USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 140:sc= 0.0347 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 18 MET CE :methyl 167:sc=-0.00951 (180deg=-0.234) USER MOD Single : A 19 MET CE :methyl -168:sc= -0.025 (180deg=-0.286) USER MOD Single : A 29 LYS NZ :NH3+ 174:sc= -0.646 (180deg=-0.786) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 140:sc= 0.461 USER MOD Single : A 58 ASN : amide:sc=-0.00393 K(o=-0.0039,f=-2.7!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.021 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0.0221 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.204 K(o=-0.2,f=-1.6) USER MOD Single : A 102 LYS NZ :NH3+ 174:sc= 2.43 (180deg=2.14) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.223 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.429 -2.199 -4.060 1.00 0.00 N ATOM 2 CA MET A 1 12.468 -2.114 -2.945 1.00 0.00 C ATOM 3 C MET A 1 11.646 -0.833 -3.048 1.00 0.00 C ATOM 4 O MET A 1 12.167 0.203 -3.456 1.00 0.00 O ATOM 5 CB MET A 1 13.197 -2.202 -1.602 1.00 0.00 C ATOM 6 CG MET A 1 12.215 -2.230 -0.433 1.00 0.00 C ATOM 7 SD MET A 1 13.021 -2.398 1.181 1.00 0.00 S ATOM 8 CE MET A 1 11.545 -2.366 2.233 1.00 0.00 C ATOM 0 H1 MET A 1 14.335 -2.572 -3.710 1.00 0.00 H new ATOM 0 H2 MET A 1 13.054 -2.833 -4.794 1.00 0.00 H new ATOM 0 H3 MET A 1 13.578 -1.252 -4.463 1.00 0.00 H new ATOM 0 HA MET A 1 11.781 -2.958 -3.008 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.815 -3.099 -1.581 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.868 -1.350 -1.495 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.625 -1.314 -0.442 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.520 -3.058 -0.572 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.841 -2.459 3.278 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.015 -1.424 2.088 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.890 -3.196 1.966 1.00 0.00 H new ATOM 20 N SER A 2 10.364 -0.917 -2.677 1.00 0.00 N ATOM 21 CA SER A 2 9.410 0.193 -2.751 1.00 0.00 C ATOM 22 C SER A 2 9.285 0.776 -4.159 1.00 0.00 C ATOM 23 O SER A 2 9.950 0.335 -5.093 1.00 0.00 O ATOM 24 CB SER A 2 9.777 1.264 -1.721 1.00 0.00 C ATOM 25 OG SER A 2 9.819 0.694 -0.427 1.00 0.00 O ATOM 0 H SER A 2 9.953 -1.775 -2.310 1.00 0.00 H new ATOM 0 HA SER A 2 8.423 -0.202 -2.510 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.745 1.701 -1.967 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.046 2.072 -1.748 1.00 0.00 H new ATOM 0 HG SER A 2 10.056 1.384 0.227 1.00 0.00 H new ATOM 31 N ALA A 3 8.418 1.779 -4.309 1.00 0.00 N ATOM 32 CA ALA A 3 8.188 2.454 -5.574 1.00 0.00 C ATOM 33 C ALA A 3 7.893 3.933 -5.333 1.00 0.00 C ATOM 34 O ALA A 3 7.609 4.342 -4.209 1.00 0.00 O ATOM 35 CB ALA A 3 7.023 1.773 -6.301 1.00 0.00 C ATOM 0 H ALA A 3 7.853 2.145 -3.543 1.00 0.00 H new ATOM 0 HA ALA A 3 9.080 2.387 -6.197 1.00 0.00 H new ATOM 0 HB1 ALA A 3 6.844 2.275 -7.252 1.00 0.00 H new ATOM 0 HB2 ALA A 3 7.269 0.727 -6.483 1.00 0.00 H new ATOM 0 HB3 ALA A 3 6.125 1.832 -5.685 1.00 0.00 H new ATOM 41 N LEU A 4 7.964 4.730 -6.401 1.00 0.00 N ATOM 42 CA LEU A 4 7.744 6.165 -6.344 1.00 0.00 C ATOM 43 C LEU A 4 7.007 6.642 -7.593 1.00 0.00 C ATOM 44 O LEU A 4 7.525 7.431 -8.385 1.00 0.00 O ATOM 45 CB LEU A 4 9.064 6.915 -6.107 1.00 0.00 C ATOM 46 CG LEU A 4 10.189 6.620 -7.110 1.00 0.00 C ATOM 47 CD1 LEU A 4 11.204 7.757 -7.037 1.00 0.00 C ATOM 48 CD2 LEU A 4 10.939 5.327 -6.790 1.00 0.00 C ATOM 0 H LEU A 4 8.179 4.387 -7.337 1.00 0.00 H new ATOM 0 HA LEU A 4 7.104 6.392 -5.491 1.00 0.00 H new ATOM 0 HB2 LEU A 4 8.860 7.986 -6.123 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.422 6.674 -5.106 1.00 0.00 H new ATOM 0 HG LEU A 4 9.731 6.521 -8.094 1.00 0.00 H new ATOM 0 HD11 LEU A 4 12.013 7.568 -7.742 1.00 0.00 H new ATOM 0 HD12 LEU A 4 10.715 8.698 -7.289 1.00 0.00 H new ATOM 0 HD13 LEU A 4 11.610 7.818 -6.027 1.00 0.00 H new ATOM 0 HD21 LEU A 4 11.723 5.168 -7.531 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.386 5.402 -5.799 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.244 4.488 -6.812 1.00 0.00 H new ATOM 60 N THR A 5 5.780 6.158 -7.768 1.00 0.00 N ATOM 61 CA THR A 5 4.924 6.563 -8.875 1.00 0.00 C ATOM 62 C THR A 5 4.398 7.977 -8.681 1.00 0.00 C ATOM 63 O THR A 5 3.742 8.509 -9.572 1.00 0.00 O ATOM 64 CB THR A 5 3.742 5.604 -9.007 1.00 0.00 C ATOM 65 OG1 THR A 5 3.402 5.059 -7.750 1.00 0.00 O ATOM 66 CG2 THR A 5 4.082 4.480 -9.979 1.00 0.00 C ATOM 0 H THR A 5 5.353 5.473 -7.144 1.00 0.00 H new ATOM 0 HA THR A 5 5.527 6.536 -9.783 1.00 0.00 H new ATOM 0 HB THR A 5 2.889 6.164 -9.390 1.00 0.00 H new ATOM 0 HG1 THR A 5 2.642 4.449 -7.853 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.232 3.803 -10.064 1.00 0.00 H new ATOM 0 HG22 THR A 5 4.310 4.902 -10.958 1.00 0.00 H new ATOM 0 HG23 THR A 5 4.948 3.930 -9.611 1.00 0.00 H new ATOM 74 N GLN A 6 4.676 8.591 -7.529 1.00 0.00 N ATOM 75 CA GLN A 6 4.153 9.904 -7.213 1.00 0.00 C ATOM 76 C GLN A 6 5.270 10.909 -6.982 1.00 0.00 C ATOM 77 O GLN A 6 6.001 10.823 -5.996 1.00 0.00 O ATOM 78 CB GLN A 6 3.212 9.771 -6.023 1.00 0.00 C ATOM 79 CG GLN A 6 2.139 8.751 -6.416 1.00 0.00 C ATOM 80 CD GLN A 6 0.967 8.675 -5.455 1.00 0.00 C ATOM 81 OE1 GLN A 6 0.901 9.373 -4.448 1.00 0.00 O ATOM 82 NE2 GLN A 6 0.021 7.801 -5.788 1.00 0.00 N ATOM 0 H GLN A 6 5.266 8.189 -6.800 1.00 0.00 H new ATOM 0 HA GLN A 6 3.588 10.297 -8.058 1.00 0.00 H new ATOM 0 HB2 GLN A 6 3.754 9.439 -5.137 1.00 0.00 H new ATOM 0 HB3 GLN A 6 2.760 10.732 -5.779 1.00 0.00 H new ATOM 0 HG2 GLN A 6 1.764 9.000 -7.409 1.00 0.00 H new ATOM 0 HG3 GLN A 6 2.600 7.766 -6.487 1.00 0.00 H new ATOM 0 HE21 GLN A 6 0.119 7.242 -6.635 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -0.802 7.690 -5.196 1.00 0.00 H new ATOM 91 N ILE A 7 5.374 11.863 -7.910 1.00 0.00 N ATOM 92 CA ILE A 7 6.471 12.814 -7.960 1.00 0.00 C ATOM 93 C ILE A 7 5.961 14.248 -7.839 1.00 0.00 C ATOM 94 O ILE A 7 4.979 14.617 -8.483 1.00 0.00 O ATOM 95 CB ILE A 7 7.240 12.627 -9.274 1.00 0.00 C ATOM 96 CG1 ILE A 7 7.637 11.160 -9.506 1.00 0.00 C ATOM 97 CG2 ILE A 7 8.487 13.512 -9.286 1.00 0.00 C ATOM 98 CD1 ILE A 7 8.468 10.576 -8.365 1.00 0.00 C ATOM 0 H ILE A 7 4.688 11.993 -8.653 1.00 0.00 H new ATOM 0 HA ILE A 7 7.138 12.630 -7.118 1.00 0.00 H new ATOM 0 HB ILE A 7 6.575 12.922 -10.085 1.00 0.00 H new ATOM 0 HG12 ILE A 7 6.735 10.562 -9.634 1.00 0.00 H new ATOM 0 HG13 ILE A 7 8.203 11.086 -10.435 1.00 0.00 H new ATOM 0 HG21 ILE A 7 9.025 13.371 -10.224 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.192 14.557 -9.191 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.134 13.240 -8.452 1.00 0.00 H new ATOM 0 HD11 ILE A 7 8.716 9.539 -8.589 1.00 0.00 H new ATOM 0 HD12 ILE A 7 9.386 11.152 -8.252 1.00 0.00 H new ATOM 0 HD13 ILE A 7 7.896 10.620 -7.438 1.00 0.00 H new ATOM 110 N LEU A 8 6.635 15.054 -7.015 1.00 0.00 N ATOM 111 CA LEU A 8 6.346 16.474 -6.885 1.00 0.00 C ATOM 112 C LEU A 8 7.241 17.242 -7.859 1.00 0.00 C ATOM 113 O LEU A 8 8.446 16.993 -7.917 1.00 0.00 O ATOM 114 CB LEU A 8 6.590 16.902 -5.429 1.00 0.00 C ATOM 115 CG LEU A 8 5.759 18.101 -4.955 1.00 0.00 C ATOM 116 CD1 LEU A 8 6.281 18.555 -3.594 1.00 0.00 C ATOM 117 CD2 LEU A 8 5.817 19.301 -5.894 1.00 0.00 C ATOM 0 H LEU A 8 7.398 14.733 -6.419 1.00 0.00 H new ATOM 0 HA LEU A 8 5.306 16.690 -7.129 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.380 16.054 -4.777 1.00 0.00 H new ATOM 0 HB3 LEU A 8 7.647 17.142 -5.309 1.00 0.00 H new ATOM 0 HG LEU A 8 4.724 17.761 -4.918 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.698 19.408 -3.246 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.191 17.738 -2.879 1.00 0.00 H new ATOM 0 HD13 LEU A 8 7.328 18.844 -3.684 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.205 20.108 -5.491 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.849 19.640 -5.988 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.439 19.014 -6.875 1.00 0.00 H new ATOM 129 N ILE A 9 6.663 18.167 -8.624 1.00 0.00 N ATOM 130 CA ILE A 9 7.396 18.978 -9.587 1.00 0.00 C ATOM 131 C ILE A 9 7.793 20.302 -8.940 1.00 0.00 C ATOM 132 O ILE A 9 6.945 20.995 -8.383 1.00 0.00 O ATOM 133 CB ILE A 9 6.531 19.205 -10.832 1.00 0.00 C ATOM 134 CG1 ILE A 9 6.175 17.864 -11.487 1.00 0.00 C ATOM 135 CG2 ILE A 9 7.283 20.098 -11.827 1.00 0.00 C ATOM 136 CD1 ILE A 9 5.080 18.043 -12.536 1.00 0.00 C ATOM 0 H ILE A 9 5.665 18.374 -8.590 1.00 0.00 H new ATOM 0 HA ILE A 9 8.305 18.461 -9.894 1.00 0.00 H new ATOM 0 HB ILE A 9 5.606 19.700 -10.536 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.063 17.435 -11.952 1.00 0.00 H new ATOM 0 HG13 ILE A 9 5.842 17.160 -10.725 1.00 0.00 H new ATOM 0 HG21 ILE A 9 6.666 20.258 -12.711 1.00 0.00 H new ATOM 0 HG22 ILE A 9 7.503 21.058 -11.360 1.00 0.00 H new ATOM 0 HG23 ILE A 9 8.215 19.614 -12.118 1.00 0.00 H new ATOM 0 HD11 ILE A 9 4.846 17.078 -12.986 1.00 0.00 H new ATOM 0 HD12 ILE A 9 4.186 18.450 -12.063 1.00 0.00 H new ATOM 0 HD13 ILE A 9 5.426 18.729 -13.309 1.00 0.00 H new ATOM 148 N VAL A 10 9.080 20.657 -9.014 1.00 0.00 N ATOM 149 CA VAL A 10 9.579 21.911 -8.459 1.00 0.00 C ATOM 150 C VAL A 10 10.459 22.600 -9.495 1.00 0.00 C ATOM 151 O VAL A 10 11.514 22.083 -9.860 1.00 0.00 O ATOM 152 CB VAL A 10 10.355 21.644 -7.167 1.00 0.00 C ATOM 153 CG1 VAL A 10 10.728 22.972 -6.511 1.00 0.00 C ATOM 154 CG2 VAL A 10 9.539 20.813 -6.174 1.00 0.00 C ATOM 0 H VAL A 10 9.798 20.084 -9.458 1.00 0.00 H new ATOM 0 HA VAL A 10 8.743 22.566 -8.216 1.00 0.00 H new ATOM 0 HB VAL A 10 11.250 21.081 -7.430 1.00 0.00 H new ATOM 0 HG11 VAL A 10 11.281 22.781 -5.591 1.00 0.00 H new ATOM 0 HG12 VAL A 10 11.349 23.553 -7.193 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.821 23.531 -6.280 1.00 0.00 H new ATOM 0 HG21 VAL A 10 10.126 20.646 -5.271 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.624 21.347 -5.919 1.00 0.00 H new ATOM 0 HG23 VAL A 10 9.285 19.853 -6.625 1.00 0.00 H new ATOM 164 N GLU A 11 10.022 23.770 -9.967 1.00 0.00 N ATOM 165 CA GLU A 11 10.677 24.482 -11.055 1.00 0.00 C ATOM 166 C GLU A 11 10.758 25.981 -10.778 1.00 0.00 C ATOM 167 O GLU A 11 10.047 26.503 -9.916 1.00 0.00 O ATOM 168 CB GLU A 11 9.897 24.245 -12.351 1.00 0.00 C ATOM 169 CG GLU A 11 10.114 22.831 -12.895 1.00 0.00 C ATOM 170 CD GLU A 11 11.567 22.600 -13.311 1.00 0.00 C ATOM 171 OE1 GLU A 11 12.242 23.602 -13.636 1.00 0.00 O ATOM 172 OE2 GLU A 11 11.996 21.425 -13.303 1.00 0.00 O ATOM 0 H GLU A 11 9.199 24.248 -9.600 1.00 0.00 H new ATOM 0 HA GLU A 11 11.695 24.102 -11.147 1.00 0.00 H new ATOM 0 HB2 GLU A 11 8.834 24.406 -12.170 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.207 24.974 -13.100 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.833 22.102 -12.135 1.00 0.00 H new ATOM 0 HG3 GLU A 11 9.460 22.667 -13.751 1.00 0.00 H new ATOM 179 N ASP A 12 11.632 26.665 -11.521 1.00 0.00 N ATOM 180 CA ASP A 12 11.800 28.112 -11.435 1.00 0.00 C ATOM 181 C ASP A 12 11.302 28.785 -12.721 1.00 0.00 C ATOM 182 O ASP A 12 11.429 29.995 -12.888 1.00 0.00 O ATOM 183 CB ASP A 12 13.270 28.429 -11.145 1.00 0.00 C ATOM 184 CG ASP A 12 13.491 29.918 -10.893 1.00 0.00 C ATOM 185 OD1 ASP A 12 12.869 30.439 -9.938 1.00 0.00 O ATOM 186 OD2 ASP A 12 14.276 30.528 -11.655 1.00 0.00 O ATOM 0 H ASP A 12 12.247 26.223 -12.204 1.00 0.00 H new ATOM 0 HA ASP A 12 11.199 28.512 -10.618 1.00 0.00 H new ATOM 0 HB2 ASP A 12 13.599 27.861 -10.275 1.00 0.00 H new ATOM 0 HB3 ASP A 12 13.884 28.108 -11.987 1.00 0.00 H new ATOM 191 N GLU A 13 10.733 27.991 -13.634 1.00 0.00 N ATOM 192 CA GLU A 13 10.222 28.461 -14.911 1.00 0.00 C ATOM 193 C GLU A 13 8.924 27.716 -15.227 1.00 0.00 C ATOM 194 O GLU A 13 8.967 26.515 -15.499 1.00 0.00 O ATOM 195 CB GLU A 13 11.292 28.207 -15.977 1.00 0.00 C ATOM 196 CG GLU A 13 10.830 28.616 -17.375 1.00 0.00 C ATOM 197 CD GLU A 13 10.494 30.105 -17.458 1.00 0.00 C ATOM 198 OE1 GLU A 13 11.415 30.924 -17.239 1.00 0.00 O ATOM 199 OE2 GLU A 13 9.315 30.412 -17.739 1.00 0.00 O ATOM 0 H GLU A 13 10.616 26.987 -13.497 1.00 0.00 H new ATOM 0 HA GLU A 13 10.002 29.528 -14.885 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.196 28.760 -15.720 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.555 27.149 -15.979 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.611 28.380 -18.098 1.00 0.00 H new ATOM 0 HG3 GLU A 13 9.953 28.031 -17.652 1.00 0.00 H new ATOM 206 N PRO A 14 7.772 28.396 -15.198 1.00 0.00 N ATOM 207 CA PRO A 14 6.468 27.801 -15.467 1.00 0.00 C ATOM 208 C PRO A 14 6.376 27.099 -16.821 1.00 0.00 C ATOM 209 O PRO A 14 5.516 26.241 -17.007 1.00 0.00 O ATOM 210 CB PRO A 14 5.476 28.961 -15.393 1.00 0.00 C ATOM 211 CG PRO A 14 6.164 29.962 -14.466 1.00 0.00 C ATOM 212 CD PRO A 14 7.630 29.796 -14.847 1.00 0.00 C ATOM 0 HA PRO A 14 6.263 27.014 -14.741 