0.00 H new ATOM 0 HD2 PRO A 52 4.693 3.991 -8.882 1.00 0.00 H new ATOM 0 HD3 PRO A 52 5.729 5.214 -8.172 1.00 0.00 H new ATOM 755 N LEU A 53 2.645 1.977 -5.087 1.00 0.00 N ATOM 756 CA LEU A 53 1.591 0.977 -5.147 1.00 0.00 C ATOM 757 C LEU A 53 0.880 0.885 -3.808 1.00 0.00 C ATOM 758 O LEU A 53 1.488 1.069 -2.755 1.00 0.00 O ATOM 759 CB LEU A 53 2.149 -0.399 -5.551 1.00 0.00 C ATOM 760 CG LEU A 53 2.539 -1.340 -4.406 1.00 0.00 C ATOM 761 CD1 LEU A 53 1.306 -1.929 -3.733 1.00 0.00 C ATOM 762 CD2 LEU A 53 3.433 -2.454 -4.924 1.00 0.00 C ATOM 0 H LEU A 53 2.710 2.456 -4.189 1.00 0.00 H new ATOM 0 HA LEU A 53 0.876 1.285 -5.910 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.404 -0.902 -6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.027 -0.241 -6.177 1.00 0.00 H new ATOM 0 HG LEU A 53 3.086 -0.759 -3.663 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.614 -2.592 -2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.693 -1.124 -3.328 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.727 -2.493 -4.464 1.00 0.00 H new ATOM 0 HD21 LEU A 53 3.703 -3.116 -4.101 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.901 -3.022 -5.687 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.337 -2.024 -5.356 1.00 0.00 H new ATOM 774 N THR A 54 -0.403 0.574 -3.852 1.00 0.00 N ATOM 775 CA THR A 54 -1.185 0.429 -2.639 1.00 0.00 C ATOM 776 C THR A 54 -1.324 -1.052 -2.316 1.00 0.00 C ATOM 777 O THR A 54 -1.995 -1.795 -3.032 1.00 0.00 O ATOM 778 CB THR A 54 -2.554 1.101 -2.797 1.00 0.00 C ATOM 779 OG1 THR A 54 -2.428 2.504 -2.670 1.00 0.00 O ATOM 780 CG2 THR A 54 -3.585 0.650 -1.780 1.00 0.00 C ATOM 0 H THR A 54 -0.925 0.417 -4.714 1.00 0.00 H new ATOM 0 HA THR A 54 -0.678 0.924 -1.811 1.00 0.00 H new ATOM 0 HB THR A 54 -2.901 0.807 -3.788 1.00 0.00 H new ATOM 0 HG1 THR A 54 -1.500 2.731 -2.453 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.525 1.171 -1.959 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.742 -0.425 -1.873 1.00 0.00 H new ATOM 0 HG23 THR A 54 -3.229 0.879 -0.775 1.00 0.00 H new ATOM 788 N VAL A 55 -0.658 -1.480 -1.252 1.00 0.00 N ATOM 789 CA VAL A 55 -0.683 -2.878 -0.859 1.00 0.00 C ATOM 790 C VAL A 55 -1.725 -3.138 0.221 1.00 0.00 C ATOM 791 O VAL A 55 -1.758 -2.460 1.247 1.00 0.00 O ATOM 792 CB VAL A 55 0.708 -3.343 -0.369 1.00 0.00 C ATOM 793 CG1 VAL A 55 0.940 -2.956 1.086 1.00 0.00 C ATOM 794 CG2 VAL A 55 0.861 -4.842 -0.556 1.00 0.00 C ATOM 0 H VAL A 55 -0.096 -0.880 -0.649 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.955 -3.453 -1.744 1.00 0.00 H new ATOM 0 HB VAL A 55 1.463 -2.838 -0.971 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.926 -3.297 1.400 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.881 -1.872 1.188 1.00 0.00 H new ATOM 0 HG13 VAL A 55 0.179 -3.421 1.712 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.845 -5.154 -0.206 1.00 0.00 H new ATOM 0 HG22 VAL A 55 0.092 -5.360 0.016 1.00 0.00 H new ATOM 0 HG23 VAL A 55 0.756 -5.089 -1.612 1.00 0.00 H new ATOM 804 N SER A 56 -2.575 -4.129 -0.022 1.00 0.00 N ATOM 805 CA SER A 56 -3.621 -4.488 0.923 1.00 0.00 C ATOM 806 C SER A 56 -3.390 -5.891 1.470 1.00 0.00 C ATOM 807 O SER A 56 -3.044 -6.811 0.728 1.00 0.00 O ATOM 808 CB SER A 56 -4.994 -4.399 0.256 1.00 0.00 C ATOM 809 OG SER A 56 -5.967 -5.123 0.989 1.00 0.00 O ATOM 0 H SER A 56 -2.559 -4.698 -0.868 1.00 0.00 H new ATOM 0 HA SER A 56 -3.590 -3.784 1.754 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.296 -3.355 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.934 -4.790 -0.760 1.00 0.00 H new ATOM 0 HG SER A 56 -6.862 -4.804 0.748 1.00 0.00 H new ATOM 815 N CYS A 57 -3.575 -6.043 2.774 1.00 0.00 N ATOM 816 CA CYS A 57 -3.381 -7.326 3.433 1.00 0.00 C ATOM 817 C CYS A 57 -4.673 -7.797 4.086 1.00 0.00 C ATOM 818 O CYS A 57 -5.439 -6.994 4.619 1.00 0.00 O ATOM 819 CB CYS A 57 -2.276 -7.205 4.484 1.00 0.00 C ATOM 820 SG CYS A 57 -1.010 -8.510 4.400 1.00 0.00 S ATOM 0 H CYS A 57 -3.861 -5.289 3.399 1.00 0.00 H new ATOM 0 HA CYS A 57 -3.088 -8.062 2.684 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -1.789 -6.236 4.372 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -2.731 -7.220 5.475 1.00 0.00 H new ATOM 825 N THR A 58 -4.915 -9.101 4.034 1.00 0.00 N ATOM 826 CA THR A 58 -6.122 -9.669 4.616 1.00 0.00 C ATOM 827 C THR A 58 -5.825 -10.976 5.343 1.00 0.00 C ATOM 828 O THR A 58 -5.686 -12.026 4.716 1.00 0.00 O ATOM 829 CB THR A 58 -7.155 -9.911 3.519 1.00 0.00 C ATOM 830 OG1 THR A 58 -7.489 -8.697 2.869 1.00 0.00 O ATOM 831 CG2 THR A 58 -8.441 -10.530 4.025 1.00 0.00 C ATOM 0 H THR A 58 -4.294 -9.782 3.597 1.00 0.00 H new ATOM 0 HA THR A 58 -6.516 -8.960 5.344 1.00 0.00 H new ATOM 0 HB THR A 58 -6.683 -10.613 2.831 1.00 0.00 H new ATOM 0 HG1 THR A 58 -8.413 -8.742 2.546 1.00 0.00 H new ATOM 0 HG21 THR A 58 -9.128 -10.673 3.191 1.00 0.00 H new ATOM 0 HG22 THR A 58 -8.224 -11.493 4.486 1.00 0.00 H new ATOM 0 HG23 THR A 58 -8.897 -9.869 4.762 1.00 0.00 H new ATOM 839 N ALA A 59 -5.744 -10.909 6.667 1.00 0.00 N ATOM 840 CA ALA A 59 -5.481 -12.094 7.473 1.00 0.00 C ATOM 841 C ALA A 59 -6.709 -12.470 8.293 1.00 0.00 C ATOM 842 O ALA A 59 -6.946 -11.910 9.364 1.00 0.00 O ATOM 843 CB ALA A 59 -4.288 -11.867 8.387 1.00 0.00 C ATOM 0 H ALA A 59 -5.856 -10.049 7.203 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.249 -12.918 6.798 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.108 -12.764 8.980 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.406 -11.647 7.786 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.493 -11.028 9.051 1.00 0.00 H new ATOM 849 N GLY A 60 -7.493 -13.414 7.783 1.00 0.00 N ATOM 850 CA GLY A 60 -8.690 -13.835 8.486 1.00 0.00 C ATOM 851 C GLY A 60 -9.710 -12.719 8.600 1.00 0.00 C ATOM 852 O GLY A 60 -10.409 -12.408 7.636 1.00 0.00 O ATOM 0 H GLY A 60 -7.322 -13.893 6.899 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -9.137 -14.681 7.964 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -8.420 -14.182 9.484 1.00 0.00 H new ATOM 856 N ASP A 61 -9.792 -12.114 9.780 1.00 0.00 N ATOM 857 CA ASP A 61 -10.732 -11.024 10.016 1.00 0.00 C ATOM 858 C ASP A 61 -9.996 -9.705 10.234 1.00 0.00 C ATOM 859 O ASP A 61 -10.490 -8.815 10.927 1.00 0.00 O ATOM 860 CB ASP A 61 -11.614 -11.335 11.227 1.00 0.00 C ATOM 861 CG ASP A 61 -13.018 -10.785 11.076 1.00 0.00 C ATOM 862 OD1 ASP A 61 -13.193 -9.799 10.329 1.00 0.00 O ATOM 863 OD2 ASP A 61 -13.944 -11.340 11.705 1.00 0.00 O ATOM 0 H ASP A 61 -9.219 -12.360 10.588 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.362 -10.925 9.132 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -11.663 -12.415 11.370 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -11.157 -10.916 12.123 1.00 0.00 H new ATOM 868 N GLN A 62 -8.812 -9.585 9.640 1.00 0.00 N ATOM 869 CA GLN A 62 -8.009 -8.373 9.772 1.00 0.00 C ATOM 870 C GLN A 62 -7.641 -7.811 8.402 1.00 0.00 C ATOM 871 O GLN A 62 -7.515 -8.554 7.429 1.00 0.00 O ATOM 872 CB GLN A 62 -6.740 -8.664 10.576 1.00 0.00 C ATOM 873 CG GLN A 62 -6.871 -8.343 12.056 1.00 0.00 C ATOM 874 CD GLN A 62 -6.878 -9.586 12.925 1.00 0.00 C ATOM 875 OE1 GLN A 62 -7.316 -10.654 12.498 1.00 0.00 O ATOM 876 NE2 GLN A 62 -6.391 -9.451 14.153 1.00 0.00 N ATOM 0 H GLN A 62 -8.388 -10.311 9.063 1.00 0.00 H new ATOM 0 HA GLN A 62 -8.604 -7.628 10.301 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -6.481 -9.717 10.463 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -5.915 -8.086 10.159 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -6.046 -7.698 12.358 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.791 -7.783 12.222 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.038 -8.546 14.465 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -6.370 -10.252 14.784 1.00 0.00 H new ATOM 885 N GLU A 63 -7.469 -6.494 8.333 1.00 0.00 N ATOM 886 CA GLU A 63 -7.116 -5.833 7.082 1.00 0.00 C ATOM 887 C GLU A 63 -6.095 -4.724 7.316 1.00 0.00 C ATOM 888 O GLU A 63 -6.314 -3.825 8.129 1.00 0.00 O ATOM 889 CB GLU A 63 -8.366 -5.260 6.412 1.00 0.00 C ATOM 890 CG GLU A 63 -9.052 -6.235 5.470 1.00 0.00 C ATOM 891 CD GLU A 63 -10.312 -5.660 4.852 1.00 0.00 C ATOM 892 OE1 GLU A 63 -11.365 -5.679 5.524 1.00 0.00 O ATOM 893 OE2 GLU A 63 -10.245 -5.190 3.697 1.00 0.00 O ATOM 0 H GLU A 63 -7.569 -5.864 9.129 1.00 0.00 H new ATOM 0 HA GLU A 63 -6.668 -6.577 6.424 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.073 -4.954 7.183 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.092 -4.363 5.857 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -8.359 -6.517 4.677 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.302 -7.146 6.014 1.00 0.00 H new ATOM 900 N HIS A 64 -4.979 -4.793 6.597 1.00 0.00 N ATOM 901 CA HIS A 64 -3.922 -3.795 6.722 1.00 0.00 C ATOM 902 C HIS A 64 -3.437 -3.345 5.348 1.00 0.00 C ATOM 903 O HIS A 64 -3.192 -4.167 4.466 1.00 0.00 O ATOM 904 CB HIS A 64 -2.751 -4.360 7.528 1.00 0.00 C ATOM 905 CG HIS A 64 -2.944 -4.265 9.010 1.00 0.00 C ATOM 906 ND1 HIS A 64 -3.725 -5.147 9.726 1.00 0.00 N ATOM 907 CD2 HIS A 64 -2.451 -3.384 9.913 1.00 0.00 C ATOM 908 CE1 HIS A 64 -3.705 -4.813 11.004 1.00 0.00 C ATOM 909 NE2 HIS A 64 -2.939 -3.747 11.144 1.00 0.00 N ATOM 0 H HIS A 64 -4.783 -5.531 5.921 1.00 0.00 H new ATOM 0 HA HIS A 64 -4.331 -2.931 7.246 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -2.603 -5.405 7.255 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -1.841 -3.827 7.253 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -1.796 -2.551 9.704 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -4.227 -5.325 11.799 