USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 783 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 HIS : no HE2:sc= -0.633 K(o=-0.63,f=-2.9) USER MOD Single : A 1 HIS N :NH3+ 158:sc=-0.00082 (180deg=-0.694) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 92:sc= 0.0124 USER MOD Single : A 30 MET CE :methyl -148:sc= -0.0794 (180deg=-0.576) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 GLN : amide:sc= -0.151 K(o=-0.15,f=-1.1) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 51:sc= 0.268 USER MOD Single : A 57 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 59 THR OG1 : rot 49:sc= 0.68 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.0426 K(o=-0.043,f=-1.5!) USER MOD Single : A 74 GLN : amide:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.18 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl -135:sc= -0.105 (180deg=-1.1) USER MOD Single : A 88 THR OG1 : rot -103:sc= -0.489 USER MOD Single : A 92 GLN : amide:sc= -0.197 K(o=-0.2,f=-1.5) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 MET CE :methyl -148:sc= -0.456 (180deg=-2.01) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 MET CE :methyl -123:sc= -0.117 (180deg=-0.795) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 GLN : amide:sc= -0.165 K(o=-0.17,f=-2.1!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 -3.228 38.057 -23.276 1.00 0.00 N ATOM 2 CA HIS A 1 -3.047 39.040 -24.385 1.00 0.00 C ATOM 3 C HIS A 1 -1.704 38.810 -25.085 1.00 0.00 C ATOM 4 O HIS A 1 -1.049 39.741 -25.509 1.00 0.00 O ATOM 5 CB HIS A 1 -3.078 40.415 -23.709 1.00 0.00 C ATOM 6 CG HIS A 1 -1.968 40.510 -22.697 1.00 0.00 C ATOM 7 ND1 HIS A 1 -0.663 40.809 -23.057 1.00 0.00 N ATOM 8 CD2 HIS A 1 -1.952 40.349 -21.335 1.00 0.00 C ATOM 9 CE1 HIS A 1 0.076 40.818 -21.934 1.00 0.00 C ATOM 10 NE2 HIS A 1 -0.661 40.545 -20.854 1.00 0.00 N ATOM 0 H1 HIS A 1 -3.918 38.429 -22.592 1.00 0.00 H new ATOM 0 H2 HIS A 1 -3.575 37.157 -23.663 1.00 0.00 H new ATOM 0 H3 HIS A 1 -2.317 37.900 -22.799 1.00 0.00 H new ATOM 0 HA HIS A 1 -3.819 38.947 -25.149 1.00 0.00 H new ATOM 0 HB2 HIS A 1 -2.969 41.201 -24.457 1.00 0.00 H new ATOM 0 HB3 HIS A 1 -4.041 40.570 -23.222 1.00 0.00 H new ATOM 0 HD1 HIS A 1 -0.325 40.989 -24.002 1.00 0.00 H new ATOM 0 HD2 HIS A 1 -2.812 40.107 -20.728 1.00 0.00 H new ATOM 0 HE1 HIS A 1 1.136 41.021 -21.908 1.00 0.00 H new ATOM 18 N MET A 2 -1.292 37.576 -25.206 1.00 0.00 N ATOM 19 CA MET A 2 0.010 37.285 -25.877 1.00 0.00 C ATOM 20 C MET A 2 -0.171 37.269 -27.396 1.00 0.00 C ATOM 21 O MET A 2 -1.236 37.555 -27.908 1.00 0.00 O ATOM 22 CB MET A 2 0.419 35.898 -25.373 1.00 0.00 C ATOM 23 CG MET A 2 1.624 36.026 -24.439 1.00 0.00 C ATOM 24 SD MET A 2 2.634 34.527 -24.543 1.00 0.00 S ATOM 25 CE MET A 2 3.926 35.197 -25.619 1.00 0.00 C ATOM 0 H MET A 2 -1.799 36.758 -24.870 1.00 0.00 H new ATOM 0 HA MET A 2 0.765 38.038 -25.653 1.00 0.00 H new ATOM 0 HB2 MET A 2 -0.414 35.431 -24.847 1.00 0.00 H new ATOM 0 HB3 MET A 2 0.666 35.252 -26.216 1.00 0.00 H new ATOM 0 HG2 MET A 2 2.219 36.897 -24.713 1.00 0.00 H new ATOM 0 HG3 MET A 2 1.288 36.180 -23.414 1.00 0.00 H new ATOM 0 HE1 MET A 2 4.670 34.426 -25.817 1.00 0.00 H new ATOM 0 HE2 MET A 2 3.483 35.524 -26.560 1.00 0.00 H new ATOM 0 HE3 MET A 2 4.404 36.045 -25.129 1.00 0.00 H new ATOM 35 N LEU A 3 0.861 36.924 -28.117 1.00 0.00 N ATOM 36 CA LEU A 3 0.754 36.872 -29.602 1.00 0.00 C ATOM 37 C LEU A 3 0.854 35.421 -30.069 1.00 0.00 C ATOM 38 O LEU A 3 1.271 35.139 -31.177 1.00 0.00 O ATOM 39 CB LEU A 3 1.943 37.688 -30.114 1.00 0.00 C ATOM 40 CG LEU A 3 1.489 39.117 -30.418 1.00 0.00 C ATOM 41 CD1 LEU A 3 1.254 39.868 -29.105 1.00 0.00 C ATOM 42 CD2 LEU A 3 2.571 39.833 -31.228 1.00 0.00 C ATOM 0 H LEU A 3 1.776 36.675 -27.740 1.00 0.00 H new ATOM 0 HA LEU A 3 -0.192 37.267 -29.971 1.00 0.00 H new ATOM 0 HB2 LEU A 3 2.738 37.699 -29.369 1.00 0.00 H new ATOM 0 HB3 LEU A 3 2.354 37.227 -31.012 1.00 0.00 H new ATOM 0 HG LEU A 3 0.563 39.090 -30.992 1.00 0.00 H new ATOM 0 HD11 LEU A 3 0.931 40.886 -29.321 1.00 0.00 H new ATOM 0 HD12 LEU A 3 0.484 39.358 -28.527 1.00 0.00 H new ATOM 0 HD13 LEU A 3 2.180 39.896 -28.531 1.00 0.00 H new ATOM 0 HD21 LEU A 3 2.249 40.851 -31.445 1.00 0.00 H new ATOM 0 HD22 LEU A 3 3.497 39.860 -30.654 1.00 0.00 H new ATOM 0 HD23 LEU A 3 2.739 39.298 -32.163 1.00 0.00 H new ATOM 54 N GLY A 4 0.479 34.497 -29.225 1.00 0.00 N ATOM 55 CA GLY A 4 0.552 33.060 -29.602 1.00 0.00 C ATOM 56 C GLY A 4 -0.831 32.571 -30.038 1.00 0.00 C ATOM 57 O GLY A 4 -1.493 33.193 -30.847 1.00 0.00 O ATOM 0 H GLY A 4 0.124 34.679 -28.286 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.269 32.922 -30.411 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.908 32.470 -28.757 1.00 0.00 H new ATOM 61 N LEU A 5 -1.272 31.462 -29.508 1.00 0.00 N ATOM 62 CA LEU A 5 -2.612 30.931 -29.889 1.00 0.00 C ATOM 63 C LEU A 5 -3.572 31.018 -28.699 1.00 0.00 C ATOM 64 O LEU A 5 -4.769 31.151 -28.862 1.00 0.00 O ATOM 65 CB LEU A 5 -2.365 29.471 -30.273 1.00 0.00 C ATOM 66 CG LEU A 5 -2.104 29.377 -31.778 1.00 0.00 C ATOM 67 CD1 LEU A 5 -0.602 29.481 -32.045 1.00 0.00 C ATOM 68 CD2 LEU A 5 -2.622 28.035 -32.300 1.00 0.00 C ATOM 0 H LEU A 5 -0.761 30.900 -28.827 1.00 0.00 H new ATOM 0 HA LEU A 5 -3.064 31.496 -30.704 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -1.512 29.078 -29.720 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -3.228 28.862 -30.004 1.00 0.00 H new ATOM 0 HG LEU A 5 -2.619 30.191 -32.287 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -0.418 29.414 -33.117 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -0.231 30.436 -31.672 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -0.085 28.667 -31.536 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -2.437 27.966 -33.372 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -2.106 27.222 -31.789 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -3.693 27.960 -32.111 1.00 0.00 H new ATOM 80 N GLY A 6 -3.052 30.943 -27.502 1.00 0.00 N ATOM 81 CA GLY A 6 -3.928 31.021 -26.299 1.00 0.00 C ATOM 82 C GLY A 6 -3.090 31.426 -25.085 1.00 0.00 C ATOM 83 O GLY A 6 -2.112 30.785 -24.753 1.00 0.00 O ATOM 0 H GLY A 6 -2.057 30.831 -27.307 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -4.725 31.746 -26.463 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -4.405 30.058 -26.120 1.00 0.00 H new ATOM 87 N ALA A 7 -3.464 32.488 -24.421 1.00 0.00 N ATOM 88 CA ALA A 7 -2.686 32.938 -23.229 1.00 0.00 C ATOM 89 C ALA A 7 -3.349 32.439 -21.942 1.00 0.00 C ATOM 90 O ALA A 7 -3.262 33.069 -20.906 1.00 0.00 O ATOM 91 CB ALA A 7 -2.716 34.465 -23.290 1.00 0.00 C ATOM 0 H ALA A 7 -4.274 33.063 -24.652 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.668 32.549 -23.231 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -2.163 34.874 -22.444 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -2.257 34.801 -24.220 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -3.749 34.811 -23.250 1.00 0.00 H new ATOM 97 N SER A 8 -4.007 31.313 -21.999 1.00 0.00 N ATOM 98 CA SER A 8 -4.675 30.774 -20.778 1.00 0.00 C ATOM 99 C SER A 8 -4.582 29.246 -20.751 1.00 0.00 C ATOM 100 O SER A 8 -5.413 28.576 -20.170 1.00 0.00 O ATOM 101 CB SER A 8 -6.132 31.219 -20.893 1.00 0.00 C ATOM 102 OG SER A 8 -6.739 30.557 -21.994 1.00 0.00 O ATOM 0 H SER A 8 -4.111 30.742 -22.838 1.00 0.00 H new ATOM 0 HA SER A 8 -4.209 31.136 -19.861 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.669 30.987 -19.973 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.185 32.299 -21.029 1.00 0.00 H new ATOM 0 HG SER A 8 -7.675 30.839 -22.070 1.00 0.00 H new ATOM 108 N ASP A 9 -3.579 28.691 -21.376 1.00 0.00 N ATOM 109 CA ASP A 9 -3.432 27.206 -21.388 1.00 0.00 C ATOM 110 C ASP A 9 -2.443 26.755 -20.307 1.00 0.00 C ATOM 111 O ASP A 9 -2.370 25.589 -19.970 1.00 0.00 O ATOM 112 CB ASP A 9 -2.893 26.873 -22.780 1.00 0.00 C ATOM 113 CG ASP A 9 -3.577 25.609 -23.305 1.00 0.00 C ATOM 114 OD1 ASP A 9 -3.284 24.543 -22.789 1.00 0.00 O ATOM 115 OD2 ASP A 9 -4.383 25.728 -24.214 1.00 0.00 O ATOM 0 H ASP A 9 -2.854 29.202 -21.880 1.00 0.00 H new ATOM 0 HA ASP A 9 -4.375 26.699 -21.181 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -3.073 27.706 -23.460 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -1.814 26.724 -22.737 1.00 0.00 H new ATOM 120 N PHE A 10 -1.681 27.667 -19.759 1.00 0.00 N ATOM 121 CA PHE A 10 -0.700 27.285 -18.702 1.00 0.00 C ATOM 122 C PHE A 10 -1.415 27.087 -17.362 1.00 0.00 C ATOM 123 O PHE A 10 -1.416 27.958 -16.515 1.00 0.00 O ATOM 124 CB PHE A 10 0.275 28.461 -18.617 1.00 0.00 C ATOM 125 CG PHE A 10 0.972 28.639 -19.945 1.00 0.00 C ATOM 126 CD1 PHE A 10 1.742 27.597 -20.478 1.00 0.00 C ATOM 127 CD2 PHE A 10 0.850 29.846 -20.643 1.00 0.00 C ATOM 128 CE1 PHE A 10 2.387 27.763 -21.709 1.00 0.00 C ATOM 129 CE2 PHE A 10 1.497 30.012 -21.874 1.00 0.00 C ATOM 130 CZ PHE A 10 2.265 28.970 -22.407 1.00 0.00 C ATOM 0 H PHE A 10 -1.697 28.658 -19.998 1.00 0.00 H new ATOM 0 HA PHE A 10 -0.191 26.349 -18.934 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.261 29.372 -18.351 1.00 0.00 H new ATOM 0 HB3 PHE A 10 1.009 28.282 -17.831 1.00 0.00 H new ATOM 0 HD1 PHE A 10 1.838 26.666 -19.939 1.00 0.00 H new ATOM 0 HD2 PHE A 10 0.257 30.650 -20.232 1.00 0.00 H new ATOM 0 HE1 PHE A 10 2.979 26.959 -22.121 1.00 0.00 H new ATOM 0 HE2 PHE A 10 1.403 30.944 -22.412 1.00 0.00 H new ATOM 0 HZ PHE A 10 2.763 29.097 -23.357 1.00 0.00 H new ATOM 140 N GLU A 11 -2.024 25.948 -17.166 1.00 0.00 N ATOM 141 CA GLU A 11 -2.739 25.694 -15.880 1.00 0.00 C ATOM 142 C GLU A 11 -3.041 24.201 -15.720 1.00 0.00 C ATOM 143 O GLU A 11 -4.062 23.820 -15.182 1.00 0.00 O ATOM 144 CB GLU A 11 -4.038 26.499 -15.981 1.00 0.00 C ATOM 145 CG GLU A 11 -4.838 26.038 -17.201 1.00 0.00 C ATOM 146 CD GLU A 11 -6.179 26.774 -17.240 1.00 0.00 C ATOM 147 OE1 GLU A 11 -6.868 26.763 -16.233 1.00 0.00 O ATOM 148 OE2 GLU A 11 -6.493 27.339 -18.275 1.00 0.00 O ATOM 0 H GLU A 11 -2.058 25.183 -17.840 1.00 0.00 H new ATOM 0 HA GLU A 11 -2.144 25.987 -15.015 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.630 26.367 -15.075 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -3.813 27.562 -16.063 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -4.276 26.236 -18.114 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -5.003 24.962 -17.155 1.00 0.00 H new ATOM 155 N PHE A 12 -2.159 23.354 -16.183 1.00 0.00 N ATOM 156 CA PHE A 12 -2.394 21.885 -16.057 1.00 0.00 C ATOM 157 C PHE A 12 -1.131 21.112 -16.444 1.00 0.00 C ATOM 158 O PHE A 12 -0.737 20.174 -15.778 1.00 0.00 O ATOM 159 CB PHE A 12 -3.531 21.577 -17.032 1.00 0.00 C ATOM 160 CG PHE A 12 -4.018 20.165 -16.809 1.00 0.00 C ATOM 161 CD1 PHE A 12 -4.608 19.813 -15.589 1.00 0.00 C ATOM 162 CD2 PHE A 12 -3.878 19.208 -17.821 1.00 0.00 C ATOM 163 CE1 PHE A 12 -5.060 18.505 -15.381 1.00 0.00 C ATOM 164 CE2 PHE A 12 -4.330 17.898 -17.613 1.00 0.00 C ATOM 165 CZ PHE A 12 -4.922 17.547 -16.393 1.00 0.00 C ATOM 0 H PHE A 12 -1.287 23.616 -16.643 1.00 0.00 H new ATOM 0 HA PHE A 12 -2.644 21.595 -15.037 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -4.349 22.282 -16.887 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -3.186 21.696 -18.059 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -4.714 20.551 -14.808 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -3.422 19.479 -18.762 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -5.515 18.234 -14.440 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -4.222 17.159 -18.393 1.00 0.00 H new ATOM 0 HZ PHE A 12 -5.272 16.538 -16.233 1.00 0.00 H new ATOM 175 N GLY A 13 -0.497 21.499 -17.518 1.00 0.00 N ATOM 176 CA GLY A 13 0.741 20.788 -17.952 1.00 0.00 C ATOM 177 C GLY A 13 1.971 21.458 -17.332 1.00 0.00 C ATOM 178 O GLY A 13 3.051 20.898 -17.320 1.00 0.00 O ATOM 0 H GLY A 13 -0.782 22.276 -18.114 1.00 0.00 H new ATOM 0 HA2 GLY A 13 0.695 19.742 -17.650 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.817 20.803 -19.039 1.00 0.00 H new ATOM 182 N VAL A 14 1.822 22.650 -16.817 1.00 0.00 N ATOM 183 CA VAL A 14 2.987 23.351 -16.200 1.00 0.00 C ATOM 184 C VAL A 14 3.223 22.830 -14.780 1.00 0.00 C ATOM 185 O VAL A 14 4.273 22.298 -14.471 1.00 0.00 O ATOM 186 CB VAL A 14 2.592 24.829 -16.173 1.00 0.00 C ATOM 187 CG1 VAL A 14 3.721 25.650 -15.546 1.00 0.00 C ATOM 188 CG2 VAL A 14 2.345 25.316 -17.603 1.00 0.00 C ATOM 0 H VAL A 14 0.944 23.169 -16.797 1.00 0.00 H new ATOM 0 HA VAL A 14 3.910 23.188 -16.756 1.00 0.00 H new ATOM 0 HB VAL A 14 1.684 24.950 -15.583 