USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 738 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 160 SER OG : rot -166:sc= 0.571 USER MOD Set 1.2: A 163 SER OG : rot 76:sc= 0.516 USER MOD Set 2.1: A 107 CYS SG : rot -140:sc= 0.516 USER MOD Set 2.2: A 138 SER OG : rot 167:sc= 0.806 USER MOD Set 3.1: A 104 THR OG1 : rot -66:sc= 0.146 USER MOD Set 3.2: A 118 SER OG : rot 180:sc= 0.143 USER MOD Set 4.1: A 90 HIS : no HD1:sc= -0.124 K(o=-0.13,f=0.9) USER MOD Set 4.2: A 92 SER OG : rot 180:sc= -0.0106 USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS : no HE2:sc=-0.00528 K(o=-0.0053,f=-2) USER MOD Single : A 83 HIS : no HE2:sc= 0.065 K(o=0.065,f=-0.47) USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 HIS : no HD1:sc= -0.828 K(o=-0.83,f=-0.18) USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 87 HIS : no HD1:sc= -0.27 K(o=-0.27,f=-0.99) USER MOD Single : A 88 HIS : no HD1:sc= -0.0613 X(o=-0.061,f=0) USER MOD Single : A 89 HIS : no HE2:sc= 0.553 K(o=0.55,f=-4.2!) USER MOD Single : A 91 HIS : no HE2:sc= 0.525 K(o=0.53,f=-3.3!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HE2:sc= 0.649 K(o=0.65,f=-2.5!) USER MOD Single : A 100 HIS : no HD1:sc= -0.132 X(o=-0.13,f=-0.32) USER MOD Single : A 101 MET CE :methyl -179:sc= 0 (180deg=-0.00533) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot -160:sc=-0.00742 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 129 ASN : amide:sc= 0.0844 K(o=0.084,f=-0.74) USER MOD Single : A 134 CYS SG : rot -14:sc= -0.919 USER MOD Single : A 145 SER OG : rot 87:sc= 0.148 USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 TYR OH : rot 42:sc= 1.09 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0.0228 USER MOD Single : A 157 ASN : amide:sc= -0.274 K(o=-0.27,f=-1) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 164 TYR OH : rot -90:sc= -0.545 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.0218 K(o=0.022,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 80 31.030 29.470 -19.034 1.00 25.00 N ATOM 2 CA MET A 80 29.836 30.188 -19.542 1.00 25.00 C ATOM 3 C MET A 80 28.665 29.253 -19.814 1.00 25.00 C ATOM 4 O MET A 80 28.796 28.198 -20.392 1.00 25.00 O ATOM 5 CB MET A 80 30.205 30.957 -20.825 1.00 25.00 C ATOM 6 CG MET A 80 31.325 31.981 -20.552 1.00 25.00 C ATOM 7 SD MET A 80 31.802 32.913 -22.046 1.00 25.00 S ATOM 8 CE MET A 80 30.475 34.161 -22.118 1.00 25.00 C ATOM 0 HA MET A 80 29.516 30.883 -18.766 1.00 25.00 H new ATOM 0 HB2 MET A 80 30.528 30.255 -21.594 1.00 25.00 H new ATOM 0 HB3 MET A 80 29.325 31.470 -21.212 1.00 25.00 H new ATOM 0 HG2 MET A 80 30.995 32.679 -19.783 1.00 25.00 H new ATOM 0 HG3 MET A 80 32.199 31.462 -20.158 1.00 25.00 H new ATOM 0 HE1 MET A 80 30.630 34.807 -22.982 1.00 25.00 H new ATOM 0 HE2 MET A 80 29.510 33.662 -22.207 1.00 25.00 H new ATOM 0 HE3 MET A 80 30.490 34.761 -21.208 1.00 25.00 H new ATOM 18 N GLY A 81 27.474 29.625 -19.314 1.00 25.00 N ATOM 19 CA GLY A 81 26.294 28.776 -19.437 1.00 25.00 C ATOM 20 C GLY A 81 26.291 27.679 -18.386 1.00 25.00 C ATOM 21 O GLY A 81 25.532 26.717 -18.455 1.00 25.00 O ATOM 0 H GLY A 81 27.311 30.505 -18.825 1.00 25.00 H new ATOM 0 HA2 GLY A 81 25.394 29.383 -19.335 1.00 25.00 H new ATOM 0 HA3 GLY A 81 26.266 28.330 -20.431 1.00 25.00 H new ATOM 25 N HIS A 82 27.167 27.828 -17.407 1.00 25.00 N ATOM 26 CA HIS A 82 27.302 26.874 -16.312 1.00 25.00 C ATOM 27 C HIS A 82 26.087 26.897 -15.374 1.00 25.00 C ATOM 28 O HIS A 82 25.602 27.963 -14.985 1.00 25.00 O ATOM 29 CB HIS A 82 28.565 27.218 -15.515 1.00 25.00 C ATOM 30 CG HIS A 82 28.840 28.690 -15.434 1.00 25.00 C ATOM 31 ND1 HIS A 82 27.936 29.624 -14.992 1.00 25.00 N ATOM 32 CD2 HIS A 82 29.951 29.406 -15.766 1.00 25.00 C ATOM 33 CE1 HIS A 82 28.503 30.822 -15.063 1.00 25.00 C ATOM 34 NE2 HIS A 82 29.730 30.751 -15.536 1.00 25.00 N ATOM 0 H HIS A 82 27.810 28.618 -17.346 1.00 25.00 H new ATOM 0 HA HIS A 82 27.369 25.873 -16.738 1.00 25.00 H new ATOM 0 HB2 HIS A 82 28.468 26.819 -14.505 1.00 25.00 H new ATOM 0 HB3 HIS A 82 29.420 26.721 -15.973 1.00 25.00 H new ATOM 0 HD1 HIS A 82 26.990 29.430 -14.665 1.00 25.00 H new ATOM 0 HD2 HIS A 82 30.868 28.985 -16.152 1.00 25.00 H new ATOM 0 HE1 HIS A 82 28.018 31.741 -14.769 1.00 25.00 H new ATOM 42 N HIS A 83 25.634 25.717 -14.975 1.00 25.00 N ATOM 43 CA HIS A 83 24.518 25.578 -14.037 1.00 25.00 C ATOM 44 C HIS A 83 25.045 24.891 -12.778 1.00 25.00 C ATOM 45 O HIS A 83 25.331 23.699 -12.789 1.00 25.00 O ATOM 46 CB HIS A 83 23.395 24.744 -14.658 1.00 25.00 C ATOM 47 CG HIS A 83 22.680 25.426 -15.784 1.00 25.00 C ATOM 48 ND1 HIS A 83 23.198 25.618 -17.041 1.00 25.00 N ATOM 49 CD2 HIS A 83 21.429 25.961 -15.836 1.00 25.00 C ATOM 50 CE1 HIS A 83 22.285 26.240 -17.778 1.00 25.00 C ATOM 51 NE2 HIS A 83 21.186 26.476 -17.092 1.00 25.00 N ATOM 0 H HIS A 83 26.025 24.829 -15.289 1.00 25.00 H new ATOM 0 HA HIS A 83 24.111 26.560 -13.794 1.00 25.00 H new ATOM 0 HB2 HIS A 83 23.812 23.805 -15.022 1.00 25.00 H new ATOM 0 HB3 HIS A 83 22.672 24.492 -13.882 1.00 25.00 H new ATOM 0 HD1 HIS A 83 24.125 25.332 -17.355 1.00 25.00 H new ATOM 0 HD2 HIS A 83 20.729 25.979 -15.014 1.00 25.00 H new ATOM 0 HE1 HIS A 83 22.426 26.518 -18.812 1.00 25.00 H new ATOM 59 N HIS A 84 25.259 25.666 -11.723 1.00 25.00 N ATOM 60 CA HIS A 84 25.953 25.162 -10.532 1.00 25.00 C ATOM 61 C HIS A 84 25.112 24.368 -9.529 1.00 25.00 C ATOM 62 O HIS A 84 25.671 23.607 -8.761 1.00 25.00 O ATOM 63 CB HIS A 84 26.622 26.329 -9.807 1.00 25.00 C ATOM 64 CG HIS A 84 27.677 27.008 -10.624 1.00 25.00 C ATOM 65 ND1 HIS A 84 27.535 28.237 -11.218 1.00 25.00 N ATOM 66 CD2 HIS A 84 28.934 26.599 -10.953 1.00 25.00 C ATOM 67 CE1 HIS A 84 28.664 28.516 -11.865 1.00 25.00 C ATOM 68 NE2 HIS A 84 29.547 27.549 -11.742 1.00 25.00 N ATOM 0 H HIS A 84 24.966 26.641 -11.662 1.00 25.00 H new ATOM 0 HA HIS A 84 26.670 24.440 -10.922 1.00 25.00 H new ATOM 0 HB2 HIS A 84 25.862 27.059 -9.529 1.00 25.00 H new ATOM 0 HB3 HIS A 84 27.068 25.965 -8.881 1.00 25.00 H new ATOM 0 HD2 HIS A 84 29.384 25.668 -10.642 1.00 25.00 H new ATOM 0 HE1 HIS A 84 28.834 29.425 -12.423 1.00 25.00 H new ATOM 0 HE2 HIS A 84 30.484 27.510 -12.144 1.00 25.00 H new ATOM 76 N HIS A 85 23.796 24.566 -9.521 1.00 25.00 N ATOM 77 CA HIS A 85 22.872 23.834 -8.623 1.00 25.00 C ATOM 78 C HIS A 85 23.389 23.572 -7.190 1.00 25.00 C ATOM 79 O HIS A 85 23.463 22.426 -6.766 1.00 25.00 O ATOM 80 CB HIS A 85 22.501 22.488 -9.258 1.00 25.00 C ATOM 81 CG HIS A 85 21.854 22.615 -10.601 1.00 25.00 C ATOM 82 ND1 HIS A 85 22.432 22.216 -11.779 1.00 25.00 N ATOM 83 CD2 HIS A 85 20.630 23.098 -10.954 1.00 25.00 C ATOM 84 CE1 HIS A 85 21.571 22.447 -12.763 1.00 25.00 C ATOM 85 NE2 HIS A 85 20.460 22.998 -12.320 1.00 25.00 N ATOM 0 H HIS A 85 23.329 25.236 -10.132 1.00 25.00 H new ATOM 0 HA HIS A 85 22.014 24.497 -8.512 1.00 25.00 H new ATOM 0 HB2 HIS A 85 23.401 21.881 -9.354 1.00 25.00 H new ATOM 0 HB3 HIS A 85 21.827 21.954 -8.589 1.00 25.00 H new ATOM 0 HD2 HIS A 85 19.900 23.500 -10.266 1.00 25.00 H new ATOM 0 HE1 HIS A 85 21.759 22.212 -13.800 1.00 25.00 H new ATOM 0 HE2 HIS A 85 19.650 23.288 -12.868 1.00 25.00 H new ATOM 93 N HIS A 86 23.728 24.636 -6.462 1.00 25.00 N ATOM 94 CA HIS A 86 24.254 24.527 -5.085 1.00 25.00 C ATOM 95 C HIS A 86 25.498 23.631 -5.022 1.00 25.00 C ATOM 96 O HIS A 86 25.560 22.669 -4.265 1.00 25.00 O ATOM 97 CB HIS A 86 23.172 24.023 -4.113 1.00 25.00 C ATOM 98 CG HIS A 86 21.933 24.862 -4.111 1.00 25.00 C ATOM 99 ND1 HIS A 86 21.780 26.016 -3.383 1.00 25.00 N ATOM 100 CD2 HIS A 86 20.753 24.702 -4.771 1.00 25.00 C ATOM 101 CE1 HIS A 86 20.565 26.501 -3.623 1.00 25.00 C ATOM 102 NE2 HIS A 86 19.897 25.743 -4.467 1.00 25.00 N ATOM 0 H HIS A 86 23.650 25.595 -6.800 1.00 25.00 H new ATOM 0 HA HIS A 86 24.551 25.529 -4.775 1.00 25.00 H new ATOM 0 HB2 HIS A 86 22.907 22.999 -4.376 1.00 25.00 H new ATOM 0 HB3 HIS A 86 23.585 23.996 -3.105 1.00 25.00 H new ATOM 0 HD2 HIS A 86 20.520 23.882 -5.434 1.00 25.00 H new ATOM 0 HE1 HIS A 86 20.175 27.405 -3.180 1.00 25.00 H new ATOM 0 HE2 HIS A 86 18.952 25.892 -4.820 1.00 25.00 H new ATOM 110 N HIS A 87 26.492 23.982 -5.829 1.00 25.00 N ATOM 111 CA HIS A 87 27.755 23.252 -5.892 1.00 25.00 C ATOM 112 C HIS A 87 28.420 23.148 -4.518 1.00 25.00 C ATOM 113 O HIS A 87 28.791 24.156 -3.914 1.00 25.00 O ATOM 114 CB HIS A 87 28.700 23.965 -6.869 1.00 25.00 C ATOM 115 CG HIS A 87 30.025 23.286 -7.037 1.00 25.00 C ATOM 116 ND1 HIS A 87 31.029 23.298 -6.100 1.00 25.00 N ATOM 117 CD2 HIS A 87 30.522 22.563 -8.078 1.00 25.00 C ATOM 118 CE1 HIS A 87 32.054 22.604 -6.580 1.00 25.00 C ATOM 119 NE2 HIS A 87 31.804 22.139 -7.787 1.00 25.00 N ATOM 0 H HIS A 87 26.446 24.782 -6.460 1.00 25.00 H new ATOM 0 HA HIS A 87 27.546 22.239 -6.236 1.00 25.00 H new ATOM 0 HB2 HIS A 87 28.214 24.037 -7.842 1.00 25.00 H new ATOM 0 HB3 HIS A 87 28.867 24.984 -6.520 1.00 25.00 H new ATOM 0 HD2 HIS A 87 29.992 22.352 -8.995 1.00 25.00 H new ATOM 0 HE1 HIS A 87 32.979 22.441 -6.047 1.00 25.00 H new ATOM 0 HE2 HIS A 87 32.423 21.585 -8.379 1.00 25.00 H new ATOM 127 N HIS A 88 28.594 21.921 -4.051 1.00 25.00 N ATOM 128 CA HIS A 88 29.256 21.641 -2.781 1.00 25.00 C ATOM 129 C HIS A 88 30.484 20.788 -3.067 1.00 25.00 C ATOM 130 O HIS A 88 30.555 20.136 -4.105 1.00 25.00 O ATOM 131 CB HIS A 88 28.316 20.873 -1.842 1.00 25.00 C ATOM 132 CG HIS A 88 27.271 21.725 -1.189 1.00 25.00 C ATOM 133 ND1 HIS A 88 26.473 21.303 -0.155 1.00 25.00 N ATOM 134 CD2 HIS A 88 26.890 23.014 -1.422 1.00 25.00 C ATOM 135 CE1 HIS A 88 25.672 22.306 0.190 1.00 25.00 C ATOM 136 NE2 HIS A 88 25.887 23.377 -0.543 1.00 25.00 N ATOM 0 H HIS A 88 28.279 21.085 -4.543 1.00 25.00 H new ATOM 0 HA HIS A 88 29.536 22.578 -2.300 1.00 25.00 H new ATOM 0 HB2 HIS A 88 27.823 20.082 -2.407 1.00 25.00 H new ATOM 0 HB3 HIS A 88 28.910 20.389 -1.067 1.00 25.00 H new ATOM 0 HD2 HIS A 88 27.310 23.656 -2.182 1.00 25.00 H new ATOM 0 HE1 HIS A 88 24.934 22.249 0.977 1.00 25.00 H new ATOM 0 HE2 HIS A 88 25.416 24.279 -0.477 1.00 25.00 H new ATOM 144 N HIS A 89 31.408 20.765 -2.112 1.00 25.00 N ATOM 145 CA HIS A 89 32.637 19.970 -2.199 1.00 25.00 C ATOM 146 C HIS A 89 33.466 20.327 -3.447 1.00 25.00 C ATOM 147 O HIS A 89 33.421 21.454 -3.937 1.00 25.00 O ATOM 148 CB HIS A 89 32.297 18.462 -2.140 1.00 25.00 C ATOM 149 CG HIS A 89 33.349 17.631 -1.467 1.00 25.00 C ATOM 150 ND1 HIS A 89 34.229 16.798 -2.119 1.00 25.00 N ATOM 151 CD2 HIS A 89 33.664 17.510 -0.148 1.00 25.00 C ATOM 152 CE1 HIS A 89 35.021 16.238 -1.210 1.00 25.00 C ATOM 153 NE2 HIS A 89 34.718 16.635 0.009 1.00 25.00 N ATOM 0 H HIS A 89 31.328 21.300 -1.247 1.00 25.00 H new ATOM 0 HA HIS A 89 33.263 20.212 -1.340 1.00 25.00 H new ATOM 0 HB2 HIS A 89 31.352 18.332 -1.612 1.00 25.00 H new ATOM 0 HB3 HIS A 89 32.149 18.092 -3.155 1.00 25.00 H new ATOM 0 HD1 HIS A 89 34.267 16.638 -3.126 1.00 25.00 H new ATOM 0 HD2 HIS A 89 33.162 18.024 0.658 1.00 25.00 H new ATOM 0 HE1 HIS A 89 35.815 15.543 -1.442 1.00 25.00 H new ATOM 161 N HIS A 90 34.261 19.374 -3.902 1.00 25.00 N ATOM 162 CA HIS A 90 35.145 19.524 -5.046 1.00 25.00 C ATOM 163 C HIS A 90 35.314 18.108 -5.584 1.00 25.00 C ATOM 164 O HIS A 90 34.872 17.158 -4.936 1.00 25.00 O ATOM 165 CB HIS A 90 36.498 20.084 -4.594 1.00 0.00 C ATOM 166 CG HIS A 90 37.131 19.291 -3.491 1.00 25.00 C ATOM 167 ND1 HIS A 90 37.074 19.632 -2.162 1.00 25.00 N ATOM 168 CD2 HIS A 90 37.846 18.132 -3.526 1.00 25.00 C ATOM 169 CE1 HIS A 90 37.723 18.702 -1.466 1.00 25.00 C ATOM 170 NE2 HIS A 90 38.219 17.768 -2.249 1.00 25.00 N ATOM 0 H HIS A 90 34.311 18.449 -3.475 1.00 25.00 H new ATOM 0 HA HIS A 90 34.749 20.209 -5.795 1.00 25.00 H new ATOM 0 HB2 HIS A 90 37.175 20.111 -5.447 1.00 0.00 H new ATOM 0 HB3 HIS A 90 36.364 21.113 -4.261 1.00 0.00 H new ATOM 0 HD2 HIS A 90 38.086 17.579 -4.422 1.00 25.00 H new ATOM 0 HE1 HIS A 90 37.829 18.712 -0.391 