USER MOD reduce.3.24.130724 H: found=0, std=0, add=648, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 648 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 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 SER OG : rot 37:sc= 0.0132 USER MOD Single : A 35 THR OG1 : rot -46:sc= 0.198 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.143 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 47 SER OG : rot -60:sc= 0.0164 USER MOD Single : A 48 THR OG1 : rot 91:sc= 0.0511 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot -157:sc= 1.26 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot -160:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.0246 K(o=-0.025,f=-0.99) USER MOD Single : A 85 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.27) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 94 HIS : no HD1:sc= -0.239 X(o=-0.24,f=-0.00018) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc=-0.00135 X(o=-0.0014,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -21:sc= 0.276 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 31 0.891 -14.526 -7.173 1.00 0.00 N ATOM 2 CA GLY A 31 1.766 -15.704 -6.983 1.00 0.00 C ATOM 3 C GLY A 31 1.316 -16.842 -7.882 1.00 0.00 C ATOM 4 O GLY A 31 0.115 -17.024 -8.035 1.00 0.00 O ATOM 0 HA2 GLY A 31 2.799 -15.439 -7.209 1.00 0.00 H new ATOM 0 HA3 GLY A 31 1.739 -16.022 -5.941 1.00 0.00 H new ATOM 8 N ASN A 32 2.260 -17.573 -8.488 1.00 0.00 N ATOM 9 CA ASN A 32 2.003 -18.690 -9.402 1.00 0.00 C ATOM 10 C ASN A 32 3.102 -19.753 -9.241 1.00 0.00 C ATOM 11 O ASN A 32 4.270 -19.439 -9.458 1.00 0.00 O ATOM 12 CB ASN A 32 1.980 -18.182 -10.856 1.00 0.00 C ATOM 13 CG ASN A 32 0.745 -17.360 -11.187 1.00 0.00 C ATOM 14 OD1 ASN A 32 -0.372 -17.852 -11.186 1.00 0.00 O ATOM 15 ND2 ASN A 32 0.912 -16.090 -11.501 1.00 0.00 N ATOM 0 H ASN A 32 3.255 -17.397 -8.350 1.00 0.00 H new ATOM 0 HA ASN A 32 1.036 -19.132 -9.164 1.00 0.00 H new ATOM 0 HB2 ASN A 32 2.869 -17.578 -11.036 1.00 0.00 H new ATOM 0 HB3 ASN A 32 2.032 -19.035 -11.532 1.00 0.00 H new ATOM 0 HD21 ASN A 32 0.106 -15.515 -11.744 1.00 0.00 H new ATOM 0 HD22 ASN A 32 1.847 -15.683 -11.500 1.00 0.00 H new ATOM 22 N GLY A 33 2.723 -20.985 -8.875 1.00 0.00 N ATOM 23 CA GLY A 33 3.628 -22.133 -8.774 1.00 0.00 C ATOM 24 C GLY A 33 4.554 -22.083 -7.553 1.00 0.00 C ATOM 25 O GLY A 33 5.567 -21.387 -7.549 1.00 0.00 O ATOM 0 H GLY A 33 1.758 -21.214 -8.636 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.037 -23.048 -8.733 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.235 -22.186 -9.678 1.00 0.00 H new ATOM 29 N SER A 34 4.223 -22.855 -6.516 1.00 0.00 N ATOM 30 CA SER A 34 4.936 -22.868 -5.239 1.00 0.00 C ATOM 31 C SER A 34 5.015 -24.296 -4.684 1.00 0.00 C ATOM 32 O SER A 34 3.997 -24.941 -4.446 1.00 0.00 O ATOM 33 CB SER A 34 4.275 -21.871 -4.271 1.00 0.00 C ATOM 34 OG SER A 34 2.877 -22.070 -4.146 1.00 0.00 O ATOM 0 H SER A 34 3.435 -23.502 -6.542 1.00 0.00 H new ATOM 0 HA SER A 34 5.967 -22.542 -5.379 1.00 0.00 H new ATOM 0 HB2 SER A 34 4.739 -21.963 -3.289 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.463 -20.855 -4.619 1.00 0.00 H new ATOM 0 HG SER A 34 2.679 -23.029 -4.175 1.00 0.00 H new ATOM 40 N THR A 35 6.243 -24.810 -4.522 1.00 0.00 N ATOM 41 CA THR A 35 6.548 -26.145 -3.964 1.00 0.00 C ATOM 42 C THR A 35 6.996 -26.070 -2.492 1.00 0.00 C ATOM 43 O THR A 35 7.644 -26.972 -1.962 1.00 0.00 O ATOM 44 CB THR A 35 7.564 -26.868 -4.870 1.00 0.00 C ATOM 45 OG1 THR A 35 7.602 -28.247 -4.571 1.00 0.00 O ATOM 46 CG2 THR A 35 8.978 -26.265 -4.834 1.00 0.00 C ATOM 0 H THR A 35 7.083 -24.294 -4.783 1.00 0.00 H new ATOM 0 HA THR A 35 5.634 -26.738 -3.952 1.00 0.00 H new ATOM 0 HB THR A 35 7.208 -26.725 -5.890 1.00 0.00 H new ATOM 0 HG1 THR A 35 7.648 -28.370 -3.600 1.00 0.00 H new ATOM 0 HG21 THR A 35 9.632 -26.831 -5.498 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.939 -25.226 -5.162 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.367 -26.310 -3.817 1.00 0.00 H new ATOM 54 N ILE A 36 6.686 -24.953 -1.825 1.00 0.00 N ATOM 55 CA ILE A 36 7.019 -24.738 -0.420 1.00 0.00 C ATOM 56 C ILE A 36 6.088 -25.592 0.457 1.00 0.00 C ATOM 57 O ILE A 36 4.946 -25.873 0.096 1.00 0.00 O ATOM 58 CB ILE A 36 6.948 -23.233 -0.064 1.00 0.00 C ATOM 59 CG1 ILE A 36 7.641 -22.309 -1.098 1.00 0.00 C ATOM 60 CG2 ILE A 36 7.557 -22.972 1.329 1.00 0.00 C ATOM 61 CD1 ILE A 36 9.138 -22.582 -1.311 1.00 0.00 C ATOM 0 H ILE A 36 6.193 -24.169 -2.252 1.00 0.00 H new ATOM 0 HA ILE A 36 8.045 -25.053 -0.231 1.00 0.00 H new ATOM 0 HB ILE A 36 5.886 -22.986 -0.071 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.129 -22.411 -2.055 1.00 0.00 H new ATOM 0 HG13 ILE A 36 7.517 -21.274 -0.779 1.00 0.00 H new ATOM 0 HG21 ILE A 36 7.497 -21.908 1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 36 7.004 -23.537 2.079 1.00 0.00 H new ATOM 0 HG23 ILE A 36 8.601 -23.286 1.334 1.00 0.00 H new ATOM 0 HD11 ILE A 36 9.533 -21.886 -2.051 1.00 0.00 H new ATOM 0 HD12 ILE A 36 9.670 -22.450 -0.369 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.275 -23.604 -1.665 1.00 0.00 H new ATOM 73 N THR A 37 6.586 -26.005 1.623 1.00 0.00 N ATOM 74 CA THR A 37 5.842 -26.711 2.671 1.00 0.00 C ATOM 75 C THR A 37 4.650 -25.905 3.210 1.00 0.00 C ATOM 76 O THR A 37 4.493 -24.724 2.933 1.00 0.00 O ATOM 77 CB THR A 37 6.780 -27.052 3.849 1.00 0.00 C ATOM 78 OG1 THR A 37 8.078 -26.501 3.715 1.00 0.00 O ATOM 79 CG2 THR A 37 6.890 -28.560 4.052 1.00 0.00 C ATOM 0 H THR A 37 7.562 -25.851 1.876 1.00 0.00 H new ATOM 0 HA THR A 37 5.450 -27.618 2.210 1.00 0.00 H new ATOM 0 HB THR A 37 6.320 -26.594 4.725 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.621 -26.751 4.491 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.557 -28.767 4.889 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.903 -28.971 4.265 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.288 -29.021 3.148 1.00 0.00 H new ATOM 87 N PHE A 38 3.832 -26.517 4.071 1.00 0.00 N ATOM 88 CA PHE A 38 2.687 -25.847 4.702 1.00 0.00 C ATOM 89 C PHE A 38 3.083 -24.767 5.736 1.00 0.00 C ATOM 90 O PHE A 38 2.227 -24.004 6.188 1.00 0.00 O ATOM 91 CB PHE A 38 1.757 -26.915 5.302 1.00 0.00 C ATOM 92 CG PHE A 38 0.855 -27.586 4.276 1.00 0.00 C ATOM 93 CD1 PHE A 38 1.381 -28.495 3.333 1.00 0.00 C ATOM 94 CD2 PHE A 38 -0.521 -27.285 4.249 1.00 0.00 C ATOM 95 CE1 PHE A 38 0.542 -29.085 2.371 1.00 0.00 C ATOM 96 CE2 PHE A 38 -1.363 -27.888 3.298 1.00 0.00 C ATOM 97 CZ PHE A 38 -0.831 -28.784 2.354 1.00 0.00 C ATOM 0 H PHE A 38 3.943 -27.491 4.352 1.00 0.00 H new ATOM 0 HA PHE A 38 2.157 -25.291 3.928 1.00 0.00 H new ATOM 0 HB2 PHE A 38 2.362 -27.676 5.794 1.00 0.00 H new ATOM 0 HB3 PHE A 38 1.137 -26.454 6.071 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.433 -28.739 3.350 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.932 -26.587 4.963 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.953 -29.770 1.644 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.419 -27.663 3.293 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.476 -29.240 1.617 1.00 0.00 H new ATOM 107 N ASP A 39 4.368 -24.649 6.091 1.00 0.00 N ATOM 108 CA ASP A 39 4.882 -23.631 7.012 1.00 0.00 C ATOM 109 C ASP A 39 4.668 -22.196 6.503 1.00 0.00 C ATOM 110 O ASP A 39 4.291 -21.327 7.289 1.00 0.00 O ATOM 111 CB ASP A 39 6.370 -23.889 7.276 1.00 0.00 C ATOM 112 CG ASP A 39 6.586 -25.286 7.861 1.00 0.00 C ATOM 113 OD1 ASP A 39 6.719 -26.208 7.026 1.00 0.00 O ATOM 114 OD2 ASP A 39 6.561 -25.415 9.107 1.00 0.00 O ATOM 0 H ASP A 39 5.094 -25.272 5.738 1.00 0.00 H new ATOM 0 HA ASP A 39 4.316 -23.714 7.940 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.931 -23.789 6.347 1.00 0.00 H new ATOM 0 HB3 ASP A 39 6.757 -23.138 7.965 1.00 0.00 H new ATOM 119 N GLU A 40 4.855 -21.940 5.196 1.00 0.00 N ATOM 120 CA GLU A 40 4.600 -20.614 4.605 1.00 0.00 C ATOM 121 C GLU A 40 3.162 -20.134 4.853 1.00 0.00 C ATOM 122 O GLU A 40 2.945 -18.953 5.127 1.00 0.00 O ATOM 123 CB GLU A 40 4.924 -20.570 3.097 1.00 0.00 C ATOM 124 CG GLU A 40 4.289 -21.694 2.258 1.00 0.00 C ATOM 125 CD GLU A 40 3.891 -21.298 0.822 1.00 0.00 C ATOM 126 OE1 GLU A 40 4.459 -20.315 0.291 1.00 0.00 O ATOM 127 OE2 GLU A 40 3.025 -21.998 0.250 1.00 0.00 O ATOM 0 H GLU A 40 5.183 -22.637 4.527 1.00 0.00 H new ATOM 0 HA GLU A 40 5.278 -19.929 5.114 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.595 -19.610 2.699 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.006 -20.612 2.973 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.990 -22.527 2.207 1.00 0.00 H new ATOM 0 HG3 GLU A 40 3.401 -22.056 2.777 1.00 0.00 H new ATOM 134 N LEU A 41 2.189 -21.057 4.813 1.00 0.00 N ATOM 135 CA LEU A 41 0.780 -20.786 5.079 1.00 0.00 C ATOM 136 C LEU A 41 0.594 -20.382 6.537 1.00 0.00 C ATOM 137 O LEU A 41 0.077 -19.301 6.806 1.00 0.00 O ATOM 138 CB LEU A 41 -0.099 -22.003 4.736 1.00 0.00 C ATOM 139 CG LEU A 41 -0.517 -22.173 3.265 1.00 0.00 C ATOM 140 CD1 LEU A 41 -1.446 -21.053 2.795 1.00 0.00 C ATOM 141 CD2 LEU A 41 0.670 -22.258 2.311 1.00 0.00 C ATOM 0 H LEU A 41 2.372 -22.035 4.589 1.00 0.00 H new ATOM 0 HA LEU A 41 0.464 -19.962 4.440 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.435 -22.903 5.042 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.004 -21.948 5.341 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.051 -23.123 3.237 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -1.714 -21.216 1.751 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.349 -21.050 3.405 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -0.938 -20.094 2.893 1.00 0.00 H