USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 747 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 101 HIS : no HD1:sc= -0.546 X(o=-2.3,f=-2.3) USER MOD Set 1.2: A 106 HIS : no HD1:sc= -1.72 X(o=-2.3,f=-2.3!) USER MOD Set 2.1: A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= -0.0846 K(o=-0.085,f=-1.6!) USER MOD Single : A 76 LYS NZ :NH3+ -129:sc= 0.571 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.0494 USER MOD Single : A 82 MET CE :methyl -140:sc= -1.24 (180deg=-5.02!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -1.23 X(o=-1.2,f=-1.2) USER MOD Single : A 93 SER OG : rot 32:sc= 0.597 USER MOD Single : A 94 CYS SG : rot 180:sc= -1.32 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 148:sc= 0 (180deg=-0.843) USER MOD Single : A 108 GLN : amide:sc= -0.239 X(o=-0.24,f=-0.022) USER MOD Single : A 110 SER OG : rot -130:sc= -2.32! USER MOD Single : A 112 HIS : no HD1:sc= -0.131 X(o=-0.13,f=-0.33) USER MOD Single : A 121 ASN : amide:sc= -2.12 K(o=-2.1,f=-6.4!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.715 X(o=-0.72,f=-0.73) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 129 SER OG : rot 180:sc= -0.14 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 GLN : amide:sc= -3.63 K(o=-3.6,f=-8.2!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 MET CE :methyl 155:sc= -2.89 (180deg=-6.37!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= -0.0214 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl 155:sc= -0.163 (180deg=-1.14) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -0.784 K(o=-0.78,f=-2.5!) USER MOD Single : A 152 GLN : amide:sc=-0.00781 K(o=-0.0078,f=-0.65) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 126 TYR OH : rot 180:sc= -0.1 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 69 6.922 13.427 2.904 1.00 0.00 N ATOM 2 CA VAL A 69 6.797 12.084 3.529 1.00 0.00 C ATOM 3 C VAL A 69 5.715 12.078 4.604 1.00 0.00 C ATOM 4 O VAL A 69 5.745 12.884 5.535 1.00 0.00 O ATOM 5 CB VAL A 69 8.133 11.633 4.155 1.00 0.00 C ATOM 6 CG1 VAL A 69 8.563 12.592 5.256 1.00 0.00 C ATOM 7 CG2 VAL A 69 8.024 10.211 4.687 1.00 0.00 C ATOM 0 HA VAL A 69 6.521 11.387 2.737 1.00 0.00 H new ATOM 0 HB VAL A 69 8.897 11.647 3.377 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.507 12.255 5.684 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.689 13.591 4.839 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.801 12.617 6.035 1.00 0.00 H new ATOM 0 HG21 VAL A 69 8.977 9.912 5.124 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.245 10.166 5.448 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.772 9.535 3.870 1.00 0.00 H new ATOM 17 N ARG A 70 4.759 11.164 4.470 1.00 0.00 N ATOM 18 CA ARG A 70 3.667 11.052 5.429 1.00 0.00 C ATOM 19 C ARG A 70 3.675 9.685 6.105 1.00 0.00 C ATOM 20 O ARG A 70 3.656 8.651 5.438 1.00 0.00 O ATOM 21 CB ARG A 70 2.323 11.281 4.733 1.00 0.00 C ATOM 22 CG ARG A 70 1.841 12.721 4.798 1.00 0.00 C ATOM 23 CD ARG A 70 0.561 12.915 4.001 1.00 0.00 C ATOM 24 NE ARG A 70 -0.283 13.966 4.566 1.00 0.00 N ATOM 25 CZ ARG A 70 0.002 15.264 4.496 1.00 0.00 C ATOM 26 NH1 ARG A 70 1.109 15.675 3.890 1.00 0.00 N ATOM 27 NH2 ARG A 70 -0.821 16.153 5.035 1.00 0.00 N ATOM 0 H ARG A 70 4.719 10.490 3.706 1.00 0.00 H new ATOM 0 HA ARG A 70 3.808 11.817 6.193 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.409 10.982 3.688 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.573 10.635 5.189 1.00 0.00 H new ATOM 0 HG2 ARG A 70 1.670 13.002 5.837 1.00 0.00 H new ATOM 0 HG3 ARG A 70 2.616 13.383 4.412 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.811 13.166 2.970 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.005 11.978 3.975 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.141 13.688 5.042 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.746 14.995 3.475 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.323 16.671 3.839 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.672 15.842 5.503 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.603 17.148 4.982 1.00 0.00 H new ATOM 41 N LEU A 71 3.701 9.688 7.434 1.00 0.00 N ATOM 42 CA LEU A 71 3.709 8.447 8.200 1.00 0.00 C ATOM 43 C LEU A 71 2.309 8.110 8.702 1.00 0.00 C ATOM 44 O LEU A 71 1.852 8.650 9.709 1.00 0.00 O ATOM 45 CB LEU A 71 4.678 8.560 9.380 1.00 0.00 C ATOM 46 CG LEU A 71 5.897 7.638 9.307 1.00 0.00 C ATOM 47 CD1 LEU A 71 7.125 8.327 9.879 1.00 0.00 C ATOM 48 CD2 LEU A 71 5.621 6.335 10.045 1.00 0.00 C ATOM 0 H LEU A 71 3.717 10.535 8.002 1.00 0.00 H new ATOM 0 HA LEU A 71 4.041 7.643 7.543 1.00 0.00 H new ATOM 0 HB2 LEU A 71 5.025 9.591 9.448 1.00 0.00 H new ATOM 0 HB3 LEU A 71 4.134 8.345 10.300 1.00 0.00 H new ATOM 0 HG LEU A 71 6.093 7.407 8.260 1.00 0.00 H new ATOM 0 HD11 LEU A 71 7.981 7.655 9.818 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.333 9.232 9.309 1.00 0.00 H new ATOM 0 HD13 LEU A 71 6.943 8.589 10.921 1.00 0.00 H new ATOM 0 HD21 LEU A 71 6.497 5.690 9.984 1.00 0.00 H new ATOM 0 HD22 LEU A 71 5.400 6.549 11.091 1.00 0.00 H new ATOM 0 HD23 LEU A 71 4.768 5.832 9.589 1.00 0.00 H new ATOM 60 N ILE A 72 1.634 7.209 7.995 1.00 0.00 N ATOM 61 CA ILE A 72 0.288 6.797 8.369 1.00 0.00 C ATOM 62 C ILE A 72 0.326 5.545 9.237 1.00 0.00 C ATOM 63 O ILE A 72 1.157 4.660 9.030 1.00 0.00 O ATOM 64 CB ILE A 72 -0.585 6.522 7.129 1.00 0.00 C ATOM 65 CG1 ILE A 72 -0.489 7.687 6.142 1.00 0.00 C ATOM 66 CG2 ILE A 72 -2.031 6.286 7.540 1.00 0.00 C ATOM 67 CD1 ILE A 72 -1.288 7.473 4.875 1.00 0.00 C ATOM 0 H ILE A 72 1.998 6.751 7.160 1.00 0.00 H new ATOM 0 HA ILE A 72 -0.151 7.620 8.933 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.217 5.622 6.636 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.836 8.597 6.632 1.00 0.00 H new ATOM 0 HG13 ILE A 72 0.557 7.845 5.880 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.635 6.093 6.653 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.084 5.427 8.208 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -2.412 7.169 8.053 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.173 8.338 4.222 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.926 6.582 4.363 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.341 7.345 5.126 1.00 0.00 H new ATOM 79 N GLN A 73 -0.573 5.475 10.212 1.00 0.00 N ATOM 80 CA GLN A 73 -0.633 4.329 11.110 1.00 0.00 C ATOM 81 C GLN A 73 -2.062 3.819 11.258 1.00 0.00 C ATOM 82 O GLN A 73 -2.962 4.563 11.651 1.00 0.00 O ATOM 83 CB GLN A 73 -0.068 4.702 12.482 1.00 0.00 C ATOM 84 CG GLN A 73 1.435 4.931 12.477 1.00 0.00 C ATOM 85 CD GLN A 73 1.866 5.990 13.473 1.00 0.00 C ATOM 86 OE1 GLN A 73 1.067 6.460 14.283 1.00 0.00 O ATOM 87 NE2 GLN A 73 3.137 6.372 13.417 1.00 0.00 N ATOM 0 H GLN A 73 -1.269 6.197 10.400 1.00 0.00 H new ATOM 0 HA GLN A 73 -0.029 3.532 10.677 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -0.564 5.605 12.837 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -0.304 3.909 13.191 1.00 0.00 H new ATOM 0 HG2 GLN A 73 1.942 3.994 12.706 1.00 0.00 H new ATOM 0 HG3 GLN A 73 1.750 5.228 11.477 1.00 0.00 H new ATOM 0 HE21 GLN A 73 3.765 5.956 12.729 1.00 0.00 H new ATOM 0 HE22 GLN A 73 3.485 7.082 14.062 1.00 0.00 H new ATOM 96 N PHE A 74 -2.262 2.543 10.947 1.00 0.00 N ATOM 97 CA PHE A 74 -3.579 1.926 11.050 1.00 0.00 C ATOM 98 C PHE A 74 -3.457 0.481 11.524 1.00 0.00 C ATOM 99 O PHE A 74 -2.661 -0.292 10.992 1.00 0.00 O ATOM 100 CB PHE A 74 -4.304 1.978 9.703 1.00 0.00 C ATOM 101 CG PHE A 74 -3.602 1.228 8.606 1.00 0.00 C ATOM 102 CD1 PHE A 74 -3.764 -0.141 8.471 1.00 0.00 C ATOM 103 CD2 PHE A 74 -2.781 1.894 7.711 1.00 0.00 C ATOM 104 CE1 PHE A 74 -3.121 -0.832 7.461 1.00 0.00 C ATOM 105 CE2 PHE A 74 -2.135 1.208 6.700 1.00 0.00 C ATOM 106 CZ PHE A 74 -2.304 -0.156 6.575 1.00 0.00 C ATOM 0 H PHE A 74 -1.527 1.915 10.621 1.00 0.00 H new ATOM 0 HA PHE A 74 -4.161 2.486 11.782 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -5.307 1.570 9.825 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.418 3.020 9.403 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -4.400 -0.674 9.162 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -2.644 2.961 7.804 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -3.257 -1.899 7.365 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -1.498 1.739 6.008 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.799 -0.694 5.786 1.00 0.00 H new ATOM 116 N GLU A 75 -4.244 0.128 12.535 1.00 0.00 N ATOM 117 CA GLU A 75 -4.216 -1.221 13.088 1.00 0.00 C ATOM 118 C GLU A 75 -5.027 -2.189 12.233 1.00 0.00 C ATOM 119 O GLU A 75 -6.095 -1.844 11.728 1.00 0.00 O ATOM 120 CB GLU A 75 -4.750 -1.218 14.521 1.00 0.00 C ATOM 121 CG GLU A 75 -6.214 -0.820 14.623 1.00 0.00 C ATOM 122 CD GLU A 75 -6.474 0.168 15.743 1.00 0.00 C ATOM 123 OE1 GLU A 75 -5.586 1.003 16.017 1.00 0.00 O ATOM 124 OE2 GLU A 75 -7.565 0.107 16.348 1.00 0.00 O ATOM 0 H GLU A 75 -4.908 0.756 12.987 1.00 0.00 H new ATOM 0 HA GLU A 75 -3.179 -1.558 13.091 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.621 -2.212 14.950 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.153 -0.532 15.121 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -6.535 -0.384 13.677 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.819 -1.713 14.783 1.00 0.00 H new ATOM 131 N LYS A 76 -4.511 -3.404 12.084 1.00 0.00 N ATOM 132 CA LYS A 76 -5.182 -4.433 11.300 1.00 0.00 C ATOM 133 C LYS A 76 -5.297 -5.724 12.103 1.00 0.00 C ATOM 134 O LYS A 76 -4.296 -6.384 12.380 1.00 0.00 O ATOM 135 CB LYS A 76 -4.422 -4.689 9.996 1.00 0.00 C ATOM 136 CG LYS A 76 -5.058 -4.032 8.782 1.00 0.00 C ATOM 137 CD LYS A 76 -5.862 -5.030 7.964 1.00 0.00 C ATOM 138 CE LYS A 76 -5.825 -4.695 6.483 1.00 0.00 C ATOM 139 NZ LYS A 76 -4.694 -5.371 5.788 1.00 0.00 N ATOM 0 H LYS A 76 -3.627 -3.701 12.498 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.185 -4.083 11.058 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -3.401 -4.324 10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -4.360 -5.764 9.826 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -5.707 -3.219 9.106 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.281 -3.590 8.158 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -5.466 -6.033 8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -6.895 -5.037 8.311 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -6.766 -4.993 6.020 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -5.735 -3.616 6.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -4.155 -4.671 5.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -4.070 -5.815 6.