1.00 0.00 H new ATOM 0 HB2 PRO A 14 5.287 29.390 -16.377 1.00 0.00 H new ATOM 0 HB3 PRO A 14 4.513 28.641 -14.994 1.00 0.00 H new ATOM 0 HG2 PRO A 14 5.812 30.980 -14.633 1.00 0.00 H new ATOM 0 HG3 PRO A 14 5.988 29.732 -13.415 1.00 0.00 H new ATOM 0 HD2 PRO A 14 7.895 30.441 -15.684 1.00 0.00 H new ATOM 0 HD3 PRO A 14 8.286 30.063 -14.018 1.00 0.00 H new ATOM 220 N LEU A 15 7.247 27.448 -17.775 1.00 0.00 N ATOM 221 CA LEU A 15 7.235 26.811 -19.082 1.00 0.00 C ATOM 222 C LEU A 15 7.818 25.399 -18.990 1.00 0.00 C ATOM 223 O LEU A 15 7.381 24.499 -19.705 1.00 0.00 O ATOM 224 CB LEU A 15 8.022 27.683 -20.064 1.00 0.00 C ATOM 225 CG LEU A 15 8.040 27.102 -21.482 1.00 0.00 C ATOM 226 CD1 LEU A 15 6.630 26.963 -22.053 1.00 0.00 C ATOM 227 CD2 LEU A 15 8.841 28.030 -22.393 1.00 0.00 C ATOM 0 H LEU A 15 7.963 28.165 -17.660 1.00 0.00 H new ATOM 0 HA LEU A 15 6.211 26.715 -19.442 1.00 0.00 H new ATOM 0 HB2 LEU A 15 7.585 28.681 -20.089 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.046 27.793 -19.707 1.00 0.00 H new ATOM 0 HG LEU A 15 8.493 26.112 -21.432 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.684 26.548 -23.059 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.044 26.299 -21.418 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.154 27.943 -22.090 1.00 0.00 H new ATOM 0 HD21 LEU A 15 8.858 27.622 -23.404 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.376 29.016 -22.407 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.861 28.115 -22.019 1.00 0.00 H new ATOM 239 N ILE A 16 8.799 25.196 -18.109 1.00 0.00 N ATOM 240 CA ILE A 16 9.390 23.881 -17.917 1.00 0.00 C ATOM 241 C ILE A 16 8.451 23.034 -17.068 1.00 0.00 C ATOM 242 O ILE A 16 8.399 21.817 -17.231 1.00 0.00 O ATOM 243 CB ILE A 16 10.770 24.026 -17.262 1.00 0.00 C ATOM 244 CG1 ILE A 16 11.700 24.911 -18.107 1.00 0.00 C ATOM 245 CG2 ILE A 16 11.411 22.651 -17.059 1.00 0.00 C ATOM 246 CD1 ILE A 16 11.938 24.369 -19.518 1.00 0.00 C ATOM 0 H ILE A 16 9.197 25.928 -17.520 1.00 0.00 H new ATOM 0 HA ILE A 16 9.529 23.383 -18.876 1.00 0.00 H new ATOM 0 HB ILE A 16 10.627 24.505 -16.293 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.273 25.911 -18.177 1.00 0.00 H new ATOM 0 HG13 ILE A 16 12.658 25.009 -17.597 1.00 0.00 H new ATOM 0 HG21 ILE A 16 12.389 22.771 -16.594 1.00 0.00 H new ATOM 0 HG22 ILE A 16 10.774 22.044 -16.415 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.526 22.157 -18.024 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.603 25.042 -20.059 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.394 23.381 -19.456 1.00 0.00 H new ATOM 0 HD13 ILE A 16 10.987 24.297 -20.045 1.00 0.00 H new ATOM 258 N ALA A 17 7.701 23.668 -16.162 1.00 0.00 N ATOM 259 CA ALA A 17 6.739 22.959 -15.337 1.00 0.00 C ATOM 260 C ALA A 17 5.585 22.435 -16.193 1.00 0.00 C ATOM 261 O ALA A 17 4.944 21.454 -15.826 1.00 0.00 O ATOM 262 CB ALA A 17 6.229 23.909 -14.258 1.00 0.00 C ATOM 0 H ALA A 17 7.747 24.672 -15.987 1.00 0.00 H new ATOM 0 HA ALA A 17 7.216 22.099 -14.867 1.00 0.00 H new ATOM 0 HB1 ALA A 17 5.505 23.391 -13.630 1.00 0.00 H new ATOM 0 HB2 ALA A 17 7.065 24.246 -13.646 1.00 0.00 H new ATOM 0 HB3 ALA A 17 5.752 24.770 -14.727 1.00 0.00 H new ATOM 268 N MET A 18 5.328 23.079 -17.334 1.00 0.00 N ATOM 269 CA MET A 18 4.290 22.638 -18.250 1.00 0.00 C ATOM 270 C MET A 18 4.789 21.439 -19.056 1.00 0.00 C ATOM 271 O MET A 18 4.003 20.566 -19.422 1.00 0.00 O ATOM 272 CB MET A 18 3.900 23.806 -19.159 1.00 0.00 C ATOM 273 CG MET A 18 2.756 23.426 -20.099 1.00 0.00 C ATOM 274 SD MET A 18 1.231 22.893 -19.272 1.00 0.00 S ATOM 275 CE MET A 18 0.789 24.429 -18.416 1.00 0.00 C ATOM 0 H MET A 18 5.831 23.911 -17.641 1.00 0.00 H new ATOM 0 HA MET A 18 3.406 22.320 -17.698 1.00 0.00 H new ATOM 0 HB2 MET A 18 3.603 24.660 -18.549 1.00 0.00 H new ATOM 0 HB3 MET A 18 4.765 24.118 -19.744 1.00 0.00 H new ATOM 0 HG2 MET A 18 2.527 24.282 -20.734 1.00 0.00 H new ATOM 0 HG3 MET A 18 3.095 22.624 -20.755 1.00 0.00 H new ATOM 0 HE1 MET A 18 -0.234 24.358 -18.047 1.00 0.00 H new ATOM 0 HE2 MET A 18 1.467 24.586 -17.577 1.00 0.00 H new ATOM 0 HE3 MET A 18 0.868 25.267 -19.108 1.00 0.00 H new ATOM 285 N MET A 19 6.097 21.386 -19.334 1.00 0.00 N ATOM 286 CA MET A 19 6.670 20.246 -20.031 1.00 0.00 C ATOM 287 C MET A 19 6.767 19.043 -19.097 1.00 0.00 C ATOM 288 O MET A 19 6.670 17.906 -19.552 1.00 0.00 O ATOM 289 CB MET A 19 8.050 20.606 -20.592 1.00 0.00 C ATOM 290 CG MET A 19 7.944 21.694 -21.661 1.00 0.00 C ATOM 291 SD MET A 19 6.856 21.294 -23.060 1.00 0.00 S ATOM 292 CE MET A 19 7.700 19.826 -23.706 1.00 0.00 C ATOM 0 H MET A 19 6.766 22.115 -19.087 1.00 0.00 H new ATOM 0 HA MET A 19 6.017 19.982 -20.862 1.00 0.00 H new ATOM 0 HB2 MET A 19 8.696 20.948 -19.784 1.00 0.00 H new ATOM 0 HB3 MET A 19 8.516 19.717 -21.018 1.00 0.00 H new ATOM 0 HG2 MET A 19 7.585 22.610 -21.191 1.00 0.00 H new ATOM 0 HG3 MET A 19 8.942 21.903 -22.045 1.00 0.00 H new ATOM 0 HE1 MET A 19 7.294 19.575 -24.686 1.00 0.00 H new ATOM 0 HE2 MET A 19 8.767 20.030 -23.797 1.00 0.00 H new ATOM 0 HE3 MET A 19 7.547 18.989 -23.024 1.00 0.00 H new ATOM 302 N LEU A 20 6.950 19.276 -17.793 1.00 0.00 N ATOM 303 CA LEU A 20 6.984 18.187 -16.831 1.00 0.00 C ATOM 304 C LEU A 20 5.595 17.569 -16.698 1.00 0.00 C ATOM 305 O LEU A 20 5.481 16.379 -16.419 1.00 0.00 O ATOM 306 CB LEU A 20 7.484 18.708 -15.480 1.00 0.00 C ATOM 307 CG LEU A 20 8.968 18.414 -15.231 1.00 0.00 C ATOM 308 CD1 LEU A 20 9.173 16.912 -15.006 1.00 0.00 C ATOM 309 CD2 LEU A 20 9.849 18.891 -16.381 1.00 0.00 C ATOM 0 H LEU A 20 7.075 20.204 -17.389 1.00 0.00 H new ATOM 0 HA LEU A 20 7.670 17.414 -17.178 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.320 19.784 -15.430 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.892 18.258 -14.683 1.00 0.00 H new ATOM 0 HG LEU A 20 9.265 18.965 -14.339 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.230 16.711 -14.830 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.594 16.591 -14.140 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.842 16.363 -15.888 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.891 18.661 -16.160 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.553 18.385 -17.300 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.733 19.968 -16.506 1.00 0.00 H new ATOM 321 N GLU A 21 4.536 18.356 -16.897 1.00 0.00 N ATOM 322 CA GLU A 21 3.185 17.814 -16.884 1.00 0.00 C ATOM 323 C GLU A 21 2.903 17.069 -18.188 1.00 0.00 C ATOM 324 O GLU A 21 2.045 16.189 -18.224 1.00 0.00 O ATOM 325 CB GLU A 21 2.180 18.950 -16.689 1.00 0.00 C ATOM 326 CG GLU A 21 2.181 19.460 -15.248 1.00 0.00 C ATOM 327 CD GLU A 21 1.461 18.484 -14.317 1.00 0.00 C ATOM 328 OE1 GLU A 21 0.267 18.731 -14.033 1.00 0.00 O ATOM 329 OE2 GLU A 21 2.106 17.499 -13.894 1.00 0.00 O ATOM 0 H GLU A 21 4.591 19.360 -17.067 1.00 0.00 H new ATOM 0 HA GLU A 21 3.088 17.109 -16.058 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.421 19.770 -17.366 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.181 18.602 -16.952 1.00 0.00 H new ATOM 0 HG2 GLU A 21 3.208 19.600 -14.909 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.695 20.435 -15.204 1.00 0.00 H new ATOM 336 N ASP A 22 3.619 17.410 -19.262 1.00 0.00 N ATOM 337 CA ASP A 22 3.405 16.783 -20.555 1.00 0.00 C ATOM 338 C ASP A 22 4.111 15.430 -20.639 1.00 0.00 C ATOM 339 O ASP A 22 3.533 14.469 -21.143 1.00 0.00 O ATOM 340 CB ASP A 22 3.882 17.727 -21.657 1.00 0.00 C ATOM 341 CG ASP A 22 3.589 17.150 -23.038 1.00 0.00 C ATOM 342 OD1 ASP A 22 4.553 16.690 -23.690 1.00 0.00 O ATOM 343 OD2 ASP A 22 2.401 17.172 -23.431 1.00 0.00 O ATOM 0 H ASP A 22 4.352 18.119 -19.255 1.00 0.00 H new ATOM 0 HA ASP A 22 2.340 16.593 -20.686 1.00 0.00 H new ATOM 0 HB2 ASP A 22 3.389 18.693 -21.551 1.00 0.00 H new ATOM 0 HB3 ASP A 22 4.953 17.902 -21.552 1.00 0.00 H new ATOM 348 N PHE A 23 5.356 15.335 -20.155 1.00 0.00 N ATOM 349 CA PHE A 23 6.088 14.082 -20.234 1.00 0.00 C ATOM 350 C PHE A 23 5.591 13.069 -19.206 1.00 0.00 C ATOM 351 O PHE A 23 5.685 11.865 -19.442 1.00 0.00 O ATOM 352 CB PHE A 23 7.581 14.343 -20.058 1.00 0.00 C ATOM 353 CG PHE A 23 8.266 14.866 -21.303 1.00 0.00 C ATOM 354 CD1 PHE A 23 8.511 13.995 -22.373 1.00 0.00 C ATOM 355 CD2 PHE A 23 8.657 16.210 -21.395 1.00 0.00 C ATOM 356 CE1 PHE A 23 9.148 14.465 -23.528 1.00 0.00 C ATOM 357 CE2 PHE A 23 9.283 16.684 -22.557 1.00 0.00 C ATOM 358 CZ PHE A 23 9.532 15.811 -23.623 1.00 0.00 C ATOM 0 H PHE A 23 5.864 16.102 -19.713 1.00 0.00 H new ATOM 0 HA PHE A 23 5.914 13.650 -21.219 1.00 0.00 H new ATOM 0 HB2 PHE A 23 7.721 15.061 -19.250 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.067 13.417 -19.750 1.00 0.00 H new ATOM 0 HD1 PHE A 23 8.208 12.960 -22.307 1.00 0.00 H new ATOM 0 HD2 PHE A 23 8.475 16.881 -20.569 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.344 13.790 -24.348 1.00 0.00 H new ATOM 0 HE2 PHE A 23 9.573 17.722 -22.630 1.00 0.00 H new ATOM 0 HZ PHE A 23 10.019 16.173 -24.517 1.00 0.00 H new ATOM 368 N LEU A 24 5.058 13.524 -18.068 1.00 0.00 N ATOM 369 CA LEU A 24 4.543 12.601 -17.069 1.00 0.00 C ATOM 370 C LEU A 24 3.155 12.093 -17.461 1.00 0.00 C ATOM 371 O LEU A 24 2.702 11.080 -16.927 1.00 0.00 O ATOM 372 CB LEU A 24 4.547 13.272 -15.692 1.00 0.00 C ATOM 373 CG LEU A 24 5.968 13.579 -15.199 1.00 0.00 C ATOM 374 CD1 LEU A 24 5.887 14.304 -13.858 1.00 0.00 C ATOM 375 CD2 LEU A 24 6.784 12.306 -14.986 1.00 0.00 C ATOM 0 H LEU A 24 4.975 14.511 -17.824 1.00 0.00 H new ATOM 0 HA LEU A 24 5.193 11.728 -17.017 1.00 0.00 H new ATOM 0 HB2 LEU A 24 3.973 14.197 -15.739 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.047 12.623 -14.973 1.00 0.00 H new ATOM 0 HG LEU A 24 6.454 14.190 -15.960 1.00 0.00 H new ATOM 0 HD11 LEU A 24 6.893 14.525 -13.502 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.333 15.235 -13.980 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.377 13.671 -13.132 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.783 12.568 -14.637 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.293 11.679 -14.242 1.00 0.00 H new ATOM 0 HD23 LEU A 24 6.860 11.761 -15.927 1.00 0.00 H new ATOM 387 N GLU A 25 2.472 12.779 -18.383 1.00 0.00 N ATOM 388 CA GLU A 25 1.184 12.322 -18.888 1.00 0.00 C ATOM 389 C GLU A 25 1.379 11.322 -20.031 1.00 0.00 C ATOM 390 O GLU A 25 0.519 10.475 -20.267 1.00 0.00 O ATOM 391 CB GLU A 25 0.373 13.538 -19.333 1.00 0.00 C ATOM 392 CG GLU A 25 -1.039 13.139 -19.761 1.00 0.00 C ATOM 393 CD GLU A 25 -1.877 14.372 -20.097 1.00 0.00 C ATOM 394 OE1 GLU A 25 -1.818 14.812 -21.269 1.00 0.00 O ATOM 395 OE2 GLU A 25 -2.570 14.870 -19.181 1.00 0.00 O ATOM 0 H GLU A 25 2.796 13.655 -18.793 1.00 0.00 H new ATOM 0 HA GLU A 25 0.637 11.802 -18.101 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.318 14.259 -18.517 1.00 0.00 H new ATOM 0 HB3 GLU A 25 0.880 14.032 -20.162 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -0.988 12.482 -20.629 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.520 12.575 -18.962 1.00 0.00 H new ATOM 402 N VAL A 26 2.510 11.410 -20.739 1.00 0.00 N ATOM 403 CA VAL A 26 2.825 10.496 -21.834 1.00 0.00 C ATOM 404 C VAL A 26 3.428 9.198 -21.302 1.00 0.00 C ATOM 405 O VAL A 26 3.375 8.172 -21.980 1.00 0.00 O ATOM 406 CB VAL A 26 3.772 11.207 -22.810 1.00 0.00 C ATOM 407 CG1 VAL A 26 4.318 10.256 -23.876 1.00 0.00 C ATOM 408 CG2 VAL A 26 3.020 12.323 -23.534 1.00 0.00 C ATOM 0 H VAL A 26 3.228 12.114 -20.568 1.00 0.00 H new ATOM 0 HA VAL A 26 1.912 10.222 -22.363 1.00 0.00 H new ATOM 0 HB VAL A 26 4.601 11.598 -22.220 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.983 10.802 -24.545 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.870 9.448 -23.395 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.490 9.838 -24.449 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.695 12.826 -24.227 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.183 11.898 -24.087 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.646 13.042 -22.805 1.00 0.00 H new ATOM 418 N LEU A 27 4.002 9.227 -20.095 1.00 0.00 N ATOM 419 CA LEU A 27 4.626 8.060 -19.489 1.00 0.00 C ATOM 420 C LEU A 27 3.718 7.407 -18.445 1.00 0.00 C ATOM 421 O LEU A 27 4.188 6.612 -17.632 1.00 0.00 O ATOM 422 CB LEU A 27 5.998 8.440 -18.924 1.00 0.00 C ATOM 423 CG LEU A 27 6.964 8.908 -20.021 1.00 0.00 C ATOM 424 CD1 LEU A 27 8.283 9.338 -19.381 1.00 0.00 C ATOM 425 CD2 LEU A 27 7.251 7.800 -21.033 1.00 0.00 C ATOM 0 H LEU A 27 4.044 10.065 -19.515 1.00 0.00 H new ATOM 0 HA LEU A 27 4.779 7.304 -20.259 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.879 9.232 -18.185 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.427 7.582 -18.406 1.00 0.00 H new ATOM 0 HG LEU A 27 6.495 9.741 -20.545 1.00 0.00 H new ATOM 0 HD11 LEU A 27 8.972 9.671 -20.157 1.00 0.00 H