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -2.742 -3.270 12.024 1.00 0.00 H new ATOM 917 N THR A 65 -3.305 -2.035 5.170 1.00 0.00 N ATOM 918 CA THR A 65 -2.854 -1.477 3.900 1.00 0.00 C ATOM 919 C THR A 65 -1.694 -0.507 4.107 1.00 0.00 C ATOM 920 O THR A 65 -1.583 0.127 5.156 1.00 0.00 O ATOM 921 CB THR A 65 -4.011 -0.766 3.193 1.00 0.00 C ATOM 922 OG1 THR A 65 -4.992 -0.353 4.127 1.00 0.00 O ATOM 923 CG2 THR A 65 -4.700 -1.627 2.157 1.00 0.00 C ATOM 0 H THR A 65 -3.504 -1.340 5.889 1.00 0.00 H new ATOM 0 HA THR A 65 -2.505 -2.299 3.276 1.00 0.00 H new ATOM 0 HB THR A 65 -3.559 0.089 2.690 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.722 0.101 3.656 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.510 -1.062 1.695 1.00 0.00 H new ATOM 0 HG22 THR A 65 -3.981 -1.922 1.393 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.107 -2.518 2.636 1.00 0.00 H new ATOM 931 N MET A 66 -0.830 -0.398 3.103 1.00 0.00 N ATOM 932 CA MET A 66 0.320 0.499 3.183 1.00 0.00 C ATOM 933 C MET A 66 0.855 0.832 1.793 1.00 0.00 C ATOM 934 O MET A 66 1.037 -0.055 0.960 1.00 0.00 O ATOM 935 CB MET A 66 1.427 -0.133 4.030 1.00 0.00 C ATOM 936 CG MET A 66 2.667 0.737 4.159 1.00 0.00 C ATOM 937 SD MET A 66 3.785 0.165 5.454 1.00 0.00 S ATOM 938 CE MET A 66 3.033 0.908 6.899 1.00 0.00 C ATOM 0 H MET A 66 -0.903 -0.917 2.228 1.00 0.00 H new ATOM 0 HA MET A 66 -0.008 1.425 3.655 1.00 0.00 H new ATOM 0 HB2 MET A 66 1.036 -0.343 5.025 1.00 0.00 H new ATOM 0 HB3 MET A 66 1.709 -1.089 3.590 1.00 0.00 H new ATOM 0 HG2 MET A 66 3.197 0.751 3.207 1.00 0.00 H new ATOM 0 HG3 MET A 66 2.366 1.763 4.371 1.00 0.00 H new ATOM 0 HE1 MET A 66 3.474 0.481 7.799 1.00 0.00 H new ATOM 0 HE2 MET A 66 3.205 1.984 6.886 1.00 0.00 H new ATOM 0 HE3 MET A 66 1.961 0.712 6.893 1.00 0.00 H new ATOM 948 N TYR A 67 1.114 2.112 1.546 1.00 0.00 N ATOM 949 CA TYR A 67 1.634 2.537 0.253 1.00 0.00 C ATOM 950 C TYR A 67 3.083 2.099 0.088 1.00 0.00 C ATOM 951 O TYR A 67 3.911 2.304 0.975 1.00 0.00 O ATOM 952 CB TYR A 67 1.516 4.053 0.083 1.00 0.00 C ATOM 953 CG TYR A 67 1.007 4.454 -1.283 1.00 0.00 C ATOM 954 CD1 TYR A 67 -0.338 4.328 -1.604 1.00 0.00 C ATOM 955 CD2 TYR A 67 1.872 4.938 -2.258 1.00 0.00 C ATOM 956 CE1 TYR A 67 -0.807 4.672 -2.858 1.00 0.00 C ATOM 957 CE2 TYR A 67 1.408 5.290 -3.510 1.00 0.00 C ATOM 958 CZ TYR A 67 0.070 5.153 -3.806 1.00 0.00 C ATOM 959 OH TYR A 67 -0.392 5.491 -5.057 1.00 0.00 O ATOM 0 H TYR A 67 0.974 2.866 2.218 1.00 0.00 H new ATOM 0 HA TYR A 67 1.034 2.060 -0.522 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.845 4.448 0.846 1.00 0.00 H new ATOM 0 HB3 TYR A 67 2.492 4.509 0.250 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.029 3.955 -0.862 1.00 0.00 H new ATOM 0 HD2 TYR A 67 2.923 5.040 -2.033 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -1.855 4.564 -3.094 1.00 0.00 H new ATOM 0 HE2 TYR A 67 2.092 5.671 -4.254 1.00 0.00 H new ATOM 0 HH TYR A 67 0.354 5.814 -5.605 1.00 0.00 H new ATOM 969 N LEU A 68 3.376 1.480 -1.049 1.00 0.00 N ATOM 970 CA LEU A 68 4.719 0.993 -1.332 1.00 0.00 C ATOM 971 C LEU A 68 5.310 1.681 -2.560 1.00 0.00 C ATOM 972 O LEU A 68 4.975 1.336 -3.693 1.00 0.00 O ATOM 973 CB LEU A 68 4.683 -0.524 -1.546 1.00 0.00 C ATOM 974 CG LEU A 68 5.988 -1.150 -2.044 1.00 0.00 C ATOM 975 CD1 LEU A 68 6.141 -2.563 -1.503 1.00 0.00 C ATOM 976 CD2 LEU A 68 6.038 -1.151 -3.566 1.00 0.00 C ATOM 0 H LEU A 68 2.699 1.303 -1.791 1.00 0.00 H new ATOM 0 HA LEU A 68 5.355 1.226 -0.478 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.408 -1.000 -0.605 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.894 -0.754 -2.262 1.00 0.00 H new ATOM 0 HG LEU A 68 6.819 -0.548 -1.676 1.00 0.00 H new ATOM 0 HD11 LEU A 68 7.074 -2.993 -1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 68 6.155 -2.536 -0.413 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.304 -3.174 -1.840 1.00 0.00 H new ATOM 0 HD21 LEU A 68 6.974 -1.600 -3.899 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.199 -1.727 -3.957 1.00 0.00 H new ATOM 0 HD23 LEU A 68 5.977 -0.126 -3.933 1.00 0.00 H new ATOM 988 N ASN A 69 6.201 2.643 -2.332 1.00 0.00 N ATOM 989 CA ASN A 69 6.844 3.354 -3.433 1.00 0.00 C ATOM 990 C ASN A 69 8.343 3.451 -3.212 1.00 0.00 C ATOM 991 O ASN A 69 8.816 4.270 -2.424 1.00 0.00 O ATOM 992 CB ASN A 69 6.256 4.753 -3.607 1.00 0.00 C ATOM 993 CG ASN A 69 6.384 5.598 -2.359 1.00 0.00 C ATOM 994 OD1 ASN A 69 5.832 5.269 -1.310 1.00 0.00 O ATOM 995 ND2 ASN A 69 7.118 6.698 -2.469 1.00 0.00 N ATOM 0 H ASN A 69 6.492 2.946 -1.403 1.00 0.00 H new ATOM 0 HA ASN A 69 6.657 2.784 -4.343 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.759 5.254 -4.434 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.204 4.669 -3.878 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.243 7.310 -1.663 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.557 6.931 -3.360 1.00 0.00 H new ATOM 1002 N ALA A 70 9.085 2.610 -3.916 1.00 0.00 N ATOM 1003 CA ALA A 70 10.534 2.599 -3.799 1.00 0.00 C ATOM 1004 C ALA A 70 11.166 1.738 -4.887 1.00 0.00 C ATOM 1005 O ALA A 70 10.464 1.156 -5.718 1.00 0.00 O ATOM 1006 CB ALA A 70 10.945 2.121 -2.415 1.00 0.00 C ATOM 0 H ALA A 70 8.708 1.927 -4.573 1.00 0.00 H new ATOM 0 HA ALA A 70 10.899 3.617 -3.934 1.00 0.00 H new ATOM 0 HB1 ALA A 70 12.032 2.117 -2.339 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.531 2.791 -1.661 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.566 1.112 -2.251 1.00 0.00 H new ATOM 1012 N LYS A 71 12.494 1.665 -4.876 1.00 0.00 N ATOM 1013 CA LYS A 71 13.230 0.874 -5.856 1.00 0.00 C ATOM 1014 C LYS A 71 14.049 -0.213 -5.166 1.00 0.00 C ATOM 1015 O LYS A 71 14.521 -0.029 -4.045 1.00 0.00 O ATOM 1016 CB LYS A 71 14.152 1.774 -6.679 1.00 0.00 C ATOM 1017 CG LYS A 71 14.861 1.047 -7.810 1.00 0.00 C ATOM 1018 CD LYS A 71 15.749 1.988 -8.608 1.00 0.00 C ATOM 1019 CE LYS A 71 17.047 1.314 -9.019 1.00 0.00 C ATOM 1020 NZ LYS A 71 18.150 2.298 -9.205 1.00 0.00 N ATOM 0 H LYS A 71 13.084 2.146 -4.197 1.00 0.00 H new ATOM 0 HA LYS A 71 12.509 0.399 -6.521 1.00 0.00 H new ATOM 0 HB2 LYS A 71 13.568 2.595 -7.096 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.898 2.217 -6.019 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.464 0.236 -7.401 1.00 0.00 H new ATOM 0 HG3 LYS A 71 14.123 0.593 -8.471 1.00 0.00 H new ATOM 0 HD2 LYS A 71 15.216 2.326 -9.497 1.00 0.00 H new ATOM 0 HD3 LYS A 71 15.970 2.874 -8.012 1.00 0.00 H new ATOM 0 HE2 LYS A 71 17.334 0.586 -8.260 1.00 0.00 H new ATOM 0 HE3 LYS A 71 16.892 0.763 -9.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.018 1.798 -9.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 17.887 2.978 -9.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.316 2.806 -8.313 1.00 0.00 H new ATOM 1034 N VAL A 72 14.219 -1.345 -5.844 1.00 0.00 N ATOM 1035 CA VAL A 72 14.987 -2.455 -5.292 1.00 0.00 C ATOM 1036 C VAL A 72 16.411 -2.460 -5.838 1.00 0.00 C ATOM 1037 O VAL A 72 16.639 -2.149 -7.007 1.00 0.00 O ATOM 1038 CB VAL A 72 14.329 -3.815 -5.600 1.00 0.00 C ATOM 1039 CG1 VAL A 72 13.133 -4.053 -4.691 1.00 0.00 C ATOM 1040 CG2 VAL A 72 13.922 -3.897 -7.064 1.00 0.00 C ATOM 0 H VAL A 72 13.836 -1.517 -6.774 1.00 0.00 H new ATOM 0 HA VAL A 72 15.010 -2.312 -4.212 1.00 0.00 H new ATOM 0 HB VAL A 72 15.061 -4.599 -5.408 1.00 0.00 H new ATOM 0 HG11 VAL A 72 12.684 -5.018 -4.926 1.00 0.00 H new ATOM 0 HG12 VAL A 72 13.460 -4.048 -3.651 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.397 -3.264 -4.844 1.00 0.00 H new ATOM 0 HG21 VAL A 72 13.460 -4.865 -7.260 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.210 -3.103 -7.289 1.00 0.00 H new ATOM 0 HG23 VAL A 72 14.804 -3.782 -7.694 1.00 0.00 H new ATOM 1050 N GLY A 73 17.365 -2.814 -4.984 1.00 0.00 N ATOM 1051 CA GLY A 73 18.755 -2.852 -5.400 1.00 0.00 C ATOM 1052 C GLY A 73 19.702 -2.412 -4.301 1.00 0.00 C ATOM 1053 O GLY A 73 20.440 -3.226 -3.746 1.00 0.00 O ATOM 0 H GLY A 73 17.201 -3.075 -4.012 1.00 0.00 H new ATOM 0 HA2 GLY A 73 19.010 -3.865 -5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 73 18.888 -2.208 -6.269 1.00 0.00 H new ATOM 1562 N MET A 109 -7.720 0.482 -4.075 1.00 0.00 N ATOM 1563 CA MET A 109 -7.512 1.850 -3.624 1.00 0.00 C ATOM 1564 C MET A 109 -6.085 2.298 -3.911 1.00 0.00 C ATOM 1565 O MET A 109 -5.157 1.489 -3.910 1.00 0.00 O ATOM 1566 CB MET A 109 -7.815 1.957 -2.125 1.00 0.00 C ATOM 1567 CG MET A 109 -6.709 2.602 -1.306 1.00 0.00 C ATOM 1568 SD MET A 109 -7.179 2.867 0.414 1.00 0.00 S ATOM 1569 CE MET A 109 -7.545 4.620 0.397 1.00 0.00 C ATOM 0 HA MET A 109 -8.191 2.506 -4.170 1.00 0.00 H new ATOM 0 HB2 MET A 109 -8.732 2.532 -1.992 1.00 0.00 H new ATOM 0 HB3 MET A 109 -8.006 0.958 -1.733 1.00 0.00 H new ATOM 0 HG2 MET A 109 -5.821 1.971 -1.342 1.00 0.00 H new ATOM 0 HG3 MET A 109 -6.440 3.558 -1.756 1.00 0.00 H new ATOM 0 HE1 MET A 109 -7.005 5.112 1.206 1.00 0.00 H new ATOM 0 HE2 MET A 109 -7.237 5.047 -0.557 1.00 0.00 H new ATOM 0 HE3 MET A 109 -8.616 4.769 0.532 1.00 0.00 H new ATOM 1579 N SER A 110 -5.916 3.591 -4.141 1.00 0.00 N ATOM 1580 CA SER A 110 -4.601 4.145 -4.412 1.00 0.00 C ATOM 1581 C SER A 110 -4.577 5.642 -4.115 1.00 0.00 C ATOM 1582 O SER A 110 -5.610 6.235 -3.797 1.00 0.00 O ATOM 1583 CB SER A 110 -4.199 3.905 -5.866 1.00 0.00 C ATOM 1584 OG SER A 110 -3.782 2.565 -6.068 1.00 0.00 O ATOM 0 H SER A 110 -6.673 4.275 -4.145 1.00 0.00 H new ATOM 0 HA SER A 110 -3.887 3.641 -3.761 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.041 4.129 -6.521 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.392 4.585 -6.140 1.00 0.00 H new ATOM 0 HG SER A 110 -4.095 2.009 -5.324 