USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1027 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 48 ASN : amide:sc= 1.9 K(o=1.9,f=-2.2!) USER MOD Set 1.2: A 50 SER OG : rot -87:sc= 0.761 USER MOD Set 1.3: A 111 HIS : no HD1:sc= -0.758 K(o=1.9,f=-3.7!) USER MOD Single : A 1 GLY N :NH3+ -134:sc= 0.0689 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -53:sc= 0.0209 USER MOD Single : A 17 LYS NZ :NH3+ -142:sc= -0.0371 (180deg=-1.8!) USER MOD Single : A 25 GLN : amide:sc= -1.41 K(o=-1.4,f=-5.7!) USER MOD Single : A 27 ASN :FLIP amide:sc= 0.962 F(o=-0.3,f=0.96) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -2.86! C(o=-2.9!,f=-4.8!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc=0.000307 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.007) USER MOD Single : A 59 CYS SG : rot 170:sc= -1.28 USER MOD Single : A 60 GLN : amide:sc= -0.0111 K(o=-0.011,f=-0.99) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 72 GLN : amide:sc= 0.183 K(o=0.18,f=-3.4!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.525 K(o=-0.53,f=-4.1!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 95 ASN : amide:sc= -2.36 X(o=-2.4,f=-2.5!) USER MOD Single : A 97 ASN : amide:sc= -0.0882 X(o=-0.088,f=0) USER MOD Single : A 98 LYS NZ :NH3+ -163:sc= -0.0108 (180deg=-0.175) USER MOD Single : A 104 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.182) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc= -0.0299 X(o=-0.03,f=0) USER MOD Single : A 114 GLN : amide:sc= -0.0669 K(o=-0.067,f=-2.7) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -0.135 X(o=-0.13,f=-0.58) USER MOD Single : A 124 ASN : amide:sc= -3.15 K(o=-3.1,f=-9.6!) USER MOD Single : A 129 SER OG : rot -80:sc= 1.22 USER MOD Single : A 131 GLN : amide:sc= 0.00457 X(o=0.0046,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.058 -32.508 -0.885 1.00 0.00 N ATOM 2 CA GLY A 1 -7.590 -31.971 0.380 1.00 0.00 C ATOM 3 C GLY A 1 -8.308 -32.578 1.569 1.00 0.00 C ATOM 4 O GLY A 1 -8.980 -33.601 1.441 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.242 -32.745 -1.485 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.621 -33.365 -0.711 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.647 -31.799 -1.366 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.519 -32.153 0.474 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.732 -30.890 0.387 1.00 0.00 H new ATOM 8 N SER A 2 -8.166 -31.946 2.730 1.00 0.00 N ATOM 9 CA SER A 2 -8.802 -32.433 3.948 1.00 0.00 C ATOM 10 C SER A 2 -9.538 -31.305 4.664 1.00 0.00 C ATOM 11 O SER A 2 -8.958 -30.261 4.961 1.00 0.00 O ATOM 12 CB SER A 2 -7.759 -33.050 4.881 1.00 0.00 C ATOM 13 OG SER A 2 -8.376 -33.681 5.990 1.00 0.00 O ATOM 0 H SER A 2 -7.616 -31.096 2.852 1.00 0.00 H new ATOM 0 HA SER A 2 -9.527 -33.198 3.670 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.160 -33.777 4.332 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.077 -32.275 5.232 1.00 0.00 H new ATOM 0 HG SER A 2 -7.688 -34.069 6.570 1.00 0.00 H new ATOM 19 N SER A 3 -10.820 -31.525 4.939 1.00 0.00 N ATOM 20 CA SER A 3 -11.638 -30.526 5.617 1.00 0.00 C ATOM 21 C SER A 3 -11.147 -30.299 7.044 1.00 0.00 C ATOM 22 O SER A 3 -11.231 -31.187 7.891 1.00 0.00 O ATOM 23 CB SER A 3 -13.104 -30.964 5.635 1.00 0.00 C ATOM 24 OG SER A 3 -13.963 -29.860 5.864 1.00 0.00 O ATOM 0 H SER A 3 -11.314 -32.385 4.703 1.00 0.00 H new ATOM 0 HA SER A 3 -11.552 -29.588 5.068 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.358 -31.435 4.686 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.254 -31.713 6.413 1.00 0.00 H new ATOM 0 HG SER A 3 -14.894 -30.166 5.869 1.00 0.00 H new ATOM 30 N GLY A 4 -10.632 -29.100 7.302 1.00 0.00 N ATOM 31 CA GLY A 4 -10.133 -28.776 8.625 1.00 0.00 C ATOM 32 C GLY A 4 -11.198 -28.160 9.511 1.00 0.00 C ATOM 33 O GLY A 4 -11.832 -27.174 9.136 1.00 0.00 O ATOM 0 H GLY A 4 -10.552 -28.348 6.618 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.750 -29.681 9.097 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.295 -28.085 8.535 1.00 0.00 H new ATOM 37 N SER A 5 -11.397 -28.744 10.689 1.00 0.00 N ATOM 38 CA SER A 5 -12.396 -28.249 11.628 1.00 0.00 C ATOM 39 C SER A 5 -11.979 -28.536 13.067 1.00 0.00 C ATOM 40 O SER A 5 -11.160 -29.419 13.323 1.00 0.00 O ATOM 41 CB SER A 5 -13.756 -28.890 11.342 1.00 0.00 C ATOM 42 OG SER A 5 -13.712 -30.292 11.544 1.00 0.00 O ATOM 0 H SER A 5 -10.879 -29.560 11.015 1.00 0.00 H new ATOM 0 HA SER A 5 -12.476 -27.170 11.500 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.513 -28.450 11.991 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.053 -28.677 10.315 1.00 0.00 H new ATOM 0 HG SER A 5 -14.593 -30.677 11.356 1.00 0.00 H new ATOM 48 N SER A 6 -12.547 -27.783 14.003 1.00 0.00 N ATOM 49 CA SER A 6 -12.232 -27.953 15.417 1.00 0.00 C ATOM 50 C SER A 6 -10.734 -28.159 15.618 1.00 0.00 C ATOM 51 O SER A 6 -10.313 -28.981 16.430 1.00 0.00 O ATOM 52 CB SER A 6 -13.004 -29.141 15.994 1.00 0.00 C ATOM 53 OG SER A 6 -13.094 -29.053 17.406 1.00 0.00 O ATOM 0 H SER A 6 -13.228 -27.049 13.808 1.00 0.00 H new ATOM 0 HA SER A 6 -12.530 -27.046 15.942 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.005 -29.172 15.564 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.508 -30.071 15.715 1.00 0.00 H new ATOM 0 HG SER A 6 -12.197 -28.937 17.784 1.00 0.00 H new ATOM 59 N GLY A 7 -9.933 -27.405 14.871 1.00 0.00 N ATOM 60 CA GLY A 7 -8.491 -27.519 14.981 1.00 0.00 C ATOM 61 C GLY A 7 -7.854 -26.277 15.574 1.00 0.00 C ATOM 62 O GLY A 7 -8.526 -25.285 15.858 1.00 0.00 O ATOM 0 H GLY A 7 -10.258 -26.717 14.191 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.244 -28.381 15.601 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.068 -27.704 13.994 1.00 0.00 H new ATOM 66 N PRO A 8 -6.528 -26.323 15.770 1.00 0.00 N ATOM 67 CA PRO A 8 -5.772 -25.202 16.335 1.00 0.00 C ATOM 68 C PRO A 8 -5.688 -24.018 15.378 1.00 0.00 C ATOM 69 O PRO A 8 -5.722 -24.172 14.157 1.00 0.00 O ATOM 70 CB PRO A 8 -4.382 -25.796 16.574 1.00 0.00 C ATOM 71 CG PRO A 8 -4.276 -26.916 15.597 1.00 0.00 C ATOM 72 CD PRO A 8 -5.665 -27.474 15.454 1.00 0.00 C ATOM 0 HA PRO A 8 -6.242 -24.806 17.235 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.601 -25.053 16.411 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -4.275 -26.153 17.598 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.897 -26.563 14.638 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -3.584 -27.679 15.952 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.846 -27.848 14.446 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.837 -28.305 16.138 1.00 0.00 H new ATOM 80 N PRO A 9 -5.576 -22.806 15.942 1.00 0.00 N ATOM 81 CA PRO A 9 -5.484 -21.573 15.156 1.00 0.00 C ATOM 82 C PRO A 9 -4.158 -21.457 14.411 1.00 0.00 C ATOM 83 O PRO A 9 -3.079 -21.531 15.000 1.00 0.00 O ATOM 84 CB PRO A 9 -5.602 -20.470 16.211 1.00 0.00 C ATOM 85 CG PRO A 9 -5.126 -21.102 17.474 1.00 0.00 C ATOM 86 CD PRO A 9 -5.529 -22.548 17.391 1.00 0.00 C ATOM 0 HA PRO A 9 -6.250 -21.526 14.382 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.995 -19.604 15.948 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.630 -20.121 16.306 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -4.045 -21.003 17.577 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.574 -20.621 18.344 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.809 -23.195 17.891 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -6.496 -22.723 17.862 1.00 0.00 H new ATOM 94 N PRO A 10 -4.237 -21.271 13.085 1.00 0.00 N ATOM 95 CA PRO A 10 -3.052 -21.140 12.232 1.00 0.00 C ATOM 96 C PRO A 10 -2.308 -19.831 12.470 1.00 0.00 C ATOM 97 O PRO A 10 -2.642 -19.072 13.380 1.00 0.00 O ATOM 98 CB PRO A 10 -3.630 -21.177 10.815 1.00 0.00 C ATOM 99 CG PRO A 10 -5.033 -20.698 10.965 1.00 0.00 C ATOM 100 CD PRO A 10 -5.489 -21.173 12.317 1.00 0.00 C ATOM 0 HA PRO A 10 -2.319 -21.922 12.429 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.063 -20.536 10.139 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -3.598 -22.185 10.401 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -5.084 -19.611 10.895 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -5.669 -21.099 10.175 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -6.187 -20.472 12.775 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -5.998 -22.135 12.254 1.00 0.00 H new ATOM 108 N ALA A 11 -1.297 -19.572 11.647 1.00 0.00 N ATOM 109 CA ALA A 11 -0.507 -18.353 11.767 1.00 0.00 C ATOM 110 C ALA A 11 -0.520 -17.560 10.465 1.00 0.00 C ATOM 111 O ALA A 11 0.232 -17.839 9.532 1.00 0.00 O ATOM 112 CB ALA A 11 0.922 -18.687 12.169 1.00 0.00 C ATOM 0 H ALA A 11 -1.006 -20.190 10.890 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.956 -17.734 12.544 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.500 -17.767 12.255 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.919 -19.204 13.128 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.372 -19.329 11.412 1.00 0.00 H new ATOM 118 N PRO A 12 -1.396 -16.546 10.397 1.00 0.00 N ATOM 119 CA PRO A 12 -1.528 -15.691 9.214 1.00 0.00 C ATOM 120 C PRO A 