new ATOM 0 HD12 LEU A 27 8.100 10.155 -18.683 1.00 0.00 H new ATOM 0 HD13 LEU A 27 8.720 8.495 -18.846 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.939 8.171 -21.793 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.700 6.948 -20.522 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.320 7.490 -21.507 1.00 0.00 H new ATOM 437 N ASP A 28 2.425 7.738 -18.461 1.00 0.00 N ATOM 438 CA ASP A 28 1.426 7.158 -17.569 1.00 0.00 C ATOM 439 C ASP A 28 1.846 7.242 -16.097 1.00 0.00 C ATOM 440 O ASP A 28 1.595 6.326 -15.316 1.00 0.00 O ATOM 441 CB ASP A 28 1.082 5.737 -18.034 1.00 0.00 C ATOM 442 CG ASP A 28 -0.133 5.168 -17.300 1.00 0.00 C ATOM 443 OD1 ASP A 28 -0.057 3.994 -16.875 1.00 0.00 O ATOM 444 OD2 ASP A 28 -1.134 5.909 -17.171 1.00 0.00 O ATOM 0 H ASP A 28 2.039 8.428 -19.106 1.00 0.00 H new ATOM 0 HA ASP A 28 0.512 7.748 -17.626 1.00 0.00 H new ATOM 0 HB2 ASP A 28 0.886 5.745 -19.106 1.00 0.00 H new ATOM 0 HB3 ASP A 28 1.941 5.085 -17.872 1.00 0.00 H new ATOM 449 N LYS A 29 2.492 8.347 -15.721 1.00 0.00 N ATOM 450 CA LYS A 29 2.967 8.578 -14.363 1.00 0.00 C ATOM 451 C LYS A 29 1.839 9.181 -13.522 1.00 0.00 C ATOM 452 O LYS A 29 0.847 9.655 -14.076 1.00 0.00 O ATOM 453 CB LYS A 29 4.194 9.494 -14.429 1.00 0.00 C ATOM 454 CG LYS A 29 5.393 8.923 -13.667 1.00 0.00 C ATOM 455 CD LYS A 29 5.121 8.856 -12.168 1.00 0.00 C ATOM 456 CE LYS A 29 6.425 8.666 -11.394 1.00 0.00 C ATOM 457 NZ LYS A 29 7.118 7.422 -11.779 1.00 0.00 N ATOM 0 H LYS A 29 2.701 9.113 -16.361 1.00 0.00 H new ATOM 0 HA LYS A 29 3.261 7.643 -13.885 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.471 9.650 -15.472 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.937 10.470 -14.017 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.622 7.925 -14.041 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.271 9.542 -13.851 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.627 9.771 -11.841 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.440 8.032 -11.953 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.081 9.518 -11.574 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.213 8.647 -10.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.044 7.381 -11.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.546 6.603 -11.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.253 7.405 -12.810 1.00 0.00 H new ATOM 471 N THR A 30 1.984 9.168 -12.193 1.00 0.00 N ATOM 472 CA THR A 30 0.965 9.692 -11.286 1.00 0.00 C ATOM 473 C THR A 30 1.509 10.872 -10.481 1.00 0.00 C ATOM 474 O THR A 30 1.749 10.739 -9.283 1.00 0.00 O ATOM 475 CB THR A 30 0.441 8.565 -10.383 1.00 0.00 C ATOM 476 OG1 THR A 30 0.097 7.449 -11.176 1.00 0.00 O ATOM 477 CG2 THR A 30 -0.810 9.017 -9.634 1.00 0.00 C ATOM 0 H THR A 30 2.808 8.795 -11.720 1.00 0.00 H new ATOM 0 HA THR A 30 0.125 10.070 -11.869 1.00 0.00 H new ATOM 0 HB THR A 30 1.223 8.306 -9.669 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.236 6.729 -10.601 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.167 8.206 -8.999 1.00 0.00 H new ATOM 0 HG22 THR A 30 -0.571 9.883 -9.016 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.586 9.285 -10.351 1.00 0.00 H new ATOM 485 N PRO A 31 1.715 12.040 -11.109 1.00 0.00 N ATOM 486 CA PRO A 31 2.219 13.222 -10.434 1.00 0.00 C ATOM 487 C PRO A 31 1.216 13.694 -9.381 1.00 0.00 C ATOM 488 O PRO A 31 0.035 13.345 -9.445 1.00 0.00 O ATOM 489 CB PRO A 31 2.430 14.268 -11.531 1.00 0.00 C ATOM 490 CG PRO A 31 1.440 13.840 -12.614 1.00 0.00 C ATOM 491 CD PRO A 31 1.459 12.317 -12.510 1.00 0.00 C ATOM 0 HA PRO A 31 3.151 13.030 -9.903 1.00 0.00 H new ATOM 0 HB2 PRO A 31 2.223 15.276 -11.172 1.00 0.00 H new ATOM 0 HB3 PRO A 31 3.456 14.265 -11.899 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.444 14.245 -12.434 1.00 0.00 H new ATOM 0 HG3 PRO A 31 1.749 14.181 -13.602 1.00 0.00 H new ATOM 0 HD2 PRO A 31 0.510 11.888 -12.830 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.234 11.888 -13.145 1.00 0.00 H new ATOM 499 N VAL A 32 1.682 14.484 -8.409 1.00 0.00 N ATOM 500 CA VAL A 32 0.857 14.875 -7.270 1.00 0.00 C ATOM 501 C VAL A 32 0.740 16.384 -7.089 1.00 0.00 C ATOM 502 O VAL A 32 -0.074 16.835 -6.283 1.00 0.00 O ATOM 503 CB VAL A 32 1.399 14.223 -5.992 1.00 0.00 C ATOM 504 CG1 VAL A 32 1.389 12.707 -6.142 1.00 0.00 C ATOM 505 CG2 VAL A 32 2.838 14.657 -5.697 1.00 0.00 C ATOM 0 H VAL A 32 2.628 14.864 -8.391 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.152 14.519 -7.476 1.00 0.00 H new ATOM 0 HB VAL A 32 0.756 14.541 -5.172 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.775 12.249 -5.231 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.369 12.365 -6.316 1.00 0.00 H new ATOM 0 HG13 VAL A 32 2.016 12.421 -6.986 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.184 14.173 -4.784 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.483 14.369 -6.527 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.873 15.739 -5.570 1.00 0.00 H new ATOM 515 N GLY A 33 1.530 17.177 -7.817 1.00 0.00 N ATOM 516 CA GLY A 33 1.438 18.624 -7.717 1.00 0.00 C ATOM 517 C GLY A 33 2.647 19.324 -8.328 1.00 0.00 C ATOM 518 O GLY A 33 3.614 18.680 -8.731 1.00 0.00 O ATOM 0 H GLY A 33 2.233 16.839 -8.475 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.532 18.964 -8.219 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.347 18.909 -6.669 1.00 0.00 H new ATOM 522 N THR A 34 2.568 20.655 -8.387 1.00 0.00 N ATOM 523 CA THR A 34 3.619 21.504 -8.922 1.00 0.00 C ATOM 524 C THR A 34 3.748 22.754 -8.057 1.00 0.00 C ATOM 525 O THR A 34 2.739 23.317 -7.630 1.00 0.00 O ATOM 526 CB THR A 34 3.282 21.894 -10.366 1.00 0.00 C ATOM 527 OG1 THR A 34 3.126 20.738 -11.156 1.00 0.00 O ATOM 528 CG2 THR A 34 4.391 22.752 -10.972 1.00 0.00 C ATOM 0 H THR A 34 1.755 21.176 -8.057 1.00 0.00 H new ATOM 0 HA THR A 34 4.566 20.964 -8.915 1.00 0.00 H new ATOM 0 HB THR A 34 2.353 22.465 -10.349 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.909 20.997 -12.076 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.128 23.016 -11.997 1.00 0.00 H new ATOM 0 HG22 THR A 34 4.511 23.661 -10.383 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.326 22.192 -10.970 1.00 0.00 H new ATOM 536 N VAL A 35 4.986 23.185 -7.798 1.00 0.00 N ATOM 537 CA VAL A 35 5.268 24.372 -7.001 1.00 0.00 C ATOM 538 C VAL A 35 6.446 25.135 -7.597 1.00 0.00 C ATOM 539 O VAL A 35 7.244 24.571 -8.341 1.00 0.00 O ATOM 540 CB VAL A 35 5.536 23.999 -5.535 1.00 0.00 C ATOM 541 CG1 VAL A 35 4.296 23.375 -4.896 1.00 0.00 C ATOM 542 CG2 VAL A 35 6.696 23.018 -5.414 1.00 0.00 C ATOM 0 H VAL A 35 5.823 22.713 -8.140 1.00 0.00 H new ATOM 0 HA VAL A 35 4.392 25.020 -7.020 1.00 0.00 H new ATOM 0 HB VAL A 35 5.792 24.922 -5.014 1.00 0.00 H new ATOM 0 HG11 VAL A 35 4.511 23.120 -3.858 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.471 24.087 -4.931 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.020 22.473 -5.442 1.00 0.00 H new ATOM 0 HG21 VAL A 35 6.859 22.775 -4.364 1.00 0.00 H new ATOM 0 HG22 VAL A 35 6.461 22.107 -5.965 1.00 0.00 H new ATOM 0 HG23 VAL A 35 7.599 23.469 -5.826 1.00 0.00 H new ATOM 552 N ASP A 36 6.549 26.425 -7.262 1.00 0.00 N ATOM 553 CA ASP A 36 7.603 27.290 -7.778 1.00 0.00 C ATOM 554 C ASP A 36 8.190 28.183 -6.684 1.00 0.00 C ATOM 555 O ASP A 36 9.044 29.022 -6.965 1.00 0.00 O ATOM 556 CB ASP A 36 7.048 28.114 -8.942 1.00 0.00 C ATOM 557 CG ASP A 36 5.881 28.995 -8.501 1.00 0.00 C ATOM 558 OD1 ASP A 36 4.723 28.555 -8.678 1.00 0.00 O ATOM 559 OD2 ASP A 36 6.151 30.101 -7.985 1.00 0.00 O ATOM 0 H ASP A 36 5.903 26.894 -6.627 1.00 0.00 H new ATOM 0 HA ASP A 36 8.424 26.671 -8.139 1.00 0.00 H new ATOM 0 HB2 ASP A 36 7.840 28.738 -9.357 1.00 0.00 H new ATOM 0 HB3 ASP A 36 6.720 27.445 -9.738 1.00 0.00 H new ATOM 564 N THR A 37 7.730 28.001 -5.441 1.00 0.00 N ATOM 565 CA THR A 37 8.204 28.768 -4.293 1.00 0.00 C ATOM 566 C THR A 37 8.357 27.827 -3.103 1.00 0.00 C ATOM 567 O THR A 37 7.629 26.842 -2.988 1.00 0.00 O ATOM 568 CB THR A 37 7.224 29.906 -3.984 1.00 0.00 C ATOM 569 OG1 THR A 37 7.069 30.730 -5.118 1.00 0.00 O ATOM 570 CG2 THR A 37 7.726 30.790 -2.844 1.00 0.00 C ATOM 0 H THR A 37 7.015 27.313 -5.206 1.00 0.00 H new ATOM 0 HA THR A 37 9.173 29.217 -4.512 1.00 0.00 H new ATOM 0 HB THR A 37 6.280 29.443 -3.699 1.00 0.00 H new ATOM 0 HG1 THR A 37 6.128 30.990 -5.208 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.004 31.585 -2.655 1.00 0.00 H new ATOM 0 HG22 THR A 37 7.847 30.188 -1.943 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.685 31.229 -3.119 1.00 0.00 H new ATOM 578 N VAL A 38 9.304 28.128 -2.208 1.00 0.00 N ATOM 579 CA VAL A 38 9.609 27.261 -1.074 1.00 0.00 C ATOM 580 C VAL A 38 8.412 27.133 -0.136 1.00 0.00 C ATOM 581 O VAL A 38 8.219 26.085 0.477 1.00 0.00 O ATOM 582 CB VAL A 38 10.828 27.820 -0.327 1.00 0.00 C ATOM 583 CG1 VAL A 38 11.171 26.964 0.892 1.00 0.00 C ATOM 584 CG2 VAL A 38 12.048 27.844 -1.251 1.00 0.00 C ATOM 0 H VAL A 38 9.874 28.973 -2.252 1.00 0.00 H new ATOM 0 HA VAL A 38 9.837 26.262 -1.445 1.00 0.00 H new ATOM 0 HB VAL A 38 10.575 28.829 -0.002 1.00 0.00 H new ATOM 0 HG11 VAL A 38 12.038 27.385 1.400 1.00 0.00 H new ATOM 0 HG12 VAL A 38 10.322 26.948 1.576 1.00 0.00 H new ATOM 0 HG13 VAL A 38 11.397 25.947 0.571 1.00 0.00 H new ATOM 0 HG21 VAL A 38 12.906 28.242 -0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.269 26.831 -1.588 1.00 0.00 H new ATOM 0 HG23 VAL A 38 11.838 28.476 -2.114 1.00 0.00 H new ATOM 594 N ALA A 39 7.596 28.183 -0.015 1.00 0.00 N ATOM 595 CA ALA A 39 6.450 28.154 0.878 1.00 0.00 C ATOM 596 C ALA A 39 5.396 27.162 0.383 1.00 0.00 C ATOM 597 O ALA A 39 4.667 26.582 1.185 1.00 0.00 O ATOM 598 CB ALA A 39 5.863 29.562 0.975 1.00 0.00 C ATOM 0 H ALA A 39 7.712 29.058 -0.525 1.00 0.00 H new ATOM 0 HA ALA A 39 6.771 27.824 1.866 1.00 0.00 H new ATOM 0 HB1 ALA A 39 5.002 29.552 1.643 1.00 0.00 H new ATOM 0 HB2 ALA A 39 6.618 30.245 1.366 1.00 0.00 H new ATOM 0 HB3 ALA A 39 5.550 29.895 -0.015 1.00 0.00 H new ATOM 604 N GLY A 40 5.315 26.960 -0.936 1.00 0.00 N ATOM 605 CA GLY A 40 4.377 26.014 -1.516 1.00 0.00 C ATOM 606 C GLY A 40 4.904 24.590 -1.398 1.00 0.00 C ATOM 607 O GLY A 40 4.120 23.647 -1.302 1.00 0.00 O ATOM 0 H GLY A 40 5.895 27.446 -1.620 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.414 26.093 -1.011 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.208 26.259 -2.565 1.00 0.00 H new ATOM 611 N ALA A 41 6.228 24.420 -1.403 1.00 0.00 N ATOM 612 CA ALA A 41 6.836 23.106 -1.301 1.00 0.00 C ATOM 613 C ALA A 41 6.713 22.567 0.125 1.00 0.00 C ATOM 614 O ALA A 41 6.608 21.355 0.321 1.00 0.00 O ATOM 615 CB ALA A 41 8.301 23.202 -1.719 1.00 0.00 C ATOM 0 H ALA A 41 6.897 25.186 -1.477 1.00 0.00 H new ATOM 0 HA ALA A 41 6.318 22.413 -1.963 1.00 0.00 H new ATOM 0 HB1 ALA A 41 8.766 22.219 -1.645 1.00 0.00 H new ATOM 0 HB2 ALA A 41 8.363 23.557 -2.748 1.00 0.00 H new ATOM 0 HB3 ALA A 41 8.822 23.899 -1.063 1.00 0.00 H new ATOM 621 N LEU A 42 6.721 23.458 1.122 1.00 0.00 N ATOM 622 CA LEU A 42 6.527 23.057 2.507 1.00 0.00 C ATOM 623 C LEU A 42 5.045 22.777 2.762 1.00 0.00 C ATOM 624 O LEU A 42 4.711 21.986 3.640 1.00 0.00 O ATOM 625 CB LEU A 42 7.058 24.152 3.437 1.00 0.00 C ATOM 626 CG LEU A 42 8.529 23.956 3.842 1.00 0.00 C ATOM 627 CD1 LEU A 42 8.671 22.752 4.773 1.00 0.00 C ATOM 628 CD2 LEU A 42 9.448 23.756 2.640 1.00 0.00 C ATOM 0 H LEU A 42 6.860 24.460 0.989 1.00 0.00 H new ATOM 0 HA LEU A 42 7.082 22.141 2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.951 25.119 2.945 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.443 24.183 4.337 1.00 0.00 H new ATOM 0 HG LEU A 42 8.831 24.870 4.353 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.718 22.628 5.050 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.075 22.914 5.671 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.322 21.854 4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.474 23.623 2.984 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.134 22.872 2.085 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.394 24.630 1.991 1.00 0.00 H new ATOM 640 N ALA A 43 4.151 23.416 2.004 1.00 0.00 N ATOM 641 CA ALA A 43 2.724 23.171 2.134 1.00 0.00 C ATOM 642 C ALA A 43 2.351 21.801 1.561 1.00 0.00 C ATOM 643 O ALA A 43 1.344 21.219 1.957 1.00 0.00 O ATOM 644 CB ALA A 43 1.961 24.289 1.428 1.00 0.00 C ATOM 0 H ALA A 43 4.397 24.107 1.295 1.00 0.00 H new ATOM 0 HA ALA A 43 2.452 23.164 3.190 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.889 24.113 1.521 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.212 25.246 1.885 1.00 0.00 H new ATOM 0 HB3 ALA A 43 2.236 24.307 0.373 1.00 0.00 H new ATOM 650 N ARG A 44 3.161 21.284 0.628 1.00 0.00 N ATOM 651 CA ARG A 44 2.915 19.984 0.012 1.00 0.00 C ATOM 652 C ARG A 44 3.523 18.836 0.817 