1.00 25.00 H new ATOM 0 HE2 HIS A 90 38.762 16.951 -1.971 1.00 25.00 H new ATOM 178 N HIS A 91 35.962 17.960 -6.732 1.00 25.00 N ATOM 179 CA HIS A 91 36.212 16.634 -7.311 1.00 25.00 C ATOM 180 C HIS A 91 37.695 16.266 -7.228 1.00 25.00 C ATOM 181 O HIS A 91 38.040 15.190 -6.756 1.00 25.00 O ATOM 182 CB HIS A 91 35.747 16.607 -8.772 1.00 25.00 C ATOM 183 CG HIS A 91 35.703 15.232 -9.369 1.00 25.00 C ATOM 184 ND1 HIS A 91 36.800 14.428 -9.562 1.00 25.00 N ATOM 185 CD2 HIS A 91 34.649 14.505 -9.833 1.00 25.00 C ATOM 186 CE1 HIS A 91 36.390 13.289 -10.109 1.00 25.00 C ATOM 187 NE2 HIS A 91 35.087 13.284 -10.304 1.00 25.00 N ATOM 0 H HIS A 91 36.326 18.736 -7.285 1.00 25.00 H new ATOM 0 HA HIS A 91 35.647 15.899 -6.737 1.00 25.00 H new ATOM 0 HB2 HIS A 91 34.754 17.052 -8.836 1.00 25.00 H new ATOM 0 HB3 HIS A 91 36.414 17.230 -9.367 1.00 25.00 H new ATOM 0 HD1 HIS A 91 37.764 14.665 -9.326 1.00 25.00 H new ATOM 0 HD2 HIS A 91 33.621 14.836 -9.832 1.00 25.00 H new ATOM 0 HE1 HIS A 91 37.044 12.468 -10.363 1.00 25.00 H new ATOM 195 N SER A 92 38.547 17.183 -7.689 1.00 25.00 N ATOM 196 CA SER A 92 40.010 17.002 -7.741 1.00 25.00 C ATOM 197 C SER A 92 40.457 15.836 -8.639 1.00 25.00 C ATOM 198 O SER A 92 39.639 15.074 -9.159 1.00 25.00 O ATOM 199 CB SER A 92 40.585 16.843 -6.327 1.00 25.00 C ATOM 200 OG SER A 92 40.182 17.933 -5.514 1.00 25.00 O ATOM 0 H SER A 92 38.241 18.089 -8.044 1.00 25.00 H new ATOM 0 HA SER A 92 40.410 17.907 -8.198 1.00 25.00 H new ATOM 0 HB2 SER A 92 40.242 15.906 -5.889 1.00 25.00 H new ATOM 0 HB3 SER A 92 41.673 16.794 -6.371 1.00 25.00 H new ATOM 0 HG SER A 92 40.552 17.823 -4.613 1.00 25.00 H new ATOM 206 N SER A 93 41.760 15.750 -8.865 1.00 25.00 N ATOM 207 CA SER A 93 42.361 14.718 -9.707 1.00 25.00 C ATOM 208 C SER A 93 43.843 14.697 -9.349 1.00 25.00 C ATOM 209 O SER A 93 44.305 15.579 -8.627 1.00 25.00 O ATOM 210 CB SER A 93 42.183 15.067 -11.189 1.00 25.00 C ATOM 211 OG SER A 93 42.755 16.332 -11.477 1.00 25.00 O ATOM 0 H SER A 93 42.439 16.399 -8.467 1.00 25.00 H new ATOM 0 HA SER A 93 41.892 13.748 -9.543 1.00 25.00 H new ATOM 0 HB2 SER A 93 42.651 14.301 -11.807 1.00 25.00 H new ATOM 0 HB3 SER A 93 41.123 15.076 -11.441 1.00 25.00 H new ATOM 0 HG SER A 93 42.633 16.537 -12.428 1.00 25.00 H new ATOM 217 N GLY A 94 44.583 13.721 -9.854 1.00 25.00 N ATOM 218 CA GLY A 94 46.014 13.658 -9.615 1.00 25.00 C ATOM 219 C GLY A 94 46.606 12.498 -10.387 1.00 25.00 C ATOM 220 O GLY A 94 45.875 11.575 -10.747 1.00 25.00 O ATOM 0 H GLY A 94 44.216 12.964 -10.431 1.00 25.00 H new ATOM 0 HA2 GLY A 94 46.486 14.591 -9.922 1.00 25.00 H new ATOM 0 HA3 GLY A 94 46.210 13.537 -8.550 1.00 25.00 H new ATOM 224 N HIS A 95 47.903 12.548 -10.658 1.00 25.00 N ATOM 225 CA HIS A 95 48.608 11.492 -11.384 1.00 25.00 C ATOM 226 C HIS A 95 50.087 11.723 -11.105 1.00 25.00 C ATOM 227 O HIS A 95 50.437 12.751 -10.534 1.00 25.00 O ATOM 228 CB HIS A 95 48.329 11.582 -12.893 1.00 25.00 C ATOM 229 CG HIS A 95 48.491 10.277 -13.610 1.00 25.00 C ATOM 230 ND1 HIS A 95 49.649 9.858 -14.220 1.00 25.00 N ATOM 231 CD2 HIS A 95 47.603 9.267 -13.816 1.00 25.00 C ATOM 232 CE1 HIS A 95 49.431 8.657 -14.746 1.00 25.00 C ATOM 233 NE2 HIS A 95 48.201 8.244 -14.524 1.00 25.00 N ATOM 0 H HIS A 95 48.502 13.325 -10.380 1.00 25.00 H new ATOM 0 HA HIS A 95 48.281 10.503 -11.063 1.00 25.00 H new ATOM 0 HB2 HIS A 95 47.313 11.947 -13.045 1.00 25.00 H new ATOM 0 HB3 HIS A 95 49.002 12.317 -13.336 1.00 25.00 H new ATOM 0 HD1 HIS A 95 50.525 10.379 -14.262 1.00 25.00 H new ATOM 0 HD2 HIS A 95 46.578 9.266 -13.475 1.00 25.00 H new ATOM 0 HE1 HIS A 95 50.172 8.089 -15.289 1.00 25.00 H new ATOM 241 N ILE A 96 50.940 10.798 -11.521 1.00 25.00 N ATOM 242 CA ILE A 96 52.391 10.944 -11.370 1.00 25.00 C ATOM 243 C ILE A 96 53.036 10.884 -12.751 1.00 25.00 C ATOM 244 O ILE A 96 52.413 10.420 -13.707 1.00 25.00 O ATOM 245 CB ILE A 96 52.993 9.825 -10.462 1.00 25.00 C ATOM 246 CG1 ILE A 96 52.757 8.425 -11.079 1.00 25.00 C ATOM 247 CG2 ILE A 96 52.378 9.910 -9.041 1.00 25.00 C ATOM 248 CD1 ILE A 96 53.542 7.293 -10.397 1.00 25.00 C ATOM 0 H ILE A 96 50.654 9.928 -11.971 1.00 25.00 H new ATOM 0 HA ILE A 96 52.594 11.902 -10.892 1.00 25.00 H new ATOM 0 HB ILE A 96 54.070 9.978 -10.389 1.00 25.00 H new ATOM 0 HG12 ILE A 96 51.693 8.194 -11.030 1.00 25.00 H new ATOM 0 HG13 ILE A 96 53.029 8.455 -12.134 1.00 25.00 H new ATOM 0 HG21 ILE A 96 52.803 9.126 -8.413 1.00 25.00 H new ATOM 0 HG22 ILE A 96 52.601 10.884 -8.606 1.00 25.00 H new ATOM 0 HG23 ILE A 96 51.298 9.779 -9.104 1.00 25.00 H new ATOM 0 HD11 ILE A 96 53.319 6.347 -10.891 1.00 25.00 H new ATOM 0 HD12 ILE A 96 54.610 7.497 -10.469 1.00 25.00 H new ATOM 0 HD13 ILE A 96 53.254 7.231 -9.348 1.00 25.00 H new ATOM 260 N GLU A 97 54.279 11.335 -12.846 1.00 25.00 N ATOM 261 CA GLU A 97 55.024 11.301 -14.110 1.00 25.00 C ATOM 262 C GLU A 97 56.105 10.212 -14.048 1.00 25.00 C ATOM 263 O GLU A 97 56.305 9.462 -15.003 1.00 25.00 O ATOM 264 CB GLU A 97 55.632 12.682 -14.379 1.00 25.00 C ATOM 265 CG GLU A 97 54.559 13.768 -14.546 1.00 25.00 C ATOM 266 CD GLU A 97 55.142 15.164 -14.670 1.00 25.00 C ATOM 267 OE1 GLU A 97 55.724 15.651 -13.677 1.00 25.00 O ATOM 268 OE2 GLU A 97 54.960 15.799 -15.731 1.00 25.00 O1- ATOM 0 H GLU A 97 54.800 11.731 -12.064 1.00 25.00 H new ATOM 0 HA GLU A 97 54.352 11.057 -14.933 1.00 25.00 H new ATOM 0 HB2 GLU A 97 56.294 12.952 -13.556 1.00 25.00 H new ATOM 0 HB3 GLU A 97 56.245 12.638 -15.280 1.00 25.00 H new ATOM 0 HG2 GLU A 97 53.963 13.549 -15.432 1.00 25.00 H new ATOM 0 HG3 GLU A 97 53.883 13.737 -13.692 1.00 25.00 H new ATOM 275 N GLY A 98 56.724 10.061 -12.882 1.00 25.00 N ATOM 276 CA GLY A 98 57.699 8.997 -12.674 1.00 25.00 C ATOM 277 C GLY A 98 59.088 9.352 -13.174 1.00 25.00 C ATOM 278 O GLY A 98 59.334 10.488 -13.525 1.00 25.00 O ATOM 0 H GLY A 98 56.569 10.659 -12.070 1.00 25.00 H new ATOM 0 HA2 GLY A 98 57.751 8.764 -11.611 1.00 25.00 H new ATOM 0 HA3 GLY A 98 57.357 8.095 -13.182 1.00 25.00 H new ATOM 282 N ARG A 99 59.990 8.366 -13.173 1.00 25.00 N ATOM 283 CA ARG A 99 61.394 8.518 -13.641 1.00 25.00 C ATOM 284 C ARG A 99 62.177 9.641 -12.949 1.00 25.00 C ATOM 285 O ARG A 99 63.157 10.149 -13.483 1.00 25.00 O ATOM 286 CB ARG A 99 61.432 8.722 -15.173 1.00 25.00 C ATOM 287 CG ARG A 99 61.082 7.474 -15.974 1.00 25.00 C ATOM 288 CD ARG A 99 62.219 6.456 -15.886 1.00 25.00 C ATOM 289 NE ARG A 99 61.944 5.236 -16.664 1.00 25.00 N ATOM 290 CZ ARG A 99 62.728 4.164 -16.698 1.00 25.00 C ATOM 291 NH1 ARG A 99 63.853 4.098 -16.025 1.00 25.00 N1+ ATOM 292 NH2 ARG A 99 62.375 3.139 -17.423 1.00 25.00 N ATOM 0 H ARG A 99 59.775 7.424 -12.846 1.00 25.00 H new ATOM 0 HA ARG A 99 61.893 7.589 -13.366 1.00 25.00 H new ATOM 0 HB2 ARG A 99 60.738 9.519 -15.440 1.00 25.00 H new ATOM 0 HB3 ARG A 99 62.429 9.058 -15.460 1.00 25.00 H new ATOM 0 HG2 ARG A 99 60.160 7.035 -15.593 1.00 25.00 H new ATOM 0 HG3 ARG A 99 60.902 7.740 -17.016 1.00 25.00 H new ATOM 0 HD2 ARG A 99 63.141 6.913 -16.246 1.00 25.00 H new ATOM 0 HD3 ARG A 99 62.383 6.188 -14.842 1.00 25.00 H new ATOM 0 HE ARG A 99 61.088 5.212 -17.218 1.00 25.00 H new ATOM 0 HH11 ARG A 99 64.151 4.887 -15.451 1.00 25.00 H new ATOM 0 HH12 ARG A 99 64.429 3.258 -16.076 1.00 25.00 H new ATOM 0 HH21 ARG A 99 61.506 3.166 -17.956 1.00 25.00 H new ATOM 0 HH22 ARG A 99 62.968 2.310 -17.457 1.00 25.00 H new ATOM 306 N HIS A 100 61.796 9.951 -11.724 1.00 25.00 N ATOM 307 CA HIS A 100 62.443 10.985 -10.961 1.00 25.00 C ATOM 308 C HIS A 100 63.362 10.297 -9.983 1.00 25.00 C ATOM 309 O HIS A 100 63.262 9.087 -9.758 1.00 25.00 O ATOM 310 CB HIS A 100 61.394 11.827 -10.229 1.00 25.00 C ATOM 311 CG HIS A 100 60.474 11.019 -9.371 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.751 10.627 -8.086 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.241 10.509 -9.638 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.720 9.917 -7.636 1.00 25.00 C ATOM 315 NE2 HIS A 100 58.772 9.806 -8.546 1.00 25.00 N ATOM 0 H HIS A 100 61.029 9.489 -11.236 1.00 25.00 H new ATOM 0 HA HIS A 100 63.009 11.659 -11.604 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.901 12.566 -9.609 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.805 12.377 -10.963 1.00 25.00 H new ATOM 0 HD2 HIS A 100 58.707 10.636 -10.568 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.666 9.485 -6.648 1.00 25.00 H new ATOM 0 HE2 HIS A 100 57.885 9.309 -8.462 1.00 25.00 H new ATOM 323 N MET A 101 64.245 11.077 -9.400 1.00 25.00 N ATOM 324 CA MET A 101 65.191 10.599 -8.421 1.00 25.00 C ATOM 325 C MET A 101 65.095 11.546 -7.225 1.00 25.00 C ATOM 326 O MET A 101 64.297 12.484 -7.255 1.00 25.00 O ATOM 327 CB MET A 101 66.601 10.604 -9.029 1.00 25.00 C ATOM 328 CG MET A 101 67.060 11.984 -9.492 1.00 25.00 C ATOM 329 SD MET A 101 68.622 11.921 -10.363 1.00 25.00 S ATOM 330 CE MET A 101 68.863 13.670 -10.714 1.00 25.00 C ATOM 0 H MET A 101 64.326 12.075 -9.597 1.00 25.00 H new ATOM 0 HA MET A 101 64.977 9.577 -8.108 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.307 10.224 -8.291 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.625 9.919 -9.876 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.301 12.418 -10.142 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.154 12.642 -8.628 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.789 13.805 -11.273 1.00 25.00 H new ATOM 0 HE2 MET A 101 68.026 14.041 -11.305 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.920 14.225 -9.777 1.00 25.00 H new ATOM 340 N LEU A 102 65.879 11.310 -6.180 1.00 25.00 N ATOM 341 CA LEU A 102 65.828 12.132 -4.964 1.00 25.00 C ATOM 342 C LEU A 102 67.192 12.748 -4.655 1.00 25.00 C ATOM 343 O LEU A 102 68.188 12.037 -4.604 1.00 25.00 O ATOM 344 CB LEU A 102 65.398 11.251 -3.782 1.00 25.00 C ATOM 345 CG LEU A 102 65.169 11.959 -2.434 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.843 12.717 -2.426 1.00 25.00 C ATOM 347 CD2 LEU A 102 65.175 10.931 -1.307 1.00 25.00 C ATOM 0 H LEU A 102 66.563 10.554 -6.145 1.00 25.00 H new ATOM 0 HA LEU A 102 65.113 12.939 -5.123 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.476 10.739 -4.058 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.158 10.483 -3.637 1.00 25.00 H new ATOM 0 HG LEU A 102 65.975 12.677 -2.286 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.709 13.206 -1.461 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.848 13.468 -3.216 1.00 25.00 H new ATOM 0 HD13 LEU A 102 63.024 12.018 -2.595 1.00 25.00 H new ATOM 0 HD21 LEU A 102 65.013 11.435 -0.354 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.380 10.204 -1.473 1.00 25.00 H new ATOM 0 HD23 LEU A 102 66.137 10.418 -1.287 1.00 25.00 H new ATOM 359 N LEU A 103 67.223 14.052 -4.409 1.00 25.00 N ATOM 360 CA LEU A 103 68.454 14.752 -4.019 1.00 25.00 C ATOM 361 C LEU A 103 68.195 15.500 -2.727 1.00 25.00 C ATOM 362 O LEU A 103 67.057 15.858 -2.443 1.00 25.00 O ATOM 363 CB LEU A 103 68.873 15.772 -5.086 1.00 25.00 C ATOM 364 CG LEU A 103 69.281 15.232 -6.462 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.622 16.412 -7.367 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.475 14.313 -6.367 1.00 25.00 C ATOM 0 H LEU A 103 66.404 14.657 -4.472 1.00 25.00 H new ATOM 0 HA LEU A 103 69.249 14.015 -3.902 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.046 16.467 -5.230 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.709 16.349 -4.690 1.00 25.00 H new ATOM 0 HG LEU A 103 68.449 14.658 -6.870 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.914 16.044 -8.350 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.750 17.058 -7.466 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.446 16.978 -6.932 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.735 13.950 -7.361 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.321 14.857 -5.947 