new ATOM 0 HD21 LEU A 41 0.308 -22.377 1.290 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.260 -21.345 2.382 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.291 -23.113 2.578 1.00 0.00 H new ATOM 153 N GLN A 42 1.035 -21.230 7.474 1.00 0.00 N ATOM 154 CA GLN A 42 0.964 -20.935 8.908 1.00 0.00 C ATOM 155 C GLN A 42 1.628 -19.582 9.219 1.00 0.00 C ATOM 156 O GLN A 42 1.061 -18.792 9.966 1.00 0.00 O ATOM 157 CB GLN A 42 1.613 -22.066 9.722 1.00 0.00 C ATOM 158 CG GLN A 42 0.924 -23.439 9.571 1.00 0.00 C ATOM 159 CD GLN A 42 -0.237 -23.683 10.540 1.00 0.00 C ATOM 160 OE1 GLN A 42 -0.226 -23.298 11.699 1.00 0.00 O ATOM 161 NE2 GLN A 42 -1.273 -24.383 10.116 1.00 0.00 N ATOM 0 H GLN A 42 1.450 -22.137 7.259 1.00 0.00 H new ATOM 0 HA GLN A 42 -0.085 -20.868 9.195 1.00 0.00 H new ATOM 0 HB2 GLN A 42 2.656 -22.162 9.420 1.00 0.00 H new ATOM 0 HB3 GLN A 42 1.611 -21.786 10.775 1.00 0.00 H new ATOM 0 HG2 GLN A 42 0.553 -23.534 8.550 1.00 0.00 H new ATOM 0 HG3 GLN A 42 1.669 -24.222 9.714 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -1.304 -24.715 9.152 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -2.042 -24.592 10.752 1.00 0.00 H new ATOM 170 N GLY A 43 2.768 -19.270 8.587 1.00 0.00 N ATOM 171 CA GLY A 43 3.453 -17.985 8.722 1.00 0.00 C ATOM 172 C GLY A 43 2.645 -16.796 8.192 1.00 0.00 C ATOM 173 O GLY A 43 2.497 -15.800 8.903 1.00 0.00 O ATOM 0 H GLY A 43 3.245 -19.917 7.958 1.00 0.00 H new ATOM 0 HA2 GLY A 43 3.684 -17.816 9.774 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.403 -18.033 8.190 1.00 0.00 H new ATOM 177 N LEU A 44 2.098 -16.885 6.968 1.00 0.00 N ATOM 178 CA LEU A 44 1.316 -15.788 6.384 1.00 0.00 C ATOM 179 C LEU A 44 0.119 -15.402 7.278 1.00 0.00 C ATOM 180 O LEU A 44 -0.194 -14.219 7.443 1.00 0.00 O ATOM 181 CB LEU A 44 0.932 -16.097 4.916 1.00 0.00 C ATOM 182 CG LEU A 44 -0.440 -16.772 4.694 1.00 0.00 C ATOM 183 CD1 LEU A 44 -1.590 -15.766 4.595 1.00 0.00 C ATOM 184 CD2 LEU A 44 -0.494 -17.610 3.422 1.00 0.00 C ATOM 0 H LEU A 44 2.184 -17.704 6.367 1.00 0.00 H new ATOM 0 HA LEU A 44 1.944 -14.898 6.347 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.948 -15.163 4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.702 -16.739 4.489 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.558 -17.405 5.573 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.528 -16.299 4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.650 -15.189 5.518 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.413 -15.092 3.757 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.483 -18.057 3.323 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.295 -16.975 2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.257 -18.398 3.473 1.00 0.00 H new ATOM 196 N VAL A 45 -0.553 -16.395 7.874 1.00 0.00 N ATOM 197 CA VAL A 45 -1.705 -16.159 8.755 1.00 0.00 C ATOM 198 C VAL A 45 -1.290 -15.845 10.194 1.00 0.00 C ATOM 199 O VAL A 45 -2.036 -15.150 10.879 1.00 0.00 O ATOM 200 CB VAL A 45 -2.718 -17.320 8.722 1.00 0.00 C ATOM 201 CG1 VAL A 45 -3.245 -17.564 7.301 1.00 0.00 C ATOM 202 CG2 VAL A 45 -2.150 -18.627 9.286 1.00 0.00 C ATOM 0 H VAL A 45 -0.315 -17.380 7.760 1.00 0.00 H new ATOM 0 HA VAL A 45 -2.202 -15.274 8.356 1.00 0.00 H new ATOM 0 HB VAL A 45 -3.541 -17.010 9.366 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.957 -18.389 7.314 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -3.740 -16.664 6.937 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.413 -17.813 6.642 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -2.911 -19.406 9.235 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.282 -18.929 8.700 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -1.853 -18.477 10.324 1.00 0.00 H new ATOM 212 N ASN A 46 -0.107 -16.294 10.638 1.00 0.00 N ATOM 213 CA ASN A 46 0.442 -16.029 11.969 1.00 0.00 C ATOM 214 C ASN A 46 0.516 -14.523 12.250 1.00 0.00 C ATOM 215 O ASN A 46 0.017 -14.075 13.281 1.00 0.00 O ATOM 216 CB ASN A 46 1.819 -16.715 12.094 1.00 0.00 C ATOM 217 CG ASN A 46 2.607 -16.300 13.320 1.00 0.00 C ATOM 218 OD1 ASN A 46 3.279 -15.284 13.335 1.00 0.00 O ATOM 219 ND2 ASN A 46 2.588 -17.097 14.366 1.00 0.00 N ATOM 0 H ASN A 46 0.509 -16.868 10.062 1.00 0.00 H new ATOM 0 HA ASN A 46 -0.221 -16.447 12.726 1.00 0.00 H new ATOM 0 HB2 ASN A 46 1.674 -17.795 12.117 1.00 0.00 H new ATOM 0 HB3 ASN A 46 2.407 -16.491 11.204 1.00 0.00 H new ATOM 0 HD21 ASN A 46 3.137 -16.865 15.194 1.00 0.00 H new ATOM 0 HD22 ASN A 46 2.024 -17.947 14.350 1.00 0.00 H new ATOM 226 N SER A 47 1.140 -13.760 11.341 1.00 0.00 N ATOM 227 CA SER A 47 1.305 -12.306 11.476 1.00 0.00 C ATOM 228 C SER A 47 1.778 -11.652 10.163 1.00 0.00 C ATOM 229 O SER A 47 2.763 -10.917 10.123 1.00 0.00 O ATOM 230 CB SER A 47 2.245 -11.990 12.655 1.00 0.00 C ATOM 231 OG SER A 47 2.123 -10.627 13.018 1.00 0.00 O ATOM 0 H SER A 47 1.547 -14.138 10.485 1.00 0.00 H new ATOM 0 HA SER A 47 0.330 -11.870 11.692 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.001 -12.625 13.506 1.00 0.00 H new ATOM 0 HB3 SER A 47 3.276 -12.211 12.378 1.00 0.00 H new ATOM 0 HG SER A 47 2.372 -10.062 12.257 1.00 0.00 H new ATOM 237 N THR A 48 1.110 -11.933 9.035 1.00 0.00 N ATOM 238 CA THR A 48 1.445 -11.306 7.735 1.00 0.00 C ATOM 239 C THR A 48 0.201 -10.774 7.017 1.00 0.00 C ATOM 240 O THR A 48 0.198 -9.622 6.591 1.00 0.00 O ATOM 241 CB THR A 48 2.268 -12.255 6.840 1.00 0.00 C ATOM 242 OG1 THR A 48 3.247 -12.926 7.607 1.00 0.00 O ATOM 243 CG2 THR A 48 3.008 -11.557 5.699 1.00 0.00 C ATOM 0 H THR A 48 0.332 -12.591 8.990 1.00 0.00 H new ATOM 0 HA THR A 48 2.075 -10.443 7.949 1.00 0.00 H new ATOM 0 HB THR A 48 1.534 -12.936 6.410 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.876 -13.767 7.947 1.00 0.00 H new ATOM 0 HG21 THR A 48 3.561 -12.295 5.119 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.289 -11.053 5.053 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.702 -10.824 6.110 1.00 0.00 H new ATOM 251 N VAL A 49 -0.876 -11.569 6.936 1.00 0.00 N ATOM 252 CA VAL A 49 -2.177 -11.136 6.404 1.00 0.00 C ATOM 253 C VAL A 49 -2.942 -10.292 7.408 1.00 0.00 C ATOM 254 O VAL A 49 -3.323 -9.182 7.053 1.00 0.00 O ATOM 255 CB VAL A 49 -3.015 -12.331 5.908 1.00 0.00 C ATOM 256 CG1 VAL A 49 -4.535 -12.103 5.903 1.00 0.00 C ATOM 257 CG2 VAL A 49 -2.596 -12.610 4.464 1.00 0.00 C ATOM 0 H VAL A 49 -0.868 -12.542 7.242 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.976 -10.503 5.540 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.825 -13.151 6.600 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.036 -13.000 5.538 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.873 -11.885 6.916 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -4.775 -11.263 5.251 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.168 -13.452 4.075 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -2.787 -11.728 3.853 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -1.533 -12.849 4.433 1.00 0.00 H new ATOM 267 N THR A 50 -3.164 -10.785 8.636 1.00 0.00 N ATOM 268 CA THR A 50 -3.965 -10.085 9.658 1.00 0.00 C ATOM 269 C THR A 50 -3.518 -8.625 9.825 1.00 0.00 C ATOM 270 O THR A 50 -4.342 -7.713 9.817 1.00 0.00 O ATOM 271 CB THR A 50 -3.966 -10.870 10.984 1.00 0.00 C ATOM 272 OG1 THR A 50 -4.915 -10.315 11.859 1.00 0.00 O ATOM 273 CG2 THR A 50 -2.614 -10.904 11.704 1.00 0.00 C ATOM 0 H THR A 50 -2.794 -11.682 8.951 1.00 0.00 H new ATOM 0 HA THR A 50 -4.999 -10.044 9.315 1.00 0.00 H new ATOM 0 HB THR A 50 -4.208 -11.898 10.714 1.00 0.00 H new ATOM 0 HG1 THR A 50 -4.916 -10.816 12.701 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.707 -11.477 12.627 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.870 -11.373 11.060 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.301 -9.887 11.939 1.00 0.00 H new ATOM 281 N GLN A 51 -2.197 -8.399 9.832 1.00 0.00 N ATOM 282 CA GLN A 51 -1.584 -7.076 9.878 1.00 0.00 C ATOM 283 C GLN A 51 -1.913 -6.202 8.663 1.00 0.00 C ATOM 284 O GLN A 51 -2.116 -5.004 8.838 1.00 0.00 O ATOM 285 CB GLN A 51 -0.062 -7.200 10.035 1.00 0.00 C ATOM 286 CG GLN A 51 0.370 -7.559 11.467 1.00 0.00 C ATOM 287 CD GLN A 51 1.838 -7.196 11.701 1.00 0.00 C ATOM 288 OE1 GLN A 51 2.173 -6.352 12.520 1.00 0.00 O ATOM 289 NE2 GLN A 51 2.757 -7.781 10.956 1.00 0.00 N ATOM 0 H GLN A 51 -1.513 -9.155 9.805 1.00 0.00 H new ATOM 0 HA GLN A 51 -2.012 -6.575 10.746 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.307 -7.962 9.349 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.405 -6.258 9.746 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -0.258 -7.031 12.184 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.223 -8.625 11.639 1.00 0.00 H new ATOM 0 HE21 GLN A 51 2.485 -8.486 10.271 1.00 0.00 H new ATOM 0 HE22 GLN A 51 3.739 -7.528 11.066 1.00 0.00 H new ATOM 298 N ALA A 52 -1.994 -6.771 7.453 1.00 0.00 N ATOM 299 CA ALA A 52 -2.292 -6.040 6.223 1.00 0.00 C ATOM 300 C ALA A 52 -3.649 -5.323 6.315 1.00 0.00 C ATOM 301 O ALA A 52 -3.737 -4.132 6.015 1.00 0.00 O ATOM 302 CB ALA A 52 -2.241 -7.005 5.028 1.00 0.00 C ATOM 0 H ALA A 52 -1.851 -7.770 7.303 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.538 -5.267 6.078 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.463 -6.460 4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.246 -7.444 4.957 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.978 -7.796 5.168 1.00 0.00 H new ATOM 308 N ILE A 53 -4.691 -6.036 6.778 1.00 0.00 N ATOM 309 CA ILE A 53 -6.024 -5.459 7.000 1.00 0.00 C ATOM 310 C ILE A 53 -5.933 -4.277 7.972 1.00 0.00 C ATOM 311 O ILE A 53 -6.334 -3.167 