1.00 0.00 C ATOM 653 O ARG A 44 2.996 17.727 0.780 1.00 0.00 O ATOM 654 CB ARG A 44 3.490 19.992 -1.406 1.00 0.00 C ATOM 655 CG ARG A 44 2.680 20.875 -2.360 1.00 0.00 C ATOM 656 CD ARG A 44 1.311 20.261 -2.649 1.00 0.00 C ATOM 657 NE ARG A 44 0.580 21.056 -3.642 1.00 0.00 N ATOM 658 CZ ARG A 44 -0.373 20.567 -4.443 1.00 0.00 C ATOM 659 NH1 ARG A 44 -0.729 19.286 -4.371 1.00 0.00 N ATOM 660 NH2 ARG A 44 -0.973 21.362 -5.324 1.00 0.00 N ATOM 0 H ARG A 44 3.998 21.755 0.284 1.00 0.00 H new ATOM 0 HA ARG A 44 1.838 19.818 -0.013 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.521 20.345 -1.375 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.514 18.973 -1.791 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.553 21.866 -1.924 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.228 21.005 -3.293 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.435 19.241 -3.013 1.00 0.00 H new ATOM 0 HD3 ARG A 44 0.732 20.202 -1.727 1.00 0.00 H new ATOM 0 HE ARG A 44 0.814 22.045 -3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -0.274 18.667 -3.700 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -1.457 18.924 -4.987 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.706 22.344 -5.389 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.700 20.989 -5.935 1.00 0.00 H new ATOM 674 N VAL A 45 4.621 19.076 1.546 1.00 0.00 N ATOM 675 CA VAL A 45 5.273 18.006 2.291 1.00 0.00 C ATOM 676 C VAL A 45 4.598 17.772 3.644 1.00 0.00 C ATOM 677 O VAL A 45 4.723 16.690 4.220 1.00 0.00 O ATOM 678 CB VAL A 45 6.770 18.305 2.426 1.00 0.00 C ATOM 679 CG1 VAL A 45 7.038 19.358 3.502 1.00 0.00 C ATOM 680 CG2 VAL A 45 7.540 17.035 2.785 1.00 0.00 C ATOM 0 H VAL A 45 5.067 19.990 1.632 1.00 0.00 H new ATOM 0 HA VAL A 45 5.167 17.073 1.737 1.00 0.00 H new ATOM 0 HB VAL A 45 7.107 18.687 1.463 1.00 0.00 H new ATOM 0 HG11 VAL A 45 8.110 19.544 3.570 1.00 0.00 H new ATOM 0 HG12 VAL A 45 6.524 20.283 3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 45 6.671 18.998 4.463 1.00 0.00 H new ATOM 0 HG21 VAL A 45 8.601 17.267 2.877 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.171 16.641 3.732 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.398 16.290 2.002 1.00 0.00 H new ATOM 690 N GLU A 46 3.877 18.771 4.160 1.00 0.00 N ATOM 691 CA GLU A 46 3.125 18.621 5.400 1.00 0.00 C ATOM 692 C GLU A 46 1.780 17.935 5.147 1.00 0.00 C ATOM 693 O GLU A 46 1.134 17.488 6.093 1.00 0.00 O ATOM 694 CB GLU A 46 2.937 19.981 6.070 1.00 0.00 C ATOM 695 CG GLU A 46 4.276 20.509 6.592 1.00 0.00 C ATOM 696 CD GLU A 46 4.085 21.819 7.356 1.00 0.00 C ATOM 697 OE1 GLU A 46 4.393 21.824 8.571 1.00 0.00 O ATOM 698 OE2 GLU A 46 3.635 22.804 6.729 1.00 0.00 O ATOM 0 H GLU A 46 3.801 19.694 3.733 1.00 0.00 H new ATOM 0 HA GLU A 46 3.694 17.983 6.076 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.513 20.689 5.358 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.228 19.893 6.893 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.735 19.766 7.245 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.960 20.666 5.758 1.00 0.00 H new ATOM 705 N ASP A 47 1.352 17.854 3.882 1.00 0.00 N ATOM 706 CA ASP A 47 0.092 17.222 3.521 1.00 0.00 C ATOM 707 C ASP A 47 0.282 15.739 3.190 1.00 0.00 C ATOM 708 O ASP A 47 -0.692 14.992 3.105 1.00 0.00 O ATOM 709 CB ASP A 47 -0.513 17.979 2.334 1.00 0.00 C ATOM 710 CG ASP A 47 -1.913 17.476 2.000 1.00 0.00 C ATOM 711 OD1 ASP A 47 -2.788 17.576 2.887 1.00 0.00 O ATOM 712 OD2 ASP A 47 -2.101 16.998 0.859 1.00 0.00 O ATOM 0 H ASP A 47 1.872 18.225 3.087 1.00 0.00 H new ATOM 0 HA ASP A 47 -0.589 17.268 4.371 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -0.554 19.044 2.564 1.00 0.00 H new ATOM 0 HB3 ASP A 47 0.132 17.866 1.463 1.00 0.00 H new ATOM 717 N GLY A 48 1.534 15.308 3.007 1.00 0.00 N ATOM 718 CA GLY A 48 1.850 13.923 2.684 1.00 0.00 C ATOM 719 C GLY A 48 1.338 13.529 1.299 1.00 0.00 C ATOM 720 O GLY A 48 0.990 14.389 0.490 1.00 0.00 O ATOM 0 H GLY A 48 2.352 15.913 3.080 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.929 13.778 2.727 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.410 13.266 3.434 1.00 0.00 H new ATOM 724 N GLY A 49 1.290 12.223 1.026 1.00 0.00 N ATOM 725 CA GLY A 49 0.788 11.713 -0.238 1.00 0.00 C ATOM 726 C GLY A 49 1.816 11.835 -1.362 1.00 0.00 C ATOM 727 O GLY A 49 1.442 11.899 -2.531 1.00 0.00 O ATOM 0 H GLY A 49 1.598 11.499 1.675 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.506 10.667 -0.119 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.115 12.257 -0.514 1.00 0.00 H new ATOM 731 N ILE A 50 3.110 11.873 -1.014 1.00 0.00 N ATOM 732 CA ILE A 50 4.186 12.001 -1.987 1.00 0.00 C ATOM 733 C ILE A 50 5.215 10.893 -1.764 1.00 0.00 C ATOM 734 O ILE A 50 5.468 10.518 -0.619 1.00 0.00 O ATOM 735 CB ILE A 50 4.824 13.391 -1.868 1.00 0.00 C ATOM 736 CG1 ILE A 50 3.734 14.471 -1.869 1.00 0.00 C ATOM 737 CG2 ILE A 50 5.825 13.608 -3.013 1.00 0.00 C ATOM 738 CD1 ILE A 50 4.311 15.885 -1.904 1.00 0.00 C ATOM 0 H ILE A 50 3.432 11.815 -0.048 1.00 0.00 H new ATOM 0 HA ILE A 50 3.789 11.895 -2.997 1.00 0.00 H new ATOM 0 HB ILE A 50 5.367 13.461 -0.926 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.084 14.326 -2.732 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.114 14.357 -0.980 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.274 14.597 -2.921 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.606 12.849 -2.962 1.00 0.00 H new ATOM 0 HG23 ILE A 50 5.307 13.532 -3.969 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.497 16.610 -1.903 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.939 16.044 -1.027 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.909 16.012 -2.806 1.00 0.00 H new ATOM 750 N ASP A 51 5.807 10.372 -2.844 1.00 0.00 N ATOM 751 CA ASP A 51 6.807 9.315 -2.742 1.00 0.00 C ATOM 752 C ASP A 51 8.198 9.833 -3.102 1.00 0.00 C ATOM 753 O ASP A 51 9.190 9.302 -2.607 1.00 0.00 O ATOM 754 CB ASP A 51 6.416 8.140 -3.640 1.00 0.00 C ATOM 755 CG ASP A 51 5.119 7.471 -3.191 1.00 0.00 C ATOM 756 OD1 ASP A 51 4.293 7.158 -4.079 1.00 0.00 O ATOM 757 OD2 ASP A 51 4.958 7.278 -1.966 1.00 0.00 O ATOM 0 H ASP A 51 5.607 10.669 -3.799 1.00 0.00 H new ATOM 0 HA ASP A 51 6.842 8.972 -1.708 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.304 8.492 -4.666 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.220 7.404 -3.641 1.00 0.00 H new ATOM 762 N ALA A 52 8.280 10.862 -3.953 1.00 0.00 N ATOM 763 CA ALA A 52 9.542 11.500 -4.315 1.00 0.00 C ATOM 764 C ALA A 52 9.284 12.857 -4.971 1.00 0.00 C ATOM 765 O ALA A 52 8.135 13.262 -5.147 1.00 0.00 O ATOM 766 CB ALA A 52 10.317 10.588 -5.264 1.00 0.00 C ATOM 0 H ALA A 52 7.467 11.274 -4.410 1.00 0.00 H new ATOM 0 HA ALA A 52 10.133 11.665 -3.414 1.00 0.00 H new ATOM 0 HB1 ALA A 52 11.260 11.063 -5.536 1.00 0.00 H new ATOM 0 HB2 ALA A 52 10.518 9.637 -4.771 1.00 0.00 H new ATOM 0 HB3 ALA A 52 9.727 10.413 -6.163 1.00 0.00 H new ATOM 772 N ALA A 53 10.351 13.578 -5.333 1.00 0.00 N ATOM 773 CA ALA A 53 10.211 14.866 -5.999 1.00 0.00 C ATOM 774 C ALA A 53 11.389 15.156 -6.931 1.00 0.00 C ATOM 775 O ALA A 53 12.449 14.540 -6.812 1.00 0.00 O ATOM 776 CB ALA A 53 10.098 15.960 -4.937 1.00 0.00 C ATOM 0 H ALA A 53 11.316 13.288 -5.174 1.00 0.00 H new ATOM 0 HA ALA A 53 9.312 14.842 -6.615 1.00 0.00 H new ATOM 0 HB1 ALA A 53 9.993 16.930 -5.423 1.00 0.00 H new ATOM 0 HB2 ALA A 53 9.226 15.771 -4.311 1.00 0.00 H new ATOM 0 HB3 ALA A 53 10.995 15.960 -4.318 1.00 0.00 H new ATOM 782 N ILE A 54 11.197 16.103 -7.854 1.00 0.00 N ATOM 783 CA ILE A 54 12.250 16.583 -8.739 1.00 0.00 C ATOM 784 C ILE A 54 12.486 18.053 -8.423 1.00 0.00 C ATOM 785 O ILE A 54 11.540 18.842 -8.426 1.00 0.00 O ATOM 786 CB ILE A 54 11.856 16.365 -10.207 1.00 0.00 C ATOM 787 CG1 ILE A 54 11.718 14.863 -10.488 1.00 0.00 C ATOM 788 CG2 ILE A 54 12.911 16.985 -11.130 1.00 0.00 C ATOM 789 CD1 ILE A 54 11.205 14.587 -11.901 1.00 0.00 C ATOM 0 H ILE A 54 10.297 16.559 -8.005 1.00 0.00 H new ATOM 0 HA ILE A 54 13.175 16.028 -8.581 1.00 0.00 H new ATOM 0 HB ILE A 54 10.898 16.849 -10.398 1.00 0.00 H new ATOM 0 HG12 ILE A 54 12.685 14.379 -10.353 1.00 0.00 H new ATOM 0 HG13 ILE A 54 11.036 14.420 -9.762 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.624 16.826 -12.169 1.00 0.00 H new ATOM 0 HG22 ILE A 54 12.983 18.055 -10.933 1.00 0.00 H new ATOM 0 HG23 ILE A 54 13.877 16.516 -10.945 1.00 0.00 H new ATOM 0 HD11 ILE A 54 11.123 13.511 -12.055 1.00 0.00 H new ATOM 0 HD12 ILE A 54 10.225 15.047 -12.029 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.900 15.006 -12.629 1.00 0.00 H new ATOM 801 N LEU A 55 13.742 18.419 -8.148 1.00 0.00 N ATOM 802 CA LEU A 55 14.089 19.744 -7.655 1.00 0.00 C ATOM 803 C LEU A 55 14.968 20.497 -8.648 1.00 0.00 C ATOM 804 O LEU A 55 15.943 19.951 -9.162 1.00 0.00 O ATOM 805 CB LEU A 55 14.846 19.609 -6.324 1.00 0.00 C ATOM 806 CG LEU A 55 13.972 19.395 -5.081 1.00 0.00 C ATOM 807 CD1 LEU A 55 13.210 20.673 -4.748 1.00 0.00 C ATOM 808 CD2 LEU A 55 12.969 18.256 -5.241 1.00 0.00 C ATOM 0 H LEU A 55 14.544 17.799 -8.263 1.00 0.00 H new ATOM 0 HA LEU A 55 13.165 20.305 -7.517 1.00 0.00 H new ATOM 0 HB2 LEU A 55 15.541 18.773 -6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 55 15.444 20.508 -6.175 1.00 0.00 H new ATOM 0 HG LEU A 55 14.653 19.127 -4.273 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.593 20.509 -3.864 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.918 21.478 -4.552 1.00 0.00 H new ATOM 0 HD13 LEU A 55 12.573 20.947 -5.589 1.00 0.00 H new ATOM 0 HD21 LEU A 55 12.382 18.157 -4.328 1.00 0.00 H new ATOM 0 HD22 LEU A 55 12.304 18.471 -6.078 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.503 17.325 -5.432 1.00 0.00 H new ATOM 820 N ASP A 56 14.629 21.760 -8.917 1.00 0.00 N ATOM 821 CA ASP A 56 15.511 22.641 -9.664 1.00 0.00 C ATOM 822 C ASP A 56 16.544 23.231 -8.702 1.00 0.00 C ATOM 823 O ASP A 56 16.230 23.507 -7.543 1.00 0.00 O ATOM 824 CB ASP A 56 14.696 23.730 -10.360 1.00 0.00 C ATOM 825 CG ASP A 56 15.602 24.630 -11.190 1.00 0.00 C ATOM 826 OD1 ASP A 56 15.957 25.719 -10.685 1.00 0.00 O ATOM 827 OD2 ASP A 56 15.932 24.222 -12.325 1.00 0.00 O ATOM 0 H ASP A 56 13.750 22.189 -8.627 1.00 0.00 H new ATOM 0 HA ASP A 56 16.036 22.085 -10.440 1.00 0.00 H new ATOM 0 HB2 ASP A 56 13.942 23.274 -11.001 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.165 24.325 -9.617 1.00 0.00 H new ATOM 832 N VAL A 57 17.776 23.424 -9.175 1.00 0.00 N ATOM 833 CA VAL A 57 18.871 23.873 -8.318 1.00 0.00 C ATOM 834 C VAL A 57 18.862 25.377 -8.066 1.00 0.00 C ATOM 835 O VAL A 57 19.598 25.847 -7.204 1.00 0.00 O ATOM 836 CB VAL A 57 20.214 23.430 -8.898 1.00 0.00 C ATOM 837 CG1 VAL A 57 20.246 21.907 -9.025 1.00 0.00 C ATOM 838 CG2 VAL A 57 20.462 24.071 -10.263 1.00 0.00 C ATOM 0 H VAL A 57 18.040 23.276 -10.149 1.00 0.00 H new ATOM 0 HA VAL A 57 18.721 23.401 -7.347 1.00 0.00 H new ATOM 0 HB VAL A 57 21.003 23.756 -8.221 1.00 0.00 H new ATOM 0 HG11 VAL A 57 21.205 21.596 -9.439 1.00 0.00 H new ATOM 0 HG12 VAL A 57 20.112 21.457 -8.041 1.00 0.00 H new ATOM 0 HG13 VAL A 57 19.443 21.580 -9.686 1.00 0.00 H new ATOM 0 HG21 VAL A 57 21.424 23.738 -10.652 1.00 0.00 H new ATOM 0 HG22 VAL A 57 19.671 23.777 -10.952 1.00 0.00 H new ATOM 0 HG23 VAL A 57 20.468 25.156 -10.160 1.00 0.00 H new ATOM 848 N ASN A 58 18.050 26.133 -8.806 1.00 0.00 N ATOM 849 CA ASN A 58 18.007 27.582 -8.696 1.00 0.00 C ATOM 850 C ASN A 58 16.589 28.058 -8.357 1.00 0.00 C ATOM 851 O ASN A 58 16.120 29.061 -8.892 1.00 0.00 O ATOM 852 CB ASN A 58 18.560 28.210 -9.979 1.00 0.00 C ATOM 853 CG ASN A 58 18.907 29.680 -9.794 1.00 0.00 C ATOM 854 OD1 ASN A 58 19.075 30.155 -8.675 1.00 0.00 O ATOM 855 ND2 ASN A 58 19.017 30.413 -10.898 1.00 0.00 N ATOM 0 H ASN A 58 17.405 25.752 -9.498 1.00 0.00 H new ATOM 0 HA ASN A 58 18.642 27.911 -7.873 1.00 0.00 H new ATOM 0 HB2 ASN A 58 19.450 27.665 -10.294 1.00 0.00 H new ATOM 0 HB3 ASN A 58 17.825 28.109 -10.777 1.00 0.00 H new ATOM 0 HD21 ASN A 58 19.248 31.404 -10.831 1.00 0.00 H new ATOM 0 HD22 ASN A 58 18.870 29.984 -11.812 1.00 0.00 H new ATOM 862 N LEU A 59 15.911 27.328 -7.466 1.00 0.00 N ATOM 863 CA LEU A 59 14.542 27.621 -7.060 1.00 0.00 C ATOM 864 C LEU A 59 14.425 29.023 -6.458 1.00 0.00 C ATOM 865 O LEU A 59 15.391 29.561 -5.917 1.00 0.00 O ATOM 866 CB LEU A 59 14.090 26.553 -6.060 1.00 0.00 C ATOM 867 CG LEU A 59 12.623 26.694 -5.638 1.00 0.00 C ATOM 868 CD1 LEU A 59 11.689 26.569 -6.839 1.00 0.00 C ATOM 869 CD2 LEU A 59 12.291 25.597 -4.631 1.00 0.00 C ATOM 0 H LEU A 59 16.306 26.509 -7.004 1.00 0.00 H new ATOM 0 HA LEU A 59 13.894 27.601 -7.936 1.00 0.00 H new ATOM 0 HB2 LEU A 59 14.240 25.567 -6.500 1.00 0.00 H new ATOM 0 HB3 LEU A 59 14.722 26.606 -5.173 1.00 0.00 H new ATOM 0 HG LEU A 59 12.482 27.680 -5.194 1.00 0.00 H new ATOM 0 HD11 LEU A 59 10.656 26.673 -6.509 1.00 0.00 H new ATOM 0 HD12 LEU A 59 11.919 27.351 -7.562 1.00 0.00 H new ATOM 0 HD13 LEU A 59 11.824 25.593 -7.305 1.00 0.00 H new ATOM 0 HD21 LEU A 59 11.249 25.688 -4.324 1.00 0.00 H new ATOM 0 HD22 LEU A 59 12.450 24.621 -5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 59 12.936 25.697 -3.758 1.00 0.00 H new ATOM 881 N ARG A 60 13.227 29.608 -6.557 1.00 0.00 N ATOM 882 CA ARG A 60 12.921 30.937 -6.042 1.00 0.00 C ATOM 883 C ARG A 60 13.203 31.021 -4.542 1.00 0.00 C ATOM 884 O ARG A 60 13.133 30.018 -3.833 1.00 0.00 O ATOM 885 CB ARG A 60 11.450 31.228 -6.336 1.00 0.00 C ATOM 886 CG ARG A 60 11.044 32.664 -6.005 1.00 0.00 C ATOM 887 CD ARG A 60 9.564 32.850 -6.331 1.00 0.00 C ATOM 888 NE ARG A 60 9.128 34.225 -6.060 1.00 0.00 N ATOM 889 CZ ARG A 60 7.917 34.558 -5.605 1.00 0.00 C ATOM 890 NH1 ARG A 60 6.999 33.631 -5.338 1.00 0.00 N ATOM 891 NH2 ARG A 60 7.616 35.839 -5.411 1.00 0.00 N ATOM 0 H ARG A 60 12.430 29.158 -7.007 1.00 0.00 H new ATOM 0 HA ARG A 60 13.554 31.680 -6.527 1.00 0.00 H new ATOM 0 HB2 ARG A 60 11.251 31.035 -7.390 1.00 0.00 H new ATOM 0 HB3 ARG A 60 10.828 30.540 -5.763 1.00 0.00 H new ATOM 0 HG2 ARG A 60 11.226 32.873 -4.951 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.647 33.368 -6.579 1.00 0.00 H new ATOM 0 HD2 ARG A 60 9.387 32.610 -7.379 1.00 0.00 H new ATOM 0 HD3 ARG A 60 8.969 32.154 -5.740 1.00 0.00 H new ATOM 0 HE ARG A 60 9.795 34.978 -6.231 1.00 0.00 H new ATOM 0 HH11 ARG A 60 7.214 32.644 -5.480 1.00 0.00 H new ATOM 0 HH12 ARG A 60 6.081 33.908 -4.991 1.00 0.00 H new ATOM 0 HH21 ARG A 60 8.308 36.561 -5.610 1.00 0.00 H new ATOM 0 HH22 ARG A 60 6.693 36.099 -5.064 1.00 0.00 H new ATOM 905 N GLY A 61 13.527 32.224 -4.058 1.00 0.00 N ATOM 906 CA GLY A 61 13.813 32.457 -2.648 1.00 0.00 C ATOM 907 C GLY A 61 15.272 32.172 -2.293 1.00 0.00 C ATOM 908 O GLY A 61 15.641 32.224 -1.120 1.00 0.00 O ATOM 0 H GLY A 61 13.597 33.061 -4.637 1.00 0.00 H new ATOM 0 HA2 GLY A 61 13.577 33.492 -2.399 1.00 0.00 H new ATOM 0 HA3 GLY A 61 13.164 31.827 -2.040 1.00 0.00 H new ATOM 912 N GLY A 62 16.107 31.872 -3.293 1.00 0.00 N ATOM 913 CA GLY A 62 17.519 31.598 -3.086 1.00 0.00 C ATOM 914 C GLY A 62 18.268 31.558 -4.415 1.00 0.00 C ATOM 915 O GLY A 62 17.660 31.685 -5.476 1.00 0.00 O ATOM 0 H GLY A 62 15.815 31.814 -4.269 1.00 0.00 H new ATOM 0 HA2 GLY A 62 17.952 32.365 -2.443 1.00 0.00 H new ATOM 0 HA3 GLY A 62 17.637 30.646 -2.569 1.00 0.00 H new ATOM 919 N GLU A 63 19.591 31.388 -4.359 1.00 0.00 N ATOM 920 CA GLU A 63 20.425 31.300 -5.546 1.00 0.00 C ATOM 921 C GLU A 63 21.274 30.032 -5.506 1.00 0.00 C ATOM 922 O GLU A 63 21.807 29.683 -4.454 1.00 0.00 O ATOM 923 CB GLU A 63 21.288 32.561 -5.654 1.00 0.00 C ATOM 924 CG GLU A 63 22.091 32.563 -6.955 1.00 0.00 C ATOM 925 CD GLU A 63 22.916 33.842 -7.080 1.00 0.00 C ATOM 926 OE1 GLU A 63 24.067 33.842 -6.588 1.00 0.00 O ATOM 927 OE2 GLU A 63 22.393 34.817 -7.667 1.00 0.00 O ATOM 0 H GLU A 63 20.109 31.308 -3.484 1.00 0.00 H new ATOM 0 HA GLU A 63 19.797 31.239 -6.435 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.653 33.446 -5.613 1.00 0.00 H new ATOM 0 HB3 GLU A 63 21.967 32.616 -4.803 1.00 0.00 H new ATOM 0 HG2 GLU A 63 22.750 31.695 -6.982 1.00 0.00 H new ATOM 0 HG3 GLU A 63 21.415 32.476 -7.805 1.00 0.00 H new ATOM 934 N LYS A 64 21.386 29.361 -6.660 1.00 0.00 N ATOM 935 CA LYS A 64 22.165 28.143 -6.895 1.00 0.00 C ATOM 936 C LYS A 64 21.974 27.028 -5.856 1.00 0.00 C ATOM 937 O LYS A 64 22.732 26.058 -5.862 1.00 0.00 O ATOM 938 CB LYS A 64 23.644 28.475 -7.145 1.00 0.00 C ATOM 939 CG LYS A 64 24.354 29.021 -5.905 1.00 0.00 C ATOM 940 CD LYS A 64 25.844 29.207 -6.201 1.00 0.00 C ATOM 941 CE LYS A 64 26.546 29.763 -4.965 1.00 0.00 C ATOM 942 NZ LYS A 64 27.985 29.967 -5.214 1.00 0.00 N ATOM 0 H LYS A 64 20.906 29.675 -7.503 1.00 0.00 H new ATOM 0 HA LYS A 64 21.751 27.709 -7.805 1.00 0.00 H new ATOM 0 HB2 LYS A 64 24.159 27.577 -7.486 1.00 0.00 H new ATOM 0 HB3 LYS A 64 23.715 29.207 -7.949 1.00 0.00 H new ATOM 0 HG2 LYS A 64 23.911 29.972 -5.610 1.00 0.00 H new ATOM 0 HG3 LYS A 64 24.223 28.335 -5.068 1.00 0.00 H new ATOM 0 HD2 LYS A 64 26.290 28.254 -6.487 1.00 0.00 H new ATOM 0 HD3 LYS A 64 25.976 29.886 -7.043 1.00 0.00 H new ATOM 0 HE2 LYS A 64 26.087 30.709 -4.678 1.00 0.00 H new ATOM 0 HE3 LYS A 64 26.413 29.077 -4.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 28.435 30.345 -4.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 28.426 29.059 -5.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 28.110 30.640 -5.997 1.00 0.00 H new ATOM 956 N SER A 65 20.977 27.157 -4.977 1.00 0.00 N ATOM 957 CA SER A 65 20.665 26.164 -3.959 1.00 0.00 C ATOM 958 C SER A 65 19.173 26.195 -3.640 1.00 0.00 C ATOM 959 O SER A 65 18.487 27.162 -3.963 1.00 0.00 O ATOM 960 CB SER A 65 21.455 26.456 -2.681 1.00 0.00 C ATOM 961 OG SER A 65 22.846 26.359 -2.917 1.00 0.00 O ATOM 0 H SER A 65 20.358 27.967 -4.956 1.00 0.00 H new ATOM 0 HA SER A 65 20.938 25.179 -4.339 1.00 0.00 H new ATOM 0 HB2 SER A 65 21.212 27.455 -2.318 1.00 0.00 H new ATOM 0 HB3 SER A 65 21.164 25.754 -1.900 1.00 0.00 H new ATOM 0 HG SER A 65 23.333 26.551 -2.088 1.00 0.00 H new ATOM 967 N THR A 66 18.672 25.133 -3.002 1.00 0.00 N ATOM 968 CA THR A 66 17.283 25.054 -2.569 1.00 0.00 C ATOM 969 C THR A 66 17.185 24.309 -1.236 1.00 0.00 C ATOM 970 O THR A 66 17.818 23.267 -1.065 1.00 0.00 O ATOM 971 CB THR A 66 16.419 24.385 -3.644 1.00 0.00 C ATOM 972 OG1 THR A 66 15.110 24.235 -3.145 1.00 0.00 O ATOM 973 CG2 THR A 66 16.944 23.006 -4.044 1.00 0.00 C ATOM 0 H THR A 66 19.223 24.305 -2.773 1.00 0.00 H new ATOM 0 HA THR A 66 16.904 26.065 -2.421 1.00 0.00 H new ATOM 0 HB THR A 66 16.444 25.022 -4.528 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.547 23.809 -3.825 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.295 22.577 -4.808 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.955 23.102 -4.439 1.00 0.00 H new ATOM 0 HG23 THR A 66 16.956 22.354 -3.171 1.00 0.00 H new ATOM 981 N PRO A 67 16.399 24.826 -0.281 1.00 0.00 N ATOM 982 CA PRO A 67 16.199 24.206 1.016 1.00 0.00 C ATOM 983 C PRO A 67 15.170 23.079 0.945 1.00 0.00 C ATOM 984 O PRO A 67 15.038 22.310 1.897 1.00 0.00 O ATOM 985 CB PRO A 67 15.687 25.346 1.897 1.00 0.00 C ATOM 986 CG PRO A 67 14.847 26.169 0.921 1.00 0.00 C ATOM 987 CD PRO A 67 15.654 26.073 -0.373 1.00 0.00 C ATOM 0 HA PRO A 67 17.112 23.750 1.398 1.00 0.00 H new ATOM 0 HB2 PRO A 67 15.092 24.977 2.733 1.00 0.00 H new ATOM 0 HB3 PRO A 67 16.504 25.930 2.321 1.00 0.00 H new ATOM 0 HG2 PRO A 67 13.843 25.760 0.805 1.00 0.00 H new ATOM 0 HG3 PRO A 67 14.734 27.201 1.253 1.00 0.00 H new ATOM 0 HD2 PRO A 67 14.999 26.074 -1.244 1.00 0.00 H new ATOM 0 HD3 PRO A 67 16.327 26.924 -0.479 1.00 0.00 H new ATOM 995 N VAL A 68 14.438 22.970 -0.169 1.00 0.00 N ATOM 996 CA VAL A 68 13.367 21.994 -0.296 1.00 0.00 C ATOM 997 C VAL A 68 13.933 20.589 -0.462 1.00 0.00 C ATOM 998 O VAL A 68 13.318 19.617 -0.027 1.00 0.00 O ATOM 999 CB VAL A 68 12.486 22.365 -1.493 1.00 0.00 C ATOM 1000 CG1 VAL A 68 11.329 21.376 -1.639 1.00 0.00 C ATOM 1001 CG2 VAL A 68 11.894 23.763 -1.320 1.00 0.00 C ATOM 0 H VAL A 68 14.574 23.552 -0.996 1.00 0.00 H new ATOM 0 HA VAL A 68 12.765 22.004 0.612 1.00 0.00 H new ATOM 0 HB VAL A 68 13.118 22.336 -2.381 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.716 21.658 -2.495 1.00 0.00 H new ATOM 0 HG12 VAL A 68 11.725 20.372 -1.791 1.00 0.00 H new ATOM 0 HG13 VAL A 68 10.720 21.392 -0.735 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.272 24.004 -2.182 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.287 23.792 -0.415 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.700 24.492 -1.239 1.00 0.00 H new ATOM 1011 N ALA A 69 15.105 20.461 -1.089 1.00 0.00 N ATOM 1012 CA ALA A 69 15.699 19.154 -1.315 1.00 0.00 C ATOM 1013 C ALA A 69 16.109 18.522 0.013 1.00 0.00 C ATOM 1014 O ALA A 69 15.936 17.321 0.215 1.00 0.00 O ATOM 1015 CB ALA A 69 16.912 19.316 -2.234 1.00 0.00 C ATOM 0 H ALA A 69 15.653 21.244 -1.445 1.00 0.00 H new ATOM 0 HA ALA A 69 14.972 18.495 -1.789 1.00 0.00 H new ATOM 0 HB1 ALA A 69 17.367 18.341 -2.411 1.00 0.00 H new ATOM 0 HB2 ALA A 69 16.594 19.746 -3.184 1.00 0.00 H new ATOM 0 HB3 ALA A 69 17.640 19.976 -1.762 1.00 0.00 H new ATOM 1021 N GLU A 70 16.654 19.325 0.925 1.00 0.00 N ATOM 1022 CA GLU A 70 17.133 18.825 2.206 1.00 0.00 C ATOM 1023 C GLU A 70 15.996 18.722 3.221 1.00 0.00 C ATOM 1024 O GLU A 70 16.132 18.032 4.229 1.00 0.00 O ATOM 1025 CB GLU A 70 18.287 19.704 2.686 1.00 0.00 C ATOM 1026 CG GLU A 70 19.463 19.525 1.722 1.00 0.00 C ATOM 1027 CD GLU A 70 20.615 20.469 2.068 1.00 0.00 C ATOM 1028 OE1 GLU A 70 21.403 20.114 2.972 1.00 0.00 O ATOM 1029 OE2 GLU A 70 20.705 21.537 1.424 1.00 0.00 O ATOM 0 H GLU A 70 16.774 20.330 0.796 1.00 0.00 H new ATOM 0 HA GLU A 70 17.512 17.810 2.088 1.00 0.00 H new ATOM 0 HB2 GLU A 70 17.979 20.749 2.719 1.00 0.00 H new ATOM 0 HB3 GLU A 70 18.580 19.426 3.698 1.00 0.00 H new ATOM 0 HG2 GLU A 70 19.812 18.493 1.759 1.00 0.00 H new ATOM 0 HG3 GLU A 70 19.131 19.713 0.701 1.00 0.00 H new ATOM 1036 N ALA A 71 14.870 19.396 2.969 1.00 0.00 N ATOM 1037 CA ALA A 71 13.689 19.225 3.796 1.00 0.00 C ATOM 1038 C ALA A 71 13.084 17.849 3.511 1.00 0.00 C ATOM 1039 O ALA A 71 12.525 17.209 4.401 1.00 0.00 O ATOM 1040 CB ALA A 71 12.693 20.344 3.485 1.00 0.00 C ATOM 0 H ALA A 71 14.759 20.059 2.202 1.00 0.00 H new ATOM 0 HA ALA A 71 13.946 19.280 4.854 1.00 0.00 H new ATOM 0 HB1 ALA A 71 11.803 20.221 4.103 1.00 0.00 H new ATOM 0 HB2 ALA A 71 13.152 21.309 3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 71 12.413 20.299 2.433 1.00 0.00 H new ATOM 1046 N LEU A 72 13.198 17.383 2.262 1.00 0.00 N ATOM 1047 CA LEU A 72 12.755 16.052 1.892 1.00 0.00 C ATOM 1048 C LEU A 72 13.733 15.018 2.438 1.00 0.00 C ATOM 1049 O LEU A 72 13.339 13.885 2.702 1.00 0.00 O ATOM 1050 CB LEU A 72 12.652 15.952 0.365 1.00 0.00 C ATOM 1051 CG LEU A 72 11.527 16.824 -0.200 1.00 0.00 C ATOM 1052 CD1 LEU A 72 11.606 16.801 -1.724 1.00 0.00 C ATOM 1053 CD2 LEU A 72 10.158 16.299 0.225 1.00 0.00 C ATOM 0 H LEU A 72 13.598 17.920 1.492 1.00 0.00 H new ATOM 0 HA LEU A 72 11.771 15.858 2.320 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.600 16.252 -0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 72 12.481 14.913 0.082 1.00 0.00 H new ATOM 0 HG LEU A 72 11.647 17.837 0.183 1.00 0.00 H new ATOM 0 HD11 LEU A 72 10.810 17.419 -2.139 1.00 0.00 H new ATOM 0 HD12 LEU A 72 12.572 17.191 -2.044 1.00 0.00 H new ATOM 0 HD13 LEU A 72 11.493 15.777 -2.079 1.00 0.00 H new ATOM 0 HD21 LEU A 72 9.378 16.938 -0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 72 10.028 15.281 -0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.089 16.303 1.313 1.00 0.00 H new ATOM 1065 N ALA A 73 15.004 15.392 2.618 1.00 0.00 N ATOM 1066 CA ALA A 73 15.990 14.501 3.210 1.00 0.00 C ATOM 1067 C ALA A 73 15.718 14.318 4.704 1.00 0.00 C ATOM 1068 O ALA A 73 16.137 13.319 5.285 1.00 0.00 O ATOM 1069 CB ALA A 73 17.389 15.072 2.980 1.00 0.00 C ATOM 0 H ALA A 73 15.368 16.309 2.359 1.00 0.00 H new ATOM 0 HA ALA A 73 15.922 13.522 2.736 1.00 0.00 H new ATOM 0 HB1 ALA A 73 18.131 14.407 3.422 1.00 0.00 H new ATOM 0 HB2 ALA A 73 17.574 15.161 1.910 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.461 16.056 3.444 1.00 0.00 H new ATOM 1075 N ALA A 74 15.018 15.271 5.327 1.00 0.00 N ATOM 1076 CA ALA A 74 14.615 15.155 6.720 1.00 0.00 C ATOM 1077 C ALA A 74 13.347 14.306 6.839 1.00 0.00 C ATOM 1078 O ALA A 74 13.049 13.791 7.914 1.00 0.00 O ATOM 1079 CB ALA A 74 14.399 16.557 7.292 1.00 0.00 C ATOM 0 H ALA A 74 14.719 16.137 4.878 1.00 0.00 H new ATOM 0 HA ALA A 74 15.398 14.656 7.292 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.096 16.481 8.336 1.00 0.00 H new ATOM 0 HB2 ALA A 74 15.327 17.125 7.223 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.620 17.065 6.724 1.00 0.00 H new ATOM 1085 N ARG A 75 12.607 14.158 5.731 1.00 0.00 N ATOM 1086 CA ARG A 75 11.435 13.289 5.656 1.00 0.00 C ATOM 1087 C ARG A 75 11.780 11.934 5.029 1.00 0.00 C ATOM 1088 O ARG A 75 10.892 11.118 4.799 1.00 0.00 O ATOM 1089 CB ARG A 75 10.327 13.991 4.865 1.00 0.00 C ATOM 1090 CG ARG A 75 9.845 15.276 5.542 1.00 0.00 C ATOM 1091 CD ARG A 75 9.238 14.986 6.916 1.00 0.00 C ATOM 1092 NE ARG A 75 8.624 16.193 7.484 1.00 0.00 N ATOM 1093 CZ ARG A 75 7.399 16.632 7.178 1.00 0.00 C ATOM 1094 NH1 ARG A 75 6.639 15.970 6.313 1.00 0.00 N ATOM 1095 NH2 ARG A 75 6.933 17.743 7.741 1.00 0.00 N ATOM 0 H ARG A 75 12.811 14.644 4.858 1.00 0.00 H new ATOM 0 HA ARG A 75 11.083 13.093 6.669 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.692 14.226 3.865 1.00 0.00 H new ATOM 0 HB3 ARG A 75 9.484 13.310 