12 -0.317 -14.787 9.013 1.00 0.00 C ATOM 121 O PRO A 12 0.700 -14.937 9.691 1.00 0.00 O ATOM 122 CB PRO A 12 -2.775 -14.856 9.517 1.00 0.00 C ATOM 123 CG PRO A 12 -2.862 -14.832 11.004 1.00 0.00 C ATOM 124 CD PRO A 12 -2.324 -16.155 11.472 1.00 0.00 C ATOM 0 HA PRO A 12 -1.602 -16.274 8.296 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -2.686 -13.849 9.109 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -3.667 -15.301 9.075 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.281 -14.007 11.416 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -3.892 -14.691 11.332 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.813 -16.065 12.431 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.119 -16.889 11.603 1.00 0.00 H new ATOM 132 N ILE A 13 -0.433 -13.850 8.079 1.00 0.00 N ATOM 133 CA ILE A 13 0.653 -12.921 7.791 1.00 0.00 C ATOM 134 C ILE A 13 0.499 -11.631 8.589 1.00 0.00 C ATOM 135 O ILE A 13 -0.472 -10.889 8.436 1.00 0.00 O ATOM 136 CB ILE A 13 0.718 -12.578 6.291 1.00 0.00 C ATOM 137 CG1 ILE A 13 0.991 -13.840 5.469 1.00 0.00 C ATOM 138 CG2 ILE A 13 1.790 -11.530 6.033 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.529 -13.736 4.032 1.00 0.00 C ATOM 0 H ILE A 13 -1.268 -13.714 7.509 1.00 0.00 H new ATOM 0 HA ILE A 13 1.578 -13.418 8.082 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.244 -12.168 5.985 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.061 -14.050 5.484 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.494 -14.687 5.942 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.824 -11.298 4.968 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.557 -10.625 6.594 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.759 -11.915 6.351 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.754 -14.666 3.509 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.546 -13.557 4.007 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.045 -12.910 3.543 1.00 0.00 H new ATOM 151 N PRO A 14 1.479 -11.353 9.461 1.00 0.00 N ATOM 152 CA PRO A 14 1.477 -10.151 10.299 1.00 0.00 C ATOM 153 C PRO A 14 1.704 -8.879 9.489 1.00 0.00 C ATOM 154 O PRO A 14 1.928 -8.934 8.280 1.00 0.00 O ATOM 155 CB PRO A 14 2.643 -10.387 11.262 1.00 0.00 C ATOM 156 CG PRO A 14 3.554 -11.314 10.534 1.00 0.00 C ATOM 157 CD PRO A 14 2.667 -12.192 9.696 1.00 0.00 C ATOM 0 HA PRO A 14 0.519 -10.003 10.797 1.00 0.00 H new ATOM 0 HB2 PRO A 14 3.146 -9.453 11.511 1.00 0.00 H new ATOM 0 HB3 PRO A 14 2.300 -10.824 12.200 1.00 0.00 H new ATOM 0 HG2 PRO A 14 4.257 -10.761 9.911 1.00 0.00 H new ATOM 0 HG3 PRO A 14 4.145 -11.908 11.231 1.00 0.00 H new ATOM 0 HD2 PRO A 14 3.150 -12.475 8.761 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.410 -13.116 10.215 1.00 0.00 H new ATOM 165 N ASP A 15 1.646 -7.736 10.163 1.00 0.00 N ATOM 166 CA ASP A 15 1.847 -6.450 9.505 1.00 0.00 C ATOM 167 C ASP A 15 3.332 -6.176 9.289 1.00 0.00 C ATOM 168 O ASP A 15 4.188 -6.806 9.913 1.00 0.00 O ATOM 169 CB ASP A 15 1.225 -5.326 10.335 1.00 0.00 C ATOM 170 CG ASP A 15 1.578 -3.950 9.804 1.00 0.00 C ATOM 171 OD1 ASP A 15 1.252 -3.664 8.633 1.00 0.00 O ATOM 172 OD2 ASP A 15 2.179 -3.159 10.560 1.00 0.00 O ATOM 0 H ASP A 15 1.462 -7.673 11.164 1.00 0.00 H new ATOM 0 HA ASP A 15 1.357 -6.487 8.532 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.141 -5.442 10.344 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.563 -5.411 11.368 1.00 0.00 H new ATOM 177 N LEU A 16 3.632 -5.235 8.401 1.00 0.00 N ATOM 178 CA LEU A 16 5.015 -4.879 8.101 1.00 0.00 C ATOM 179 C LEU A 16 5.140 -3.389 7.802 1.00 0.00 C ATOM 180 O LEU A 16 4.529 -2.879 6.861 1.00 0.00 O ATOM 181 CB LEU A 16 5.526 -5.695 6.912 1.00 0.00 C ATOM 182 CG LEU A 16 7.043 -5.727 6.723 1.00 0.00 C ATOM 183 CD1 LEU A 16 7.464 -7.000 6.007 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.510 -4.500 5.953 1.00 0.00 C ATOM 0 H LEU A 16 2.937 -4.705 7.876 1.00 0.00 H new ATOM 0 HA LEU A 16 5.622 -5.107 8.977 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.172 -6.720 7.021 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.075 -5.297 6.003 1.00 0.00 H new ATOM 0 HG LEU A 16 7.513 -5.715 7.706 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.547 -7.006 5.881 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.163 -7.866 6.597 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.985 -7.043 5.029 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.592 -4.539 5.828 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.032 -4.481 4.974 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.241 -3.600 6.505 1.00 0.00 H new ATOM 196 N LYS A 17 5.938 -2.694 8.606 1.00 0.00 N ATOM 197 CA LYS A 17 6.147 -1.262 8.426 1.00 0.00 C ATOM 198 C LYS A 17 7.045 -0.991 7.223 1.00 0.00 C ATOM 199 O LYS A 17 8.111 -1.592 7.083 1.00 0.00 O ATOM 200 CB LYS A 17 6.767 -0.654 9.686 1.00 0.00 C ATOM 201 CG LYS A 17 6.625 0.856 9.767 1.00 0.00 C ATOM 202 CD LYS A 17 6.830 1.361 11.185 1.00 0.00 C ATOM 203 CE LYS A 17 8.275 1.197 11.631 1.00 0.00 C ATOM 204 NZ LYS A 17 8.494 1.725 13.006 1.00 0.00 N ATOM 0 H LYS A 17 6.451 -3.100 9.389 1.00 0.00 H new ATOM 0 HA LYS A 17 5.177 -0.798 8.246 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.300 -1.102 10.563 1.00 0.00 H new ATOM 0 HB3 LYS A 17 7.825 -0.913 9.721 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.351 1.327 9.104 1.00 0.00 H new ATOM 0 HG3 LYS A 17 5.636 1.149 9.415 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.547 2.412 11.243 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.174 0.817 11.865 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.547 0.142 11.599 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.932 1.717 10.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.422 2.191 13.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.749 2.413 13.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.464 0.940 13.688 1.00 0.00 H new ATOM 218 N VAL A 18 6.609 -0.081 6.358 1.00 0.00 N ATOM 219 CA VAL A 18 7.375 0.272 5.169 1.00 0.00 C ATOM 220 C VAL A 18 7.863 1.715 5.237 1.00 0.00 C ATOM 221 O VAL A 18 8.837 2.085 4.580 1.00 0.00 O ATOM 222 CB VAL A 18 6.541 0.084 3.888 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.746 -1.210 3.953 1.00 0.00 C ATOM 224 CG2 VAL A 18 5.620 1.276 3.673 1.00 0.00 C ATOM 0 H VAL A 18 5.729 0.425 6.458 1.00 0.00 H new ATOM 0 HA VAL A 18 8.234 -0.398 5.136 1.00 0.00 H new ATOM 0 HB VAL A 18 7.221 0.021 3.038 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.163 -1.325 3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.430 -2.052 4.056 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.074 -1.181 4.811 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.038 1.127 2.764 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.945 1.373 4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.216 2.184 3.578 1.00 0.00 H new ATOM 234 N PHE A 19 7.180 2.527 6.037 1.00 0.00 N ATOM 235 CA PHE A 19 7.543 3.931 6.192 1.00 0.00 C ATOM 236 C PHE A 19 7.182 4.436 7.586 1.00 0.00 C ATOM 237 O PHE A 19 6.072 4.215 8.068 1.00 0.00 O ATOM 238 CB PHE A 19 6.841 4.782 5.132 1.00 0.00 C ATOM 239 CG PHE A 19 7.040 6.258 5.319 1.00 0.00 C ATOM 240 CD1 PHE A 19 6.454 6.919 6.387 1.00 0.00 C ATOM 241 CD2 PHE A 19 7.813 6.986 4.429 1.00 0.00 C ATOM 242 CE1 PHE A 19 6.634 8.279 6.561 1.00 0.00 C ATOM 243 CE2 PHE A 19 7.998 8.345 4.598 1.00 0.00 C ATOM 244 CZ PHE A 19 7.408 8.992 5.667 1.00 0.00 C ATOM 0 H PHE A 19 6.372 2.237 6.588 1.00 0.00 H new ATOM 0 HA PHE A 19 8.622 4.017 6.061 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.209 4.496 4.146 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.773 4.562 5.150 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.850 6.366 7.091 1.00 0.00 H new ATOM 0 HD2 PHE A 19 8.277 6.485 3.592 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.170 8.783 7.396 1.00 0.00 H new ATOM 0 HE2 PHE A 19 8.602 8.900 3.896 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.552 10.054 5.803 1.00 0.00 H new ATOM 254 N GLU A 20 8.129 5.114 8.227 1.00 0.00 N ATOM 255 CA GLU A 20 7.911 5.649 9.566 1.00 0.00 C ATOM 256 C GLU A 20 8.536 7.034 9.707 1.00 0.00 C ATOM 257 O GLU A 20 9.754 7.189 9.618 1.00 0.00 O ATOM 258 CB GLU A 20 8.496 4.704 10.618 1.00 0.00 C ATOM 259 CG GLU A 20 8.284 5.178 12.046 1.00 0.00 C ATOM 260 CD GLU A 20 9.127 6.391 12.389 1.00 0.00 C ATOM 261 OE1 GLU A 20 10.369 6.265 12.407 1.00 0.00 O ATOM 262 OE2 GLU A 20 8.544 7.466 12.640 1.00 0.00 O ATOM 0 H GLU A 20 9.054 5.306 7.841 1.00 0.00 H new ATOM 0 HA GLU A 20 6.836 5.737 9.724 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.045 3.719 10.500 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.565 4.589 10.437 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.231 5.419 12.192 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.524 4.367 12.734 1.00 0.00 H new ATOM 269 N ARG A 21 7.692 8.037 9.928 1.00 0.00 N ATOM 270 CA ARG A 21 8.161 9.409 10.079 1.00 0.00 C ATOM 271 C ARG A 21 7.429 10.111 11.220 1.00 0.00 C ATOM 272 O ARG A 21 6.199 10.122 11.266 1.00 0.00 O ATOM 273 CB ARG A 21 7.960 10.186 8.777 1.00 0.00 C ATOM 274 CG ARG