7.623 1.00 0.00 O ATOM 312 CB ILE A 53 -7.055 -6.516 7.473 1.00 0.00 C ATOM 313 CG1 ILE A 53 -7.226 -7.658 6.440 1.00 0.00 C ATOM 314 CG2 ILE A 53 -8.421 -5.848 7.715 1.00 0.00 C ATOM 315 CD1 ILE A 53 -6.368 -8.889 6.748 1.00 0.00 C ATOM 0 H ILE A 53 -4.630 -7.028 7.008 1.00 0.00 H new ATOM 0 HA ILE A 53 -6.391 -5.090 6.042 1.00 0.00 H new ATOM 0 HB ILE A 53 -6.677 -6.947 8.400 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -8.275 -7.954 6.407 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -6.969 -7.283 5.449 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -9.139 -6.598 8.047 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -8.319 -5.079 8.481 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -8.773 -5.394 6.789 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -6.536 -9.650 5.986 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.315 -8.607 6.753 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -6.641 -9.288 7.725 1.00 0.00 H new ATOM 327 N LEU A 54 -5.373 -4.502 9.168 1.00 0.00 N ATOM 328 CA LEU A 54 -5.247 -3.486 10.221 1.00 0.00 C ATOM 329 C LEU A 54 -4.507 -2.248 9.699 1.00 0.00 C ATOM 330 O LEU A 54 -5.006 -1.130 9.835 1.00 0.00 O ATOM 331 CB LEU A 54 -4.504 -4.054 11.449 1.00 0.00 C ATOM 332 CG LEU A 54 -5.077 -5.367 12.025 1.00 0.00 C ATOM 333 CD1 LEU A 54 -4.003 -6.135 12.811 1.00 0.00 C ATOM 334 CD2 LEU A 54 -6.330 -5.150 12.883 1.00 0.00 C ATOM 0 H LEU A 54 -4.989 -5.409 9.435 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.254 -3.196 10.521 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -3.462 -4.222 11.176 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.510 -3.300 12.236 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.387 -5.969 11.171 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.431 -7.056 13.207 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.171 -6.376 12.150 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -3.644 -5.518 13.635 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.685 -6.110 13.259 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.088 -4.499 13.723 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.109 -4.687 12.278 1.00 0.00 H new ATOM 346 N PHE A 55 -3.336 -2.463 9.077 1.00 0.00 N ATOM 347 CA PHE A 55 -2.507 -1.418 8.487 1.00 0.00 C ATOM 348 C PHE A 55 -3.302 -0.611 7.459 1.00 0.00 C ATOM 349 O PHE A 55 -3.359 0.613 7.566 1.00 0.00 O ATOM 350 CB PHE A 55 -1.229 -2.016 7.876 1.00 0.00 C ATOM 351 CG PHE A 55 -0.121 -0.996 7.666 1.00 0.00 C ATOM 352 CD1 PHE A 55 -0.244 0.012 6.688 1.00 0.00 C ATOM 353 CD2 PHE A 55 1.038 -1.047 8.466 1.00 0.00 C ATOM 354 CE1 PHE A 55 0.771 0.973 6.530 1.00 0.00 C ATOM 355 CE2 PHE A 55 2.060 -0.095 8.298 1.00 0.00 C ATOM 356 CZ PHE A 55 1.923 0.920 7.334 1.00 0.00 C ATOM 0 H PHE A 55 -2.936 -3.395 8.972 1.00 0.00 H new ATOM 0 HA PHE A 55 -2.202 -0.732 9.277 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -0.862 -2.810 8.526 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -1.474 -2.476 6.919 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -1.121 0.046 6.058 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.142 -1.821 9.212 1.00 0.00 H new ATOM 0 HE1 PHE A 55 0.665 1.753 5.790 1.00 0.00 H new ATOM 0 HE2 PHE A 55 2.949 -0.143 8.909 1.00 0.00 H new ATOM 0 HZ PHE A 55 2.702 1.658 7.212 1.00 0.00 H new ATOM 366 N GLY A 56 -3.941 -1.280 6.492 1.00 0.00 N ATOM 367 CA GLY A 56 -4.773 -0.630 5.481 1.00 0.00 C ATOM 368 C GLY A 56 -5.909 0.209 6.079 1.00 0.00 C ATOM 369 O GLY A 56 -6.162 1.310 5.596 1.00 0.00 O ATOM 0 H GLY A 56 -3.893 -2.294 6.391 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -4.146 0.010 4.861 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -5.198 -1.391 4.826 1.00 0.00 H new ATOM 373 N VAL A 57 -6.559 -0.273 7.148 1.00 0.00 N ATOM 374 CA VAL A 57 -7.633 0.448 7.854 1.00 0.00 C ATOM 375 C VAL A 57 -7.105 1.741 8.482 1.00 0.00 C ATOM 376 O VAL A 57 -7.545 2.833 8.108 1.00 0.00 O ATOM 377 CB VAL A 57 -8.304 -0.441 8.924 1.00 0.00 C ATOM 378 CG1 VAL A 57 -9.343 0.349 9.737 1.00 0.00 C ATOM 379 CG2 VAL A 57 -8.996 -1.667 8.310 1.00 0.00 C ATOM 0 H VAL A 57 -6.352 -1.186 7.553 1.00 0.00 H new ATOM 0 HA VAL A 57 -8.390 0.709 7.115 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.501 -0.779 9.579 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.797 -0.305 10.481 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.854 1.184 10.238 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.116 0.729 9.069 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.453 -2.261 9.101 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.766 -1.339 7.612 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -8.261 -2.273 7.780 1.00 0.00 H new ATOM 389 N ARG A 58 -6.170 1.622 9.441 1.00 0.00 N ATOM 390 CA ARG A 58 -5.594 2.781 10.142 1.00 0.00 C ATOM 391 C ARG A 58 -4.977 3.772 9.153 1.00 0.00 C ATOM 392 O ARG A 58 -5.183 4.978 9.284 1.00 0.00 O ATOM 393 CB ARG A 58 -4.601 2.333 11.233 1.00 0.00 C ATOM 394 CG ARG A 58 -3.329 1.679 10.672 1.00 0.00 C ATOM 395 CD ARG A 58 -2.389 1.160 11.756 1.00 0.00 C ATOM 396 NE ARG A 58 -0.987 1.247 11.304 1.00 0.00 N ATOM 397 CZ ARG A 58 0.076 1.332 12.089 1.00 0.00 C ATOM 398 NH1 ARG A 58 -0.029 1.180 13.389 1.00 0.00 N ATOM 399 NH2 ARG A 58 1.258 1.587 11.577 1.00 0.00 N ATOM 0 H ARG A 58 -5.795 0.725 9.750 1.00 0.00 H new ATOM 0 HA ARG A 58 -6.400 3.309 10.652 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -4.321 3.197 11.835 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -5.099 1.628 11.899 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -3.611 0.853 10.019 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -2.797 2.404 10.056 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -2.520 1.741 12.669 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -2.637 0.126 11.997 1.00 0.00 H new ATOM 0 HE ARG A 58 -0.822 1.241 10.297 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -0.940 0.993 13.809 1.00 0.00 H new ATOM 0 HH12 ARG A 58 0.800 1.249 13.979 1.00 0.00 H new ATOM 0 HH21 ARG A 58 1.360 1.720 10.571 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.074 1.652 12.185 1.00 0.00 H new ATOM 413 N SER A 59 -4.269 3.254 8.140 1.00 0.00 N ATOM 414 CA SER A 59 -3.648 4.046 7.087 1.00 0.00 C ATOM 415 C SER A 59 -4.698 4.764 6.251 1.00 0.00 C ATOM 416 O SER A 59 -4.535 5.954 6.022 1.00 0.00 O ATOM 417 CB SER A 59 -2.765 3.171 6.196 1.00 0.00 C ATOM 418 OG SER A 59 -2.119 3.962 5.222 1.00 0.00 O ATOM 0 H SER A 59 -4.113 2.252 8.034 1.00 0.00 H new ATOM 0 HA SER A 59 -3.019 4.798 7.564 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.024 2.652 6.804 1.00 0.00 H new ATOM 0 HB3 SER A 59 -3.371 2.406 5.710 1.00 0.00 H new ATOM 0 HG SER A 59 -1.872 3.402 4.457 1.00 0.00 H new ATOM 424 N GLY A 60 -5.780 4.092 5.842 1.00 0.00 N ATOM 425 CA GLY A 60 -6.872 4.695 5.085 1.00 0.00 C ATOM 426 C GLY A 60 -7.504 5.875 5.823 1.00 0.00 C ATOM 427 O GLY A 60 -7.630 6.957 5.245 1.00 0.00 O ATOM 0 H GLY A 60 -5.919 3.100 6.033 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -6.499 5.031 4.118 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.635 3.942 4.888 1.00 0.00 H new ATOM 431 N ALA A 61 -7.861 5.687 7.099 1.00 0.00 N ATOM 432 CA ALA A 61 -8.453 6.744 7.921 1.00 0.00 C ATOM 433 C ALA A 61 -7.472 7.905 8.148 1.00 0.00 C ATOM 434 O ALA A 61 -7.810 9.057 7.865 1.00 0.00 O ATOM 435 CB ALA A 61 -8.958 6.160 9.249 1.00 0.00 C ATOM 0 H ALA A 61 -7.747 4.799 7.588 1.00 0.00 H new ATOM 0 HA ALA A 61 -9.306 7.158 7.383 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.396 6.955 9.853 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -9.712 5.399 9.048 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -8.125 5.712 9.790 1.00 0.00 H new ATOM 441 N ALA A 62 -6.254 7.601 8.627 1.00 0.00 N ATOM 442 CA ALA A 62 -5.200 8.589 8.848 1.00 0.00 C ATOM 443 C ALA A 62 -4.843 9.341 7.561 1.00 0.00 C ATOM 444 O ALA A 62 -4.647 10.552 7.606 1.00 0.00 O ATOM 445 CB ALA A 62 -3.965 7.907 9.446 1.00 0.00 C ATOM 0 H ALA A 62 -5.977 6.651 8.872 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.574 9.330 9.554 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.183 8.648 9.608 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.229 7.444 10.397 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.603 7.142 8.759 1.00 0.00 H new ATOM 451 N ALA A 63 -4.799 8.652 6.414 1.00 0.00 N ATOM 452 CA ALA A 63 -4.555 9.273 5.124 1.00 0.00 C ATOM 453 C ALA A 63 -5.694 10.210 4.722 1.00 0.00 C ATOM 454 O ALA A 63 -5.431 11.362 4.383 1.00 0.00 O ATOM 455 CB ALA A 63 -4.282 8.216 4.049 1.00 0.00 C ATOM 0 H ALA A 63 -4.934 7.642 6.364 1.00 0.00 H new ATOM 0 HA ALA A 63 -3.660 9.888 5.217 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.103 8.707 3.093 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -3.405 7.632 4.327 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.144 7.555 3.961 1.00 0.00 H new ATOM 461 N LEU A 64 -6.950 9.747 4.800 1.00 0.00 N ATOM 462 CA LEU A 64 -8.135 10.551 4.503 1.00 0.00 C ATOM 463 C LEU A 64 -8.097 11.889 5.246 1.00 0.00 C ATOM 464 O LEU A 64 -8.095 12.934 4.596 1.00 0.00 O ATOM 465 CB LEU A 64 -9.401 9.725 4.786 1.00 0.00 C ATOM 466 CG LEU A 64 -10.721 10.531 4.730 1.00 0.00 C ATOM 467 CD1 LEU A 64 -11.793 9.734 3.985 1.00 0.00 C ATOM 468 CD2 LEU A 64 -11.234 10.876 6.136 1.00 0.00 C ATOM 0 H LEU A 64 -7.170 8.790 5.075 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.149 10.809 3.444 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.457 8.911 4.064 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -9.310 