4.744 1.00 0.00 H new ATOM 0 HG2 ARG A 75 10.680 15.968 5.650 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.104 15.766 4.911 1.00 0.00 H new ATOM 0 HD2 ARG A 75 8.489 14.199 6.828 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.012 14.616 7.589 1.00 0.00 H new ATOM 0 HE ARG A 75 9.169 16.732 8.157 1.00 0.00 H new ATOM 0 HH11 ARG A 75 6.989 15.118 5.875 1.00 0.00 H new ATOM 0 HH12 ARG A 75 5.706 16.314 6.087 1.00 0.00 H new ATOM 0 HH21 ARG A 75 7.510 18.259 8.405 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.999 18.079 7.509 1.00 0.00 H new ATOM 1109 N ASP A 76 13.070 11.700 4.755 1.00 0.00 N ATOM 1110 CA ASP A 76 13.553 10.483 4.113 1.00 0.00 C ATOM 1111 C ASP A 76 12.896 10.238 2.745 1.00 0.00 C ATOM 1112 O ASP A 76 12.773 9.097 2.302 1.00 0.00 O ATOM 1113 CB ASP A 76 13.432 9.296 5.076 1.00 0.00 C ATOM 1114 CG ASP A 76 14.188 8.069 4.568 1.00 0.00 C ATOM 1115 OD1 ASP A 76 15.366 8.228 4.174 1.00 0.00 O ATOM 1116 OD2 ASP A 76 13.586 6.972 4.582 1.00 0.00 O ATOM 0 H ASP A 76 13.813 12.363 4.978 1.00 0.00 H new ATOM 0 HA ASP A 76 14.612 10.608 3.887 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.819 9.581 6.054 1.00 0.00 H new ATOM 0 HB3 ASP A 76 12.380 9.044 5.211 1.00 0.00 H new ATOM 1121 N ILE A 77 12.472 11.312 2.072 1.00 0.00 N ATOM 1122 CA ILE A 77 11.880 11.241 0.743 1.00 0.00 C ATOM 1123 C ILE A 77 12.966 11.482 -0.309 1.00 0.00 C ATOM 1124 O ILE A 77 13.643 12.509 -0.252 1.00 0.00 O ATOM 1125 CB ILE A 77 10.746 12.273 0.625 1.00 0.00 C ATOM 1126 CG1 ILE A 77 9.634 11.942 1.627 1.00 0.00 C ATOM 1127 CG2 ILE A 77 10.187 12.275 -0.798 1.00 0.00 C ATOM 1128 CD1 ILE A 77 8.494 12.960 1.598 1.00 0.00 C ATOM 0 H ILE A 77 12.533 12.261 2.442 1.00 0.00 H new ATOM 0 HA ILE A 77 11.453 10.252 0.576 1.00 0.00 H new ATOM 0 HB ILE A 77 11.142 13.264 0.849 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.237 10.951 1.409 1.00 0.00 H new ATOM 0 HG13 ILE A 77 10.055 11.902 2.632 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.384 13.009 -0.873 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.980 12.532 -1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.797 11.286 -1.037 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.735 12.677 2.327 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.882 13.948 1.844 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.051 12.982 0.602 1.00 0.00 H new ATOM 1140 N PRO A 78 13.153 10.562 -1.266 1.00 0.00 N ATOM 1141 CA PRO A 78 14.126 10.694 -2.339 1.00 0.00 C ATOM 1142 C PRO A 78 13.889 11.924 -3.216 1.00 0.00 C ATOM 1143 O PRO A 78 12.753 12.370 -3.382 1.00 0.00 O ATOM 1144 CB PRO A 78 14.002 9.416 -3.174 1.00 0.00 C ATOM 1145 CG PRO A 78 13.384 8.412 -2.202 1.00 0.00 C ATOM 1146 CD PRO A 78 12.464 9.289 -1.363 1.00 0.00 C ATOM 0 HA PRO A 78 15.123 10.827 -1.919 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.370 9.568 -4.049 1.00 0.00 H new ATOM 0 HB3 PRO A 78 14.973 9.078 -3.537 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.834 7.629 -2.723 1.00 0.00 H new ATOM 0 HG3 PRO A 78 14.141 7.918 -1.593 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.488 9.402 -1.834 1.00 0.00 H new ATOM 0 HD3 PRO A 78 12.294 8.855 -0.378 1.00 0.00 H new ATOM 1154 N PHE A 79 14.971 12.470 -3.780 1.00 0.00 N ATOM 1155 CA PHE A 79 14.891 13.595 -4.700 1.00 0.00 C ATOM 1156 C PHE A 79 16.060 13.574 -5.679 1.00 0.00 C ATOM 1157 O PHE A 79 17.081 12.936 -5.422 1.00 0.00 O ATOM 1158 CB PHE A 79 14.875 14.916 -3.921 1.00 0.00 C ATOM 1159 CG PHE A 79 16.182 15.265 -3.240 1.00 0.00 C ATOM 1160 CD1 PHE A 79 17.238 15.812 -3.987 1.00 0.00 C ATOM 1161 CD2 PHE A 79 16.339 15.053 -1.864 1.00 0.00 C ATOM 1162 CE1 PHE A 79 18.446 16.144 -3.356 1.00 0.00 C ATOM 1163 CE2 PHE A 79 17.542 15.404 -1.233 1.00 0.00 C ATOM 1164 CZ PHE A 79 18.597 15.943 -1.977 1.00 0.00 C ATOM 0 H PHE A 79 15.921 12.142 -3.609 1.00 0.00 H new ATOM 0 HA PHE A 79 13.965 13.510 -5.269 1.00 0.00 H new ATOM 0 HB2 PHE A 79 14.611 15.722 -4.605 1.00 0.00 H new ATOM 0 HB3 PHE A 79 14.090 14.868 -3.167 1.00 0.00 H new ATOM 0 HD1 PHE A 79 17.120 15.977 -5.048 1.00 0.00 H new ATOM 0 HD2 PHE A 79 15.534 14.619 -1.289 1.00 0.00 H new ATOM 0 HE1 PHE A 79 19.261 16.555 -3.933 1.00 0.00 H new ATOM 0 HE2 PHE A 79 17.654 15.258 -0.169 1.00 0.00 H new ATOM 0 HZ PHE A 79 19.525 16.204 -1.490 1.00 0.00 H new ATOM 1174 N VAL A 80 15.908 14.279 -6.803 1.00 0.00 N ATOM 1175 CA VAL A 80 16.954 14.420 -7.810 1.00 0.00 C ATOM 1176 C VAL A 80 17.025 15.874 -8.271 1.00 0.00 C ATOM 1177 O VAL A 80 16.046 16.610 -8.153 1.00 0.00 O ATOM 1178 CB VAL A 80 16.705 13.484 -9.000 1.00 0.00 C ATOM 1179 CG1 VAL A 80 16.739 12.022 -8.556 1.00 0.00 C ATOM 1180 CG2 VAL A 80 15.354 13.762 -9.657 1.00 0.00 C ATOM 0 H VAL A 80 15.046 14.771 -7.038 1.00 0.00 H new ATOM 0 HA VAL A 80 17.909 14.139 -7.366 1.00 0.00 H new ATOM 0 HB VAL A 80 17.500 13.671 -9.722 1.00 0.00 H new ATOM 0 HG11 VAL A 80 16.560 11.376 -9.416 1.00 0.00 H new ATOM 0 HG12 VAL A 80 17.715 11.794 -8.128 1.00 0.00 H new ATOM 0 HG13 VAL A 80 15.966 11.851 -7.807 1.00 0.00 H new ATOM 0 HG21 VAL A 80 15.210 13.081 -10.496 1.00 0.00 H new ATOM 0 HG22 VAL A 80 14.557 13.613 -8.928 1.00 0.00 H new ATOM 0 HG23 VAL A 80 15.329 14.791 -10.016 1.00 0.00 H new ATOM 1190 N PHE A 81 18.184 16.284 -8.794 1.00 0.00 N ATOM 1191 CA PHE A 81 18.400 17.656 -9.234 1.00 0.00 C ATOM 1192 C PHE A 81 18.155 17.819 -10.736 1.00 0.00 C ATOM 1193 O PHE A 81 18.170 16.851 -11.496 1.00 0.00 O ATOM 1194 CB PHE A 81 19.828 18.087 -8.892 1.00 0.00 C ATOM 1195 CG PHE A 81 20.168 18.183 -7.418 1.00 0.00 C ATOM 1196 CD1 PHE A 81 21.357 17.607 -6.944 1.00 0.00 C ATOM 1197 CD2 PHE A 81 19.317 18.856 -6.528 1.00 0.00 C ATOM 1198 CE1 PHE A 81 21.702 17.716 -5.589 1.00 0.00 C ATOM 1199 CE2 PHE A 81 19.657 18.958 -5.172 1.00 0.00 C ATOM 1200 CZ PHE A 81 20.852 18.391 -4.701 1.00 0.00 C ATOM 0 H PHE A 81 18.992 15.674 -8.922 1.00 0.00 H new ATOM 0 HA PHE A 81 17.684 18.290 -8.712 1.00 0.00 H new ATOM 0 HB2 PHE A 81 20.518 17.383 -9.357 1.00 0.00 H new ATOM 0 HB3 PHE A 81 20.010 19.060 -9.349 1.00 0.00 H new ATOM 0 HD1 PHE A 81 22.008 17.078 -7.625 1.00 0.00 H new ATOM 0 HD2 PHE A 81 18.399 19.296 -6.888 1.00 0.00 H new ATOM 0 HE1 PHE A 81 22.622 17.280 -5.229 1.00 0.00 H new ATOM 0 HE2 PHE A 81 18.999 19.474 -4.488 1.00 0.00 H new ATOM 0 HZ PHE A 81 21.116 18.475 -3.657 1.00 0.00 H new ATOM 1210 N ALA A 82 17.933 19.067 -11.154 1.00 0.00 N ATOM 1211 CA ALA A 82 17.818 19.442 -12.554 1.00 0.00 C ATOM 1212 C ALA A 82 18.570 20.756 -12.755 1.00 0.00 C ATOM 1213 O ALA A 82 18.451 21.668 -11.937 1.00 0.00 O ATOM 1214 CB ALA A 82 16.347 19.566 -12.937 1.00 0.00 C ATOM 0 H ALA A 82 17.827 19.854 -10.514 1.00 0.00 H new ATOM 0 HA ALA A 82 18.256 18.681 -13.200 1.00 0.00 H new ATOM 0 HB1 ALA A 82 16.267 19.847 -13.987 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.848 18.610 -12.778 1.00 0.00 H new ATOM 0 HB3 ALA A 82 15.873 20.329 -12.320 1.00 0.00 H new ATOM 1220 N THR A 83 19.342 20.855 -13.839 1.00 0.00 N ATOM 1221 CA THR A 83 20.248 21.976 -14.055 1.00 0.00 C ATOM 1222 C THR A 83 20.148 22.525 -15.475 1.00 0.00 C ATOM 1223 O THR A 83 19.643 21.859 -16.380 1.00 0.00 O ATOM 1224 CB THR A 83 21.691 21.539 -13.771 1.00 0.00 C ATOM 1225 OG1 THR A 83 22.061 20.504 -14.651 1.00 0.00 O ATOM 1226 CG2 THR A 83 21.849 21.036 -12.337 1.00 0.00 C ATOM 0 H THR A 83 19.354 20.161 -14.587 1.00 0.00 H new ATOM 0 HA THR A 83 19.957 22.772 -13.370 1.00 0.00 H new ATOM 0 HB THR A 83 22.332 22.409 -13.914 1.00 0.00 H new ATOM 0 HG1 THR A 83 22.984 20.231 -14.465 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.883 20.734 -12.169 1.00 0.00 H new ATOM 0 HG22 THR A 83 21.586 21.832 -11.641 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.191 20.182 -12.177 1.00 0.00 H new ATOM 1234 N GLY A 84 20.639 23.755 -15.663 1.00 0.00 N ATOM 1235 CA GLY A 84 20.709 24.394 -16.969 1.00 0.00 C ATOM 1236 C GLY A 84 21.918 23.886 -17.750 1.00 0.00 C ATOM 1237 O GLY A 84 22.545 22.900 -17.363 1.00 0.00 O ATOM 0 H GLY A 84 21.000 24.333 -14.904 1.00 0.00 H new ATOM 0 HA2 GLY A 84 19.796 24.191 -17.529 1.00 0.00 H new ATOM 0 HA3 GLY A 84 20.775 25.475 -16.848 1.00 0.00 H new ATOM 1241 N GLY A 85 22.249 24.564 -18.853 1.00 0.00 N ATOM 1242 CA GLY A 85 23.374 24.196 -19.703 1.00 0.00 C ATOM 1243 C GLY A 85 24.714 24.617 -19.103 1.00 0.00 C ATOM 1244 O GLY A 85 25.527 25.238 -19.783 1.00 0.00 O ATOM 0 H GLY A 85 21.739 25.386 -19.178 1.00 0.00 H new ATOM 0 HA2 GLY A 85 23.371 23.117 -19.859 1.00 0.00 H new ATOM 0 HA3 GLY A 85 23.254 24.660 -20.682 1.00 0.00 H new ATOM 1248 N SER A 86 24.946 24.283 -17.831 1.00 0.00 N ATOM 1249 CA SER A 86 26.194 24.573 -17.139 1.00 0.00 C ATOM 1250 C SER A 86 26.413 23.567 -16.012 1.00 0.00 C ATOM 1251 O SER A 86 25.458 23.140 -15.362 1.00 0.00 O ATOM 1252 CB SER A 86 26.156 25.990 -16.570 1.00 0.00 C ATOM 1253 OG SER A 86 27.363 26.263 -15.888 1.00 0.00 O ATOM 0 H SER A 86 24.262 23.798 -17.250 1.00 0.00 H new ATOM 0 HA SER A 86 27.018 24.495 -17.848 1.00 0.00 H new ATOM 0 HB2 SER A 86 26.011 26.711 -17.374 1.00 0.00 H new ATOM 0 HB3 SER A 86 25.311 26.096 -15.890 1.00 0.00 H new ATOM 0 HG SER A 86 27.336 27.173 -15.526 1.00 0.00 H new ATOM 1259 N ASP A 87 27.673 23.193 -15.782 1.00 0.00 N ATOM 1260 CA ASP A 87 28.056 22.277 -14.716 1.00 0.00 C ATOM 1261 C ASP A 87 28.726 23.018 -13.554 1.00 0.00 C ATOM 1262 O ASP A 87 29.073 22.400 -12.548 1.00 0.00 O ATOM 1263 CB ASP A 87 28.963 21.187 -15.290 1.00 0.00 C ATOM 1264 CG ASP A 87 30.321 21.741 -15.719 1.00 0.00 C ATOM 1265 OD1 ASP A 87 30.346 22.550 -16.676 1.00 0.00 O ATOM 1266 OD2 ASP A 87 31.322 21.348 -15.080 1.00 0.00 O ATOM 0 H ASP A 87 28.461 23.523 -16.339 1.00 0.00 H new ATOM 0 HA ASP A 87 27.159 21.810 -14.309 1.00 0.00 H new ATOM 0 HB2 ASP A 87 29.109 20.406 -14.543 1.00 0.00 H new ATOM 0 HB3 ASP A 87 28.474 20.722 -16.146 1.00 0.00 H new ATOM 1271 N ASP A 88 28.906 24.337 -13.689 1.00 0.00 N ATOM 1272 CA ASP A 88 29.582 25.153 -12.689 1.00 0.00 C ATOM 1273 C ASP A 88 28.582 25.899 -11.805 1.00 0.00 C ATOM 1274 O ASP A 88 28.978 26.601 -10.872 1.00 0.00 O ATOM 1275 CB ASP A 88 30.534 26.114 -13.406 1.00 0.00 C ATOM 1276 CG ASP A 88 31.403 26.895 -12.426 1.00 0.00 C ATOM 1277 OD1 ASP A 88 31.300 28.144 -12.427 1.00 0.00 O ATOM 1278 OD2 ASP A 88 32.166 26.240 -11.681 1.00 0.00 O ATOM 0 H ASP A 88 28.584 24.865 -14.500 1.00 0.00 H new ATOM 0 HA ASP A 88 30.156 24.510 -12.022 1.00 0.00 H new ATOM 0 HB2 ASP A 88 31.172 25.551 -14.087 1.00 0.00 H new ATOM 0 HB3 ASP A 88 29.956 26.811 -14.013 1.00 0.00 H new ATOM 1283 N SER A 89 27.285 25.759 -12.092 1.00 0.00 N ATOM 1284 CA SER A 89 26.229 26.422 -11.340 1.00 0.00 C ATOM 1285 C SER A 89 25.817 25.616 -10.108 1.00 0.00 C ATOM 1286 O SER A 89 24.863 25.987 -9.421 1.00 0.00 O ATOM 1287 CB SER A 89 25.037 26.677 -12.260 1.00 0.00 C ATOM 1288 OG SER A 89 24.561 25.451 -12.781 1.00 0.00 O ATOM 0 H SER A 89 26.942 25.179 -12.857 1.00 0.00 H new ATOM 0 HA SER A 89 26.609 27.376 -10.974 1.00 0.00 H new ATOM 0 HB2 SER A 89 24.243 27.181 -11.709 1.00 0.00 H new ATOM 0 HB3 SER A 89 25.330 27.339 -13.075 1.00 0.00 H new ATOM 0 HG SER A 89 23.795 25.621 -13.369 1.00 0.00 H new ATOM 1294 N VAL A 90 26.523 24.517 -9.819 1.00 0.00 N ATOM 1295 CA VAL A 90 26.202 23.634 -8.705 1.00 0.00 C ATOM 1296 C VAL A 90 27.460 23.113 -8.013 1.00 0.00 C ATOM 1297 O VAL A 90 28.531 23.039 -8.619 1.00 0.00 O ATOM 1298 CB VAL A 90 25.345 22.455 -9.174 1.00 0.00 C ATOM 1299 CG1 VAL A 90 23.940 22.898 -9.567 1.00 0.00 C ATOM 1300 CG2 VAL A 90 25.992 21.713 -10.345 1.00 0.00 C ATOM 0 H VAL A 90 27.336 24.218 -10.357 1.00 0.00 H new ATOM 0 HA VAL A 90 25.637 24.224 -7.984 1.00 0.00 H new ATOM 0 HB VAL A 90 25.273 21.774 -8.326 1.00 0.00 H new ATOM 0 HG11 VAL A 90 23.364 22.032 -9.894 1.00 0.00 H new ATOM 0 HG12 VAL A 90 23.450 23.357 -8.709 1.00 0.00 H new ATOM 0 HG13 VAL A 90 24.001 23.622 -10.380 1.00 0.00 H new ATOM 0 HG21 VAL A 90 25.353 20.884 -10.648 1.00 0.00 H new ATOM 0 HG22 VAL A 90 26.120 22.398 -11.183 1.00 0.00 H new ATOM 0 HG23 VAL A 90 26.965 21.328 -10.039 1.00 0.00 H new ATOM 1310 N ASP A 91 27.322 22.755 -6.734 1.00 0.00 N ATOM 1311 CA ASP A 91 28.406 22.220 -5.919 1.00 0.00 C ATOM 1312 C ASP A 91 28.620 20.726 -6.193 1.00 0.00 C ATOM 1313 O ASP A 91 27.823 20.089 -6.881 1.00 0.00 O ATOM 1314 CB ASP A 91 28.078 22.488 -4.448 1.00 0.00 C ATOM 1315 CG ASP A 91 29.218 22.072 -3.519 1.00 0.00 C ATOM 1316 OD1 ASP A 91 30.370 22.473 -3.800 1.00 0.00 O ATOM 1317 OD2 ASP A 91 28.924 21.355 -2.536 1.00 0.00 O ATOM 0 H ASP A 91 26.438 22.832 -6.231 1.00 0.00 H new ATOM 0 HA ASP A 91 29.343 22.715 -6.175 1.00 0.00 H new ATOM 0 HB2 ASP A 91 27.869 23.549 -4.311 1.00 0.00 H new ATOM 0 HB3 ASP A 91 27.172 21.947 -4.175 1.00 0.00 H new ATOM 1322 N SER