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.438 26.703 -15.527 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.900 25.304 -14.528 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.630 25.529 -16.136 1.00 0.00 H new ATOM 0 HG21 VAL A 14 2.063 26.369 -17.585 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.254 25.193 -18.191 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.541 24.733 -18.052 1.00 0.00 H new ATOM 198 N ASP A 15 2.256 22.978 -13.914 1.00 0.00 N ATOM 199 CA ASP A 15 2.425 22.492 -12.515 1.00 0.00 C ATOM 200 C ASP A 15 1.062 22.138 -11.908 1.00 0.00 C ATOM 201 O ASP A 15 0.045 22.652 -12.329 1.00 0.00 O ATOM 202 CB ASP A 15 3.059 23.663 -11.763 1.00 0.00 C ATOM 203 CG ASP A 15 4.519 23.815 -12.193 1.00 0.00 C ATOM 204 OD1 ASP A 15 5.245 22.838 -12.110 1.00 0.00 O ATOM 205 OD2 ASP A 15 4.886 24.906 -12.598 1.00 0.00 O ATOM 0 H ASP A 15 1.357 23.415 -14.116 1.00 0.00 H new ATOM 0 HA ASP A 15 3.039 21.593 -12.462 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.510 24.582 -11.970 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.001 23.493 -10.688 1.00 0.00 H new ATOM 210 N PRO A 16 1.087 21.265 -10.932 1.00 0.00 N ATOM 211 CA PRO A 16 -0.168 20.839 -10.263 1.00 0.00 C ATOM 212 C PRO A 16 -0.732 21.977 -9.407 1.00 0.00 C ATOM 213 O PRO A 16 -1.889 21.969 -9.036 1.00 0.00 O ATOM 214 CB PRO A 16 0.272 19.664 -9.392 1.00 0.00 C ATOM 215 CG PRO A 16 1.730 19.888 -9.150 1.00 0.00 C ATOM 216 CD PRO A 16 2.267 20.602 -10.362 1.00 0.00 C ATOM 0 HA PRO A 16 -0.958 20.570 -10.964 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -0.284 19.637 -8.455 1.00 0.00 H new ATOM 0 HB3 PRO A 16 0.097 18.713 -9.894 1.00 0.00 H new ATOM 0 HG2 PRO A 16 1.886 20.483 -8.250 1.00 0.00 H new ATOM 0 HG3 PRO A 16 2.247 18.940 -8.999 1.00 0.00 H new ATOM 0 HD2 PRO A 16 3.039 21.323 -10.092 1.00 0.00 H new ATOM 0 HD3 PRO A 16 2.715 19.905 -11.070 1.00 0.00 H new ATOM 224 N SER A 17 0.074 22.958 -9.095 1.00 0.00 N ATOM 225 CA SER A 17 -0.419 24.097 -8.266 1.00 0.00 C ATOM 226 C SER A 17 -1.519 24.862 -9.012 1.00 0.00 C ATOM 227 O SER A 17 -2.259 25.627 -8.423 1.00 0.00 O ATOM 228 CB SER A 17 0.802 24.991 -8.051 1.00 0.00 C ATOM 229 OG SER A 17 1.860 24.216 -7.501 1.00 0.00 O ATOM 0 H SER A 17 1.052 23.020 -9.378 1.00 0.00 H new ATOM 0 HA SER A 17 -0.850 23.761 -7.323 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.114 25.434 -8.997 1.00 0.00 H new ATOM 0 HB3 SER A 17 0.552 25.813 -7.381 1.00 0.00 H new ATOM 0 HG SER A 17 2.645 24.786 -7.363 1.00 0.00 H new ATOM 235 N ALA A 18 -1.634 24.664 -10.300 1.00 0.00 N ATOM 236 CA ALA A 18 -2.689 25.382 -11.077 1.00 0.00 C ATOM 237 C ALA A 18 -4.071 25.108 -10.476 1.00 0.00 C ATOM 238 O ALA A 18 -4.966 25.926 -10.559 1.00 0.00 O ATOM 239 CB ALA A 18 -2.598 24.812 -12.494 1.00 0.00 C ATOM 0 H ALA A 18 -1.044 24.037 -10.847 1.00 0.00 H new ATOM 0 HA ALA A 18 -2.546 26.462 -11.063 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.344 25.291 -13.128 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.604 25.000 -12.899 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -2.781 23.738 -12.467 1.00 0.00 H new ATOM 245 N ASP A 19 -4.247 23.964 -9.872 1.00 0.00 N ATOM 246 CA ASP A 19 -5.568 23.634 -9.261 1.00 0.00 C ATOM 247 C ASP A 19 -5.445 22.398 -8.370 1.00 0.00 C ATOM 248 O ASP A 19 -5.108 21.328 -8.837 1.00 0.00 O ATOM 249 CB ASP A 19 -6.498 23.356 -10.444 1.00 0.00 C ATOM 250 CG ASP A 19 -7.355 24.593 -10.724 1.00 0.00 C ATOM 251 OD1 ASP A 19 -8.151 24.943 -9.868 1.00 0.00 O ATOM 252 OD2 ASP A 19 -7.201 25.167 -11.789 1.00 0.00 O ATOM 0 H ASP A 19 -3.533 23.242 -9.775 1.00 0.00 H new ATOM 0 HA ASP A 19 -5.944 24.441 -8.632 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -5.913 23.099 -11.327 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.137 22.500 -10.224 1.00 0.00 H new ATOM 257 N PRO A 20 -5.719 22.589 -7.106 1.00 0.00 N ATOM 258 CA PRO A 20 -5.632 21.473 -6.137 1.00 0.00 C ATOM 259 C PRO A 20 -6.820 20.522 -6.310 1.00 0.00 C ATOM 260 O PRO A 20 -6.691 19.322 -6.164 1.00 0.00 O ATOM 261 CB PRO A 20 -5.691 22.175 -4.786 1.00 0.00 C ATOM 262 CG PRO A 20 -6.410 23.458 -5.041 1.00 0.00 C ATOM 263 CD PRO A 20 -6.128 23.847 -6.465 1.00 0.00 C ATOM 0 HA PRO A 20 -4.736 20.864 -6.259 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -6.218 21.568 -4.050 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -4.691 22.356 -4.393 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -7.481 23.338 -4.879 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -6.069 24.234 -4.355 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.010 24.270 -6.945 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -5.341 24.599 -6.524 1.00 0.00 H new ATOM 271 N GLU A 21 -7.974 21.051 -6.618 1.00 0.00 N ATOM 272 CA GLU A 21 -9.171 20.179 -6.802 1.00 0.00 C ATOM 273 C GLU A 21 -8.938 19.193 -7.949 1.00 0.00 C ATOM 274 O GLU A 21 -9.314 18.039 -7.875 1.00 0.00 O ATOM 275 CB GLU A 21 -10.314 21.136 -7.142 1.00 0.00 C ATOM 276 CG GLU A 21 -10.995 21.598 -5.852 1.00 0.00 C ATOM 277 CD GLU A 21 -12.482 21.840 -6.117 1.00 0.00 C ATOM 278 OE1 GLU A 21 -13.193 20.871 -6.319 1.00 0.00 O ATOM 279 OE2 GLU A 21 -12.884 22.992 -6.115 1.00 0.00 O ATOM 0 H GLU A 21 -8.140 22.049 -6.750 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.388 19.586 -5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.931 21.996 -7.691 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -11.037 20.640 -7.790 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.872 20.845 -5.074 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.526 22.512 -5.488 1.00 0.00 H new ATOM 286 N LEU A 22 -8.318 19.639 -9.009 1.00 0.00 N ATOM 287 CA LEU A 22 -8.058 18.728 -10.162 1.00 0.00 C ATOM 288 C LEU A 22 -6.968 17.717 -9.796 1.00 0.00 C ATOM 289 O LEU A 22 -6.971 16.592 -10.256 1.00 0.00 O ATOM 290 CB LEU A 22 -7.587 19.640 -11.297 1.00 0.00 C ATOM 291 CG LEU A 22 -8.724 19.834 -12.303 1.00 0.00 C ATOM 292 CD1 LEU A 22 -9.723 20.854 -11.754 1.00 0.00 C ATOM 293 CD2 LEU A 22 -8.150 20.346 -13.626 1.00 0.00 C ATOM 0 H LEU A 22 -7.980 20.594 -9.126 1.00 0.00 H new ATOM 0 HA LEU A 22 -8.942 18.157 -10.444 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.273 20.604 -10.896 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.720 19.203 -11.792 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.230 18.883 -12.468 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -10.533 20.992 -12.470 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -10.131 20.492 -10.810 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.218 21.806 -11.589 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -8.958 20.485 -14.344 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.645 21.298 -13.460 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.437 19.621 -14.018 1.00 0.00 H new ATOM 305 N ALA A 23 -6.036 18.111 -8.968 1.00 0.00 N ATOM 306 CA ALA A 23 -4.946 17.173 -8.567 1.00 0.00 C ATOM 307 C ALA A 23 -5.499 16.093 -7.636 1.00 0.00 C ATOM 308 O ALA A 23 -5.184 14.926 -7.764 1.00 0.00 O ATOM 309 CB ALA A 23 -3.922 18.042 -7.836 1.00 0.00 C ATOM 0 H ALA A 23 -5.983 19.041 -8.552 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.505 16.661 -9.422 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.087 17.423 -7.509 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.557 18.818 -8.509 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.392 18.506 -6.969 1.00 0.00 H new ATOM 315 N LEU A 24 -6.325 16.475 -6.698 1.00 0.00 N ATOM 316 CA LEU A 24 -6.904 15.473 -5.756 1.00 0.00 C ATOM 317 C LEU A 24 -7.932 14.602 -6.483 1.00 0.00 C ATOM 318 O LEU A 24 -7.947 13.395 -6.341 1.00 0.00 O ATOM 319 CB LEU A 24 -7.580 16.302 -4.659 1.00 0.00 C ATOM 320 CG LEU A 24 -7.250 15.716 -3.281 1.00 0.00 C ATOM 321 CD1 LEU A 24 -7.732 14.266 -3.208 1.00 0.00 C ATOM 322 CD2 LEU A 24 -5.738 15.764 -3.051 1.00 0.00 C ATOM 0 H LEU A 24 -6.624 17.438 -6.544 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.148 14.802 -5.349 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.242 17.337 -4.714 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -8.659 16.310 -4.811 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.753 16.303 -2.512 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.496 13.853 -2.227 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.810 14.233 -3.366 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.234 13.678 -3.979 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.506 15.347 -2.071 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.234 15.181 -3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.396 16.798 -3.096 1.00 0.00 H new ATOM 334 N ALA A 25 -8.792 15.206 -7.260 1.00 0.00 N ATOM 335 CA ALA A 25 -9.819 14.414 -7.999 1.00 0.00 C ATOM 336 C ALA A 25 -9.138 13.438 -8.962 1.00 0.00 C ATOM 337 O ALA A 25 -9.607 12.338 -9.182 1.00 0.00 O ATOM 338 CB ALA A 25 -10.639 15.447 -8.772 1.00 0.00 C ATOM 0 H ALA A 25 -8.828 16.214 -7.415 1.00 0.00 H new ATOM 0 HA ALA A 25 -10.442 13.820 -7.331 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.418 14.941 -9.343 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.098 16.145 -8.072 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.987 15.993 -9.454 1.00 0.00 H new ATOM 344 N LEU A 26 -8.032 13.833 -9.536 1.00 0.00 N ATOM 345 CA LEU A 26 -7.316 12.928 -10.483 1.00 0.00 C ATOM 346 C LEU A 26 -6.584 11.825 -9.714 1.00 0.00 C ATOM 347 O LEU A 26 -6.276 10.781 -10.254 1.00 0.00 O ATOM 348 CB LEU A 26 -6.319 13.824 -11.219 1.00 0.00 C ATOM 349 CG LEU A 26 -5.610 13.015 -12.306 1.00 0.00 C ATOM 350 CD1 LEU A 26 -6.634 12.521 -13.332 1.00 0.00 C ATOM 351 CD2 LEU A 26 -4.577 13.899 -13.007 1.00 0.00 C ATOM 0 H LEU A 26 -7.594 14.742 -9.390 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.000 12.432 -11.172 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.837 14.674 -11.663 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.589 14.227 -10.517 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.111 12.159 -11.851 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.126 11.945 -14.105 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.371 11.890 -12.835 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.135 13.376 -13.787 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.071 13.323 -13.782 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.078 14.755 -13.460 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.845 14.250 -12.280 1.00 0.00 H new ATOM 363 N ARG A 27 -6.313 12.044 -8.453 1.00 0.00 N ATOM 364 CA ARG A 27 -5.613 11.003 -7.650 1.00 0.00 C ATOM 365 C ARG A 27 -6.624 9.951 -7.202 1.00 0.00 C ATOM 366 O ARG A 27 -6.305 8.788 -7.046 1.00 0.00 O ATOM 367 CB ARG A 27 -5.037 11.748 -6.445 1.00 0.00 C ATOM 368 CG ARG A 27 -3.894 10.934 -5.837 1.00 0.00 C ATOM 369 CD ARG A 27 -3.173 11.777 -4.780 1.00 0.00 C ATOM 370 NE ARG A 27 -2.254 10.828 -4.093 1.00 0.00 N ATOM 371 CZ ARG A 27 -1.029 11.187 -3.823 1.00 0.00 C ATOM 372 NH1 ARG A 27 -0.767 11.840 -2.724 1.00 0.00 N ATOM 373 NH2 ARG A 27 -0.065 10.893 -4.653 1.00 0.00 N ATOM 0 H ARG A 27 -6.547 12.898 -7.947 1.00 0.00 H new ATOM 0 HA ARG A 27 -4.832 10.489 -8.211 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -4.675 12.730 -6.751 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -5.816 11.913 -5.700 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.283 10.021 -5.386 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.194 10.632 -6.616 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -2.622 12.598 -5.238 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.880 12.220 -4.078 1.00 0.00 H new ATOM 0 HE ARG A 27 -2.582 9.898 -3.834 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -1.520 12.070 -2.076 1.00 0.00 H new ATOM 0 HH12 ARG A 27 0.191 12.120 -2.513 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -0.270 10.383 -5.512 1.00 0.00 H new ATOM 0 HH22 ARG A 27 0.893 11.174 -4.442 1.00 0.00 H new ATOM 387 N VAL A 28 -7.849 10.358 -7.005 1.00 0.00 N ATOM 388 CA VAL A 28 -8.897 9.392 -6.577 1.00 0.00 C ATOM 389 C VAL A 28 -9.360 8.565 -7.781 1.00 0.00 C ATOM 390 O VAL A 28 -9.783 7.434 -7.644 1.00 0.00 O ATOM 391 CB VAL A 28 -10.038 10.256 -6.035 1.00 0.00 C ATOM 392 CG1 VAL A 28 -11.203 9.361 -5.607 1.00 0.00 C ATOM 393 CG2 VAL A 28 -9.541 11.053 -4.828 1.00 0.00 C ATOM 0 H VAL A 28 -8.168 11.320 -7.123 1.00 0.00 H new ATOM 0 HA VAL A 28 -8.538 8.688 -5.826 1.00 0.00 H new ATOM 0 HB VAL A 28 -10.375 10.940 -6.814 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -12.014 