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -5.067 -6.100 5.147 1.00 0.00 H new ATOM 153 N VAL A 77 -6.521 -6.074 12.481 1.00 0.00 N ATOM 154 CA VAL A 77 -6.760 -7.283 13.259 1.00 0.00 C ATOM 155 C VAL A 77 -7.521 -8.328 12.446 1.00 0.00 C ATOM 156 O VAL A 77 -7.434 -9.525 12.720 1.00 0.00 O ATOM 157 CB VAL A 77 -7.538 -6.961 14.560 1.00 0.00 C ATOM 158 CG1 VAL A 77 -9.000 -7.388 14.466 1.00 0.00 C ATOM 159 CG2 VAL A 77 -6.861 -7.613 15.756 1.00 0.00 C ATOM 0 H VAL A 77 -7.361 -5.539 12.262 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.786 -7.694 13.523 1.00 0.00 H new ATOM 0 HB VAL A 77 -7.525 -5.880 14.696 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -9.511 -7.145 15.398 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.480 -6.862 13.641 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -9.055 -8.463 14.292 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.419 -7.378 16.663 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.836 -8.694 15.615 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.843 -7.235 15.848 1.00 0.00 H new ATOM 169 N THR A 78 -8.275 -7.866 11.456 1.00 0.00 N ATOM 170 CA THR A 78 -9.060 -8.759 10.616 1.00 0.00 C ATOM 171 C THR A 78 -8.266 -9.213 9.399 1.00 0.00 C ATOM 172 O THR A 78 -7.354 -8.521 8.947 1.00 0.00 O ATOM 173 CB THR A 78 -10.348 -8.066 10.168 1.00 0.00 C ATOM 174 OG1 THR A 78 -10.451 -6.771 10.735 1.00 0.00 O ATOM 175 CG2 THR A 78 -11.592 -8.832 10.551 1.00 0.00 C ATOM 0 H THR A 78 -8.359 -6.878 11.216 1.00 0.00 H new ATOM 0 HA THR A 78 -9.311 -9.640 11.207 1.00 0.00 H new ATOM 0 HB THR A 78 -10.286 -8.012 9.081 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.281 -6.347 10.433 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.473 -8.291 10.206 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.568 -9.819 10.089 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.633 -8.940 11.635 1.00 0.00 H new ATOM 183 N GLU A 79 -8.624 -10.377 8.869 1.00 0.00 N ATOM 184 CA GLU A 79 -7.949 -10.918 7.700 1.00 0.00 C ATOM 185 C GLU A 79 -8.639 -10.466 6.429 1.00 0.00 C ATOM 186 O GLU A 79 -9.551 -11.125 5.928 1.00 0.00 O ATOM 187 CB GLU A 79 -7.893 -12.446 7.764 1.00 0.00 C ATOM 188 CG GLU A 79 -6.916 -13.062 6.775 1.00 0.00 C ATOM 189 CD GLU A 79 -5.555 -13.324 7.390 1.00 0.00 C ATOM 190 OE1 GLU A 79 -5.104 -12.496 8.209 1.00 0.00 O ATOM 191 OE2 GLU A 79 -4.941 -14.359 7.052 1.00 0.00 O ATOM 0 H GLU A 79 -9.377 -10.962 9.231 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.927 -10.538 7.692 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -7.615 -12.749 8.773 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.889 -12.846 7.575 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -7.327 -13.999 6.398 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.802 -12.397 5.919 1.00 0.00 H new ATOM 198 N GLU A 80 -8.206 -9.321 5.928 1.00 0.00 N ATOM 199 CA GLU A 80 -8.783 -8.751 4.730 1.00 0.00 C ATOM 200 C GLU A 80 -7.901 -7.631 4.177 1.00 0.00 C ATOM 201 O GLU A 80 -7.264 -6.902 4.938 1.00 0.00 O ATOM 202 CB GLU A 80 -10.169 -8.224 5.068 1.00 0.00 C ATOM 203 CG GLU A 80 -11.282 -8.906 4.295 1.00 0.00 C ATOM 204 CD GLU A 80 -12.355 -7.937 3.836 1.00 0.00 C ATOM 205 OE1 GLU A 80 -12.005 -6.798 3.463 1.00 0.00 O ATOM 206 OE2 GLU A 80 -13.543 -8.319 3.851 1.00 0.00 O ATOM 0 H GLU A 80 -7.453 -8.768 6.338 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.855 -9.518 3.959 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -10.347 -8.353 6.136 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -10.201 -7.153 4.866 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.859 -9.411 3.427 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -11.736 -9.674 4.921 1.00 0.00 H new ATOM 213 N PRO A 81 -7.854 -7.478 2.843 1.00 0.00 N ATOM 214 CA PRO A 81 -7.045 -6.439 2.197 1.00 0.00 C ATOM 215 C PRO A 81 -7.310 -5.055 2.779 1.00 0.00 C ATOM 216 O PRO A 81 -8.405 -4.775 3.265 1.00 0.00 O ATOM 217 CB PRO A 81 -7.490 -6.500 0.735 1.00 0.00 C ATOM 218 CG PRO A 81 -7.981 -7.893 0.545 1.00 0.00 C ATOM 219 CD PRO A 81 -8.584 -8.302 1.860 1.00 0.00 C ATOM 0 HA PRO A 81 -5.977 -6.607 2.338 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -8.275 -5.772 0.530 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -6.664 -6.276 0.060 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -8.720 -7.941 -0.255 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -7.165 -8.560 0.265 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -9.656 -8.106 1.889 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -8.449 -9.367 2.050 1.00 0.00 H new ATOM 227 N MET A 82 -6.299 -4.192 2.725 1.00 0.00 N ATOM 228 CA MET A 82 -6.425 -2.836 3.247 1.00 0.00 C ATOM 229 C MET A 82 -7.586 -2.103 2.581 1.00 0.00 C ATOM 230 O MET A 82 -8.343 -1.390 3.240 1.00 0.00 O ATOM 231 CB MET A 82 -5.125 -2.060 3.029 1.00 0.00 C ATOM 232 CG MET A 82 -4.189 -2.093 4.228 1.00 0.00 C ATOM 233 SD MET A 82 -2.763 -3.165 3.970 1.00 0.00 S ATOM 234 CE MET A 82 -1.615 -2.024 3.203 1.00 0.00 C ATOM 0 H MET A 82 -5.386 -4.408 2.326 1.00 0.00 H new ATOM 0 HA MET A 82 -6.625 -2.902 4.316 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.607 -2.471 2.163 1.00 0.00 H new ATOM 0 HB3 MET A 82 -5.365 -1.023 2.794 1.00 0.00 H new ATOM 0 HG2 MET A 82 -3.844 -1.081 4.442 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.740 -2.434 5.104 1.00 0.00 H new ATOM 0 HE1 MET A 82 -1.078 -2.532 2.402 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.164 -1.177 2.791 1.00 0.00 H new ATOM 0 HE3 MET A 82 -0.904 -1.668 3.948 1.00 0.00 H new ATOM 244 N GLY A 83 -7.719 -2.285 1.272 1.00 0.00 N ATOM 245 CA GLY A 83 -8.790 -1.636 0.538 1.00 0.00 C ATOM 246 C GLY A 83 -8.276 -0.721 -0.556 1.00 0.00 C ATOM 247 O GLY A 83 -8.933 0.257 -0.916 1.00 0.00 O ATOM 0 H GLY A 83 -7.105 -2.870 0.706 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -9.436 -2.396 0.098 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -9.403 -1.059 1.231 1.00 0.00 H new ATOM 251 N ILE A 84 -7.101 -1.037 -1.087 1.00 0.00 N ATOM 252 CA ILE A 84 -6.499 -0.238 -2.147 1.00 0.00 C ATOM 253 C ILE A 84 -5.678 -1.110 -3.089 1.00 0.00 C ATOM 254 O ILE A 84 -5.402 -2.272 -2.794 1.00 0.00 O ATOM 255 CB ILE A 84 -5.588 0.865 -1.572 1.00 0.00 C ATOM 256 CG1 ILE A 84 -4.637 0.278 -0.526 1.00 0.00 C ATOM 257 CG2 ILE A 84 -6.423 1.985 -0.969 1.00 0.00 C ATOM 258 CD1 ILE A 84 -3.626 1.275 -0.003 1.00 0.00 C ATOM 0 H ILE A 84 -6.545 -1.843 -0.800 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.318 0.225 -2.698 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.992 1.282 -2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.222 -0.107 0.310 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.108 -0.569 -0.962 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -5.764 2.755 -0.568 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -7.061 2.419 -1.739 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -7.044 1.585 -0.167 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.985 0.791 0.734 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.016 1.642 -0.829 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.147 2.111 0.463 1.00 0.00 H new ATOM 270 N CYS A 85 -5.283 -0.536 -4.220 1.00 0.00 N ATOM 271 CA CYS A 85 -4.484 -1.255 -5.202 1.00 0.00 C ATOM 272 C CYS A 85 -3.294 -0.403 -5.620 1.00 0.00 C ATOM 273 O CYS A 85 -3.460 0.746 -6.011 1.00 0.00 O ATOM 274 CB CYS A 85 -5.336 -1.616 -6.423 1.00 0.00 C ATOM 275 SG CYS A 85 -5.214 -3.365 -6.924 1.00 0.00 S ATOM 0 H CYS A 85 -5.504 0.426 -4.478 1.00 0.00 H new ATOM 0 HA CYS A 85 -4.119 -2.179 -4.753 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -6.379 -1.383 -6.207 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -5.036 -0.987 -7.261 1.00 0.00 H new ATOM 280 N LEU A 86 -2.096 -0.972 -5.520 1.00 0.00 N ATOM 281 CA LEU A 86 -0.871 -0.262 -5.874 1.00 0.00 C ATOM 282 C LEU A 86 -0.034 -1.080 -6.853 1.00 0.00 C ATOM 283 O LEU A 86 -0.204 -2.291 -6.960 1.00 0.00 O ATOM 284 CB LEU A 86 -0.053 0.047 -4.619 1.00 0.00 C ATOM 285 CG LEU A 86 -0.875 0.410 -3.381 1.00 0.00 C ATOM 286 CD1 LEU A 86 -1.125 -0.823 -2.527 1.00 0.00 C ATOM 287 CD2 LEU A 86 -0.171 1.489 -2.570 1.00 0.00 C ATOM 0 H LEU A 86 -1.947 -1.927 -5.195 1.00 0.00 H new ATOM 0 HA LEU A 86 -1.150 0.675 -6.355 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.565 -0.820 -4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.625 0.871 -4.840 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.838 0.801 -3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.711 -0.546 -1.651 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.672 -1.564 -3.110 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.172 -1.244 -2.208 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.770 1.734 -1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.806 1.126 -2.251 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.044 2.381 -3.184 1.00 0.00 H new ATOM 299 N LYS A 87 0.862 -0.410 -7.570 1.00 0.00 N ATOM 300 CA LYS A 87 1.714 -1.083 -8.547 1.00 0.00 C ATOM 301 C LYS A 87 3.160 -0.603 -8.454 1.00 0.00 C ATOM 302 O LYS A 87 3.419 0.534 -8.059 1.00 0.00 O ATOM 303 CB LYS A 87 1.185 -0.834 -9.962 1.00 0.00 C ATOM 304 CG LYS A 87 0.729 0.597 -10.198 1.00 0.00 C ATOM 305 CD LYS A 87 -0.126 0.710 -11.450 1.00 0.00 C ATOM 306 CE LYS A 87 -0.086 2.116 -12.026 1.00 0.00 C ATOM 307 NZ LYS A 87 0.979 2.264 -13.056 1.00 0.00 N ATOM 0 H LYS A 87 1.018 0.595 -7.494 1.00 0.00 H new ATOM 0 HA LYS A 87 1.693 -2.150 -8.326 1.00 0.00 H new ATOM 0 HB2 LYS A 87 1.966 -1.081 -10.681 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.350 -1.509 -10.153 1.00 0.00 H new ATOM 0 HG2 LYS A 87 0.161 0.946 -9.336 1.00 0.00 H new ATOM 0 HG3 LYS A 87 1.599 1.247 -10.291 1.00 0.00 H new ATOM 0 HD2 LYS A 87 0.226 -0.001 -12.198 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -1.156 0.441 -11.214 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -1.054 2.355 -12.467 1.00 0.00 H new ATOM 0 HE3 LYS A 87 0.084 2.833 -11.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.973 3.237 -13.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.905 2.061 -12.