A 92 29.700 20.156 -5.653 1.00 0.00 N ATOM 1323 CA SER A 92 30.049 18.760 -5.886 1.00 0.00 C ATOM 1324 C SER A 92 28.990 17.793 -5.352 1.00 0.00 C ATOM 1325 O SER A 92 28.974 16.626 -5.740 1.00 0.00 O ATOM 1326 CB SER A 92 31.405 18.464 -5.251 1.00 0.00 C ATOM 1327 OG SER A 92 31.345 18.689 -3.858 1.00 0.00 O ATOM 0 H SER A 92 30.353 20.650 -5.045 1.00 0.00 H new ATOM 0 HA SER A 92 30.099 18.606 -6.964 1.00 0.00 H new ATOM 0 HB2 SER A 92 31.691 17.431 -5.449 1.00 0.00 H new ATOM 0 HB3 SER A 92 32.171 19.098 -5.698 1.00 0.00 H new ATOM 0 HG SER A 92 32.218 18.495 -3.457 1.00 0.00 H new ATOM 1333 N ARG A 93 28.100 18.253 -4.464 1.00 0.00 N ATOM 1334 CA ARG A 93 27.024 17.416 -3.944 1.00 0.00 C ATOM 1335 C ARG A 93 25.986 17.155 -5.033 1.00 0.00 C ATOM 1336 O ARG A 93 25.333 16.113 -5.034 1.00 0.00 O ATOM 1337 CB ARG A 93 26.402 18.098 -2.724 1.00 0.00 C ATOM 1338 CG ARG A 93 25.389 17.168 -2.049 1.00 0.00 C ATOM 1339 CD ARG A 93 24.849 17.799 -0.763 1.00 0.00 C ATOM 1340 NE ARG A 93 24.057 19.003 -1.039 1.00 0.00 N ATOM 1341 CZ ARG A 93 23.343 19.644 -0.111 1.00 0.00 C ATOM 1342 NH1 ARG A 93 23.340 19.227 1.153 1.00 0.00 N ATOM 1343 NH2 ARG A 93 22.624 20.712 -0.445 1.00 0.00 N ATOM 0 H ARG A 93 28.108 19.203 -4.093 1.00 0.00 H new ATOM 0 HA ARG A 93 27.421 16.450 -3.634 1.00 0.00 H new ATOM 0 HB2 ARG A 93 27.183 18.371 -2.015 1.00 0.00 H new ATOM 0 HB3 ARG A 93 25.910 19.022 -3.028 1.00 0.00 H new ATOM 0 HG2 ARG A 93 24.565 16.962 -2.733 1.00 0.00 H new ATOM 0 HG3 ARG A 93 25.861 16.212 -1.821 1.00 0.00 H new ATOM 0 HD2 ARG A 93 24.234 17.073 -0.232 1.00 0.00 H new ATOM 0 HD3 ARG A 93 25.680 18.053 -0.106 1.00 0.00 H new ATOM 0 HE ARG A 93 24.052 19.370 -1.991 1.00 0.00 H new ATOM 0 HH11 ARG A 93 23.887 18.409 1.422 1.00 0.00 H new ATOM 0 HH12 ARG A 93 22.790 19.725 1.853 1.00 0.00 H new ATOM 0 HH21 ARG A 93 22.618 21.041 -1.410 1.00 0.00 H new ATOM 0 HH22 ARG A 93 22.078 21.202 0.264 1.00 0.00 H new ATOM 1357 N PHE A 94 25.832 18.101 -5.961 1.00 0.00 N ATOM 1358 CA PHE A 94 24.924 17.950 -7.085 1.00 0.00 C ATOM 1359 C PHE A 94 25.590 17.113 -8.171 1.00 0.00 C ATOM 1360 O PHE A 94 24.911 16.494 -8.986 1.00 0.00 O ATOM 1361 CB PHE A 94 24.575 19.325 -7.653 1.00 0.00 C ATOM 1362 CG PHE A 94 23.970 20.309 -6.672 1.00 0.00 C ATOM 1363 CD1 PHE A 94 24.761 20.884 -5.667 1.00 0.00 C ATOM 1364 CD2 PHE A 94 22.618 20.661 -6.781 1.00 0.00 C ATOM 1365 CE1 PHE A 94 24.198 21.804 -4.770 1.00 0.00 C ATOM 1366 CE2 PHE A 94 22.058 21.587 -5.888 1.00 0.00 C ATOM 1367 CZ PHE A 94 22.847 22.157 -4.881 1.00 0.00 C ATOM 0 H PHE A 94 26.334 18.989 -5.949 1.00 0.00 H new ATOM 0 HA PHE A 94 24.014 17.454 -6.746 1.00 0.00 H new ATOM 0 HB2 PHE A 94 25.481 19.766 -8.069 1.00 0.00 H new ATOM 0 HB3 PHE A 94 23.878 19.190 -8.480 1.00 0.00 H new ATOM 0 HD1 PHE A 94 25.804 20.618 -5.583 1.00 0.00 H new ATOM 0 HD2 PHE A 94 22.006 20.219 -7.553 1.00 0.00 H new ATOM 0 HE1 PHE A 94 24.807 22.241 -3.993 1.00 0.00 H new ATOM 0 HE2 PHE A 94 21.017 21.861 -5.977 1.00 0.00 H new ATOM 0 HZ PHE A 94 22.415 22.867 -4.192 1.00 0.00 H new ATOM 1377 N ARG A 95 26.926 17.095 -8.177 1.00 0.00 N ATOM 1378 CA ARG A 95 27.700 16.310 -9.127 1.00 0.00 C ATOM 1379 C ARG A 95 27.858 14.868 -8.642 1.00 0.00 C ATOM 1380 O ARG A 95 28.315 14.017 -9.402 1.00 0.00 O ATOM 1381 CB ARG A 95 29.056 16.984 -9.350 1.00 0.00 C ATOM 1382 CG ARG A 95 28.864 18.418 -9.854 1.00 0.00 C ATOM 1383 CD ARG A 95 30.213 19.116 -10.045 1.00 0.00 C ATOM 1384 NE ARG A 95 31.028 18.447 -11.069 1.00 0.00 N ATOM 1385 CZ ARG A 95 31.377 18.987 -12.239 1.00 0.00 C ATOM 1386 NH1 ARG A 95 30.993 20.215 -12.574 1.00 0.00 N ATOM 1387 NH2 ARG A 95 32.121 18.294 -13.096 1.00 0.00 N ATOM 0 H ARG A 95 27.497 17.627 -7.520 1.00 0.00 H new ATOM 0 HA ARG A 95 27.172 16.267 -10.079 1.00 0.00 H new ATOM 0 HB2 ARG A 95 29.623 16.992 -8.419 1.00 0.00 H new ATOM 0 HB3 ARG A 95 29.639 16.413 -10.073 1.00 0.00 H new ATOM 0 HG2 ARG A 95 28.320 18.406 -10.798 1.00 0.00 H new ATOM 0 HG3 ARG A 95 28.257 18.979 -9.143 1.00 0.00 H new ATOM 0 HD2 ARG A 95 30.049 20.155 -10.331 1.00 0.00 H new ATOM 0 HD3 ARG A 95 30.754 19.128 -9.099 1.00 0.00 H new ATOM 0 HE ARG A 95 31.351 17.500 -10.871 1.00 0.00 H new ATOM 0 HH11 ARG A 95 30.421 20.763 -11.932 1.00 0.00 H new ATOM 0 HH12 ARG A 95 31.271 20.609 -13.473 1.00 0.00 H new ATOM 0 HH21 ARG A 95 32.425 17.350 -12.860 1.00 0.00 H new ATOM 0 HH22 ARG A 95 32.387 18.707 -13.990 1.00 0.00 H new ATOM 1401 N ASP A 96 27.482 14.598 -7.387 1.00 0.00 N ATOM 1402 CA ASP A 96 27.521 13.256 -6.818 1.00 0.00 C ATOM 1403 C ASP A 96 26.131 12.610 -6.844 1.00 0.00 C ATOM 1404 O ASP A 96 26.019 11.386 -6.827 1.00 0.00 O ATOM 1405 CB ASP A 96 28.071 13.339 -5.393 1.00 0.00 C ATOM 1406 CG ASP A 96 28.202 11.956 -4.761 1.00 0.00 C ATOM 1407 OD1 ASP A 96 29.074 11.188 -5.224 1.00 0.00 O ATOM 1408 OD2 ASP A 96 27.429 11.677 -3.816 1.00 0.00 O ATOM 0 H ASP A 96 27.142 15.309 -6.740 1.00 0.00 H new ATOM 0 HA ASP A 96 28.177 12.624 -7.417 1.00 0.00 H new ATOM 0 HB2 ASP A 96 29.045 13.828 -5.406 1.00 0.00 H new ATOM 0 HB3 ASP A 96 27.412 13.958 -4.783 1.00 0.00 H new ATOM 1413 N ARG A 97 25.073 13.429 -6.886 1.00 0.00 N ATOM 1414 CA ARG A 97 23.697 12.955 -6.996 1.00 0.00 C ATOM 1415 C ARG A 97 23.240 13.006 -8.455 1.00 0.00 C ATOM 1416 O ARG A 97 23.873 13.673 -9.273 1.00 0.00 O ATOM 1417 CB ARG A 97 22.785 13.802 -6.103 1.00 0.00 C ATOM 1418 CG ARG A 97 23.115 13.580 -4.628 1.00 0.00 C ATOM 1419 CD ARG A 97 22.124 14.338 -3.743 1.00 0.00 C ATOM 1420 NE ARG A 97 20.761 13.812 -3.891 1.00 0.00 N ATOM 1421 CZ ARG A 97 20.268 12.791 -3.185 1.00 0.00 C ATOM 1422 NH1 ARG A 97 21.004 12.180 -2.260 1.00 0.00 N ATOM 1423 NH2 ARG A 97 19.028 12.367 -3.402 1.00 0.00 N ATOM 0 H ARG A 97 25.153 14.445 -6.844 1.00 0.00 H new ATOM 0 HA ARG A 97 23.642 11.919 -6.660 1.00 0.00 H new ATOM 0 HB2 ARG A 97 22.902 14.857 -6.352 1.00 0.00 H new ATOM 0 HB3 ARG A 97 21.743 13.544 -6.290 1.00 0.00 H new ATOM 0 HG2 ARG A 97 23.079 12.515 -4.396 1.00 0.00 H new ATOM 0 HG3 ARG A 97 24.130 13.918 -4.421 1.00 0.00 H new ATOM 0 HD2 ARG A 97 22.433 14.262 -2.701 1.00 0.00 H new ATOM 0 HD3 ARG A 97 22.137 15.396 -4.003 1.00 0.00 H new ATOM 0 HE ARG A 97 20.151 14.255 -4.578 1.00 0.00 H new ATOM 0 HH11 ARG A 97 21.959 12.490 -2.082 1.00 0.00 H new ATOM 0 HH12 ARG A 97 20.613 11.402 -1.729 1.00 0.00 H new ATOM 0 HH21 ARG A 97 18.450 12.821 -4.109 1.00 0.00 H new ATOM 0 HH22 ARG A 97 18.654 11.587 -2.862 1.00 0.00 H new ATOM 1437 N PRO A 98 22.145 12.316 -8.805 1.00 0.00 N ATOM 1438 CA PRO A 98 21.588 12.332 -10.148 1.00 0.00 C ATOM 1439 C PRO A 98 21.215 13.745 -10.599 1.00 0.00 C ATOM 1440 O PRO A 98 20.819 14.579 -9.786 1.00 0.00 O ATOM 1441 CB PRO A 98 20.352 11.431 -10.093 1.00 0.00 C ATOM 1442 CG PRO A 98 20.632 10.513 -8.904 1.00 0.00 C ATOM 1443 CD PRO A 98 21.377 11.436 -7.946 1.00 0.00 C ATOM 0 HA PRO A 98 22.319 11.977 -10.875 1.00 0.00 H new ATOM 0 HB2 PRO A 98 19.440 12.010 -9.947 1.00 0.00 H new ATOM 0 HB3 PRO A 98 20.226 10.865 -11.016 1.00 0.00 H new ATOM 0 HG2 PRO A 98 19.713 10.127 -8.464 1.00 0.00 H new ATOM 0 HG3 PRO A 98 21.235 9.651 -9.189 1.00 0.00 H new ATOM 0 HD2 PRO A 98 20.685 11.999 -7.320 1.00 0.00 H new ATOM 0 HD3 PRO A 98 22.026 10.871 -7.276 1.00 0.00 H new ATOM 1451 N VAL A 99 21.343 14.002 -11.903 1.00 0.00 N ATOM 1452 CA VAL A 99 21.038 15.297 -12.502 1.00 0.00 C ATOM 1453 C VAL A 99 20.346 15.108 -13.844 1.00 0.00 C ATOM 1454 O VAL A 99 20.530 14.085 -14.504 1.00 0.00 O ATOM 1455 CB VAL A 99 22.308 16.138 -12.691 1.00 0.00 C ATOM 1456 CG1 VAL A 99 22.913 16.524 -11.343 1.00 0.00 C ATOM 1457 CG2 VAL A 99 23.361 15.389 -13.511 1.00 0.00 C ATOM 0 H VAL A 99 21.665 13.307 -12.577 1.00 0.00 H new ATOM 0 HA VAL A 99 20.372 15.828 -11.822 1.00 0.00 H new ATOM 0 HB VAL A 99 22.013 17.038 -13.230 1.00 0.00 H new ATOM 0 HG11 VAL A 99 23.812 17.119 -11.505 1.00 0.00 H new ATOM 0 HG12 VAL A 99 22.189 17.107 -10.773 1.00 0.00 H new ATOM 0 HG13 VAL A 99 23.170 15.622 -10.788 1.00 0.00 H new ATOM 0 HG21 VAL A 99 24.246 16.015 -13.625 1.00 0.00 H new ATOM 0 HG22 VAL A 99 23.632 14.466 -12.999 1.00 0.00 H new ATOM 0 HG23 VAL A 99 22.955 15.152 -14.495 1.00 0.00 H new ATOM 1467 N LEU A 100 19.553 16.107 -14.243 1.00 0.00 N ATOM 1468 CA LEU A 100 18.870 16.127 -15.528 1.00 0.00 C ATOM 1469 C LEU A 100 19.027 17.498 -16.180 1.00 0.00 C ATOM 1470 O LEU A 100 19.166 18.506 -15.487 1.00 0.00 O ATOM 1471 CB LEU A 100 17.386 15.799 -15.332 1.00 0.00 C ATOM 1472 CG LEU A 100 17.154 14.365 -14.845 1.00 0.00 C ATOM 1473 CD1 LEU A 100 15.671 14.178 -14.539 1.00 0.00 C ATOM 1474 CD2 LEU A 100 17.559 13.351 -15.914 1.00 0.00 C ATOM 0 H LEU A 100 19.369 16.932 -13.672 1.00 0.00 H new ATOM 0 HA LEU A 100 19.314 15.376 -16.182 1.00 0.00 H new ATOM 0 HB2 LEU A 100 16.957 16.496 -14.612 1.00 0.00 H new ATOM 0 HB3 LEU A 100 16.858 15.948 -16.274 1.00 0.00 H new ATOM 0 HG LEU A 100 17.760 14.202 -13.954 1.00 0.00 H new ATOM 0 HD11 LEU A 100 15.497 13.160 -14.192 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.368 14.883 -13.765 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.088 14.358 -15.442 1.00 0.00 H new ATOM 0 HD21 LEU A 100 17.384 12.341 -15.543 1.00 0.00 H new ATOM 0 HD22 LEU A 100 16.966 13.514 -16.814 1.00 0.00 H new ATOM 0 HD23 LEU A 100 18.616 13.473 -16.149 1.00 0.00 H new ATOM 1486 N GLN A 101 19.000 17.535 -17.513 1.00 0.00 N ATOM 1487 CA GLN A 101 19.052 18.783 -18.257 1.00 0.00 C ATOM 1488 C GLN A 101 17.703 19.490 -18.151 1.00 0.00 C ATOM 1489 O GLN A 101 16.684 18.845 -17.898 1.00 0.00 O ATOM 1490 CB GLN A 101 19.409 18.499 -19.719 1.00 0.00 C ATOM 1491 CG GLN A 101 20.823 17.930 -19.856 1.00 0.00 C ATOM 1492 CD GLN A 101 21.899 18.953 -19.499 1.00 0.00 C ATOM 1493 OE1 GLN A 101 21.627 20.140 -19.339 1.00 0.00 O ATOM 1494 NE2 GLN A 101 23.143 18.499 -19.374 1.00 0.00 N ATOM 0 H GLN A 101 18.942 16.703 -18.100 1.00 0.00 H new ATOM 0 HA GLN A 101 19.820 19.433 -17.839 1.00 0.00 H new ATOM 0 HB2 GLN A 101 18.691 17.794 -20.139 1.00 0.00 H new ATOM 0 HB3 GLN A 101 19.329 19.419 -20.298 1.00 0.00 H new ATOM 0 HG2 GLN A 101 20.925 17.058 -19.209 1.00 0.00 H new ATOM 0 HG3 GLN A 101 20.976 17.587 -20.879 1.00 0.00 H new ATOM 0 HE21 GLN A 101 23.341 17.508 -19.512 1.00 0.00 H new ATOM 0 HE22 GLN A 101 23.899 19.142 -19.140 1.00 0.00 H new ATOM 1503 N LYS A 102 17.676 20.812 -18.340 1.00 0.00 N ATOM 1504 CA LYS A 102 16.437 21.571 -18.240 1.00 0.00 C ATOM 1505 C LYS A 102 15.500 21.286 -19.420 1.00 0.00 C ATOM 1506 O LYS A 102 14.316 21.042 -19.184 1.00 0.00 O ATOM 1507 CB LYS A 102 16.755 23.060 -18.083 1.00 0.00 C ATOM 1508 CG LYS A 102 15.524 23.891 -17.704 1.00 0.00 C ATOM 1509 CD LYS A 102 15.273 23.939 -16.193 1.00 0.00 C ATOM 1510 CE LYS A 102 15.098 22.548 -15.584 1.00 0.00 C ATOM 1511 NZ LYS A 102 14.715 22.639 -14.166 1.00 0.00 N ATOM 0 H LYS A 102 18.498 21.373 -18.562 1.00 0.00 H new ATOM 0 HA LYS A 102 15.896 21.249 -17.350 1.00 0.00 H new ATOM 0 HB2 LYS A 102 17.522 23.185 -17.319 1.00 0.00 H new ATOM 0 HB3 LYS A 102 17.171 23.439 -19.017 1.00 0.00 H new ATOM 0 HG2 LYS A 102 15.650 24.907 -18.078 1.00 0.00 H new ATOM 0 HG3 LYS A 102 14.646 23.476 -18.199 1.00 0.00 H new ATOM 0 HD2 LYS A 102 16.107 24.443 -15.705 1.00 0.00 H new ATOM 0 HD3 LYS A 102 14.381 24.534 -15.995 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.336 21.998 -16.136 1.00 0.00 H new ATOM 0 HE3 LYS A 102 16.027 21.986 -15.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.503 21.688 -13.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 15.498 23.052 -13.