A 21 8.515 11.600 8.819 1.00 0.00 C ATOM 275 CD ARG A 21 8.935 12.076 7.437 1.00 0.00 C ATOM 276 NE ARG A 21 9.219 13.508 7.414 1.00 0.00 N ATOM 277 CZ ARG A 21 9.310 14.221 6.297 1.00 0.00 C ATOM 278 NH1 ARG A 21 9.140 13.638 5.119 1.00 0.00 N ATOM 279 NH2 ARG A 21 9.571 15.521 6.357 1.00 0.00 N ATOM 0 H ARG A 21 6.681 7.925 10.006 1.00 0.00 H new ATOM 0 HA ARG A 21 9.225 9.379 10.316 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.437 9.642 7.962 1.00 0.00 H new ATOM 0 HB3 ARG A 21 6.895 10.230 8.551 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.762 12.276 9.224 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.371 11.636 9.493 1.00 0.00 H new ATOM 0 HD2 ARG A 21 9.820 11.526 7.118 1.00 0.00 H new ATOM 0 HD3 ARG A 21 8.145 11.852 6.721 1.00 0.00 H new ATOM 0 HE ARG A 21 9.355 13.987 8.304 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.939 12.639 5.069 1.00 0.00 H new ATOM 0 HH12 ARG A 21 9.210 14.188 4.263 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.702 15.974 7.262 1.00 0.00 H new ATOM 0 HH22 ARG A 21 9.641 16.067 5.498 1.00 0.00 H new ATOM 293 N GLU A 22 8.194 10.694 12.138 1.00 0.00 N ATOM 294 CA GLU A 22 7.617 11.395 13.278 1.00 0.00 C ATOM 295 C GLU A 22 6.312 12.084 12.891 1.00 0.00 C ATOM 296 O GLU A 22 6.314 13.092 12.185 1.00 0.00 O ATOM 297 CB GLU A 22 8.607 12.426 13.825 1.00 0.00 C ATOM 298 CG GLU A 22 8.871 13.581 12.873 1.00 0.00 C ATOM 299 CD GLU A 22 10.147 14.331 13.205 1.00 0.00 C ATOM 300 OE1 GLU A 22 10.079 15.292 14.000 1.00 0.00 O ATOM 301 OE2 GLU A 22 11.212 13.958 12.671 1.00 0.00 O ATOM 0 H GLU A 22 9.214 10.694 12.114 1.00 0.00 H new ATOM 0 HA GLU A 22 7.403 10.659 14.053 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.224 12.822 14.766 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.550 11.928 14.049 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.933 13.200 11.854 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.029 14.272 12.904 1.00 0.00 H new ATOM 308 N GLY A 23 5.196 11.530 13.357 1.00 0.00 N ATOM 309 CA GLY A 23 3.899 12.102 13.048 1.00 0.00 C ATOM 310 C GLY A 23 3.116 11.264 12.057 1.00 0.00 C ATOM 311 O GLY A 23 1.961 10.916 12.304 1.00 0.00 O ATOM 0 H GLY A 23 5.168 10.695 13.943 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.323 12.205 13.967 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.035 13.105 12.643 1.00 0.00 H new ATOM 315 N VAL A 24 3.745 10.939 10.932 1.00 0.00 N ATOM 316 CA VAL A 24 3.100 10.137 9.900 1.00 0.00 C ATOM 317 C VAL A 24 3.778 8.779 9.755 1.00 0.00 C ATOM 318 O VAL A 24 5.005 8.688 9.729 1.00 0.00 O ATOM 319 CB VAL A 24 3.117 10.855 8.538 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.391 10.027 7.488 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.498 12.240 8.658 1.00 0.00 C ATOM 0 H VAL A 24 4.701 11.219 10.712 1.00 0.00 H new ATOM 0 HA VAL A 24 2.066 9.992 10.213 1.00 0.00 H new ATOM 0 HB VAL A 24 4.154 10.971 8.221 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.413 10.551 6.532 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.883 9.060 7.384 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.356 9.877 7.795 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.518 12.733 7.686 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.466 12.149 8.997 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.066 12.831 9.377 1.00 0.00 H new ATOM 331 N GLN A 25 2.971 7.727 9.660 1.00 0.00 N ATOM 332 CA GLN A 25 3.494 6.374 9.518 1.00 0.00 C ATOM 333 C GLN A 25 2.696 5.588 8.482 1.00 0.00 C ATOM 334 O GLN A 25 1.580 5.966 8.125 1.00 0.00 O ATOM 335 CB GLN A 25 3.461 5.647 10.863 1.00 0.00 C ATOM 336 CG GLN A 25 4.509 6.141 11.848 1.00 0.00 C ATOM 337 CD GLN A 25 4.029 7.323 12.667 1.00 0.00 C ATOM 338 OE1 GLN A 25 3.007 7.935 12.355 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.766 7.651 13.721 1.00 0.00 N ATOM 0 H GLN A 25 1.953 7.786 9.679 1.00 0.00 H new ATOM 0 HA GLN A 25 4.527 6.445 9.177 1.00 0.00 H new ATOM 0 HB2 GLN A 25 2.473 5.766 11.307 1.00 0.00 H new ATOM 0 HB3 GLN A 25 3.608 4.580 10.694 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.784 5.327 12.519 1.00 0.00 H new ATOM 0 HG3 GLN A 25 5.410 6.423 11.303 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.606 7.116 13.943 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.493 8.438 14.309 1.00 0.00 H new ATOM 348 N LEU A 26 3.276 4.493 8.003 1.00 0.00 N ATOM 349 CA LEU A 26 2.619 3.653 7.007 1.00 0.00 C ATOM 350 C LEU A 26 2.830 2.175 7.318 1.00 0.00 C ATOM 351 O LEU A 26 3.931 1.755 7.669 1.00 0.00 O ATOM 352 CB LEU A 26 3.152 3.973 5.609 1.00 0.00 C ATOM 353 CG LEU A 26 2.212 3.661 4.445 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.949 4.503 4.538 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.914 3.895 3.115 1.00 0.00 C ATOM 0 H LEU A 26 4.199 4.166 8.288 1.00 0.00 H new ATOM 0 HA LEU A 26 1.550 3.863 7.038 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.404 5.033 5.572 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.079 3.419 5.460 1.00 0.00 H new ATOM 0 HG LEU A 26 1.929 2.610 4.504 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.292 4.267 3.701 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.435 4.286 5.475 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.213 5.560 4.505 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.230 3.668 2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.227 4.937 3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.789 3.248 3.046 1.00 0.00 H new ATOM 367 N ASN A 27 1.766 1.390 7.183 1.00 0.00 N ATOM 368 CA ASN A 27 1.834 -0.043 7.448 1.00 0.00 C ATOM 369 C ASN A 27 1.439 -0.844 6.211 1.00 0.00 C ATOM 370 O ASN A 27 0.837 -0.310 5.278 1.00 0.00 O ATOM 371 CB ASN A 27 0.922 -0.410 8.620 1.00 0.00 C ATOM 372 CG ASN A 27 1.319 0.292 9.904 1.00 0.00 C ATOM 373 OD1 ASN A 27 1.012 1.581 9.993 1.00 0.00 O flip ATOM 374 ND2 ASN A 27 1.896 -0.317 10.805 1.00 0.00 N flip ATOM 0 H ASN A 27 0.846 1.722 6.892 1.00 0.00 H new ATOM 0 HA ASN A 27 2.863 -0.291 7.706 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.107 -0.151 8.371 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.951 -1.489 8.775 1.00 0.00 H new ATOM 0 HD21 ASN A 27 2.112 -1.308 10.694 1.00 0.00 H new ATOM 0 HD22 ASN A 27 2.158 0.169 11.663 1.00 0.00 H new ATOM 381 N LEU A 28 1.781 -2.128 6.210 1.00 0.00 N ATOM 382 CA LEU A 28 1.461 -3.004 5.089 1.00 0.00 C ATOM 383 C LEU A 28 0.838 -4.308 5.577 1.00 0.00 C ATOM 384 O LEU A 28 1.386 -4.982 6.448 1.00 0.00 O ATOM 385 CB LEU A 28 2.721 -3.302 4.274 1.00 0.00 C ATOM 386 CG LEU A 28 2.507 -3.591 2.788 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.823 -3.957 2.120 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.485 -4.704 2.603 1.00 0.00 C ATOM 0 H LEU A 28 2.280 -2.585 6.973 1.00 0.00 H new ATOM 0 HA LEU A 28 0.737 -2.492 4.455 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.397 -2.452 4.364 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.224 -4.159 4.721 1.00 0.00 H new ATOM 0 HG LEU A 28 2.122 -2.688 2.314 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.651 -4.159 1.063 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.525 -3.129 2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.238 -4.845 2.596 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.345 -4.896 1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.842 -5.611 3.092 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.535 -4.403 3.045 1.00 0.00 H new ATOM 400 N SER A 29 -0.311 -4.657 5.007 1.00 0.00 N ATOM 401 CA SER A 29 -1.011 -5.880 5.385 1.00 0.00 C ATOM 402 C SER A 29 -1.317 -6.732 4.158 1.00 0.00 C ATOM 403 O SER A 29 -1.837 -6.237 3.157 1.00 0.00 O ATOM 404 CB SER A 29 -2.309 -5.543 6.122 1.00 0.00 C ATOM 405 OG SER A 29 -2.918 -6.711 6.642 1.00 0.00 O ATOM 0 H SER A 29 -0.777 -4.111 4.282 1.00 0.00 H new ATOM 0 HA SER A 29 -0.362 -6.450 6.049 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.100 -4.846 6.934 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.998 -5.042 5.442 1.00 0.00 H new ATOM 0 HG SER A 29 -3.744 -6.469 7.110 1.00 0.00 H new ATOM 411 N PHE A 30 -0.990 -8.018 4.242 1.00 0.00 N ATOM 412 CA PHE A 30 -1.229 -8.941 3.138 1.00 0.00 C ATOM 413 C PHE A 30 -2.372 -9.897 3.466 1.00 0.00 C ATOM 414 O PHE A 30 -2.548 -10.300 4.616 1.00 0.00 O ATOM 415 CB PHE A 30 0.041 -9.735 2.826 1.00 0.00 C ATOM 416 CG PHE A 30 1.271 -8.880 2.717 1.00 0.00 C ATOM 417 CD1 PHE A 30 1.979 -8.512 3.850 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.720 -8.444 1.480 1.00 0.00 C ATOM 419 CE1 PHE A 30 3.111 -7.725 3.752 1.00 0.00 C ATOM 420 CE2 PHE A 30 2.852 -7.657 1.377 1.00 0.00 C ATOM 421 CZ PHE A 30 3.548 -7.297 2.514 1.00 0.00 C ATOM 0 H PHE A 30 -0.559 -8.444 5.062 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.508 -8.356 2.262 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.195 -10.481 3.606 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.099 -10.277 1.891 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.642 -8.844 4.821 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.180 -8.722 0.587 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.653 -7.445 4.643 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.192 -7.324 0.408 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.432 -6.682 2.435 1.00 0.00 H new ATOM 431 N ILE A 31 -3.147 -10.254 2.447 1.00 0.00 N ATOM 432 CA ILE A 31 -4.273 -11.162 2.626 1.00 0.00 C ATOM 433 C ILE A 31 -4.318 -12.207 1.516 1.00 0.00 C ATOM 434 O ILE A 31 -4.142 -11.887 0.341 1.00 0.00 O ATOM 435 CB ILE A 31 -5.611 -10.401 2.653 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.777 -9.665 3.984 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.770 -11.359 2.424 1.00 0.00 C ATOM 438 CD1 ILE A 31 -5.175 -8.277 3.986 1.00 0.00 C ATOM 0 H ILE A 31 -3.016 -9.928 1.489 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.128 -11.659 3.585 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.609 -9.665 1.849 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.839 -9.592 4.220 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.314 -10.254 4.776 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.709 -10.806 2.446 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.656 -11.842 1.454 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.777 -12.116 3.208 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.330 -7.815 4.961 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.106 -8.344 3.782 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.654 -7.671 3.217 1.00 0.00 H new ATOM 450 N ARG A 32 -4.556 -13.458 1.898 1.00 0.00 N ATOM 451 CA ARG A 32 -4.625 -14.551 0.936 1.00 0.00 C ATOM 452 C ARG A 32 -5.920 -15.340 1.101 1.00 0.00 C ATOM 453 O ARG A 32 -6.042 -16.204 1.969 1.00 0.00 O ATOM 454 CB ARG A 32 -3.422 -15.482 1.102 1.00 0.00 C ATOM 455 CG ARG A 32 -2.112 -14.875 0.630 1.00 0.00 C ATOM 456 CD ARG A 32 -1.148 -15.943 0.138 1.00 0.00 C ATOM 457 NE ARG A 32 -0.739 -16.846 1.211 1.00 0.00 N ATOM 458 CZ ARG A 32 0.283 -17.690 1.112 1.00 0.00 C ATOM 459 NH1 ARG A 32 0.995 -17.745 -0.005 1.00 0.00 N ATOM 460 NH2 ARG A 32 0.594 -18.479 2.132 1.00 0.00 N ATOM 0 H ARG A 32 -4.704 -13.739 2.867 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.607 -14.122 -0.066 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.328 -15.756 2.153 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.607 -16.402 0.548 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.308 -14.163 -0.172 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.653 -14.317 1.446 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.619 -16.517 -0.660 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.266 -15.466 -0.291 1.00 0.00 H new ATOM 0 HE ARG A 32 -1.267 -16.828 2.084 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.759 -17.139 -0.791 1.00 0.00 H new ATOM 0 HH12 ARG A 32 1.779 -18.393 -0.079 1.00 0.00 H new ATOM 0 HH21 ARG A 32 0.049 -18.438 2.993 1.00 0.00 H new ATOM 0 HH22 ARG A 32 1.378 -19.126 2.055 1.00 0.00 H new ATOM 474 N PRO A 33 -6.911 -15.037 0.249 1.00 0.00 N ATOM 475 CA PRO A 33 -8.215 -15.706 0.281 1.00 0.00 C ATOM 476 C PRO A 33 -8.132 -17.158 -0.178 1.00 0.00 C ATOM 477 O PRO A 33 -7.299 -17.526 -1.006 1.00 0.00 O ATOM 478 CB PRO A 33 -9.060 -14.884 -0.695 1.00 0.00 C ATOM 479 CG PRO A 33 -8.072 -14.271 -1.626 1.00 0.00 C ATOM 480 CD PRO A 33 -6.835 -14.018 -0.811 1.00 0.00 C ATOM 0 HA PRO A 33 -8.626 -15.749 1.289 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.771 -15.513 -1.230 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.639 -14.122 -0.173 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.859 -14.937 -2.462 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.458 -13.343 -2.048 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.930 -14.127 -1.409 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.825 -13.009 -0.399 1.00 0.00 H new ATOM 488 N PRO A 34 -9.015 -18.005 0.372 1.00 0.00 N ATOM 489 CA PRO A 34 -9.063 -19.430 0.033 1.00 0.00 C ATOM 490 C PRO A 34 -9.566 -19.672 -1.386 1.00 0.00 C ATOM 491 O PRO A 34 -9.054 -20.536 -2.096 1.00 0.00 O ATOM 492 CB PRO A 34 -10.047 -20.005 1.055 1.00 0.00 C ATOM 493 CG PRO A 34 -10.914 -18.855 1.435 1.00 0.00 C ATOM 494 CD PRO A 34 -10.036 -17.635 1.367 1.00 0.00 C ATOM 0 HA PRO A 34 -8.075 -19.890 0.066 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.633 -20.818 0.626 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.525 -20.411 1.922 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.762 -18.764 0.756 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -11.321 -18.988 2.437 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.597 -16.753 1.058 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.590 -17.406 2.335 1.00 0.00 H new ATOM 502 N GLU A 35 -10.571 -18.902 -1.792 1.00 0.00 N ATOM 503 CA GLU A 35 -11.143 -19.034 -3.127 1.00 0.00 C ATOM 504 C GLU A 35 -10.081 -18.806 -4.199 1.00 0.00 C ATOM 505 O GLU A 35 -10.059 -19.490 -5.221 1.00 0.00 O ATOM 506 CB GLU A 35 -12.293 -18.042 -3.314 1.00 0.00 C ATOM 507 CG GLU A 35 -11.939 -16.618 -2.918 1.00 0.00 C ATOM 508 CD GLU A 35 -13.088 -15.652 -3.129 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.939 -15.536 -2.222 1.00 0.00 O ATOM 510 OE2 GLU A 35 -13.137 -15.011 -4.199 1.00 0.00 O ATOM 0 H GLU A 35 -11.005 -18.181 -1.216 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.527 -20.049 -3.231 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.605 -18.053 -4.358 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.147 -18.373 -2.723 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.641 -16.600 -1.870 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -11.079 -16.286 -3.499 1.00 0.00 H new ATOM 517 N ASN A 36 -9.201 -17.839 -3.956 1.00 0.00 N ATOM 518 CA ASN A 36 -8.137 -17.520 -4.900 1.00 0.00 C ATOM 519 C ASN A 36 -6.779 -17.508 -4.205 1.00 0.00 C ATOM 520 O ASN A 36 -6.348 -16.499 -3.646 1.00 0.00 O ATOM 521 CB ASN A 36 -8.399 -16.162 -5.555 1.00 0.00 C ATOM 522 CG ASN A 36 -7.680 -16.013 -6.883 1.00 0.00 C ATOM 523 OD1 ASN A 36 -6.647 -16.640 -7.116 1.00 0.00 O ATOM 524 ND2 ASN A 36 -8.226 -15.178 -7.760 1.00 0.00 N ATOM 0 H ASN A 36 -9.204 -17.264 -3.114 1.00 0.00 H new ATOM 0 HA ASN A 36 -8.125 -18.291 -5.670 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -9.471 -16.036 -5.709 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -8.079 -15.368 -4.880 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -7.788 -15.036 -8.670 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -9.084 -14.679 -7.524 1.00 0.00 H new ATOM 531 N PRO A 37 -6.086 -18.656 -4.240 1.00 0.00 N ATOM 532 CA PRO A 37 -4.766 -18.804 -3.619 1.00 0.00 C ATOM 533 C PRO A 37 -3.688 -18.017 -4.357 1.00 0.00 C ATOM 534 O PRO A 37 -2.674 -17.638 -3.772 1.00 0.00 O ATOM 535 CB PRO A 37 -4.494 -20.307 -3.718 1.00 0.00 C ATOM 536 CG PRO A 37 -5.308 -20.764 -4.879 1.00 0.00 C ATOM 537 CD PRO A 37 -6.538 -19.899 -4.888 1.00 0.00 C ATOM 0 HA PRO A 37 -4.749 -18.421 -2.599 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.434 -20.508 -3.874 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.785 -20.823 -2.803 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.752 -20.661 -5.811 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -5.572 -21.817 -4.780 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.894 -19.717 -5.902 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.359 -20.362 -4.340 1.00 0.00 H new ATOM 545 N ALA A 38 -3.914 -17.775 -5.644 1.00 0.00 N ATOM 546 CA ALA A 38 -2.963 -17.031 -6.460 1.00 0.00 C ATOM 547 C ALA A 38 -3.228 -15.531 -6.383 1.00 0.00 C ATOM 548 O ALA A 38 -2.512 -14.732 -6.988 1.00 0.00 O ATOM 549 CB ALA A 38 -3.022 -17.506 -7.904 1.00 0.00 C ATOM 0 H ALA A 38 -4.748 -18.084 -6.144 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.963 -17.217 -6.068 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.307 -16.942 -8.502 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.775 -18.567 -7.948 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -4.027 -17.350 -8.297 1.00 0.00 H new ATOM 555 N LEU A 39 -4.262 -15.156 -5.637 1.00 0.00 N ATOM 556 CA LEU A 39 -4.622 -13.751 -5.482 1.00 0.00 C ATOM 557 C LEU A 39 -4.006 -13.167 -4.215 1.00 0.00 C ATOM 558 O LEU A 39 -4.050 -13.784 -3.149 1.00 0.00 O ATOM 559 CB LEU A 39 -6.144 -13.596 -5.441 1.00 0.00 C ATOM 560 CG LEU A 39 -6.670 -12.165 -5.327 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.685 -11.492 -6.691 1.00 0.00 C ATOM 562 CD2 LEU A 39 -8.061 -12.156 -4.711 1.00 0.00 C ATOM 0 H LEU A 39 -4.865 -15.805 -5.131 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.230 -13.204 -6.339 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.559 -14.044 -6.344 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.525 -14.170 -4.596 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.002 -11.603 -4.674 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.062 -10.474 -6.590 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.673 -11.466 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.331 -12.053 -7.367 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.420 -11.129 -4.637 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.740 -12.734 -5.338 