1.00 0.00 H new ATOM 1590 N VAL A 111 -3.401 6.253 -4.231 1.00 0.00 N ATOM 1591 CA VAL A 111 -3.264 7.684 -3.986 1.00 0.00 C ATOM 1592 C VAL A 111 -2.975 8.436 -5.283 1.00 0.00 C ATOM 1593 O VAL A 111 -2.243 7.952 -6.146 1.00 0.00 O ATOM 1594 CB VAL A 111 -2.162 8.001 -2.945 1.00 0.00 C ATOM 1595 CG1 VAL A 111 -2.221 7.032 -1.770 1.00 0.00 C ATOM 1596 CG2 VAL A 111 -0.775 7.995 -3.579 1.00 0.00 C ATOM 0 H VAL A 111 -2.535 5.782 -4.492 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.217 8.020 -3.578 1.00 0.00 H new ATOM 0 HB VAL A 111 -2.351 9.006 -2.568 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.436 7.279 -1.055 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.193 7.110 -1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.076 6.014 -2.131 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -0.027 8.221 -2.819 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.574 7.012 -4.005 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.732 8.747 -4.366 1.00 0.00 H new ATOM 1606 N LYS A 112 -3.559 9.620 -5.410 1.00 0.00 N ATOM 1607 CA LYS A 112 -3.372 10.446 -6.594 1.00 0.00 C ATOM 1608 C LYS A 112 -2.382 11.569 -6.314 1.00 0.00 C ATOM 1609 O LYS A 112 -2.114 11.898 -5.159 1.00 0.00 O ATOM 1610 CB LYS A 112 -4.712 11.031 -7.041 1.00 0.00 C ATOM 1611 CG LYS A 112 -4.858 11.138 -8.550 1.00 0.00 C ATOM 1612 CD LYS A 112 -4.611 12.557 -9.036 1.00 0.00 C ATOM 1613 CE LYS A 112 -5.566 12.936 -10.157 1.00 0.00 C ATOM 1614 NZ LYS A 112 -5.267 14.286 -10.709 1.00 0.00 N ATOM 0 H LYS A 112 -4.169 10.031 -4.703 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.970 9.821 -7.392 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -5.518 10.410 -6.650 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -4.831 12.022 -6.602 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -4.155 10.460 -9.033 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -5.859 10.821 -8.843 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.729 13.253 -8.205 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -3.583 12.649 -9.386 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -5.502 12.196 -10.954 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.590 12.915 -9.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -5.860 14.458 -11.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -5.467 15.008 -9.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -4.264 14.336 -10.980 1.00 0.00 H new ATOM 1628 N GLU A 113 -1.844 12.158 -7.376 1.00 0.00 N ATOM 1629 CA GLU A 113 -0.888 13.249 -7.238 1.00 0.00 C ATOM 1630 C GLU A 113 -1.341 14.467 -8.028 1.00 0.00 C ATOM 1631 O GLU A 113 -1.401 14.444 -9.257 1.00 0.00 O ATOM 1632 CB GLU A 113 0.503 12.805 -7.692 1.00 0.00 C ATOM 1633 CG GLU A 113 1.356 12.250 -6.563 1.00 0.00 C ATOM 1634 CD GLU A 113 2.811 12.087 -6.956 1.00 0.00 C ATOM 1635 OE1 GLU A 113 3.239 12.738 -7.932 1.00 0.00 O ATOM 1636 OE2 GLU A 113 3.523 11.308 -6.288 1.00 0.00 O ATOM 0 H GLU A 113 -2.053 11.899 -8.340 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.837 13.524 -6.185 1.00 0.00 H new ATOM 0 HB2 GLU A 113 0.399 12.045 -8.467 1.00 0.00 H new ATOM 0 HB3 GLU A 113 1.018 13.653 -8.144 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.289 12.915 -5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.957 11.284 -6.253 1.00 0.00 H new ATOM 1643 N VAL A 114 -1.670 15.524 -7.302 1.00 0.00 N ATOM 1644 CA VAL A 114 -2.136 16.764 -7.905 1.00 0.00 C ATOM 1645 C VAL A 114 -1.251 17.932 -7.486 1.00 0.00 C ATOM 1646 O VAL A 114 -0.265 17.749 -6.777 1.00 0.00 O ATOM 1647 CB VAL A 114 -3.599 17.077 -7.522 1.00 0.00 C ATOM 1648 CG1 VAL A 114 -4.287 17.878 -8.618 1.00 0.00 C ATOM 1649 CG2 VAL A 114 -4.374 15.801 -7.237 1.00 0.00 C ATOM 0 H VAL A 114 -1.622 15.547 -6.283 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.082 16.629 -8.985 1.00 0.00 H new ATOM 0 HB VAL A 114 -3.582 17.678 -6.613 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -5.316 18.086 -8.325 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -3.756 18.818 -8.770 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -4.282 17.305 -9.545 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -5.401 16.051 -6.970 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.374 15.169 -8.125 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.904 15.267 -6.411 1.00 0.00 H new ATOM 1659 N SER A 115 -1.614 19.125 -7.950 1.00 0.00 N ATOM 1660 CA SER A 115 -0.882 20.359 -7.664 1.00 0.00 C ATOM 1661 C SER A 115 -0.196 20.351 -6.295 1.00 0.00 C ATOM 1662 O SER A 115 -0.741 20.854 -5.313 1.00 0.00 O ATOM 1663 CB SER A 115 -1.861 21.526 -7.725 1.00 0.00 C ATOM 1664 OG SER A 115 -1.262 22.673 -8.303 1.00 0.00 O ATOM 0 H SER A 115 -2.433 19.265 -8.542 1.00 0.00 H new ATOM 0 HA SER A 115 -0.094 20.453 -8.411 1.00 0.00 H new ATOM 0 HB2 SER A 115 -2.737 21.238 -8.307 1.00 0.00 H new ATOM 0 HB3 SER A 115 -2.210 21.763 -6.720 1.00 0.00 H new ATOM 0 HG SER A 115 -1.914 23.404 -8.330 1.00 0.00 H new ATOM 1670 N GLY A 116 1.010 19.797 -6.249 1.00 0.00 N ATOM 1671 CA GLY A 116 1.766 19.755 -5.009 1.00 0.00 C ATOM 1672 C GLY A 116 1.014 19.062 -3.895 1.00 0.00 C ATOM 1673 O GLY A 116 1.235 19.345 -2.718 1.00 0.00 O ATOM 0 H GLY A 116 1.480 19.375 -7.050 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.711 19.239 -5.181 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.009 20.772 -4.701 1.00 0.00 H new ATOM 1677 N LYS A 117 0.102 18.174 -4.263 1.00 0.00 N ATOM 1678 CA LYS A 117 -0.705 17.467 -3.282 1.00 0.00 C ATOM 1679 C LYS A 117 -0.771 15.972 -3.569 1.00 0.00 C ATOM 1680 O LYS A 117 -0.298 15.498 -4.602 1.00 0.00 O ATOM 1681 CB LYS A 117 -2.118 18.045 -3.281 1.00 0.00 C ATOM 1682 CG LYS A 117 -2.211 19.448 -2.707 1.00 0.00 C ATOM 1683 CD LYS A 117 -3.546 20.094 -3.043 1.00 0.00 C ATOM 1684 CE LYS A 117 -3.728 20.263 -4.546 1.00 0.00 C ATOM 1685 NZ LYS A 117 -5.130 20.619 -4.903 1.00 0.00 N ATOM 0 H LYS A 117 -0.097 17.927 -5.232 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.237 17.598 -2.306 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.496 18.056 -4.303 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -2.769 17.385 -2.708 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -2.085 19.410 -1.625 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -1.399 20.059 -3.101 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -4.356 19.483 -2.645 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -3.612 21.067 -2.557 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -3.054 21.039 -4.908 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -3.449 19.338 -5.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -5.461 19.998 -5.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -5.742 20.498 -4.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -5.167 21.609 -5.219 1.00 0.00 H new ATOM 1699 N VAL A 118 -1.383 15.242 -2.642 1.00 0.00 N ATOM 1700 CA VAL A 118 -1.549 13.802 -2.772 1.00 0.00 C ATOM 1701 C VAL A 118 -2.906 13.380 -2.219 1.00 0.00 C ATOM 1702 O VAL A 118 -3.147 13.444 -1.013 1.00 0.00 O ATOM 1703 CB VAL A 118 -0.432 13.030 -2.045 1.00 0.00 C ATOM 1704 CG1 VAL A 118 0.927 13.377 -2.632 1.00 0.00 C ATOM 1705 CG2 VAL A 118 -0.465 13.318 -0.553 1.00 0.00 C ATOM 0 H VAL A 118 -1.775 15.631 -1.785 1.00 0.00 H new ATOM 0 HA VAL A 118 -1.491 13.559 -3.833 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.603 11.963 -2.188 1.00 0.00 H new ATOM 0 HG11 VAL A 118 1.703 12.822 -2.105 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.945 13.112 -3.689 1.00 0.00 H new ATOM 0 HG13 VAL A 118 1.108 14.446 -2.523 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.332 12.763 -0.058 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.322 14.386 -0.385 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.428 13.012 -0.145 1.00 0.00 H new ATOM 1715 N PHE A 119 -3.794 12.966 -3.112 1.00 0.00 N ATOM 1716 CA PHE A 119 -5.138 12.551 -2.728 1.00 0.00 C ATOM 1717 C PHE A 119 -5.272 11.036 -2.765 1.00 0.00 C ATOM 1718 O PHE A 119 -4.332 10.332 -3.129 1.00 0.00 O ATOM 1719 CB PHE A 119 -6.169 13.212 -3.644 1.00 0.00 C ATOM 1720 CG PHE A 119 -6.007 14.706 -3.722 1.00 0.00 C ATOM 1721 CD1 PHE A 119 -4.900 15.259 -4.342 1.00 0.00 C ATOM 1722 CD2 PHE A 119 -6.953 15.556 -3.170 1.00 0.00 C ATOM 1723 CE1 PHE A 119 -4.735 16.627 -4.411 1.00 0.00 C ATOM 1724 CE2 PHE A 119 -6.795 16.930 -3.238 1.00 0.00 C ATOM 1725 CZ PHE A 119 -5.681 17.466 -3.860 1.00 0.00 C ATOM 0 H PHE A 119 -3.607 12.908 -4.113 1.00 0.00 H new ATOM 0 HA PHE A 119 -5.322 12.873 -1.703 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -6.083 12.789 -4.645 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -7.171 12.978 -3.284 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.155 14.610 -4.778 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -7.823 15.142 -2.682 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -3.864 17.041 -4.897 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -7.540 17.582 -2.806 1.00 0.00 H new ATOM 0 HZ PHE A 119 -5.553 18.537 -3.914 1.00 0.00 H new ATOM 1735 N LEU A 120 -6.432 10.535 -2.361 1.00 0.00 N ATOM 1736 CA LEU A 120 -6.660 9.098 -2.332 1.00 0.00 C ATOM 1737 C LEU A 120 -8.075 8.736 -2.773 1.00 0.00 C ATOM 1738 O LEU A 120 -8.942 9.601 -2.911 1.00 0.00 O ATOM 1739 CB LEU A 120 -6.403 8.567 -0.921 1.00 0.00 C ATOM 1740 CG LEU A 120 -5.018 7.957 -0.701 1.00 0.00 C ATOM 1741 CD1 LEU A 120 -4.341 8.592 0.505 1.00 0.00 C ATOM 1742 CD2 LEU A 120 -5.118 6.449 -0.526 1.00 0.00 C ATOM 0 H LEU A 120 -7.224 11.098 -2.051 1.00 0.00 H new ATOM 0 HA LEU A 120 -5.968 8.636 -3.036 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -6.541 9.383 -0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -7.156 7.813 -0.690 1.00 0.00 H new ATOM 0 HG LEU A 120 -4.410 8.159 -1.583 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.357 8.146 0.646 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.233 9.664 0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -4.948 8.422 1.394 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.122 6.034 -0.371 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -5.744 6.224 0.338 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -5.560 6.008 -1.419 1.00 0.00 H new ATOM 1754 N GLN A 121 -8.293 7.440 -2.979 1.00 0.00 N ATOM 1755 CA GLN A 121 -9.595 6.928 -3.389 1.00 0.00 C ATOM 1756 C GLN A 121 -10.077 5.875 -2.396 1.00 0.00 C ATOM 1757 O GLN A 121 -9.337 5.486 -1.493 1.00 0.00 O ATOM 1758 CB GLN A 121 -9.516 6.328 -4.795 1.00 0.00 C ATOM 1759 CG GLN A 121 -9.027 7.309 -5.848 1.00 0.00 C ATOM 1760 CD GLN A 121 -7.519 7.464 -5.846 1.00 0.00 C ATOM 1761 OE1 GLN A 121 -6.985 8.452 -5.342 1.00 0.00 O ATOM 1762 NE2 GLN A 121 -6.823 6.484 -6.411 1.00 0.00 N ATOM 0 H GLN A 121 -7.578 6.721 -2.867 1.00 0.00 H new ATOM 0 HA GLN A 121 -10.306 7.754 -3.404 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -8.849 5.466 -4.776 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -10.502 5.962 -5.081 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -9.352 6.972 -6.832 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -9.489 8.281 -5.675 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -7.307 5.683 -6.817 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -5.805 6.532 -6.439 1.00 0.00 H new ATOM 1771 N CYS A 122 -11.314 5.417 -2.557 1.00 0.00 N ATOM 1772 CA CYS A 122 -11.866 4.414 -1.653 1.00 0.00 C ATOM 1773 C CYS A 122 -13.010 3.642 -2.307 1.00 0.00 C ATOM 1774 O CYS A 122 -13.377 3.905 -3.452 1.00 0.00 O ATOM 1775 CB CYS A 122 -12.350 5.087 -0.363 1.00 0.00 C ATOM 1776 SG CYS A 122 -12.335 4.014 1.113 1.00 0.00 S ATOM 0 H CYS A 122 -11.948 5.720 -3.297 1.00 0.00 H new ATOM 0 HA CYS A 122 -11.077 3.700 -1.415 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -11.725 5.958 -0.168 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -13.365 5.452 -0.519 1.00 0.00 H new ATOM 1781 N GLN A 123 -13.567 2.686 -1.567 1.00 0.00 N ATOM 1782 CA GLN A 123 -14.665 1.868 -2.062 1.00 0.00 C ATOM 1783 C GLN A 123 -16.003 2.394 -1.552 1.00 0.00 C ATOM 1784 O GLN A 123 -16.179 2.611 -0.353 1.00 0.00 O ATOM 1785 CB GLN A 123 -14.471 0.414 -1.621 1.00 0.00 C ATOM 1786 CG GLN A 123 -14.572 0.211 -0.118 1.00 0.00 C ATOM 1787 CD GLN A 123 -13.737 -0.960 0.364 1.00 0.00 C ATOM 1788 OE1 GLN A 123 -12.526 -0.839 0.549 1.00 0.00 O ATOM 1789 NE2 GLN A 123 -14.381 -2.104 0.567 1.00 0.00 N ATOM 0 H GLN A 123 -13.272 2.460 -0.617 1.00 0.00 H new ATOM 0 HA GLN A 123 -14.669 1.916 -3.151 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -15.218 -0.208 -2.113 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -13.495 0.068 -1.960 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -14.248 1.119 0.391 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -15.615 0.047 0.155 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -15.386 -2.160 0.401 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -13.871 -2.926 0.889 1.00 0.00 H new ATOM 1919 N TYR A 132 -16.347 8.123 -0.824 1.00 0.00 N ATOM 1920 CA TYR A 132 -14.993 7.904 -0.328 1.00 0.00 C ATOM 1921 C TYR A 132 -14.964 7.906 1.197 1.00 0.00 C ATOM 1922 O TYR A 132 -15.041 8.960 1.828 1.00 0.00 O ATOM 1923 CB TYR A 132 -14.048 8.980 -0.868 1.00 0.00 C ATOM 1924 CG TYR A 132 -13.891 8.952 -2.372 1.00 0.00 C ATOM 1925 CD1 TYR A 132 -14.979 9.169 -3.208 1.00 0.00 C ATOM 1926 CD2 TYR A 132 -12.653 8.710 -2.955 1.00 0.00 C ATOM 1927 CE1 TYR A 132 -14.839 9.145 -4.582 1.00 0.00 C ATOM 1928 CE2 TYR A 132 -12.505 8.684 -4.329 1.00 0.00 C ATOM 1929 CZ TYR A 132 -13.600 8.902 -5.138 1.00 0.00 C ATOM 1930 OH TYR A 132 -13.456 8.877 -6.506 1.00 0.00 O ATOM 0 HA TYR A 132 -14.659 6.927 -0.679 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -14.419 9.960 -0.568 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -13.068 8.855 -0.407 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -15.951 9.360 -2.776 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -11.793 8.540 -2.325 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -15.695 9.316 -5.218 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -11.536 8.494 -4.767 1.00 0.00 H new ATOM 0 HH TYR A 132 -12.520 8.694 -6.733 1.00 0.00 H new ATOM 1940 N LEU A 133 -14.851 6.719 1.783 1.00 0.00 N ATOM 1941 CA LEU A 133 -14.810 6.583 3.234 1.00 0.00 C ATOM 1942 C LEU A 133 -13.373 6.624 3.741 1.00 0.00 C ATOM 1943 O LEU A 133 -12.543 5.806 3.348 1.00 0.00 O ATOM 1944 CB LEU A 133 -15.477 5.277 3.665 1.00 0.00 C ATOM 1945 CG LEU A 133 -16.917 5.090 3.181 1.00 0.00 C ATOM 1946 CD1 LEU A 133 -17.743 6.338 3.455 1.00 0.00 C ATOM 1947 CD2 LEU A 133 -16.941 4.747 1.700 1.00 0.00 C ATOM 0 H LEU A 133 -14.786 5.837 1.275 1.00 0.00 H new ATOM 0 HA LEU A 133 -15.356 7.421 3.668 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -14.877 4.443 3.300 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -15.467 5.224 4.754 1.00 0.00 H new ATOM 0 HG LEU A 133 -17.359 4.261 3.734 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -18.763 6.184 3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -17.755 6.538 4.526 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.303 7.187 2.932 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.973 4.618 1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -16.479 5.554 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -16.388 3.823 1.532 1.00 0.00 H new ATOM 1959 N TRP A 134 -13.083 7.579 4.615 1.00 0.00 N ATOM 1960 CA TRP A 134 -11.743 7.719 5.169 1.00 0.00 C ATOM 1961 C TRP A 134 -11.794 7.906 6.683 1.00 0.00 C ATOM 1962 O TRP A 134 -12.318 8.905 7.175 1.00 0.00 O ATOM 1963 CB TRP A 134 -11.021 8.912 4.522 1.00 0.00 C ATOM 1964 CG TRP A 134 -10.088 9.629 5.449 1.00 0.00 C ATOM 1965 CD1 TRP A 134 -8.848 9.220 5.843 1.00 0.00 C ATOM 1966 CD2 TRP A 134 -10.328 10.877 6.104 1.00 0.00 C ATOM 1967 NE1 TRP A 134 -8.301 10.138 6.706 1.00 0.00 N ATOM 1968 CE2 TRP A 134 -9.189 11.167 6.879 1.00 0.00 C ATOM 1969 CE3 TRP A 134 -11.395 11.779 6.107 1.00 0.00 C ATOM 1970 CZ2 TRP A 134 -9.088 12.322 7.649 1.00 0.00 C ATOM 1971 CZ3 TRP A 134 -11.294 12.925 6.872 1.00 0.00 C ATOM 1972 CH2 TRP A 134 -10.147 13.188 7.633 1.00 0.00 C ATOM 0 H TRP A 134 -13.756 8.266 4.955 1.00 0.00 H new ATOM 0 HA TRP A 134 -11.192 6.804 4.952 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -10.459 8.559 3.657 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -11.765 9.618 4.152 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -8.367 8.308 5.523 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -7.384 10.066 7.146 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -12.282 11.584 5.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -8.206 12.527 8.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -12.112 13.630 6.884 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -10.098 14.094 8.219 1.00 0.00 H new ATOM 1983 N LYS A 135 -11.223 6.957 7.416 1.00 0.00 N ATOM 1984 CA LYS A 135 -11.184 7.050 8.868 1.00 0.00 C ATOM 1985 C LYS A 135 -9.736 6.998 9.348 1.00 0.00 C ATOM 1986 O LYS A 135 -9.042 5.999 9.159 1.00 0.00 O ATOM 1987 CB LYS A 135 -12.021 5.934 9.510 1.00 0.00 C ATOM 1988 CG LYS A 135 -12.447 6.241 10.936 1.00 0.00 C ATOM 1989 CD LYS A 135 -13.440 5.212 11.458 1.00 0.00 C ATOM 1990 CE LYS A 135 -12.970 4.560 12.750 1.00 0.00 C ATOM 1991 NZ LYS A 135 -12.188 5.493 13.610 1.00 0.00 N ATOM 0 H LYS A 135 -10.784 6.121 7.031 1.00 0.00 H new ATOM 0 HA LYS A 135 -11.619 8.002 9.174 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -12.910 5.762 8.903 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -11.445 5.008 9.502 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -11.569 6.261 11.582 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -12.896 7.234 10.977 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -14.404 5.693 11.626 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -13.595 4.443 10.701 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -13.835 4.198 13.306 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -12.357 3.691 12.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -12.181 5.140 14.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -11.212 5.554 13.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -12.625 6.437 13.585 1.00 0.00 H new ATOM 2005 N LYS A 136 -9.283 8.094 9.952 1.00 0.00 N ATOM 2006 CA LYS A 136 -7.911 8.195 10.442 1.00 0.00 C ATOM 2007 C LYS A 136 -7.779 7.607 11.842 1.00 0.00 C ATOM 2008 O LYS A 136 -8.704 7.688 12.650 1.00 0.00 O ATOM 2009 CB LYS A 136 -7.459 9.658 10.443 1.00 0.00 C ATOM 2010 CG LYS A 136 -6.339 9.949 9.455 1.00 0.00 C ATOM 2011 CD LYS A 136 -5.041 10.309 10.164 1.00 0.00 C ATOM 2012 CE LYS A 136 -4.432 11.584 9.603 1.00 0.00 C ATOM 2013 NZ LYS A 136 -3.883 11.382 8.234 1.00 0.00 N ATOM 0 H LYS A 136 -9.848 8.927 10.114 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.271 7.621 9.772 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -8.313 10.294 10.209 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -7.127 9.926 11.446 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -6.177 9.077 8.821 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -6.635 10.769 8.800 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -5.231 10.434 11.230 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -4.330 9.489 10.061 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -5.189 12.368 9.578 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -3.638 11.929 10.