9.270 5.772 1.00 0.00 H new ATOM 0 HG LEU A 64 -10.514 11.461 4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -12.717 10.310 3.952 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.455 9.531 2.969 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.972 8.792 4.503 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -12.162 11.442 6.056 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -11.416 9.957 6.693 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -10.488 11.475 6.659 1.00 0.00 H new ATOM 480 N THR A 65 -8.015 11.867 6.585 1.00 0.00 N ATOM 481 CA THR A 65 -7.965 13.102 7.388 1.00 0.00 C ATOM 482 C THR A 65 -6.798 14.002 6.972 1.00 0.00 C ATOM 483 O THR A 65 -7.003 15.211 6.870 1.00 0.00 O ATOM 484 CB THR A 65 -7.965 12.823 8.906 1.00 0.00 C ATOM 485 OG1 THR A 65 -7.967 14.016 9.663 1.00 0.00 O ATOM 486 CG2 THR A 65 -6.765 12.009 9.376 1.00 0.00 C ATOM 0 H THR A 65 -7.982 11.009 7.136 1.00 0.00 H new ATOM 0 HA THR A 65 -8.885 13.647 7.177 1.00 0.00 H new ATOM 0 HB THR A 65 -8.879 12.252 9.068 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.968 13.797 10.618 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.831 11.851 10.453 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.758 11.045 8.868 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.846 12.548 9.144 1.00 0.00 H new ATOM 494 N LEU A 66 -5.612 13.431 6.691 1.00 0.00 N ATOM 495 CA LEU A 66 -4.434 14.158 6.201 1.00 0.00 C ATOM 496 C LEU A 66 -4.749 14.930 4.916 1.00 0.00 C ATOM 497 O LEU A 66 -4.340 16.078 4.774 1.00 0.00 O ATOM 498 CB LEU A 66 -3.216 13.214 6.056 1.00 0.00 C ATOM 499 CG LEU A 66 -2.587 13.036 4.653 1.00 0.00 C ATOM 500 CD1 LEU A 66 -1.704 14.222 4.234 1.00 0.00 C ATOM 501 CD2 LEU A 66 -1.811 11.725 4.579 1.00 0.00 C ATOM 0 H LEU A 66 -5.446 12.431 6.802 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.159 14.905 6.946 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.436 13.573 6.727 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.515 12.229 6.414 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.411 13.003 3.940 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.293 14.037 3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.303 15.132 4.214 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.889 14.339 4.949 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.375 11.616 3.586 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.017 11.730 5.325 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.486 10.891 4.773 1.00 0.00 H new ATOM 513 N ILE A 67 -5.467 14.305 3.980 1.00 0.00 N ATOM 514 CA ILE A 67 -5.794 14.904 2.687 1.00 0.00 C ATOM 515 C ILE A 67 -6.737 16.088 2.921 1.00 0.00 C ATOM 516 O ILE A 67 -6.485 17.180 2.406 1.00 0.00 O ATOM 517 CB ILE A 67 -6.389 13.842 1.734 1.00 0.00 C ATOM 518 CG1 ILE A 67 -5.396 12.687 1.450 1.00 0.00 C ATOM 519 CG2 ILE A 67 -6.795 14.467 0.392 1.00 0.00 C ATOM 520 CD1 ILE A 67 -6.089 11.350 1.153 1.00 0.00 C ATOM 0 H ILE A 67 -5.840 13.363 4.100 1.00 0.00 H new ATOM 0 HA ILE A 67 -4.894 15.279 2.200 1.00 0.00 H new ATOM 0 HB ILE A 67 -7.266 13.440 2.242 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.767 12.958 0.602 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -4.737 12.564 2.310 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -7.210 13.696 -0.258 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -7.544 15.240 0.563 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.919 14.909 -0.083 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -5.337 10.585 0.963 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -6.697 11.057 2.009 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -6.727 11.458 0.275 1.00 0.00 H new ATOM 532 N VAL A 68 -7.776 15.899 3.750 1.00 0.00 N ATOM 533 CA VAL A 68 -8.744 16.953 4.079 1.00 0.00 C ATOM 534 C VAL A 68 -8.038 18.167 4.695 1.00 0.00 C ATOM 535 O VAL A 68 -8.192 19.275 4.173 1.00 0.00 O ATOM 536 CB VAL A 68 -9.887 16.459 4.996 1.00 0.00 C ATOM 537 CG1 VAL A 68 -11.046 17.466 4.982 1.00 0.00 C ATOM 538 CG2 VAL A 68 -10.450 15.089 4.586 1.00 0.00 C ATOM 0 H VAL A 68 -7.967 15.009 4.211 1.00 0.00 H new ATOM 0 HA VAL A 68 -9.208 17.253 3.139 1.00 0.00 H new ATOM 0 HB VAL A 68 -9.450 16.363 5.990 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -11.846 17.109 5.631 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.692 18.433 5.340 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.424 17.572 3.965 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.248 14.804 5.272 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.846 15.147 3.572 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.656 14.343 4.623 1.00 0.00 H new ATOM 548 N VAL A 69 -7.241 17.956 5.760 1.00 0.00 N ATOM 549 CA VAL A 69 -6.442 19.019 6.397 1.00 0.00 C ATOM 550 C VAL A 69 -5.469 19.650 5.397 1.00 0.00 C ATOM 551 O VAL A 69 -5.383 20.871 5.325 1.00 0.00 O ATOM 552 CB VAL A 69 -5.745 18.571 7.701 1.00 0.00 C ATOM 553 CG1 VAL A 69 -4.668 17.513 7.498 1.00 0.00 C ATOM 554 CG2 VAL A 69 -5.083 19.736 8.441 1.00 0.00 C ATOM 0 H VAL A 69 -7.133 17.043 6.203 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.145 19.792 6.708 1.00 0.00 H new ATOM 0 HB VAL A 69 -6.561 18.148 8.287 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -4.228 17.253 8.461 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -5.111 16.624 7.050 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.893 17.904 6.838 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.608 19.367 9.350 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.331 20.195 7.799 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.838 20.477 8.702 1.00 0.00 H new ATOM 564 N TRP A 70 -4.769 18.851 4.582 1.00 0.00 N ATOM 565 CA TRP A 70 -3.816 19.363 3.603 1.00 0.00 C ATOM 566 C TRP A 70 -4.477 20.294 2.579 1.00 0.00 C ATOM 567 O TRP A 70 -3.894 21.332 2.270 1.00 0.00 O ATOM 568 CB TRP A 70 -3.062 18.201 2.941 1.00 0.00 C ATOM 569 CG TRP A 70 -2.084 18.604 1.885 1.00 0.00 C ATOM 570 CD1 TRP A 70 -0.763 18.824 2.069 1.00 0.00 C ATOM 571 CD2 TRP A 70 -2.342 18.878 0.475 1.00 0.00 C ATOM 572 NE1 TRP A 70 -0.206 19.267 0.887 1.00 0.00 N ATOM 573 CE2 TRP A 70 -1.134 19.329 -0.129 1.00 0.00 C ATOM 574 CE3 TRP A 70 -3.484 18.808 -0.349 1.00 0.00 C ATOM 575 CZ2 TRP A 70 -1.064 19.727 -1.472 1.00 0.00 C ATOM 576 CZ3 TRP A 70 -3.428 19.191 -1.702 1.00 0.00 C ATOM 577 CH2 TRP A 70 -2.224 19.654 -2.263 1.00 0.00 C ATOM 0 H TRP A 70 -4.851 17.834 4.586 1.00 0.00 H new ATOM 0 HA TRP A 70 -3.087 19.979 4.129 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -2.531 17.645 3.714 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -3.790 17.519 2.500 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -0.228 18.676 2.995 1.00 0.00 H new ATOM 0 HE1 TRP A 70 0.776 19.519 0.778 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -4.417 18.455 0.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 -0.135 20.083 -1.891 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 -4.316 19.129 -2.314 1.00 0.00 H new ATOM 0 HH2 TRP A 70 -2.191 19.953 -3.300 1.00 0.00 H new ATOM 588 N ILE A 71 -5.695 19.978 2.114 1.00 0.00 N ATOM 589 CA ILE A 71 -6.499 20.854 1.251 1.00 0.00 C ATOM 590 C ILE A 71 -6.911 22.140 1.982 1.00 0.00 C ATOM 591 O ILE A 71 -6.556 23.227 1.529 1.00 0.00 O ATOM 592 CB ILE A 71 -7.707 20.077 0.662 1.00 0.00 C ATOM 593 CG1 ILE A 71 -7.293 19.271 -0.596 1.00 0.00 C ATOM 594 CG2 ILE A 71 -8.886 20.987 0.260 1.00 0.00 C ATOM 595 CD1 ILE A 71 -7.615 17.778 -0.502 1.00 0.00 C ATOM 0 H ILE A 71 -6.155 19.094 2.331 1.00 0.00 H new ATOM 0 HA ILE A 71 -5.885 21.173 0.409 1.00 0.00 H new ATOM 0 HB ILE A 71 -8.033 19.416 1.465 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -7.798 19.689 -1.467 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -6.222 19.393 -0.759 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -9.695 20.378 -0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -9.242 21.529 1.136 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -8.555 21.698 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -7.297 17.279 -1.417 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -7.089 17.345 0.349 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -8.689 17.645 -0.370 1.00 0.00 H new ATOM 607 N THR A 72 -7.666 22.049 3.086 1.00 0.00 N ATOM 608 CA THR A 72 -8.213 23.230 3.790 1.00 0.00 C ATOM 609 C THR A 72 -7.124 24.130 4.388 1.00 0.00 C ATOM 610 O THR A 72 -7.188 25.354 4.262 1.00 0.00 O ATOM 611 CB THR A 72 -9.233 22.813 4.868 1.00 0.00 C ATOM 612 OG1 THR A 72 -9.778 23.938 5.519 1.00 0.00 O ATOM 613 CG2 THR A 72 -8.639 21.926 5.958 1.00 0.00 C ATOM 0 H THR A 72 -7.917 21.160 3.519 1.00 0.00 H new ATOM 0 HA THR A 72 -8.728 23.824 3.035 1.00 0.00 H new ATOM 0 HB THR A 72 -9.994 22.255 4.322 1.00 0.00 H new ATOM 0 HG1 THR A 72 -10.422 23.644 6.196 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.413 21.671 6.682 1.00 0.00 H new ATOM 0 HG22 THR A 72 -8.246 21.013 5.510 1.00 0.00 H new ATOM 0 HG23 THR A 72 -7.832 22.459 6.462 1.00 0.00 H new ATOM 621 N SER A 73 -6.095 23.535 5.001 1.00 0.00 N ATOM 622 CA SER A 73 -4.936 24.243 5.547 1.00 0.00 C ATOM 623 C SER A 73 -3.886 24.580 4.482 1.00 0.00 C ATOM 624 O SER A 73 -2.909 25.249 4.812 1.00 0.00 O ATOM 625 CB SER A 73 -4.265 23.422 6.658 1.00 0.00 C ATOM 626 OG SER A 73 -5.193 22.997 7.637 1.00 0.00 O ATOM 0 H SER A 73 -6.045 22.525 5.133 1.00 0.00 H new ATOM 0 HA SER A 73 -5.323 25.179 5.950 1.00 0.00 H new ATOM 0 HB2 SER A 73 -3.776 22.552 6.220 1.00 0.00 H new ATOM 0 HB3 SER A 73 -3.487 24.021 7.132 1.00 0.00 