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.872 23.241 -14.072 1.00 0.00 H new ATOM 1525 N PRO A 103 15.970 21.303 -20.677 1.00 0.00 N ATOM 1526 CA PRO A 103 15.159 20.879 -21.806 1.00 0.00 C ATOM 1527 C PRO A 103 15.020 19.359 -21.801 1.00 0.00 C ATOM 1528 O PRO A 103 15.967 18.647 -21.467 1.00 0.00 O ATOM 1529 CB PRO A 103 15.897 21.375 -23.047 1.00 0.00 C ATOM 1530 CG PRO A 103 17.356 21.326 -22.606 1.00 0.00 C ATOM 1531 CD PRO A 103 17.287 21.723 -21.132 1.00 0.00 C ATOM 0 HA PRO A 103 14.147 21.283 -21.771 1.00 0.00 H new ATOM 0 HB2 PRO A 103 15.713 20.736 -23.911 1.00 0.00 H new ATOM 0 HB3 PRO A 103 15.591 22.384 -23.325 1.00 0.00 H new ATOM 0 HG2 PRO A 103 17.783 20.332 -22.736 1.00 0.00 H new ATOM 0 HG3 PRO A 103 17.974 22.016 -23.181 1.00 0.00 H new ATOM 0 HD2 PRO A 103 18.075 21.236 -20.557 1.00 0.00 H new ATOM 0 HD3 PRO A 103 17.421 22.798 -21.008 1.00 0.00 H new ATOM 1539 N PHE A 104 13.836 18.864 -22.172 1.00 0.00 N ATOM 1540 CA PHE A 104 13.516 17.445 -22.181 1.00 0.00 C ATOM 1541 C PHE A 104 13.247 16.960 -23.604 1.00 0.00 C ATOM 1542 O PHE A 104 12.913 17.748 -24.487 1.00 0.00 O ATOM 1543 CB PHE A 104 12.294 17.186 -21.295 1.00 0.00 C ATOM 1544 CG PHE A 104 12.530 17.046 -19.800 1.00 0.00 C ATOM 1545 CD1 PHE A 104 13.798 17.245 -19.226 1.00 0.00 C ATOM 1546 CD2 PHE A 104 11.450 16.698 -18.975 1.00 0.00 C ATOM 1547 CE1 PHE A 104 13.977 17.101 -17.844 1.00 0.00 C ATOM 1548 CE2 PHE A 104 11.635 16.535 -17.595 1.00 0.00 C ATOM 1549 CZ PHE A 104 12.896 16.745 -17.026 1.00 0.00 C ATOM 0 H PHE A 104 13.063 19.454 -22.479 1.00 0.00 H new ATOM 0 HA PHE A 104 14.369 16.892 -21.788 1.00 0.00 H new ATOM 0 HB2 PHE A 104 11.587 18.001 -21.449 1.00 0.00 H new ATOM 0 HB3 PHE A 104 11.811 16.274 -21.646 1.00 0.00 H new ATOM 0 HD1 PHE A 104 14.637 17.510 -19.853 1.00 0.00 H new ATOM 0 HD2 PHE A 104 10.470 16.555 -19.406 1.00 0.00 H new ATOM 0 HE1 PHE A 104 14.951 17.265 -17.407 1.00 0.00 H new ATOM 0 HE2 PHE A 104 10.803 16.247 -16.970 1.00 0.00 H new ATOM 0 HZ PHE A 104 13.036 16.633 -15.961 1.00 0.00 H new ATOM 1559 N THR A 105 13.396 15.647 -23.815 1.00 0.00 N ATOM 1560 CA THR A 105 13.154 14.992 -25.098 1.00 0.00 C ATOM 1561 C THR A 105 12.501 13.633 -24.860 1.00 0.00 C ATOM 1562 O THR A 105 12.546 13.103 -23.754 1.00 0.00 O ATOM 1563 CB THR A 105 14.465 14.811 -25.871 1.00 0.00 C ATOM 1564 OG1 THR A 105 15.356 14.016 -25.122 1.00 0.00 O ATOM 1565 CG2 THR A 105 15.133 16.153 -26.170 1.00 0.00 C ATOM 0 H THR A 105 13.694 15.002 -23.083 1.00 0.00 H new ATOM 0 HA THR A 105 12.489 15.619 -25.692 1.00 0.00 H new ATOM 0 HB THR A 105 14.224 14.325 -26.816 1.00 0.00 H new ATOM 0 HG1 THR A 105 16.192 13.902 -25.621 1.00 0.00 H new ATOM 0 HG21 THR A 105 16.059 15.984 -26.719 1.00 0.00 H new ATOM 0 HG22 THR A 105 14.462 16.767 -26.771 1.00 0.00 H new ATOM 0 HG23 THR A 105 15.354 16.666 -25.234 1.00 0.00 H new ATOM 1573 N MET A 106 11.890 13.060 -25.901 1.00 0.00 N ATOM 1574 CA MET A 106 11.191 11.788 -25.779 1.00 0.00 C ATOM 1575 C MET A 106 12.160 10.657 -25.435 1.00 0.00 C ATOM 1576 O MET A 106 11.784 9.718 -24.736 1.00 0.00 O ATOM 1577 CB MET A 106 10.475 11.473 -27.097 1.00 0.00 C ATOM 1578 CG MET A 106 9.339 12.459 -27.364 1.00 0.00 C ATOM 1579 SD MET A 106 7.962 12.339 -26.193 1.00 0.00 S ATOM 1580 CE MET A 106 6.916 13.664 -26.841 1.00 0.00 C ATOM 0 H MET A 106 11.868 13.462 -26.838 1.00 0.00 H new ATOM 0 HA MET A 106 10.464 11.869 -24.971 1.00 0.00 H new ATOM 0 HB2 MET A 106 11.190 11.508 -27.919 1.00 0.00 H new ATOM 0 HB3 MET A 106 10.078 10.458 -27.064 1.00 0.00 H new ATOM 0 HG2 MET A 106 9.738 13.473 -27.335 1.00 0.00 H new ATOM 0 HG3 MET A 106 8.959 12.294 -28.372 1.00 0.00 H new ATOM 0 HE1 MET A 106 6.010 13.740 -26.239 1.00 0.00 H new ATOM 0 HE2 MET A 106 7.459 14.608 -26.801 1.00 0.00 H new ATOM 0 HE3 MET A 106 6.647 13.443 -27.874 1.00 0.00 H new ATOM 1590 N ASP A 107 13.405 10.736 -25.918 1.00 0.00 N ATOM 1591 CA ASP A 107 14.402 9.711 -25.644 1.00 0.00 C ATOM 1592 C ASP A 107 15.101 9.949 -24.303 1.00 0.00 C ATOM 1593 O ASP A 107 15.452 8.995 -23.612 1.00 0.00 O ATOM 1594 CB ASP A 107 15.413 9.693 -26.791 1.00 0.00 C ATOM 1595 CG ASP A 107 16.456 8.595 -26.595 1.00 0.00 C ATOM 1596 OD1 ASP A 107 16.081 7.410 -26.739 1.00 0.00 O ATOM 1597 OD2 ASP A 107 17.621 8.951 -26.306 1.00 0.00 O ATOM 0 H ASP A 107 13.740 11.503 -26.501 1.00 0.00 H new ATOM 0 HA ASP A 107 13.907 8.742 -25.573 1.00 0.00 H new ATOM 0 HB2 ASP A 107 14.892 9.538 -27.736 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.909 10.661 -26.856 1.00 0.00 H new ATOM 1602 N GLY A 108 15.304 11.216 -23.932 1.00 0.00 N ATOM 1603 CA GLY A 108 16.035 11.561 -22.722 1.00 0.00 C ATOM 1604 C GLY A 108 15.203 11.372 -21.461 1.00 0.00 C ATOM 1605 O GLY A 108 15.755 11.075 -20.403 1.00 0.00 O ATOM 0 H GLY A 108 14.967 12.021 -24.460 1.00 0.00 H new ATOM 0 HA2 GLY A 108 16.932 10.946 -22.656 1.00 0.00 H new ATOM 0 HA3 GLY A 108 16.364 12.598 -22.784 1.00 0.00 H new ATOM 1609 N VAL A 109 13.880 11.536 -21.553 1.00 0.00 N ATOM 1610 CA VAL A 109 13.010 11.390 -20.396 1.00 0.00 C ATOM 1611 C VAL A 109 12.589 9.934 -20.217 1.00 0.00 C ATOM 1612 O VAL A 109 12.311 9.513 -19.097 1.00 0.00 O ATOM 1613 CB VAL A 109 11.798 12.314 -20.531 1.00 0.00 C ATOM 1614 CG1 VAL A 109 10.876 12.176 -19.321 1.00 0.00 C ATOM 1615 CG2 VAL A 109 12.255 13.768 -20.589 1.00 0.00 C ATOM 0 H VAL A 109 13.394 11.770 -22.419 1.00 0.00 H new ATOM 0 HA VAL A 109 13.559 11.682 -19.501 1.00 0.00 H new ATOM 0 HB VAL A 109 11.270 12.034 -21.442 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.021 12.842 -19.437 1.00 0.00 H new ATOM 0 HG12 VAL A 109 10.527 11.146 -19.245 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.422 12.442 -18.416 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.386 14.419 -20.685 1.00 0.00 H new ATOM 0 HG22 VAL A 109 12.795 14.016 -19.675 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.911 13.909 -21.448 1.00 0.00 H new ATOM 1625 N ALA A 110 12.539 9.153 -21.300 1.00 0.00 N ATOM 1626 CA ALA A 110 12.170 7.749 -21.188 1.00 0.00 C ATOM 1627 C ALA A 110 13.261 6.971 -20.451 1.00 0.00 C ATOM 1628 O ALA A 110 12.966 6.008 -19.743 1.00 0.00 O ATOM 1629 CB ALA A 110 11.945 7.179 -22.587 1.00 0.00 C ATOM 0 H ALA A 110 12.747 9.467 -22.248 1.00 0.00 H new ATOM 0 HA ALA A 110 11.248 7.656 -20.613 1.00 0.00 H new ATOM 0 HB1 ALA A 110 11.668 6.127 -22.511 1.00 0.00 H new ATOM 0 HB2 ALA A 110 11.144 7.730 -23.080 1.00 0.00 H new ATOM 0 HB3 ALA A 110 12.862 7.272 -23.169 1.00 0.00 H new ATOM 1635 N LYS A 111 14.522 7.390 -20.610 1.00 0.00 N ATOM 1636 CA LYS A 111 15.643 6.760 -19.929 1.00 0.00 C ATOM 1637 C LYS A 111 15.781 7.309 -18.508 1.00 0.00 C ATOM 1638 O LYS A 111 16.246 6.599 -17.620 1.00 0.00 O ATOM 1639 CB LYS A 111 16.913 7.014 -20.750 1.00 0.00 C ATOM 1640 CG LYS A 111 18.156 6.350 -20.139 1.00 0.00 C ATOM 1641 CD LYS A 111 18.017 4.830 -20.001 1.00 0.00 C ATOM 1642 CE LYS A 111 17.748 4.187 -21.363 1.00 0.00 C ATOM 1643 NZ LYS A 111 17.670 2.717 -21.256 1.00 0.00 N ATOM 0 H LYS A 111 14.786 8.170 -21.212 1.00 0.00 H new ATOM 0 HA LYS A 111 15.477 5.686 -19.846 1.00 0.00 H new ATOM 0 HB2 LYS A 111 16.767 6.639 -21.763 1.00 0.00 H new ATOM 0 HB3 LYS A 111 17.081 8.088 -20.829 1.00 0.00 H new ATOM 0 HG2 LYS A 111 19.023 6.575 -20.760 1.00 0.00 H new ATOM 0 HG3 LYS A 111 18.346 6.782 -19.157 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.928 4.414 -19.570 1.00 0.00 H new ATOM 0 HD3 LYS A 111 17.203 4.595 -19.315 1.00 0.00 H new ATOM 0 HE2 LYS A 111 16.815 4.574 -21.772 1.00 0.00 H new ATOM 0 HE3 LYS A 111 18.540 4.462 -22.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 17.487 2.310 -22.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 18.570 2.347 -20.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 16.898 2.456 -20.609 1.00 0.00 H new ATOM 1657 N ALA A 112 15.382 8.565 -18.285 1.00 0.00 N ATOM 1658 CA ALA A 112 15.477 9.182 -16.973 1.00 0.00 C ATOM 1659 C ALA A 112 14.343 8.719 -16.061 1.00 0.00 C ATOM 1660 O ALA A 112 14.528 8.630 -14.850 1.00 0.00 O ATOM 1661 CB ALA A 112 15.449 10.699 -17.142 1.00 0.00 C ATOM 0 H ALA A 112 14.989 9.171 -19.005 1.00 0.00 H new ATOM 0 HA ALA A 112 16.413 8.881 -16.501 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.520 11.175 -16.164 1.00 0.00 H new ATOM 0 HB2 ALA A 112 16.291 11.012 -17.760 1.00 0.00 H new ATOM 0 HB3 ALA A 112 14.517 10.994 -17.623 1.00 0.00 H new ATOM 1667 N LEU A 113 13.169 8.424 -16.629 1.00 0.00 N ATOM 1668 CA LEU A 113 12.028 7.966 -15.851 1.00 0.00 C ATOM 1669 C LEU A 113 12.245 6.510 -15.447 1.00 0.00 C ATOM 1670 O LEU A 113 11.924 6.125 -14.322 1.00 0.00 O ATOM 1671 CB LEU A 113 10.759 8.180 -16.691 1.00 0.00 C ATOM 1672 CG LEU A 113 9.423 7.972 -15.964 1.00 0.00 C ATOM 1673 CD1 LEU A 113 9.057 6.495 -15.828 1.00 0.00 C ATOM 1674 CD2 LEU A 113 9.422 8.629 -14.584 1.00 0.00 C ATOM 0 H LEU A 113 12.990 8.497 -17.631 1.00 0.00 H new ATOM 0 HA LEU A 113 11.914 8.532 -14.926 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.778 9.195 -17.089 1.00 0.00 H new ATOM 0 HB3 LEU A 113 10.794 7.502 -17.544 1.00 0.00 H new ATOM 0 HG LEU A 113 8.668 8.453 -16.585 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.104 6.403 -15.307 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.974 6.048 -16.819 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.832 5.979 -15.261 1.00 0.00 H new ATOM 0 HD21 LEU A 113 8.460 8.460 -14.101 1.00 0.00 H new ATOM 0 HD22 LEU A 113 10.215 8.196 -13.974 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.591 9.701 -14.691 1.00 0.00 H new ATOM 1686 N ALA A 114 12.792 5.696 -16.356 1.00 0.00 N ATOM 1687 CA ALA A 114 13.058 4.299 -16.060 1.00 0.00 C ATOM 1688 C ALA A 114 14.186 4.166 -15.035 1.00 0.00 C ATOM 1689 O ALA A 114 14.235 3.181 -14.303 1.00 0.00 O ATOM 1690 CB ALA A 114 13.416 3.586 -17.363 1.00 0.00 C ATOM 0 H ALA A 114 13.056 5.987 -17.298 1.00 0.00 H new ATOM 0 HA ALA A 114 12.170 3.840 -15.625 1.00 0.00 H new ATOM 0 HB1 ALA A 114 13.619 2.535 -17.159 1.00 0.00 H new ATOM 0 HB2 ALA A 114 12.583 3.666 -18.062 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.301 4.048 -17.799 1.00 0.00 H new ATOM 1696 N ALA A 115 15.090 5.152 -14.979 1.00 0.00 N ATOM 1697 CA ALA A 115 16.181 5.162 -14.013 1.00 0.00 C ATOM 1698 C ALA A 115 15.757 5.809 -12.692 1.00 0.00 C ATOM 1699 O ALA A 115 16.451 5.670 -11.687 1.00 0.00 O ATOM 1700 CB ALA A 115 17.374 5.895 -14.627 1.00 0.00 C ATOM 0 H ALA A 115 15.081 5.960 -15.602 1.00 0.00 H new ATOM 0 HA ALA A 115 16.463 4.135 -13.782 1.00 0.00 H new ATOM 0 HB1 ALA A 115 18.198 5.910 -13.914 1.00 0.00 H new ATOM 0 HB2 ALA A 115 17.689 5.381 -15.535 1.00 0.00 H new ATOM 0 HB3 ALA A 115 17.087 6.918 -14.870 1.00 0.00 H new ATOM 1706 N LEU A 116 14.622 6.517 -12.687 1.00 0.00 N ATOM 1707 CA LEU A 116 14.104 7.166 -11.492 1.00 0.00 C ATOM 1708 C LEU A 116 13.152 6.238 -10.741 1.00 0.00 C ATOM 1709 O LEU A 116 13.128 6.252 -9.512 1.00 0.00 O ATOM 1710 CB LEU A 116 13.439 8.483 -11.911 1.00 0.00 C ATOM 1711 CG LEU A 116 12.815 9.265 -10.747 1.00 0.00 C ATOM 1712 CD1 LEU A 116 12.788 10.751 -11.102 1.00 0.00 C ATOM 1713 CD2 LEU A 116 11.367 8.841 -10.483 1.00 0.00 C ATOM 0 H LEU A 116 14.042 6.652 -13.515 1.00 0.00 H new ATOM 0 HA LEU A 116 14.913 7.391 -10.797 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.181 9.113 -12.402 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.665 8.269 -12.648 1.00 0.00 H new ATOM 0 HG LEU A 116 13.417 9.063 -9.861 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.346 11.314 -10.280 1.00 0.00 H new ATOM 0 HD12 LEU A 116 13.805 11.102 -11.276 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.194 10.899 -12.004 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.964 9.419 -9.651 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.767 9.021 -11.375 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.338 7.780 -10.235 1.00 0.00 H new ATOM 1725 N LEU A 117 12.373 5.434 -11.470 1.00 0.00 N ATOM 1726 CA LEU A 117 11.361 4.575 -10.868 1.00 0.00 C ATOM 1727 C LEU A 117 11.932 3.209 -10.478 1.00 0.00 C ATOM 1728 O LEU A 117 11.276 2.456 -9.758 1.00 0.00 O ATOM 1729 CB LEU A 117 10.195 4.459 -11.855 1.00 0.00 C ATOM 1730 CG LEU A 117 8.951 3.791 -11.255 1.00 0.00 C ATOM 1731 CD1 LEU A 117 8.445 4.553 -10.027 1.00 0.00 C ATOM 1732 CD2 LEU A 117 7.849 3.762 -12.311 1.00 0.00 C ATOM 0 H LEU A 117 12.428 5.363 -12.486 1.00 0.00 H new ATOM 0 HA LEU A 117 11.005 5.015 -9.936 1.00 0.00 H new ATOM 0 HB2 LEU A 117 9.928 5.455 -12.209 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.521 3.888 -12.725 1.00 0.00 H new ATOM 0 HG LEU A 117 9.218 2.781 -10.945 1.00 0.00 H new ATOM 0 HD11 LEU A 117 7.563 4.053 -9.627 1.00 0.00 H new ATOM 0 HD12 LEU A 117 9.225 4.577 -9.266 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.186 5.572 -10.313 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.959 3.289 -11.895 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.610 4.781 -12.615 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.190 3.195 -13.177 1.00 0.00 H new ATOM 1744 N VAL A 118 13.144 2.887 -10.942 1.00 0.00 N ATOM 1745 CA VAL A 118 13.793 1.610 -10.659 1.00 0.00 C ATOM 1746 C VAL A 118 15.261 1.832 -10.312 1.00 0.00 C ATOM 1747 O VAL A 118 15.628 1.517 -9.159 1.00 0.00 O ATOM 1748 CB VAL A 118 13.653 0.665 -11.858 1.00 0.00 C ATOM 1749 CG1 VAL A 118 14.275 -0.692 -11.525 1.00 0.00 C ATOM 1750 CG2 VAL A 118 12.186 0.439 -12.222 1.00 0.00 C ATOM 0 H VAL A 118 13.702 3.510 -11.526 1.00 0.00 H new ATOM 0 HA VAL A 118 13.304 1.147 -9.802 1.00 0.00 H new ATOM 0 HB VAL A 118 14.165 1.129 -12.701 1.00 0.00 H new ATOM 0 HG11 VAL A 118 14.172 -1.359 -12.381 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.332 -0.561 -11.292 1.00 0.00 H new ATOM 0 HG13 VAL A 118 13.765 -1.125 -10.664 1.00 0.00 H new ATOM 0 HG21 VAL A 118 12.123 -0.236 -13.076 1.00 0.00 H new ATOM 0 HG22 VAL A 118 11.664 -0.001 -11.372 1.00 0.00 H new ATOM 0 HG23 VAL A 118 11.724 1.392 -12.478 1.00 0.00 H new TER 1760 VAL A 118