9.979 -5.221 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -11.558 8.791 -6.465 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -10.868 8.675 -4.829 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -10.352 11.669 -4.440 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -9.204 10.366 -4.052 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -8.712 11.693 -5.131 1.00 0.00 H new ATOM 403 N SER A 29 -9.278 9.125 -8.959 1.00 0.00 N ATOM 404 CA SER A 29 -9.705 8.377 -10.177 1.00 0.00 C ATOM 405 C SER A 29 -8.625 7.370 -10.578 1.00 0.00 C ATOM 406 O SER A 29 -8.917 6.277 -11.024 1.00 0.00 O ATOM 407 CB SER A 29 -9.873 9.442 -11.260 1.00 0.00 C ATOM 408 OG SER A 29 -11.095 10.136 -11.050 1.00 0.00 O ATOM 0 H SER A 29 -8.933 10.070 -9.130 1.00 0.00 H new ATOM 0 HA SER A 29 -10.624 7.814 -10.016 1.00 0.00 H new ATOM 0 HB2 SER A 29 -9.036 10.140 -11.233 1.00 0.00 H new ATOM 0 HB3 SER A 29 -9.870 8.978 -12.246 1.00 0.00 H new ATOM 0 HG SER A 29 -10.930 10.929 -10.498 1.00 0.00 H new ATOM 414 N MET A 30 -7.379 7.731 -10.419 1.00 0.00 N ATOM 415 CA MET A 30 -6.276 6.796 -10.787 1.00 0.00 C ATOM 416 C MET A 30 -6.250 5.610 -9.821 1.00 0.00 C ATOM 417 O MET A 30 -5.987 4.488 -10.207 1.00 0.00 O ATOM 418 CB MET A 30 -4.994 7.621 -10.658 1.00 0.00 C ATOM 419 CG MET A 30 -4.611 8.189 -12.026 1.00 0.00 C ATOM 420 SD MET A 30 -2.846 8.588 -12.039 1.00 0.00 S ATOM 421 CE MET A 30 -2.920 9.984 -10.891 1.00 0.00 C ATOM 0 H MET A 30 -7.078 8.633 -10.050 1.00 0.00 H new ATOM 0 HA MET A 30 -6.397 6.389 -11.791 1.00 0.00 H new ATOM 0 HB2 MET A 30 -5.141 8.432 -9.944 1.00 0.00 H new ATOM 0 HB3 MET A 30 -4.186 6.999 -10.272 1.00 0.00 H new ATOM 0 HG2 MET A 30 -4.837 7.465 -12.809 1.00 0.00 H new ATOM 0 HG3 MET A 30 -5.199 9.082 -12.239 1.00 0.00 H new ATOM 0 HE1 MET A 30 -2.154 10.713 -11.155 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.902 10.453 -10.951 1.00 0.00 H new ATOM 0 HE3 MET A 30 -2.749 9.629 -9.875 1.00 0.00 H new ATOM 431 N GLU A 31 -6.525 5.852 -8.565 1.00 0.00 N ATOM 432 CA GLU A 31 -6.519 4.738 -7.572 1.00 0.00 C ATOM 433 C GLU A 31 -7.690 3.789 -7.839 1.00 0.00 C ATOM 434 O GLU A 31 -7.555 2.583 -7.758 1.00 0.00 O ATOM 435 CB GLU A 31 -6.678 5.416 -6.211 1.00 0.00 C ATOM 436 CG GLU A 31 -6.108 4.506 -5.121 1.00 0.00 C ATOM 437 CD GLU A 31 -4.587 4.661 -5.072 1.00 0.00 C ATOM 438 OE1 GLU A 31 -4.130 5.694 -4.612 1.00 0.00 O ATOM 439 OE2 GLU A 31 -3.904 3.743 -5.497 1.00 0.00 O ATOM 0 H GLU A 31 -6.753 6.771 -8.185 1.00 0.00 H new ATOM 0 HA GLU A 31 -5.607 4.143 -7.625 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.160 6.375 -6.207 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.730 5.621 -6.015 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.542 4.762 -4.154 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.372 3.468 -5.324 1.00 0.00 H new ATOM 446 N GLU A 32 -8.839 4.323 -8.159 1.00 0.00 N ATOM 447 CA GLU A 32 -10.020 3.452 -8.435 1.00 0.00 C ATOM 448 C GLU A 32 -9.727 2.531 -9.621 1.00 0.00 C ATOM 449 O GLU A 32 -10.010 1.349 -9.586 1.00 0.00 O ATOM 450 CB GLU A 32 -11.159 4.416 -8.772 1.00 0.00 C ATOM 451 CG GLU A 32 -12.070 4.580 -7.554 1.00 0.00 C ATOM 452 CD GLU A 32 -13.090 5.688 -7.824 1.00 0.00 C ATOM 453 OE1 GLU A 32 -13.703 5.657 -8.879 1.00 0.00 O ATOM 454 OE2 GLU A 32 -13.241 6.547 -6.972 1.00 0.00 O ATOM 0 H GLU A 32 -9.011 5.325 -8.241 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.269 2.813 -7.588 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.754 5.384 -9.069 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -11.731 4.037 -9.618 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -12.584 3.642 -7.342 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -11.476 4.824 -6.673 1.00 0.00 H new ATOM 461 N GLN A 33 -9.158 3.063 -10.671 1.00 0.00 N ATOM 462 CA GLN A 33 -8.842 2.218 -11.859 1.00 0.00 C ATOM 463 C GLN A 33 -7.874 1.099 -11.464 1.00 0.00 C ATOM 464 O GLN A 33 -7.922 0.007 -11.995 1.00 0.00 O ATOM 465 CB GLN A 33 -8.187 3.168 -12.865 1.00 0.00 C ATOM 466 CG GLN A 33 -8.797 2.948 -14.250 1.00 0.00 C ATOM 467 CD GLN A 33 -7.791 3.363 -15.325 1.00 0.00 C ATOM 468 OE1 GLN A 33 -7.920 4.413 -15.923 1.00 0.00 O ATOM 469 NE2 GLN A 33 -6.785 2.578 -15.598 1.00 0.00 N ATOM 0 H GLN A 33 -8.899 4.046 -10.757 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.729 1.741 -12.275 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.333 4.202 -12.552 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -7.112 2.994 -12.898 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -9.068 1.900 -14.377 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -9.714 3.529 -14.351 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -6.675 1.696 -15.097 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -6.108 2.846 -16.312 1.00 0.00 H new ATOM 478 N ARG A 34 -6.999 1.365 -10.531 1.00 0.00 N ATOM 479 CA ARG A 34 -6.030 0.319 -10.094 1.00 0.00 C ATOM 480 C ARG A 34 -6.757 -0.763 -9.291 1.00 0.00 C ATOM 481 O ARG A 34 -6.450 -1.935 -9.391 1.00 0.00 O ATOM 482 CB ARG A 34 -5.022 1.055 -9.209 1.00 0.00 C ATOM 483 CG ARG A 34 -3.611 0.539 -9.499 1.00 0.00 C ATOM 484 CD ARG A 34 -3.158 1.032 -10.875 1.00 0.00 C ATOM 485 NE ARG A 34 -2.428 -0.119 -11.474 1.00 0.00 N ATOM 486 CZ ARG A 34 -1.360 0.089 -12.194 1.00 0.00 C ATOM 487 NH1 ARG A 34 -1.468 0.280 -13.481 1.00 0.00 N ATOM 488 NH2 ARG A 34 -0.185 0.108 -11.628 1.00 0.00 N ATOM 0 H ARG A 34 -6.914 2.262 -10.053 1.00 0.00 H new ATOM 0 HA ARG A 34 -5.546 -0.176 -10.936 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -5.073 2.128 -9.396 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -5.267 0.903 -8.158 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -2.920 0.887 -8.731 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -3.598 -0.551 -9.469 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -4.009 1.323 -11.490 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -2.513 1.907 -10.789 1.00 0.00 H new ATOM 0 HE ARG A 34 -2.763 -1.070 -11.321 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -2.387 0.267 -13.923 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -0.633 0.443 -14.044 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -0.101 -0.040 -10.622 1.00 0.00 H new ATOM 0 HH22 ARG A 34 0.650 0.271 -12.191 1.00 0.00 H new ATOM 502 N GLN A 35 -7.720 -0.375 -8.498 1.00 0.00 N ATOM 503 CA GLN A 35 -8.475 -1.378 -7.689 1.00 0.00 C ATOM 504 C GLN A 35 -9.150 -2.396 -8.611 1.00 0.00 C ATOM 505 O GLN A 35 -9.158 -3.581 -8.342 1.00 0.00 O ATOM 506 CB GLN A 35 -9.523 -0.567 -6.925 1.00 0.00 C ATOM 507 CG GLN A 35 -8.833 0.290 -5.861 1.00 0.00 C ATOM 508 CD GLN A 35 -9.759 0.450 -4.655 1.00 0.00 C ATOM 509 OE1 GLN A 35 -10.403 -0.494 -4.240 1.00 0.00 O ATOM 510 NE2 GLN A 35 -9.856 1.612 -4.070 1.00 0.00 N ATOM 0 H GLN A 35 -8.017 0.593 -8.375 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.827 -1.939 -7.016 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.079 0.069 -7.614 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.244 -1.236 -6.456 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -7.897 -0.176 -5.554 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -8.582 1.268 -6.273 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -9.316 2.405 -4.417 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -10.472 1.728 -3.265 1.00 0.00 H new ATOM 519 N ARG A 36 -9.713 -1.941 -9.698 1.00 0.00 N ATOM 520 CA ARG A 36 -10.385 -2.882 -10.642 1.00 0.00 C ATOM 521 C ARG A 36 -9.341 -3.749 -11.348 1.00 0.00 C ATOM 522 O ARG A 36 -9.485 -4.951 -11.452 1.00 0.00 O ATOM 523 CB ARG A 36 -11.111 -1.987 -11.647 1.00 0.00 C ATOM 524 CG ARG A 36 -12.591 -1.886 -11.270 1.00 0.00 C ATOM 525 CD ARG A 36 -13.402 -2.877 -12.111 1.00 0.00 C ATOM 526 NE ARG A 36 -14.538 -3.280 -11.237 1.00 0.00 N ATOM 527 CZ ARG A 36 -14.658 -4.524 -10.855 1.00 0.00 C ATOM 528 NH1 ARG A 36 -15.276 -5.383 -11.619 1.00 0.00 N ATOM 529 NH2 ARG A 36 -14.158 -4.907 -9.713 1.00 0.00 N ATOM 0 H ARG A 36 -9.737 -0.959 -9.974 1.00 0.00 H new ATOM 0 HA ARG A 36 -11.072 -3.559 -10.134 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -10.660 -0.995 -11.658 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -11.009 -2.395 -12.653 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -12.722 -2.100 -10.209 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -12.951 -0.871 -11.437 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -13.757 -2.416 -13.033 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -12.799 -3.738 -12.398 1.00 0.00 H new ATOM 0 HE ARG A 36 -15.222 -2.586 -10.937 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -15.665 -5.083 -12.513 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -15.370 -6.354 -11.322 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -13.673 -4.236 -9.118 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -14.252 -5.878 -9.415 1.00 0.00 H new ATOM 543 N GLN A 37 -8.286 -3.147 -11.830 1.00 0.00 N ATOM 544 CA GLN A 37 -7.227 -3.937 -12.526 1.00 0.00 C ATOM 545 C GLN A 37 -6.553 -4.895 -11.539 1.00 0.00 C ATOM 546 O GLN A 37 -6.016 -5.915 -11.921 1.00 0.00 O ATOM 547 CB GLN A 37 -6.224 -2.899 -13.035 1.00 0.00 C ATOM 548 CG GLN A 37 -5.649 -3.356 -14.380 1.00 0.00 C ATOM 549 CD GLN A 37 -5.737 -2.212 -15.392 1.00 0.00 C ATOM 550 OE1 GLN A 37 -4.800 -1.456 -15.556 1.00 0.00 O ATOM 551 NE2 GLN A 37 -6.834 -2.051 -16.081 1.00 0.00 N ATOM 0 H GLN A 37 -8.111 -2.144 -11.772 1.00 0.00 H new ATOM 0 HA GLN A 37 -7.630 -4.544 -13.337 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -6.712 -1.931 -13.147 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.421 -2.769 -12.310 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -4.611 -3.667 -14.257 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -6.200 -4.222 -14.747 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.621 -2.686 -15.943 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -6.905 -1.291 -16.757 1.00 0.00 H new ATOM 560 N GLU A 38 -6.588 -4.576 -10.272 1.00 0.00 N ATOM 561 CA GLU A 38 -5.962 -5.465 -9.252 1.00 0.00 C ATOM 562 C GLU A 38 -6.942 -6.574 -8.871 1.00 0.00 C ATOM 563 O GLU A 38 -6.656 -7.745 -9.028 1.00 0.00 O ATOM 564 CB GLU A 38 -5.679 -4.562 -8.052 1.00 0.00 C ATOM 565 CG GLU A 38 -4.680 -5.250 -7.120 1.00 0.00 C ATOM 566 CD GLU A 38 -3.256 -4.850 -7.514 1.00 0.00 C ATOM 567 OE1 GLU A 38 -2.744 -5.417 -8.465 1.00 0.00 O ATOM 568 OE2 GLU A 38 -2.703 -3.985 -6.857 1.00 0.00 O ATOM 0 H GLU A 38 -7.026 -3.734 -9.899 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.053 -5.944 -9.616 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -5.279 -3.606 -8.389 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.605 -4.349 -7.517 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -4.876 -4.966 -6.086 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -4.795 -6.332 -7.181 1.00 0.00 H new ATOM 575 N GLU A 39 -8.103 -6.212 -8.384 1.00 0.00 N ATOM 576 CA GLU A 39 -9.113 -7.245 -8.007 1.00 0.00 C ATOM 577 C GLU A 39 -9.321 -8.201 -9.181 1.00 0.00 C ATOM 578 O GLU A 39 -9.547 -9.383 -9.005 1.00 0.00 O ATOM 579 CB GLU A 39 -10.397 -6.466 -7.713 1.00 0.00 C ATOM 580 CG GLU A 39 -10.367 -5.950 -6.271 1.00 0.00 C ATOM 581 CD GLU A 39 -11.582 -6.483 -5.509 1.00 0.00 C ATOM 582 OE1 GLU A 39 -12.626 -5.856 -5.584 1.00 0.00 O ATOM 583 OE2 GLU A 39 -11.448 -7.511 -4.864 1.00 0.00 O ATOM 0 H GLU A 39 -8.394 -5.246 -8.232 1.00 0.00 H new ATOM 0 HA GLU A 39 -8.804 -7.841 -7.149 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -10.494 -5.631 -8.407 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -11.266 -7.107 -7.862 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -9.448 -6.269 -5.779 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -10.370 -4.860 -6.264 1.00 0.00 H new ATOM 590 N GLU A 40 -9.218 -7.694 -10.380 1.00 0.00 N ATOM 591 CA GLU A 40 -9.381 -8.561 -11.576 1.00 0.00 C ATOM 592 C GLU A 40 -8.052 -9.259 -11.870 1.00 0.00 C ATOM 593 O GLU A 40 -8.018 -10.390 -12.318 1.00 0.00 O ATOM 594 CB GLU A 40 -9.755 -7.611 -12.714 1.00 0.00 C ATOM 595 CG GLU A 40 -10.227 -8.422 -13.923 1.00 0.00 C ATOM 596 CD GLU A 40 -11.745 -8.596 -13.860 1.00 0.00 C ATOM 597 OE1 GLU A 40 -12.431 -7.600 -13.701 1.00 0.00 O ATOM 598 OE2 GLU A 40 -12.198 -9.724 -13.973 1.00 0.00 O ATOM 0 H GLU A 40 -9.027 -6.712 -10.580 1.00 0.00 H new ATOM 0 HA GLU A 40 -10.138 -9.333 -11.440 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.542 -6.930 -12.390 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.896 -6.998 -12.987 