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.021 -12.599 -3.716 1.00 0.00 H new ATOM 574 N LEU A 40 -3.434 -11.975 -4.337 1.00 0.00 N ATOM 575 CA LEU A 40 -2.810 -11.305 -3.200 1.00 0.00 C ATOM 576 C LEU A 40 -3.447 -9.942 -2.954 1.00 0.00 C ATOM 577 O LEU A 40 -3.188 -8.983 -3.683 1.00 0.00 O ATOM 578 CB LEU A 40 -1.308 -11.143 -3.441 1.00 0.00 C ATOM 579 CG LEU A 40 -0.496 -10.593 -2.268 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.502 -11.575 -1.106 1.00 0.00 C ATOM 581 CD2 LEU A 40 0.930 -10.287 -2.703 1.00 0.00 C ATOM 0 H LEU A 40 -3.389 -11.452 -5.211 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.966 -11.922 -2.315 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.898 -12.114 -3.717 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.167 -10.482 -4.296 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.960 -9.665 -1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.081 -11.166 -0.281 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.528 -11.743 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.064 -12.520 -1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.493 -9.897 -1.855 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.404 -11.200 -3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.916 -9.545 -3.502 1.00 0.00 H new ATOM 593 N LEU A 41 -4.280 -9.862 -1.922 1.00 0.00 N ATOM 594 CA LEU A 41 -4.953 -8.614 -1.578 1.00 0.00 C ATOM 595 C LEU A 41 -4.131 -7.811 -0.575 1.00 0.00 C ATOM 596 O LEU A 41 -3.993 -8.202 0.584 1.00 0.00 O ATOM 597 CB LEU A 41 -6.341 -8.903 -1.002 1.00 0.00 C ATOM 598 CG LEU A 41 -7.227 -9.839 -1.825 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.346 -10.406 -0.965 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.798 -9.109 -3.032 1.00 0.00 C ATOM 0 H LEU A 41 -4.505 -10.646 -1.309 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.059 -8.024 -2.488 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.218 -9.333 -0.008 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.865 -7.956 -0.877 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.615 -10.667 -2.183 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.967 -11.070 -1.567 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.918 -10.965 -0.133 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.957 -9.590 -0.578 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.426 -9.791 -3.606 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.395 -8.262 -2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.982 -8.751 -3.660 1.00 0.00 H new ATOM 612 N ILE A 42 -3.590 -6.685 -1.029 1.00 0.00 N ATOM 613 CA ILE A 42 -2.785 -5.825 -0.170 1.00 0.00 C ATOM 614 C ILE A 42 -3.596 -4.635 0.332 1.00 0.00 C ATOM 615 O ILE A 42 -4.447 -4.103 -0.382 1.00 0.00 O ATOM 616 CB ILE A 42 -1.536 -5.306 -0.905 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.512 -6.431 -1.072 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.925 -4.135 -0.151 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.649 -6.063 -1.970 1.00 0.00 C ATOM 0 H ILE A 42 -3.694 -6.347 -1.986 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.471 -6.432 0.679 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.833 -4.960 -1.895 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.128 -6.710 -0.091 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -1.012 -7.309 -1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.043 -3.780 -0.684 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.655 -3.328 -0.079 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.639 -4.457 0.850 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.335 -6.907 -2.043 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.276 -5.812 -2.963 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.174 -5.204 -1.552 1.00 0.00 H new ATOM 631 N THR A 43 -3.326 -4.220 1.566 1.00 0.00 N ATOM 632 CA THR A 43 -4.030 -3.092 2.164 1.00 0.00 C ATOM 633 C THR A 43 -3.064 -2.168 2.898 1.00 0.00 C ATOM 634 O THR A 43 -2.158 -2.629 3.592 1.00 0.00 O ATOM 635 CB THR A 43 -5.117 -3.566 3.147 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.835 -4.671 2.588 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.084 -2.437 3.470 1.00 0.00 C ATOM 0 H THR A 43 -2.625 -4.648 2.171 1.00 0.00 H new ATOM 0 HA THR A 43 -4.502 -2.545 1.348 1.00 0.00 H new ATOM 0 HB THR A 43 -4.629 -3.880 4.070 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.523 -4.967 3.220 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.843 -2.796 4.166 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.538 -1.609 3.923 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.565 -2.096 2.553 1.00 0.00 H new ATOM 645 N ILE A 44 -3.265 -0.865 2.740 1.00 0.00 N ATOM 646 CA ILE A 44 -2.413 0.123 3.389 1.00 0.00 C ATOM 647 C ILE A 44 -3.134 0.790 4.556 1.00 0.00 C ATOM 648 O ILE A 44 -4.357 0.936 4.543 1.00 0.00 O ATOM 649 CB ILE A 44 -1.952 1.208 2.398 1.00 0.00 C ATOM 650 CG1 ILE A 44 -1.765 0.608 1.003 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.661 1.852 2.881 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.231 1.595 -0.012 1.00 0.00 C ATOM 0 H ILE A 44 -4.011 -0.469 2.168 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.539 -0.411 3.762 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.721 1.979 2.342 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.082 -0.239 1.069 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.721 0.220 0.652 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.348 2.617 2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.825 2.309 3.857 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.116 1.092 2.962 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.123 1.101 -0.978 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.925 2.431 -0.107 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.260 1.965 0.316 1.00 0.00 H new ATOM 664 N THR A 45 -2.369 1.195 5.564 1.00 0.00 N ATOM 665 CA THR A 45 -2.934 1.848 6.739 1.00 0.00 C ATOM 666 C THR A 45 -2.148 3.101 7.103 1.00 0.00 C ATOM 667 O THR A 45 -1.269 3.065 7.964 1.00 0.00 O ATOM 668 CB THR A 45 -2.958 0.899 7.952 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.927 -0.135 7.747 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.282 1.660 9.228 1.00 0.00 C ATOM 0 H THR A 45 -1.356 1.082 5.591 1.00 0.00 H new ATOM 0 HA THR A 45 -3.957 2.126 6.485 1.00 0.00 H new ATOM 0 HB THR A 45 -1.969 0.453 8.056 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.934 -0.735 8.522 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.293 0.969 10.071 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.525 2.426 9.397 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.260 2.131 9.132 1.00 0.00 H new ATOM 678 N ALA A 46 -2.469 4.209 6.443 1.00 0.00 N ATOM 679 CA ALA A 46 -1.794 5.475 6.701 1.00 0.00 C ATOM 680 C ALA A 46 -2.461 6.231 7.845 1.00 0.00 C ATOM 681 O ALA A 46 -3.594 6.698 7.718 1.00 0.00 O ATOM 682 CB ALA A 46 -1.775 6.329 5.442 1.00 0.00 C ATOM 0 H ALA A 46 -3.192 4.255 5.726 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.767 5.257 6.995 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.268 7.271 5.649 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.246 5.799 4.650 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.798 6.530 5.123 1.00 0.00 H new ATOM 688 N THR A 47 -1.753 6.347 8.964 1.00 0.00 N ATOM 689 CA THR A 47 -2.277 7.044 10.131 1.00 0.00 C ATOM 690 C THR A 47 -1.524 8.346 10.379 1.00 0.00 C ATOM 691 O THR A 47 -0.312 8.419 10.182 1.00 0.00 O ATOM 692 CB THR A 47 -2.193 6.167 11.394 1.00 0.00 C ATOM 693 OG1 THR A 47 -1.000 5.376 11.362 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.408 5.258 11.504 1.00 0.00 C ATOM 0 H THR A 47 -0.814 5.967 9.086 1.00 0.00 H new ATOM 0 HA THR A 47 -3.323 7.267 9.922 1.00 0.00 H new ATOM 0 HB THR A 47 -2.170 6.823 12.264 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.953 4.822 12.169 1.00 0.00 H new ATOM 0 HG21 THR A 47 -3.326 4.648 12.404 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.312 5.864 11.558 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.457 4.609 10.629 1.00 0.00 H new ATOM 702 N ASN A 48 -2.249 9.371 10.813 1.00 0.00 N ATOM 703 CA ASN A 48 -1.648 10.671 11.088 1.00 0.00 C ATOM 704 C ASN A 48 -2.019 11.157 12.486 1.00 0.00 C ATOM 705 O ASN A 48 -3.198 11.270 12.823 1.00 0.00 O ATOM 706 CB ASN A 48 -2.097 11.695 10.044 1.00 0.00 C ATOM 707 CG ASN A 48 -1.588 13.091 10.347 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.528 13.260 10.950 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.343 14.100 9.928 1.00 0.00 N ATOM 0 H ASN A 48 -3.254 9.327 10.982 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.565 10.561 11.036 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.741 11.387 9.061 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.186 11.710 9.999 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -2.051 15.062 10.102 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -3.214 13.913 9.432 1.00 0.00 H new ATOM 716 N PHE A 49 -1.005 11.445 13.295 1.00 0.00 N ATOM 717 CA PHE A 49 -1.224 11.919 