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.803 1.598 -13.835 1.00 0.00 H new ATOM 321 N LEU A 88 4.098 -1.473 -8.836 1.00 0.00 N ATOM 322 CA LEU A 88 5.512 -1.127 -8.811 1.00 0.00 C ATOM 323 C LEU A 88 5.962 -0.641 -10.184 1.00 0.00 C ATOM 324 O LEU A 88 6.171 -1.438 -11.099 1.00 0.00 O ATOM 325 CB LEU A 88 6.365 -2.327 -8.380 1.00 0.00 C ATOM 326 CG LEU A 88 5.718 -3.282 -7.369 1.00 0.00 C ATOM 327 CD1 LEU A 88 4.865 -2.522 -6.363 1.00 0.00 C ATOM 328 CD2 LEU A 88 4.892 -4.337 -8.091 1.00 0.00 C ATOM 0 H LEU A 88 3.900 -2.418 -9.165 1.00 0.00 H new ATOM 0 HA LEU A 88 5.649 -0.327 -8.084 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.631 -2.897 -9.270 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.295 -1.952 -7.952 1.00 0.00 H new ATOM 0 HG LEU A 88 6.514 -3.783 -6.817 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.419 -3.225 -5.659 1.00 0.00 H new ATOM 0 HD12 LEU A 88 5.489 -1.812 -5.820 1.00 0.00 H new ATOM 0 HD13 LEU A 88 4.075 -1.984 -6.888 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.439 -5.007 -7.360 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.108 -3.851 -8.672 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.536 -4.910 -8.758 1.00 0.00 H new ATOM 340 N ASN A 89 6.110 0.671 -10.320 1.00 0.00 N ATOM 341 CA ASN A 89 6.536 1.266 -11.582 1.00 0.00 C ATOM 342 C ASN A 89 7.963 0.852 -11.916 1.00 0.00 C ATOM 343 O ASN A 89 8.620 0.168 -11.133 1.00 0.00 O ATOM 344 CB ASN A 89 6.436 2.791 -11.509 1.00 0.00 C ATOM 345 CG ASN A 89 5.020 3.267 -11.253 1.00 0.00 C ATOM 346 OD1 ASN A 89 4.165 3.211 -12.136 1.00 0.00 O ATOM 347 ND2 ASN A 89 4.765 3.738 -10.037 1.00 0.00 N ATOM 0 H ASN A 89 5.941 1.344 -9.572 1.00 0.00 H new ATOM 0 HA ASN A 89 5.876 0.905 -12.371 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.088 3.157 -10.716 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.797 3.221 -12.443 1.00 0.00 H new ATOM 0 HD21 ASN A 89 3.829 4.072 -9.805 1.00 0.00 H new ATOM 0 HD22 ASN A 89 5.505 3.766 -9.335 1.00 0.00 H new ATOM 354 N GLU A 90 8.443 1.274 -13.083 1.00 0.00 N ATOM 355 CA GLU A 90 9.800 0.949 -13.513 1.00 0.00 C ATOM 356 C GLU A 90 10.817 1.319 -12.433 1.00 0.00 C ATOM 357 O GLU A 90 11.907 0.753 -12.373 1.00 0.00 O ATOM 358 CB GLU A 90 10.133 1.680 -14.816 1.00 0.00 C ATOM 359 CG GLU A 90 9.835 3.169 -14.770 1.00 0.00 C ATOM 360 CD GLU A 90 10.277 3.892 -16.028 1.00 0.00 C ATOM 361 OE1 GLU A 90 11.475 3.807 -16.371 1.00 0.00 O ATOM 362 OE2 GLU A 90 9.425 4.542 -16.670 1.00 0.00 O ATOM 0 H GLU A 90 7.914 1.840 -13.746 1.00 0.00 H new ATOM 0 HA GLU A 90 9.853 -0.126 -13.684 1.00 0.00 H new ATOM 0 HB2 GLU A 90 11.189 1.536 -15.044 1.00 0.00 H new ATOM 0 HB3 GLU A 90 9.566 1.229 -15.631 1.00 0.00 H new ATOM 0 HG2 GLU A 90 8.765 3.317 -14.627 1.00 0.00 H new ATOM 0 HG3 GLU A 90 10.335 3.609 -13.908 1.00 0.00 H new ATOM 369 N LYS A 91 10.446 2.274 -11.583 1.00 0.00 N ATOM 370 CA LYS A 91 11.321 2.721 -10.501 1.00 0.00 C ATOM 371 C LYS A 91 11.177 1.839 -9.261 1.00 0.00 C ATOM 372 O LYS A 91 11.810 2.092 -8.237 1.00 0.00 O ATOM 373 CB LYS A 91 11.029 4.180 -10.122 1.00 0.00 C ATOM 374 CG LYS A 91 9.584 4.611 -10.341 1.00 0.00 C ATOM 375 CD LYS A 91 9.368 5.153 -11.747 1.00 0.00 C ATOM 376 CE LYS A 91 8.898 6.599 -11.726 1.00 0.00 C ATOM 377 NZ LYS A 91 9.647 7.441 -12.700 1.00 0.00 N ATOM 0 H LYS A 91 9.546 2.753 -11.622 1.00 0.00 H new ATOM 0 HA LYS A 91 12.344 2.643 -10.869 1.00 0.00 H new ATOM 0 HB2 LYS A 91 11.284 4.328 -9.073 1.00 0.00 H new ATOM 0 HB3 LYS A 91 11.682 4.831 -10.704 1.00 0.00 H new ATOM 0 HG2 LYS A 91 8.921 3.763 -10.172 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.317 5.375 -9.611 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.297 5.081 -12.312 1.00 0.00 H new ATOM 0 HD3 LYS A 91 8.632 4.538 -12.265 1.00 0.00 H new ATOM 0 HE2 LYS A 91 7.833 6.638 -11.956 1.00 0.00 H new ATOM 0 HE3 LYS A 91 9.022 7.007 -10.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 9.297 8.419 -12.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.660 7.425 -12.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 9.508 7.068 -13.661 1.00 0.00 H new ATOM 391 N GLN A 92 10.343 0.806 -9.352 1.00 0.00 N ATOM 392 CA GLN A 92 10.128 -0.096 -8.227 1.00 0.00 C ATOM 393 C GLN A 92 9.581 0.668 -7.026 1.00 0.00 C ATOM 394 O GLN A 92 10.326 1.018 -6.110 1.00 0.00 O ATOM 395 CB GLN A 92 11.439 -0.796 -7.855 1.00 0.00 C ATOM 396 CG GLN A 92 11.331 -1.692 -6.632 1.00 0.00 C ATOM 397 CD GLN A 92 12.684 -2.160 -6.133 1.00 0.00 C ATOM 398 OE1 GLN A 92 13.389 -2.902 -6.816 1.00 0.00 O ATOM 399 NE2 GLN A 92 13.055 -1.725 -4.934 1.00 0.00 N ATOM 0 H GLN A 92 9.808 0.575 -10.189 1.00 0.00 H new ATOM 0 HA GLN A 92 9.396 -0.849 -8.521 1.00 0.00 H new ATOM 0 HB2 GLN A 92 11.774 -1.393 -8.703 1.00 0.00 H new ATOM 0 HB3 GLN A 92 12.204 -0.041 -7.674 1.00 0.00 H new ATOM 0 HG2 GLN A 92 10.820 -1.152 -5.834 1.00 0.00 H new ATOM 0 HG3 GLN A 92 10.717 -2.559 -6.874 1.00 0.00 H new ATOM 0 HE21 GLN A 92 12.439 -1.111 -4.401 1.00 0.00 H new ATOM 0 HE22 GLN A 92 13.956 -2.005 -4.546 1.00 0.00 H new ATOM 408 N SER A 93 8.278 0.928 -7.034 1.00 0.00 N ATOM 409 CA SER A 93 7.639 1.654 -5.941 1.00 0.00 C ATOM 410 C SER A 93 6.146 1.362 -5.903 1.00 0.00 C ATOM 411 O SER A 93 5.494 1.291 -6.941 1.00 0.00 O ATOM 412 CB SER A 93 7.874 3.158 -6.093 1.00 0.00 C ATOM 413 OG SER A 93 9.090 3.548 -5.480 1.00 0.00 O ATOM 0 H SER A 93 7.645 0.648 -7.783 1.00 0.00 H new ATOM 0 HA SER A 93 8.083 1.319 -5.003 1.00 0.00 H new ATOM 0 HB2 SER A 93 7.895 3.421 -7.151 1.00 0.00 H new ATOM 0 HB3 SER A 93 7.045 3.706 -5.645 1.00 0.00 H new ATOM 0 HG SER A 93 9.736 2.813 -5.537 1.00 0.00 H new ATOM 419 N CYS A 94 5.606 1.188 -4.702 1.00 0.00 N ATOM 420 CA CYS A 94 4.187 0.890 -4.553 1.00 0.00 C ATOM 421 C CYS A 94 3.355 2.166 -4.483 1.00 0.00 C ATOM 422 O CYS A 94 3.418 2.912 -3.507 1.00 0.00 O ATOM 423 CB CYS A 94 3.956 0.047 -3.296 1.00 0.00 C ATOM 424 SG CYS A 94 2.999 -1.461 -3.584 1.00 0.00 S ATOM 0 H CYS A 94 6.124 1.247 -3.825 1.00 0.00 H new ATOM 0 HA CYS A 94 3.869 0.327 -5.431 1.00 0.00 H new ATOM 0 HB2 CYS A 94 4.922 -0.224 -2.871 1.00 0.00 H new ATOM 0 HB3 CYS A 94 3.440 0.655 -2.553 1.00 0.00 H new ATOM 0 HG CYS A 94 2.859 -2.106 -2.464 1.00 0.00 H new ATOM 430 N THR A 95 2.561 2.397 -5.527 1.00 0.00 N ATOM 431 CA THR A 95 1.696 3.567 -5.594 1.00 0.00 C ATOM 432 C THR A 95 0.268 3.123 -5.862 1.00 0.00 C ATOM 433 O THR A 95 0.024 2.343 -6.781 1.00 0.00 O ATOM 434 CB THR A 95 2.158 4.516 -6.698 1.00 0.00 C ATOM 435 OG1 THR A 95 3.565 4.676 -6.668 1.00 0.00 O ATOM 436 CG2 THR A 95 1.535 5.892 -6.607 1.00 0.00 C ATOM 0 H THR A 95 2.501 1.784 -6.340 1.00 0.00 H new ATOM 0 HA THR A 95 1.745 4.096 -4.642 1.00 0.00 H new ATOM 0 HB THR A 95 1.835 4.052 -7.630 1.00 0.00 H new ATOM 0 HG1 THR A 95 3.840 5.286 -7.384 1.00 0.00 H new ATOM 0 HG21 THR A 95 1.907 6.514 -7.421 1.00 0.00 H new ATOM 0 HG22 THR A 95 0.451 5.806 -6.682 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.798 6.348 -5.653 1.00 0.00 H new ATOM 444 N VAL A 96 -0.673 3.603 -5.060 1.00 0.00 N ATOM 445 CA VAL A 96 -2.063 3.217 -5.236 1.00 0.00 C ATOM 446 C VAL A 96 -2.555 3.588 -6.628 1.00 0.00 C ATOM 447 O VAL A 96 -2.790 4.757 -6.931 1.00 0.00 O ATOM 448 CB VAL A 96 -2.974 3.847 -4.160 1.00 0.00 C ATOM 449 CG1 VAL A 96 -2.791 5.349 -4.090 1.00 0.00 C ATOM 450 CG2 VAL A 96 -4.435 3.481 -4.399 1.00 0.00 C ATOM 0 H VAL A 96 -0.501 4.252 -4.292 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.114 2.134 -5.122 1.00 0.00 H new ATOM 0 HB VAL A 96 -2.678 3.436 -3.195 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.447 5.760 -3.323 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.755 5.578 -3.842 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.040 5.791 -5.055 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.055 3.937 -3.627 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.746 3.846 -5.378 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.549 2.398 -4.363 1.00 0.00 H new ATOM 460 N ALA A 97 -2.702 2.573 -7.468 1.00 0.00 N ATOM 461 CA ALA A 97 -3.159 2.763 -8.835 1.00 0.00 C ATOM 462 C ALA A 97 -4.662 3.027 -8.886 1.00 0.00 C ATOM 463 O ALA A 97 -5.169 3.597 -9.852 1.00 0.00 O ATOM 464 CB ALA A 97 -2.799 1.542 -9.664 1.00 0.00 C ATOM 0 H ALA A 97 -2.509 1.602 -7.222 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.661 3.639 -9.250 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -3.142 1.684 -10.689 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.718 1.404 -9.659 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.279 0.660 -9.240 1.00 0.00 H new ATOM 470 N ARG A 98 -5.367 2.612 -7.837 1.00 0.00 N ATOM 471 CA ARG A 98 -6.810 2.808 -7.761 1.00 0.00 C ATOM 472 C ARG A 98 -7.335 2.430 -6.380 1.00 0.00 C ATOM 473 O ARG A 98 -6.984 1.382 -5.837 1.00 0.00 O ATOM 474 CB ARG A 98 -7.516 1.979 -8.838 1.00 0.00 C ATOM 475 CG ARG A 98 -8.013 2.807 -10.012 1.00 0.00 C ATOM 476 CD ARG A 98 -9.243 2.184 -10.653 1.00 0.00 C ATOM 477 NE ARG A 98 -10.377 2.138 -9.731 1.00 0.00 N ATOM 478 CZ ARG A 98 -11.155 3.183 -9.461 1.00 0.00 C ATOM 479 NH1 ARG A 98 -10.927 4.356 -10.039 1.00 0.00 N ATOM 480 NH2 ARG A 98 -12.164 3.055 -8.612 1.00 0.00 N ATOM 0 H ARG A 98 -4.962 2.139 -7.029 1.00 0.00 H new ATOM 0 HA ARG A 98 -7.021 3.864 -7.933 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -6.830 1.216 -9.206 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -8.361 1.457 -8.388 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -8.250 3.816 -9.673 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -7.221 2.898 -10.755 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -9.519 2.756 -11.539 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -9.006 1.174 -10.987 1.00 0.00 H new ATOM 0 HE ARG A 98 -10.584 1.253 -9.268 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -10.152 4.460 -10.694 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -11.527 5.154 -9.828 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -12.344 2.156 -8.166 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -12.761 3.856 -8.405 1.00 0.00 H new ATOM 494 N ILE A 99 -8.180 3.288 -5.816 1.00 0.00 N ATOM 495 CA ILE A 99 -8.753 3.039 -4.499 1.00 0.00 C ATOM 496 C ILE A 99 -10.011 2.184 -4.607 1.00 0.00 C ATOM 497 O ILE A 99 -11.074 2.672 -4.993 1.00 0.00 O ATOM 498 CB ILE A 99 -9.100 4.357 -3.777 1.00 0.00 C ATOM 499 CG1 ILE A 99 -7.874 5.271 -3.719 1.00 0.00 C ATOM 500 CG2 ILE A 99 -9.625 4.076 -2.375 1.00 0.00 C ATOM 501 CD1 ILE A 99 -6.769 4.751 -2.826 1.00 0.00 C ATOM 0 H ILE A 99 -8.482 4.160 -6.250 1.00 0.00 H new ATOM 0 HA ILE A 99 -8.000 2.506 -3.919 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.883 4.865 -4.340 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.482 5.403 -4.728 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -8.182 6.255 -3.365 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -9.865 5.017 -1.881 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -10.523 3.461 -2.439 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.864 3.548 -1.801 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -5.934 5.451 -2.835 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -7.143 4.646 -1.808 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -6.433 3.781 -3.191 1.00 0.00 H new ATOM 513 N LEU A 100 -9.885 0.905 -4.266 1.00 0.00 N ATOM 514 CA LEU A 100 -11.014 -0.016 -4.328 1.00 0.00 C ATOM 515 C LEU A 100 -12.161 0.464 -3.443 1.00 0.00 C ATOM 516 O LEU A 100 -11.942 0.938 -2.328 1.00 0.00 O ATOM 517 CB LEU A 100 -10.578 -1.420 -3.902 1.00 0.00 C ATOM 518 CG LEU A 100 -10.015 -2.290 -5.027 1.00 0.00 C ATOM 519 CD1 LEU A 100 -8.791 -1.635 -5.647 1.00 0.00 C ATOM 520 CD2 LEU A 100 -9.671 -3.677 -4.504 1.00 0.00 C ATOM 0 H LEU A 100 -9.014 0.484 -3.944 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.366 -0.049 -5.359 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -9.823 -1.329 -3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.433 -1.932 -3.460 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.778 -2.391 -5.799 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.404 -2.269 -6.445 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.066 -0.663 -6.056 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.023 -1.503 -4.884 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.272 -4.284 -5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.925 -3.593 -3.714 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.569 -4.149 -4.106 1.00 0.00 H new ATOM 532 N HIS A 101 -13.383 0.340 -3.950 1.00 0.00 N ATOM 533 CA HIS A 101 -14.566 0.762 -3.209 1.00 0.00 C ATOM 534 C HIS A 101 -14.965 -0.287 -2.176 1.00 0.00 C ATOM 535 O HIS A 101 -14.953 -1.486 -2.457 1.00 0.00 O ATOM 536 CB HIS A 101 -15.729 1.016 -4.170 1.00 0.00 C ATOM 537 CG HIS A 101 -16.608 2.157 -3.761 1.00 0.00 C ATOM 538 ND1 HIS A 101 -17.059 3.114 -4.647 1.00 0.00 N ATOM 539 CD2 HIS A 101 -17.121 2.493 -2.553 1.00 0.00 C ATOM 540 CE1 HIS A 101 -17.810 3.988 -4.002 1.00 0.00 C ATOM 541 NE2 HIS A 101 -17.864 3.634 -2.731 1.00 0.00 N ATOM 0 H HIS A 101 -13.580 -0.050 -4.872 1.00 0.00 H new ATOM 0 HA HIS A 101 -14.326 1.687 -2.685 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -15.330 1.214 -5.165 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -16.333 0.111 -4.243 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.973 1.963 -1.624 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -18.297 4.847 -4.440 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -18.375 4.128 -2.000 1.00 0.00 H new ATOM 550 N GLY A 102 -15.319 0.173 -0.979 1.00 0.00 N ATOM 551 CA GLY A 102 -15.717 -0.740 0.077 1.00 0.00 C ATOM 552 C GLY A 102 -14.575 -1.082 1.014 1.00 0.00 C ATOM 553 O GLY A 102 -14.799 -1.460 2.163 1.00 0.00 O ATOM 0 H GLY A 102 -15.337 1.160 -0.722 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -16.531 -0.295 0.649 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -16.104 -1.657 -0.367 1.00 0.00 H new ATOM 557 N GLY A 103 -13.347 -0.950 0.523 1.00 0.00 N ATOM 558 CA GLY A 103 -12.186 -1.254 1.338 1.00 0.00 C ATOM 559 C GLY A 103 -12.132 -0.427 2.608 1.00 0.00 C ATOM 560 O GLY A 103 -12.976 0.442 2.827 1.00 0.00 O ATOM 0 H GLY A 103 -13.135 -0.638 -0.425 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -12.197 -2.312 1.598 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -11.282 -1.078 0.756 1.00 0.00 H new ATOM 564 N MET A 104 -11.138 -0.701 3.447 1.00 0.00 N ATOM 565 CA MET A 104 -10.976 0.022 4.704 1.00 0.00 C ATOM 566 C MET A 104 -10.345 1.391 4.467 1.00 0.00 C ATOM 567 O MET A 104 -10.649 2.355 5.168 1.00 0.00 O ATOM 568 CB MET A 104 -10.117 -0.789 5.674 1.00 0.00 C ATOM 569 CG MET A 104 -10.313 -0.402 7.131 1.00 0.00 C ATOM 570 SD MET A 104 -9.551 -1.574 8.270 1.00 0.00 S ATOM 571 CE MET A 104 -7.815 -1.308 7.918 1.00 0.00 C ATOM 0 H MET A 104 -10.433 -1.418 3.279 1.00 0.00 H new ATOM 0 HA MET A 104 -11.964 0.169 5.141 1.00 0.00 H new ATOM 0 HB2 MET A 104 -10.349 -1.847 5.554 1.00 0.00 H new ATOM 0 HB3 MET A 104 -9.067 -0.661 5.411 1.00 0.00 H new ATOM 0 HG2 MET A 104 -9.891 0.589 7.300 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.380 -0.335 7.345 1.00 0.00 H new ATOM 0 HE1 MET A 104 -7.231 -1.470 8.824 1.00 0.00 H new ATOM 0 HE2 MET A 104 -7.489 -2.006 7.147 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.667 -0.286 7.569 1.00 0.00 H new ATOM 581 N ILE A 105 -9.464 1.467 3.475 1.00 0.00 N ATOM 582 CA ILE A 105 -8.791 2.717 3.145 1.00 0.00 C ATOM 583 C ILE A 105 -9.753 3.692 2.476 1.00 0.00 C ATOM 584 O ILE A 105 -9.677 4.902 2.693 1.00 0.00 O ATOM 585 CB ILE A 105 -7.584 2.476 2.217 1.00 0.00 C ATOM 586 CG1 ILE A 105 -6.658 1.411 2.811 1.00 0.00 C ATOM 587 CG2 ILE A 105 -6.823 3.773 1.981 1.00 0.00 C ATOM 588 CD1 ILE A 105 -6.177 1.738 4.208 1.00 0.00 C ATOM 0 H ILE A 105 -9.200 0.677 2.886 1.00 0.00 H new ATOM 0 HA ILE A 105 -8.435 3.147 4.081 1.00 0.00 H new ATOM 0 HB ILE A 105 -7.954 2.116 1.257 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -7.182 0.456 2.831 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -5.794 1.287 2.158 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -5.975 3.583 1.324 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -7.485 4.504 1.517 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -6.464 4.163 2.934 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -5.526 0.940 4.565 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -5.624 2.677 4.192 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -7.034 1.833 4.875 1.00 0.00 H new ATOM 600 N HIS A 106 -10.661 3.159 1.665 1.00 0.00 N ATOM 601 CA HIS A 106 -11.641 3.985 0.968 1.00 0.00 C ATOM 602 C HIS A 106 -12.760 4.407 1.915 1.00 0.00 C ATOM 603 O HIS A 106 -13.204 5.555 1.895 1.00 0.00 O ATOM 604 CB HIS A 106 -12.224 3.226 -0.225 1.00 0.00 C ATOM 605 CG HIS A 106 -13.013 4.093 -1.157 1.00 0.00 C ATOM 606 ND1 HIS A 106 -14.297 3.791 -1.560 1.00 0.00 N ATOM 607 CD2 HIS A 106 -12.695 5.260 -1.765 1.00 0.00 C ATOM 608 CE1 HIS A 106 -14.734 4.733 -2.377 1.00 0.00 C ATOM 609 NE2 HIS A 106 -13.781 5.636 -2.517 1.00 0.00 N ATOM 0 H HIS A 106 -10.739 2.160 1.474 1.00 0.00 H new ATOM 0 HA HIS A 106 -11.136 4.880 0.605 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -11.411 2.756 -0.779 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -12.864 2.424 0.142 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -11.761 5.795 -1.675 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -15.705 4.760 -2.850 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -13.842 6.477 -3.091 1.00 0.00 H new ATOM 618 N ARG A 107 -13.209 3.471 2.745 1.00 0.00 N ATOM 619 CA ARG A 107 -14.274 3.745 3.703 1.00 0.00 C ATOM 620 C ARG A 107 -13.766 4.632 4.835 1.00 0.00 C ATOM 621 O ARG A 107 -14.452 5.555 5.272 1.00 0.00 O ATOM 622 CB ARG A 107 -14.827 2.436 4.272 1.00 0.00 C ATOM 623 CG ARG A 107 -16.170 2.594 4.967 1.00 0.00 C ATOM 624 CD ARG A 107 -16.861 1.253 5.154 1.00 0.00 C ATOM 625 NE ARG A 107 -17.510 1.148 6.459 1.00 0.00 N ATOM 626 CZ ARG A 107 -18.686 1.700 6.749 1.00 0.00 C ATOM 627 NH1 ARG A 107 -19.347 2.392 5.829 1.00 0.00 N ATOM 628 NH2 ARG A 107 -19.205 1.557 7.961 1.00 0.00 N ATOM 0 H ARG A 107 -12.852 2.516 2.773 1.00 0.00 H new ATOM 0 HA ARG A 107 -15.074 4.271 3.182 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -14.929 1.712 3.463 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -14.107 2.024 4.980 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -16.025 3.068 5.938 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -16.809 3.255 4.381 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -17.603 1.115 4.368 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -16.131 0.451 5.047 1.00 0.00 H new ATOM 0 HE ARG A 107 -17.034 0.621 7.191 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -18.954 2.503 4.894 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -20.248 2.813 6.057 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -18.703 1.024 8.671 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.106 1.980 8.183 1.00 0.00 H new ATOM 642 N GLN A 108 -12.556 4.344 5.305 1.00 0.00 N ATOM 643 CA GLN A 108 -11.951 5.114 6.385 1.00 0.00 C ATOM 644 C GLN A 108 -11.280 6.372 5.842 1.00 0.00 C ATOM 645 O GLN A 108 -11.431 7.458 6.401 1.00 0.00 O ATOM 646 CB GLN A 108 -10.928 4.259 7.135 1.00 0.00 C ATOM 647 CG GLN A 108 -10.440 4.892 8.428 1.00 0.00 C ATOM 648 CD GLN A 108 -10.634 3.988 9.630 1.00 0.00 C ATOM 649 OE1 GLN A 108 -11.106 4.425 10.679 1.00 0.00 O ATOM 650 NE2 GLN A 108 -10.269 2.721 9.484 1.00 0.00 N ATOM 0 H GLN A 108 -11.975 3.582 4.954 1.00 0.00 H new ATOM 0 HA GLN A 108 -12.740 5.413 7.075 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.372 3.289 7.360 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -10.073 4.075 6.484 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -9.383 5.139 8.331 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -10.972 5.829 8.593 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -9.882 2.401 8.596 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -10.375 2.067 10.259 1.00 0.00 H new ATOM 659 N GLY A 109 -10.539 6.216 4.749 1.00 0.00 N ATOM 660 CA GLY A 109 -9.858 7.347 4.148 1.00 0.00 C ATOM 661 C GLY A 109 -8.448 7.526 4.678 1.00 0.00 C ATOM 662 O GLY A 109 -8.206 8.367 5.545 1.00 0.00 O ATOM 0 H GLY A 109 -10.398 5.327 4.270 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.822 7.212 3.067 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -10.432 8.254 4.337 1.00 0.00 H new ATOM 666 N SER A 110 -7.517 6.733 4.160 1.00 0.00 N ATOM 667 CA SER A 110 -6.124 6.806 4.588 1.00 0.00 C ATOM 668 C SER A 110 -5.212 7.207 3.432 1.00 0.00 C ATOM 669 O SER A 110 -4.197 7.874 3.634 1.00 0.00 O ATOM 670 CB SER A 110 -5.675 5.462 5.163 1.00 0.00 C ATOM 671 OG SER A 110 -4.436 5.584 5.841 1.00 0.00 O ATOM 0 H SER A 110 -7.701 6.032 3.443 1.00 0.00 H new ATOM 0 HA SER A 110 -6.051 7.570 5.362 1.00 0.00 H new ATOM 0 HB2 SER A 110 -6.433 5.086 5.850 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.583 4.732 4.359 1.00 0.00 H new ATOM 0 HG SER A 110 -3.821 4.889 5.526 1.00 0.00 H new ATOM 677 N LEU A 111 -5.576 6.796 2.221 1.00 0.00 N ATOM 678 CA LEU A 111 -4.785 7.114 1.036 1.00 0.00 C ATOM 679 C LEU A 111 -5.684 7.492 -0.137 1.00 0.00 C ATOM 680 O LEU A 111 -6.907 7.370 -0.060 1.00 0.00 O ATOM 681 CB LEU A 111 -3.900 5.922 0.658 1.00 0.00 C ATOM 682 CG LEU A 111 -2.399 6.217 0.619 1.00 0.00 C ATOM 683 CD1 LEU A 111 -1.804 6.138 2.016 1.00 0.00 C ATOM 684 CD2 LEU A 111 -1.693 5.252 -0.320 1.00 0.00 C ATOM 0 H LEU A 111 -6.412 6.243 2.034 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.152 7.970 1.269 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.078 5.116 1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -4.209 5.556 -0.321 1.00 0.00 H new ATOM 0 HG LEU A 111 -2.255 7.230 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.736 6.351 1.969 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.292 6.869 2.661 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.957 5.138 2.421 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.626 5.475 -0.336 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -1.845 4.230 0.027 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -2.101 5.358 -1.325 1.00 0.00 H new ATOM 696 N HIS A 112 -5.069 7.948 -1.223 1.00 0.00 N ATOM 697 CA HIS A 112 -5.810 8.344 -2.416 1.00 0.00 C ATOM 698 C HIS A 112 -5.114 7.846 -3.677 1.00 0.00 C ATOM 699 O HIS A 112 -3.887 7.872 -3.770 1.00 0.00 O ATOM 700 CB HIS A 112 -5.960 9.866 -2.469 1.00 0.00 C ATOM 701 CG HIS A 112 -7.128 10.379 -1.685 1.00 0.00 C ATOM 702 ND1 HIS A 112 -8.363 9.765 -1.684 1.00 0.00 N ATOM 703 CD2 HIS A 112 -7.244 11.455 -0.870 1.00 0.00 C ATOM 704 CE1 HIS A 112 -9.189 10.443 -0.905 1.00 0.00 C ATOM 705 NE2 HIS A 112 -8.533 11.470 -0.399 1.00 0.00 N ATOM 0 H HIS A 112 -4.057 8.053 -1.302 1.00 0.00 H new ATOM 0 HA HIS A 112 -6.800 7.891 -2.365 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -5.048 10.326 -2.090 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -6.066 10.177 -3.508 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -6.467 12.168 -0.635 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.224 10.198 -0.715 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -8.922 12.164 0.240 1.00 0.00 H new ATOM 714 N VAL A 113 -5.908 7.392 -4.647 1.00 0.00 N ATOM 715 CA VAL A 113 -5.379 6.884 -5.912 1.00 0.00 C ATOM 716 C VAL A 113 -4.268 7.775 -6.457 1.00 0.00 C ATOM 717 O VAL A 113 -4.507 8.923 -6.834 1.00 0.00 O ATOM 718 CB VAL A 113 -6.491 6.756 -6.967 1.00 0.00 C ATOM 719 CG1 VAL A 113 -7.112 8.111 -7.227 1.00 0.00 C ATOM 720 CG2 VAL A 113 -5.952 6.146 -8.253 1.00 0.00 C ATOM 0 H VAL A 113 -6.925 7.366 -4.579 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.965 5.897 -5.705 1.00 0.00 H new ATOM 0 HB VAL A 113 -7.262 6.087 -6.584 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -7.899 8.013 -7.975 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -7.537 8.500 -6.302 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.348 8.797 -7.592 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.757 6.066 -8.983 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -5.161 6.780 -8.653 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -5.551 5.154 -8.045 1.00 0.00 H new ATOM 730 N GLY A 114 -3.053 7.239 -6.496 1.00 0.00 N ATOM 731 CA GLY A 114 -1.923 8.000 -6.998 1.00 0.00 C ATOM 732 C GLY A 114 -0.843 8.192 -5.953 1.00 0.00 C ATOM 733 O GLY A 114 0.335 8.325 -6.285 1.00 0.00 O ATOM 0 H GLY A 114 -2.830 6.292 -6.189 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.500 7.489 -7.863 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -2.269 8.975 -7.341 1.00 0.00 H new ATOM 737 N ASP A 115 -1.243 8.207 -4.685 1.00 0.00 N ATOM 738 CA ASP A 115 -0.302 8.381 -3.583 1.00 0.00 C ATOM 739 C ASP A 115 0.875 7.417 -3.718 1.00 0.00 C ATOM 740 O ASP A 115 0.687 6.224 -3.959 1.00 0.00 O ATOM 741 CB ASP A 115 -1.015 8.163 -2.247 1.00 0.00 C ATOM 742 CG ASP A 115 -1.146 9.444 -1.446 1.00 0.00 C ATOM 743 OD1 ASP A 115 -0.288 10.337 -1.610 1.00 0.00 O ATOM 744 OD2 ASP A 115 -2.105 9.553 -0.653 1.00 0.00 O ATOM 0 H ASP A 115 -2.215 8.100 -4.395 1.00 0.00 H new ATOM 0 HA ASP A 115 0.086 9.399 -3.617 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -2.007 7.750 -2.431 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -0.466 7.426 -1.661 1.00 0.00 H new ATOM 749 N GLU A 116 2.089 7.941 -3.574 1.00 0.00 N ATOM 750 CA GLU A 116 3.291 7.124 -3.695 1.00 0.00 C ATOM 751 C GLU A 116 3.780 6.637 -2.334 1.00 0.00 C ATOM 752 O GLU A 116 4.287 7.419 -1.529 1.00 0.00 O ATOM 753 CB GLU A 116 4.399 7.917 -4.391 1.00 0.00 C ATOM 754 CG GLU A 116 5.662 7.109 -4.636 1.00 0.00 C ATOM 755 CD GLU A 116 5.892 6.814 -6.105 1.00 0.00 C ATOM 756 OE1 GLU A 116 5.565 7.681 -6.942 1.00 0.00 O ATOM 757 OE2 GLU A 116 6.397 5.716 -6.418 1.00 0.00 O ATOM 0 H GLU A 116 2.266 8.925 -3.374 1.00 0.00 H new ATOM 0 HA GLU A 116 3.037 6.249 -4.294 1.00 0.00 H new ATOM 0 HB2 GLU A 116 4.024 8.288 -5.345 1.00 0.00 H new ATOM 0 HB3 GLU A 116 4.647 8.788 -3.785 1.00 0.00 H new ATOM 0 HG2 GLU A 116 6.519 7.654 -4.240 1.00 0.00 H new ATOM 0 HG3 GLU A 116 5.600 6.170 -4.086 1.00 0.00 H new ATOM 764 N ILE A 117 3.635 5.338 -2.091 1.00 0.00 N ATOM 765 CA ILE A 117 4.071 4.740 -0.834 1.00 0.00 C ATOM 766 C ILE A 117 5.525 4.288 -0.935 1.00 0.00 C ATOM 767 O ILE A 117 5.812 3.184 -1.399 1.00 0.00 O ATOM 768 CB ILE A 117 3.189 3.536 -0.445 1.00 0.00 C ATOM 769 CG1 ILE A 117 1.718 3.950 -0.384 1.00 0.00 C ATOM 770 CG2 ILE A 117 3.635 2.956 0.889 1.00 0.00 C ATOM 771 CD1 ILE A 117 1.070 4.092 -1.744 1.00 0.00 C ATOM 0 H ILE A 117 3.219 4.679 -2.749 1.00 0.00 H new ATOM 0 HA ILE A 117 3.977 5.503 -0.061 1.00 0.00 H new ATOM 0 HB ILE A 117 3.300 2.766 -1.208 1.00 0.00 H new ATOM 0 HG12 ILE A 117 1.165 3.211 0.197 1.00 0.00 H new ATOM 0 HG13 ILE A 117 1.638 4.898 0.148 1.00 0.00 H new ATOM 0 HG21 ILE A 117 3.001 2.108 1.147 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.671 2.625 0.814 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.553 3.719 1.663 1.00 0.00 H new ATOM 0 HD11 ILE A 117 0.028 4.388 -1.621 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.597 4.852 -2.321 1.00 0.00 H new ATOM 0 HD13 ILE A 117 1.117 3.139 -2.271 1.00 0.00 H new ATOM 783 N LEU A 118 6.437 5.152 -0.506 1.00 0.00 N ATOM 784 CA LEU A 118 7.863 4.849 -0.555 1.00 0.00 C ATOM 785 C LEU A 118 8.221 3.695 0.377 1.00 0.00 C ATOM 786 O LEU A 118 9.198 2.983 0.143 1.00 0.00 O ATOM 787 CB LEU A 118 8.680 6.090 -0.188 1.00 0.00 C ATOM 788 CG LEU A 118 9.116 6.952 -1.375 1.00 0.00 C ATOM 789 CD1 LEU A 118 10.134 6.211 -2.227 1.00 0.00 C ATOM 790 CD2 LEU A 118 7.911 7.354 -2.211 1.00 0.00 C ATOM 0 H LEU A 118 6.215 6.069 -0.120 1.00 0.00 H new ATOM 0 HA LEU A 118 8.104 4.547 -1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 118 8.091 6.706 0.492 1.00 0.00 H new ATOM 0 HB3 LEU A 118 9.569 5.773 0.357 1.00 0.00 H new ATOM 0 HG LEU A 118 9.585 7.857 -0.990 1.00 0.00 H new ATOM 0 HD11 LEU A 118 10.432 6.839 -3.066 1.00 0.00 H new ATOM 0 HD12 LEU A 118 11.009 5.973 -1.623 1.00 0.00 H new ATOM 0 HD13 LEU A 118 9.691 5.289 -2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 118 8.239 7.967 -3.051 1.00 0.00 H new ATOM 0 HD22 LEU A 118 7.414 6.460 -2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 118 7.215 7.924 -1.596 1.00 0.00 H new ATOM 802 N GLU A 119 7.434 3.513 1.433 1.00 0.00 N ATOM 803 CA GLU A 119 7.690 2.442 2.390 1.00 0.00 C ATOM 804 C GLU A 119 6.405 1.709 2.758 1.00 0.00 C ATOM 805 O GLU A 119 5.403 2.330 3.112 1.00 0.00 O ATOM 806 CB GLU A 119 8.352 3.004 3.650 1.00 0.00 C ATOM 807 CG GLU A 119 9.557 2.202 4.113 1.00 0.00 C ATOM 808 CD GLU A 119 9.995 2.565 5.518 1.00 0.00 C ATOM 809 OE1 GLU A 119 9.121 2.675 6.403 1.00 0.00 O ATOM 810 OE2 GLU A 119 11.214 2.740 5.733 1.00 0.00 O ATOM 0 H GLU A 119 6.620 4.089 1.647 1.00 0.00 H new ATOM 0 HA GLU A 119 8.365 1.727 1.919 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.661 4.032 3.460 1.00 0.00 H new ATOM 0 HB3 GLU A 119 7.616 3.036 4.454 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.318 1.139 4.074 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.385 2.368 3.424 1.00 0.00 H new ATOM 817 N ILE A 120 6.446 0.383 2.678 1.00 0.00 N ATOM 818 CA ILE A 120 5.290 -0.441 3.009 1.00 0.00 C ATOM 819 C ILE A 120 5.553 -1.258 4.269 1.00 0.00 C ATOM 820 O ILE A 120 6.202 -2.302 4.220 1.00 0.00 O ATOM 821 CB ILE A 120 4.926 -1.395 1.854 1.00 0.00 C ATOM 822 CG1 ILE A 120 4.766 -0.614 0.549 1.00 0.00 C ATOM 823 CG2 ILE A 120 3.651 -2.159 2.180 1.00 0.00 C ATOM 824 CD1 ILE A 120 5.248 -1.368 -0.671 1.00 0.00 C ATOM 0 H ILE A 120 7.269 -0.144 2.386 1.00 0.00 H new ATOM 0 HA ILE A 120 4.453 0.236 3.181 1.00 0.00 H new ATOM 0 HB ILE A 120 5.735 -2.114 1.728 1.00 0.00 H new ATOM 0 HG12 ILE A 120 3.715 -0.357 0.415 1.00 0.00 H new ATOM 0 HG13 ILE A 120 5.316 0.324 0.627 1.00 0.00 H new ATOM 0 HG21 ILE A 120 3.407 -2.828 1.355 1.00 0.00 H new ATOM 0 HG22 ILE A 120 3.799 -2.742 3.089 1.00 0.00 H new ATOM 0 HG23 ILE A 120 2.833 -1.454 2.330 1.00 0.00 H new ATOM 0 HD11 ILE A 120 5.104 -0.753 -1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 120 6.307 -1.602 -0.560 1.00 0.00 H new ATOM 0 HD13 ILE A 120 4.681 -2.293 -0.774 1.00 0.00 H new ATOM 836 N ASN A 121 5.052 -0.770 5.400 1.00 0.00 N ATOM 837 CA ASN A 121 5.242 -1.452 6.674 1.00 0.00 C ATOM 838 C ASN A 121 6.724 -1.539 7.022 1.00 0.00 C ATOM 839 O ASN A 121 7.156 -2.453 7.724 1.00 0.00 O ATOM 840 CB ASN A 121 4.634 -2.856 6.625 1.00 0.00 C ATOM 841 CG ASN A 121 4.014 -3.264 7.946 1.00 0.00 C ATOM 842 OD1 ASN A 121 3.797 -2.432 8.827 1.00 0.00 O ATOM 843 ND2 ASN A 121 3.726 -4.553 8.093 1.00 0.00 N ATOM 0 H ASN A 121 4.512 0.094 5.459 1.00 0.00 H new ATOM 0 HA ASN A 121 4.735 -0.875 7.447 1.00 0.00 H new ATOM 0 HB2 ASN A 121 3.875 -2.893 5.844 1.00 0.00 H new ATOM 0 HB3 ASN A 121 5.407 -3.574 6.352 1.00 0.00 H new ATOM 0 HD21 ASN A 121 3.308 -4.886 8.962 1.00 0.00 H new ATOM 0 HD22 ASN A 121 3.922 -5.209 7.337 1.00 0.00 H new ATOM 850 N GLY A 122 7.499 -0.580 6.524 1.00 0.00 N ATOM 851 CA GLY A 122 8.926 -0.564 6.791 1.00 0.00 C ATOM 852 C GLY A 122 9.740 -1.203 5.680 1.00 0.00 C ATOM 853 O GLY A 122 10.969 -1.231 5.746 1.00 0.00 O ATOM 0 H GLY A 122 7.164 0.186 5.940 1.00 0.00 H new ATOM 0 HA2 GLY A 122 9.254 0.466 6.929 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.122 -1.088 7.726 1.00 0.00 H new ATOM 857 N THR A 123 9.060 -1.720 4.659 1.00 0.00 N ATOM 858 CA THR A 123 9.740 -2.361 3.539 1.00 0.00 C ATOM 859 C THR A 123 9.178 -1.883 2.203 1.00 0.00 C ATOM 860 O THR A 123 7.970 -1.931 1.973 1.00 0.00 O ATOM 861 CB THR A 123 9.611 -3.881 3.641 1.00 0.00 C ATOM 862 OG1 THR A 123 10.024 -4.336 4.918 1.00 0.00 O ATOM 863 CG2 THR A 123 10.426 -4.623 2.605 1.00 0.00 C ATOM 0 H THR A 123 8.043 -1.707 4.585 1.00 0.00 H new ATOM 0 HA THR A 123 10.793 -2.084 3.586 1.00 0.00 H new ATOM 0 HB THR A 123 8.556 -4.092 3.468 1.00 0.00 H new ATOM 0 HG1 THR A 123 9.932 -5.311 4.963 1.00 0.00 H new ATOM 0 HG21 THR A 123 10.288 -5.697 2.734 1.00 0.00 H new ATOM 0 HG22 THR A 123 10.097 -4.333 1.607 1.00 0.00 H new ATOM 0 HG23 THR A 123 11.481 -4.375 2.726 1.00 0.00 H new ATOM 871 N ASN A 124 10.065 -1.430 1.324 1.00 0.00 N ATOM 872 CA ASN A 124 9.665 -0.953 0.005 1.00 0.00 C ATOM 873 C ASN A 124 9.554 -2.115 -0.974 1.00 0.00 C ATOM 874 O ASN A 124 10.521 -2.841 -1.202 1.00 0.00 O ATOM 875 CB ASN A 124 10.671 0.075 -0.517 1.00 0.00 C ATOM 876 CG ASN A 124 12.096 -0.443 -0.479 1.00 0.00 C ATOM 877 OD1 ASN A 124 12.571 -1.057 -1.433 1.00 0.00 O ATOM 878 ND2 ASN A 124 12.785 -0.198 0.630 1.00 0.00 N ATOM 0 H ASN A 124 11.068 -1.383 1.502 1.00 0.00 H new ATOM 0 HA ASN A 124 8.688 -0.478 0.095 1.00 0.00 H new ATOM 0 HB2 ASN A 124 10.412 0.346 -1.541 1.00 0.00 H new ATOM 0 HB3 ASN A 124 10.601 0.984 0.080 1.00 0.00 H new ATOM 0 HD21 ASN A 124 13.748 -0.523 0.714 1.00 0.00 H new ATOM 0 HD22 ASN A 124 12.351 0.315 1.397 1.00 0.00 H new ATOM 885 N VAL A 125 8.368 -2.288 -1.548 1.00 0.00 N ATOM 886 CA VAL A 125 8.126 -3.365 -2.501 1.00 0.00 C ATOM 887 C VAL A 125 9.191 -3.387 -3.593 1.00 0.00 C ATOM 888 O VAL A 125 9.640 -2.339 -4.058 1.00 0.00 O ATOM 889 CB VAL A 125 6.735 -3.233 -3.152 1.00 0.00 C ATOM 890 CG1 VAL A 125 6.638 -1.947 -3.960 1.00 0.00 C ATOM 891 CG2 VAL A 125 6.439 -4.444 -4.024 1.00 0.00 C ATOM 0 H VAL A 125 7.558 -1.695 -1.369 1.00 0.00 H new ATOM 0 HA VAL A 125 8.170 -4.299 -1.942 1.00 0.00 H new ATOM 0 HB VAL A 125 5.987 -3.190 -2.360 1.00 0.00 H new ATOM 0 HG11 VAL A 125 5.648 -1.874 -4.411 1.00 0.00 H new ATOM 0 HG12 VAL A 125 6.802 -1.092 -3.304 1.00 0.00 H new ATOM 0 HG13 VAL A 125 7.394 -1.952 -4.745 1.00 0.00 H new ATOM 0 HG21 VAL