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -3.011 11.938 8.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.672 10.374 8.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -4.582 11.693 7.530 1.00 0.00 H new ATOM 2027 N GLY A 137 -6.618 7.019 12.124 1.00 0.00 N ATOM 2028 CA GLY A 137 -6.378 6.424 13.429 1.00 0.00 C ATOM 2029 C GLY A 137 -6.815 7.317 14.578 1.00 0.00 C ATOM 2030 O GLY A 137 -7.166 6.828 15.652 1.00 0.00 O ATOM 0 H GLY A 137 -5.838 6.944 11.471 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.909 5.474 13.492 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -5.316 6.203 13.532 1.00 0.00 H new ATOM 2034 N LYS A 138 -6.791 8.627 14.354 1.00 0.00 N ATOM 2035 CA LYS A 138 -7.186 9.586 15.382 1.00 0.00 C ATOM 2036 C LYS A 138 -8.466 10.326 14.993 1.00 0.00 C ATOM 2037 O LYS A 138 -9.143 10.900 15.845 1.00 0.00 O ATOM 2038 CB LYS A 138 -6.060 10.591 15.628 1.00 0.00 C ATOM 2039 CG LYS A 138 -5.726 11.440 14.412 1.00 0.00 C ATOM 2040 CD LYS A 138 -4.326 12.025 14.508 1.00 0.00 C ATOM 2041 CE LYS A 138 -3.633 12.037 13.155 1.00 0.00 C ATOM 2042 NZ LYS A 138 -2.151 12.008 13.289 1.00 0.00 N ATOM 0 H LYS A 138 -6.503 9.049 13.471 1.00 0.00 H new ATOM 0 HA LYS A 138 -7.381 9.029 16.299 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.343 11.246 16.452 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -5.166 10.053 15.942 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -5.807 10.833 13.510 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -6.453 12.247 14.320 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -4.381 13.041 14.899 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -3.735 11.443 15.215 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -3.961 11.177 12.572 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -3.930 12.929 12.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -1.717 12.017 12.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -1.834 12.842 13.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -1.865 11.144 13.793 1.00 0.00 H new ATOM 2056 N GLU A 139 -8.791 10.313 13.703 1.00 0.00 N ATOM 2057 CA GLU A 139 -9.985 10.985 13.207 1.00 0.00 C ATOM 2058 C GLU A 139 -10.987 9.971 12.671 1.00 0.00 C ATOM 2059 O GLU A 139 -10.626 9.067 11.919 1.00 0.00 O ATOM 2060 CB GLU A 139 -9.596 11.991 12.113 1.00 0.00 C ATOM 2061 CG GLU A 139 -10.691 12.277 11.087 1.00 0.00 C ATOM 2062 CD GLU A 139 -10.880 13.760 10.836 1.00 0.00 C ATOM 2063 OE1 GLU A 139 -9.902 14.423 10.429 1.00 0.00 O ATOM 2064 OE2 GLU A 139 -12.005 14.260 11.047 1.00 0.00 O ATOM 0 H GLU A 139 -8.242 9.843 12.983 1.00 0.00 H new ATOM 0 HA GLU A 139 -10.457 11.522 14.030 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.308 12.929 12.587 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.717 11.616 11.590 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -10.443 11.782 10.148 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -11.631 11.848 11.435 1.00 0.00 H new ATOM 2071 N GLU A 140 -12.249 10.130 13.052 1.00 0.00 N ATOM 2072 CA GLU A 140 -13.287 9.226 12.592 1.00 0.00 C ATOM 2073 C GLU A 140 -13.502 9.392 11.086 1.00 0.00 C ATOM 2074 O GLU A 140 -12.538 9.357 10.326 1.00 0.00 O ATOM 2075 CB GLU A 140 -14.585 9.435 13.374 1.00 0.00 C ATOM 2076 CG GLU A 140 -15.512 8.230 13.320 1.00 0.00 C ATOM 2077 CD GLU A 140 -16.623 8.300 14.349 1.00 0.00 C ATOM 2078 OE1 GLU A 140 -16.333 8.642 15.515 1.00 0.00 O ATOM 2079 OE2 GLU A 140 -17.784 8.013 13.990 1.00 0.00 O ATOM 0 H GLU A 140 -12.573 10.871 13.673 1.00 0.00 H new ATOM 0 HA GLU A 140 -12.964 8.201 12.776 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -14.345 9.655 14.414 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -15.106 10.306 12.976 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -15.949 8.157 12.324 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -14.931 7.322 13.480 1.00 0.00 H new ATOM 2086 N LEU A 141 -14.748 9.549 10.640 1.00 0.00 N ATOM 2087 CA LEU A 141 -15.012 9.678 9.217 1.00 0.00 C ATOM 2088 C LEU A 141 -15.263 11.119 8.795 1.00 0.00 C ATOM 2089 O LEU A 141 -15.201 12.050 9.598 1.00 0.00 O ATOM 2090 CB LEU A 141 -16.209 8.809 8.818 1.00 0.00 C ATOM 2091 CG LEU A 141 -15.866 7.370 8.429 1.00 0.00 C ATOM 2092 CD1 LEU A 141 -14.700 7.341 7.455 1.00 0.00 C ATOM 2093 CD2 LEU A 141 -15.541 6.555 9.668 1.00 0.00 C ATOM 0 H LEU A 141 -15.575 9.589 11.236 1.00 0.00 H new ATOM 0 HA LEU A 141 -14.116 9.337 8.699 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -16.914 8.786 9.649 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -16.719 9.284 7.980 1.00 0.00 H new ATOM 0 HG LEU A 141 -16.733 6.929 7.937 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -14.472 6.308 7.191 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -14.964 7.896 6.555 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -13.826 7.798 7.920 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -15.299 5.533 9.378 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -14.688 6.998 10.182 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -16.403 6.548 10.335 1.00 0.00 H new ATOM 2105 N GLY A 142 -15.541 11.270 7.508 1.00 0.00 N ATOM 2106 CA GLY A 142 -15.803 12.566 6.918 1.00 0.00 C ATOM 2107 C GLY A 142 -15.834 12.461 5.408 1.00 0.00 C ATOM 2108 O GLY A 142 -14.853 12.773 4.737 1.00 0.00 O ATOM 0 H GLY A 142 -15.590 10.495 6.847 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -16.755 12.953 7.282 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -15.033 13.274 7.224 1.00 0.00 H new ATOM 2112 N ASN A 143 -16.956 11.985 4.878 1.00 0.00 N ATOM 2113 CA ASN A 143 -17.111 11.790 3.439 1.00 0.00 C ATOM 2114 C ASN A 143 -16.616 12.992 2.640 1.00 0.00 C ATOM 2115 O ASN A 143 -16.839 14.143 3.017 1.00 0.00 O ATOM 2116 CB ASN A 143 -18.576 11.511 3.100 1.00 0.00 C ATOM 2117 CG ASN A 143 -19.519 12.503 3.752 1.00 0.00 C ATOM 2118 OD1 ASN A 143 -19.460 12.732 4.960 1.00 0.00 O ATOM 2119 ND2 ASN A 143 -20.398 13.098 2.953 1.00 0.00 N ATOM 0 H ASN A 143 -17.776 11.726 5.426 1.00 0.00 H new ATOM 0 HA ASN A 143 -16.499 10.932 3.160 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -18.709 11.545 2.019 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.835 10.502 3.422 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -21.059 13.774 3.336 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -20.412 12.878 1.957 1.00 0.00 H new ATOM 2126 N MET A 144 -15.940 12.705 1.530 1.00 0.00 N ATOM 2127 CA MET A 144 -15.403 13.744 0.659 1.00 0.00 C ATOM 2128 C MET A 144 -15.289 13.236 -0.776 1.00 0.00 C ATOM 2129 O MET A 144 -15.015 12.058 -1.005 1.00 0.00 O ATOM 2130 CB MET A 144 -14.029 14.198 1.160 1.00 0.00 C ATOM 2131 CG MET A 144 -13.012 13.069 1.270 1.00 0.00 C ATOM 2132 SD MET A 144 -12.597 12.664 2.975 1.00 0.00 S ATOM 2133 CE MET A 144 -13.435 11.091 3.151 1.00 0.00 C ATOM 0 H MET A 144 -15.751 11.754 1.212 1.00 0.00 H new ATOM 0 HA MET A 144 -16.087 14.592 0.677 1.00 0.00 H new ATOM 0 HB2 MET A 144 -13.640 14.961 0.485 1.00 0.00 H new ATOM 0 HB3 MET A 144 -14.145 14.666 2.137 1.00 0.00 H new ATOM 0 HG2 MET A 144 -13.408 12.181 0.777 1.00 0.00 H new ATOM 0 HG3 MET A 144 -12.104 13.352 0.738 1.00 0.00 H new ATOM 0 HE1 MET A 144 -13.521 10.841 4.208 1.00 0.00 H new ATOM 0 HE2 MET A 144 -14.430 11.158 2.712 1.00 0.00 H new ATOM 0 HE3 MET A 144 -12.864 10.316 2.640 1.00 0.00 H new ATOM 2143 N ARG A 145 -15.497 14.128 -1.742 1.00 0.00 N ATOM 2144 CA ARG A 145 -15.411 13.761 -3.153 1.00 0.00 C ATOM 2145 C ARG A 145 -14.075 13.086 -3.451 1.00 0.00 C ATOM 2146 O ARG A 145 -14.020 12.056 -4.122 1.00 0.00 O ATOM 2147 CB ARG A 145 -15.581 14.998 -4.037 1.00 0.00 C ATOM 2148 CG ARG A 145 -17.023 15.269 -4.433 1.00 0.00 C ATOM 2149 CD ARG A 145 -17.671 16.293 -3.516 1.00 0.00 C ATOM 2150 NE ARG A 145 -18.539 17.212 -4.248 1.00 0.00 N ATOM 2151 CZ ARG A 145 -18.094 18.138 -5.094 1.00 0.00 C ATOM 2152 NH1 ARG A 145 -16.792 18.270 -5.319 1.00 0.00 N ATOM 2153 NH2 ARG A 145 -18.952 18.933 -5.719 1.00 0.00 N ATOM 0 H ARG A 145 -15.726 15.108 -1.574 1.00 0.00 H new ATOM 0 HA ARG A 145 -16.214 13.058 -3.373 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -15.188 15.868 -3.510 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -14.982 14.875 -4.939 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -17.057 15.628 -5.462 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -17.591 14.339 -4.400 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -18.252 15.778 -2.751 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -16.896 16.860 -3.000 1.00 0.00 H new ATOM 0 HE ARG A 145 -19.546 17.140 -4.102 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -16.128 17.660 -4.842 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -16.456 18.981 -5.968 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -19.953 18.835 -5.551 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -18.611 19.643 -6.367 1.00 0.00 H new ATOM 2167 N GLN A 146 -13.004 13.673 -2.932 1.00 0.00 N ATOM 2168 CA GLN A 146 -11.662 13.136 -3.119 1.00 0.00 C ATOM 2169 C GLN A 146 -10.927 13.105 -1.785 1.00 0.00 C ATOM 2170 O GLN A 146 -10.959 14.077 -1.031 1.00 0.00 O ATOM 2171 CB GLN A 146 -10.883 13.980 -4.130 1.00 0.00 C ATOM 2172 CG GLN A 146 -11.022 13.494 -5.563 1.00 0.00 C ATOM 2173 CD GLN A 146 -10.891 14.616 -6.574 1.00 0.00 C ATOM 2174 