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.233 13.467 -5.724 1.00 25.00 H new ATOM 378 N THR A 104 69.242 15.779 -1.968 1.00 25.00 N ATOM 379 CA THR A 104 69.116 16.551 -0.732 1.00 25.00 C ATOM 380 C THR A 104 69.741 17.928 -0.953 1.00 25.00 C ATOM 381 O THR A 104 70.728 18.065 -1.663 1.00 25.00 O ATOM 382 CB THR A 104 69.790 15.799 0.439 1.00 25.00 C ATOM 383 OG1 THR A 104 69.215 14.495 0.541 1.00 25.00 O ATOM 384 CG2 THR A 104 69.579 16.496 1.773 1.00 25.00 C ATOM 0 H THR A 104 70.194 15.483 -2.183 1.00 25.00 H new ATOM 0 HA THR A 104 68.066 16.679 -0.470 1.00 25.00 H new ATOM 0 HB THR A 104 70.859 15.764 0.229 1.00 25.00 H new ATOM 0 HG1 THR A 104 68.273 14.572 0.799 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.072 15.928 2.562 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.002 17.500 1.730 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.512 16.561 1.985 1.00 25.00 H new ATOM 392 N VAL A 105 69.137 18.957 -0.387 1.00 25.00 N ATOM 393 CA VAL A 105 69.623 20.323 -0.530 1.00 25.00 C ATOM 394 C VAL A 105 69.829 20.918 0.857 1.00 25.00 C ATOM 395 O VAL A 105 68.907 20.936 1.670 1.00 25.00 O ATOM 396 CB VAL A 105 68.594 21.194 -1.287 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.123 22.623 -1.478 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.228 20.571 -2.647 1.00 25.00 C ATOM 0 H VAL A 105 68.297 18.873 0.185 1.00 25.00 H new ATOM 0 HA VAL A 105 70.557 20.305 -1.091 1.00 25.00 H new ATOM 0 HB VAL A 105 67.689 21.238 -0.680 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.382 23.217 -2.013 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.315 23.073 -0.504 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.049 22.595 -2.053 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.503 21.207 -3.155 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.125 20.482 -3.260 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.797 19.582 -2.490 1.00 25.00 H new ATOM 408 N TYR A 106 71.025 21.424 1.119 1.00 25.00 N ATOM 409 CA TYR A 106 71.309 22.103 2.378 1.00 25.00 C ATOM 410 C TYR A 106 71.418 23.603 2.132 1.00 25.00 C ATOM 411 O TYR A 106 72.348 24.065 1.479 1.00 25.00 O ATOM 412 CB TYR A 106 72.607 21.571 2.996 1.00 25.00 C ATOM 413 CG TYR A 106 72.932 22.166 4.359 1.00 25.00 C ATOM 414 CD1 TYR A 106 71.905 22.551 5.250 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.269 22.335 4.776 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.198 23.078 6.523 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.568 22.870 6.065 1.00 25.00 C ATOM 418 CZ TYR A 106 73.519 23.229 6.924 1.00 25.00 C ATOM 419 OH TYR A 106 73.749 23.732 8.172 1.00 25.00 O ATOM 0 H TYR A 106 71.816 21.378 0.477 1.00 25.00 H new ATOM 0 HA TYR A 106 70.495 21.910 3.077 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.535 20.488 3.092 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.433 21.776 2.315 1.00 25.00 H new ATOM 0 HD1 TYR A 106 70.874 22.439 4.949 1.00 25.00 H new ATOM 0 HD2 TYR A 106 75.075 22.057 4.113 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.396 23.364 7.187 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.594 22.997 6.377 1.00 25.00 H new ATOM 0 HH TYR A 106 74.715 23.787 8.330 1.00 25.00 H new ATOM 429 N CYS A 107 70.461 24.359 2.643 1.00 25.00 N ATOM 430 CA CYS A 107 70.442 25.807 2.481 1.00 25.00 C ATOM 431 C CYS A 107 71.032 26.449 3.724 1.00 25.00 C ATOM 432 O CYS A 107 70.621 26.146 4.834 1.00 25.00 O ATOM 433 CB CYS A 107 69.003 26.294 2.306 1.00 25.00 C ATOM 434 SG CYS A 107 68.872 28.098 2.182 1.00 25.00 S ATOM 0 H CYS A 107 69.677 23.990 3.181 1.00 25.00 H new ATOM 0 HA CYS A 107 71.024 26.079 1.601 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.580 25.843 1.409 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.404 25.949 3.149 1.00 25.00 H new ATOM 0 HG CYS A 107 67.829 28.504 2.843 1.00 25.00 H new ATOM 440 N VAL A 108 71.993 27.341 3.536 1.00 25.00 N ATOM 441 CA VAL A 108 72.655 28.010 4.650 1.00 25.00 C ATOM 442 C VAL A 108 72.497 29.520 4.545 1.00 25.00 C ATOM 443 O VAL A 108 72.882 30.126 3.543 1.00 25.00 O ATOM 444 CB VAL A 108 74.166 27.649 4.696 1.00 25.00 C ATOM 445 CG1 VAL A 108 74.833 28.270 5.932 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.345 26.125 4.720 1.00 25.00 C ATOM 0 H VAL A 108 72.335 27.621 2.617 1.00 25.00 H new ATOM 0 HA VAL A 108 72.181 27.665 5.569 1.00 25.00 H new ATOM 0 HB VAL A 108 74.642 28.052 3.802 1.00 25.00 H new ATOM 0 HG11 VAL A 108 75.890 28.006 5.946 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.730 29.355 5.895 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.352 27.891 6.834 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.408 25.884 4.752 1.00 25.00 H new ATOM 0 HG22 VAL A 108 73.853 25.715 5.602 1.00 25.00 H new ATOM 0 HG23 VAL A 108 73.902 25.692 3.823 1.00 25.00 H new ATOM 456 N ARG A 109 71.960 30.136 5.591 1.00 25.00 N ATOM 457 CA ARG A 109 71.813 31.586 5.648 1.00 25.00 C ATOM 458 C ARG A 109 72.678 32.064 6.790 1.00 25.00 C ATOM 459 O ARG A 109 72.779 31.389 7.801 1.00 25.00 O ATOM 460 CB ARG A 109 70.353 31.970 5.919 1.00 25.00 C ATOM 461 CG ARG A 109 69.373 31.551 4.814 1.00 25.00 C ATOM 462 CD ARG A 109 67.963 32.121 5.048 1.00 25.00 C ATOM 463 NE ARG A 109 67.907 33.580 4.831 1.00 25.00 N ATOM 464 CZ ARG A 109 67.554 34.493 5.735 1.00 25.00 C ATOM 465 NH1 ARG A 109 67.196 34.195 6.958 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 67.575 35.750 5.392 1.00 25.00 N ATOM 0 H ARG A 109 71.616 29.649 6.419 1.00 25.00 H new ATOM 0 HA ARG A 109 72.108 32.039 4.701 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.039 31.515 6.859 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.292 33.050 6.051 1.00 25.00 H new ATOM 0 HG2 ARG A 109 69.747 31.893 3.849 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.321 30.463 4.768 1.00 25.00 H new ATOM 0 HD2 ARG A 109 67.258 31.629 4.378 1.00 25.00 H new ATOM 0 HD3 ARG A 109 67.646 31.895 6.066 1.00 25.00 H new ATOM 0 HE ARG A 109 68.162 33.921 3.904 1.00 25.00 H new ATOM 0 HH11 ARG A 109 67.177 33.221 7.261 1.00 25.00 H new ATOM 0 HH12 ARG A 109 66.936 34.937 7.608 1.00 25.00 H new ATOM 0 HH21 ARG A 109 67.857 36.017 4.449 1.00 25.00 H new ATOM 0 HH22 ARG A 109 67.309 36.467 6.067 1.00 25.00 H new ATOM 480 N ARG A 110 73.262 33.250 6.661 1.00 25.00 N ATOM 481 CA ARG A 110 74.090 33.819 7.743 1.00 25.00 C ATOM 482 C ARG A 110 73.260 34.119 8.989 1.00 25.00 C ATOM 483 O ARG A 110 73.793 34.360 10.055 1.00 25.00 O ATOM 484 CB ARG A 110 74.763 35.121 7.299 1.00 25.00 C ATOM 485 CG ARG A 110 75.694 34.980 6.105 1.00 25.00 C ATOM 486 CD ARG A 110 76.662 36.162 6.038 1.00 25.00 C ATOM 487 NE ARG A 110 75.959 37.455 5.937 1.00 25.00 N ATOM 488 CZ ARG A 110 76.543 38.651 5.951 1.00 25.00 C ATOM 489 NH1 ARG A 110 77.843 38.795 6.052 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 75.803 39.721 5.864 1.00 25.00 N ATOM 0 H ARG A 110 73.185 33.839 5.831 1.00 25.00 H new ATOM 0 HA ARG A 110 74.845 33.068 7.978 1.00 25.00 H new ATOM 0 HB2 ARG A 110 73.989 35.849 7.055 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.329 35.526 8.138 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.254 34.048 6.181 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.111 34.928 5.186 1.00 25.00 H new ATOM 0 HD2 ARG A 110 77.294 36.163 6.926 1.00 25.00 H new ATOM 0 HD3 ARG A 110 77.321 36.041 5.178 1.00 25.00 H new ATOM 0 HE ARG A 110 74.943 37.431 5.849 1.00 25.00 H new ATOM 0 HH11 ARG A 110 78.443 37.973 6.123 1.00 25.00 H new ATOM 0 HH12 ARG A 110 78.254 39.729 6.059 1.00 25.00 H new ATOM 0 HH21 ARG A 110 74.790 39.635 5.786 1.00 25.00 H new ATOM 0 HH22 ARG A 110 76.238 40.644 5.874 1.00 25.00 H new ATOM 504 N ASP A 111 71.954 34.116 8.806 1.00 25.00 N ATOM 505 CA ASP A 111 70.980 34.445 9.843 1.00 25.00 C ATOM 506 C ASP A 111 70.637 33.240 10.739 1.00 25.00 C ATOM 507 O ASP A 111 69.603 33.224 11.394 1.00 25.00 O ATOM 508 CB ASP A 111 69.719 34.911 9.112 1.00 25.00 C ATOM 509 CG ASP A 111 68.940 35.967 9.868 1.00 25.00 C ATOM 510 OD1 ASP A 111 69.486 36.593 10.800 1.00 25.00 O ATOM 511 OD2 ASP A 111 67.822 36.282 9.393 1.00 25.00 O1- ATOM 0 H ASP A 111 71.524 33.880 7.912 1.00 25.00 H new ATOM 0 HA ASP A 111 71.393 35.209 10.502 1.00 25.00 H new ATOM 0 HB2 ASP A 111 69.999 35.307 8.136 1.00 25.00 H new ATOM 0 HB3 ASP A 111 69.073 34.051 8.934 1.00 25.00 H new ATOM 516 N LEU A 112 71.477 32.203 10.679 1.00 25.00 N ATOM 517 CA LEU A 112 71.286 30.928 11.413 1.00 25.00 C ATOM 518 C LEU A 112 69.940 30.278 11.098 1.00 25.00 C ATOM 519 O LEU A 112 69.396 29.505 11.874 1.00 25.00 O ATOM 520 CB LEU A 112 71.430 31.126 12.934 1.00 25.00 C ATOM 521 CG LEU A 112 72.764 31.696 13.435 1.00 25.00 C ATOM 522 CD1 LEU A 112 72.662 31.974 14.934 1.00 25.00 C ATOM 523 CD2 LEU A 112 73.923 30.724 13.168 1.00 25.00 C ATOM 0 H LEU A 112 72.325 32.216 10.113 1.00 25.00 H new ATOM 0 HA LEU A 112 72.073 30.256 11.071 1.00 25.00 H new ATOM 0 HB2 LEU A 112 70.631 31.788 13.267 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.269 30.163 13.419 1.00 25.00 H new ATOM 0 HG LEU A 112 72.968 32.620 12.895 1.00 25.00 H new ATOM 0 HD11 LEU A 112 73.608 32.379 15.294 1.00 25.00 H new ATOM 0 HD12 LEU A 112 71.865 32.695 15.117 1.00 25.00 H new ATOM 0 HD13 LEU A 112 72.440 31.046 15.462 1.00 25.00 H new ATOM 0 HD21 LEU A 112 74.853 31.158 13.535 1.00 25.00 H new ATOM 0 HD22 LEU A 112 73.734 29.782 13.683 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.005 30.541 12.097 1.00 25.00 H new ATOM 535 N SER A 113 69.430 30.595 9.924 1.00 25.00 N ATOM 536 CA SER A 113 68.150 30.091 9.439 1.00 25.00 C ATOM 537 C SER A 113 68.397 28.931 8.490 1.00 25.00 C ATOM 538 O SER A 113 67.670 28.742 7.520 1.00 25.00 O ATOM 539 CB SER A 113 67.395 31.195 8.723 1.00 25.00 C ATOM 540 OG SER A 113 67.278 32.349 9.535 1.00 25.00 O ATOM 0 H SER A 113 69.897 31.219 9.266 1.00 25.00 H new ATOM 0 HA SER A 113 67.551 29.749 10.283 1.00 25.00 H new ATOM 0 HB2 SER A 113 67.911 31.450 7.797 1.00 25.00 H new ATOM 0 HB3 SER A 113 66.402 30.840 8.447 1.00 25.00 H new ATOM 0 HG SER A 113 66.544 32.908 9.205 1.00 25.00 H new ATOM 546 N GLU A 114 69.526 28.268 8.675 1.00 25.00 N ATOM 547 CA GLU A 114 69.943 27.205 7.774 1.00 25.00 C ATOM 548 C GLU A 114 69.066 25.970 7.987 1.00 25.00 C ATOM 549 O GLU A 114 68.583 25.712 9.089 1.00 25.00 O ATOM 550 CB GLU A 114 71.436 26.898 7.990 1.00 25.00 C ATOM 551 CG GLU A 114 71.861 26.579 9.433 1.00 25.00 C ATOM 552 CD GLU A 114 73.363 26.806 9.646 1.00 25.00 C ATOM 553 OE1 GLU A 114 73.835 27.930 9.348 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.072 25.879 10.091 1.00 25.00 O1- ATOM 0 H GLU A 114 70.173 28.447 9.443 1.00 25.00 H new ATOM 0 HA GLU A 114 69.817 27.523 6.739 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.707 26.052 7.358 1.00 25.00 H new ATOM 0 HB3 GLU A 114 72.016 27.754 7.643 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.297 27.204 10.125 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.613 25.543 9.665 1.00 25.00 H new ATOM 561 N VAL A 115 68.805 25.258 6.902 1.00 25.00 N ATOM 562 CA VAL A 115 67.847 24.154 6.892 1.00 25.00 C ATOM 563 C VAL A 115 68.239 23.190 5.776 1.00 25.00 C ATOM 564 O VAL A 115 68.813 23.600 4.774 1.00 25.00 O ATOM 565 CB VAL A 115 66.378 24.705 6.667 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.218 25.362 5.276 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.323 23.602 6.860 1.00 25.00 C ATOM 0 H VAL A 115 69.250 25.426 6.000 1.00 25.00 H new ATOM 0 HA VAL A 115 67.863 23.633 7.849 1.00 25.00 H new ATOM 0 HB VAL A 115 66.213 25.472 7.424 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.197 25.727 5.161 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.914 26.196 5.185 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.430 24.627 4.500 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.328 