H new ATOM 0 HG SER A 73 -4.728 22.477 8.325 1.00 0.00 H new ATOM 632 N ARG A 74 -4.067 24.127 3.228 1.00 0.00 N ATOM 633 CA ARG A 74 -3.141 24.320 2.099 1.00 0.00 C ATOM 634 C ARG A 74 -1.688 24.017 2.492 1.00 0.00 C ATOM 635 O ARG A 74 -0.774 24.791 2.205 1.00 0.00 O ATOM 636 CB ARG A 74 -3.328 25.734 1.524 1.00 0.00 C ATOM 637 CG ARG A 74 -4.722 25.979 0.934 1.00 0.00 C ATOM 638 CD ARG A 74 -4.900 25.254 -0.408 1.00 0.00 C ATOM 639 NE ARG A 74 -6.158 25.642 -1.066 1.00 0.00 N ATOM 640 CZ ARG A 74 -6.415 26.799 -1.670 1.00 0.00 C ATOM 641 NH1 ARG A 74 -5.522 27.757 -1.759 1.00 0.00 N ATOM 642 NH2 ARG A 74 -7.599 27.016 -2.194 1.00 0.00 N ATOM 0 H ARG A 74 -4.896 23.595 2.964 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.379 23.603 1.313 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.143 26.465 2.311 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -2.580 25.904 0.749 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.481 25.637 1.637 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -4.876 27.049 0.794 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -4.059 25.485 -1.062 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -4.890 24.176 -0.245 1.00 0.00 H new ATOM 0 HE ARG A 74 -6.910 24.953 -1.058 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -4.594 27.628 -1.357 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -5.757 28.631 -2.230 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.321 26.298 -2.138 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -7.797 27.903 -2.657 1.00 0.00 H new ATOM 656 N SER A 75 -1.485 22.890 3.183 1.00 0.00 N ATOM 657 CA SER A 75 -0.170 22.509 3.702 1.00 0.00 C ATOM 658 C SER A 75 0.852 22.409 2.570 1.00 0.00 C ATOM 659 O SER A 75 0.577 21.871 1.502 1.00 0.00 O ATOM 660 CB SER A 75 -0.223 21.189 4.478 1.00 0.00 C ATOM 661 OG SER A 75 -0.054 21.429 5.859 1.00 0.00 O ATOM 0 H SER A 75 -2.224 22.221 3.397 1.00 0.00 H new ATOM 0 HA SER A 75 0.140 23.292 4.394 1.00 0.00 H new ATOM 0 HB2 SER A 75 -1.177 20.693 4.302 1.00 0.00 H new ATOM 0 HB3 SER A 75 0.557 20.517 4.120 1.00 0.00 H new ATOM 0 HG SER A 75 -0.091 20.579 6.346 1.00 0.00 H new ATOM 667 N ARG A 76 2.068 22.901 2.821 1.00 0.00 N ATOM 668 CA ARG A 76 3.143 22.951 1.819 1.00 0.00 C ATOM 669 C ARG A 76 4.461 22.343 2.320 1.00 0.00 C ATOM 670 O ARG A 76 5.503 22.493 1.685 1.00 0.00 O ATOM 671 CB ARG A 76 3.284 24.403 1.333 1.00 0.00 C ATOM 672 CG ARG A 76 3.758 24.450 -0.126 1.00 0.00 C ATOM 673 CD ARG A 76 4.157 25.877 -0.521 1.00 0.00 C ATOM 674 NE ARG A 76 5.110 25.881 -1.646 1.00 0.00 N ATOM 675 CZ ARG A 76 6.400 25.564 -1.589 1.00 0.00 C ATOM 676 NH1 ARG A 76 6.967 25.135 -0.483 1.00 0.00 N ATOM 677 NH2 ARG A 76 7.156 25.666 -2.655 1.00 0.00 N ATOM 0 H ARG A 76 2.339 23.279 3.729 1.00 0.00 H new ATOM 0 HA ARG A 76 2.875 22.321 0.971 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.327 24.916 1.425 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.993 24.935 1.967 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.607 23.780 -0.259 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.964 24.094 -0.783 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.266 26.442 -0.796 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.603 26.382 0.336 1.00 0.00 H new ATOM 0 HE ARG A 76 4.744 26.154 -2.558 1.00 0.00 H new ATOM 0 HH11 ARG A 76 6.414 25.036 0.368 1.00 0.00 H new ATOM 0 HH12 ARG A 76 7.960 24.901 -0.476 1.00 0.00 H new ATOM 0 HH21 ARG A 76 6.755 25.990 -3.535 1.00 0.00 H new ATOM 0 HH22 ARG A 76 8.145 25.421 -2.604 1.00 0.00 H new ATOM 691 N LYS A 77 4.400 21.679 3.478 1.00 0.00 N ATOM 692 CA LYS A 77 5.516 21.091 4.218 1.00 0.00 C ATOM 693 C LYS A 77 5.089 19.779 4.883 1.00 0.00 C ATOM 694 O LYS A 77 4.828 19.720 6.081 1.00 0.00 O ATOM 695 CB LYS A 77 6.088 22.106 5.225 1.00 0.00 C ATOM 696 CG LYS A 77 5.053 22.764 6.166 1.00 0.00 C ATOM 697 CD LYS A 77 4.828 24.254 5.855 1.00 0.00 C ATOM 698 CE LYS A 77 4.158 24.960 7.042 1.00 0.00 C ATOM 699 NZ LYS A 77 2.704 24.675 7.141 1.00 0.00 N ATOM 0 H LYS A 77 3.510 21.529 3.953 1.00 0.00 H new ATOM 0 HA LYS A 77 6.318 20.846 3.522 1.00 0.00 H new ATOM 0 HB2 LYS A 77 6.839 21.603 5.834 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.601 22.892 4.671 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.105 22.233 6.084 1.00 0.00 H new ATOM 0 HG3 LYS A 77 5.388 22.659 7.198 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.782 24.732 5.632 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.205 24.355 4.966 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.647 24.650 7.965 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.306 26.036 6.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.307 25.178 7.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.228 24.995 6.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.558 23.652 7.259 1.00 0.00 H new ATOM 713 N THR A 78 4.997 18.725 4.076 1.00 0.00 N ATOM 714 CA THR A 78 4.619 17.377 4.510 1.00 0.00 C ATOM 715 C THR A 78 5.734 16.373 4.206 1.00 0.00 C ATOM 716 O THR A 78 6.493 16.566 3.253 1.00 0.00 O ATOM 717 CB THR A 78 3.288 16.916 3.874 1.00 0.00 C ATOM 718 OG1 THR A 78 3.065 17.500 2.605 1.00 0.00 O ATOM 719 CG2 THR A 78 2.109 17.270 4.779 1.00 0.00 C ATOM 0 H THR A 78 5.188 18.783 3.076 1.00 0.00 H new ATOM 0 HA THR A 78 4.470 17.418 5.589 1.00 0.00 H new ATOM 0 HB THR A 78 3.366 15.836 3.752 1.00 0.00 H new ATOM 0 HG1 THR A 78 2.112 17.447 2.384 1.00 0.00 H new ATOM 0 HG21 THR A 78 1.181 16.937 4.314 1.00 0.00 H new ATOM 0 HG22 THR A 78 2.229 16.776 5.743 1.00 0.00 H new ATOM 0 HG23 THR A 78 2.075 18.349 4.926 1.00 0.00 H new ATOM 727 N PRO A 79 5.842 15.287 4.993 1.00 0.00 N ATOM 728 CA PRO A 79 6.843 14.250 4.779 1.00 0.00 C ATOM 729 C PRO A 79 6.559 13.470 3.488 1.00 0.00 C ATOM 730 O PRO A 79 5.477 12.907 3.313 1.00 0.00 O ATOM 731 CB PRO A 79 6.798 13.366 6.032 1.00 0.00 C ATOM 732 CG PRO A 79 5.400 13.590 6.596 1.00 0.00 C ATOM 733 CD PRO A 79 5.030 15.001 6.167 1.00 0.00 C ATOM 0 HA PRO A 79 7.842 14.663 4.643 1.00 0.00 H new ATOM 0 HB2 PRO A 79 6.965 12.317 5.786 1.00 0.00 H new ATOM 0 HB3 PRO A 79 7.568 13.652 6.749 1.00 0.00 H new ATOM 0 HG2 PRO A 79 4.693 12.859 6.203 1.00 0.00 H new ATOM 0 HG3 PRO A 79 5.391 13.491 7.681 1.00 0.00 H new ATOM 0 HD2 PRO A 79 3.968 15.072 5.934 1.00 0.00 H new ATOM 0 HD3 PRO A 79 5.230 15.717 6.964 1.00 0.00 H new ATOM 741 N ILE A 80 7.559 13.386 2.602 1.00 0.00 N ATOM 742 CA ILE A 80 7.502 12.623 1.345 1.00 0.00 C ATOM 743 C ILE A 80 6.980 11.196 1.537 1.00 0.00 C ATOM 744 O ILE A 80 6.194 10.722 0.722 1.00 0.00 O ATOM 745 CB ILE A 80 8.878 12.582 0.638 1.00 0.00 C ATOM 746 CG1 ILE A 80 10.034 12.208 1.599 1.00 0.00 C ATOM 747 CG2 ILE A 80 9.146 13.913 -0.082 1.00 0.00 C ATOM 748 CD1 ILE A 80 11.368 11.928 0.901 1.00 0.00 C ATOM 0 H ILE A 80 8.453 13.858 2.741 1.00 0.00 H new ATOM 0 HA ILE A 80 6.792 13.155 0.712 1.00 0.00 H new ATOM 0 HB ILE A 80 8.840 11.786 -0.106 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.174 13.020 2.313 1.00 0.00 H new ATOM 0 HG13 ILE A 80 9.745 11.326 2.171 1.00 0.00 H new ATOM 0 HG21 ILE A 80 10.117 13.871 -0.575 1.00 0.00 H new ATOM 0 HG22 ILE A 80 8.369 14.087 -0.826 1.00 0.00 H new ATOM 0 HG23 ILE A 80 9.143 14.726 0.644 1.00 0.00 H new ATOM 0 HD11 ILE A 80 12.122 11.674 1.646 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.248 11.096 0.208 1.00 0.00 H new ATOM 0 HD13 ILE A 80 11.685 12.815 0.352 1.00 0.00 H new ATOM 760 N PHE A 81 7.377 10.528 2.629 1.00 0.00 N ATOM 761 CA PHE A 81 6.964 9.167 2.962 1.00 0.00 C ATOM 762 C PHE A 81 5.436 9.056 3.042 1.00 0.00 C ATOM 763 O PHE A 81 4.861 8.124 2.483 1.00 0.00 O ATOM 764 CB PHE A 81 7.641 8.736 4.276 1.00 0.00 C ATOM 765 CG PHE A 81 7.770 7.231 4.443 1.00 0.00 C ATOM 766 CD1 PHE A 81 6.625 6.425 4.610 1.00 0.00 C ATOM 767 CD2 PHE A 81 9.043 6.629 4.421 1.00 0.00 C ATOM 768 CE1 PHE A 81 6.750 5.029 4.721 1.00 0.00 C ATOM 769 CE2 PHE A 81 9.169 5.234 4.548 1.00 0.00 C ATOM 770 CZ PHE A 81 8.023 4.433 4.689 1.00 0.00 C ATOM 0 H PHE A 81 8.010 10.933 3.319 1.00 0.00 H new ATOM 0 HA PHE A 81 7.284 8.490 2.170 1.00 0.00 H new ATOM 0 HB2 PHE A 81 8.634 9.183 4.324 1.00 0.00 H new ATOM 0 HB3 PHE A 81 7.071 9.136 5.114 1.00 0.00 H new ATOM 0 HD1 PHE A 81 5.647 6.882 4.653 1.00 0.00 H new ATOM 0 HD2 PHE A 81 9.926 7.241 4.306 1.00 0.00 H new ATOM 0 HE1 PHE A 81 5.869 4.415 4.831 1.00 0.00 H new ATOM 0 HE2 PHE A 81 10.148 4.778 4.537 1.00 0.00 H new ATOM 0 HZ PHE A 81 8.120 3.361 4.773 1.00 0.00 H new ATOM 780 N ILE A 82 4.784 10.030 3.693 1.00 0.00 N ATOM 781 CA ILE A 82 3.328 10.118 3.784 1.00 0.00 C ATOM 782 C ILE A 82 2.724 10.278 2.388 1.00 0.00 C ATOM 783 O ILE A 82 1.939 9.428 1.973 1.00 0.00 O ATOM 784 CB ILE A 82 2.914 11.249 4.756 1.00 0.00 C ATOM 785 CG1 ILE A 82 3.075 10.826 6.235 1.00 0.00 C ATOM 786 CG2 ILE A 82 1.493 11.750 4.520 1.00 0.00 C ATOM 787 CD1 ILE A 82 2.023 9.831 6.743 1.00 0.00 C ATOM 0 H ILE A 82 5.265 10.788 4.177 1.00 0.00 H new ATOM 0 HA ILE A 82 2.929 9.192 4.198 1.00 0.00 H new ATOM 0 HB ILE A 82 3.596 12.072 4.545 1.00 0.00 H new ATOM 0 HG12 ILE A 82 4.063 10.385 6.366 1.00 0.00 H new ATOM 0 HG13 ILE A 82 3.040 11.719 6.859 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.263 12.542 5.233 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.408 12.139 3.505 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.790 10.927 4.653 1.00 0.00 H new ATOM 0 HD11 ILE A 82 2.220 9.596 7.789 1.00 0.00 H new ATOM 0 HD12 ILE A 82 1.031 10.272 6.651 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.070 8.917 6.150 1.00 0.00 