A 125 5.453 -4.335 -4.476 1.00 0.00 H new ATOM 0 HG22 VAL A 125 7.192 -4.520 -4.809 1.00 0.00 H new ATOM 0 HG23 VAL A 125 6.460 -5.346 -3.413 1.00 0.00 H new ATOM 901 N THR A 126 9.592 -4.587 -3.995 1.00 0.00 N ATOM 902 CA THR A 126 10.605 -4.745 -5.031 1.00 0.00 C ATOM 903 C THR A 126 9.987 -5.271 -6.320 1.00 0.00 C ATOM 904 O THR A 126 8.976 -5.973 -6.296 1.00 0.00 O ATOM 905 CB THR A 126 11.706 -5.691 -4.554 1.00 0.00 C ATOM 906 OG1 THR A 126 11.157 -6.923 -4.120 1.00 0.00 O ATOM 907 CG2 THR A 126 12.525 -5.125 -3.415 1.00 0.00 C ATOM 0 H THR A 126 9.231 -5.464 -3.620 1.00 0.00 H new ATOM 0 HA THR A 126 11.040 -3.766 -5.233 1.00 0.00 H new ATOM 0 HB THR A 126 12.359 -5.834 -5.415 1.00 0.00 H new ATOM 0 HG1 THR A 126 11.878 -7.515 -3.820 1.00 0.00 H new ATOM 0 HG21 THR A 126 13.289 -5.845 -3.123 1.00 0.00 H new ATOM 0 HG22 THR A 126 13.003 -4.199 -3.735 1.00 0.00 H new ATOM 0 HG23 THR A 126 11.874 -4.922 -2.565 1.00 0.00 H new ATOM 915 N ASN A 127 10.602 -4.927 -7.445 1.00 0.00 N ATOM 916 CA ASN A 127 10.114 -5.363 -8.747 1.00 0.00 C ATOM 917 C ASN A 127 10.092 -6.886 -8.841 1.00 0.00 C ATOM 918 O ASN A 127 9.318 -7.456 -9.611 1.00 0.00 O ATOM 919 CB ASN A 127 10.984 -4.778 -9.861 1.00 0.00 C ATOM 920 CG ASN A 127 10.502 -5.174 -11.243 1.00 0.00 C ATOM 921 OD1 ASN A 127 10.947 -6.175 -11.805 1.00 0.00 O ATOM 922 ND2 ASN A 127 9.589 -4.386 -11.800 1.00 0.00 N ATOM 0 H ASN A 127 11.440 -4.347 -7.482 1.00 0.00 H new ATOM 0 HA ASN A 127 9.093 -5.000 -8.866 1.00 0.00 H new ATOM 0 HB2 ASN A 127 10.990 -3.691 -9.780 1.00 0.00 H new ATOM 0 HB3 ASN A 127 12.013 -5.114 -9.728 1.00 0.00 H new ATOM 0 HD21 ASN A 127 9.229 -4.601 -12.730 1.00 0.00 H new ATOM 0 HD22 ASN A 127 9.248 -3.566 -11.298 1.00 0.00 H new ATOM 929 N HIS A 128 10.941 -7.541 -8.053 1.00 0.00 N ATOM 930 CA HIS A 128 11.007 -8.998 -8.053 1.00 0.00 C ATOM 931 C HIS A 128 9.648 -9.594 -7.673 1.00 0.00 C ATOM 932 O HIS A 128 8.717 -9.575 -8.478 1.00 0.00 O ATOM 933 CB HIS A 128 12.107 -9.480 -7.101 1.00 0.00 C ATOM 934 CG HIS A 128 13.488 -9.330 -7.659 1.00 0.00 C ATOM 935 ND1 HIS A 128 14.066 -8.105 -7.917 1.00 0.00 N ATOM 936 CD2 HIS A 128 14.409 -10.259 -8.010 1.00 0.00 C ATOM 937 CE1 HIS A 128 15.282 -8.287 -8.402 1.00 0.00 C ATOM 938 NE2 HIS A 128 15.513 -9.584 -8.467 1.00 0.00 N ATOM 0 H HIS A 128 11.590 -7.088 -7.409 1.00 0.00 H new ATOM 0 HA HIS A 128 11.255 -9.339 -9.058 1.00 0.00 H new ATOM 0 HB2 HIS A 128 12.038 -8.922 -6.167 1.00 0.00 H new ATOM 0 HB3 HIS A 128 11.933 -10.529 -6.859 1.00 0.00 H new ATOM 0 HD2 HIS A 128 14.296 -11.331 -7.943 1.00 0.00 H new ATOM 0 HE1 HIS A 128 15.969 -7.507 -8.695 1.00 0.00 H new ATOM 0 HE2 HIS A 128 16.374 -10.016 -8.803 1.00 0.00 H new ATOM 947 N SER A 129 9.524 -10.115 -6.451 1.00 0.00 N ATOM 948 CA SER A 129 8.261 -10.692 -6.009 1.00 0.00 C ATOM 949 C SER A 129 7.599 -9.808 -4.957 1.00 0.00 C ATOM 950 O SER A 129 8.245 -9.358 -4.010 1.00 0.00 O ATOM 951 CB SER A 129 8.487 -12.095 -5.442 1.00 0.00 C ATOM 952 OG SER A 129 7.306 -12.601 -4.845 1.00 0.00 O ATOM 0 H SER A 129 10.274 -10.148 -5.760 1.00 0.00 H new ATOM 0 HA SER A 129 7.599 -10.759 -6.872 1.00 0.00 H new ATOM 0 HB2 SER A 129 8.811 -12.765 -6.239 1.00 0.00 H new ATOM 0 HB3 SER A 129 9.288 -12.067 -4.704 1.00 0.00 H new ATOM 0 HG SER A 129 7.477 -13.499 -4.492 1.00 0.00 H new ATOM 958 N VAL A 130 6.304 -9.571 -5.126 1.00 0.00 N ATOM 959 CA VAL A 130 5.539 -8.750 -4.190 1.00 0.00 C ATOM 960 C VAL A 130 4.949 -9.595 -3.074 1.00 0.00 C ATOM 961 O VAL A 130 4.591 -9.079 -2.015 1.00 0.00 O ATOM 962 CB VAL A 130 4.398 -7.994 -4.893 1.00 0.00 C ATOM 963 CG1 VAL A 130 4.125 -6.669 -4.197 1.00 0.00 C ATOM 964 CG2 VAL A 130 4.730 -7.781 -6.356 1.00 0.00 C ATOM 0 H VAL A 130 5.758 -9.937 -5.906 1.00 0.00 H new ATOM 0 HA VAL A 130 6.239 -8.027 -3.771 1.00 0.00 H new ATOM 0 HB VAL A 130 3.492 -8.597 -4.834 1.00 0.00 H new ATOM 0 HG11 VAL A 130 3.315 -6.149 -4.709 1.00 0.00 H new ATOM 0 HG12 VAL A 130 3.840 -6.854 -3.161 1.00 0.00 H new ATOM 0 HG13 VAL A 130 5.024 -6.053 -4.222 1.00 0.00 H new ATOM 0 HG21 VAL A 130 3.914 -7.245 -6.840 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.647 -7.198 -6.440 1.00 0.00 H new ATOM 0 HG23 VAL A 130 4.869 -8.747 -6.842 1.00 0.00 H new ATOM 974 N ASP A 131 4.837 -10.899 -3.323 1.00 0.00 N ATOM 975 CA ASP A 131 4.277 -11.824 -2.345 1.00 0.00 C ATOM 976 C ASP A 131 4.818 -11.543 -0.944 1.00 0.00 C ATOM 977 O ASP A 131 4.151 -11.813 0.054 1.00 0.00 O ATOM 978 CB ASP A 131 4.583 -13.268 -2.747 1.00 0.00 C ATOM 979 CG ASP A 131 3.366 -13.983 -3.302 1.00 0.00 C ATOM 980 OD1 ASP A 131 2.239 -13.656 -2.874 1.00 0.00 O ATOM 981 OD2 ASP A 131 3.541 -14.868 -4.166 1.00 0.00 O ATOM 0 H ASP A 131 5.128 -11.337 -4.197 1.00 0.00 H new ATOM 0 HA ASP A 131 3.197 -11.679 -2.326 1.00 0.00 H new ATOM 0 HB2 ASP A 131 5.377 -13.274 -3.494 1.00 0.00 H new ATOM 0 HB3 ASP A 131 4.957 -13.812 -1.880 1.00 0.00 H new ATOM 986 N GLN A 132 6.026 -10.991 -0.880 1.00 0.00 N ATOM 987 CA GLN A 132 6.645 -10.665 0.398 1.00 0.00 C ATOM 988 C GLN A 132 5.819 -9.617 1.138 1.00 0.00 C ATOM 989 O GLN A 132 5.586 -9.730 2.342 1.00 0.00 O ATOM 990 CB GLN A 132 8.073 -10.158 0.185 1.00 0.00 C ATOM 991 CG GLN A 132 9.139 -11.200 0.485 1.00 0.00 C ATOM 992 CD GLN A 132 9.487 -12.043 -0.727 1.00 0.00 C ATOM 993 OE1 GLN A 132 10.092 -11.556 -1.683 1.00 0.00 O ATOM 994 NE2 GLN A 132 9.105 -13.314 -0.693 1.00 0.00 N ATOM 0 H GLN A 132 6.593 -10.761 -1.696 1.00 0.00 H new ATOM 0 HA GLN A 132 6.683 -11.570 1.004 1.00 0.00 H new ATOM 0 HB2 GLN A 132 8.182 -9.826 -0.847 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.239 -9.287 0.819 1.00 0.00 H new ATOM 0 HG2 GLN A 132 10.038 -10.701 0.846 1.00 0.00 H new ATOM 0 HG3 GLN A 132 8.791 -11.850 1.288 1.00 0.00 H new ATOM 0 HE21 GLN A 132 8.606 -13.675 0.120 1.00 0.00 H new ATOM 0 HE22 GLN A 132 9.311 -13.930 -1.480 1.00 0.00 H new ATOM 1003 N LEU A 133 5.375 -8.600 0.405 1.00 0.00 N ATOM 1004 CA LEU A 133 4.568 -7.534 0.986 1.00 0.00 C ATOM 1005 C LEU A 133 3.099 -7.940 1.038 1.00 0.00 C ATOM 1006 O LEU A 133 2.417 -7.716 2.037 1.00 0.00 O ATOM 1007 CB LEU A 133 4.728 -6.244 0.177 1.00 0.00 C ATOM 1008 CG LEU A 133 6.081 -5.548 0.328 1.00 0.00 C ATOM 1009 CD1 LEU A 133 6.280 -5.072 1.759 1.00 0.00 C ATOM 1010 CD2 LEU A 133 7.209 -6.481 -0.087 1.00 0.00 C ATOM 0 H LEU A 133 5.561 -8.492 -0.592 1.00 0.00 H new ATOM 0 HA LEU A 133 4.916 -7.357 2.004 1.00 0.00 H new ATOM 0 HB2 LEU A 133 4.570 -6.472 -0.877 1.00 0.00 H new ATOM 0 HB3 LEU A 133 3.943 -5.548 0.473 1.00 0.00 H new ATOM 0 HG LEU A 133 6.096 -4.678 -0.328 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.248 -4.579 1.847 1.00 0.00 H new ATOM 0 HD12 LEU A 133 5.490 -4.369 2.022 1.00 0.00 H new ATOM 0 HD13 LEU A 133 6.245 -5.926 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 133 8.165 -5.969 0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.196 -7.370 0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.075 -6.773 -1.129 1.00 0.00 H new ATOM 1022 N GLN A 134 2.620 -8.545 -0.044 1.00 0.00 N ATOM 1023 CA GLN A 134 1.234 -8.992 -0.124 1.00 0.00 C ATOM 1024 C GLN A 134 0.932 -9.995 0.987 1.00 0.00 C ATOM 1025 O GLN A 134 -0.063 -9.866 1.702 1.00 0.00 O ATOM 1026 CB GLN A 134 0.965 -9.621 -1.497 1.00 0.00 C ATOM 1027 CG GLN A 134 -0.383 -10.320 -1.612 1.00 0.00 C ATOM 1028 CD GLN A 134 -1.353 -9.586 -2.516 1.00 0.00 C ATOM 1029 OE1 GLN A 134 -0.975 -8.658 -3.229 1.00 0.00 O ATOM 1030 NE2 GLN A 134 -2.615 -9.999 -2.488 1.00 0.00 N ATOM 0 H GLN A 134 3.173 -8.737 -0.879 1.00 0.00 H new ATOM 0 HA GLN A 134 0.580 -8.130 0.004 1.00 0.00 H new ATOM 0 HB2 GLN A 134 1.024 -8.843 -2.258 1.00 0.00 H new ATOM 0 HB3 GLN A 134 1.754 -10.341 -1.715 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -0.232 -11.330 -1.994 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -0.822 -10.417 -0.619 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -2.885 -10.773 -1.881 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -3.314 -9.542 -3.073 1.00 0.00 H new ATOM 1039 N LYS A 135 1.799 -10.993 1.127 1.00 0.00 N ATOM 1040 CA LYS A 135 1.628 -12.018 2.150 1.00 0.00 C ATOM 1041 C LYS A 135 1.837 -11.433 3.543 1.00 0.00 C ATOM 1042 O LYS A 135 1.049 -11.681 4.456 1.00 0.00 O ATOM 1043 CB LYS A 135 2.609 -13.168 1.915 1.00 0.00 C ATOM 1044 CG LYS A 135 2.247 -14.437 2.669 1.00 0.00 C ATOM 1045 CD LYS A 135 1.570 -15.452 1.762 1.00 0.00 C ATOM 1046 CE LYS A 135 1.882 -16.877 2.190 1.00 0.00 C ATOM 1047 NZ LYS A 135 0.741 -17.798 1.931 1.00 0.00 N ATOM 0 H LYS A 135 2.627 -11.113 0.544 1.00 0.00 H new ATOM 0 HA LYS A 135 0.609 -12.399 2.084 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.650 -13.388 0.848 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.608 -12.850 2.214 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.148 -14.875 3.098 1.00 0.00 H new ATOM 0 HG3 LYS A 135 1.585 -14.191 3.499 1.00 0.00 H new ATOM 0 HD2 LYS A 135 0.492 -15.294 1.778 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.899 -15.299 0.734 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.763 -17.232 1.655 1.00 0.00 H new ATOM 0 HE3 LYS A 135 2.126 -16.892 3.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 0.994 -18.759 2.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -0.093 -17.475 2.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 0.524 -17.804 0.914 1.00 0.00 H new ATOM 1061 N ALA A 136 2.904 -10.659 3.701 1.00 0.00 N ATOM 1062 CA ALA A 136 3.218 -10.041 4.983 1.00 0.00 C ATOM 1063 C ALA A 136 2.168 -9.006 5.370 1.00 0.00 C ATOM 1064 O ALA A 136 1.931 -8.761 6.552 1.00 0.00 O ATOM 1065 CB ALA A 136 4.598 -9.404 4.937 1.00 0.00 C ATOM 0 H ALA A 136 3.567 -10.444 2.956 1.00 0.00 H new ATOM 0 HA ALA A 136 3.214 -10.822 5.743 1.00 0.00 H new ATOM 0 HB1 ALA A 136 4.820 -8.946 5.901 1.00 0.00 H new ATOM 0 HB2 ALA A 136 5.344 -10.168 4.718 1.00 0.00 H new ATOM 0 HB3 ALA A 136 4.621 -8.641 4.159 1.00 0.00 H new ATOM 1071 N MET A 137 1.543 -8.396 4.367 1.00 0.00 N ATOM 1072 CA MET A 137 0.521 -7.383 4.606 1.00 0.00 C ATOM 1073 C MET A 137 -0.766 -8.012 5.131 1.00 0.00 C ATOM 1074 O MET A 137 -1.449 -7.435 5.978 1.00 0.00 O ATOM 1075 CB MET A 137 0.233 -6.606 3.320 1.00 0.00 C ATOM 1076 CG MET A 137 1.221 -5.483 3.052 1.00 0.00 C ATOM 1077 SD MET A 137 0.810 -3.969 3.939 1.00 0.00 S ATOM 1078 CE MET A 137 1.670 -4.237 5.486 1.00 0.00 C ATOM 0 H MET A 137 1.727 -8.586 3.382 1.00 0.00 H new ATOM 0 HA MET A 137 0.901 -6.697 5.363 1.00 0.00 H new ATOM 0 HB2 MET A 137 0.245 -7.298 2.478 1.00 0.00 H new ATOM 0 HB3 MET A 137 -0.772 -6.188 3.375 1.00 0.00 H new ATOM 0 HG2 MET A 137 2.221 -5.808 3.340 1.00 0.00 H new ATOM 0 HG3 MET A 137 1.249 -5.276 1.982 1.00 0.00 H new ATOM 0 HE1 MET A 137 1.896 -3.276 5.948 1.00 0.00 H new ATOM 0 HE2 MET A 137 1.040 -4.823 6.156 1.00 0.00 H new ATOM 0 HE3 MET A 137 2.599 -4.776 5.297 1.00 0.00 H new ATOM 1088 N LYS A 138 -1.095 -9.195 4.623 1.00 0.00 N ATOM 1089 CA LYS A 138 -2.303 -9.896 5.043 1.00 0.00 C ATOM 1090 C LYS A 138 -2.028 -10.822 6.225 1.00 0.00 C ATOM 1091 O LYS A 138 -2.943 -11.193 6.959 1.00 0.00 O ATOM 1092 CB LYS A 138 -2.884 -10.697 3.877 1.00 0.00 C ATOM 1093 CG LYS A 138 -1.968 -11.803 3.377 1.00 0.00 C ATOM 1094 CD LYS A 138 -2.250 -12.145 1.922 1.00 0.00 C ATOM 1095 CE LYS A 138 -1.822 -13.564 1.589 1.00 0.00 C ATOM 1096 NZ LYS A 138 -1.751 -13.794 0.120 1.00 0.00 N ATOM 0 H LYS A 138 -0.543 -9.688 3.921 1.00 0.00 H new ATOM 0 HA LYS A 138 -3.028 -9.147 5.361 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -3.833 -11.136 4.186 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -3.101 -10.017 3.053 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -0.929 -11.492 3.484 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -2.100 -12.692 3.993 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -3.315 -12.028 1.720 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -1.724 -11.444 1.274 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.847 -13.763 2.035 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -2.525 -14.269 2.