24.017 6.698 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.502 22.799 6.145 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.390 23.207 7.874 1.00 25.00 H new ATOM 577 N THR A 116 67.933 21.914 5.943 1.00 25.00 N ATOM 578 CA THR A 116 68.200 20.918 4.911 1.00 25.00 C ATOM 579 C THR A 116 66.885 20.214 4.618 1.00 25.00 C ATOM 580 O THR A 116 66.055 20.042 5.514 1.00 25.00 O ATOM 581 CB THR A 116 69.318 19.919 5.339 1.00 25.00 C ATOM 582 OG1 THR A 116 69.475 18.912 4.339 1.00 25.00 O ATOM 583 CG2 THR A 116 69.010 19.242 6.669 1.00 25.00 C ATOM 0 H THR A 116 67.498 21.539 6.786 1.00 25.00 H new ATOM 0 HA THR A 116 68.578 21.399 4.009 1.00 25.00 H new ATOM 0 HB THR A 116 70.236 20.496 5.455 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.180 18.288 4.611 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.818 18.556 6.924 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.916 19.998 7.449 1.00 25.00 H new ATOM 0 HG23 THR A 116 68.075 18.687 6.587 1.00 25.00 H new ATOM 591 N PHE A 117 66.672 19.874 3.359 1.00 25.00 N ATOM 592 CA PHE A 117 65.429 19.257 2.905 1.00 25.00 C ATOM 593 C PHE A 117 65.780 18.429 1.680 1.00 25.00 C ATOM 594 O PHE A 117 66.898 18.520 1.191 1.00 25.00 O ATOM 595 CB PHE A 117 64.385 20.332 2.565 1.00 25.00 C ATOM 596 CG PHE A 117 64.867 21.365 1.581 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.495 22.543 2.034 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.676 21.180 0.197 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.934 23.529 1.117 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.107 22.160 -0.729 1.00 25.00 C ATOM 601 CZ PHE A 117 65.733 23.337 -0.268 1.00 25.00 C ATOM 0 H PHE A 117 67.357 20.017 2.616 1.00 25.00 H new ATOM 0 HA PHE A 117 64.992 18.630 3.682 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.497 19.846 2.160 1.00 25.00 H new ATOM 0 HB3 PHE A 117 64.083 20.834 3.484 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.643 22.695 3.093 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.196 20.281 -0.161 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.421 24.424 1.475 1.00 25.00 H new ATOM 0 HE2 PHE A 117 64.957 22.007 -1.787 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.058 24.089 -0.972 1.00 25.00 H new ATOM 611 N SER A 118 64.854 17.621 1.189 1.00 25.00 N ATOM 612 CA SER A 118 65.116 16.787 0.018 1.00 25.00 C ATOM 613 C SER A 118 64.055 17.033 -1.031 1.00 25.00 C ATOM 614 O SER A 118 62.920 17.357 -0.707 1.00 25.00 O ATOM 615 CB SER A 118 65.148 15.308 0.402 1.00 25.00 C ATOM 616 OG SER A 118 66.198 15.047 1.320 1.00 25.00 O ATOM 0 H SER A 118 63.916 17.522 1.578 1.00 25.00 H new ATOM 0 HA SER A 118 66.092 17.053 -0.389 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.194 15.022 0.844 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.281 14.699 -0.492 1.00 25.00 H new ATOM 0 HG SER A 118 66.199 14.095 1.553 1.00 25.00 H new ATOM 622 N LEU A 119 64.444 16.890 -2.288 1.00 25.00 N ATOM 623 CA LEU A 119 63.565 17.158 -3.416 1.00 25.00 C ATOM 624 C LEU A 119 63.562 16.002 -4.385 1.00 25.00 C ATOM 625 O LEU A 119 64.595 15.377 -4.629 1.00 25.00 O ATOM 626 CB LEU A 119 64.046 18.405 -4.161 1.00 25.00 C ATOM 627 CG LEU A 119 63.462 19.736 -3.679 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.165 20.883 -4.401 1.00 25.00 C ATOM 629 CD2 LEU A 119 61.955 19.771 -3.952 1.00 25.00 C ATOM 0 H LEU A 119 65.380 16.584 -2.556 1.00 25.00 H new ATOM 0 HA LEU A 119 62.558 17.307 -3.027 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.132 18.456 -4.082 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.809 18.288 -5.218 1.00 25.00 H new ATOM 0 HG LEU A 119 63.620 19.842 -2.606 1.00 25.00 H new ATOM 0 HD11 LEU A 119 63.753 21.833 -4.062 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.232 20.851 -4.182 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.012 20.784 -5.476 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.545 20.720 -3.607 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.777 19.666 -5.022 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.470 18.952 -3.421 1.00 25.00 H new ATOM 641 N GLN A 120 62.406 15.759 -4.979 1.00 25.00 N ATOM 642 CA GLN A 120 62.284 14.767 -6.035 1.00 25.00 C ATOM 643 C GLN A 120 62.392 15.545 -7.330 1.00 25.00 C ATOM 644 O GLN A 120 61.687 16.532 -7.520 1.00 25.00 O ATOM 645 CB GLN A 120 60.950 14.024 -5.954 1.00 25.00 C ATOM 646 CG GLN A 120 60.801 13.196 -4.684 1.00 25.00 C ATOM 647 CD GLN A 120 59.540 12.362 -4.677 1.00 25.00 C ATOM 648 OE1 GLN A 120 59.593 11.145 -4.733 1.00 25.00 O ATOM 649 NE2 GLN A 120 58.406 13.008 -4.598 1.00 25.00 N ATOM 0 H GLN A 120 61.535 16.237 -4.747 1.00 25.00 H new ATOM 0 HA GLN A 120 63.056 14.002 -5.953 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.135 14.746 -6.007 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.853 13.370 -6.820 1.00 25.00 H new ATOM 0 HG2 GLN A 120 61.666 12.541 -4.579 1.00 25.00 H new ATOM 0 HG3 GLN A 120 60.797 13.861 -3.820 1.00 25.00 H new ATOM 0 HE21 GLN A 120 58.402 14.027 -4.553 1.00 25.00 H new ATOM 0 HE22 GLN A 120 57.526 12.493 -4.581 1.00 25.00 H new ATOM 658 N VAL A 121 63.324 15.144 -8.176 1.00 25.00 N ATOM 659 CA VAL A 121 63.616 15.858 -9.418 1.00 25.00 C ATOM 660 C VAL A 121 63.829 14.831 -10.501 1.00 25.00 C ATOM 661 O VAL A 121 64.183 13.703 -10.203 1.00 25.00 O ATOM 662 CB VAL A 121 64.910 16.716 -9.286 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.673 17.892 -8.352 1.00 25.00 C ATOM 664 CG2 VAL A 121 66.086 15.869 -8.754 1.00 25.00 C ATOM 0 H VAL A 121 63.902 14.317 -8.027 1.00 25.00 H new ATOM 0 HA VAL A 121 62.785 16.524 -9.650 1.00 25.00 H new ATOM 0 HB VAL A 121 65.165 17.086 -10.279 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.586 18.482 -8.270 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.872 18.516 -8.749 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.390 17.523 -7.366 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.976 16.493 -8.672 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.831 15.469 -7.773 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.282 15.046 -9.442 1.00 25.00 H new ATOM 674 N ASP A 122 63.617 15.194 -11.751 1.00 25.00 N ATOM 675 CA ASP A 122 63.841 14.244 -12.833 1.00 25.00 C ATOM 676 C ASP A 122 65.332 14.152 -13.150 1.00 25.00 C ATOM 677 O ASP A 122 66.120 15.004 -12.738 1.00 25.00 O ATOM 678 CB ASP A 122 63.049 14.628 -14.075 1.00 25.00 C ATOM 679 CG ASP A 122 62.731 13.421 -14.931 1.00 25.00 C ATOM 680 OD1 ASP A 122 61.711 12.765 -14.662 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 63.577 13.053 -15.780 1.00 25.00 O1- ATOM 0 H ASP A 122 63.297 16.117 -12.043 1.00 25.00 H new ATOM 0 HA ASP A 122 63.490 13.265 -12.507 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.122 15.118 -13.778 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.618 15.350 -14.661 1.00 25.00 H new ATOM 686 N ALA A 123 65.728 13.128 -13.888 1.00 25.00 N ATOM 687 CA ALA A 123 67.128 12.958 -14.251 1.00 25.00 C ATOM 688 C ALA A 123 67.574 14.105 -15.166 1.00 25.00 C ATOM 689 O ALA A 123 68.690 14.625 -15.043 1.00 25.00 O ATOM 690 CB ALA A 123 67.321 11.608 -14.948 1.00 25.00 C ATOM 0 H ALA A 123 65.105 12.405 -14.247 1.00 25.00 H new ATOM 0 HA ALA A 123 67.740 12.977 -13.349 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.370 11.485 -15.218 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.023 10.805 -14.274 1.00 25.00 H new ATOM 0 HB3 ALA A 123 66.708 11.573 -15.849 1.00 25.00 H new ATOM 696 N ASP A 124 66.696 14.495 -16.080 1.00 25.00 N ATOM 697 CA ASP A 124 67.025 15.534 -17.061 1.00 25.00 C ATOM 698 C ASP A 124 66.507 16.910 -16.636 1.00 25.00 C ATOM 699 O ASP A 124 66.468 17.846 -17.426 1.00 25.00 O ATOM 700 CB ASP A 124 66.472 15.156 -18.440 1.00 25.00 C ATOM 701 CG ASP A 124 67.335 15.694 -19.587 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.561 15.907 -19.380 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.814 15.809 -20.718 1.00 25.00 O1- ATOM 0 H ASP A 124 65.754 14.113 -16.167 1.00 25.00 H new ATOM 0 HA ASP A 124 68.112 15.600 -17.117 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.407 14.071 -18.517 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.458 15.544 -18.540 1.00 25.00 H new ATOM 708 N PHE A 125 66.130 17.026 -15.368 1.00 25.00 N ATOM 709 CA PHE A 125 65.650 18.293 -14.806 1.00 25.00 C ATOM 710 C PHE A 125 66.768 19.316 -14.954 1.00 25.00 C ATOM 711 O PHE A 125 67.920 19.041 -14.599 1.00 25.00 O ATOM 712 CB PHE A 125 65.316 18.087 -13.329 1.00 25.00 C ATOM 713 CG PHE A 125 64.264 19.015 -12.785 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.969 19.032 -13.338 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.543 19.837 -11.673 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.961 19.862 -12.791 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.534 20.661 -11.113 1.00 25.00 C ATOM 718 CZ PHE A 125 62.244 20.672 -11.673 1.00 25.00 C ATOM 0 H PHE A 125 66.146 16.254 -14.701 1.00 25.00 H new ATOM 0 HA PHE A 125 64.755 18.640 -15.322 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.983 17.059 -13.186 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.227 18.211 -12.744 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.743 18.405 -14.188 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.534 19.839 -11.244 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.975 19.874 -13.231 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.756 21.280 -10.256 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.474 21.298 -11.248 1.00 25.00 H new ATOM 728 N GLU A 126 66.460 20.468 -15.520 1.00 25.00 N ATOM 729 CA GLU A 126 67.496 21.463 -15.793 1.00 25.00 C ATOM 730 C GLU A 126 67.883 22.149 -14.497 1.00 25.00 C ATOM 731 O GLU A 126 67.063 22.302 -13.595 1.00 25.00 O ATOM 732 CB GLU A 126 67.044 22.534 -16.804 1.00 25.00 C ATOM 733 CG GLU A 126 65.878 22.155 -17.712 1.00 25.00 C ATOM 734 CD GLU A 126 64.543 22.471 -17.063 1.00 25.00 C ATOM 735 OE1 GLU A 126 64.178 23.669 -17.025 1.00 25.00 O ATOM 736 OE2 GLU A 126 63.925 21.558 -16.475 1.00 25.00 O1- ATOM 0 H GLU A 126 65.518 20.741 -15.798 1.00 25.00 H new ATOM 0 HA GLU A 126 68.343 20.933 -16.230 1.00 25.00 H new ATOM 0 HB2 GLU A 126 66.770 23.432 -16.251 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.896 22.794 -17.432 1.00 25.00 H new ATOM 0 HG2 GLU A 126 65.961 22.693 -18.656 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.928 21.091 -17.945 1.00 25.00 H new ATOM 743 N LEU A 127 69.112 22.635 -14.416 1.00 25.00 N ATOM 744 CA LEU A 127 69.546 23.366 -13.234 1.00 25.00 C ATOM 745 C LEU A 127 68.725 24.629 -13.054 1.00 25.00 C ATOM 746 O LEU A 127 68.498 25.068 -11.935 1.00 25.00 O ATOM 747 CB LEU A 127 71.020 23.744 -13.330 1.00 25.00 C ATOM 748 CG LEU A 127 71.962 22.968 -12.407 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.375 23.416 -12.694 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.636 23.213 -10.930 1.00 25.00 C ATOM 0 H LEU A 127 69.819 22.539 -15.144 1.00 25.00 H new ATOM 0 HA LEU A 127 69.401 22.710 -12.376 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.348 23.599 -14.359 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.119 24.807 -13.111 1.00 25.00 H new ATOM 0 HG LEU A 127 71.843 21.901 -12.596 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.066 22.876 -12.047 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.617 23.210 -13.737 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.463 24.486 -12.506 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.326 22.645 -10.306 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.735 24.275 -10.707 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.614 22.893 -10.725 1.00 25.00 H new ATOM 762 N HIS A 128 68.248 25.195 -14.153 1.00 25.00 N ATOM 763 CA HIS A 128 67.380 26.367 -14.086 1.00 25.00 C ATOM 764 C HIS A 128 66.149 26.040 -13.243 1.00 25.00 C ATOM 765 O HIS A 128 65.805 26.769 -12.310 1.00 25.00 O ATOM 766 CB HIS A 128 66.947 26.768 -15.499 1.00 25.00 C ATOM 767 CG HIS A 128 66.059 27.972 -15.532 1.00 25.00 C ATOM 768 ND1 HIS A 128 64.689 27.921 -15.584 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.363 29.299 -15.516 1.00 25.00 C ATOM 770 CE1 HIS A 128 64.227 29.168 -15.588 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.206 30.050 -15.549 1.00 25.00 N ATOM 0 H HIS A 128 68.445 24.866 -15.098 1.00 25.00 H new ATOM 0 HA HIS A 128 67.922 27.195 -13.629 1.00 25.00 H new ATOM 0 HB2 HIS A 128 67.835 26.964 -16.100 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.427 25.930 -15.963 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.363 29.704 -15.482 1.00 25.00 H new ATOM 0 HE1 HIS A 128 63.179 29.426 -15.619 1.00 25.00 H new ATOM 0 HE2 HIS A 128 65.126 31.067 -15.544 1.00 25.00 H new ATOM 779 N ASN A 129 65.539 24.907 -13.546 1.00 25.00 N ATOM 780 CA ASN A 129 64.360 24.437 -12.837 1.00 25.00 C ATOM 781 C ASN A 129 64.701 24.010 -11.414 1.00 25.00 C ATOM 782 O ASN A 129 63.949 24.256 -10.490 1.00 25.00 O ATOM 783 CB ASN A 129 63.786 23.251 -13.601 1.00 25.00 C ATOM 784 CG ASN A 129 62.288 23.272 -13.673 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.616 23.799 -12.800 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.755 22.723 -14.726 1.00 25.00 N ATOM 0 H ASN A 129 65.848 24.285 -14.293 1.00 25.00 H new ATOM 0 HA ASN A 129 63.635 25.248 -12.776 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.193 23.245 -14.612 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.109 22.326 -13.122 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.742 22.723 -14.844 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.351 22.293 -15.433 1.00 25.00 H new ATOM 793 N PHE A 130 65.856 23.393 -11.229 1.00 25.00 N ATOM 794 CA PHE A 130 66.270 22.929 -9.904 1.00 25.00 C ATOM 795 C PHE A 130 66.437 24.076 -8.906 1.00 25.00 C ATOM 796 O PHE A 130 66.005 23.974 -7.767 1.00 25.00 O ATOM 797 CB PHE A 130 67.577 22.148 -10.013 1.00 25.00 C ATOM 798 CG PHE A 130 67.995 21.475 -8.729 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.084 20.684 -8.003 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.309 21.617 -8.244 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.481 20.028 -6.810 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.718 20.964 -7.057 1.00 25.00 C ATOM 803 CZ PHE A 130 68.802 20.164 -6.342 1.00 25.00 C ATOM 0 H PHE A 130 66.526 23.199 -11.973 1.00 25.00 H new ATOM 0 HA PHE A 130 65.477 22.284 -9.527 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.473 21.392 -10.791 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.369 22.826 -10.331 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.070 20.576 -8.359 1.00 25.00 H new ATOM 0 HD2 PHE A 130 70.014 22.232 -8.784 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.772 19.426 -6.262 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.730 21.078 -6.699 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.113 19.658 -5.440 1.00 25.00 H new ATOM 813 N ARG A 131 67.035 25.179 -9.335 1.00 25.00 N ATOM 814 CA ARG A 131 67.200 26.349 -8.454 1.00 25.00 C ATOM 815 C ARG A 131 65.855 26.949 -8.130 1.00 25.00 C ATOM 816 O ARG A 131 65.618 27.404 -7.024 1.00 25.00 O ATOM 817 CB ARG A 131 68.058 27.412 -9.126 1.00 25.00 C ATOM 818 CG ARG A 131 69.436 26.916 -9.391 1.00 25.00 C ATOM 819 CD ARG A 131 70.295 27.909 -10.175 1.00 25.00 C ATOM 820 NE ARG A 131 70.553 29.156 -9.425 1.00 25.00 N ATOM 821 CZ ARG A 131 69.959 30.328 -9.640 1.00 25.00 C ATOM 822 NH1 ARG A 131 69.043 30.497 -10.564 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 70.290 31.353 -8.909 1.00 25.00 N ATOM 0 H ARG A 131 67.413 25.298 -10.275 1.00 25.00 H new ATOM 0 HA ARG A 131 67.689 26.014 -7.539 1.00 25.00 H new ATOM 0 HB2 ARG A 131 67.593 27.716 -10.064 1.00 25.00 H new ATOM 0 HB3 ARG A 131 68.105 28.297 -8.492 1.00 25.00 H new ATOM 0 HG2 ARG A 131 69.924 26.694 -8.442 1.00 25.00 H new ATOM 0 HG3 ARG A 131 69.377 25.980 -9.946 1.00 25.00 H new ATOM 0 HD2 ARG A 131 71.245 27.440 -10.429 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.798 28.151 -11.114 1.00 25.00 H new ATOM 0 HE ARG A 131 71.246 29.115 -8.678 1.00 25.00 H new ATOM 0 HH11 ARG A 131 68.760 29.713 -11.152 1.00 25.00 H new ATOM 0 HH12 ARG A 131 68.613 31.413 -10.695 1.00 25.00 H new ATOM 0 HH21 ARG A 131 70.997 31.253 -8.181 1.00 25.00 H new ATOM 0 HH22 ARG A 131 69.842 32.256 -9.064 1.00 25.00 H new ATOM 837 N ALA A 132 64.982 26.929 -9.116 1.00 25.00 N ATOM 838 CA ALA A 132 63.615 27.429 -8.933 1.00 25.00 C ATOM 839 C ALA A 132 62.846 26.550 -7.926 1.00 25.00 C ATOM 840 O ALA A 132 62.175 27.048 -7.036 1.00 25.00 O ATOM 841 CB ALA A 132 62.881 27.481 -10.283 1.00 25.00 C ATOM 0 H ALA A 132 65.183 26.576 -10.052 1.00 25.00 H new ATOM 0 HA ALA A 132 63.666 28.440 -8.530 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.868 27.854 -10.132 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.415 28.146 -10.962 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.839 26.480 -10.713 1.00 25.00 H new ATOM 847 N LEU A 133 62.979 25.240 -8.054 1.00 25.00 N ATOM 848 CA LEU A 133 62.319 24.304 -7.144 1.00 25.00 C ATOM 849 C LEU A 133 62.905 24.427 -5.729 1.00 25.00 C ATOM 850 O LEU A 133 62.198 24.336 -4.733 1.00 25.00 O ATOM 851 CB LEU A 133 62.486 22.879 -7.687 1.00 25.00 C ATOM 852 CG LEU A 133 61.536 21.809 -7.128 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.080 22.097 -7.486 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.932 20.449 -7.695 1.00 25.00 C ATOM 0 H LEU A 133 63.539 24.794 -8.781 1.00 25.00 H new ATOM 0 HA LEU A 133 61.257 24.540 -7.082 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.362 22.911 -8.769 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.510 22.559 -7.493 1.00 25.00 H new ATOM 0 HG LEU A 133 61.621 21.816 -6.041 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.442 21.316 -7.071 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.788 23.062 -7.072 1.00 25.00 H new ATOM 0 HD13 LEU A 133 59.969 22.118 -8.570 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.263 19.683 -7.304 1.00 25.00 H new ATOM 0 HD22 LEU A 133 61.860 20.473 -8.782 1.00 25.00 H new ATOM 0 HD23 LEU A 133 62.957 20.218 -7.405 1.00 25.00 H new ATOM 866 N CYS A 134 64.200 24.698 -5.657 1.00 25.00 N ATOM 867 CA CYS A 134 64.875 24.943 -4.384 1.00 25.00 C ATOM 868 C CYS A 134 64.342 26.211 -3.711 1.00 25.00 C ATOM 869 O CYS A 134 64.221 26.266 -2.489 1.00 25.00 O ATOM 870 CB CYS A 134 66.378 25.102 -4.622 1.00 25.00 C ATOM 871 SG CYS A 134 67.314 25.435 -3.117 1.00 25.00 S ATOM 0 H CYS A 134 64.812 24.755 -6.471 1.00 25.00 H new ATOM 0 HA CYS A 134 64.683 24.092 -3.730 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.762 24.194 -5.086 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.542 25.915 -5.329 1.00 25.00 H new ATOM 0 HG CYS A 134 66.497 25.768 -2.162 1.00 25.00 H new ATOM 877 N GLU A 135 64.036 27.229 -4.507 1.00 25.00 N ATOM 878 CA GLU A 135 63.500 28.488 -3.983 1.00 25.00 C ATOM 879 C GLU A 135 62.164 28.222 -3.301 1.00 25.00 C ATOM 880 O GLU A 135 61.904 28.733 -2.215 1.00 25.00 O ATOM 881 CB GLU A 135 63.296 29.494 -5.128 1.00 25.00 C ATOM 882 CG GLU A 135 62.825 30.872 -4.690 1.00 25.00 C ATOM 883 CD GLU A 135 61.752 31.435 -5.602 1.00 25.00 C ATOM 884 OE1 GLU A 135 62.067 31.711 -6.781 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 60.618 31.659 -5.132 1.00 25.00 O1- ATOM 0 H GLU A 135 64.149 27.211 -5.521 1.00 25.00 H new ATOM 0 HA GLU A 135 64.206 28.905 -3.265 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.236 29.602 -5.670 1.00 25.00 H new ATOM 0 HB3 GLU A 135 62.569 29.083 -5.829 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.439 30.814 -3.672 1.00 25.00 H new ATOM 0 HG3 GLU A 135 63.675 31.554 -4.670 1.00 25.00 H new ATOM 892 N LEU A 136 61.340 27.399 -3.936 1.00 25.00 N ATOM 893 CA LEU A 136 60.005 27.091 -3.426 1.00 25.00 C ATOM 894 C LEU A 136 60.047 26.438 -2.045 1.00 25.00 C ATOM 895 O LEU A 136 59.301 26.824 -1.150 1.00 25.00 O ATOM 896 CB LEU A 136 59.290 26.160 -4.415 1.00 25.00 C ATOM 897 CG LEU A 136 57.824 25.814 -4.110 1.00 25.00 C ATOM 898 CD1 LEU A 136 56.919 27.048 -4.211 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.351 24.742 -5.092 1.00 25.00 C ATOM 0 H LEU A 136 61.572 26.929 -4.811 1.00 25.00 H new ATOM 0 HA LEU A 136 59.463 28.031 -3.324 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.332 26.619 -5.403 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.853 25.229 -4.472 1.00 25.00 H new ATOM 0 HG LEU A 136 57.763 25.443 -3.087 1.00 25.00 H new ATOM 0 HD11 LEU A 136 55.890 26.764 -3.989 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.250 27.801 -3.496 1.00 25.00 H new ATOM 0 HD13 LEU A 136 56.973 27.457 -5.220 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.311 24.490 -4.883 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.435 25.120 -6.111 1.00 25.00 H new ATOM 0 HD23 LEU A 136 57.969 23.851 -4.983 1.00 25.00 H new ATOM 911 N GLU A 137 60.920 25.458 -1.872 1.00 25.00 N ATOM 912 CA GLU A 137 61.022 24.744 -0.596 1.00 25.00 C ATOM 913 C GLU A 137 61.696 25.580 0.486 1.00 25.00 C ATOM 914 O GLU A 137 61.323 25.528 1.655 1.00 25.00 O ATOM 915 CB GLU A 137 61.850 23.472 -0.777 1.00 25.00 C ATOM 916 CG GLU A 137 61.168 22.387 -1.584 1.00 25.00 C ATOM 917 CD GLU A 137 59.915 21.841 -0.912 1.00 25.00 C ATOM 918 OE1 GLU A 137 60.006 21.384 0.250 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.847 21.825 -1.563 1.00 25.00 O1- ATOM 0 H GLU A 137 61.568 25.136 -2.591 1.00 25.00 H new ATOM 0 HA GLU A 137 60.002 24.517 -0.285 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.790 23.732 -1.263 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.099 23.073 0.206 1.00 25.00 H new ATOM 0 HG2 GLU A 137 60.904 22.783 -2.564 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.870 21.570 -1.749 1.00 25.00 H new ATOM 926 N SER A 138 62.740 26.307 0.113 1.00 25.00 N ATOM 927 CA SER A 138 63.539 27.031 1.098 1.00 25.00 C ATOM 928 C SER A 138 62.978 28.408 1.447 1.00 25.00 C ATOM 929 O SER A 138 63.367 28.993 2.458 1.00 25.00 O ATOM 930 CB SER A 138 64.970 27.187 0.598 1.00 25.00 C ATOM 931 OG SER A 138 65.790 27.717 1.625 1.00 25.00 O ATOM 0 H SER A 138 63.053 26.412 -0.852 1.00 25.00 H new ATOM 0 HA SER A 138 63.510 26.433 2.009 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.358 26.221 0.275 1.00 25.00 H new ATOM 0 HB3 SER A 138 64.990 27.846 -0.270 1.00 25.00 H new ATOM 0 HG SER A 138 66.732 27.625 1.372 1.00 25.00 H new ATOM 937 N GLY A 139 62.108 28.942 0.602 1.00 25.00 N ATOM 938 CA GLY A 139 61.528 30.255 0.841 1.00 25.00 C ATOM 939 C GLY A 139 62.529 31.395 0.754 1.00 25.00 C ATOM 940 O GLY A 139 62.373 32.416 1.426 1.00 25.00 O ATOM 0 H GLY A 139 61.789 28.487 -0.253 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.732 30.427 0.116 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.067 30.264 1.829 1.00 25.00 H new ATOM 944 N ILE A 140 63.569 31.231 -0.054 1.00 25.00 N ATOM 945 CA ILE A 140 64.609 32.255 -0.198 1.00 25.00 C ATOM 946 C ILE A 140 64.871 32.572 -1.669 1.00 25.00 C ATOM 947 O ILE A 140 64.865 31.676 -2.504 1.00 25.00 O ATOM 948 CB ILE A 140 65.960 31.812 0.460 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.511 30.511 -0.159 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.794 31.624 1.966 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.671 30.728 -1.118 1.00 25.00 C ATOM 0 H ILE A 140 63.719 30.398 -0.623 1.00 25.00 H new ATOM 0 HA ILE A 140 64.236 33.143 0.313 1.00 25.00 H new ATOM 0 HB ILE A 140 66.677 32.610 0.267 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.835 29.847 0.643 1.00 25.00 H