H new ATOM 799 N ILE A 83 3.096 11.341 1.660 1.00 0.00 N ATOM 800 CA ILE A 83 2.510 11.650 0.345 1.00 0.00 C ATOM 801 C ILE A 83 2.680 10.478 -0.634 1.00 0.00 C ATOM 802 O ILE A 83 1.740 10.116 -1.346 1.00 0.00 O ATOM 803 CB ILE A 83 3.084 12.962 -0.237 1.00 0.00 C ATOM 804 CG1 ILE A 83 2.992 14.163 0.735 1.00 0.00 C ATOM 805 CG2 ILE A 83 2.377 13.292 -1.565 1.00 0.00 C ATOM 806 CD1 ILE A 83 1.571 14.500 1.211 1.00 0.00 C ATOM 0 H ILE A 83 3.807 12.007 1.962 1.00 0.00 H new ATOM 0 HA ILE A 83 1.440 11.801 0.492 1.00 0.00 H new ATOM 0 HB ILE A 83 4.147 12.793 -0.407 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.612 13.955 1.607 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.414 15.041 0.246 1.00 0.00 H new ATOM 0 HG21 ILE A 83 2.783 14.217 -1.973 1.00 0.00 H new ATOM 0 HG22 ILE A 83 2.538 12.481 -2.275 1.00 0.00 H new ATOM 0 HG23 ILE A 83 1.308 13.412 -1.388 1.00 0.00 H new ATOM 0 HD11 ILE A 83 1.607 15.354 1.887 1.00 0.00 H new ATOM 0 HD12 ILE A 83 0.948 14.744 0.351 1.00 0.00 H new ATOM 0 HD13 ILE A 83 1.149 13.641 1.733 1.00 0.00 H new ATOM 818 N ASN A 84 3.860 9.848 -0.623 1.00 0.00 N ATOM 819 CA ASN A 84 4.158 8.663 -1.417 1.00 0.00 C ATOM 820 C ASN A 84 3.237 7.488 -1.059 1.00 0.00 C ATOM 821 O ASN A 84 2.609 6.919 -1.954 1.00 0.00 O ATOM 822 CB ASN A 84 5.643 8.308 -1.243 1.00 0.00 C ATOM 823 CG ASN A 84 6.115 7.299 -2.279 1.00 0.00 C ATOM 824 OD1 ASN A 84 5.648 7.269 -3.404 1.00 0.00 O ATOM 825 ND2 ASN A 84 7.080 6.468 -1.945 1.00 0.00 N ATOM 0 H ASN A 84 4.645 10.157 -0.050 1.00 0.00 H new ATOM 0 HA ASN A 84 3.967 8.879 -2.468 1.00 0.00 H new ATOM 0 HB2 ASN A 84 6.243 9.214 -1.320 1.00 0.00 H new ATOM 0 HB3 ASN A 84 5.804 7.903 -0.244 1.00 0.00 H new ATOM 0 HD21 ASN A 84 7.436 5.799 -2.628 1.00 0.00 H new ATOM 0 HD22 ASN A 84 7.471 6.493 -1.003 1.00 0.00 H new ATOM 832 N GLN A 85 3.120 7.156 0.239 1.00 0.00 N ATOM 833 CA GLN A 85 2.188 6.133 0.724 1.00 0.00 C ATOM 834 C GLN A 85 0.757 6.401 0.253 1.00 0.00 C ATOM 835 O GLN A 85 0.119 5.475 -0.248 1.00 0.00 O ATOM 836 CB GLN A 85 2.238 6.023 2.260 1.00 0.00 C ATOM 837 CG GLN A 85 3.413 5.176 2.767 1.00 0.00 C ATOM 838 CD GLN A 85 3.308 3.710 2.352 1.00 0.00 C ATOM 839 OE1 GLN A 85 2.262 3.086 2.419 1.00 0.00 O ATOM 840 NE2 GLN A 85 4.396 3.103 1.923 1.00 0.00 N ATOM 0 H GLN A 85 3.671 7.592 0.978 1.00 0.00 H new ATOM 0 HA GLN A 85 2.505 5.181 0.298 1.00 0.00 H new ATOM 0 HB2 GLN A 85 2.308 7.023 2.687 1.00 0.00 H new ATOM 0 HB3 GLN A 85 1.304 5.589 2.617 1.00 0.00 H new ATOM 0 HG2 GLN A 85 4.346 5.591 2.385 1.00 0.00 H new ATOM 0 HG3 GLN A 85 3.458 5.239 3.854 1.00 0.00 H new ATOM 0 HE21 GLN A 85 5.276 3.615 1.863 1.00 0.00 H new ATOM 0 HE22 GLN A 85 4.358 2.121 1.651 1.00 0.00 H new ATOM 849 N VAL A 86 0.276 7.651 0.363 1.00 0.00 N ATOM 850 CA VAL A 86 -1.064 8.043 -0.102 1.00 0.00 C ATOM 851 C VAL A 86 -1.240 7.668 -1.576 1.00 0.00 C ATOM 852 O VAL A 86 -2.138 6.890 -1.894 1.00 0.00 O ATOM 853 CB VAL A 86 -1.367 9.546 0.105 1.00 0.00 C ATOM 854 CG1 VAL A 86 -2.846 9.858 -0.176 1.00 0.00 C ATOM 855 CG2 VAL A 86 -1.033 10.056 1.515 1.00 0.00 C ATOM 0 H VAL A 86 0.806 8.418 0.777 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.780 7.494 0.510 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.719 10.061 -0.605 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.029 10.921 -0.022 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.084 9.594 -1.206 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.475 9.280 0.501 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.272 11.117 1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.618 9.504 2.250 1.00 0.00 H new ATOM 0 HG23 VAL A 86 0.029 9.910 1.713 1.00 0.00 H new ATOM 865 N SER A 87 -0.388 8.202 -2.466 1.00 0.00 N ATOM 866 CA SER A 87 -0.497 7.960 -3.910 1.00 0.00 C ATOM 867 C SER A 87 -0.485 6.461 -4.233 1.00 0.00 C ATOM 868 O SER A 87 -1.425 5.968 -4.850 1.00 0.00 O ATOM 869 CB SER A 87 0.588 8.714 -4.689 1.00 0.00 C ATOM 870 OG SER A 87 0.177 8.825 -6.041 1.00 0.00 O ATOM 0 H SER A 87 0.389 8.809 -2.206 1.00 0.00 H new ATOM 0 HA SER A 87 -1.461 8.352 -4.234 1.00 0.00 H new ATOM 0 HB2 SER A 87 0.745 9.703 -4.259 1.00 0.00 H new ATOM 0 HB3 SER A 87 1.538 8.184 -4.624 1.00 0.00 H new ATOM 0 HG SER A 87 0.860 9.307 -6.552 1.00 0.00 H new ATOM 876 N LEU A 88 0.522 5.720 -3.747 1.00 0.00 N ATOM 877 CA LEU A 88 0.627 4.259 -3.884 1.00 0.00 C ATOM 878 C LEU A 88 -0.660 3.526 -3.470 1.00 0.00 C ATOM 879 O LEU A 88 -1.166 2.698 -4.232 1.00 0.00 O ATOM 880 CB LEU A 88 1.826 3.766 -3.054 1.00 0.00 C ATOM 881 CG LEU A 88 3.132 3.685 -3.870 1.00 0.00 C ATOM 882 CD1 LEU A 88 4.343 3.756 -2.936 1.00 0.00 C ATOM 883 CD2 LEU A 88 3.190 2.389 -4.699 1.00 0.00 C ATOM 0 H LEU A 88 1.304 6.129 -3.236 1.00 0.00 H new ATOM 0 HA LEU A 88 0.778 4.029 -4.939 1.00 0.00 H new ATOM 0 HB2 LEU A 88 1.974 4.436 -2.207 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.598 2.782 -2.646 1.00 0.00 H new ATOM 0 HG LEU A 88 3.153 4.532 -4.555 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.259 3.698 -3.523 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.324 4.697 -2.386 1.00 0.00 H new ATOM 0 HD13 LEU A 88 4.309 2.924 -2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.122 2.360 -5.264 1.00 0.00 H new ATOM 0 HD22 LEU A 88 3.143 1.528 -4.032 1.00 0.00 H new ATOM 0 HD23 LEU A 88 2.347 2.360 -5.389 1.00 0.00 H new ATOM 895 N PHE A 89 -1.204 3.840 -2.286 1.00 0.00 N ATOM 896 CA PHE A 89 -2.453 3.253 -1.792 1.00 0.00 C ATOM 897 C PHE A 89 -3.618 3.423 -2.773 1.00 0.00 C ATOM 898 O PHE A 89 -4.339 2.456 -3.036 1.00 0.00 O ATOM 899 CB PHE A 89 -2.816 3.833 -0.416 1.00 0.00 C ATOM 900 CG PHE A 89 -2.540 2.882 0.729 1.00 0.00 C ATOM 901 CD1 PHE A 89 -3.326 1.721 0.864 1.00 0.00 C ATOM 902 CD2 PHE A 89 -1.518 3.147 1.658 1.00 0.00 C ATOM 903 CE1 PHE A 89 -3.097 0.833 1.930 1.00 0.00 C ATOM 904 CE2 PHE A 89 -1.287 2.256 2.720 1.00 0.00 C ATOM 905 CZ PHE A 89 -2.081 1.105 2.861 1.00 0.00 C ATOM 0 H PHE A 89 -0.786 4.512 -1.642 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.279 2.182 -1.693 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.253 4.753 -0.258 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -3.873 4.100 -0.410 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -4.106 1.512 0.147 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.911 4.034 1.555 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.701 -0.056 2.033 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.498 2.456 3.429 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.910 0.429 3.686 1.00 0.00 H new ATOM 915 N LEU A 90 -3.785 4.630 -3.332 1.00 0.00 N ATOM 916 CA LEU A 90 -4.818 4.922 -4.332 1.00 0.00 C ATOM 917 C LEU A 90 -4.690 3.994 -5.554 1.00 0.00 C ATOM 918 O LEU A 90 -5.705 3.526 -6.074 1.00 0.00 O ATOM 919 CB LEU A 90 -4.734 6.395 -4.782 1.00 0.00 C ATOM 920 CG LEU A 90 -4.882 7.455 -3.669 1.00 0.00 C ATOM 921 CD1 LEU A 90 -4.259 8.800 -4.084 1.00 0.00 C ATOM 922 CD2 LEU A 90 -6.345 7.664 -3.274 1.00 0.00 C ATOM 0 H LEU A 90 -3.203 5.435 -3.101 1.00 0.00 H new ATOM 0 HA LEU A 90 -5.788 4.745 -3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.775 6.548 -5.277 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -5.509 6.570 -5.528 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.343 7.072 -2.803 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.382 9.522 -3.277 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.197 8.661 -4.289 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -4.756 9.170 -4.981 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.406 8.417 -2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.912 7.999 -4.143 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.761 6.725 -2.909 1.00 0.00 H new ATOM 934 N ILE A 91 -3.457 3.699 -5.993 1.00 0.00 N ATOM 935 CA ILE A 91 -3.195 2.805 -7.132 1.00 0.00 C ATOM 936 C ILE A 91 -3.596 1.367 -6.803 1.00 0.00 C ATOM 937 O ILE A 91 -4.322 0.753 -7.584 1.00 0.00 O ATOM 938 CB ILE A 91 -1.717 2.825 -7.587 1.00 0.00 C ATOM 939 CG1 ILE A 91 -1.089 4.228 -7.687 1.00 0.00 C ATOM 940 CG2 ILE A 91 -1.554 2.113 -8.945 1.00 0.00 C ATOM 941 CD1 ILE A 91 -1.948 5.292 -8.389 1.00 0.00 C ATOM 0 H ILE A 91 -2.610 4.075 -5.567 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.804 3.183 -7.953 1.00 0.00 H new ATOM 0 HB ILE A 91 -1.181 2.297 -6.798 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.861 4.577 -6.680 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.140 4.145 -8.217 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -0.507 2.139 -9.246 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.880 1.077 -8.854 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.160 2.619 -9.696 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.412 6.241 -8.404 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -2.155 4.976 -9.411 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.887 5.415 -7.850 1.00 0.00 H new ATOM 953 N ILE A 92 -3.135 0.836 -5.663 1.00 0.00 N ATOM 954 CA ILE A 92 -3.452 -0.530 -5.219 1.00 0.00 C ATOM 955 C ILE A 92 -4.971 -0.712 -5.179 1.00 0.00 C ATOM 956 O ILE A 92 -5.485 -1.686 -5.728 1.00 0.00 O ATOM 957 CB ILE A 92 -2.799 -0.838 -3.851 1.00 0.00 C ATOM 958 CG1 ILE A 92 -1.257 -0.741 -3.931 1.00 0.00 C ATOM 959 CG2 ILE A 92 -3.201 -2.237 -3.343 1.00 0.00 C ATOM 960 CD1 ILE A 92 -0.607 -0.414 -2.581 1.00 0.00 C ATOM 0 H ILE A 92 -2.529 1.344 -5.019 1.00 0.00 H new ATOM 0 HA ILE A 92 -3.037 -1.244 -5.931 1.00 0.00 H new ATOM 0 HB ILE A 92 -3.163 -0.089 -3.147 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -0.858 -1.685 -4.301 