14.657 1.00 0.00 C ATOM 718 C PHE A 49 -0.569 13.281 14.871 1.00 0.00 C ATOM 719 O PHE A 49 -0.605 13.833 15.970 1.00 0.00 O ATOM 720 CB PHE A 49 -0.672 10.911 15.666 1.00 0.00 C ATOM 721 CG PHE A 49 -1.263 9.537 15.525 1.00 0.00 C ATOM 722 CD1 PHE A 49 -2.620 9.330 15.712 1.00 0.00 C ATOM 723 CD2 PHE A 49 -0.461 8.453 15.207 1.00 0.00 C ATOM 724 CE1 PHE A 49 -3.167 8.067 15.584 1.00 0.00 C ATOM 725 CE2 PHE A 49 -1.002 7.187 15.077 1.00 0.00 C ATOM 726 CZ PHE A 49 -2.357 6.995 15.265 1.00 0.00 C ATOM 0 H PHE A 49 -0.023 11.359 13.031 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.298 12.024 14.810 1.00 0.00 H new ATOM 0 HB2 PHE A 49 0.410 10.846 15.548 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.862 11.278 16.675 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.258 10.165 15.961 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.599 8.598 15.059 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -4.226 7.919 15.733 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.366 6.350 14.829 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.782 6.008 15.163 1.00 0.00 H new ATOM 736 N SER A 50 0.029 13.816 13.811 1.00 0.00 N ATOM 737 CA SER A 50 0.697 15.110 13.883 1.00 0.00 C ATOM 738 C SER A 50 -0.315 16.232 14.100 1.00 0.00 C ATOM 739 O SER A 50 -1.520 15.991 14.157 1.00 0.00 O ATOM 740 CB SER A 50 1.495 15.368 12.603 1.00 0.00 C ATOM 741 OG SER A 50 0.641 15.433 11.474 1.00 0.00 O ATOM 0 H SER A 50 0.064 13.373 12.893 1.00 0.00 H new ATOM 0 HA SER A 50 1.381 15.092 14.731 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.049 16.302 12.698 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.229 14.575 12.462 1.00 0.00 H new ATOM 0 HG SER A 50 0.503 14.531 11.116 1.00 0.00 H new ATOM 747 N GLU A 51 0.187 17.457 14.219 1.00 0.00 N ATOM 748 CA GLU A 51 -0.673 18.616 14.430 1.00 0.00 C ATOM 749 C GLU A 51 -1.297 19.077 13.117 1.00 0.00 C ATOM 750 O GLU A 51 -2.407 19.607 13.096 1.00 0.00 O ATOM 751 CB GLU A 51 0.123 19.761 15.059 1.00 0.00 C ATOM 752 CG GLU A 51 0.591 19.472 16.476 1.00 0.00 C ATOM 753 CD GLU A 51 -0.459 19.808 17.517 1.00 0.00 C ATOM 754 OE1 GLU A 51 -1.059 20.899 17.422 1.00 0.00 O ATOM 755 OE2 GLU A 51 -0.680 18.981 18.426 1.00 0.00 O ATOM 0 H GLU A 51 1.183 17.673 14.173 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.474 18.323 15.109 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.991 19.974 14.435 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.493 20.660 15.065 1.00 0.00 H new ATOM 0 HG2 GLU A 51 0.856 18.418 16.559 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.496 20.045 16.680 1.00 0.00 H new ATOM 762 N GLY A 52 -0.573 18.872 12.020 1.00 0.00 N ATOM 763 CA GLY A 52 -1.071 19.272 10.717 1.00 0.00 C ATOM 764 C GLY A 52 -1.951 18.214 10.082 1.00 0.00 C ATOM 765 O GLY A 52 -1.624 17.027 10.111 1.00 0.00 O ATOM 0 H GLY A 52 0.349 18.436 12.011 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.637 20.198 10.817 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.228 19.482 10.058 1.00 0.00 H new ATOM 769 N ASP A 53 -3.069 18.643 9.507 1.00 0.00 N ATOM 770 CA ASP A 53 -3.999 17.723 8.862 1.00 0.00 C ATOM 771 C ASP A 53 -3.462 17.268 7.509 1.00 0.00 C ATOM 772 O ASP A 53 -2.883 18.057 6.762 1.00 0.00 O ATOM 773 CB ASP A 53 -5.366 18.386 8.687 1.00 0.00 C ATOM 774 CG ASP A 53 -5.259 19.879 8.448 1.00 0.00 C ATOM 775 OD1 ASP A 53 -5.163 20.633 9.438 1.00 0.00 O ATOM 776 OD2 ASP A 53 -5.272 20.294 7.270 1.00 0.00 O ATOM 0 H ASP A 53 -3.353 19.622 9.474 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.109 16.847 9.502 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.886 17.923 7.848 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.970 18.206 9.576 1.00 0.00 H new ATOM 781 N VAL A 54 -3.658 15.990 7.199 1.00 0.00 N ATOM 782 CA VAL A 54 -3.195 15.430 5.935 1.00 0.00 C ATOM 783 C VAL A 54 -4.362 15.162 4.992 1.00 0.00 C ATOM 784 O VAL A 54 -5.139 14.229 5.196 1.00 0.00 O ATOM 785 CB VAL A 54 -2.415 14.120 6.155 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.313 13.335 4.856 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.034 14.411 6.721 1.00 0.00 C ATOM 0 H VAL A 54 -4.134 15.323 7.806 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.531 16.169 5.485 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.958 13.511 6.878 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.759 12.413 5.031 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.314 13.095 4.497 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.793 13.934 4.108 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.497 13.474 6.870 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.480 15.040 6.024 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.133 14.928 7.675 1.00 0.00 H new ATOM 797 N THR A 55 -4.479 15.987 3.955 1.00 0.00 N ATOM 798 CA THR A 55 -5.551 15.840 2.979 1.00 0.00 C ATOM 799 C THR A 55 -4.993 15.599 1.582 1.00 0.00 C ATOM 800 O THR A 55 -3.782 15.473 1.399 1.00 0.00 O ATOM 801 CB THR A 55 -6.458 17.085 2.950 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.748 18.195 2.389 1.00 0.00 O ATOM 803 CG2 THR A 55 -6.938 17.438 4.350 1.00 0.00 C ATOM 0 H THR A 55 -3.844 16.764 3.770 1.00 0.00 H new ATOM 0 HA THR A 55 -6.141 14.976 3.285 1.00 0.00 H new ATOM 0 HB THR A 55 -7.327 16.860 2.332 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.332 18.982 2.372 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.577 18.320 4.304 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.503 16.602 4.762 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.079 17.645 4.988 1.00 0.00 H new ATOM 811 N HIS A 56 -5.884 15.536 0.597 1.00 0.00 N ATOM 812 CA HIS A 56 -5.479 15.311 -0.786 1.00 0.00 C ATOM 813 C HIS A 56 -4.318 14.323 -0.859 1.00 0.00 C ATOM 814 O HIS A 56 -3.363 14.526 -1.609 1.00 0.00 O ATOM 815 CB HIS A 56 -5.082 16.632 -1.445 1.00 0.00 C ATOM 816 CG HIS A 56 -5.232 16.627 -2.936 1.00 0.00 C ATOM 817 ND1 HIS A 56 -4.339 17.246 -3.784 1.00 0.00 N ATOM 818 CD2 HIS A 56 -6.179 16.072 -3.728 1.00 0.00 C ATOM 819 CE1 HIS A 56 -4.730 17.073 -5.034 1.00 0.00 C ATOM 820 NE2 HIS A 56 -5.844 16.364 -5.028 1.00 0.00 N ATOM 0 H HIS A 56 -6.890 15.638 0.731 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.328 14.887 -1.322 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.692 17.434 -1.029 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.046 16.857 -1.193 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.038 15.505 -3.399 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -4.224 17.448 -5.912 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -6.370 16.079 -5.854 1.00 0.00 H new ATOM 828 N PHE A 57 -4.407 13.255 -0.074 1.00 0.00 N ATOM 829 CA PHE A 57 -3.363 12.236 -0.049 1.00 0.00 C ATOM 830 C PHE A 57 -3.593 11.195 -1.140 1.00 0.00 C ATOM 831 O PHE A 57 -4.654 10.574 -1.207 1.00 0.00 O ATOM 832 CB PHE A 57 -3.319 11.556 1.321 1.00 0.00 C ATOM 833 CG PHE A 57 -2.623 10.225 1.307 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.358 10.096 0.758 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.235 9.103 1.842 1.00 0.00 C ATOM 836 CE1 PHE A 57 -0.714 8.872 0.744 1.00 0.00 C ATOM 837 CE2 PHE A 57 -2.597 7.877 1.831 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.335 7.761 1.280 1.00 0.00 C ATOM 0 H PHE A 57 -5.190 13.072 0.553 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.407 12.725 -0.235 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.814 12.214 2.028 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.338 11.421 1.683 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.869 10.961 0.336 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.222 9.187 2.273 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.273 8.785 0.315 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.084 7.010 2.253 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.835 6.804 1.269 1.00 0.00 H new ATOM 848 N ILE A 58 -2.590 11.009 -1.992 1.00 0.00 N ATOM 849 CA ILE A 58 -2.682 10.043 -3.079 1.00 0.00 C ATOM 850 C ILE A 58 -1.634 8.945 -2.929 1.00 0.00 C ATOM 851 O ILE A 58 -0.439 9.224 -2.828 1.00 0.00 O ATOM 852 CB ILE A 58 -2.507 10.720 -4.451 1.00 0.00 C ATOM 853 CG1 ILE A 58 -3.628 11.734 -4.691 1.00 0.00 C ATOM 854 CG2 ILE A 58 -2.482 9.677 -5.558 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.456 12.535 -5.962 1.00 0.00 C ATOM 0 H ILE A 58 -1.705 11.514 -1.950 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.677 9.602 -3.025 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.555 11.251 -4.458 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.581 11.207 -4.729 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.676 12.418 -3.844 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.358 10.172 -6.521 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.651 8.991 -5.393 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.419 9.120 -5.554 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.286 13.233 -6.067 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -2.519 13.090 -5.918 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.439 11.860 -6.818 