new ATOM 0 HG13 ILE A 140 65.705 30.002 -0.688 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.745 31.316 2.401 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.475 32.564 2.417 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.043 30.857 2.156 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.003 29.767 -1.511 1.00 25.00 H new ATOM 0 HD12 ILE A 140 67.348 31.365 -1.941 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.495 31.208 -0.590 1.00 25.00 H new ATOM 963 N PRO A 141 65.128 33.852 -2.006 1.00 25.00 N ATOM 964 CA PRO A 141 65.432 34.115 -3.419 1.00 25.00 C ATOM 965 C PRO A 141 66.712 33.420 -3.883 1.00 25.00 C ATOM 966 O PRO A 141 67.808 33.687 -3.368 1.00 25.00 O ATOM 967 CB PRO A 141 65.604 35.642 -3.463 1.00 25.00 C ATOM 968 CG PRO A 141 64.890 36.138 -2.256 1.00 25.00 C ATOM 969 CD PRO A 141 65.162 35.097 -1.218 1.00 25.00 C ATOM 0 HA PRO A 141 64.652 33.737 -4.080 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.657 35.922 -3.443 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.179 36.062 -4.375 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.261 37.115 -1.947 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.821 36.246 -2.441 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.128 35.247 -0.735 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.408 35.101 -0.431 1.00 25.00 H new ATOM 977 N ALA A 142 66.583 32.541 -4.867 1.00 25.00 N ATOM 978 CA ALA A 142 67.728 31.805 -5.396 1.00 25.00 C ATOM 979 C ALA A 142 68.736 32.751 -6.061 1.00 25.00 C ATOM 980 O ALA A 142 69.915 32.438 -6.161 1.00 25.00 O ATOM 981 CB ALA A 142 67.245 30.743 -6.396 1.00 25.00 C ATOM 0 H ALA A 142 65.695 32.318 -5.318 1.00 25.00 H new ATOM 0 HA ALA A 142 68.235 31.312 -4.567 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.102 30.196 -6.788 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.571 30.049 -5.893 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.718 31.229 -7.217 1.00 25.00 H new ATOM 987 N ALA A 143 68.260 33.903 -6.518 1.00 25.00 N ATOM 988 CA ALA A 143 69.114 34.898 -7.170 1.00 25.00 C ATOM 989 C ALA A 143 70.153 35.485 -6.203 1.00 25.00 C ATOM 990 O ALA A 143 71.259 35.817 -6.602 1.00 25.00 O ATOM 991 CB ALA A 143 68.241 36.023 -7.743 1.00 25.00 C ATOM 0 H ALA A 143 67.280 34.176 -6.450 1.00 25.00 H new ATOM 0 HA ALA A 143 69.658 34.400 -7.972 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.875 36.764 -8.229 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.545 35.608 -8.472 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.682 36.497 -6.936 1.00 25.00 H new ATOM 997 N GLU A 144 69.784 35.588 -4.934 1.00 25.00 N ATOM 998 CA GLU A 144 70.650 36.172 -3.903 1.00 25.00 C ATOM 999 C GLU A 144 71.558 35.108 -3.285 1.00 25.00 C ATOM 1000 O GLU A 144 72.127 35.305 -2.212 1.00 25.00 O ATOM 1001 CB GLU A 144 69.780 36.785 -2.795 1.00 25.00 C ATOM 1002 CG GLU A 144 68.902 37.938 -3.264 1.00 25.00 C ATOM 1003 CD GLU A 144 69.720 39.099 -3.810 1.00 25.00 C ATOM 1004 OE1 GLU A 144 70.609 39.598 -3.087 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 69.473 39.506 -4.964 1.00 25.00 O1- ATOM 0 H GLU A 144 68.879 35.272 -4.584 1.00 25.00 H new ATOM 0 HA GLU A 144 71.270 36.938 -4.369 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.145 36.006 -2.373 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.427 37.138 -1.992 1.00 25.00 H new ATOM 0 HG2 GLU A 144 68.220 37.582 -4.036 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.289 38.287 -2.433 1.00 25.00 H new ATOM 1012 N SER A 145 71.642 33.954 -3.931 1.00 25.00 N ATOM 1013 CA SER A 145 72.363 32.821 -3.370 1.00 25.00 C ATOM 1014 C SER A 145 73.217 32.097 -4.402 1.00 25.00 C ATOM 1015 O SER A 145 72.954 32.160 -5.603 1.00 25.00 O ATOM 1016 CB SER A 145 71.350 31.836 -2.797 1.00 25.00 C ATOM 1017 OG SER A 145 70.389 32.505 -1.996 1.00 25.00 O ATOM 0 H SER A 145 71.220 33.778 -4.843 1.00 25.00 H new ATOM 0 HA SER A 145 73.033 33.205 -2.601 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.849 31.310 -3.610 1.00 25.00 H new ATOM 0 HB3 SER A 145 71.866 31.084 -2.200 1.00 25.00 H new ATOM 0 HG SER A 145 69.658 32.829 -2.563 1.00 25.00 H new ATOM 1023 N GLN A 146 74.206 31.355 -3.927 1.00 25.00 N ATOM 1024 CA GLN A 146 75.034 30.527 -4.798 1.00 25.00 C ATOM 1025 C GLN A 146 74.874 29.081 -4.367 1.00 25.00 C ATOM 1026 O GLN A 146 74.765 28.789 -3.184 1.00 25.00 O ATOM 1027 CB GLN A 146 76.503 30.952 -4.738 1.00 25.00 C ATOM 1028 CG GLN A 146 77.385 30.180 -5.722 1.00 25.00 C ATOM 1029 CD GLN A 146 78.774 30.749 -5.837 1.00 25.00 C ATOM 1030 OE1 GLN A 146 79.428 31.040 -4.852 1.00 25.00 O ATOM 1031 NE2 GLN A 146 79.234 30.899 -7.048 1.00 25.00 N ATOM 0 H GLN A 146 74.457 31.308 -2.940 1.00 25.00 H new ATOM 0 HA GLN A 146 74.711 30.648 -5.832 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.577 32.018 -4.951 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.879 30.802 -3.726 1.00 25.00 H new ATOM 0 HG2 GLN A 146 77.450 29.139 -5.404 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.914 30.185 -6.705 1.00 25.00 H new ATOM 0 HE21 GLN A 146 78.656 30.644 -7.848 1.00 25.00 H new ATOM 0 HE22 GLN A 146 80.172 31.272 -7.195 1.00 25.00 H new ATOM 1040 N ILE A 147 74.840 28.192 -5.345 1.00 25.00 N ATOM 1041 CA ILE A 147 74.629 26.768 -5.121 1.00 25.00 C ATOM 1042 C ILE A 147 75.896 26.038 -5.595 1.00 25.00 C ATOM 1043 O ILE A 147 76.513 26.430 -6.595 1.00 25.00 O ATOM 1044 CB ILE A 147 73.332 26.311 -5.866 1.00 25.00 C ATOM 1045 CG1 ILE A 147 73.135 24.788 -5.726 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.358 26.801 -7.338 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.809 24.245 -6.318 1.00 25.00 C ATOM 0 H ILE A 147 74.959 28.439 -6.328 1.00 25.00 H new ATOM 0 HA ILE A 147 74.472 26.532 -4.068 1.00 25.00 H new ATOM 0 HB ILE A 147 72.460 26.772 -5.403 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.968 24.282 -6.214 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.178 24.526 -4.669 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.450 26.476 -7.846 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.416 27.889 -7.358 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.227 26.382 -7.846 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.760 23.166 -6.172 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.965 24.717 -5.815 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.768 24.469 -7.384 1.00 25.00 H new ATOM 1059 N VAL A 148 76.325 25.048 -4.827 1.00 25.00 N ATOM 1060 CA VAL A 148 77.590 24.347 -5.048 1.00 25.00 C ATOM 1061 C VAL A 148 77.415 22.842 -4.756 1.00 25.00 C ATOM 1062 O VAL A 148 76.657 22.453 -3.865 1.00 25.00 O ATOM 1063 CB VAL A 148 78.718 25.007 -4.144 1.00 25.00 C ATOM 1064 CG1 VAL A 148 78.435 24.826 -2.646 1.00 25.00 C ATOM 1065 CG2 VAL A 148 80.110 24.467 -4.475 1.00 25.00 C ATOM 0 H VAL A 148 75.802 24.702 -4.023 1.00 25.00 H new ATOM 0 HA VAL A 148 77.897 24.440 -6.090 1.00 25.00 H new ATOM 0 HB VAL A 148 78.699 26.073 -4.373 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.231 25.293 -2.066 1.00 25.00 H new ATOM 0 HG12 VAL A 148 77.483 25.294 -2.396 1.00 25.00 H new ATOM 0 HG13 VAL A 148 78.390 23.763 -2.410 1.00 25.00 H new ATOM 0 HG21 VAL A 148 80.849 24.947 -3.833 1.00 25.00 H new ATOM 0 HG22 VAL A 148 80.131 23.390 -4.311 1.00 25.00 H new ATOM 0 HG23 VAL A 148 80.344 24.679 -5.518 1.00 25.00 H new ATOM 1075 N TYR A 149 78.100 22.007 -5.525 1.00 25.00 N ATOM 1076 CA TYR A 149 78.058 20.548 -5.371 1.00 25.00 C ATOM 1077 C TYR A 149 79.422 20.020 -5.778 1.00 25.00 C ATOM 1078 O TYR A 149 79.994 20.506 -6.748 1.00 25.00 O ATOM 1079 CB TYR A 149 76.992 19.964 -6.288 1.00 25.00 C ATOM 1080 CG TYR A 149 77.133 18.480 -6.565 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.870 17.513 -5.567 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.522 18.034 -7.846 1.00 25.00 C ATOM 1083 CE1 TYR A 149 76.987 16.115 -5.858 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.635 16.651 -8.133 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.364 15.704 -7.145 1.00 25.00 C ATOM 1086 OH TYR A 149 77.472 14.378 -7.476 1.00 25.00 O ATOM 0 H TYR A 149 78.708 22.320 -6.282 1.00 25.00 H new ATOM 0 HA TYR A 149 77.819 20.271 -4.344 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.013 20.145 -5.844 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.016 20.500 -7.237 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.578 17.831 -4.577 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.737 18.757 -8.619 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.786 15.382 -5.091 1.00 25.00 H new ATOM 0 HE2 TYR A 149 77.932 16.329 -9.120 1.00 25.00 H new ATOM 0 HH TYR A 149 76.719 13.883 -7.092 1.00 25.00 H new ATOM 1096 N ALA A 150 79.956 19.071 -5.015 1.00 25.00 N ATOM 1097 CA ALA A 150 81.296 18.519 -5.255 1.00 25.00 C ATOM 1098 C ALA A 150 82.333 19.652 -5.409 1.00 25.00 C ATOM 1099 O ALA A 150 83.165 19.629 -6.312 1.00 25.00 O ATOM 1100 CB ALA A 150 81.281 17.600 -6.500 1.00 25.00 C ATOM 0 H ALA A 150 79.478 18.660 -4.213 1.00 25.00 H new ATOM 0 HA ALA A 150 81.587 17.919 -4.393 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.280 17.197 -6.667 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.581 16.780 -6.338 1.00 25.00 H new ATOM 0 HB3 ALA A 150 80.971 18.175 -7.373 1.00 25.00 H new ATOM 1106 N GLU A 151 82.207 20.652 -4.535 1.00 25.00 N ATOM 1107 CA GLU A 151 83.068 21.854 -4.499 1.00 25.00 C ATOM 1108 C GLU A 151 83.060 22.709 -5.782 1.00 25.00 C ATOM 1109 O GLU A 151 83.835 23.654 -5.907 1.00 25.00 O ATOM 1110 CB GLU A 151 84.511 21.475 -4.122 1.00 25.00 C ATOM 1111 CG GLU A 151 84.615 20.778 -2.768 1.00 25.00 C ATOM 1112 CD GLU A 151 86.056 20.510 -2.365 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.669 19.573 -2.920 1.00 25.00 O ATOM 1114 OE2 GLU A 151 86.570 21.229 -1.480 1.00 25.00 O1- ATOM 0 H GLU A 151 81.488 20.657 -3.811 1.00 25.00 H new ATOM 0 HA GLU A 151 82.627 22.488 -3.730 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.921 20.822 -4.892 1.00 25.00 H new ATOM 0 HB3 GLU A 151 85.125 22.376 -4.108 1.00 25.00 H new ATOM 0 HG2 GLU A 151 84.136 21.394 -2.007 1.00 25.00 H new ATOM 0 HG3 GLU A 151 84.069 19.835 -2.805 1.00 25.00 H new ATOM 1121 N ARG A 152 82.156 22.418 -6.709 1.00 25.00 N ATOM 1122 CA ARG A 152 82.047 23.175 -7.961 1.00 25.00 C ATOM 1123 C ARG A 152 80.683 23.859 -8.023 1.00 25.00 C ATOM 1124 O ARG A 152 79.686 23.301 -7.565 1.00 25.00 O ATOM 1125 CB ARG A 152 82.223 22.222 -9.143 1.00 25.00 C ATOM 1126 CG ARG A 152 83.634 21.632 -9.227 1.00 25.00 C ATOM 1127 CD ARG A 152 83.596 20.166 -9.614 1.00 25.00 C ATOM 1128 NE ARG A 152 83.115 19.969 -10.992 1.00 25.00 N ATOM 1129 CZ ARG A 152 82.903 18.789 -11.564 1.00 25.00 C ATOM 1130 NH1 ARG A 152 83.111 17.660 -10.933 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 82.475 18.747 -12.796 1.00 25.00 N ATOM 0 H ARG A 152 81.481 21.659 -6.621 1.00 25.00 H new ATOM 0 HA ARG A 152 82.824 23.938 -8.005 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.500 21.411 -9.060 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.001 22.754 -10.068 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.220 22.188 -9.958 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.135 21.744 -8.265 1.00 25.00 H new ATOM 0 HD2 ARG A 152 84.594 19.739 -9.514 1.00 25.00 H new ATOM 0 HD3 ARG A 152 82.948 19.626 -8.924 1.00 25.00 H new ATOM 0 HE ARG A 152 82.930 20.803 -11.550 1.00 25.00 H new ATOM 0 HH11 ARG A 152 83.447 17.668 -9.970 1.00 25.00 H new ATOM 0 HH12 ARG A 152 82.937 16.773 -11.405 1.00 25.00 H new ATOM 0 HH21 ARG A 152 82.307 19.613 -13.307 1.00 25.00 H new ATOM 0 HH22 ARG A 152 82.308 17.848 -13.248 1.00 25.00 H new ATOM 1145 N PRO A 153 80.622 25.097 -8.542 1.00 25.00 N ATOM 1146 CA PRO A 153 79.308 25.745 -8.519 1.00 25.00 C ATOM 1147 C PRO