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -0.984 0.026 -4.655 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.726 -2.425 -2.380 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.284 -2.286 -3.230 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.877 -2.991 -4.060 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.475 -0.359 -2.702 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.981 0.544 -2.220 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.853 -1.194 -1.860 1.00 0.00 H new ATOM 972 N LEU A 93 -5.687 0.260 -4.596 1.00 0.00 N ATOM 973 CA LEU A 93 -7.144 0.318 -4.606 1.00 0.00 C ATOM 974 C LEU A 93 -7.709 0.336 -6.037 1.00 0.00 C ATOM 975 O LEU A 93 -8.547 -0.506 -6.347 1.00 0.00 O ATOM 976 CB LEU A 93 -7.600 1.516 -3.749 1.00 0.00 C ATOM 977 CG LEU A 93 -9.083 1.905 -3.904 1.00 0.00 C ATOM 978 CD1 LEU A 93 -10.020 0.777 -3.462 1.00 0.00 C ATOM 979 CD2 LEU A 93 -9.407 3.173 -3.103 1.00 0.00 C ATOM 0 H LEU A 93 -5.256 1.038 -4.097 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.552 -0.590 -4.161 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.408 1.287 -2.701 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.986 2.380 -4.004 1.00 0.00 H new ATOM 0 HG LEU A 93 -9.245 2.094 -4.965 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -11.055 1.094 -3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -9.835 -0.109 -4.070 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.837 0.542 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.460 3.425 -3.230 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.201 2.999 -2.047 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.791 3.997 -3.462 1.00 0.00 H new ATOM 991 N HIS A 94 -7.269 1.255 -6.906 1.00 0.00 N ATOM 992 CA HIS A 94 -7.750 1.367 -8.291 1.00 0.00 C ATOM 993 C HIS A 94 -7.566 0.060 -9.083 1.00 0.00 C ATOM 994 O HIS A 94 -8.533 -0.464 -9.642 1.00 0.00 O ATOM 995 CB HIS A 94 -7.048 2.553 -8.975 1.00 0.00 C ATOM 996 CG HIS A 94 -7.355 2.731 -10.445 1.00 0.00 C ATOM 997 ND1 HIS A 94 -6.497 3.278 -11.374 1.00 0.00 N ATOM 998 CD2 HIS A 94 -8.506 2.379 -11.107 1.00 0.00 C ATOM 999 CE1 HIS A 94 -7.114 3.247 -12.568 1.00 0.00 C ATOM 1000 NE2 HIS A 94 -8.328 2.693 -12.457 1.00 0.00 N ATOM 0 H HIS A 94 -6.562 1.949 -6.666 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.824 1.551 -8.271 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -7.324 3.468 -8.451 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -5.971 2.432 -8.859 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -9.388 1.940 -10.665 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -6.689 3.618 -13.489 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -8.994 2.531 -13.212 1.00 0.00 H new ATOM 1008 N SER A 95 -6.343 -0.481 -9.108 1.00 0.00 N ATOM 1009 CA SER A 95 -6.024 -1.731 -9.798 1.00 0.00 C ATOM 1010 C SER A 95 -6.818 -2.908 -9.229 1.00 0.00 C ATOM 1011 O SER A 95 -7.425 -3.655 -9.997 1.00 0.00 O ATOM 1012 CB SER A 95 -4.520 -2.010 -9.731 1.00 0.00 C ATOM 1013 OG SER A 95 -3.826 -1.083 -10.545 1.00 0.00 O ATOM 0 H SER A 95 -5.540 -0.057 -8.644 1.00 0.00 H new ATOM 0 HA SER A 95 -6.313 -1.616 -10.843 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.172 -1.936 -8.701 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.314 -3.027 -10.064 1.00 0.00 H new ATOM 0 HG SER A 95 -2.864 -1.263 -10.499 1.00 0.00 H new ATOM 1019 N ALA A 96 -6.851 -3.064 -7.896 1.00 0.00 N ATOM 1020 CA ALA A 96 -7.623 -4.122 -7.250 1.00 0.00 C ATOM 1021 C ALA A 96 -9.126 -3.998 -7.539 1.00 0.00 C ATOM 1022 O ALA A 96 -9.764 -5.014 -7.817 1.00 0.00 O ATOM 1023 CB ALA A 96 -7.344 -4.119 -5.744 1.00 0.00 C ATOM 0 H ALA A 96 -6.346 -2.462 -7.246 1.00 0.00 H new ATOM 0 HA ALA A 96 -7.306 -5.078 -7.668 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.922 -4.910 -5.265 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.282 -4.290 -5.570 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.630 -3.155 -5.323 1.00 0.00 H new ATOM 1029 N LEU A 97 -9.683 -2.779 -7.511 1.00 0.00 N ATOM 1030 CA LEU A 97 -11.075 -2.508 -7.872 1.00 0.00 C ATOM 1031 C LEU A 97 -11.373 -2.965 -9.293 1.00 0.00 C ATOM 1032 O LEU A 97 -12.246 -3.811 -9.472 1.00 0.00 O ATOM 1033 CB LEU A 97 -11.419 -1.013 -7.726 1.00 0.00 C ATOM 1034 CG LEU A 97 -11.914 -0.597 -6.334 1.00 0.00 C ATOM 1035 CD1 LEU A 97 -12.131 0.920 -6.331 1.00 0.00 C ATOM 1036 CD2 LEU A 97 -13.228 -1.296 -5.961 1.00 0.00 C ATOM 0 H LEU A 97 -9.168 -1.944 -7.232 1.00 0.00 H new ATOM 0 HA LEU A 97 -11.697 -3.075 -7.180 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -10.534 -0.426 -7.971 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -12.184 -0.758 -8.459 1.00 0.00 H new ATOM 0 HG LEU A 97 -11.164 -0.889 -5.599 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -12.483 1.235 -5.349 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -11.191 1.423 -6.558 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -12.874 1.183 -7.084 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -13.543 -0.973 -4.969 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -13.997 -1.036 -6.688 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -13.079 -2.376 -5.961 1.00 0.00 H new ATOM 1048 N TYR A 98 -10.665 -2.420 -10.290 1.00 0.00 N ATOM 1049 CA TYR A 98 -10.911 -2.751 -11.693 1.00 0.00 C ATOM 1050 C TYR A 98 -10.764 -4.260 -11.931 1.00 0.00 C ATOM 1051 O TYR A 98 -11.658 -4.884 -12.498 1.00 0.00 O ATOM 1052 CB TYR A 98 -9.995 -1.921 -12.610 1.00 0.00 C ATOM 1053 CG TYR A 98 -10.617 -1.593 -13.958 1.00 0.00 C ATOM 1054 CD1 TYR A 98 -10.837 -2.611 -14.905 1.00 0.00 C ATOM 1055 CD2 TYR A 98 -10.993 -0.268 -14.260 1.00 0.00 C ATOM 1056 CE1 TYR A 98 -11.447 -2.314 -16.140 1.00 0.00 C ATOM 1057 CE2 TYR A 98 -11.591 0.036 -15.498 1.00 0.00 C ATOM 1058 CZ TYR A 98 -11.827 -0.989 -16.438 1.00 0.00 C ATOM 1059 OH TYR A 98 -12.415 -0.698 -17.631 1.00 0.00 O ATOM 0 H TYR A 98 -9.914 -1.745 -10.146 1.00 0.00 H new ATOM 0 HA TYR A 98 -11.940 -2.490 -11.943 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.735 -0.991 -12.104 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -9.066 -2.467 -12.772 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -10.537 -3.625 -14.684 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.822 0.517 -13.539 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -11.624 -3.101 -16.858 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.869 1.054 -15.728 1.00 0.00 H new ATOM 0 HH TYR A 98 -12.613 0.261 -17.673 1.00 0.00 H new ATOM 1069 N PHE A 99 -9.679 -4.869 -11.436 1.00 0.00 N ATOM 1070 CA PHE A 99 -9.439 -6.308 -11.549 1.00 0.00 C ATOM 1071 C PHE A 99 -10.595 -7.146 -10.977 1.00 0.00 C ATOM 1072 O PHE A 99 -11.129 -8.023 -11.661 1.00 0.00 O ATOM 1073 CB PHE A 99 -8.113 -6.641 -10.859 1.00 0.00 C ATOM 1074 CG PHE A 99 -7.720 -8.094 -11.000 1.00 0.00 C ATOM 1075 CD1 PHE A 99 -7.237 -8.564 -12.235 1.00 0.00 C ATOM 1076 CD2 PHE A 99 -7.870 -8.981 -9.918 1.00 0.00 C ATOM 1077 CE1 PHE A 99 -6.895 -9.919 -12.387 1.00 0.00 C ATOM 1078 CE2 PHE A 99 -7.524 -10.336 -10.068 1.00 0.00 C ATOM 1079 CZ PHE A 99 -7.035 -10.803 -11.303 1.00 0.00 C ATOM 0 H PHE A 99 -8.939 -4.370 -10.942 1.00 0.00 H new ATOM 0 HA PHE A 99 -9.381 -6.568 -12.606 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -7.325 -6.015 -11.278 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -8.189 -6.392 -9.800 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.129 -7.883 -13.067 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -8.250 -8.622 -8.973 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -6.525 -10.280 -13.335 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -7.633 -11.017 -9.237 1.00 0.00 H new ATOM 0 HZ PHE A 99 -6.767 -11.843 -11.418 1.00 0.00 H new ATOM 1089 N LYS A 100 -11.014 -6.859 -9.734 1.00 0.00 N ATOM 1090 CA LYS A 100 -12.151 -7.530 -9.092 1.00 0.00 C ATOM 1091 C LYS A 100 -13.463 -7.267 -9.830 1.00 0.00 C ATOM 1092 O LYS A 100 -14.233 -8.199 -10.026 1.00 0.00 O ATOM 1093 CB LYS A 100 -12.266 -7.105 -7.623 1.00 0.00 C ATOM 1094 CG LYS A 100 -11.118 -7.666 -6.767 1.00 0.00 C ATOM 1095 CD LYS A 100 -11.090 -6.984 -5.393 1.00 0.00 C ATOM 1096 CE LYS A 100 -9.753 -7.252 -4.695 1.00 0.00 C ATOM 1097 NZ LYS A 100 -9.736 -6.702 -3.317 1.00 0.00 N ATOM 0 H LYS A 100 -10.571 -6.153 -9.146 1.00 0.00 H new ATOM 0 HA LYS A 100 -11.963 -8.603 -9.137 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -12.266 -6.017 -7.560 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -13.219 -7.448 -7.220 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -11.241 -8.742 -6.643 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -10.167 -7.510 -7.276 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -11.239 -5.910 -5.509 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -11.910 -7.355 -4.778 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -9.569 -8.326 -4.661 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -8.944 -6.808 -5.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -8.816 -6.902 -2.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -9.887 -5.674 -3.