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -1.455 -14.774 -0.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -2.687 -13.629 -0.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -1.061 -13.140 -0.301 1.00 0.00 H new ATOM 1110 N GLU A 139 -0.764 -11.200 6.402 1.00 0.00 N ATOM 1111 CA GLU A 139 -0.379 -12.086 7.495 1.00 0.00 C ATOM 1112 C GLU A 139 0.012 -11.299 8.744 1.00 0.00 C ATOM 1113 O GLU A 139 0.067 -11.852 9.843 1.00 0.00 O ATOM 1114 CB GLU A 139 0.780 -12.986 7.063 1.00 0.00 C ATOM 1115 CG GLU A 139 0.866 -14.285 7.848 1.00 0.00 C ATOM 1116 CD GLU A 139 2.201 -14.983 7.673 1.00 0.00 C ATOM 1117 OE1 GLU A 139 3.244 -14.337 7.904 1.00 0.00 O ATOM 1118 OE2 GLU A 139 2.202 -16.177 7.305 1.00 0.00 O ATOM 0 H GLU A 139 0.008 -10.907 5.804 1.00 0.00 H new ATOM 0 HA GLU A 139 -1.244 -12.702 7.742 1.00 0.00 H new ATOM 0 HB2 GLU A 139 0.674 -13.218 6.003 1.00 0.00 H new ATOM 0 HB3 GLU A 139 1.716 -12.439 7.177 1.00 0.00 H new ATOM 0 HG2 GLU A 139 0.704 -14.078 8.906 1.00 0.00 H new ATOM 0 HG3 GLU A 139 0.066 -14.953 7.528 1.00 0.00 H new ATOM 1125 N THR A 140 0.287 -10.008 8.575 1.00 0.00 N ATOM 1126 CA THR A 140 0.675 -9.158 9.698 1.00 0.00 C ATOM 1127 C THR A 140 -0.535 -8.786 10.548 1.00 0.00 C ATOM 1128 O THR A 140 -1.671 -8.808 10.076 1.00 0.00 O ATOM 1129 CB THR A 140 1.365 -7.889 9.195 1.00 0.00 C ATOM 1130 OG1 THR A 140 1.754 -7.067 10.282 1.00 0.00 O ATOM 1131 CG2 THR A 140 0.495 -7.057 8.279 1.00 0.00 C ATOM 0 H THR A 140 0.249 -9.529 7.675 1.00 0.00 H new ATOM 0 HA THR A 140 1.372 -9.722 10.317 1.00 0.00 H new ATOM 0 HB THR A 140 2.231 -8.235 8.630 1.00 0.00 H new ATOM 0 HG1 THR A 140 2.195 -6.261 9.941 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.045 -6.172 7.959 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.217 -7.647 7.406 1.00 0.00 H new ATOM 0 HG23 THR A 140 -0.406 -6.751 8.811 1.00 0.00 H new ATOM 1139 N LYS A 141 -0.279 -8.442 11.806 1.00 0.00 N ATOM 1140 CA LYS A 141 -1.344 -8.061 12.728 1.00 0.00 C ATOM 1141 C LYS A 141 -0.876 -6.951 13.664 1.00 0.00 C ATOM 1142 O LYS A 141 0.094 -7.119 14.404 1.00 0.00 O ATOM 1143 CB LYS A 141 -1.801 -9.273 13.542 1.00 0.00 C ATOM 1144 CG LYS A 141 -0.658 -10.037 14.191 1.00 0.00 C ATOM 1145 CD LYS A 141 -1.015 -10.491 15.596 1.00 0.00 C ATOM 1146 CE LYS A 141 0.202 -10.498 16.507 1.00 0.00 C ATOM 1147 NZ LYS A 141 0.349 -9.214 17.247 1.00 0.00 N ATOM 0 H LYS A 141 0.657 -8.419 12.211 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.185 -7.690 12.142 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -2.491 -8.940 14.317 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -2.355 -9.949 12.891 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.407 -10.904 13.581 1.00 0.00 H new ATOM 0 HG3 LYS A 141 0.229 -9.405 14.227 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -1.777 -9.830 16.010 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -1.447 -11.491 15.557 1.00 0.00 H new ATOM 0 HE2 LYS A 141 0.118 -11.320 17.218 1.00 0.00 H new ATOM 0 HE3 LYS A 141 1.098 -10.680 15.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 1.190 -9.259 17.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 0.455 -8.433 16.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -0.495 -9.052 17.833 1.00 0.00 H new ATOM 1161 N GLY A 142 -1.571 -5.819 13.628 1.00 0.00 N ATOM 1162 CA GLY A 142 -1.209 -4.701 14.479 1.00 0.00 C ATOM 1163 C GLY A 142 -1.206 -3.379 13.735 1.00 0.00 C ATOM 1164 O GLY A 142 -1.818 -3.254 12.675 1.00 0.00 O ATOM 0 H GLY A 142 -2.378 -5.656 13.025 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -1.908 -4.643 15.313 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -0.221 -4.877 14.903 1.00 0.00 H new ATOM 1168 N MET A 143 -0.514 -2.390 14.296 1.00 0.00 N ATOM 1169 CA MET A 143 -0.433 -1.068 13.684 1.00 0.00 C ATOM 1170 C MET A 143 0.548 -1.062 12.516 1.00 0.00 C ATOM 1171 O MET A 143 1.757 -1.191 12.708 1.00 0.00 O ATOM 1172 CB MET A 143 -0.012 -0.030 14.724 1.00 0.00 C ATOM 1173 CG MET A 143 -1.062 0.222 15.794 1.00 0.00 C ATOM 1174 SD MET A 143 -2.317 1.406 15.272 1.00 0.00 S ATOM 1175 CE MET A 143 -1.446 2.952 15.516 1.00 0.00 C ATOM 0 H MET A 143 -0.002 -2.480 15.173 1.00 0.00 H new ATOM 0 HA MET A 143 -1.421 -0.813 13.301 1.00 0.00 H new ATOM 0 HB2 MET A 143 0.910 -0.361 15.203 1.00 0.00 H new ATOM 0 HB3 MET A 143 0.211 0.909 14.218 1.00 0.00 H new ATOM 0 HG2 MET A 143 -1.544 -0.721 16.054 1.00 0.00 H new ATOM 0 HG3 MET A 143 -0.574 0.590 16.696 1.00 0.00 H new ATOM 0 HE1 MET A 143 -1.866 3.714 14.860 1.00 0.00 H new ATOM 0 HE2 MET A 143 -1.551 3.269 16.554 1.00 0.00 H new ATOM 0 HE3 MET A 143 -0.390 2.815 15.283 1.00 0.00 H new ATOM 1185 N ILE A 144 0.020 -0.905 11.306 1.00 0.00 N ATOM 1186 CA ILE A 144 0.852 -0.877 10.108 1.00 0.00 C ATOM 1187 C ILE A 144 1.379 0.530 9.841 1.00 0.00 C ATOM 1188 O ILE A 144 0.660 1.516 10.007 1.00 0.00 O ATOM 1189 CB ILE A 144 0.077 -1.360 8.865 1.00 0.00 C ATOM 1190 CG1 ILE A 144 -0.575 -2.720 9.131 1.00 0.00 C ATOM 1191 CG2 ILE A 144 1.003 -1.440 7.658 1.00 0.00 C ATOM 1192 CD1 ILE A 144 -1.254 -3.315 7.914 1.00 0.00 C ATOM 0 H ILE A 144 -0.979 -0.795 11.129 1.00 0.00 H new ATOM 0 HA ILE A 144 1.687 -1.554 10.291 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.711 -0.638 8.650 1.00 0.00 H new ATOM 0 HG12 ILE A 144 0.185 -3.414 9.488 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -1.309 -2.612 9.930 1.00 0.00 H new ATOM 0 HG21 ILE A 144 0.440 -1.782 6.790 1.00 0.00 H new ATOM 0 HG22 ILE A 144 1.421 -0.454 7.454 1.00 0.00 H new ATOM 0 HG23 ILE A 144 1.812 -2.141 7.866 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -1.693 -4.277 8.177 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -2.037 -2.641 7.568 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -0.520 -3.456 7.120 1.00 0.00 H new ATOM 1204 N SER A 145 2.636 0.614 9.417 1.00 0.00 N ATOM 1205 CA SER A 145 3.258 1.898 9.113 1.00 0.00 C ATOM 1206 C SER A 145 3.443 2.058 7.610 1.00 0.00 C ATOM 1207 O SER A 145 4.163 1.286 6.976 1.00 0.00 O ATOM 1208 CB SER A 145 4.606 2.025 9.823 1.00 0.00 C ATOM 1209 OG SER A 145 4.520 1.586 11.169 1.00 0.00 O ATOM 0 H SER A 145 3.244 -0.193 9.276 1.00 0.00 H new ATOM 0 HA SER A 145 2.599 2.689 9.472 1.00 0.00 H new ATOM 0 HB2 SER A 145 5.356 1.437 9.293 1.00 0.00 H new ATOM 0 HB3 SER A 145 4.938 3.063 9.797 1.00 0.00 H new ATOM 0 HG SER A 145 5.396 1.676 11.599 1.00 0.00 H new ATOM 1215 N LEU A 146 2.781 3.059 7.044 1.00 0.00 N ATOM 1216 CA LEU A 146 2.864 3.315 5.612 1.00 0.00 C ATOM 1217 C LEU A 146 3.413 4.709 5.332 1.00 0.00 C ATOM 1218 O LEU A 146 2.814 5.713 5.720 1.00 0.00 O ATOM 1219 CB LEU A 146 1.481 3.164 4.972 1.00 0.00 C ATOM 1220 CG LEU A 146 1.100 1.738 4.568 1.00 0.00 C ATOM 1221 CD1 LEU A 146 2.195 1.108 3.726 1.00 0.00 C ATOM 1222 CD2 LEU A 146 0.825 0.893 5.801 1.00 0.00 C ATOM 0 H LEU A 146 2.181 3.707 7.555 1.00 0.00 H new ATOM 0 HA LEU A 146 3.548 2.585 5.178 1.00 0.00 H new ATOM 0 HB2 LEU A 146 0.733 3.538 5.671 1.00 0.00 H new ATOM 0 HB3 LEU A 146 1.437 3.799 4.087 1.00 0.00 H new ATOM 0 HG LEU A 146 0.191 1.783 3.968 1.00 0.00 H new ATOM 0 HD11 LEU A 146 1.904 0.095 3.450 1.00 0.00 H new ATOM 0 HD12 LEU A 146 2.347 1.701 2.824 1.00 0.00 H new ATOM 0 HD13 LEU A 146 3.122 1.076 4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 146 0.555 -0.118 5.496 1.00 0.00 H new ATOM 0 HD22 LEU A 146 1.718 0.858 6.425 1.00 0.00 H new ATOM 0 HD23 LEU A 146 0.004 1.332 6.367 1.00 0.00 H new ATOM 1234 N LYS A 147 4.546 4.764 4.643 1.00 0.00 N ATOM 1235 CA LYS A 147 5.166 6.035 4.293 1.00 0.00 C ATOM 1236 C LYS A 147 4.748 6.442 2.887 1.00 0.00 C ATOM 1237 O LYS A 147 5.208 5.867 1.900 1.00 0.00 O ATOM 1238 CB LYS A 147 6.691 5.931 4.385 1.00 0.00 C ATOM 1239 CG LYS A 147 7.287 6.726 5.536 1.00 0.00 C ATOM 1240 CD LYS A 147 7.629 5.830 6.716 1.00 0.00 C ATOM 1241 CE LYS A 147 8.790 6.390 7.521 1.00 0.00 C ATOM 1242 NZ LYS A 147 9.306 5.405 8.511 1.00 0.00 N ATOM 0 H LYS A 147 5.054 3.942 4.316 1.00 0.00 H new ATOM 0 HA LYS A 147 4.832 6.796 4.998 1.00 0.00 H new ATOM 0 HB2 LYS A 147 6.969 4.883 4.496 1.00 0.00 H new ATOM 0 HB3 LYS A 147 7.128 6.280 3.449 1.00 0.00 H new ATOM 0 HG2 LYS A 147 8.186 7.241 5.197 1.00 0.00 H new ATOM 0 HG3 LYS A 147 6.581 7.493 5.853 1.00 0.00 H new ATOM 0 HD2 LYS A 147 6.756 5.725 7.360 1.00 0.00 H new ATOM 0 HD3 LYS A 147 7.882 4.833 6.356 1.00 0.00 H new ATOM 0 HE2 LYS A 147 9.594 6.680 6.845 1.00 0.00 H new ATOM 0 HE3 LYS A 147 8.469 7.293 8.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 10.097 5.826 9.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 8.546 5.147 9.