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.947 -7.915 -14.846 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.739 -9.396 -13.934 1.00 0.00 H new ATOM 605 N ALA A 41 -6.954 -8.595 -11.604 1.00 0.00 N ATOM 606 CA ALA A 41 -5.625 -9.227 -11.854 1.00 0.00 C ATOM 607 C ALA A 41 -5.454 -10.439 -10.939 1.00 0.00 C ATOM 608 O ALA A 41 -5.187 -11.536 -11.389 1.00 0.00 O ATOM 609 CB ALA A 41 -4.594 -8.150 -11.514 1.00 0.00 C ATOM 0 H ALA A 41 -6.922 -7.648 -11.227 1.00 0.00 H new ATOM 0 HA ALA A 41 -5.517 -9.575 -12.881 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -3.590 -8.544 -11.674 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -4.750 -7.282 -12.155 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.706 -7.856 -10.470 1.00 0.00 H new ATOM 615 N ARG A 42 -5.615 -10.249 -9.655 1.00 0.00 N ATOM 616 CA ARG A 42 -5.471 -11.393 -8.711 1.00 0.00 C ATOM 617 C ARG A 42 -6.589 -12.408 -8.961 1.00 0.00 C ATOM 618 O ARG A 42 -6.418 -13.596 -8.769 1.00 0.00 O ATOM 619 CB ARG A 42 -5.585 -10.781 -7.310 1.00 0.00 C ATOM 620 CG ARG A 42 -7.004 -10.255 -7.081 1.00 0.00 C ATOM 621 CD ARG A 42 -7.116 -9.715 -5.656 1.00 0.00 C ATOM 622 NE ARG A 42 -8.539 -9.934 -5.271 1.00 0.00 N ATOM 623 CZ ARG A 42 -8.923 -11.102 -4.837 1.00 0.00 C ATOM 624 NH1 ARG A 42 -8.447 -11.570 -3.715 1.00 0.00 N ATOM 625 NH2 ARG A 42 -9.783 -11.804 -5.524 1.00 0.00 N ATOM 0 H ARG A 42 -5.839 -9.353 -9.222 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.526 -11.921 -8.834 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -5.340 -11.529 -6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -4.866 -9.970 -7.199 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.233 -9.468 -7.800 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.730 -11.052 -7.239 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.439 -10.239 -4.981 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -6.854 -8.658 -5.613 1.00 0.00 H new ATOM 0 HE ARG A 42 -9.212 -9.171 -5.347 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -7.775 -11.022 -3.178 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.747 -12.484 -3.375 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -10.155 -11.439 -6.401 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -10.083 -12.718 -5.184 1.00 0.00 H new ATOM 639 N ARG A 43 -7.733 -11.946 -9.401 1.00 0.00 N ATOM 640 CA ARG A 43 -8.861 -12.883 -9.680 1.00 0.00 C ATOM 641 C ARG A 43 -8.381 -13.985 -10.624 1.00 0.00 C ATOM 642 O ARG A 43 -8.647 -15.153 -10.421 1.00 0.00 O ATOM 643 CB ARG A 43 -9.939 -12.029 -10.352 1.00 0.00 C ATOM 644 CG ARG A 43 -11.147 -11.897 -9.421 1.00 0.00 C ATOM 645 CD ARG A 43 -12.406 -11.641 -10.251 1.00 0.00 C ATOM 646 NE ARG A 43 -12.865 -12.991 -10.679 1.00 0.00 N ATOM 647 CZ ARG A 43 -14.140 -13.268 -10.703 1.00 0.00 C ATOM 648 NH1 ARG A 43 -14.777 -13.507 -9.589 1.00 0.00 N ATOM 649 NH2 ARG A 43 -14.778 -13.308 -11.840 1.00 0.00 N ATOM 0 H ARG A 43 -7.933 -10.962 -9.578 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.240 -13.365 -8.779 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -9.540 -11.042 -10.588 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.242 -12.484 -11.295 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -11.266 -12.806 -8.831 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.990 -11.079 -8.718 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -13.170 -11.132 -9.663 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -12.190 -11.006 -11.111 1.00 0.00 H new ATOM 0 HE ARG A 43 -12.184 -13.699 -10.953 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -14.278 -13.477 -8.700 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -15.774 -13.723 -9.608 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -14.280 -13.123 -12.711 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -15.775 -13.525 -11.858 1.00 0.00 H new ATOM 663 N ALA A 44 -7.656 -13.617 -11.646 1.00 0.00 N ATOM 664 CA ALA A 44 -7.133 -14.640 -12.595 1.00 0.00 C ATOM 665 C ALA A 44 -5.982 -15.405 -11.934 1.00 0.00 C ATOM 666 O ALA A 44 -5.689 -16.531 -12.282 1.00 0.00 O ATOM 667 CB ALA A 44 -6.630 -13.848 -13.803 1.00 0.00 C ATOM 0 H ALA A 44 -7.404 -12.653 -11.864 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.889 -15.371 -12.884 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -6.229 -14.536 -14.547 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -7.455 -13.284 -14.238 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -5.847 -13.159 -13.486 1.00 0.00 H new ATOM 673 N ALA A 45 -5.332 -14.794 -10.975 1.00 0.00 N ATOM 674 CA ALA A 45 -4.204 -15.476 -10.278 1.00 0.00 C ATOM 675 C ALA A 45 -4.733 -16.654 -9.456 1.00 0.00 C ATOM 676 O ALA A 45 -4.086 -17.674 -9.326 1.00 0.00 O ATOM 677 CB ALA A 45 -3.601 -14.409 -9.361 1.00 0.00 C ATOM 0 H ALA A 45 -5.536 -13.850 -10.646 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.467 -15.877 -10.974 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -2.762 -14.834 -8.811 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.253 -13.568 -9.961 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -4.358 -14.064 -8.657 1.00 0.00 H new ATOM 683 N ALA A 46 -5.908 -16.517 -8.900 1.00 0.00 N ATOM 684 CA ALA A 46 -6.486 -17.626 -8.087 1.00 0.00 C ATOM 685 C ALA A 46 -7.246 -18.600 -8.990 1.00 0.00 C ATOM 686 O ALA A 46 -7.198 -19.801 -8.803 1.00 0.00 O ATOM 687 CB ALA A 46 -7.442 -16.942 -7.107 1.00 0.00 C ATOM 0 H ALA A 46 -6.492 -15.684 -8.974 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.720 -18.204 -7.570 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -7.910 -17.693 -6.471 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -6.886 -16.237 -6.488 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -8.212 -16.408 -7.663 1.00 0.00 H new ATOM 693 N ALA A 47 -7.946 -18.091 -9.968 1.00 0.00 N ATOM 694 CA ALA A 47 -8.709 -18.987 -10.886 1.00 0.00 C ATOM 695 C ALA A 47 -7.748 -19.917 -11.632 1.00 0.00 C ATOM 696 O ALA A 47 -8.048 -21.070 -11.871 1.00 0.00 O ATOM 697 CB ALA A 47 -9.413 -18.047 -11.867 1.00 0.00 C ATOM 0 H ALA A 47 -8.023 -17.094 -10.171 1.00 0.00 H new ATOM 0 HA ALA A 47 -9.417 -19.620 -10.351 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.997 -18.633 -12.577 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -10.075 -17.378 -11.318 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -8.669 -17.460 -12.406 1.00 0.00 H new ATOM 703 N SER A 48 -6.595 -19.424 -11.996 1.00 0.00 N ATOM 704 CA SER A 48 -5.611 -20.280 -12.722 1.00 0.00 C ATOM 705 C SER A 48 -4.854 -21.167 -11.730 1.00 0.00 C ATOM 706 O SER A 48 -4.481 -22.282 -12.038 1.00 0.00 O ATOM 707 CB SER A 48 -4.657 -19.300 -13.404 1.00 0.00 C ATOM 708 OG SER A 48 -4.347 -19.777 -14.706 1.00 0.00 O ATOM 0 H SER A 48 -6.291 -18.466 -11.822 1.00 0.00 H new ATOM 0 HA SER A 48 -6.091 -20.944 -13.441 1.00 0.00 H new ATOM 0 HB2 SER A 48 -5.114 -18.312 -13.465 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.745 -19.193 -12.816 1.00 0.00 H new ATOM 0 HG SER A 48 -3.737 -19.150 -15.147 1.00 0.00 H new ATOM 714 N ALA A 49 -4.626 -20.678 -10.539 1.00 0.00 N ATOM 715 CA ALA A 49 -3.897 -21.491 -9.523 1.00 0.00 C ATOM 716 C ALA A 49 -4.785 -22.639 -9.034 1.00 0.00 C ATOM 717 O ALA A 49 -4.305 -23.686 -8.646 1.00 0.00 O ATOM 718 CB ALA A 49 -3.594 -20.523 -8.379 1.00 0.00 C ATOM 0 H ALA A 49 -4.913 -19.751 -10.227 1.00 0.00 H new ATOM 0 HA ALA A 49 -2.989 -21.938 -9.926 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -3.057 -21.049 -7.590 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -2.981 -19.702 -8.750 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -4.528 -20.127 -7.980 1.00 0.00 H new ATOM 724 N ALA A 50 -6.077 -22.447 -9.053 1.00 0.00 N ATOM 725 CA ALA A 50 -7.002 -23.525 -8.594 1.00 0.00 C ATOM 726 C ALA A 50 -7.476 -24.361 -9.788 1.00 0.00 C ATOM 727 O ALA A 50 -8.450 -25.084 -9.702 1.00 0.00 O ATOM 728 CB ALA A 50 -8.179 -22.790 -7.953 1.00 0.00 C ATOM 0 H ALA A 50 -6.532 -21.590 -9.367 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.522 -24.212 -7.897 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.906 -23.516 -7.589 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.820 -22.186 -7.120 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -8.651 -22.144 -8.693 1.00 0.00 H new ATOM 734 N GLU A 51 -6.795 -24.269 -10.899 1.00 0.00 N ATOM 735 CA GLU A 51 -7.203 -25.058 -12.098 1.00 0.00 C ATOM 736 C GLU A 51 -5.975 -25.717 -12.731 1.00 0.00 C ATOM 737 O GLU A 51 -6.002 -26.876 -13.098 1.00 0.00 O ATOM 738 CB GLU A 51 -7.820 -24.036 -13.054 1.00 0.00 C ATOM 739 CG GLU A 51 -8.516 -24.766 -14.204 1.00 0.00 C ATOM 740 CD GLU A 51 -7.612 -24.758 -15.439 1.00 0.00 C ATOM 741 OE1 GLU A 51 -6.775 -25.640 -15.542 1.00 0.00 O ATOM 742 OE2 GLU A 51 -7.772 -23.871 -16.261 1.00 0.00 O ATOM 0 H GLU A 51 -5.972 -23.680 -11.028 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.903 -25.856 -11.853 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -8.536 -23.410 -12.521 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.047 -23.375 -13.444 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.742 -25.792 -13.913 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.466 -24.283 -14.433 1.00 0.00 H new ATOM 749 N ALA A 52 -4.897 -24.989 -12.854 1.00 0.00 N ATOM 750 CA ALA A 52 -3.665 -25.574 -13.457 1.00 0.00 C ATOM 751 C ALA A 52 -2.997 -26.525 -12.460 1.00 0.00 C ATOM 752 O ALA A 52 -2.310 -27.454 -12.839 1.00 0.00 O ATOM 753 CB ALA A 52 -2.757 -24.377 -13.747 1.00 0.00 C ATOM 0 H ALA A 52 -4.817 -24.015 -12.563 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.877 -26.150 -14.358 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.826 -24.726 -14.194 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -3.259 -23.699 -14.437 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.539 -23.852 -12.817 1.00 0.00 H new ATOM 759 N GLY A 53 -3.197 -26.301 -11.188 1.00 0.00 N ATOM 760 CA GLY A 53 -2.577 -27.192 -10.165 1.00 0.00 C ATOM 761 C GLY A 53 -3.477 -28.406 -9.933 1.00 0.00 C ATOM 762 O GLY A 53 -3.437 -29.369 -10.675 1.00 0.00 O ATOM 0 H GLY A 53 -3.763 -25.539 -10.814 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -1.591 -27.515 -10.499 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -2.435 -26.648 -9.231 1.00 0.00 H new ATOM 766 N ILE A 54 -4.289 -28.370 -8.910 1.00 0.00 N ATOM 767 CA ILE A 54 -5.190 -29.523 -8.628 1.00 0.00 C ATOM 768 C ILE A 54 -6.568 -29.023 -8.175 1.00 0.00 C ATOM 769 O ILE A 54 -7.589 -29.543 -8.581 1.00 0.00 O ATOM 770 CB ILE A 54 -4.494 -30.306 -7.510 1.00 0.00 C ATOM 771 CG1 ILE A 54 -5.362 -31.498 -7.104 1.00 0.00 C ATOM 772 CG2 ILE A 54 -4.279 -29.399 -6.296 1.00 0.00 C ATOM 773 CD1 ILE A 54 -5.267 -32.589 -8.173 1.00 0.00 C ATOM 0 H ILE A 54 -4.367 -27.590 -8.257 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.359 -30.143 -9.508 1.00 0.00 H new ATOM 0 HB ILE A 54 -3.529 -30.661 -7.870 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -5.034 -31.889 -6.141 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.398 -31.182 -6.983 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -3.784 -29.962 -5.505 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -3.657 -28.550 -6.581 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -5.243 -29.038 -5.936 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -5.886 -33.438 -7.883 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.616 -32.195 -9.127 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -4.231 -32.912 -8.272 1.00 0.00 H new ATOM 785 N ALA A 55 -6.606 -28.018 -7.337 1.00 0.00 N ATOM 786 CA ALA A 55 -7.919 -27.487 -6.861 1.00 0.00 C ATOM 787 C ALA A 55 -7.702 -26.244 -5.993 1.00 0.00 C ATOM 788 O ALA A 55 -7.963 -25.132 -6.409 1.00 0.00 O ATOM 789 CB ALA A 55 -8.533 -28.617 -6.031 1.00 0.00 C ATOM 0 H ALA A 55 -5.785 -27.543 -6.962 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.566 -27.192 -7.687 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.502 -28.300 -5.646 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.662 -29.500 -6.657 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -7.873 -28.857 -5.198 1.00 0.00 H new ATOM 795 N THR A 56 -7.226 -26.426 -4.790 1.00 0.00 N ATOM 796 CA THR A 56 -6.990 -25.258 -3.892 1.00 0.00 C ATOM 797 C THR A 56 -5.490 -25.081 -3.643 1.00 0.00 C ATOM 798 O THR A 56 -4.666 -25.689 -4.297 1.00 0.00 O ATOM 799 CB THR A 56 -7.714 -25.608 -2.591 1.00 0.00 C ATOM 800 OG1 THR A 56 -7.455 -26.965 -2.257 1.00 0.00 O ATOM 801 CG2 THR A 56 -9.218 -25.401 -2.768 1.00 0.00 C ATOM 0 H THR A 56 -6.990 -27.334 -4.390 1.00 0.00 H new ATOM 0 HA THR A 56 -7.353 -24.324 -4.321 1.00 0.00 H new ATOM 0 HB THR A 56 -7.355 -24.962 -1.790 1.00 0.00 H new ATOM 0 HG1 THR A 56 -6.490 -27.131 -2.287 1.00 0.00 H new ATOM 0 HG21 THR A 56 -9.731 -25.651 -1.840 1.00 0.00 H new ATOM 0 HG22 THR A 56 -9.414 -24.359 -3.022 1.00 0.00 H new ATOM 0 HG23 THR A 56 -9.582 -26.045 -3.569 1.00 0.00 H new ATOM 809 N THR A 57 -5.131 -24.253 -2.697 1.00 0.00 N ATOM 810 CA THR A 57 -3.685 -24.036 -2.401 1.00 0.00 C ATOM 811 C THR A 57 -3.474 -23.865 -0.895 1.00 0.00 C ATOM 812 O THR A 57 -3.449 -22.762 -0.385 1.00 0.00 O ATOM 813 CB THR A 57 -3.316 -22.752 -3.146 1.00 0.00 C ATOM 814 OG1 THR A 57 -3.802 -22.821 -4.479 1.00 0.00 O ATOM 815 CG2 THR A 57 -1.796 -22.588 -3.162 1.00 0.00 C ATOM 0 H THR A 57 -5.777 -23.718 -2.117 1.00 0.00 H new ATOM 0 HA THR A 57 -3.068 -24.878 -2.713 1.00 0.00 H new ATOM 0 HB THR A 57 -3.766 -21.897 -2.640 1.00 0.00 H new ATOM 0 HG1 THR A 57 -3.567 -21.998 -4.956 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.534 -21.673 -3.693 1.00 0.00 H new ATOM 0 HG22 THR A 57 -1.425 -22.532 -2.139 1.00 0.00 H new ATOM 0 HG23 THR A 57 -1.343 -23.442 -3.666 1.00 0.00 H new ATOM 823 N GLY A 58 -3.325 -24.949 -0.181 1.00 0.00 N ATOM 824 CA GLY A 58 -3.117 -24.851 1.294 1.00 0.00 C ATOM 825 C GLY A 58 -2.426 -26.119 1.799 1.00 0.00 C ATOM 826 O GLY A 58 -1.243 -26.121 2.082 1.00 0.00 O ATOM 0 H GLY A 58 -3.338 -25.898 -0.555 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -2.511 -23.976 1.529 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.074 -24.720 1.799 1.00 0.00 H new ATOM 830 N THR A 59 -3.155 -27.197 1.917 1.00 0.00 N ATOM 831 CA THR A 59 -2.542 -28.466 2.406 1.00 0.00 C ATOM 832 C THR A 59 -2.915 -29.628 1.480 1.00 0.00 C ATOM 833 O THR A 59 -4.007 -30.156 1.543 1.00 0.00 O ATOM 834 CB THR A 59 -3.134 -28.680 3.802 1.00 0.00 C ATOM 835 OG1 THR A 59 -4.552 -28.621 3.725 1.00 0.00 O ATOM 836 CG2 THR A 59 -2.627 -27.590 4.750 1.00 0.00 C ATOM 0 H THR A 59 -4.149 -27.253 1.696 1.00 0.00 H new ATOM 0 HA THR A 59 -1.453 -28.416 2.428 1.00 0.00 H new ATOM 0 HB THR A 59 -2.828 -29.655 4.180 1.00 0.00 H new ATOM 0 HG1 THR A 59 -4.864 -29.193 2.993 1.00 0.00 H new ATOM 0 HG21 THR A 59 -3.050 -27.745 5.742 1.00 0.00 H new ATOM 0 HG22 THR A 59 -1.539 -27.635 4.808 1.00 0.00 H new ATOM 0 HG23 THR A 59 -2.930 -26.612 4.375 1.00 0.00 H new ATOM 844 N GLU A 60 -2.013 -30.026 0.622 1.00 0.00 N ATOM 845 CA GLU A 60 -2.314 -31.153 -0.309 1.00 0.00 C ATOM 846 C GLU A 60 -1.093 -32.066 -0.448 1.00 0.00 C ATOM 847 O GLU A 60 -0.580 -32.273 -1.530 1.00 0.00 O ATOM 848 CB GLU A 60 -2.640 -30.486 -1.647 1.00 0.00 C ATOM 849 CG GLU A 60 -4.156 -30.329 -1.786 1.00 0.00 C ATOM 850 CD GLU A 60 -4.557 -28.897 -1.429 1.00 0.00 C ATOM 851 OE1 GLU A 60 -4.580 -28.069 -2.325 1.00 0.00 O ATOM 852 OE2 GLU A 60 -4.835 -28.651 -0.267 1.00 0.00 O ATOM 0 H GLU A 60 -1.082 -29.620 0.526 1.00 0.00 H new ATOM 0 HA GLU A 60 -3.135 -31.774 0.048 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.156 -29.511 -1.706 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.249 -31.086 -2.469 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -4.464 -30.560 -2.806 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -4.667 -31.035 -1.131 1.00 0.00 H new ATOM 859 N ASP A 61 -0.625 -32.614 0.641 1.00 0.00 N ATOM 860 CA ASP A 61 0.563 -33.515 0.575 1.00 0.00 C ATOM 861 C ASP A 61 0.145 -34.901 0.075 1.00 0.00 C ATOM 862 O ASP A 61 0.793 -35.487 -0.771 1.00 0.00 O ATOM 863 CB ASP A 61 1.078 -33.598 2.012 1.00 0.00 C ATOM 864 CG ASP A 61 1.838 -32.316 2.358 1.00 0.00 C ATOM 865 OD1 ASP A 61 2.938 -32.149 1.858 1.00 0.00 O ATOM 866 OD2 ASP A 61 1.307 -31.523 3.118 1.00 0.00 O ATOM 0 H ASP A 61 -1.014 -32.477 1.574 1.00 0.00 H new ATOM 0 HA ASP A 61 1.326 -33.145 -0.110 1.00 0.00 H new ATOM 0 HB2 ASP A 61 0.244 -33.736 2.701 1.00 0.00 H new ATOM 0 HB3 ASP A 61 1.732 -34.463 2.126 1.00 0.00 H new ATOM 871 N SER A 62 -0.935 -35.425 0.589 1.00 0.00 N ATOM 872 CA SER A 62 -1.400 -36.771 0.145 1.00 0.00 C ATOM 873 C SER A 62 -2.906 -36.740 -0.132 1.00 0.00 C ATOM 874 O SER A 62 -3.714 -36.713 0.775 1.00 0.00 O ATOM 875 CB SER A 62 -1.088 -37.704 1.315 1.00 0.00 C ATOM 876 OG SER A 62 0.092 -38.442 1.024 1.00 0.00 O ATOM 0 H SER A 62 -1.516 -34.978 1.298 1.00 0.00 H new ATOM 0 HA SER A 62 -0.913 -37.096 -0.774 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.954 -37.127 2.230 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.923 -38.383 1.486 1.00 0.00 H new ATOM 0 HG SER A 62 0.297 -39.040 1.773 1.00 0.00 H new ATOM 882 N ASP A 63 -3.288 -36.742 -1.382 1.00 0.00 N ATOM 883 CA ASP A 63 -4.741 -36.709 -1.726 1.00 0.00 C ATOM 884 C ASP A 63 -5.494 -37.828 -0.999 1.00 0.00 C ATOM 885 O ASP A 63 -6.641 -37.674 -0.621 1.00 0.00 O ATOM 886 CB ASP A 63 -4.796 -36.924 -3.239 1.00 0.00 C ATOM 887 CG ASP A 63 -4.650 -35.579 -3.954 1.00 0.00 C ATOM 888 OD1 ASP A 63 -5.643 -34.880 -4.067 1.00 0.00 O ATOM 889 OD2 ASP A 63 -3.546 -35.273 -4.375 1.00 0.00 O ATOM 0 H ASP A 63 -2.655 -36.765 -2.182 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.209 -35.771 -1.427 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.000 -37.601 -3.550 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.740 -37.394 -3.516 1.00 0.00 H new ATOM 894 N ASP A 64 -4.857 -38.949 -0.787 1.00 0.00 N ATOM 895 CA ASP A 64 -5.540 -40.064 -0.077 1.00 0.00 C ATOM 896 C ASP A 64 -5.577 -39.761 1.415 1.00 0.00 C ATOM 897 O ASP A 64 -6.500 -40.137 2.111 1.00 0.00 O ATOM 898 CB ASP A 64 -4.697 -41.307 -0.351 1.00 0.00 C ATOM 899 CG ASP A 64 -4.619 -41.554 -1.860 1.00 0.00 C ATOM 900 OD1 ASP A 64 -3.797 -40.921 -2.502 1.00 0.00 O ATOM 901 OD2 ASP A 64 -5.383 -42.371 -2.346 1.00 0.00 O ATOM 0 H ASP A 64 -3.897 -39.138 -1.074 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.567 -40.204 -0.413 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -3.695 -41.177 0.058 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -5.135 -42.172 0.147 1.00 0.00 H new ATOM 906 N ALA A 65 -4.586 -39.069 1.910 1.00 0.00 N ATOM 907 CA ALA A 65 -4.580 -38.730 3.357 1.00 0.00 C ATOM 908 C ALA A 65 -5.817 -37.895 3.673 1.00 0.00 C ATOM 909 O ALA A 65 -6.556 -38.184 4.590 1.00 0.00 O ATOM 910 CB ALA A 65 -3.309 -37.919 3.594 1.00 0.00 C ATOM 0 H ALA A 65 -3.787 -38.727 1.377 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.599 -39.615 3.993 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.247 -37.638 4.645 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -2.439 -38.519 3.327 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.332 -37.019 2.979 1.00 0.00 H new ATOM 916 N LEU A 66 -6.062 -36.874 2.895 1.00 0.00 N ATOM 917 CA LEU A 66 -7.272 -36.040 3.132 1.00 0.00 C ATOM 918 C LEU A 66 -8.512 -36.921 2.982 1.00 0.00 C ATOM 919 O LEU A 66 -9.531 -36.688 3.599 1.00 0.00 O ATOM 920 CB LEU A 66 -7.240 -34.957 2.052 1.00 0.00 C ATOM 921 CG LEU A 66 -8.416 -33.998 2.254 1.00 0.00 C ATOM 922 CD1 LEU A 66 -7.969 -32.568 1.948 1.00 0.00 C ATOM 923 CD2 LEU A 66 -9.560 -34.387 1.315 1.00 0.00 C ATOM 0 H LEU A 66 -5.479 -36.584 2.110 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.295 -35.597 4.128 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.299 -34.410 2.099 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -7.295 -35.413 1.063 1.00 0.00 H new ATOM 0 HG LEU A 66 -8.758 -34.058 3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.807 -31.886 2.092 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.155 -32.290 2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.625 -32.507 0.915 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.397 -33.704 1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.218 -34.329 0.282 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.881 -35.405 1.535 1.00 0.00 H new ATOM 935 N LEU A 67 -8.418 -37.947 2.173 1.00 0.00 N ATOM 936 CA LEU A 67 -9.577 -38.867 1.988 1.00 0.00 C ATOM 937 C LEU A 67 -9.685 -39.807 3.193 1.00 0.00 C ATOM 938 O LEU A 67 -10.765 -40.186 3.606 1.00 0.00 O ATOM 939 CB LEU A 67 -9.257 -39.658 0.718 1.00 0.00 C ATOM 940 CG LEU A 67 -10.444 -40.555 0.360 1.00 0.00 C ATOM 941 CD1 LEU A 67 -10.613 -40.599 -1.160 1.00 0.00 C ATOM 942 CD2 LEU A 67 -10.192 -41.971 0.884 1.00 0.00 C ATOM 0 H LEU A 67 -7.586 -38.186 1.633 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.525 -38.335 1.905 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.043 -38.975 -0.104 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -8.363 -40.263 0.870 1.00 0.00 H new ATOM 0 HG LEU A 67 -11.350 -40.154 0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -11.459 -41.238 -1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -10.794 -39.592 -1.535 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -9.707 -40.998 -1.615 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -11.038 -42.609 0.629 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.285 -42.371 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -10.073 -41.942 1.967 1.00 0.00 H new ATOM 954 N LYS A 68 -8.568 -40.180 3.760 1.00 0.00 N ATOM 955 CA LYS A 68 -8.592 -41.090 4.941 1.00 0.00 C ATOM 956 C LYS A 68 -8.841 -40.286 6.220 1.00 0.00 C ATOM 957 O LYS A 68 -9.777 -40.544 6.952 1.00 0.00 O ATOM 958 CB LYS A 68 -7.205 -41.733 4.970 1.00 0.00 C ATOM 959 CG LYS A 68 -7.119 -42.715 6.140 1.00 0.00 C ATOM 960 CD LYS A 68 -6.633 -41.977 7.390 1.00 0.00 C ATOM 961 CE LYS A 68 -5.892 -42.955 8.304 1.00 0.00 C ATOM 962 NZ LYS A 68 -4.871 -42.127 9.005 1.00 0.00 N ATOM 0 H LYS A 68 -7.638 -39.892 3.455 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.385 -41.835 4.876 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -7.014 -42.253 4.031 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -6.439 -40.964 5.070 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.095 -43.163 6.325 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.436 -43.529 5.896 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.974 -41.156 7.107 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.479 -41.539 7.919 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.573 -43.426 9.013 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.425 -43.756 7.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -4.321 -42.728 9.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -4.233 -41.697 8.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.345 -41.378 9.548 1.00 0.00 H new ATOM 976 N MET A 69 -8.011 -39.313 6.496 1.00 0.00 N ATOM 977 CA MET A 69 -8.200 -38.492 7.731 1.00 0.00 C ATOM 978 C MET A 69 -9.632 -37.947 7.807 1.00 0.00 C ATOM 979 O MET A 69 -10.220 -37.877 8.869 1.00 0.00 O ATOM 980 CB MET A 69 -7.197 -37.345 7.606 1.00 0.00 C ATOM 981 CG MET A 69 -5.966 -37.645 8.462 1.00 0.00 C ATOM 982 SD MET A 69 -4.579 -36.625 7.905 1.00 0.00 S ATOM 983 CE MET A 69 -3.593 -36.736 9.419 1.00 0.00 C ATOM 0 H MET A 69 -7.211 -39.051 5.920 1.00 0.00 H new ATOM 0 HA MET A 69 -8.041 -39.079 8.636 1.00 0.00 H new ATOM 0 HB2 MET A 69 -6.905 -37.216 6.564 1.00 0.00 H new ATOM 0 HB3 MET A 69 -7.656 -36.410 7.927 1.00 0.00 H new ATOM 0 HG2 MET A 69 -6.182 -37.443 9.511 1.00 0.00 H new ATOM 0 HG3 MET A 69 -5.707 -38.701 8.388 1.00 0.00 H new ATOM 0 HE1 MET A 69 -2.672 -36.167 9.296 1.00 0.00 H new ATOM 0 HE2 MET A 69 -4.162 -36.329 10.255 1.00 0.00 H new ATOM 0 HE3 MET A 69 -3.350 -37.780 9.620 1.00 0.00 H new ATOM 993 N THR A 70 -10.198 -37.561 6.692 1.00 0.00 N ATOM 994 CA THR A 70 -11.591 -37.021 6.715 1.00 0.00 C ATOM 995 C THR A 70 -12.594 -38.150 6.975 1.00 0.00 C ATOM 996 O THR A 70 -13.560 -37.976 7.692 1.00 0.00 O ATOM 997 CB THR A 70 -11.812 -36.394 5.331 1.00 0.00 C ATOM 998 OG1 THR A 70 -12.981 -35.587 5.363 1.00 0.00 O ATOM 999 CG2 THR A 70 -11.978 -37.489 4.275 1.00 0.00 C ATOM 0 H THR A 70 -9.759 -37.596 5.772 1.00 0.00 H new ATOM 0 HA THR A 70 -11.733 -36.288 7.509 1.00 0.00 H new ATOM 0 HB THR A 70 -10.947 -35.783 5.074 1.00 0.00 H new ATOM 0 HG1 THR A 70 -13.124 -35.184 4.481 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.134 -37.032 3.298 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.080 -38.107 4.247 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.838 -38.110 4.527 1.00 0.00 H new ATOM 1007 N ILE A 71 -12.374 -39.304 6.401 1.00 0.00 N ATOM 1008 CA ILE A 71 -13.319 -40.433 6.625 1.00 0.00 C ATOM 1009 C ILE A 71 -12.948 -41.193 7.905 1.00 0.00 C ATOM 1010 O ILE A 71 -13.673 -42.056 8.353 1.00 0.00 O ATOM 1011 CB ILE A 71 -13.185 -41.319 5.379 1.00 0.00 C ATOM 1012 CG1 ILE A 71 -14.522 -42.013 5.120 