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -10.493 -7.145 -2.757 1.00 0.00 H new ATOM 1111 N TYR A 101 -13.704 -6.035 -10.282 1.00 0.00 N ATOM 1112 CA TYR A 101 -14.889 -5.671 -11.058 1.00 0.00 C ATOM 1113 C TYR A 101 -14.982 -6.466 -12.372 1.00 0.00 C ATOM 1114 O TYR A 101 -16.069 -6.893 -12.759 1.00 0.00 O ATOM 1115 CB TYR A 101 -14.869 -4.159 -11.312 1.00 0.00 C ATOM 1116 CG TYR A 101 -16.130 -3.629 -11.961 1.00 0.00 C ATOM 1117 CD1 TYR A 101 -16.243 -3.603 -13.364 1.00 0.00 C ATOM 1118 CD2 TYR A 101 -17.194 -3.178 -11.156 1.00 0.00 C ATOM 1119 CE1 TYR A 101 -17.422 -3.125 -13.965 1.00 0.00 C ATOM 1120 CE2 TYR A 101 -18.370 -2.686 -11.753 1.00 0.00 C ATOM 1121 CZ TYR A 101 -18.484 -2.660 -13.162 1.00 0.00 C ATOM 1122 OH TYR A 101 -19.603 -2.168 -13.755 1.00 0.00 O ATOM 0 H TYR A 101 -13.072 -5.252 -10.117 1.00 0.00 H new ATOM 0 HA TYR A 101 -15.781 -5.929 -10.486 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -14.716 -3.643 -10.364 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -14.017 -3.918 -11.947 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -15.425 -3.950 -13.979 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.108 -3.210 -10.080 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -17.514 -3.114 -15.041 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -19.182 -2.330 -11.137 1.00 0.00 H new ATOM 0 HH TYR A 101 -20.243 -1.889 -13.067 1.00 0.00 H new ATOM 1132 N LEU A 102 -13.842 -6.716 -13.030 1.00 0.00 N ATOM 1133 CA LEU A 102 -13.771 -7.572 -14.212 1.00 0.00 C ATOM 1134 C LEU A 102 -14.048 -9.043 -13.868 1.00 0.00 C ATOM 1135 O LEU A 102 -14.907 -9.661 -14.501 1.00 0.00 O ATOM 1136 CB LEU A 102 -12.407 -7.404 -14.906 1.00 0.00 C ATOM 1137 CG LEU A 102 -12.189 -6.034 -15.580 1.00 0.00 C ATOM 1138 CD1 LEU A 102 -10.793 -6.024 -16.217 1.00 0.00 C ATOM 1139 CD2 LEU A 102 -13.275 -5.713 -16.614 1.00 0.00 C ATOM 0 H LEU A 102 -12.941 -6.326 -12.752 1.00 0.00 H new ATOM 0 HA LEU A 102 -14.553 -7.259 -14.905 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -11.619 -7.560 -14.170 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -12.300 -8.185 -15.659 1.00 0.00 H new ATOM 0 HG LEU A 102 -12.259 -5.253 -14.823 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -10.620 -5.062 -16.699 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.040 -6.184 -15.445 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.726 -6.819 -16.959 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -13.076 -4.738 -17.060 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -13.273 -6.476 -17.393 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -14.249 -5.697 -16.125 1.00 0.00 H new ATOM 1151 N LEU A 103 -13.350 -9.611 -12.870 1.00 0.00 N ATOM 1152 CA LEU A 103 -13.552 -11.011 -12.463 1.00 0.00 C ATOM 1153 C LEU A 103 -14.975 -11.258 -11.912 1.00 0.00 C ATOM 1154 O LEU A 103 -15.528 -12.339 -12.102 1.00 0.00 O ATOM 1155 CB LEU A 103 -12.408 -11.472 -11.522 1.00 0.00 C ATOM 1156 CG LEU A 103 -12.742 -11.482 -10.013 1.00 0.00 C ATOM 1157 CD1 LEU A 103 -13.412 -12.802 -9.585 1.00 0.00 C ATOM 1158 CD2 LEU A 103 -11.506 -11.243 -9.137 1.00 0.00 C ATOM 0 H LEU A 103 -12.639 -9.120 -12.329 1.00 0.00 H new ATOM 0 HA LEU A 103 -13.493 -11.647 -13.346 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.105 -12.477 -11.815 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.548 -10.821 -11.680 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.439 -10.658 -9.862 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -13.631 -12.770 -8.518 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -14.339 -12.937 -10.142 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -12.740 -13.635 -9.792 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.796 -11.260 -8.086 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -10.771 -12.026 -9.323 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -11.071 -10.273 -9.378 1.00 0.00 H new ATOM 1170 N SER A 104 -15.587 -10.253 -11.271 1.00 0.00 N ATOM 1171 CA SER A 104 -16.931 -10.323 -10.695 1.00 0.00 C ATOM 1172 C SER A 104 -17.943 -10.811 -11.725 1.00 0.00 C ATOM 1173 O SER A 104 -18.696 -11.736 -11.436 1.00 0.00 O ATOM 1174 CB SER A 104 -17.352 -8.960 -10.125 1.00 0.00 C ATOM 1175 OG SER A 104 -18.757 -8.892 -9.940 1.00 0.00 O ATOM 0 H SER A 104 -15.145 -9.344 -11.137 1.00 0.00 H new ATOM 0 HA SER A 104 -16.908 -11.043 -9.877 1.00 0.00 H new ATOM 0 HB2 SER A 104 -16.849 -8.790 -9.173 1.00 0.00 H new ATOM 0 HB3 SER A 104 -17.033 -8.166 -10.800 1.00 0.00 H new ATOM 0 HG SER A 104 -18.997 -8.015 -9.575 1.00 0.00 H new ATOM 1181 N ASN A 105 -17.945 -10.224 -12.927 1.00 0.00 N ATOM 1182 CA ASN A 105 -18.892 -10.592 -13.973 1.00 0.00 C ATOM 1183 C ASN A 105 -18.734 -12.054 -14.422 1.00 0.00 C ATOM 1184 O ASN A 105 -19.740 -12.746 -14.584 1.00 0.00 O ATOM 1185 CB ASN A 105 -18.742 -9.607 -15.141 1.00 0.00 C ATOM 1186 CG ASN A 105 -20.014 -9.517 -15.965 1.00 0.00 C ATOM 1187 OD1 ASN A 105 -20.067 -9.920 -17.113 1.00 0.00 O ATOM 1188 ND2 ASN A 105 -21.066 -8.951 -15.408 1.00 0.00 N ATOM 0 H ASN A 105 -17.294 -9.487 -13.196 1.00 0.00 H new ATOM 0 HA ASN A 105 -19.904 -10.524 -13.574 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -18.488 -8.620 -14.755 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -17.916 -9.922 -15.779 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -21.931 -8.848 -15.939 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -21.015 -8.616 -14.446 1.00 0.00 H new ATOM 1195 N TYR A 106 -17.485 -12.533 -14.544 1.00 0.00 N ATOM 1196 CA TYR A 106 -17.155 -13.930 -14.854 1.00 0.00 C ATOM 1197 C TYR A 106 -17.738 -14.929 -13.839 1.00 0.00 C ATOM 1198 O TYR A 106 -18.025 -16.070 -14.206 1.00 0.00 O ATOM 1199 CB TYR A 106 -15.627 -14.107 -14.944 1.00 0.00 C ATOM 1200 CG TYR A 106 -15.001 -13.668 -16.252 1.00 0.00 C ATOM 1201 CD1 TYR A 106 -15.180 -14.471 -17.394 1.00 0.00 C ATOM 1202 CD2 TYR A 106 -14.203 -12.508 -16.326 1.00 0.00 C ATOM 1203 CE1 TYR A 106 -14.562 -14.120 -18.607 1.00 0.00 C ATOM 1204 CE2 TYR A 106 -13.567 -12.160 -17.535 1.00 0.00 C ATOM 1205 CZ TYR A 106 -13.747 -12.973 -18.677 1.00 0.00 C ATOM 1206 OH TYR A 106 -13.112 -12.685 -19.845 1.00 0.00 O ATOM 0 H TYR A 106 -16.660 -11.945 -14.427 1.00 0.00 H new ATOM 0 HA TYR A 106 -17.615 -14.152 -15.817 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -15.164 -13.546 -14.132 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -15.389 -15.158 -14.781 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -15.793 -15.358 -17.338 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -14.079 -11.884 -15.453 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -14.712 -14.730 -19.486 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -12.946 -11.278 -17.588 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.588 -11.864 -19.739 1.00 0.00 H new ATOM 1216 N SER A 107 -17.948 -14.511 -12.584 1.00 0.00 N ATOM 1217 CA SER A 107 -18.513 -15.349 -11.525 1.00 0.00 C ATOM 1218 C SER A 107 -19.639 -14.627 -10.771 1.00 0.00 C ATOM 1219 O SER A 107 -19.610 -14.519 -9.544 1.00 0.00 O ATOM 1220 CB SER A 107 -17.390 -15.856 -10.614 1.00 0.00 C ATOM 1221 OG SER A 107 -17.834 -16.994 -9.900 1.00 0.00 O ATOM 0 H SER A 107 -17.726 -13.565 -12.274 1.00 0.00 H new ATOM 0 HA SER A 107 -18.987 -16.224 -11.970 1.00 0.00 H new ATOM 0 HB2 SER A 107 -16.512 -16.107 -11.208 1.00 0.00 H new ATOM 0 HB3 SER A 107 -17.091 -15.072 -9.918 1.00 0.00 H new ATOM 0 HG SER A 107 -17.114 -17.317 -9.319 1.00 0.00 H new ATOM 1227 N SER A 108 -20.644 -14.153 -11.522 1.00 0.00 N ATOM 1228 CA SER A 108 -21.829 -13.483 -10.977 1.00 0.00 C ATOM 1229 C SER A 108 -23.055 -14.402 -11.019 1.00 0.00 C ATOM 1230 O SER A 108 -23.236 -15.168 -11.974 1.00 0.00 O ATOM 1231 CB SER A 108 -22.074 -12.139 -11.684 1.00 0.00 C ATOM 1232 OG SER A 108 -22.873 -12.246 -12.847 1.00 0.00 O ATOM 0 H SER A 108 -20.654 -14.226 -12.539 1.00 0.00 H new ATOM 0 HA SER A 108 -21.644 -13.259 -9.926 1.00 0.00 H new ATOM 0 HB2 SER A 108 -22.554 -11.453 -10.986 1.00 0.00 H new ATOM 0 HB3 SER A 108 -21.113 -11.699 -11.953 1.00 0.00 H new ATOM 0 HG SER A 108 -22.991 -11.359 -13.246 1.00 0.00 H new ATOM 1238 N VAL A 109 -23.871 -14.326 -9.956 1.00 0.00 N ATOM 1239 CA VAL A 109 -25.103 -15.095 -9.739 1.00 0.00 C ATOM 1240 C VAL A 109 -26.083 -14.296 -8.860 1.00 0.00 C ATOM 1241 O VAL A 109 -25.856 -14.121 -7.662 1.00 0.00 O ATOM 1242 CB VAL A 109 -24.834 -16.493 -9.126 1.00 0.00 C ATOM 1243 CG1 VAL A 109 -24.323 -17.488 -10.182 1.00 0.00 C ATOM 1244 CG2 VAL A 109 -23.855 -16.507 -7.935 1.00 0.00 C ATOM 0 H VAL A 109 -23.676 -13.690 -9.183 1.00 0.00 H new ATOM 0 HA VAL A 109 -25.553 -15.263 -10.718 1.00 0.00 H new ATOM 0 HB VAL A 109 -25.810 -16.795 -8.746 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -24.146 -18.456 -9.714 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -25.068 -17.597 -10.970 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -23.392 -17.117 -10.611 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -23.732 -17.529 -7.577 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -22.889 -16.116 -8.254 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -24.251 -15.886 -7.131 1.00 0.00 H new ATOM 1254 N THR A 110 -27.153 -13.771 -9.469 1.00 0.00 N ATOM 1255 CA THR A 110 -28.234 -13.046 -8.775 1.00 0.00 C ATOM 1256 C THR A 110 -28.979 -13.873 -7.718 1.00 0.00 C ATOM 1257 O THR A 110 -29.467 -13.212 -6.770 1.00 0.00 O ATOM 1258 CB THR A 110 -29.230 -12.448 -9.773 1.00 0.00 C ATOM 1259 OG1 THR A 110 -30.117 -11.629 -9.051 1.00 0.00 O ATOM 1260 CG2 THR A 110 -30.045 -13.487 -10.552 1.00 0.00 C ATOM 0 H THR A 110 -27.298 -13.837 -10.476 1.00 0.00 H new ATOM 0 HA THR A 110 -27.730 -12.246 -8.233 1.00 0.00 H new ATOM 0 HB THR A 110 -28.651 -11.899 -10.516 1.00 0.00 H new ATOM 0 HG1 THR A 110 -30.110 -11.892 -8.107 1.00 0.00 H new ATOM 0 HG21 THR A 110 -30.725 -12.978 -11.236 1.00 0.00 H new ATOM 0 HG22 THR A 110 -29.370 -14.127 -11.121 1.00 0.00 H new ATOM 0 HG23 THR A 110 -30.620 -14.096 -9.854 1.00 0.00 H new TER 1268 THR A 110