A 153 78.322 25.136 -9.507 1.00 25.00 C ATOM 1148 O PRO A 153 78.701 24.622 -10.555 1.00 25.00 O ATOM 1149 CB PRO A 153 79.638 27.193 -8.892 1.00 25.00 C ATOM 1150 CG PRO A 153 80.824 27.078 -9.765 1.00 25.00 C ATOM 1151 CD PRO A 153 81.645 25.980 -9.132 1.00 25.00 C ATOM 0 HA PRO A 153 78.814 25.635 -7.554 1.00 25.00 H new ATOM 0 HB2 PRO A 153 78.806 27.671 -9.410 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.850 27.794 -8.008 1.00 25.00 H new ATOM 0 HG2 PRO A 153 80.543 26.826 -10.788 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.379 28.015 -9.809 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.254 25.456 -9.869 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.326 26.370 -8.375 1.00 25.00 H new ATOM 1159 N LEU A 154 77.048 25.236 -9.173 1.00 25.00 N ATOM 1160 CA LEU A 154 75.964 24.753 -10.032 1.00 25.00 C ATOM 1161 C LEU A 154 75.234 25.970 -10.601 1.00 0.00 C ATOM 1162 O LEU A 154 74.017 26.104 -10.499 1.00 25.00 O ATOM 1163 CB LEU A 154 75.000 23.860 -9.239 1.00 25.00 C ATOM 1164 CG LEU A 154 75.502 22.490 -8.759 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.373 21.783 -8.004 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.956 21.610 -9.916 1.00 25.00 C ATOM 0 H LEU A 154 76.728 25.654 -8.299 1.00 25.00 H new ATOM 0 HA LEU A 154 76.370 24.149 -10.844 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.674 24.420 -8.363 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.118 23.693 -9.857 1.00 25.00 H new ATOM 0 HG LEU A 154 76.361 22.656 -8.109 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.720 20.809 -7.659 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.075 22.386 -7.147 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.519 21.650 -8.668 1.00 25.00 H new ATOM 0 HD21 LEU A 154 76.303 20.651 -9.530 1.00 25.00 H new ATOM 0 HD22 LEU A 154 75.121 21.446 -10.598 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.769 22.102 -10.450 1.00 25.00 H new ATOM 1178 N THR A 155 76.008 26.895 -11.143 1.00 25.00 N ATOM 1179 CA THR A 155 75.468 28.154 -11.655 1.00 25.00 C ATOM 1180 C THR A 155 75.179 28.094 -13.152 1.00 25.00 C ATOM 1181 O THR A 155 74.511 28.972 -13.691 1.00 25.00 O ATOM 1182 CB THR A 155 76.461 29.298 -11.389 1.00 25.00 C ATOM 1183 OG1 THR A 155 77.776 28.873 -11.760 1.00 25.00 O ATOM 1184 CG2 THR A 155 76.488 29.656 -9.905 1.00 25.00 C ATOM 0 H THR A 155 77.019 26.801 -11.242 1.00 25.00 H new ATOM 0 HA THR A 155 74.528 28.332 -11.133 1.00 25.00 H new ATOM 0 HB THR A 155 76.148 30.166 -11.970 1.00 25.00 H new ATOM 0 HG1 THR A 155 78.413 29.599 -11.594 1.00 25.00 H new ATOM 0 HG21 THR A 155 77.197 30.467 -9.739 1.00 25.00 H new ATOM 0 HG22 THR A 155 75.494 29.972 -9.589 1.00 25.00 H new ATOM 0 HG23 THR A 155 76.792 28.784 -9.326 1.00 25.00 H new ATOM 1192 N ASP A 156 75.658 27.052 -13.816 1.00 25.00 N ATOM 1193 CA ASP A 156 75.417 26.875 -15.251 1.00 25.00 C ATOM 1194 C ASP A 156 74.025 26.282 -15.450 1.00 25.00 C ATOM 1195 O ASP A 156 73.843 25.070 -15.516 1.00 25.00 O ATOM 1196 CB ASP A 156 76.474 25.958 -15.866 1.00 25.00 C ATOM 1197 CG ASP A 156 77.867 26.518 -15.740 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.265 27.342 -16.586 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.575 26.119 -14.787 1.00 25.00 O1- ATOM 0 H ASP A 156 76.217 26.313 -13.389 1.00 25.00 H new ATOM 0 HA ASP A 156 75.480 27.843 -15.749 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.432 24.983 -15.380 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.244 25.799 -16.919 1.00 25.00 H new ATOM 1204 N ASN A 157 73.031 27.156 -15.497 1.00 25.00 N ATOM 1205 CA ASN A 157 71.621 26.757 -15.514 1.00 25.00 C ATOM 1206 C ASN A 157 71.189 25.931 -16.729 1.00 25.00 C ATOM 1207 O ASN A 157 70.093 25.379 -16.742 1.00 25.00 O ATOM 1208 CB ASN A 157 70.744 28.010 -15.452 1.00 25.00 C ATOM 1209 CG ASN A 157 70.686 28.744 -16.776 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.704 29.110 -17.336 1.00 25.00 O ATOM 1211 ND2 ASN A 157 69.501 28.946 -17.283 1.00 25.00 N ATOM 0 H ASN A 157 73.174 28.166 -15.525 1.00 25.00 H new ATOM 0 HA ASN A 157 71.495 26.111 -14.645 1.00 25.00 H new ATOM 0 HB2 ASN A 157 69.735 27.729 -15.152 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.129 28.681 -14.685 1.00 25.00 H new ATOM 0 HD21 ASN A 157 69.404 29.425 -18.178 1.00 25.00 H new ATOM 0 HD22 ASN A 157 68.671 28.625 -16.784 1.00 25.00 H new ATOM 1218 N HIS A 158 72.032 25.886 -17.750 1.00 25.00 N ATOM 1219 CA HIS A 158 71.708 25.234 -19.018 1.00 25.00 C ATOM 1220 C HIS A 158 71.994 23.723 -19.058 1.00 25.00 C ATOM 1221 O HIS A 158 71.944 23.112 -20.121 1.00 25.00 O ATOM 1222 CB HIS A 158 72.507 25.921 -20.130 1.00 25.00 C ATOM 1223 CG HIS A 158 71.752 26.064 -21.414 1.00 25.00 C ATOM 1224 ND1 HIS A 158 71.073 27.197 -21.789 1.00 25.00 N ATOM 1225 CD2 HIS A 158 71.566 25.186 -22.438 1.00 25.00 C ATOM 1226 CE1 HIS A 158 70.527 26.979 -22.982 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.800 25.770 -23.428 1.00 25.00 N ATOM 0 H HIS A 158 72.964 26.301 -17.726 1.00 25.00 H new ATOM 0 HA HIS A 158 70.631 25.336 -19.152 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.814 26.909 -19.787 1.00 25.00 H new ATOM 0 HB3 HIS A 158 73.418 25.351 -20.316 1.00 25.00 H new ATOM 0 HD2 HIS A 158 71.960 24.181 -22.471 1.00 25.00 H new ATOM 0 HE1 HIS A 158 69.933 27.704 -23.519 1.00 25.00 H new ATOM 0 HE2 HIS A 158 70.509 25.355 -24.313 1.00 25.00 H new ATOM 1235 N ARG A 159 72.331 23.125 -17.922 1.00 25.00 N ATOM 1236 CA ARG A 159 72.641 21.687 -17.876 1.00 25.00 C ATOM 1237 C ARG A 159 71.704 20.961 -16.936 1.00 25.00 C ATOM 1238 O ARG A 159 71.225 21.544 -15.973 1.00 25.00 O ATOM 1239 CB ARG A 159 74.078 21.473 -17.408 1.00 25.00 C ATOM 1240 CG ARG A 159 75.115 21.918 -18.409 1.00 25.00 C ATOM 1241 CD ARG A 159 76.507 21.536 -17.933 1.00 25.00 C ATOM 1242 NE ARG A 159 77.527 21.876 -18.938 1.00 25.00 N ATOM 1243 CZ ARG A 159 77.878 21.106 -19.965 1.00 25.00 C ATOM 1244 NH1 ARG A 159 77.342 19.928 -20.182 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.791 21.535 -20.791 1.00 25.00 N ATOM 0 H ARG A 159 72.399 23.602 -17.023 1.00 25.00 H new ATOM 0 HA ARG A 159 72.516 21.287 -18.882 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.231 22.015 -16.475 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.226 20.415 -17.191 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.916 21.459 -19.377 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.055 22.997 -18.549 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.728 22.051 -16.998 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.542 20.467 -17.724 1.00 25.00 H new ATOM 0 HE ARG A 159 78.003 22.773 -18.840 1.00 25.00 H new ATOM 0 HH11 ARG A 159 76.626 19.569 -19.550 1.00 25.00 H new ATOM 0 HH12 ARG A 159 77.641 19.371 -20.982 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.223 22.447 -20.644 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.073 20.959 -21.584 1.00 25.00 H new ATOM 1259 N SER A 160 71.464 19.689 -17.211 1.00 25.00 N ATOM 1260 CA SER A 160 70.621 18.866 -16.354 1.00 25.00 C ATOM 1261 C SER A 160 71.437 18.282 -15.210 1.00 25.00 C ATOM 1262 O SER A 160 72.664 18.276 -15.251 1.00 25.00 O ATOM 1263 CB SER A 160 69.985 17.745 -17.167 1.00 25.00 C ATOM 1264 OG SER A 160 70.965 16.934 -17.796 1.00 25.00 O ATOM 0 H SER A 160 71.842 19.201 -18.023 1.00 25.00 H new ATOM 0 HA SER A 160 69.833 19.492 -15.936 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.366 17.129 -16.515 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.326 18.172 -17.923 1.00 25.00 H new ATOM 0 HG SER A 160 70.537 16.369 -18.473 1.00 25.00 H new ATOM 1270 N LEU A 161 70.761 17.807 -14.179 1.00 25.00 N ATOM 1271 CA LEU A 161 71.429 17.302 -12.972 1.00 25.00 C ATOM 1272 C LEU A 161 72.211 16.001 -13.240 1.00 25.00 C ATOM 1273 O LEU A 161 73.318 15.777 -12.694 1.00 25.00 O ATOM 1274 CB LEU A 161 70.370 17.105 -11.878 1.00 25.00 C ATOM 1275 CG LEU A 161 69.538 18.373 -11.574 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.388 18.035 -10.659 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.372 19.498 -10.956 1.00 25.00 C ATOM 0 H LEU A 161 69.743 17.756 -14.145 1.00 25.00 H new ATOM 0 HA LEU A 161 72.169 18.032 -12.643 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.695 16.304 -12.179 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.864 16.779 -10.963 1.00 25.00 H new ATOM 0 HG LEU A 161 69.162 18.736 -12.530 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.810 18.936 -10.453 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.747 17.295 -11.138 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.774 17.630 -9.724 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.734 20.361 -10.765 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.808 19.154 -10.018 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.168 19.781 -11.644 1.00 25.00 H new ATOM 1289 N ALA A 162 71.695 15.189 -14.153 1.00 25.00 N ATOM 1290 CA ALA A 162 72.394 13.982 -14.587 1.00 25.00 C ATOM 1291 C ALA A 162 73.746 14.341 -15.223 1.00 25.00 C ATOM 1292 O ALA A 162 74.705 13.581 -15.126 1.00 25.00 O ATOM 1293 CB ALA A 162 71.530 13.202 -15.580 1.00 25.00 C ATOM 0 H ALA A 162 70.795 15.342 -14.609 1.00 25.00 H new ATOM 0 HA ALA A 162 72.580 13.355 -13.715 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.061 12.304 -15.897 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.592 12.919 -15.102 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.321 13.826 -16.449 1.00 25.00 H new ATOM 1299 N SER A 163 73.833 15.515 -15.838 1.00 25.00 N ATOM 1300 CA SER A 163 75.081 15.963 -16.469 1.00 25.00 C ATOM 1301 C SER A 163 76.177 16.265 -15.444 1.00 25.00 C ATOM 1302 O SER A 163 77.352 16.335 -15.797 1.00 25.00 O ATOM 1303 CB SER A 163 74.847 17.217 -17.315 1.00 25.00 C ATOM 1304 OG SER A 163 73.860 16.997 -18.312 1.00 25.00 O ATOM 0 H SER A 163 73.060 16.176 -15.916 1.00 25.00 H new ATOM 0 HA SER A 163 75.413 15.140 -17.102 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.537 18.039 -16.670 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.782 17.518 -17.788 1.00 25.00 H new ATOM 0 HG SER A 163 72.971 17.003 -17.899 1.00 25.00 H new ATOM 1310 N TYR A 164 75.803 16.422 -14.179 1.00 25.00 N ATOM 1311 CA TYR A 164 76.784 16.650 -13.113 1.00 25.00 C ATOM 1312 C TYR A 164 77.037 15.359 -12.368 1.00 25.00 C ATOM 1313 O TYR A 164 77.878 15.298 -11.476 1.00 25.00 O ATOM 1314 CB TYR A 164 76.282 17.706 -12.133 1.00 25.00 C ATOM 1315 CG TYR A 164 76.231 19.066 -12.761 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.369 19.898 -12.760 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.058 19.529 -13.382 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.335 21.165 -13.379 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.024 20.784 -14.006 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.162 21.592 -14.001 1.00 25.00 C ATOM 1321 OH TYR A 164 76.128 22.809 -14.611 1.00 25.00 O ATOM 0 H TYR A 164 74.834 16.397 -13.863 1.00 25.00 H new ATOM 0 HA TYR A 164 77.709 17.003 -13.568 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.288 17.431 -11.779 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.935 17.732 -11.261 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.276 19.562 -12.280 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.173 18.911 -13.378 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.209 21.799 -13.371 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.120 21.124 -14.489 1.00 25.00 H new ATOM 0 HH TYR A 164 75.841 23.490 -13.967 1.00 25.00 H new ATOM 1331 N GLY A 165 76.289 14.329 -12.733 1.00 25.00 N ATOM 1332 CA GLY A 165 76.377 13.063 -12.040 1.00 25.00 C ATOM 1333 C GLY A 165 75.640 13.131 -10.720 1.00 25.00 C ATOM 1334 O GLY A 165 76.005 12.421 -9.785 1.00 25.00 O ATOM 0 H GLY A 