1.00 0.00 C ATOM 1013 CG2 ILE A 71 -12.092 -42.375 5.579 1.00 0.00 C ATOM 1014 CD1 ILE A 71 -15.510 -41.003 4.531 1.00 0.00 C ATOM 0 H ILE A 71 -11.584 -39.511 5.790 1.00 0.00 H new ATOM 0 HA ILE A 71 -14.347 -40.097 6.761 1.00 0.00 H new ATOM 0 HB ILE A 71 -12.911 -40.696 4.528 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -14.384 -42.848 4.433 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -14.916 -42.426 6.048 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -12.014 -42.992 4.684 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -11.138 -41.881 5.763 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -12.346 -43.004 6.432 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -16.465 -41.494 4.345 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -15.655 -40.183 5.234 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -15.115 -40.611 3.594 1.00 0.00 H new ATOM 1026 N SER A 72 -11.828 -40.877 8.498 1.00 0.00 N ATOM 1027 CA SER A 72 -11.426 -41.582 9.748 1.00 0.00 C ATOM 1028 C SER A 72 -12.076 -40.905 10.955 1.00 0.00 C ATOM 1029 O SER A 72 -12.530 -41.556 11.877 1.00 0.00 O ATOM 1030 CB SER A 72 -9.906 -41.451 9.809 1.00 0.00 C ATOM 1031 OG SER A 72 -9.426 -42.090 10.984 1.00 0.00 O ATOM 0 H SER A 72 -11.176 -40.163 8.172 1.00 0.00 H new ATOM 0 HA SER A 72 -11.739 -42.626 9.758 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.455 -41.903 8.926 1.00 0.00 H new ATOM 0 HB3 SER A 72 -9.620 -40.399 9.811 1.00 0.00 H new ATOM 0 HG SER A 72 -8.450 -42.009 11.025 1.00 0.00 H new ATOM 1037 N GLN A 73 -12.128 -39.600 10.952 1.00 0.00 N ATOM 1038 CA GLN A 73 -12.751 -38.871 12.093 1.00 0.00 C ATOM 1039 C GLN A 73 -14.234 -38.611 11.808 1.00 0.00 C ATOM 1040 O GLN A 73 -15.014 -38.371 12.710 1.00 0.00 O ATOM 1041 CB GLN A 73 -11.985 -37.551 12.184 1.00 0.00 C ATOM 1042 CG GLN A 73 -10.727 -37.746 13.031 1.00 0.00 C ATOM 1043 CD GLN A 73 -10.116 -36.383 13.361 1.00 0.00 C ATOM 1044 OE1 GLN A 73 -10.821 -35.399 13.473 1.00 0.00 O ATOM 1045 NE2 GLN A 73 -8.826 -36.281 13.522 1.00 0.00 N ATOM 0 H GLN A 73 -11.765 -39.006 10.206 1.00 0.00 H new ATOM 0 HA GLN A 73 -12.700 -39.438 13.023 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.714 -37.206 11.186 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.618 -36.781 12.626 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.974 -38.278 13.950 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.005 -38.359 12.492 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.234 -37.106 13.428 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.409 -35.376 13.742 1.00 0.00 H new ATOM 1054 N GLN A 74 -14.629 -38.656 10.562 1.00 0.00 N ATOM 1055 CA GLN A 74 -16.060 -38.410 10.222 1.00 0.00 C ATOM 1056 C GLN A 74 -16.828 -39.733 10.153 1.00 0.00 C ATOM 1057 O GLN A 74 -17.998 -39.797 10.481 1.00 0.00 O ATOM 1058 CB GLN A 74 -16.032 -37.734 8.851 1.00 0.00 C ATOM 1059 CG GLN A 74 -17.378 -37.056 8.588 1.00 0.00 C ATOM 1060 CD GLN A 74 -17.401 -36.498 7.164 1.00 0.00 C ATOM 1061 OE1 GLN A 74 -18.358 -36.687 6.440 1.00 0.00 O ATOM 1062 NE2 GLN A 74 -16.379 -35.813 6.728 1.00 0.00 N ATOM 0 H GLN A 74 -14.022 -38.852 9.766 1.00 0.00 H new ATOM 0 HA GLN A 74 -16.559 -37.795 10.970 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -15.229 -36.998 8.813 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -15.826 -38.471 8.075 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -18.189 -37.771 8.722 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -17.539 -36.253 9.307 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -15.575 -35.654 7.335 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -16.384 -35.437 5.780 1.00 0.00 H new ATOM 1071 N GLU A 75 -16.183 -40.789 9.731 1.00 0.00 N ATOM 1072 CA GLU A 75 -16.882 -42.105 9.645 1.00 0.00 C ATOM 1073 C GLU A 75 -16.707 -42.881 10.953 1.00 0.00 C ATOM 1074 O GLU A 75 -17.595 -43.588 11.390 1.00 0.00 O ATOM 1075 CB GLU A 75 -16.209 -42.843 8.489 1.00 0.00 C ATOM 1076 CG GLU A 75 -17.225 -43.763 7.808 1.00 0.00 C ATOM 1077 CD GLU A 75 -17.197 -45.138 8.478 1.00 0.00 C ATOM 1078 OE1 GLU A 75 -16.115 -45.591 8.812 1.00 0.00 O ATOM 1079 OE2 GLU A 75 -18.259 -45.716 8.644 1.00 0.00 O ATOM 0 H GLU A 75 -15.205 -40.797 9.443 1.00 0.00 H new ATOM 0 HA GLU A 75 -17.954 -41.992 9.482 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -15.811 -42.127 7.769 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -15.365 -43.426 8.858 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -18.224 -43.333 7.877 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -16.992 -43.858 6.748 1.00 0.00 H new ATOM 1086 N PHE A 76 -15.568 -42.753 11.581 1.00 0.00 N ATOM 1087 CA PHE A 76 -15.334 -43.482 12.861 1.00 0.00 C ATOM 1088 C PHE A 76 -15.138 -42.486 14.008 1.00 0.00 C ATOM 1089 O PHE A 76 -14.027 -42.190 14.403 1.00 0.00 O ATOM 1090 CB PHE A 76 -14.059 -44.293 12.631 1.00 0.00 C ATOM 1091 CG PHE A 76 -13.778 -45.143 13.846 1.00 0.00 C ATOM 1092 CD1 PHE A 76 -14.704 -46.114 14.251 1.00 0.00 C ATOM 1093 CD2 PHE A 76 -12.594 -44.962 14.570 1.00 0.00 C ATOM 1094 CE1 PHE A 76 -14.444 -46.902 15.379 1.00 0.00 C ATOM 1095 CE2 PHE A 76 -12.335 -45.749 15.698 1.00 0.00 C ATOM 1096 CZ PHE A 76 -13.259 -46.719 16.103 1.00 0.00 C ATOM 0 H PHE A 76 -14.790 -42.175 11.263 1.00 0.00 H new ATOM 0 HA PHE A 76 -16.176 -44.118 13.133 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -14.171 -44.925 11.750 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -13.220 -43.625 12.439 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -15.618 -46.254 13.693 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.880 -44.214 14.258 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -15.157 -47.651 15.691 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -11.421 -45.608 16.256 1.00 0.00 H new ATOM 0 HZ PHE A 76 -13.058 -47.326 16.973 1.00 0.00 H new ATOM 1106 N GLY A 77 -16.210 -41.968 14.542 1.00 0.00 N ATOM 1107 CA GLY A 77 -16.093 -40.991 15.663 1.00 0.00 C ATOM 1108 C GLY A 77 -17.416 -40.934 16.428 1.00 0.00 C ATOM 1109 O GLY A 77 -17.507 -41.361 17.562 1.00 0.00 O ATOM 0 H GLY A 77 -17.164 -42.179 14.250 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -15.285 -41.285 16.333 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.842 -40.004 15.275 1.00 0.00 H new ATOM 1113 N ARG A 78 -18.443 -40.411 15.813 1.00 0.00 N ATOM 1114 CA ARG A 78 -19.765 -40.328 16.499 1.00 0.00 C ATOM 1115 C ARG A 78 -20.716 -41.385 15.936 1.00 0.00 C ATOM 1116 O ARG A 78 -21.189 -41.277 14.821 1.00 0.00 O ATOM 1117 CB ARG A 78 -20.282 -38.920 16.194 1.00 0.00 C ATOM 1118 CG ARG A 78 -21.613 -38.697 16.915 1.00 0.00 C ATOM 1119 CD ARG A 78 -21.351 -38.093 18.297 1.00 0.00 C ATOM 1120 NE ARG A 78 -21.639 -36.641 18.142 1.00 0.00 N ATOM 1121 CZ ARG A 78 -21.978 -35.930 19.182 1.00 0.00 C ATOM 1122 NH1 ARG A 78 -21.276 -36.002 20.280 1.00 0.00 N ATOM 1123 NH2 ARG A 78 -23.020 -35.147 19.125 1.00 0.00 N ATOM 0 H ARG A 78 -18.423 -40.037 14.864 1.00 0.00 H new ATOM 0 HA ARG A 78 -19.688 -40.509 17.571 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -19.553 -38.176 16.516 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -20.413 -38.794 15.119 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -22.248 -38.032 16.330 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -22.147 -39.642 17.015 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -21.993 -38.544 19.053 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -20.321 -38.260 18.612 1.00 0.00 H new ATOM 0 HE ARG A 78 -21.571 -36.202 17.224 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -20.462 -36.614 20.325 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -21.542 -35.446 21.093 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -23.569 -35.091 18.267 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -23.285 -34.591 19.938 1.00 0.00 H new ATOM 1137 N THR A 79 -20.998 -42.408 16.698 1.00 0.00 N ATOM 1138 CA THR A 79 -21.917 -43.475 16.205 1.00 0.00 C ATOM 1139 C THR A 79 -22.798 -43.994 17.347 1.00 0.00 C ATOM 1140 O THR A 79 -23.394 -45.049 17.248 1.00 0.00 O ATOM 1141 CB THR A 79 -20.997 -44.585 15.695 1.00 0.00 C ATOM 1142 OG1 THR A 79 -19.841 -44.010 15.101 1.00 0.00 O ATOM 1143 CG2 THR A 79 -21.740 -45.426 14.655 1.00 0.00 C ATOM 0 H THR A 79 -20.632 -42.551 17.639 1.00 0.00 H new ATOM 0 HA THR A 79 -22.589 -43.110 15.429 1.00 0.00 H new ATOM 0 HB THR A 79 -20.698 -45.219 16.530 1.00 0.00 H new ATOM 0 HG1 THR A 79 -19.252 -44.722 14.776 1.00 0.00 H new ATOM 0 HG21 THR A 79 -21.084 -46.217 14.291 1.00 0.00 H new ATOM 0 HG22 THR A 79 -22.625 -45.869 15.111 1.00 0.00 H new ATOM 0 HG23 THR A 79 -22.040 -44.792 13.821 1.00 0.00 H new ATOM 1151 N GLY A 80 -22.886 -43.265 18.428 1.00 0.00 N ATOM 1152 CA GLY A 80 -23.731 -43.722 19.569 1.00 0.00 C ATOM 1153 C GLY A 80 -25.132 -43.115 19.452 1.00 0.00 C ATOM 1154 O GLY A 80 -25.909 -43.144 20.387 1.00 0.00 O ATOM 0 H GLY A 80 -22.410 -42.374 18.570 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -23.795 -44.810 19.573 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -23.274 -43.426 20.513 1.00 0.00 H new ATOM 1158 N LEU A 81 -25.465 -42.566 18.311 1.00 0.00 N ATOM 1159 CA LEU A 81 -26.819 -41.958 18.136 1.00 0.00 C ATOM 1160 C LEU A 81 -27.010 -41.499 16.684 1.00 0.00 C ATOM 1161 O LEU A 81 -26.603 -40.413 16.321 1.00 0.00 O ATOM 1162 CB LEU A 81 -26.852 -40.756 19.087 1.00 0.00 C ATOM 1163 CG LEU A 81 -25.664 -39.830 18.798 1.00 0.00 C ATOM 1164 CD1 LEU A 81 -26.177 -38.449 18.385 1.00 0.00 C ATOM 1165 CD2 LEU A 81 -24.804 -39.695 20.058 1.00 0.00 C ATOM 0 H LEU A 81 -24.858 -42.513 17.493 1.00 0.00 H new ATOM 0 HA LEU A 81 -27.617 -42.668 18.355 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -27.788 -40.210 18.965 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -26.815 -41.098 20.121 1.00 0.00 H new ATOM 0 HG LEU A 81 -25.066 -40.252 17.990 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -25.331 -37.793 18.180 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -26.790 -38.542 17.488 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -26.776 -38.027 19.192 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -23.959 -39.037 19.853 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -25.404 -39.275 20.865 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -24.435 -40.677 20.354 1.00 0.00 H new ATOM 1177 N PRO A 82 -27.623 -42.345 15.896 1.00 0.00 N ATOM 1178 CA PRO A 82 -27.865 -42.013 14.471 1.00 0.00 C ATOM 1179 C PRO A 82 -28.963 -40.953 14.347 1.00 0.00 C ATOM 1180 O PRO A 82 -30.126 -41.222 14.575 1.00 0.00 O ATOM 1181 CB PRO A 82 -28.318 -43.338 13.864 1.00 0.00 C ATOM 1182 CG PRO A 82 -28.881 -44.117 15.009 1.00 0.00 C ATOM 1183 CD PRO A 82 -28.146 -43.673 16.248 1.00 0.00 C ATOM 0 HA PRO A 82 -26.987 -41.601 13.974 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -29.067 -43.181 13.088 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -27.484 -43.865 13.400 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -29.951 -43.936 15.110 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -28.753 -45.187 14.847 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -28.811 -43.624 17.110 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -27.342 -44.363 16.504 1.00 0.00 H new ATOM 1191 N ASP A 83 -28.601 -39.750 13.988 1.00 0.00 N ATOM 1192 CA ASP A 83 -29.622 -38.671 13.848 1.00 0.00 C ATOM 1193 C ASP A 83 -30.294 -38.754 12.474 1.00 0.00 C ATOM 1194 O ASP A 83 -30.045 -37.946 11.601 1.00 0.00 O ATOM 1195 CB ASP A 83 -28.839 -37.364 13.986 1.00 0.00 C ATOM 1196 CG ASP A 83 -28.949 -36.852 15.422 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -29.877 -36.110 15.697 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -28.102 -37.210 16.224 1.00 0.00 O ATOM 0 H ASP A 83 -27.642 -39.468 13.786 1.00 0.00 H new ATOM 0 HA ASP A 83 -30.414 -38.751 14.593 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -27.793 -37.525 13.725 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -29.229 -36.619 13.292 1.00 0.00 H new ATOM 1203 N LEU A 84 -31.142 -39.729 12.278 1.00 0.00 N ATOM 1204 CA LEU A 84 -31.832 -39.868 10.960 1.00 0.00 C ATOM 1205 C LEU A 84 -32.667 -38.618 10.663 1.00 0.00 C ATOM 1206 O LEU A 84 -32.925 -38.293 9.520 1.00 0.00 O ATOM 1207 CB LEU A 84 -32.737 -41.091 11.112 1.00 0.00 C ATOM 1208 CG LEU A 84 -31.876 -42.345 11.280 1.00 0.00 C ATOM 1209 CD1 LEU A 84 -32.615 -43.360 12.154 1.00 0.00 C ATOM 1210 CD2 LEU A 84 -31.602 -42.960 9.905 1.00 0.00 C ATOM 0 H LEU A 84 -31.387 -40.435 12.972 