OE1 GLN A 146 -11.885 15.090 -7.126 1.00 0.00 O ATOM 2175 NE2 GLN A 146 -9.660 15.048 -6.824 1.00 0.00 N ATOM 0 H GLN A 146 -13.040 14.527 -2.375 1.00 0.00 H new ATOM 0 HA GLN A 146 -11.742 12.120 -3.506 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -11.227 15.013 -4.070 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -9.828 13.979 -3.855 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -10.261 12.740 -5.762 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -11.991 13.010 -5.686 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -8.864 14.627 -6.344 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -9.510 15.801 -7.496 1.00 0.00 H new ATOM 2184 N LEU A 147 -10.279 11.985 -1.485 1.00 0.00 N ATOM 2185 CA LEU A 147 -9.561 11.852 -0.225 1.00 0.00 C ATOM 2186 C LEU A 147 -8.318 12.734 -0.195 1.00 0.00 C ATOM 2187 O LEU A 147 -7.325 12.455 -0.867 1.00 0.00 O ATOM 2188 CB LEU A 147 -9.168 10.396 0.029 1.00 0.00 C ATOM 2189 CG LEU A 147 -9.843 9.730 1.233 1.00 0.00 C ATOM 2190 CD1 LEU A 147 -9.193 8.387 1.530 1.00 0.00 C ATOM 2191 CD2 LEU A 147 -9.778 10.632 2.458 1.00 0.00 C ATOM 0 H LEU A 147 -10.236 11.165 -2.090 1.00 0.00 H new ATOM 0 HA LEU A 147 -10.235 12.180 0.566 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.400 9.814 -0.863 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.088 10.349 0.168 1.00 0.00 H new ATOM 0 HG LEU A 147 -10.892 9.564 0.986 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -9.684 7.927 2.388 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -9.292 7.735 0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.136 8.536 1.753 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -10.263 10.138 3.300 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.736 10.833 2.707 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -10.288 11.572 2.245 1.00 0.00 H new ATOM 2203 N ASP A 148 -8.378 13.788 0.608 1.00 0.00 N ATOM 2204 CA ASP A 148 -7.258 14.708 0.758 1.00 0.00 C ATOM 2205 C ASP A 148 -6.973 14.946 2.237 1.00 0.00 C ATOM 2206 O ASP A 148 -7.565 15.827 2.860 1.00 0.00 O ATOM 2207 CB ASP A 148 -7.561 16.037 0.062 1.00 0.00 C ATOM 2208 CG ASP A 148 -6.302 16.807 -0.284 1.00 0.00 C ATOM 2209 OD1 ASP A 148 -5.223 16.182 -0.353 1.00 0.00 O ATOM 2210 OD2 ASP A 148 -6.395 18.036 -0.486 1.00 0.00 O ATOM 0 H ASP A 148 -9.196 14.028 1.169 1.00 0.00 H new ATOM 0 HA ASP A 148 -6.378 14.264 0.293 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -8.129 15.846 -0.849 1.00 0.00 H new ATOM 0 HB3 ASP A 148 -8.191 16.648 0.709 1.00 0.00 H new ATOM 2215 N LEU A 149 -6.067 14.148 2.794 1.00 0.00 N ATOM 2216 CA LEU A 149 -5.707 14.262 4.204 1.00 0.00 C ATOM 2217 C LEU A 149 -4.204 14.473 4.358 1.00 0.00 C ATOM 2218 O LEU A 149 -3.619 14.121 5.382 1.00 0.00 O ATOM 2219 CB LEU A 149 -6.145 13.010 4.987 1.00 0.00 C ATOM 2220 CG LEU A 149 -7.215 12.143 4.311 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -8.409 12.990 3.897 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -6.622 11.412 3.115 1.00 0.00 C ATOM 0 H LEU A 149 -5.568 13.415 2.290 1.00 0.00 H new ATOM 0 HA LEU A 149 -6.229 15.127 4.614 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -5.266 12.392 5.170 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -6.521 13.326 5.960 1.00 0.00 H new ATOM 0 HG LEU A 149 -7.565 11.399 5.027 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -9.156 12.356 3.420 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -8.843 13.462 4.778 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -8.084 13.759 3.196 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -7.392 10.800 2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -6.245 12.138 2.395 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -5.804 10.773 3.448 1.00 0.00 H new ATOM 2234 N GLY A 150 -3.586 15.049 3.332 1.00 0.00 N ATOM 2235 CA GLY A 150 -2.158 15.297 3.369 1.00 0.00 C ATOM 2236 C GLY A 150 -1.661 15.995 2.119 1.00 0.00 C ATOM 2237 O GLY A 150 -2.391 16.117 1.135 1.00 0.00 O ATOM 0 H GLY A 150 -4.050 15.349 2.475 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -1.920 15.906 4.241 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -1.630 14.351 3.488 1.00 0.00 H new ATOM 2241 N ALA A 151 -0.418 16.457 2.160 1.00 0.00 N ATOM 2242 CA ALA A 151 0.180 17.150 1.026 1.00 0.00 C ATOM 2243 C ALA A 151 1.370 16.376 0.476 1.00 0.00 C ATOM 2244 O ALA A 151 1.855 15.438 1.105 1.00 0.00 O ATOM 2245 CB ALA A 151 0.614 18.546 1.438 1.00 0.00 C ATOM 0 H ALA A 151 0.197 16.364 2.968 1.00 0.00 H new ATOM 0 HA ALA A 151 -0.571 17.224 0.239 1.00 0.00 H new ATOM 0 HB1 ALA A 151 1.060 19.055 0.584 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -0.253 19.109 1.785 1.00 0.00 H new ATOM 0 HB3 ALA A 151 1.347 18.477 2.242 1.00 0.00 H new ATOM 2251 N ILE A 152 1.845 16.781 -0.696 1.00 0.00 N ATOM 2252 CA ILE A 152 2.988 16.125 -1.312 1.00 0.00 C ATOM 2253 C ILE A 152 4.259 16.426 -0.525 1.00 0.00 C ATOM 2254 O ILE A 152 5.058 15.533 -0.244 1.00 0.00 O ATOM 2255 CB ILE A 152 3.164 16.552 -2.785 1.00 0.00 C ATOM 2256 CG1 ILE A 152 3.974 15.501 -3.538 1.00 0.00 C ATOM 2257 CG2 ILE A 152 3.828 17.920 -2.890 1.00 0.00 C ATOM 2258 CD1 ILE A 152 3.650 15.434 -5.011 1.00 0.00 C ATOM 0 H ILE A 152 1.458 17.556 -1.235 1.00 0.00 H new ATOM 0 HA ILE A 152 2.800 15.051 -1.295 1.00 0.00 H new ATOM 0 HB ILE A 152 2.176 16.631 -3.239 1.00 0.00 H new ATOM 0 HG12 ILE A 152 5.036 15.716 -3.417 1.00 0.00 H new ATOM 0 HG13 ILE A 152 3.793 14.524 -3.089 1.00 0.00 H new ATOM 0 HG21 ILE A 152 3.938 18.192 -3.940 1.00 0.00 H new ATOM 0 HG22 ILE A 152 3.211 18.664 -2.385 1.00 0.00 H new ATOM 0 HG23 ILE A 152 4.811 17.884 -2.420 1.00 0.00 H new ATOM 0 HD11 ILE A 152 4.262 14.666 -5.484 1.00 0.00 H new ATOM 0 HD12 ILE A 152 2.596 15.189 -5.141 1.00 0.00 H new ATOM 0 HD13 ILE A 152 3.857 16.399 -5.473 1.00 0.00 H new ATOM 2270 N TYR A 153 4.423 17.692 -0.153 1.00 0.00 N ATOM 2271 CA TYR A 153 5.576 18.120 0.625 1.00 0.00 C ATOM 2272 C TYR A 153 5.257 17.996 2.109 1.00 0.00 C ATOM 2273 O TYR A 153 6.102 17.600 2.912 1.00 0.00 O ATOM 2274 CB TYR A 153 5.951 19.561 0.272 1.00 0.00 C ATOM 2275 CG TYR A 153 4.902 20.576 0.668 1.00 0.00 C ATOM 2276 CD1 TYR A 153 3.836 20.866 -0.175 1.00 0.00 C ATOM 2277 CD2 TYR A 153 4.978 21.245 1.883 1.00 0.00 C ATOM 2278 CE1 TYR A 153 2.876 21.794 0.182 1.00 0.00 C ATOM 2279 CE2 TYR A 153 4.022 22.174 2.247 1.00 0.00 C ATOM 2280 CZ TYR A 153 2.973 22.444 1.394 1.00 0.00 C ATOM 2281 OH TYR A 153 2.020 23.369 1.753 1.00 0.00 O ATOM 0 H TYR A 153 3.768 18.440 -0.380 1.00 0.00 H new ATOM 0 HA TYR A 153 6.428 17.482 0.389 1.00 0.00 H new ATOM 0 HB2 TYR A 153 6.891 19.813 0.762 1.00 0.00 H new ATOM 0 HB3 TYR A 153 6.123 19.630 -0.802 1.00 0.00 H new ATOM 0 HD1 TYR A 153 3.756 20.358 -1.125 1.00 0.00 H new ATOM 0 HD2 TYR A 153 5.798 21.036 2.554 1.00 0.00 H new ATOM 0 HE1 TYR A 153 2.054 22.009 -0.485 1.00 0.00 H new ATOM 0 HE2 TYR A 153 4.096 22.686 3.195 1.00 0.00 H new ATOM 0 HH TYR A 153 2.235 23.734 2.637 1.00 0.00 H new ATOM 2291 N ASP A 154 4.013 18.313 2.454 1.00 0.00 N ATOM 2292 CA ASP A 154 3.541 18.216 3.828 1.00 0.00 C ATOM 2293 C ASP A 154 2.715 16.945 3.986 1.00 0.00 C ATOM 2294 O ASP A 154 1.512 16.996 4.247 1.00 0.00 O ATOM 2295 CB ASP A 154 2.706 19.443 4.198 1.00 0.00 C ATOM 2296 CG ASP A 154 2.878 19.843 5.650 1.00 0.00 C ATOM 2297 OD1 ASP A 154 4.037 19.929 6.109 1.00 0.00 O ATOM 2298 OD2 ASP A 154 1.855 20.071 6.329 1.00 0.00 O ATOM 0 H ASP A 154 3.309 18.642 1.793 1.00 0.00 H new ATOM 0 HA ASP A 154 4.399 18.177 4.500 1.00 0.00 H new ATOM 0 HB2 ASP A 154 2.990 20.278 3.558 1.00 0.00 H new ATOM 0 HB3 ASP A 154 1.654 19.235 4.003 1.00 0.00 H new ATOM 2303 N ASP A 155 3.380 15.808 3.792 1.00 0.00 N ATOM 2304 CA ASP A 155 2.749 14.490 3.873 1.00 0.00 C ATOM 2305 C ASP A 155 1.628 14.429 4.911 1.00 0.00 C ATOM 2306 O ASP A 155 1.630 15.170 5.894 1.00 0.00 O ATOM 2307 CB ASP A 155 3.804 13.431 4.185 1.00 0.00 C ATOM 2308 CG ASP A 155 4.434 13.623 5.550 1.00 0.00 C ATOM 2309 OD1 ASP A 155 5.090 14.664 5.761 1.00 0.00 O ATOM 2310 OD2 ASP A 155 4.272 12.731 6.409 1.00 0.00 O ATOM 0 H ASP A 155 4.376 15.774 3.573 1.00 0.00 H new ATOM 0 HA ASP A 155 2.293 14.294 2.903 1.00 0.00 H new ATOM 0 HB2 ASP A 155 3.348 12.442 4.135 1.00 0.00 H new ATOM 0 HB3 ASP A 155 4.582 13.462 3.422 1.00 0.00 H new ATOM 2315 N PRO A 156 0.653 13.527 4.693 1.00 0.00 N ATOM 2316 CA PRO A 156 -0.488 13.342 5.594 1.00 0.00 C ATOM 2317 C PRO A 156 -0.060 13.210 7.043 1.00 0.00 C ATOM 2318 O PRO A 156 -0.770 13.626 7.959 1.00 0.00 O ATOM 2319 CB PRO A 156 -1.147 12.043 5.096 1.00 0.00 C ATOM 2320 CG PRO A 156 -0.187 11.454 4.110 1.00 0.00 C ATOM 2321 CD PRO A 156 0.588 12.608 3.552 1.00 0.00 C ATOM 0 HA PRO A 156 -1.162 14.199 5.576 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -1.331 11.356 5.922 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -2.111 12.247 4.630 1.00 0.00 H new ATOM 0 HG2 PRO A 156 0.476 10.735 4.592 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -0.716 10.921 3.320 1.00 0.00 H new ATOM 0 HD2 PRO A 156 1.580 12.306 3.217 1.00 0.00 H new ATOM 0 HD3 PRO A 156 0.086 13.058 2.696 1.00 0.00 H new ATOM 2329 N ARG A 157 1.112 12.639 7.238 1.00 0.00 N ATOM 2330 CA ARG A 157 1.662 12.452 8.569 1.00 0.00 C ATOM 2331 C ARG A 157 0.710 11.658 9.457 1.00 0.00 C ATOM 2332 O ARG A 157 0.694 11.832 10.675 1.00 0.00 O ATOM 2333 CB ARG A 157 1.967 13.806 9.213 1.00 0.00 C ATOM 2334 CG ARG A 157 3.089 14.568 8.526 1.00 0.00 C ATOM 2335 CD ARG A 157 2.986 16.062 8.785 1.00 0.00 C ATOM 2336 NE ARG A 157 3.270 16.398 10.178 1.00 0.00 N ATOM 2337 CZ ARG A 157 2.976 17.571 10.733 1.00 0.00 C ATOM 2338 NH1 ARG A 157 2.390 18.523 10.017 1.00 0.00 N ATOM 2339 NH2 ARG A 157 3.267 17.793 12.007 1.00 0.00 N ATOM 0 H ARG A 157 1.707 12.293 6.485 1.00 0.00 H new ATOM 0 HA ARG A 157 2.587 11.884 8.469 1.00 0.00 H new ATOM 0 HB2 ARG A 157 1.064 14.416 9.201 1.00 0.00 H new ATOM 0 HB3 ARG A 157 2.232 13.650 10.259 1.00 0.00 H new ATOM 0 HG2 ARG A 157 4.051 14.201 8.883 1.00 0.00 H new ATOM 0 HG3 ARG A 157 3.054 14.380 7.453 1.00 0.00 H new ATOM 0 HD2 ARG A 157 3.683 16.591 8.135 1.00 0.00 H new ATOM 0 HD3 ARG A 157 1.985 16.406 8.526 1.00 0.00 H new ATOM 0 HE ARG A 157 3.720 15.691 10.760 1.00 0.00 H new ATOM 0 HH11 ARG A 157 2.163 18.357 9.037 1.00 0.00 H new ATOM 0 HH12 ARG A 157 2.167 19.420 10.447 1.00 0.00 H new ATOM 0 HH21 ARG A 157 3.716 17.065 12.562 1.00 0.00 H new ATOM 0 HH22 ARG A 157 3.042 18.692 12.432 1.00 0.00 H new ATOM 2353 N GLY A 158 -0.080 10.785 8.842 1.00 0.00 N ATOM 2354 CA GLY A 158 -1.019 9.982 9.601 1.00 0.00 C ATOM 2355 C GLY A 158 -1.628 8.862 8.781 1.00 0.00 C ATOM 2356 O GLY A 158 -2.041 9.072 7.640 1.00 0.00 O ATOM 0 H GLY A 158 -0.087 10.620 7.836 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -0.511 9.558 10.467 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -1.815 10.623 9.981 1.00 0.00 H new ATOM 2360 N THR A 159 -1.686 7.671 9.366 1.00 0.00 N ATOM 2361 CA THR A 159 -2.252 6.512 8.686 1.00 0.00 C ATOM 2362 C THR A 159 -3.774 6.520 8.783 1.00 0.00 C ATOM 2363 O THR A 159 -4.338 6.753 9.856 1.00 0.00 O ATOM 2364 CB THR A 159 -1.697 5.220 9.286 1.00 0.00 C ATOM 2365 OG1 THR A 159 -2.311 4.088 8.696 1.00 0.00 O ATOM 2366 CG2 THR A 159 -1.896 5.121 10.783 1.00 0.00 C ATOM 0 H THR A 159 -1.348 7.483 10.310 1.00 0.00 H new ATOM 0 HA THR A 159 -1.971 6.563 7.634 1.00 0.00 H new ATOM 0 HB THR A 159 -0.627 5.242 9.078 1.00 0.00 H new ATOM 0 HG1 THR A 159 -1.941 3.272 9.092 1.00 0.00 H new ATOM 0 HG21 THR A 159 -1.479 4.181 11.144 1.00 0.00 H new ATOM 0 HG22 THR A 159 -1.391 5.953 11.273 1.00 0.00 H new ATOM 0 HG23 THR A 159 -2.961 5.158 11.012 1.00 0.00 H new ATOM 2374 N TYR A 160 -4.437 6.265 7.659 1.00 0.00 N ATOM 2375 CA TYR A 160 -5.894 6.246 7.628 1.00 0.00 C ATOM 2376 C TYR A 160 -6.419 4.884 7.205 1.00 0.00 C ATOM 2377 O TYR A 160 -5.666 4.025 6.755 1.00 0.00 O ATOM 2378 CB TYR A 160 -6.451 7.323 6.691 1.00 0.00 C ATOM 2379 CG TYR A 160 -5.418 7.991 5.817 1.00 0.00 C ATOM 2380 CD1 TYR A 160 -4.756 9.131 6.248 1.00 0.00 C ATOM 2381 CD2 TYR A 160 -5.113 7.486 4.562 1.00 0.00 C ATOM 2382 CE1 TYR A 160 -3.814 9.751 5.450 1.00 0.00 C ATOM 2383 CE2 TYR A 160 -4.174 8.099 3.757 1.00 0.00 C ATOM 2384 CZ TYR A 160 -3.528 9.231 4.205 1.00 0.00 C ATOM 2385 OH TYR A 160 -2.594 9.846 3.405 1.00 0.00 O ATOM 0 H TYR A 160 -3.991 6.070 6.763 1.00 0.00 H new ATOM 0 HA TYR A 160 -6.233 6.457 8.642 1.00 0.00 H new ATOM 0 HB2 TYR A 160 -7.211 6.873 6.053 1.00 0.00 H new ATOM 0 HB3 TYR A 160 -6.949 8.085 7.290 1.00 0.00 H new ATOM 0 HD1 TYR A 160 -4.980 9.540 7.222 1.00 0.00 H new ATOM 0 HD2 TYR A 160 -5.618 6.599 4.209 1.00 0.00 H new ATOM 0 HE1 TYR A 160 -3.305 10.637 5.799 1.00 0.00 H new ATOM 0 HE2 TYR A 160 -3.947 7.694 2.782 1.00 0.00 H new ATOM 0 HH TYR A 160 -2.510 9.353 2.562 1.00 0.00 H new ATOM 2395 N THR A 161 -7.723 4.705 7.356 1.00 0.00 N ATOM 2396 CA THR A 161 -8.379 3.459 6.995 1.00 0.00 C ATOM 2397 C THR A 161 -9.444 3.714 5.931 1.00 0.00 C ATOM 2398 O THR A 161 -10.198 4.683 6.017 1.00 0.00 O ATOM 2399 CB THR A 161 -8.997 2.827 8.242 1.00 0.00 C ATOM 2400 OG1 THR A 161 -8.058 2.793 9.302 1.00 0.00 O ATOM 2401 CG2 THR A 161 -9.492 1.416 8.024 1.00 0.00 C ATOM 0 H THR A 161 -8.352 5.415 7.730 1.00 0.00 H new ATOM 0 HA THR A 161 -7.644 2.769 6.580 1.00 0.00 H new ATOM 0 HB THR A 161 -9.852 3.457 8.487 1.00 0.00 H new ATOM 0 HG1 THR A 161 -8.471 2.387 10.092 1.00 0.00 H new ATOM 0 HG21 THR A 161 -9.917 1.032 8.951 1.00 0.00 H new ATOM 0 HG22 THR A 161 -10.256 1.414 7.246 1.00 0.00 H new ATOM 0 HG23 THR A 161 -8.660 0.782 7.717 1.00 0.00 H new ATOM 2409 N CYS A 162 -9.489 2.853 4.918 1.00 0.00 N ATOM 2410 CA CYS A 162 -10.453 3.005 3.832 1.00 0.00 C ATOM 2411 C CYS A 162 -11.223 1.705 3.597 1.00 0.00 C ATOM 2412 O CYS A 162 -10.633 0.637 3.449 1.00 0.00 O ATOM 2413 CB CYS A 162 -9.726 3.452 2.557 1.00 0.00 C ATOM 2414 SG CYS A 162 -10.568 3.024 0.996 1.00 0.00 S ATOM 0 H CYS A 162 -8.872 2.046 4.826 1.00 0.00 H new ATOM 0 HA CYS A 162 -11.179 3.769 4.110 1.00 0.00 H new ATOM 0 HB2 CYS A 162 -9.591 4.533 2.594 1.00 0.00 H new ATOM 0 HB3 CYS A 162 -8.731 3.006 2.549 1.00 0.00 H new ATOM 2419 N GLN A 163 -12.547 1.813 3.569 1.00 0.00 N ATOM 2420 CA GLN A 163 -13.414 0.660 3.358 1.00 0.00 C ATOM 2421 C GLN A 163 -14.856 1.109 3.143 1.00 0.00 C ATOM 2422 O GLN A 163 -15.197 2.266 3.388 1.00 0.00 O ATOM 2423 CB GLN A 163 -13.329 -0.299 4.548 1.00 0.00 C ATOM 2424 CG GLN A 163 -13.161 -1.755 4.144 1.00 0.00 C ATOM 2425 CD GLN A 163 -13.831 -2.709 5.113 1.00 0.00 C ATOM 2426 OE1 GLN A 163 -14.131 -2.348 6.251 1.00 0.00 O ATOM 2427 NE2 GLN A 163 -14.070 -3.936 4.665 1.00 0.00 N ATOM 0 H GLN A 163 -13.046 2.694 3.691 1.00 0.00 H new ATOM 0 HA GLN A 163 -13.076 0.135 2.464 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.491 -0.007 5.180 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -14.232 -0.199 5.150 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -13.578 -1.902 3.148 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -12.099 -1.991 4.083 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -13.804 -4.192 3.714 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -14.519 -4.622 5.272 1.00 0.00 H new ATOM 2436 N ARG A 164 -15.699 0.193 2.682 1.00 0.00 N ATOM 2437 CA ARG A 164 -17.105 0.502 2.430 1.00 0.00 C ATOM 2438 C ARG A 164 -17.940 0.468 3.715 1.00 0.00 C ATOM 2439 O ARG A 164 -19.101 0.059 3.690 1.00 0.00 O ATOM 2440 CB ARG A 164 -17.680 -0.487 1.411 1.00 0.00 C ATOM 2441 CG ARG A 164 -18.220 0.174 0.154 1.00 0.00 C ATOM 2442 CD ARG A 164 -18.790 -0.853 -0.812 1.00 0.00 C ATOM 2443 NE ARG A 164 -17.892 -1.992 -0.994 1.00 0.00 N ATOM 2444 CZ ARG A 164 -18.279 -3.173 -1.470 1.00 0.00 C ATOM 2445 NH1 ARG A 164 -19.545 -3.376 -1.814 1.00 0.00 N ATOM 2446 NH2 ARG A 164 -17.398 -4.155 -1.603 1.00 0.00 N ATOM 0 H ARG A 164 -15.436 -0.770 2.474 1.00 0.00 H new ATOM 0 HA ARG A 164 -17.153 1.515 2.032 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -16.904 -1.199 1.131 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -18.480 -1.057 1.883 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -18.995 0.892 0.423 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -17.423 0.733 -0.336 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -19.752 -1.206 -0.440 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -18.975 -0.380 -1.776 1.00 0.00 H new ATOM 0 HE ARG A 164 -16.911 -1.875 -0.741 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -20.227 -2.625 -1.714 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -19.835 -4.283 -2.178 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -16.424 -4.005 -1.340 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -17.694 -5.060 -1.968 1.00 0.00 H new ATOM 2460 N ASP A 165 -17.359 0.899 4.836 1.00 0.00 N ATOM 2461 CA ASP A 165 -18.081 0.906 6.105 1.00 0.00 C ATOM 2462 C ASP A 165 -17.849 2.210 6.864 1.00 0.00 C ATOM 2463 O ASP A 165 -16.893 2.937 6.593 1.00 0.00 O ATOM 2464 CB ASP A 165 -17.649 -0.279 6.970 1.00 0.00 C ATOM 2465 CG ASP A 165 -17.561 -1.573 6.183 1.00 0.00 C ATOM 2466 OD1 ASP A 165 -16.740 -1.641 5.244 1.00 0.00 O ATOM 2467 OD2 ASP A 165 -18.313 -2.516 6.505 1.00 0.00 O ATOM 0 H ASP A 165 -16.401 1.244 4.890 1.00 0.00 H new ATOM 0 HA ASP A 165 -19.145 0.821 5.883 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -16.679 -0.063 7.417 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -18.357 -0.404 7.789 1.00 0.00 H new ATOM 2472 N GLU A 166 -18.726 2.493 7.825 1.00 0.00 N ATOM 2473 CA GLU A 166 -18.615 3.703 8.636 1.00 0.00 C ATOM 2474 C GLU A 166 -17.494 3.570 9.668 1.00 0.00 C ATOM 2475 O GLU A 166 -17.171 4.523 10.375 1.00 0.00 O ATOM 2476 CB GLU A 166 -19.940 3.992 9.342 1.00 0.00 C ATOM 2477 CG GLU A 166 -20.301 5.468 9.380 1.00 0.00 C ATOM 2478 CD GLU A 166 -20.896 5.956 8.073 1.00 0.00 C ATOM 2479 OE1 GLU A 166 -20.121 6.220 7.130 1.00 0.00 O ATOM 2480 OE2 GLU A 166 -22.137 6.072 7.993 1.00 0.00 O ATOM 0 H GLU A 166 -19.522 1.900 8.061 1.00 0.00 H new ATOM 0 HA GLU A 166 -18.375 4.533 7.971 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -20.737 3.445 8.839 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -19.888 3.613 10.363 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -21.012 5.644 10.187 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -19.409 6.051 9.609 1.00 0.00 H new ATOM 2487 N ASN A 167 -16.908 2.381 9.743 1.00 0.00 N ATOM 2488 CA ASN A 167 -15.821 2.104 10.672 1.00 0.00 C ATOM 2489 C ASN A 167 -14.758 1.276 9.976 1.00 0.00 C ATOM 2490 O ASN A 167 -14.243 0.306 10.531 1.00 0.00 O ATOM 2491 CB ASN A 167 -16.334 1.372 11.909 1.00 0.00 C ATOM 2492 CG ASN A 167 -17.492 2.093 12.572 1.00 0.00 C ATOM 2493 OD1 ASN A 167 -18.580 2.195 12.007 1.00 0.00 O ATOM 2494 ND2 ASN A 167 -17.261 2.598 13.779 1.00 0.00 N ATOM 0 H ASN A 167 -17.172 1.585 9.163 1.00 0.00 H new ATOM 0 HA ASN A 167 -15.389 3.051 10.996 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -16.649 0.367 11.628 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -15.520 1.262 12.626 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -18.002 3.094 14.275 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -16.343 