165 75.619 14.349 -13.502 1.00 25.00 H new ATOM 0 HA2 GLY A 165 75.954 12.272 -12.659 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.423 12.808 -11.867 1.00 25.00 H new ATOM 1338 N LEU A 166 74.618 13.979 -10.628 1.00 25.00 N ATOM 1339 CA LEU A 166 73.867 14.087 -9.376 1.00 25.00 C ATOM 1340 C LEU A 166 72.986 12.856 -9.192 1.00 25.00 C ATOM 1341 O LEU A 166 71.825 12.830 -9.584 1.00 25.00 O ATOM 1342 CB LEU A 166 73.041 15.373 -9.348 1.00 25.00 C ATOM 1343 CG LEU A 166 73.859 16.569 -8.849 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.300 17.886 -9.336 1.00 25.00 C ATOM 1345 CD2 LEU A 166 73.881 16.562 -7.331 1.00 25.00 C ATOM 0 H LEU A 166 74.296 14.587 -11.381 1.00 25.00 H new ATOM 0 HA LEU A 166 74.570 14.133 -8.544 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.664 15.584 -10.349 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.173 15.233 -8.703 1.00 25.00 H new ATOM 0 HG LEU A 166 74.868 16.471 -9.249 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.913 18.704 -8.957 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.306 17.903 -10.426 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.277 18.002 -8.977 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.462 17.411 -6.972 1.00 25.00 H new ATOM 0 HD22 LEU A 166 72.862 16.633 -6.952 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.335 15.636 -6.978 1.00 25.00 H new ATOM 1357 N LYS A 167 73.591 11.825 -8.627 1.00 25.00 N ATOM 1358 CA LYS A 167 72.924 10.546 -8.356 1.00 25.00 C ATOM 1359 C LYS A 167 71.897 10.689 -7.255 1.00 25.00 C ATOM 1360 O LYS A 167 71.982 11.584 -6.426 1.00 25.00 O ATOM 1361 CB LYS A 167 73.949 9.521 -7.881 1.00 25.00 C ATOM 1362 CG LYS A 167 75.013 9.197 -8.894 1.00 25.00 C ATOM 1363 CD LYS A 167 76.071 8.339 -8.257 1.00 25.00 C ATOM 1364 CE LYS A 167 77.230 8.145 -9.203 1.00 25.00 C ATOM 1365 NZ LYS A 167 78.310 7.369 -8.527 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.569 11.844 -8.338 1.00 25.00 H new ATOM 0 HA LYS A 167 72.441 10.228 -9.280 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.427 9.895 -6.976 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.429 8.602 -7.611 1.00 25.00 H new ATOM 0 HG2 LYS A 167 74.573 8.677 -9.745 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.457 10.116 -9.276 1.00 25.00 H new ATOM 0 HD2 LYS A 167 76.420 8.805 -7.335 1.00 25.00 H new ATOM 0 HD3 LYS A 167 75.649 7.371 -7.986 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.897 7.619 -10.098 1.00 25.00 H new ATOM 0 HE3 LYS A 167 77.613 9.113 -9.527 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 79.106 7.238 -9.183 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 78.636 7.887 -7.686 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 77.942 6.440 -8.240 1.00 25.00 H new ATOM 1379 N ASP A 168 70.981 9.742 -7.192 1.00 25.00 N ATOM 1380 CA ASP A 168 70.023 9.692 -6.104 1.00 25.00 C ATOM 1381 C ASP A 168 70.785 9.565 -4.785 1.00 25.00 C ATOM 1382 O ASP A 168 71.684 8.737 -4.640 1.00 25.00 O ATOM 1383 CB ASP A 168 69.037 8.526 -6.286 1.00 25.00 C ATOM 1384 CG ASP A 168 69.732 7.169 -6.440 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.477 6.980 -7.436 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.430 6.258 -5.640 1.00 25.00 O1- ATOM 0 H ASP A 168 70.880 8.997 -7.881 1.00 25.00 H new ATOM 0 HA ASP A 168 69.434 10.609 -6.098 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.366 8.488 -5.428 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.420 8.713 -7.165 1.00 25.00 H new ATOM 1391 N GLY A 169 70.455 10.442 -3.849 1.00 25.00 N ATOM 1392 CA GLY A 169 71.122 10.465 -2.557 1.00 25.00 C ATOM 1393 C GLY A 169 72.223 11.504 -2.443 1.00 25.00 C ATOM 1394 O GLY A 169 72.704 11.759 -1.339 1.00 25.00 O ATOM 0 H GLY A 169 69.728 11.148 -3.961 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.380 10.652 -1.781 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.546 9.480 -2.362 1.00 25.00 H new ATOM 1398 N ASP A 170 72.620 12.127 -3.548 1.00 25.00 N ATOM 1399 CA ASP A 170 73.630 13.186 -3.480 1.00 25.00 C ATOM 1400 C ASP A 170 73.025 14.420 -2.816 1.00 25.00 C ATOM 1401 O ASP A 170 71.808 14.648 -2.864 1.00 25.00 O ATOM 1402 CB ASP A 170 74.153 13.577 -4.868 1.00 25.00 C ATOM 1403 CG ASP A 170 75.367 12.760 -5.295 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.192 12.407 -4.424 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.574 12.593 -6.517 1.00 25.00 O1- ATOM 0 H ASP A 170 72.269 11.926 -4.484 1.00 25.00 H new ATOM 0 HA ASP A 170 74.469 12.803 -2.899 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.357 13.446 -5.601 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.415 14.635 -4.867 1.00 25.00 H new ATOM 1410 N VAL A 171 73.883 15.222 -2.203 1.00 25.00 N ATOM 1411 CA VAL A 171 73.452 16.422 -1.495 1.00 25.00 C ATOM 1412 C VAL A 171 74.182 17.642 -2.054 1.00 25.00 C ATOM 1413 O VAL A 171 75.386 17.590 -2.333 1.00 25.00 O ATOM 1414 CB VAL A 171 73.662 16.263 0.058 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.092 15.822 0.387 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.311 17.561 0.817 1.00 25.00 C ATOM 0 H VAL A 171 74.890 15.063 -2.181 1.00 25.00 H new ATOM 0 HA VAL A 171 72.384 16.569 -1.654 1.00 25.00 H new ATOM 0 HB VAL A 171 72.978 15.482 0.392 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.203 15.722 1.467 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.296 14.863 -0.089 1.00 25.00 H new ATOM 0 HG13 VAL A 171 75.797 16.567 0.018 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.469 17.412 1.885 1.00 25.00 H new ATOM 0 HG22 VAL A 171 73.949 18.372 0.466 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.267 17.817 0.637 1.00 25.00 H new ATOM 1426 N VAL A 172 73.452 18.736 -2.237 1.00 25.00 N ATOM 1427 CA VAL A 172 74.037 19.978 -2.740 1.00 25.00 C ATOM 1428 C VAL A 172 73.945 21.009 -1.626 1.00 25.00 C ATOM 1429 O VAL A 172 73.169 20.843 -0.684 1.00 25.00 O ATOM 1430 CB VAL A 172 73.312 20.486 -4.027 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.282 19.383 -5.090 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.886 20.932 -3.724 1.00 25.00 C ATOM 0 H VAL A 172 72.452 18.790 -2.045 1.00 25.00 H new ATOM 0 HA VAL A 172 75.075 19.805 -3.024 1.00 25.00 H new ATOM 0 HB VAL A 172 73.871 21.343 -4.402 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.774 19.751 -5.982 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.302 19.096 -5.346 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.749 18.516 -4.700 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.411 21.279 -4.641 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.321 20.093 -3.318 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.905 21.743 -2.996 1.00 25.00 H new ATOM 1442 N ILE A 173 74.737 22.062 -1.716 1.00 25.00 N ATOM 1443 CA ILE A 173 74.759 23.096 -0.686 1.00 25.00 C ATOM 1444 C ILE A 173 74.466 24.431 -1.353 1.00 25.00 C ATOM 1445 O ILE A 173 75.049 24.762 -2.374 1.00 25.00 O ATOM 1446 CB ILE A 173 76.146 23.137 0.035 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.389 21.808 0.784 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.225 24.342 1.018 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.820 21.625 1.321 1.00 25.00 C ATOM 0 H ILE A 173 75.377 22.228 -2.493 1.00 25.00 H new ATOM 0 HA ILE A 173 74.006 22.879 0.071 1.00 25.00 H new ATOM 0 HB ILE A 173 76.925 23.266 -0.717 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.691 21.744 1.619 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.159 20.981 0.112 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.199 24.349 1.507 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.090 25.272 0.465 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.442 24.250 1.770 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.897 20.665 1.831 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.526 21.652 0.491 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.051 22.428 2.021 1.00 25.00 H new ATOM 1461 N LEU A 174 73.573 25.202 -0.761 1.00 25.00 N ATOM 1462 CA LEU A 174 73.247 26.536 -1.239 1.00 25.00 C ATOM 1463 C LEU A 174 73.583 27.492 -0.107 1.00 25.00 C ATOM 1464 O LEU A 174 73.271 27.221 1.044 1.00 25.00 O ATOM 1465 CB LEU A 174 71.764 26.614 -1.619 1.00 25.00 C ATOM 1466 CG LEU A 174 71.282 28.007 -2.053 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.272 27.904 -3.187 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.650 28.737 -0.871 1.00 25.00 C ATOM 0 H LEU A 174 73.050 24.921 0.069 1.00 25.00 H new ATOM 0 HA LEU A 174 73.813 26.793 -2.134 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.574 25.910 -2.429 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.168 26.288 -0.767 1.00 25.00 H new ATOM 0 HG LEU A 174 72.147 28.568 -2.406 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.946 28.903 -3.476 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.734 27.412 -4.042 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.411 27.323 -2.856 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.312 29.723 -1.191 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.799 28.164 -0.502 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.386 28.846 -0.075 1.00 25.00 H new ATOM 1480 N ARG A 175 74.248 28.594 -0.420 1.00 25.00 N ATOM 1481 CA ARG A 175 74.632 29.574 0.597 1.00 25.00 C ATOM 1482 C ARG A 175 74.139 30.961 0.219 1.00 25.00 C ATOM 1483 O ARG A 175 74.383 31.443 -0.886 1.00 25.00 O ATOM 1484 CB ARG A 175 76.152 29.582 0.777 1.00 25.00 C ATOM 1485 CG ARG A 175 76.722 28.200 1.097 1.00 25.00 C ATOM 1486 CD ARG A 175 78.178 28.261 1.550 1.00 25.00 C ATOM 1487 NE ARG A 175 78.315 28.812 2.913 1.00 25.00 N ATOM 1488 CZ ARG A 175 78.204 28.113 4.041 1.00 25.00 C ATOM 1489 NH1 ARG A 175 77.943 26.829 4.052 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 78.361 28.723 5.182 1.00 25.00 N ATOM 0 H ARG A 175 74.535 28.836 -1.368 1.00 25.00 H new ATOM 0 HA ARG A 175 74.167 29.290 1.541 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.618 29.960 -0.133 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.414 30.272 1.579 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.121 27.734 1.878 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.645 27.565 0.214 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.609 27.260 1.520 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.748 28.875 0.853 1.00 25.00 H new ATOM 0 HE ARG A 175 78.511 29.809 2.997 1.00 25.00 H new ATOM 0 HH11 ARG A 175 77.816 26.327 3.173 1.00 25.00 H new ATOM 0 HH12 ARG A 175 77.866 26.332 4.939 1.00 25.00 H new ATOM 0 HH21 ARG A 175 78.566 29.722 5.202 1.00 25.00 H new ATOM 0 HH22 ARG A 175 78.279 28.201 6.055 1.00 25.00 H new ATOM 1504 N GLN A 176 73.449 31.594 1.168 1.00 25.00 N ATOM 1505 CA GLN A 176 72.923 32.956 1.042 1.00 25.00 C ATOM 1506 C GLN A 176 73.662 33.915 1.981 1.00 25.00 C ATOM 1507 O GLN A 176 73.624 33.887 3.202 1.00 25.00 O ATOM 1508 CB GLN A 176 71.401 32.990 1.303 1.00 25.00 C ATOM 1509 CG GLN A 176 70.832 34.373 0.943 1.00 25.00 C ATOM 1510 CD GLN A 176 69.349 34.420 1.152 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.829 34.495 2.247 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.614 34.384 0.057 1.00 25.00 N ATOM 1513 OXT GLN A 176 74.336 34.720 1.401 1.00 25.00 O ATOM 0 H GLN A 176 73.234 31.165 2.068 1.00 25.00 H new ATOM 0 HA GLN A 176 73.093 33.288 0.018 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.906 32.220 0.712 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.199 32.767 2.351 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.312 35.137 1.554 1.00 25.00 H new ATOM 0 HG3 GLN A 176 71.063 34.605 -0.097 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.063 34.321 -0.857 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.597 34.419 0.124 1.00 25.00 H new TER 1523 GLN A 176