1.00 0.00 H new ATOM 0 HA LEU A 84 -31.127 -39.982 10.137 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -33.391 -40.968 11.975 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -33.379 -41.192 10.237 1.00 0.00 H new ATOM 0 HG LEU A 84 -30.932 -42.077 11.755 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -32.001 -44.253 12.273 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -32.812 -42.922 13.132 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -33.559 -43.629 11.680 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -30.989 -43.854 10.022 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -32.547 -43.227 9.431 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -31.075 -42.237 9.282 1.00 0.00 H new ATOM 1222 N SER A 85 -33.089 -37.917 11.681 1.00 0.00 N ATOM 1223 CA SER A 85 -33.906 -36.688 11.458 1.00 0.00 C ATOM 1224 C SER A 85 -33.131 -35.683 10.602 1.00 0.00 C ATOM 1225 O SER A 85 -33.703 -34.942 9.827 1.00 0.00 O ATOM 1226 CB SER A 85 -34.158 -36.119 12.854 1.00 0.00 C ATOM 1227 OG SER A 85 -35.415 -36.582 13.331 1.00 0.00 O ATOM 0 H SER A 85 -32.903 -38.142 12.658 1.00 0.00 H new ATOM 0 HA SER A 85 -34.836 -36.903 10.931 1.00 0.00 H new ATOM 0 HB2 SER A 85 -33.363 -36.426 13.533 1.00 0.00 H new ATOM 0 HB3 SER A 85 -34.147 -35.030 12.822 1.00 0.00 H new ATOM 0 HG SER A 85 -35.578 -36.220 14.227 1.00 0.00 H new ATOM 1233 N SER A 86 -31.832 -35.654 10.738 1.00 0.00 N ATOM 1234 CA SER A 86 -31.016 -34.699 9.933 1.00 0.00 C ATOM 1235 C SER A 86 -30.029 -35.463 9.047 1.00 0.00 C ATOM 1236 O SER A 86 -28.868 -35.117 8.953 1.00 0.00 O ATOM 1237 CB SER A 86 -30.268 -33.853 10.963 1.00 0.00 C ATOM 1238 OG SER A 86 -29.851 -32.637 10.356 1.00 0.00 O ATOM 0 H SER A 86 -31.301 -36.251 11.372 1.00 0.00 H new ATOM 0 HA SER A 86 -31.629 -34.088 9.271 1.00 0.00 H new ATOM 0 HB2 SER A 86 -30.912 -33.645 11.817 1.00 0.00 H new ATOM 0 HB3 SER A 86 -29.404 -34.399 11.341 1.00 0.00 H new ATOM 0 HG SER A 86 -29.372 -32.091 11.014 1.00 0.00 H new ATOM 1244 N MET A 87 -30.485 -36.502 8.397 1.00 0.00 N ATOM 1245 CA MET A 87 -29.577 -37.291 7.516 1.00 0.00 C ATOM 1246 C MET A 87 -29.962 -37.091 6.048 1.00 0.00 C ATOM 1247 O MET A 87 -31.127 -37.039 5.704 1.00 0.00 O ATOM 1248 CB MET A 87 -29.787 -38.747 7.934 1.00 0.00 C ATOM 1249 CG MET A 87 -28.658 -39.176 8.875 1.00 0.00 C ATOM 1250 SD MET A 87 -28.353 -40.950 8.683 1.00 0.00 S ATOM 1251 CE MET A 87 -26.794 -41.012 9.600 1.00 0.00 C ATOM 0 H MET A 87 -31.447 -36.837 8.439 1.00 0.00 H new ATOM 0 HA MET A 87 -28.535 -36.986 7.615 1.00 0.00 H new ATOM 0 HB2 MET A 87 -30.751 -38.858 8.431 1.00 0.00 H new ATOM 0 HB3 MET A 87 -29.806 -39.390 7.054 1.00 0.00 H new ATOM 0 HG2 MET A 87 -27.751 -38.614 8.652 1.00 0.00 H new ATOM 0 HG3 MET A 87 -28.926 -38.952 9.908 1.00 0.00 H new ATOM 0 HE1 MET A 87 -26.070 -41.609 9.046 1.00 0.00 H new ATOM 0 HE2 MET A 87 -26.407 -40.001 9.729 1.00 0.00 H new ATOM 0 HE3 MET A 87 -26.965 -41.463 10.578 1.00 0.00 H new ATOM 1261 N THR A 88 -28.991 -36.976 5.184 1.00 0.00 N ATOM 1262 CA THR A 88 -29.295 -36.776 3.735 1.00 0.00 C ATOM 1263 C THR A 88 -29.811 -38.077 3.116 1.00 0.00 C ATOM 1264 O THR A 88 -29.774 -39.127 3.731 1.00 0.00 O ATOM 1265 CB THR A 88 -27.964 -36.376 3.097 1.00 0.00 C ATOM 1266 OG1 THR A 88 -27.032 -37.437 3.250 1.00 0.00 O ATOM 1267 CG2 THR A 88 -27.423 -35.117 3.778 1.00 0.00 C ATOM 0 H THR A 88 -27.999 -37.012 5.417 1.00 0.00 H new ATOM 0 HA THR A 88 -30.065 -36.021 3.580 1.00 0.00 H new ATOM 0 HB THR A 88 -28.116 -36.173 2.037 1.00 0.00 H new ATOM 0 HG1 THR A 88 -26.407 -37.222 3.974 1.00 0.00 H new ATOM 0 HG21 THR A 88 -26.475 -34.835 3.321 1.00 0.00 H new ATOM 0 HG22 THR A 88 -28.139 -34.303 3.660 1.00 0.00 H new ATOM 0 HG23 THR A 88 -27.270 -35.314 4.839 1.00 0.00 H new ATOM 1275 N GLU A 89 -30.289 -38.016 1.901 1.00 0.00 N ATOM 1276 CA GLU A 89 -30.805 -39.247 1.233 1.00 0.00 C ATOM 1277 C GLU A 89 -29.716 -40.323 1.194 1.00 0.00 C ATOM 1278 O GLU A 89 -29.994 -41.503 1.284 1.00 0.00 O ATOM 1279 CB GLU A 89 -31.181 -38.805 -0.184 1.00 0.00 C ATOM 1280 CG GLU A 89 -29.938 -38.278 -0.909 1.00 0.00 C ATOM 1281 CD GLU A 89 -30.365 -37.502 -2.157 1.00 0.00 C ATOM 1282 OE1 GLU A 89 -31.116 -36.552 -2.012 1.00 0.00 O ATOM 1283 OE2 GLU A 89 -29.933 -37.873 -3.237 1.00 0.00 O ATOM 0 H GLU A 89 -30.344 -37.165 1.341 1.00 0.00 H new ATOM 0 HA GLU A 89 -31.656 -39.678 1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -31.607 -39.643 -0.735 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -31.945 -38.029 -0.142 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -29.363 -37.632 -0.245 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -29.288 -39.107 -1.188 1.00 0.00 H new ATOM 1290 N GLU A 90 -28.478 -39.924 1.064 1.00 0.00 N ATOM 1291 CA GLU A 90 -27.372 -40.923 1.022 1.00 0.00 C ATOM 1292 C GLU A 90 -27.013 -41.373 2.441 1.00 0.00 C ATOM 1293 O GLU A 90 -26.645 -42.509 2.664 1.00 0.00 O ATOM 1294 CB GLU A 90 -26.192 -40.196 0.377 1.00 0.00 C ATOM 1295 CG GLU A 90 -26.580 -39.731 -1.029 1.00 0.00 C ATOM 1296 CD GLU A 90 -25.359 -39.811 -1.947 1.00 0.00 C ATOM 1297 OE1 GLU A 90 -24.410 -39.084 -1.703 1.00 0.00 O ATOM 1298 OE2 GLU A 90 -25.393 -40.599 -2.877 1.00 0.00 O ATOM 0 H GLU A 90 -28.186 -38.950 0.985 1.00 0.00 H new ATOM 0 HA GLU A 90 -27.650 -41.817 0.463 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -25.902 -39.340 0.987 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -25.328 -40.858 0.326 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -27.384 -40.354 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -26.956 -38.709 -0.995 1.00 0.00 H new ATOM 1305 N GLU A 91 -27.118 -40.491 3.402 1.00 0.00 N ATOM 1306 CA GLU A 91 -26.783 -40.874 4.808 1.00 0.00 C ATOM 1307 C GLU A 91 -27.619 -42.086 5.235 1.00 0.00 C ATOM 1308 O GLU A 91 -27.092 -43.143 5.525 1.00 0.00 O ATOM 1309 CB GLU A 91 -27.139 -39.649 5.655 1.00 0.00 C ATOM 1310 CG GLU A 91 -25.977 -39.324 6.597 1.00 0.00 C ATOM 1311 CD GLU A 91 -24.774 -38.854 5.778 1.00 0.00 C ATOM 1312 OE1 GLU A 91 -24.789 -37.715 5.341 1.00 0.00 O ATOM 1313 OE2 GLU A 91 -23.858 -39.640 5.602 1.00 0.00 O ATOM 0 H GLU A 91 -27.420 -39.525 3.275 1.00 0.00 H new ATOM 0 HA GLU A 91 -25.735 -41.152 4.922 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -27.347 -38.796 5.010 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -28.044 -39.842 6.230 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -26.274 -38.550 7.305 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -25.711 -40.205 7.181 1.00 0.00 H new ATOM 1320 N GLN A 92 -28.917 -41.941 5.263 1.00 0.00 N ATOM 1321 CA GLN A 92 -29.787 -43.089 5.659 1.00 0.00 C ATOM 1322 C GLN A 92 -29.587 -44.247 4.678 1.00 0.00 C ATOM 1323 O GLN A 92 -29.801 -45.398 5.006 1.00 0.00 O ATOM 1324 CB GLN A 92 -31.218 -42.555 5.578 1.00 0.00 C ATOM 1325 CG GLN A 92 -31.377 -41.370 6.533 1.00 0.00 C ATOM 1326 CD GLN A 92 -32.828 -41.288 7.010 1.00 0.00 C ATOM 1327 OE1 GLN A 92 -33.436 -42.292 7.318 1.00 0.00 O ATOM 1328 NE2 GLN A 92 -33.411 -40.122 7.086 1.00 0.00 N ATOM 0 H GLN A 92 -29.412 -41.080 5.030 1.00 0.00 H new ATOM 0 HA GLN A 92 -29.556 -43.464 6.656 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -31.445 -42.246 4.558 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -31.926 -43.342 5.837 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -30.709 -41.485 7.386 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -31.096 -40.444 6.031 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -32.900 -39.278 6.827 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -34.378 -40.055 7.404 1.00 0.00 H new ATOM 1337 N ILE A 93 -29.170 -43.946 3.475 1.00 0.00 N ATOM 1338 CA ILE A 93 -28.946 -45.023 2.466 1.00 0.00 C ATOM 1339 C ILE A 93 -27.698 -45.829 2.842 1.00 0.00 C ATOM 1340 O ILE A 93 -27.692 -47.042 2.783 1.00 0.00 O ATOM 1341 CB ILE A 93 -28.765 -44.280 1.130 1.00 0.00 C ATOM 1342 CG1 ILE A 93 -30.049 -44.417 0.305 1.00 0.00 C ATOM 1343 CG2 ILE A 93 -27.584 -44.863 0.343 1.00 0.00 C ATOM 1344 CD1 ILE A 93 -29.878 -43.709 -1.040 1.00 0.00 C ATOM 0 H ILE A 93 -28.975 -43.000 3.148 1.00 0.00 H new ATOM 0 HA ILE A 93 -29.768 -45.736 2.410 1.00 0.00 H new ATOM 0 HB ILE A 93 -28.560 -43.229 1.333 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -30.279 -45.470 0.145 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -30.890 -43.986 0.849 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -27.473 -44.324 -0.598 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -26.671 -44.762 0.929 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -27.769 -45.917 0.138 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -30.794 -43.809 -1.623 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -29.669 -42.653 -0.871 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -29.049 -44.160 -1.586 1.00 0.00 H new ATOM 1356 N ALA A 94 -26.644 -45.162 3.232 1.00 0.00 N ATOM 1357 CA ALA A 94 -25.401 -45.894 3.617 1.00 0.00 C ATOM 1358 C ALA A 94 -25.692 -46.813 4.804 1.00 0.00 C ATOM 1359 O ALA A 94 -25.085 -47.855 4.960 1.00 0.00 O ATOM 1360 CB ALA A 94 -24.401 -44.806 4.010 1.00 0.00 C ATOM 0 H ALA A 94 -26.590 -44.146 3.301 1.00 0.00 H new ATOM 0 HA ALA A 94 -25.017 -46.519 2.811 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -23.459 -45.267 4.306 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -24.230 -44.145 3.160 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -24.800 -44.229 4.844 1.00 0.00 H new ATOM 1366 N TYR A 95 -26.623 -46.435 5.638 1.00 0.00 N ATOM 1367 CA TYR A 95 -26.967 -47.280 6.815 1.00 0.00 C ATOM 1368 C TYR A 95 -28.001 -48.338 6.417 1.00 0.00 C ATOM 1369 O TYR A 95 -27.870 -49.502 6.745 1.00 0.00 O ATOM 1370 CB TYR A 95 -27.556 -46.306 7.835 1.00 0.00 C ATOM 1371 CG TYR A 95 -27.312 -46.821 9.233 1.00 0.00 C ATOM 1372 CD1 TYR A 95 -26.019 -47.182 9.633 1.00 0.00 C ATOM 1373 CD2 TYR A 95 -28.379 -46.937 10.131 1.00 0.00 C ATOM 1374 CE1 TYR A 95 -25.795 -47.658 10.930 1.00 0.00 C ATOM 1375 CE2 TYR A 95 -28.156 -47.413 11.427 1.00 0.00 C ATOM 1376 CZ TYR A 95 -26.862 -47.774 11.828 1.00 0.00 C ATOM 1377 OH TYR A 95 -26.642 -48.244 13.106 1.00 0.00 O ATOM 0 H TYR A 95 -27.162 -45.573 5.553 1.00 0.00 H new ATOM 0 HA TYR A 95 -26.105 -47.815 7.213 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -27.103 -45.322 7.716 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -28.626 -46.187 7.663 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -25.195 -47.093 8.941 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -29.376 -46.659 9.823 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -24.798 -47.936 11.238 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -28.980 -47.502 12.119 1.00 0.00 H new ATOM 0 HH TYR A 95 -27.489 -48.261 13.599 1.00 0.00 H new ATOM 1387 N ALA A 96 -29.026 -47.941 5.709 1.00 0.00 N ATOM 1388 CA ALA A 96 -30.070 -48.920 5.285 1.00 0.00 C ATOM 1389 C ALA A 96 -29.501 -49.877 4.235 1.00 0.00 C ATOM 1390 O ALA A 96 -29.947 -51.000 4.101 1.00 0.00 O ATOM 1391 CB ALA A 96 -31.192 -48.073 4.685 1.00 0.00 C ATOM 0 H ALA A 96 -29.185 -46.980 5.406 1.00 0.00 H new ATOM 0 HA ALA A 96 -30.422 -49.531 6.116 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -31.999 -48.724 4.349 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -31.571 -47.384 5.440 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -30.807 -47.506 3.838 1.00 0.00 H new ATOM 1397 N MET A 97 -28.517 -49.443 3.492 1.00 0.00 N ATOM 1398 CA MET A 97 -27.918 -50.329 2.455 1.00 0.00 C ATOM 1399 C MET A 97 -26.879 -51.247 3.100 1.00 0.00 C ATOM 1400 O MET A 97 -26.648 -52.352 2.649 1.00 0.00 O ATOM 1401 CB MET A 97 -27.252 -49.381 1.456 1.00 0.00 C ATOM 1402 CG MET A 97 -26.744 -50.178 0.253 1.00 0.00 C ATOM 1403 SD MET A 97 -25.283 -49.363 -0.437 1.00 0.00 S ATOM 1404 CE MET A 97 -26.058 -47.765 -0.786 1.00 0.00 C ATOM 0 H MET A 97 -28.103 -48.513 3.560 1.00 0.00 H new ATOM 0 HA MET A 97 -28.658 -50.967 1.972 1.00 0.00 H new ATOM 0 HB2 MET A 97 -27.964 -48.623 1.129 1.00 0.00 H new ATOM 0 HB3 MET A 97 -26.424 -48.856 1.933 1.00 0.00 H new ATOM 0 HG2 MET A 97 -26.497 -51.196 0.555 1.00 0.00 H new ATOM 0 HG3 MET A 97 -27.525 -50.251 -0.504 1.00 0.00 H new ATOM 0 HE1 MET A 97 -25.595 -47.321 -1.667 1.00 0.00 H new ATOM 0 HE2 MET A 97 -27.123 -47.909 -0.970 1.00 0.00 H new ATOM 0 HE3 MET A 97 -25.924 -47.101 0.068 1.00 0.00 H new ATOM 1414 N GLN A 98 -26.254 -50.797 4.155 1.00 0.00 N ATOM 1415 CA GLN A 98 -25.234 -51.645 4.834 1.00 0.00 C ATOM 1416 C GLN A 98 -25.915 -52.836 5.510 1.00 0.00 C ATOM 