1.00 0.00 H new ATOM 867 N CYS A 59 -2.090 7.697 -2.917 1.00 0.00 N ATOM 868 CA CYS A 59 -1.192 6.556 -2.780 1.00 0.00 C ATOM 869 C CYS A 59 -1.268 5.654 -4.008 1.00 0.00 C ATOM 870 O CYS A 59 -2.305 5.052 -4.283 1.00 0.00 O ATOM 871 CB CYS A 59 -1.536 5.757 -1.523 1.00 0.00 C ATOM 872 SG CYS A 59 -0.149 4.819 -0.842 1.00 0.00 S ATOM 0 H CYS A 59 -3.076 7.450 -3.000 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.174 6.935 -2.692 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -1.907 6.442 -0.760 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.348 5.068 -1.755 1.00 0.00 H new ATOM 0 HG CYS A 59 -0.473 4.352 0.327 1.00 0.00 H new ATOM 878 N GLN A 60 -0.163 5.568 -4.742 1.00 0.00 N ATOM 879 CA GLN A 60 -0.107 4.741 -5.942 1.00 0.00 C ATOM 880 C GLN A 60 0.937 3.639 -5.794 1.00 0.00 C ATOM 881 O GLN A 60 1.748 3.659 -4.869 1.00 0.00 O ATOM 882 CB GLN A 60 0.212 5.602 -7.165 1.00 0.00 C ATOM 883 CG GLN A 60 -0.370 7.004 -7.091 1.00 0.00 C ATOM 884 CD GLN A 60 0.110 7.896 -8.219 1.00 0.00 C ATOM 885 OE1 GLN A 60 1.215 7.724 -8.735 1.00 0.00 O ATOM 886 NE2 GLN A 60 -0.720 8.856 -8.610 1.00 0.00 N ATOM 0 H GLN A 60 0.704 6.060 -4.527 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.083 4.276 -6.079 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.294 5.672 -7.277 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -0.169 5.106 -8.058 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -1.458 6.943 -7.119 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.100 7.455 -6.136 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -1.627 8.963 -8.155 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -0.451 9.486 -9.366 1.00 0.00 H new ATOM 895 N ALA A 61 0.910 2.679 -6.713 1.00 0.00 N ATOM 896 CA ALA A 61 1.855 1.569 -6.686 1.00 0.00 C ATOM 897 C ALA A 61 2.113 1.034 -8.090 1.00 0.00 C ATOM 898 O ALA A 61 1.422 1.399 -9.041 1.00 0.00 O ATOM 899 CB ALA A 61 1.339 0.459 -5.783 1.00 0.00 C ATOM 0 H ALA A 61 0.244 2.648 -7.485 1.00 0.00 H new ATOM 0 HA ALA A 61 2.800 1.938 -6.287 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.054 -0.363 -5.772 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.212 0.843 -4.771 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.380 0.101 -6.158 1.00 0.00 H new ATOM 905 N ALA A 62 3.114 0.168 -8.214 1.00 0.00 N ATOM 906 CA ALA A 62 3.463 -0.418 -9.502 1.00 0.00 C ATOM 907 C ALA A 62 3.956 -1.851 -9.337 1.00 0.00 C ATOM 908 O ALA A 62 4.601 -2.186 -8.344 1.00 0.00 O ATOM 909 CB ALA A 62 4.518 0.429 -10.199 1.00 0.00 C ATOM 0 H ALA A 62 3.698 -0.143 -7.437 1.00 0.00 H new ATOM 0 HA ALA A 62 2.565 -0.439 -10.119 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.769 -0.021 -11.160 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.129 1.435 -10.359 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.412 0.480 -9.578 1.00 0.00 H new ATOM 915 N VAL A 63 3.648 -2.694 -10.318 1.00 0.00 N ATOM 916 CA VAL A 63 4.060 -4.092 -10.282 1.00 0.00 C ATOM 917 C VAL A 63 4.596 -4.542 -11.636 1.00 0.00 C ATOM 918 O VAL A 63 4.187 -4.050 -12.688 1.00 0.00 O ATOM 919 CB VAL A 63 2.894 -5.011 -9.872 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.239 -4.506 -8.595 1.00 0.00 C ATOM 921 CG2 VAL A 63 1.877 -5.115 -10.998 1.00 0.00 C ATOM 0 H VAL A 63 3.115 -2.433 -11.147 1.00 0.00 H new ATOM 0 HA VAL A 63 4.852 -4.169 -9.537 1.00 0.00 H new ATOM 0 HB VAL A 63 3.290 -6.008 -9.678 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.418 -5.168 -8.321 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.975 -4.489 -7.791 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.855 -3.499 -8.757 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.060 -5.768 -10.691 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.484 -4.124 -11.226 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.357 -5.527 -11.885 1.00 0.00 H new ATOM 931 N PRO A 64 5.533 -5.502 -11.613 1.00 0.00 N ATOM 932 CA PRO A 64 6.144 -6.041 -12.832 1.00 0.00 C ATOM 933 C PRO A 64 5.166 -6.879 -13.649 1.00 0.00 C ATOM 934 O PRO A 64 4.305 -7.563 -13.095 1.00 0.00 O ATOM 935 CB PRO A 64 7.283 -6.915 -12.301 1.00 0.00 C ATOM 936 CG PRO A 64 6.855 -7.300 -10.926 1.00 0.00 C ATOM 937 CD PRO A 64 6.067 -6.135 -10.396 1.00 0.00 C ATOM 0 HA PRO A 64 6.473 -5.251 -13.507 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.434 -7.793 -12.929 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.226 -6.369 -12.284 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.248 -8.205 -10.945 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.717 -7.508 -10.293 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.269 -6.460 -9.729 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.696 -5.449 -9.829 1.00 0.00 H new ATOM 945 N LYS A 65 5.305 -6.822 -14.969 1.00 0.00 N ATOM 946 CA LYS A 65 4.435 -7.577 -15.864 1.00 0.00 C ATOM 947 C LYS A 65 4.114 -8.949 -15.280 1.00 0.00 C ATOM 948 O LYS A 65 2.980 -9.420 -15.367 1.00 0.00 O ATOM 949 CB LYS A 65 5.095 -7.736 -17.235 1.00 0.00 C ATOM 950 CG LYS A 65 4.770 -6.609 -18.201 1.00 0.00 C ATOM 951 CD LYS A 65 5.777 -5.476 -18.095 1.00 0.00 C ATOM 952 CE LYS A 65 5.880 -4.698 -19.398 1.00 0.00 C ATOM 953 NZ LYS A 65 7.207 -4.039 -19.547 1.00 0.00 N ATOM 0 H LYS A 65 6.012 -6.261 -15.443 1.00 0.00 H new ATOM 0 HA LYS A 65 3.503 -7.023 -15.978 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.176 -7.791 -17.104 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.778 -8.682 -17.674 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.760 -6.994 -19.221 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.770 -6.228 -17.994 1.00 0.00 H new ATOM 0 HD2 LYS A 65 5.485 -4.802 -17.290 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.755 -5.880 -17.833 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.713 -5.372 -20.238 1.00 0.00 H new ATOM 0 HE3 LYS A 65 5.094 -3.944 -19.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.237 -3.519 -20.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.356 -3.376 -18.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.956 -4.761 -19.539 1.00 0.00 H new ATOM 967 N SER A 66 5.118 -9.584 -14.685 1.00 0.00 N ATOM 968 CA SER A 66 4.942 -10.903 -14.089 1.00 0.00 C ATOM 969 C SER A 66 3.680 -10.949 -13.234 1.00 0.00 C ATOM 970 O SER A 66 2.885 -11.886 -13.328 1.00 0.00 O ATOM 971 CB SER A 66 6.161 -11.269 -13.240 1.00 0.00 C ATOM 972 OG SER A 66 6.228 -12.667 -13.019 1.00 0.00 O ATOM 0 H SER A 66 6.062 -9.207 -14.603 1.00 0.00 H new ATOM 0 HA SER A 66 4.839 -11.628 -14.896 1.00 0.00 H new ATOM 0 HB2 SER A 66 7.070 -10.933 -13.739 1.00 0.00 H new ATOM 0 HB3 SER A 66 6.111 -10.749 -12.284 1.00 0.00 H new ATOM 0 HG SER A 66 7.017 -12.875 -12.476 1.00 0.00 H new ATOM 978 N LEU A 67 3.501 -9.931 -12.399 1.00 0.00 N ATOM 979 CA LEU A 67 2.335 -9.854 -11.526 1.00 0.00 C ATOM 980 C LEU A 67 1.339 -8.818 -12.038 1.00 0.00 C ATOM 981 O LEU A 67 1.680 -7.972 -12.865 1.00 0.00 O ATOM 982 CB LEU A 67 2.764 -9.504 -10.100 1.00 0.00 C ATOM 983 CG LEU A 67 4.026 -10.201 -9.588 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.750 -9.322 -8.581 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.678 -11.548 -8.971 1.00 0.00 C ATOM 0 H LEU A 67 4.148 -9.148 -12.308 1.00 0.00 H new ATOM 0 HA LEU A 67 1.848 -10.829 -11.524 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.920 -8.427 -10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.942 -9.743 -9.426 1.00 0.00 H new ATOM 0 HG LEU A 67 4.692 -10.373 -10.434 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.645 -9.834 -8.228 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.033 -8.382 -9.055 1.00 0.00 H new ATOM 0 HD13 LEU A 67 4.092 -9.118 -7.736 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.588 -12.030 -8.612 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.992 -11.400 -8.137 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.204 -12.181 -9.722 1.00 0.00 H new ATOM 997 N GLN A 68 0.110 -8.889 -11.538 1.00 0.00 N ATOM 998 CA GLN A 68 -0.935 -7.957 -11.945 1.00 0.00 C ATOM 999 C GLN A 68 -1.233 -6.956 -10.833 1.00 0.00 C ATOM 1000 O GLN A 68 -0.927 -7.200 -9.665 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.209 -8.716 -12.319 1.00 0.00 C ATOM 1002 CG GLN A 68 -3.043 -8.018 -13.381 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.512 -8.384 -13.304 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -5.189 -8.079 -12.321 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -5.014 -9.043 -14.342 1.00 0.00 N ATOM 0 H GLN A 68 -0.187 -9.582 -10.851 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.579 -7.409 -12.817 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.938 -9.710 -12.676 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.816 -8.853 -11.424 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -2.935 -6.939 -13.271 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.659 -8.278 -14.368 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -4.417 -9.275 -15.136 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.997 -9.317 -14.345 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.833 -5.830 -11.203 