2.490 14.210 1.00 0.00 H new ATOM 2501 N VAL A 168 -14.461 1.680 8.744 1.00 0.00 N ATOM 2502 CA VAL A 168 -13.470 1.027 7.885 1.00 0.00 C ATOM 2503 C VAL A 168 -12.468 0.183 8.666 1.00 0.00 C ATOM 2504 O VAL A 168 -12.104 0.507 9.797 1.00 0.00 O ATOM 2505 CB VAL A 168 -12.704 2.089 7.092 1.00 0.00 C ATOM 2506 CG1 VAL A 168 -13.608 2.710 6.045 1.00 0.00 C ATOM 2507 CG2 VAL A 168 -12.171 3.151 8.038 1.00 0.00 C ATOM 0 H VAL A 168 -14.909 2.484 8.304 1.00 0.00 H new ATOM 0 HA VAL A 168 -14.019 0.358 7.222 1.00 0.00 H new ATOM 0 HB VAL A 168 -11.862 1.620 6.583 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -13.053 3.464 5.487 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -13.958 1.936 5.361 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -14.464 3.176 6.533 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -11.627 3.905 7.469 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -13.003 3.622 8.562 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -11.501 2.689 8.763 1.00 0.00 H new ATOM 2517 N ASN A 169 -12.038 -0.912 8.053 1.00 0.00 N ATOM 2518 CA ASN A 169 -11.099 -1.825 8.686 1.00 0.00 C ATOM 2519 C ASN A 169 -9.718 -1.787 8.029 1.00 0.00 C ATOM 2520 O ASN A 169 -8.699 -1.892 8.712 1.00 0.00 O ATOM 2521 CB ASN A 169 -11.669 -3.237 8.627 1.00 0.00 C ATOM 2522 CG ASN A 169 -11.125 -4.135 9.723 1.00 0.00 C ATOM 2523 OD1 ASN A 169 -9.833 -4.434 9.658 1.00 0.00 O flip ATOM 2524 ND2 ASN A 169 -11.859 -4.554 10.618 1.00 0.00 N flip ATOM 0 H ASN A 169 -12.327 -1.189 7.115 1.00 0.00 H new ATOM 0 HA ASN A 169 -10.965 -1.511 9.721 1.00 0.00 H new ATOM 0 HB2 ASN A 169 -12.755 -3.190 8.708 1.00 0.00 H new ATOM 0 HB3 ASN A 169 -11.440 -3.676 7.656 1.00 0.00 H new ATOM 0 HD21 ASN A 169 -12.847 -4.299 10.629 1.00 0.00 H new ATOM 0 HD22 ASN A 169 -11.480 -5.156 11.349 1.00 0.00 H new ATOM 2531 N SER A 170 -9.684 -1.648 6.707 1.00 0.00 N ATOM 2532 CA SER A 170 -8.416 -1.610 5.981 1.00 0.00 C ATOM 2533 C SER A 170 -7.648 -0.331 6.297 1.00 0.00 C ATOM 2534 O SER A 170 -8.002 0.749 5.825 1.00 0.00 O ATOM 2535 CB SER A 170 -8.659 -1.716 4.475 1.00 0.00 C ATOM 2536 OG SER A 170 -9.451 -2.849 4.163 1.00 0.00 O ATOM 0 H SER A 170 -10.513 -1.560 6.119 1.00 0.00 H new ATOM 0 HA SER A 170 -7.817 -2.462 6.303 1.00 0.00 H new ATOM 0 HB2 SER A 170 -9.155 -0.813 4.119 1.00 0.00 H new ATOM 0 HB3 SER A 170 -7.704 -1.782 3.953 1.00 0.00 H new ATOM 0 HG SER A 170 -8.868 -3.601 3.928 1.00 0.00 H new ATOM 2542 N THR A 171 -6.600 -0.461 7.105 1.00 0.00 N ATOM 2543 CA THR A 171 -5.786 0.686 7.493 1.00 0.00 C ATOM 2544 C THR A 171 -4.642 0.914 6.511 1.00 0.00 C ATOM 2545 O THR A 171 -3.677 0.151 6.478 1.00 0.00 O ATOM 2546 CB THR A 171 -5.228 0.485 8.903 1.00 0.00 C ATOM 2547 OG1 THR A 171 -6.235 0.010 9.778 1.00 0.00 O ATOM 2548 CG2 THR A 171 -4.656 1.750 9.505 1.00 0.00 C ATOM 0 H THR A 171 -6.295 -1.349 7.504 1.00 0.00 H new ATOM 0 HA THR A 171 -6.426 1.568 7.479 1.00 0.00 H new ATOM 0 HB THR A 171 -4.424 -0.243 8.795 1.00 0.00 H new ATOM 0 HG1 THR A 171 -5.858 -0.114 10.674 1.00 0.00 H new ATOM 0 HG21 THR A 171 -4.277 1.538 10.505 1.00 0.00 H new ATOM 0 HG22 THR A 171 -3.842 2.115 8.879 1.00 0.00 H new ATOM 0 HG23 THR A 171 -5.436 2.509 9.566 1.00 0.00 H new ATOM 2556 N LEU A 172 -4.753 1.977 5.721 1.00 0.00 N ATOM 2557 CA LEU A 172 -3.726 2.319 4.745 1.00 0.00 C ATOM 2558 C LEU A 172 -2.737 3.322 5.334 1.00 0.00 C ATOM 2559 O LEU A 172 -3.083 4.476 5.584 1.00 0.00 O ATOM 2560 CB LEU A 172 -4.368 2.891 3.475 1.00 0.00 C ATOM 2561 CG LEU A 172 -3.394 3.496 2.456 1.00 0.00 C ATOM 2562 CD1 LEU A 172 -3.060 4.932 2.827 1.00 0.00 C ATOM 2563 CD2 LEU A 172 -2.124 2.660 2.355 1.00 0.00 C ATOM 0 H LEU A 172 -5.546 2.618 5.738 1.00 0.00 H new ATOM 0 HA LEU A 172 -3.183 1.410 4.485 1.00 0.00 H new ATOM 0 HB2 LEU A 172 -4.932 2.097 2.985 1.00 0.00 H new ATOM 0 HB3 LEU A 172 -5.085 3.659 3.766 1.00 0.00 H new ATOM 0 HG LEU A 172 -3.879 3.494 1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 172 -2.368 5.346 2.094 1.00 0.00 H new ATOM 0 HD12 LEU A 172 -3.974 5.526 2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 172 -2.599 4.955 3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 172 -1.450 3.110 1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 172 -1.634 2.623 3.328 1.00 0.00 H new ATOM 0 HD23 LEU A 172 -2.378 1.649 2.038 1.00 0.00 H new ATOM 2575 N HIS A 173 -1.506 2.871 5.556 1.00 0.00 N ATOM 2576 CA HIS A 173 -0.468 3.727 6.120 1.00 0.00 C ATOM 2577 C HIS A 173 0.097 4.673 5.065 1.00 0.00 C ATOM 2578 O HIS A 173 -0.082 4.460 3.865 1.00 0.00 O ATOM 2579 CB HIS A 173 0.658 2.875 6.709 1.00 0.00 C ATOM 2580 CG HIS A 173 1.360 3.526 7.860 1.00 0.00 C ATOM 2581 ND1 HIS A 173 2.361 4.461 7.701 1.00 0.00 N ATOM 2582 CD2 HIS A 173 1.201 3.372 9.196 1.00 0.00 C ATOM 2583 CE1 HIS A 173 2.787 4.853 8.888 1.00 0.00 C ATOM 2584 NE2 HIS A 173 2.099 4.208 9.812 1.00 0.00 N ATOM 0 H HIS A 173 -1.203 1.918 5.354 1.00 0.00 H new ATOM 0 HA HIS A 173 -0.919 4.325 6.912 1.00 0.00 H new ATOM 0 HB2 HIS A 173 0.247 1.920 7.037 1.00 0.00 H new ATOM 0 HB3 HIS A 173 1.385 2.657 5.927 1.00 0.00 H new ATOM 0 HD2 HIS A 173 0.498 2.714 9.686 1.00 0.00 H new ATOM 0 HE1 HIS A 173 3.566 5.578 9.072 1.00 0.00 H new ATOM 0 HE2 HIS A 173 2.216 4.314 10.820 1.00 0.00 H new ATOM 2592 N VAL A 174 0.780 5.718 5.521 1.00 0.00 N ATOM 2593 CA VAL A 174 1.373 6.699 4.619 1.00 0.00 C ATOM 2594 C VAL A 174 2.877 6.814 4.841 1.00 0.00 C ATOM 2595 O VAL A 174 3.340 6.930 5.976 1.00 0.00 O ATOM 2596 CB VAL A 174 0.732 8.088 4.802 1.00 0.00 C ATOM 2597 CG1 VAL A 174 -0.744 8.046 4.441 1.00 0.00 C ATOM 2598 CG2 VAL A 174 0.929 8.588 6.227 1.00 0.00 C ATOM 0 H VAL A 174 0.937 5.907 6.511 1.00 0.00 H new ATOM 0 HA VAL A 174 1.185 6.349 3.604 1.00 0.00 H new ATOM 0 HB VAL A 174 1.227 8.787 4.128 1.00 0.00 H new ATOM 0 HG11 VAL A 174 -1.180 9.036 4.576 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -0.856 7.739 3.401 1.00 0.00 H new ATOM 0 HG13 VAL A 174 -1.256 7.333 5.086 1.00 0.00 H new ATOM 0 HG21 VAL A 174 0.469 9.570 6.335 1.00 0.00 H new ATOM 0 HG22 VAL A 174 0.464 7.891 6.925 1.00 0.00 H new ATOM 0 HG23 VAL A 174 1.995 8.661 6.443 1.00 0.00 H new ATOM 2608 N HIS A 175 3.636 6.782 3.750 1.00 0.00 N ATOM 2609 CA HIS A 175 5.089 6.884 3.825 1.00 0.00 C ATOM 2610 C HIS A 175 5.708 6.850 2.432 1.00 0.00 C ATOM 2611 O HIS A 175 5.925 5.779 1.865 1.00 0.00 O ATOM 2612 CB HIS A 175 5.659 5.746 4.675 1.00 0.00 C ATOM 2613 CG HIS A 175 6.931 6.105 5.378 1.00 0.00 C ATOM 2614 ND1 HIS A 175 6.973 6.918 6.491 1.00 0.00 N ATOM 2615 CD2 HIS A 175 8.215 5.755 5.123 1.00 0.00 C ATOM 2616 CE1 HIS A 175 8.226 7.054 6.889 1.00 0.00 C ATOM 2617 NE2 HIS A 175 8.998 6.358 6.076 1.00 0.00 N ATOM 0 H HIS A 175 3.269 6.686 2.803 1.00 0.00 H new ATOM 0 HA HIS A 175 5.337 7.837 4.292 1.00 0.00 H new ATOM 0 HB2 HIS A 175 4.916 5.448 5.415 1.00 0.00 H new ATOM 0 HB3 HIS A 175 5.838 4.881 4.037 1.00 0.00 H new ATOM 0 HD2 HIS A 175 8.558 5.120 4.320 1.00 0.00 H new ATOM 0 HE1 HIS A 175 8.561 7.636 7.735 1.00 0.00 H new ATOM 0 HE2 HIS A 175 10.013 6.281 6.145 1.00 0.00 H new ATOM 2625 N TYR A 176 5.994 8.027 1.885 1.00 0.00 N ATOM 2626 CA TYR A 176 6.591 8.125 0.559 1.00 0.00 C ATOM 2627 C TYR A 176 7.766 9.087 0.554 1.00 0.00 C ATOM 2628 O TYR A 176 7.763 10.092 1.265 1.00 0.00 O ATOM 2629 CB TYR A 176 5.559 8.583 -0.475 1.00 0.00 C ATOM 2630 CG TYR A 176 4.708 9.761 -0.041 1.00 0.00 C ATOM 2631 CD1 TYR A 176 3.860 9.674 1.060 1.00 0.00 C ATOM 2632 CD2 TYR A 176 4.748 10.962 -0.742 1.00 0.00 C ATOM 2633 CE1 TYR A 176 3.081 10.748 1.447 1.00 0.00 C ATOM 2634 CE2 TYR A 176 3.972 12.038 -0.359 1.00 0.00 C ATOM 2635 CZ TYR A 176 3.141 11.926 0.735 1.00 0.00 C ATOM 2636 OH TYR A 176 2.365 12.996 1.116 1.00 0.00 O ATOM 0 H TYR A 176 5.822 8.924 2.339 1.00 0.00 H new ATOM 0 HA TYR A 176 6.947 7.130 0.293 1.00 0.00 H new ATOM 0 HB2 TYR A 176 6.080 8.848 -1.395 1.00 0.00 H new ATOM 0 HB3 TYR A 176 4.903 7.745 -0.710 1.00 0.00 H new ATOM 0 HD1 TYR A 176 3.810 8.752 1.621 1.00 0.00 H new ATOM 0 HD2 TYR A 176 5.397 11.054 -1.600 1.00 0.00 H new ATOM 0 HE1 TYR A 176 2.428 10.664 2.303 1.00 0.00 H new ATOM 0 HE2 TYR A 176 4.016 12.963 -0.914 1.00 0.00 H new ATOM 0 HH TYR A 176 2.755 13.824 0.765 1.00 0.00 H new ATOM 2646 N ARG A 177 8.766 8.779 -0.261 1.00 0.00 N ATOM 2647 CA ARG A 177 9.938 9.625 -0.364 1.00 0.00 C ATOM 2648 C ARG A 177 10.520 9.581 -1.774 1.00 0.00 C ATOM 2649 O ARG A 177 11.598 9.028 -1.996 1.00 0.00 O ATOM 2650 CB ARG A 177 10.996 9.198 0.656 1.00 0.00 C ATOM 2651 CG ARG A 177 12.235 10.078 0.652 1.00 0.00 C ATOM 2652 CD ARG A 177 13.402 9.402 1.354 1.00 0.00 C ATOM 2653 NE ARG A 177 14.661 9.603 0.642 1.00 0.00 N ATOM 2654 CZ ARG A 177 15.018 8.917 -0.441 1.00 0.00 C ATOM 2655 NH1 ARG A 177 14.214 7.985 -0.940 1.00 0.00 N ATOM 2656 NH2 ARG A 177 16.182 9.162 -1.028 1.00 0.00 N ATOM 0 H ARG A 177 8.785 7.951 -0.857 1.00 0.00 H new ATOM 0 HA ARG A 177 9.635 10.650 -0.150 1.00 0.00 H new ATOM 0 HB2 ARG A 177 10.554 9.211 1.652 1.00 0.00 H new ATOM 0 HB3 ARG A 177 11.291 8.169 0.452 1.00 0.00 H new ATOM 0 HG2 ARG A 177 12.513 10.311 -0.376 1.00 0.00 H new ATOM 0 HG3 ARG A 177 12.012 11.024 1.145 1.00 0.00 H new ATOM 0 HD2 ARG A 177 13.492 9.794 2.367 1.00 0.00 H new ATOM 0 HD3 ARG A 177 13.202 8.334 1.442 1.00 0.00 H new ATOM 0 HE ARG A 177 15.305 10.311 0.996 1.00 0.00 H new ATOM 0 HH11 ARG A 177 13.318 7.792 -0.493 1.00 0.00 H new ATOM 0 HH12 ARG A 177 14.493 7.462 -1.770 1.00 0.00 H new ATOM 0 HH21 ARG A 177 16.804 9.876 -0.649 1.00 0.00 H new ATOM 0 HH22 ARG A 177 16.455 8.636 -1.858 1.00 0.00 H new