1417 O GLN A 98 -25.360 -53.914 5.597 1.00 0.00 O ATOM 1418 CB GLN A 98 -24.581 -50.735 5.876 1.00 0.00 C ATOM 1419 CG GLN A 98 -23.428 -51.480 6.553 1.00 0.00 C ATOM 1420 CD GLN A 98 -22.311 -50.493 6.893 1.00 0.00 C ATOM 1421 OE1 GLN A 98 -21.372 -50.336 6.138 1.00 0.00 O ATOM 1422 NE2 GLN A 98 -22.374 -49.814 8.007 1.00 0.00 N ATOM 0 H GLN A 98 -26.406 -49.880 4.575 1.00 0.00 H new ATOM 0 HA GLN A 98 -24.499 -52.048 4.136 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -24.212 -49.826 5.401 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -25.317 -50.429 6.620 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -23.781 -51.972 7.459 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -23.049 -52.261 5.894 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -23.162 -49.946 8.641 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -21.635 -49.152 8.243 1.00 0.00 H new ATOM 1431 N MET A 99 -27.118 -52.647 5.986 1.00 0.00 N ATOM 1432 CA MET A 99 -27.844 -53.766 6.654 1.00 0.00 C ATOM 1433 C MET A 99 -28.609 -54.594 5.617 1.00 0.00 C ATOM 1434 O MET A 99 -28.942 -55.740 5.850 1.00 0.00 O ATOM 1435 CB MET A 99 -28.816 -53.087 7.621 1.00 0.00 C ATOM 1436 CG MET A 99 -28.307 -53.245 9.055 1.00 0.00 C ATOM 1437 SD MET A 99 -28.750 -54.887 9.675 1.00 0.00 S ATOM 1438 CE MET A 99 -30.510 -54.561 9.940 1.00 0.00 C ATOM 0 H MET A 99 -27.629 -51.765 5.941 1.00 0.00 H new ATOM 0 HA MET A 99 -27.167 -54.448 7.169 1.00 0.00 H new ATOM 0 HB2 MET A 99 -28.913 -52.030 7.373 1.00 0.00 H new ATOM 0 HB3 MET A 99 -29.808 -53.529 7.526 1.00 0.00 H new ATOM 0 HG2 MET A 99 -27.225 -53.113 9.085 1.00 0.00 H new ATOM 0 HG3 MET A 99 -28.740 -52.475 9.693 1.00 0.00 H new ATOM 0 HE1 MET A 99 -30.764 -54.761 10.981 1.00 0.00 H new ATOM 0 HE2 MET A 99 -30.726 -53.518 9.708 1.00 0.00 H new ATOM 0 HE3 MET A 99 -31.101 -55.207 9.291 1.00 0.00 H new ATOM 1448 N SER A 100 -28.892 -54.024 4.475 1.00 0.00 N ATOM 1449 CA SER A 100 -29.637 -54.779 3.425 1.00 0.00 C ATOM 1450 C SER A 100 -28.681 -55.677 2.635 1.00 0.00 C ATOM 1451 O SER A 100 -29.067 -56.709 2.122 1.00 0.00 O ATOM 1452 CB SER A 100 -30.239 -53.706 2.517 1.00 0.00 C ATOM 1453 OG SER A 100 -31.308 -54.269 1.769 1.00 0.00 O ATOM 0 H SER A 100 -28.639 -53.068 4.224 1.00 0.00 H new ATOM 0 HA SER A 100 -30.401 -55.429 3.850 1.00 0.00 H new ATOM 0 HB2 SER A 100 -30.599 -52.868 3.114 1.00 0.00 H new ATOM 0 HB3 SER A 100 -29.477 -53.313 1.844 1.00 0.00 H new ATOM 0 HG SER A 100 -31.697 -53.583 1.187 1.00 0.00 H new ATOM 1459 N LEU A 101 -27.436 -55.292 2.534 1.00 0.00 N ATOM 1460 CA LEU A 101 -26.456 -56.126 1.775 1.00 0.00 C ATOM 1461 C LEU A 101 -26.330 -57.509 2.420 1.00 0.00 C ATOM 1462 O LEU A 101 -26.229 -58.512 1.741 1.00 0.00 O ATOM 1463 CB LEU A 101 -25.132 -55.369 1.868 1.00 0.00 C ATOM 1464 CG LEU A 101 -25.186 -54.134 0.967 1.00 0.00 C ATOM 1465 CD1 LEU A 101 -24.249 -53.057 1.519 1.00 0.00 C ATOM 1466 CD2 LEU A 101 -24.743 -54.517 -0.447 1.00 0.00 C ATOM 0 H LEU A 101 -27.055 -54.439 2.943 1.00 0.00 H new ATOM 0 HA LEU A 101 -26.762 -56.283 0.741 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -24.943 -55.072 2.899 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -24.309 -56.017 1.566 1.00 0.00 H new ATOM 0 HG LEU A 101 -26.205 -53.749 0.939 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.288 -52.177 0.877 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -24.562 -52.785 2.527 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -23.229 -53.441 1.547 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -24.781 -53.638 -1.091 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -23.723 -54.901 -0.417 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -25.409 -55.285 -0.841 1.00 0.00 H new ATOM 1478 N GLN A 102 -26.338 -57.568 3.724 1.00 0.00 N ATOM 1479 CA GLN A 102 -26.221 -58.885 4.415 1.00 0.00 C ATOM 1480 C GLN A 102 -27.581 -59.307 4.978 1.00 0.00 C ATOM 1481 O GLN A 102 -27.680 -59.792 6.088 1.00 0.00 O ATOM 1482 CB GLN A 102 -25.221 -58.651 5.548 1.00 0.00 C ATOM 1483 CG GLN A 102 -23.821 -59.064 5.086 1.00 0.00 C ATOM 1484 CD GLN A 102 -22.945 -59.355 6.306 1.00 0.00 C ATOM 1485 OE1 GLN A 102 -22.294 -60.378 6.371 1.00 0.00 O ATOM 1486 NE2 GLN A 102 -22.901 -58.490 7.283 1.00 0.00 N ATOM 0 H GLN A 102 -26.421 -56.761 4.342 1.00 0.00 H new ATOM 0 HA GLN A 102 -25.895 -59.678 3.742 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -25.224 -57.601 5.839 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -25.510 -59.227 6.427 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -23.882 -59.947 4.450 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -23.376 -58.270 4.486 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -23.448 -57.631 7.228 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -22.320 -58.674 8.101 1.00 0.00 H new ATOM 1495 N GLY A 103 -28.628 -59.125 4.219 1.00 0.00 N ATOM 1496 CA GLY A 103 -29.984 -59.513 4.706 1.00 0.00 C ATOM 1497 C GLY A 103 -30.402 -60.832 4.055 1.00 0.00 C ATOM 1498 O GLY A 103 -29.757 -61.848 4.219 1.00 0.00 O ATOM 0 H GLY A 103 -28.603 -58.724 3.282 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -29.976 -59.617 5.791 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -30.705 -58.732 4.466 1.00 0.00 H new ATOM 1502 N ALA A 104 -31.481 -60.823 3.318 1.00 0.00 N ATOM 1503 CA ALA A 104 -31.944 -62.076 2.655 1.00 0.00 C ATOM 1504 C ALA A 104 -32.923 -61.748 1.524 1.00 0.00 C ATOM 1505 O ALA A 104 -34.125 -61.829 1.687 1.00 0.00 O ATOM 1506 CB ALA A 104 -32.647 -62.870 3.757 1.00 0.00 C ATOM 0 H ALA A 104 -32.061 -60.002 3.147 1.00 0.00 H new ATOM 0 HA ALA A 104 -31.121 -62.635 2.210 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -33.018 -63.810 3.348 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -31.942 -63.078 4.562 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -33.483 -62.289 4.147 1.00 0.00 H new ATOM 1512 N GLU A 105 -32.415 -61.378 0.378 1.00 0.00 N ATOM 1513 CA GLU A 105 -33.314 -61.044 -0.765 1.00 0.00 C ATOM 1514 C GLU A 105 -33.705 -62.318 -1.521 1.00 0.00 C ATOM 1515 O GLU A 105 -33.405 -62.476 -2.688 1.00 0.00 O ATOM 1516 CB GLU A 105 -32.487 -60.120 -1.661 1.00 0.00 C ATOM 1517 CG GLU A 105 -32.605 -58.677 -1.161 1.00 0.00 C ATOM 1518 CD GLU A 105 -31.273 -58.232 -0.554 1.00 0.00 C ATOM 1519 OE1 GLU A 105 -30.315 -58.110 -1.300 1.00 0.00 O ATOM 1520 OE2 GLU A 105 -31.232 -58.020 0.647 1.00 0.00 O ATOM 0 H GLU A 105 -31.417 -61.293 0.184 1.00 0.00 H new ATOM 0 HA GLU A 105 -34.241 -60.573 -0.438 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -31.443 -60.432 -1.657 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -32.836 -60.188 -2.691 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -32.879 -58.018 -1.985 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -33.398 -58.603 -0.417 1.00 0.00 H new ATOM 1527 N PHE A 106 -34.372 -63.227 -0.861 1.00 0.00 N ATOM 1528 CA PHE A 106 -34.784 -64.491 -1.539 1.00 0.00 C ATOM 1529 C PHE A 106 -36.021 -65.080 -0.853 1.00 0.00 C ATOM 1530 O PHE A 106 -35.916 -65.926 0.014 1.00 0.00 O ATOM 1531 CB PHE A 106 -33.586 -65.430 -1.386 1.00 0.00 C ATOM 1532 CG PHE A 106 -33.365 -66.183 -2.677 1.00 0.00 C ATOM 1533 CD1 PHE A 106 -34.270 -67.176 -3.071 1.00 0.00 C ATOM 1534 CD2 PHE A 106 -32.256 -65.888 -3.479 1.00 0.00 C ATOM 1535 CE1 PHE A 106 -34.065 -67.874 -4.268 1.00 0.00 C ATOM 1536 CE2 PHE A 106 -32.052 -66.585 -4.676 1.00 0.00 C ATOM 1537 CZ PHE A 106 -32.957 -67.577 -5.070 1.00 0.00 C ATOM 0 H PHE A 106 -34.649 -63.149 0.118 1.00 0.00 H new ATOM 0 HA PHE A 106 -35.047 -64.333 -2.585 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -32.694 -64.859 -1.129 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -33.762 -66.131 -0.570 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -35.126 -67.404 -2.452 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -31.558 -65.123 -3.174 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -34.762 -68.641 -4.572 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -31.197 -66.357 -5.295 1.00 0.00 H new ATOM 0 HZ PHE A 106 -32.800 -68.114 -5.994 1.00 0.00 H new ATOM 1547 N GLY A 107 -37.189 -64.637 -1.235 1.00 0.00 N ATOM 1548 CA GLY A 107 -38.433 -65.169 -0.607 1.00 0.00 C ATOM 1549 C GLY A 107 -38.819 -64.291 0.585 1.00 0.00 C ATOM 1550 O GLY A 107 -39.947 -63.855 0.706 1.00 0.00 O ATOM 0 H GLY A 107 -37.335 -63.929 -1.955 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -39.243 -65.186 -1.337 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -38.277 -66.197 -0.280 1.00 0.00 H new ATOM 1554 N GLN A 108 -37.890 -64.030 1.466 1.00 0.00 N ATOM 1555 CA GLN A 108 -38.200 -63.180 2.652 1.00 0.00 C ATOM 1556 C GLN A 108 -37.841 -61.720 2.363 1.00 0.00 C ATOM 1557 O GLN A 108 -37.126 -61.087 3.116 1.00 0.00 O ATOM 1558 CB GLN A 108 -37.326 -63.736 3.777 1.00 0.00 C ATOM 1559 CG GLN A 108 -38.131 -64.746 4.597 1.00 0.00 C ATOM 1560 CD GLN A 108 -37.981 -66.138 3.983 1.00 0.00 C ATOM 1561 OE1 GLN A 108 -36.964 -66.449 3.394 1.00 0.00 O ATOM 1562 NE2 GLN A 108 -38.957 -66.997 4.095 1.00 0.00 N ATOM 0 H GLN A 108 -36.929 -64.369 1.415 1.00 0.00 H new ATOM 0 HA GLN A 108 -39.259 -63.201 2.911 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -36.439 -64.214 3.361 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -36.980 -62.925 4.418 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -37.782 -64.753 5.629 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -39.182 -64.458 4.618 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -39.811 -66.737 4.589 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -38.866 -67.928 3.689 1.00 0.00 H new ATOM 1571 N ALA A 109 -38.333 -61.182 1.279 1.00 0.00 N ATOM 1572 CA ALA A 109 -38.022 -59.763 0.941 1.00 0.00 C ATOM 1573 C ALA A 109 -39.116 -58.837 1.481 1.00 0.00 C ATOM 1574 O ALA A 109 -38.849 -57.731 1.906 1.00 0.00 O ATOM 1575 CB ALA A 109 -37.989 -59.718 -0.588 1.00 0.00 C ATOM 0 H ALA A 109 -38.937 -61.664 0.613 1.00 0.00 H new ATOM 0 HA ALA A 109 -37.081 -59.432 1.380 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -37.765 -58.703 -0.917 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -37.219 -60.397 -0.955 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -38.959 -60.022 -0.982 1.00 0.00 H new ATOM 1581 N GLU A 110 -40.345 -59.288 1.469 1.00 0.00 N ATOM 1582 CA GLU A 110 -41.474 -58.447 1.980 1.00 0.00 C ATOM 1583 C GLU A 110 -41.598 -57.160 1.155 1.00 0.00 C ATOM 1584 O GLU A 110 -42.452 -57.045 0.298 1.00 0.00 O ATOM 1585 CB GLU A 110 -41.124 -58.125 3.440 1.00 0.00 C ATOM 1586 CG GLU A 110 -42.138 -58.795 4.370 1.00 0.00 C ATOM 1587 CD GLU A 110 -41.563 -58.863 5.786 1.00 0.00 C ATOM 1588 OE1 GLU A 110 -40.389 -59.164 5.914 1.00 0.00 O ATOM 1589 OE2 GLU A 110 -42.309 -58.611 6.719 1.00 0.00 O ATOM 0 H GLU A 110 -40.618 -60.209 1.125 1.00 0.00 H new ATOM 0 HA GLU A 110 -42.430 -58.964 1.904 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -40.118 -58.476 3.669 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -41.129 -57.046 3.596 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -43.072 -58.234 4.372 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -42.369 -59.798 4.011 1.00 0.00 H new ATOM 1596 N SER A 111 -40.756 -56.196 1.407 1.00 0.00 N ATOM 1597 CA SER A 111 -40.826 -54.919 0.637 1.00 0.00 C ATOM 1598 C SER A 111 -40.205 -55.101 -0.749 1.00 0.00 C ATOM 1599 O SER A 111 -39.207 -55.777 -0.909 1.00 0.00 O ATOM 1600 CB SER A 111 -40.018 -53.915 1.458 1.00 0.00 C ATOM 1601 OG SER A 111 -39.788 -52.749 0.680 1.00 0.00 O ATOM 0 H SER A 111 -40.021 -56.236 2.113 1.00 0.00 H new ATOM 0 HA SER A 111 -41.853 -54.587 0.483 1.00 0.00 H new ATOM 0 HB2 SER A 111 -40.556 -53.657 2.370 1.00 0.00 H new ATOM 0 HB3 SER A 111 -39.069 -54.356 1.762 1.00 0.00 H new ATOM 0 HG SER A 111 -39.271 -52.102 1.205 1.00 0.00 H new ATOM 1607 N ALA A 112 -40.788 -54.503 -1.754 1.00 0.00 N ATOM 1608 CA ALA A 112 -40.234 -54.640 -3.132 1.00 0.00 C ATOM 1609 C ALA A 112 -39.821 -53.269 -3.674 1.00 0.00 C ATOM 1610 O ALA A 112 -40.365 -52.281 -3.209 1.00 0.00 O ATOM 1611 CB ALA A 112 -41.377 -55.223 -3.963 1.00 0.00 C ATOM 1612 OXT ALA A 112 -38.967 -53.232 -4.545 1.00 0.00 O ATOM 0 H ALA A 112 -41.625 -53.925 -1.680 1.00 0.00 H new ATOM 0 HA ALA A 112 -39.347 -55.273 -3.159 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -41.047 -55.354 -4.994 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -41.671 -56.188 -3.551 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -42.229 -54.543 -3.938 1.00 0.00 H new TER 1618 ALA A 112