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 9.636 4.553 8.014 1.00 0.00 H new ATOM 1256 N VAL A 148 3.854 7.421 2.803 1.00 0.00 N ATOM 1257 CA VAL A 148 3.353 7.885 1.516 1.00 0.00 C ATOM 1258 C VAL A 148 3.685 9.353 1.275 1.00 0.00 C ATOM 1259 O VAL A 148 3.860 10.127 2.217 1.00 0.00 O ATOM 1260 CB VAL A 148 1.826 7.699 1.412 1.00 0.00 C ATOM 1261 CG1 VAL A 148 1.381 7.721 -0.041 1.00 0.00 C ATOM 1262 CG2 VAL A 148 1.394 6.404 2.090 1.00 0.00 C ATOM 0 H VAL A 148 3.462 7.907 3.610 1.00 0.00 H new ATOM 0 HA VAL A 148 3.848 7.280 0.756 1.00 0.00 H new ATOM 0 HB VAL A 148 1.344 8.530 1.928 1.00 0.00 H new ATOM 0 HG11 VAL A 148 0.300 7.588 -0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.651 8.677 -0.490 1.00 0.00 H new ATOM 0 HG13 VAL A 148 1.872 6.914 -0.584 1.00 0.00 H new ATOM 0 HG21 VAL A 148 0.313 6.292 2.005 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.885 5.559 1.607 1.00 0.00 H new ATOM 0 HG23 VAL A 148 1.674 6.434 3.143 1.00 0.00 H new ATOM 1272 N ILE A 149 3.762 9.728 0.002 1.00 0.00 N ATOM 1273 CA ILE A 149 4.061 11.101 -0.380 1.00 0.00 C ATOM 1274 C ILE A 149 3.057 11.601 -1.418 1.00 0.00 C ATOM 1275 O ILE A 149 2.751 10.896 -2.381 1.00 0.00 O ATOM 1276 CB ILE A 149 5.486 11.229 -0.954 1.00 0.00 C ATOM 1277 CG1 ILE A 149 6.506 10.611 0.004 1.00 0.00 C ATOM 1278 CG2 ILE A 149 5.821 12.688 -1.222 1.00 0.00 C ATOM 1279 CD1 ILE A 149 7.695 9.990 -0.698 1.00 0.00 C ATOM 0 H ILE A 149 3.620 9.095 -0.785 1.00 0.00 H new ATOM 0 HA ILE A 149 3.990 11.709 0.522 1.00 0.00 H new ATOM 0 HB ILE A 149 5.529 10.687 -1.898 1.00 0.00 H new ATOM 0 HG12 ILE A 149 6.860 11.380 0.690 1.00 0.00 H new ATOM 0 HG13 ILE A 149 6.011 9.849 0.607 1.00 0.00 H new ATOM 0 HG21 ILE A 149 6.830 12.761 -1.627 1.00 0.00 H new ATOM 0 HG22 ILE A 149 5.111 13.098 -1.940 1.00 0.00 H new ATOM 0 HG23 ILE A 149 5.762 13.252 -0.291 1.00 0.00 H new ATOM 0 HD11 ILE A 149 8.377 9.571 0.042 1.00 0.00 H new ATOM 0 HD12 ILE A 149 7.352 9.198 -1.364 1.00 0.00 H new ATOM 0 HD13 ILE A 149 8.214 10.753 -1.279 1.00 0.00 H new ATOM 1291 N PRO A 150 2.526 12.824 -1.239 1.00 0.00 N ATOM 1292 CA PRO A 150 1.552 13.403 -2.170 1.00 0.00 C ATOM 1293 C PRO A 150 2.052 13.395 -3.611 1.00 0.00 C ATOM 1294 O PRO A 150 3.107 13.952 -3.915 1.00 0.00 O ATOM 1295 CB PRO A 150 1.387 14.840 -1.671 1.00 0.00 C ATOM 1296 CG PRO A 150 1.760 14.787 -0.230 1.00 0.00 C ATOM 1297 CD PRO A 150 2.829 13.736 -0.119 1.00 0.00 C ATOM 0 HA PRO A 150 0.621 12.836 -2.187 1.00 0.00 H new ATOM 0 HB2 PRO A 150 2.031 15.526 -2.221 1.00 0.00 H new ATOM 0 HB3 PRO A 150 0.363 15.189 -1.802 1.00 0.00 H new ATOM 0 HG2 PRO A 150 2.126 15.754 0.114 1.00 0.00 H new ATOM 0 HG3 PRO A 150 0.898 14.534 0.387 1.00 0.00 H new ATOM 0 HD2 PRO A 150 3.827 14.166 -0.209 1.00 0.00 H new ATOM 0 HD3 PRO A 150 2.789 13.221 0.841 1.00 0.00 H new ATOM 1305 N ASN A 151 1.288 12.761 -4.495 1.00 0.00 N ATOM 1306 CA ASN A 151 1.653 12.683 -5.905 1.00 0.00 C ATOM 1307 C ASN A 151 1.808 14.076 -6.506 1.00 0.00 C ATOM 1308 O ASN A 151 1.112 15.013 -6.114 1.00 0.00 O ATOM 1309 CB ASN A 151 0.598 11.895 -6.683 1.00 0.00 C ATOM 1310 CG ASN A 151 -0.792 12.484 -6.531 1.00 0.00 C ATOM 1311 OD1 ASN A 151 -0.977 13.501 -5.863 1.00 0.00 O ATOM 1312 ND2 ASN A 151 -1.776 11.844 -7.151 1.00 0.00 N ATOM 0 H ASN A 151 0.412 12.294 -4.260 1.00 0.00 H new ATOM 0 HA ASN A 151 2.610 12.167 -5.978 1.00 0.00 H new ATOM 0 HB2 ASN A 151 0.868 11.876 -7.739 1.00 0.00 H new ATOM 0 HB3 ASN A 151 0.592 10.861 -6.337 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -2.732 12.192 -7.084 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -1.576 11.004 -7.694 1.00 0.00 H new ATOM 1319 N GLN A 152 2.726 14.206 -7.458 1.00 0.00 N ATOM 1320 CA GLN A 152 2.973 15.486 -8.114 1.00 0.00 C ATOM 1321 C GLN A 152 3.457 16.528 -7.110 1.00 0.00 C ATOM 1322 O GLN A 152 2.657 17.153 -6.414 1.00 0.00 O ATOM 1323 CB GLN A 152 1.703 15.981 -8.808 1.00 0.00 C ATOM 1324 CG GLN A 152 1.181 15.030 -9.874 1.00 0.00 C ATOM 1325 CD GLN A 152 -0.314 14.803 -9.772 1.00 0.00 C ATOM 1326 OE1 GLN A 152 -0.765 13.745 -9.335 1.00 0.00 O ATOM 1327 NE2 GLN A 152 -1.093 15.800 -10.178 1.00 0.00 N ATOM 0 H GLN A 152 3.312 13.441 -7.793 1.00 0.00 H new ATOM 0 HA GLN A 152 3.753 15.338 -8.861 1.00 0.00 H new ATOM 0 HB2 GLN A 152 0.926 16.135 -8.059 1.00 0.00 H new ATOM 0 HB3 GLN A 152 1.903 16.951 -9.264 1.00 0.00 H new ATOM 0 HG2 GLN A 152 1.417 15.430 -10.860 1.00 0.00 H new ATOM 0 HG3 GLN A 152 1.697 14.074 -9.786 1.00 0.00 H new ATOM 0 HE21 GLN A 152 -0.676 16.660 -10.534 1.00 0.00 H new ATOM 0 HE22 GLN A 152 -2.108 15.705 -10.134 1.00 0.00 H new ATOM 1336 N GLN A 153 4.771 16.709 -7.041 1.00 0.00 N ATOM 1337 CA GLN A 153 5.363 17.676 -6.123 1.00 0.00 C ATOM 1338 C GLN A 153 5.010 17.340 -4.678 1.00 0.00 C ATOM 1339 O GLN A 153 5.851 16.720 -3.993 1.00 0.00 O ATOM 1340 CB GLN A 153 4.887 19.090 -6.462 1.00 0.00 C ATOM 1341 CG GLN A 153 5.747 19.788 -7.503 1.00 0.00 C ATOM 1342 CD GLN A 153 5.960 21.256 -7.193 1.00 0.00 C ATOM 1343 OE1 GLN A 153 6.973 21.639 -6.607 1.00 0.00 O ATOM 1344 NE2 GLN A 153 5.002 22.090 -7.584 1.00 0.00 N ATOM 1345 OXT GLN A 153 3.897 17.702 -4.242 1.00 0.00 O ATOM 0 H GLN A 153 5.447 16.199 -7.610 1.00 0.00 H new ATOM 0 HA GLN A 153 6.446 17.629 -6.234 1.00 0.00 H new ATOM 0 HB2 GLN A 153 3.860 19.042 -6.824 1.00 0.00 H new ATOM 0 HB3 GLN A 153 4.876 19.689 -5.551 1.00 0.00 H new ATOM 0 HG2 GLN A 153 6.714 19.289 -7.564 1.00 0.00 H new ATOM 0 HG3 GLN A 153 5.277 19.692 -8.482 1.00 0.00 H new ATOM 0 HE21 GLN A 153 4.179 21.730 -8.067 1.00 0.00 H new ATOM 0 HE22 GLN A 153 5.090 23.090 -7.401 1.00 0.00 H new TER 1354 GLN A 153 ATOM 1355 N ARG B 123 5.349 -4.153 -15.880 1.00 0.00 N ATOM 1356 CA ARG B 123 4.496 -3.337 -14.976 1.00 0.00 C ATOM 1357 C ARG B 123 3.318 -4.149 -14.447 1.00 0.00 C ATOM 1358 O ARG B 123 2.488 -4.632 -15.217 1.00 0.00 O ATOM 1359 CB ARG B 123 3.996 -2.116 -15.753 1.00 0.00 C ATOM 1360 CG ARG B 123 4.570 -0.800 -15.253 1.00 0.00 C ATOM 1361 CD ARG B 123 5.141 0.031 -16.391 1.00 0.00 C ATOM 1362 NE ARG B 123 4.091 0.645 -17.201 1.00 0.00 N ATOM 1363 CZ ARG B 123 4.283 1.115 -18.432 1.00 0.00 C ATOM 1364 NH1 ARG B 123 5.482 1.045 -18.997 1.00 0.00 N ATOM 1365 NH2 ARG B 123 3.274 1.657 -19.100 1.00 0.00 N ATOM 0 HA ARG B 123 5.084 -3.019 -14.115 1.00 0.00 H new ATOM 0 HB2 ARG B 123 4.250 -2.237 -16.806 1.00 0.00 H new ATOM 0 HB3 ARG B 123 2.909 -2.076 -15.690 1.00 0.00 H new ATOM 0 HG2 ARG B 123 3.791 -0.233 -14.743 1.00 0.00 H new ATOM 0 HG3 ARG B 123 5.351 -0.999 -14.519 1.00 0.00 H new ATOM 0 HD2 ARG B 123 5.786 0.809 -15.983 1.00 0.00 H new ATOM 0 HD3 ARG B 123 5.764 -0.601 -17.024 1.00 0.00 H new ATOM 0 HE ARG B 123 3.156 0.718 -16.800 1.00 0.00 H new ATOM 0 HH11 ARG B 123 6.262 0.630 -18.488 1.00 0.00 H new ATOM 0 HH12 ARG B 123 5.623 1.407 -19.940 1.00 0.00 H new ATOM 0 HH21 ARG B 123 2.350 1.714 -18.671 1.00 0.00 H new ATOM 0 HH22 ARG B 123 3.421 2.017 -20.043 1.00 0.00 H new ATOM 1379 N LYS B 124 3.253 -4.296 -13.128 1.00 0.00 N ATOM 1380 CA LYS B 124 2.177 -5.050 -12.494 1.00 0.00 C ATOM 1381 C LYS B 124 1.491 -4.212 -11.418 1.00 0.00 C ATOM 1382 O LYS B 124 2.023 -3.192 -10.985 1.00 0.00 O ATOM 1383 CB LYS B 124 2.726 -6.342 -11.884 1.00 0.00 C ATOM 1384 CG LYS B 124 2.179 -7.603 -12.535 1.00 0.00 C ATOM 1385 CD LYS B 124 1.075 -8.228 -11.698 1.00 0.00 C ATOM 1386 CE LYS B 124 0.706 -9.612 -12.207 1.00 0.00 C ATOM 1387 NZ LYS B 124 -0.385 -9.561 -13.219 1.00 0.00 N ATOM 0 H LYS B 124 3.933 -3.903 -12.477 1.00 0.00 H new ATOM 0 HA LYS B 124 1.440 -5.303 -13.256 1.00 0.00 H new ATOM 0 HB2 LYS B 124 3.813 -6.341 -11.969 1.00 0.00 H new ATOM 0 HB3 LYS B 124 2.490 -6.361 -10.820 1.00 0.00 H new ATOM 0 HG2 LYS B 124 1.794 -7.364 -13.527 1.00 0.00 H new ATOM 0 HG3 LYS B 124 2.986 -8.323 -12.671 1.00 0.00 H new ATOM 0 HD2 LYS B 124 1.398 -8.295 -10.659 1.00 0.00 H new ATOM 0 HD3 LYS B 124 0.195 -7.586 -11.717 1.00 0.00 H new ATOM 0 HE2 LYS B 124 1.586 -10.084 -12.645 1.00 0.00 H new ATOM 0 HE3 LYS B 124 0.394 -10.235 -11.369 1.00 0.00 H new ATOM 0 HZ1 LYS B 124 -0.606 -10.525 -13.540 1.00 0.00 H new ATOM 0 HZ2 LYS B 124 -1.233 -9.135 -12.794 1.00 0.00 H new ATOM 0 HZ3 LYS B 124 -0.079 -8.988 -14.031 1.00 0.00 H new ATOM 1401 N GLU B 125 0.314 -4.654 -10.987 1.00 0.00 N ATOM 1402 CA GLU B 125 -0.442 -3.962 -9.967 1.00 0.00 C ATOM 1403 C GLU B 125 -1.089 -4.964 -9.029 1.00 0.00 C ATOM 1404 O GLU B 125 -1.718 -5.931 -9.462 1.00 0.00 O ATOM 1405 CB GLU B 125 -1.506 -3.070 -10.594 1.00 0.00 C ATOM 1406 CG GLU B 125 -2.617 -3.838 -11.295 1.00 0.00 C ATOM 1407 CD GLU B 125 -2.116 -4.624 -12.490 1.00 0.00 C ATOM 1408 OE1 GLU B 125 -1.852 -4.003 -13.541 1.00 0.00 O ATOM 1409 OE2 GLU B 125 -1.989 -5.861 -12.376 1.00 0.00 O ATOM 0 H GLU B 125 -0.135 -5.500 -11.338 1.00 0.00 H new ATOM 0 HA GLU B 125 0.243 -3.332 -9.399 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -1.945 -2.443 -9.818 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -1.030 -2.402 -11.312 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -3.085 -4.521 -10.586 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -3.387 -3.139 -11.621 1.00 0.00 H new ATOM 1416 N TYR B 126 -0.913 -4.729 -7.748 1.00 0.00 N ATOM 1417 CA TYR B 126 -1.452 -5.606 -6.724 1.00 0.00 C ATOM 1418 C TYR B 126 -2.494 -4.911 -5.868 1.00 0.00 C ATOM 1419 O TYR B 126 -2.422 -3.705 -5.631 1.00 0.00 O ATOM 1420 CB TYR B 126 -0.333 -6.092 -5.812 1.00 0.00 C ATOM 1421 CG TYR B 126 0.596 -7.072 -6.467 1.00 0.00 C ATOM 1422 CD1 TYR B 126 1.286 -6.734 -7.618 1.00 0.00 C ATOM 1423 CD2 TYR B 126 0.784 -8.332 -5.929 1.00 0.00 C ATOM 1424 CE1 TYR B 126 2.145 -7.629 -8.221 1.00 0.00 C ATOM 1425 CE2 TYR B 126 1.637 -9.236 -6.518 1.00 0.00 C ATOM 1426 CZ TYR B 126 2.318 -8.883 -7.667 1.00 0.00 C ATOM 1427 OH TYR B 126 3.172 -9.782 -8.262 1.00 0.00 O ATOM 0 H TYR B 126 -0.395 -3.929 -7.384 1.00 0.00 H new ATOM 0 HA TYR B 126 -1.924 -6.443 -7.239 1.00 0.00 H new ATOM 0 HB2 TYR B 126 0.243 -5.233 -5.468 1.00 0.00 H new ATOM 0 HB3 TYR B 126 -0.772 -6.555 -4.928 1.00 0.00 H new ATOM 0 HD1 TYR B 126 1.150 -5.754 -8.051 1.00 0.00 H new ATOM 0 HD2 TYR B 126 0.252 -8.611 -5.031 1.00 0.00 H new ATOM 0 HE1 TYR B 126 2.678 -7.352 -9.119 1.00 0.00 H new ATOM 0 HE2 TYR B 126 1.774 -10.216 -6.085 1.00 0.00 H new ATOM 0 HH TYR B 126 3.180 -10.616 -7.747 1.00 0.00 H new ATOM 1437 N CYS B 127 -3.427 -5.699 -5.357 1.00 0.00 N ATOM 1438 CA CYS B 127 -4.447 -5.186 -4.466 1.00 0.00 C ATOM 1439 C CYS B 127 -4.171 -5.739 -3.079 1.00 0.00 C ATOM 1440 O CYS B 127 -4.190 -6.952 -2.870 1.00 0.00 O ATOM 1441 CB CYS B 127 -5.844 -5.584 -4.944 1.00 0.00 C ATOM 1442 SG CYS B 127 -6.703 -4.279 -5.885 1.00 0.00 S ATOM 0 H CYS B 127 -3.496 -6.699 -5.547 1.00 0.00 H new ATOM 0 HA CYS B 127 -4.416 -4.097 -4.450 1.00 0.00 H new ATOM 0 HB2 CYS B 127 -5.764 -6.475 -5.567 1.00 0.00 H new ATOM 0 HB3 CYS B 127 -6.450 -5.853 -4.079 1.00 0.00 H new ATOM 1447 N ILE B 128 -3.869 -4.854 -2.145 1.00 0.00 N ATOM 1448 CA ILE B 128 -3.536 -5.272 -0.795 1.00 0.00 C ATOM 1449 C ILE B 128 -4.035 -4.268 0.241 1.00 0.00 C ATOM 1450 O ILE B 128 -3.404 -4.163 1.314 1.00 0.00 O ATOM 1451 CB ILE B 128 -2.008 -5.447 -0.658 1.00 0.00 C ATOM 1452 CG1 ILE B 128 -1.300 -4.108 -0.921 1.00 0.00 C ATOM 1453 CG2 ILE B 128 -1.512 -6.536 -1.611 1.00 0.00 C ATOM 1454 CD1 ILE B 128 -0.576 -4.034 -2.250 1.00 0.00 C ATOM 1455 OXT ILE B 128 -5.054 -3.596 -0.029 1.00 0.00 O ATOM 0 H ILE B 128 -3.848 -3.845 -2.296 1.00 0.00 H new ATOM 0 HA ILE B 128 -4.032 -6.225 -0.609 1.00 0.00 H new ATOM 0 HB ILE B 128 -1.772 -5.761 0.359 1.00 0.00 H new ATOM 0 HG12 ILE B 128 -2.037 -3.306 -0.877 1.00 0.00 H new ATOM 0 HG13 ILE B 128 -0.584 -3.926 -0.120 1.00 0.00 H new ATOM 0 HG21 ILE B 128 -0.433 -6.649 -1.504 1.00 0.00 H new ATOM 0 HG22 ILE B 128 -2.001 -7.480 -1.371 1.00 0.00 H new ATOM 0 HG23 ILE B 128 -1.748 -6.256 -2.638 1.00 0.00 H new ATOM 0 HD11 ILE B 128 -0.105 -3.056 -2.354 1.00 0.00 H new ATOM 0 HD12 ILE B 128 0.187 -4.811 -2.292 1.00 0.00 H new ATOM 0 HD13 ILE B 128 -1.289 -4.181 -3.061 1.00 0.00 H new TER 1467 ILE B 128