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.173 -4.791 -10.237 1.00 0.00 C ATOM 1016 C LEU A 69 -3.510 -4.143 -10.582 1.00 0.00 C ATOM 1017 O LEU A 69 -3.820 -3.926 -11.753 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.074 -3.728 -10.193 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.309 -2.559 -9.236 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -1.562 -3.067 -7.825 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.122 -1.606 -9.256 1.00 0.00 C ATOM 0 H LEU A 69 -2.094 -5.613 -12.165 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.259 -5.257 -9.255 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.137 -4.213 -9.919 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.943 -3.328 -11.198 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.193 -2.015 -9.569 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.727 -2.221 -7.158 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.443 -3.709 -7.822 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.697 -3.636 -7.483 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.307 -0.780 -8.569 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.778 -2.139 -8.949 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.014 -1.215 -10.264 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.295 -3.835 -9.555 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.598 -3.210 -9.751 1.00 0.00 C ATOM 1035 C GLN A 70 -5.887 -2.197 -8.648 1.00 0.00 C ATOM 1036 O GLN A 70 -6.043 -2.561 -7.481 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.697 -4.273 -9.784 1.00 0.00 C ATOM 1038 CG GLN A 70 -8.090 -3.702 -9.994 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.299 -3.175 -11.400 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -7.957 -3.837 -12.380 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -8.863 -1.977 -11.506 1.00 0.00 N ATOM 0 H GLN A 70 -4.052 -4.008 -8.580 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.581 -2.685 -10.706 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.480 -4.983 -10.582 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.679 -4.831 -8.848 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.830 -4.474 -9.786 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.260 -2.897 -9.279 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -9.131 -1.463 -10.666 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.028 -1.571 -12.427 1.00 0.00 H new ATOM 1050 N LEU A 71 -5.957 -0.925 -9.023 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.227 0.142 -8.066 1.00 0.00 C ATOM 1052 C LEU A 71 -7.718 0.232 -7.757 1.00 0.00 C ATOM 1053 O LEU A 71 -8.521 0.571 -8.625 1.00 0.00 O ATOM 1054 CB LEU A 71 -5.726 1.481 -8.609 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.520 2.590 -7.577 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.500 3.602 -8.076 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -6.841 3.274 -7.259 1.00 0.00 C ATOM 0 H LEU A 71 -5.830 -0.607 -9.984 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.696 -0.090 -7.143 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.780 1.311 -9.123 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.436 1.835 -9.357 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.136 2.141 -6.661 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.367 4.384 -7.328 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.548 3.102 -8.252 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.854 4.047 -9.006 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.675 4.061 -6.523 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.253 3.710 -8.169 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.542 2.542 -6.857 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.079 -0.073 -6.515 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.473 -0.025 -6.091 1.00 0.00 C ATOM 1071 C GLN A 72 -9.831 1.355 -5.551 1.00 0.00 C ATOM 1072 O GLN A 72 -8.951 2.158 -5.240 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.742 -1.089 -5.025 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.208 -1.213 -4.645 1.00 0.00 C ATOM 1075 CD GLN A 72 -12.089 -1.575 -5.825 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -12.806 -0.731 -6.363 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -12.038 -2.837 -6.236 1.00 0.00 N ATOM 0 H GLN A 72 -7.425 -0.356 -5.785 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.098 -0.227 -6.961 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.387 -2.053 -5.388 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.163 -0.852 -4.133 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.315 -1.972 -3.870 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.549 -0.270 -4.217 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.430 -3.504 -5.761 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -12.607 -3.139 -7.027 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.128 1.625 -5.441 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.601 2.907 -4.936 1.00 0.00 C ATOM 1088 C ALA A 73 -11.192 3.110 -3.481 1.00 0.00 C ATOM 1089 O ALA A 73 -11.371 2.235 -2.633 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.113 3.005 -5.079 1.00 0.00 C ATOM 0 H ALA A 73 -11.869 0.972 -5.695 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.138 3.696 -5.529 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.453 3.968 -4.698 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.386 2.914 -6.130 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.585 2.203 -4.511 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.628 4.290 -3.183 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.181 4.634 -1.830 1.00 0.00 C ATOM 1098 C PRO A 74 -11.346 4.838 -0.868 1.00 0.00 C ATOM 1099 O PRO A 74 -12.482 4.469 -1.168 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.418 5.946 -2.031 1.00 0.00 C ATOM 1101 CG PRO A 74 -10.005 6.539 -3.265 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.383 5.379 -4.143 1.00 0.00 C ATOM 0 HA PRO A 74 -9.581 3.840 -1.385 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.540 6.610 -1.176 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.349 5.769 -2.147 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.877 7.149 -3.028 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -9.287 7.189 -3.765 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -11.270 5.598 -4.738 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.585 5.127 -4.841 1.00 0.00 H new ATOM 1110 N SER A 75 -11.058 5.427 0.288 1.00 0.00 N ATOM 1111 CA SER A 75 -12.083 5.676 1.295 1.00 0.00 C ATOM 1112 C SER A 75 -12.239 7.172 1.553 1.00 0.00 C ATOM 1113 O SER A 75 -13.280 7.627 2.023 1.00 0.00 O ATOM 1114 CB SER A 75 -11.732 4.957 2.599 1.00 0.00 C ATOM 1115 OG SER A 75 -12.688 5.234 3.608 1.00 0.00 O ATOM 0 H SER A 75 -10.124 5.741 0.551 1.00 0.00 H new ATOM 0 HA SER A 75 -13.029 5.289 0.918 1.00 0.00 H new ATOM 0 HB2 SER A 75 -11.685 3.882 2.424 1.00 0.00 H new ATOM 0 HB3 SER A 75 -10.743 5.269 2.935 1.00 0.00 H new ATOM 0 HG SER A 75 -12.442 4.762 4.431 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.194 7.932 1.239 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.233 9.368 1.443 1.00 0.00 C ATOM 1123 C GLY A 76 -9.856 9.999 1.396 1.00 0.00 C ATOM 1124 O GLY A 76 -8.907 9.478 1.982 1.00 0.00 O ATOM 0 H GLY A 76 -10.321 7.578 0.847 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.864 9.823 0.679 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.695 9.582 2.407 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.745 11.123 0.696 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.472 11.825 0.573 1.00 0.00 C ATOM 1130 C ASN A 77 -8.290 12.825 1.711 1.00 0.00 C ATOM 1131 O ASN A 77 -7.809 13.939 1.502 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.392 12.547 -0.773 1.00 0.00 C ATOM 1133 CG ASN A 77 -8.522 11.596 -1.948 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -9.119 10.526 -1.832 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -7.961 11.984 -3.087 1.00 0.00 N ATOM 0 H ASN A 77 -10.521 11.568 0.205 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.672 11.087 0.630 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.181 13.297 -0.827 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.442 13.078 -0.842 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.015 11.386 -3.912 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.476 12.880 -3.137 1.00 0.00 H new ATOM 1142 N THR A 78 -8.677 12.418 2.916 1.00 0.00 N ATOM 1143 CA THR A 78 -8.557 13.278 4.087 1.00 0.00 C ATOM 1144 C THR A 78 -8.285 12.459 5.344 1.00 0.00 C ATOM 1145 O THR A 78 -8.950 11.455 5.599 1.00 0.00 O ATOM 1146 CB THR A 78 -9.830 14.117 4.301 1.00 0.00 C ATOM 1147 OG1 THR A 78 -9.965 15.079 3.248 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.790 14.830 5.644 1.00 0.00 C ATOM 0 H THR A 78 -9.076 11.499 3.106 1.00 0.00 H new ATOM 0 HA THR A 78 -7.717 13.947 3.903 1.00 0.00 H new ATOM 0 HB THR A 78 -10.688 13.444 4.291 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.778 15.608 3.390 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.700 15.416 5.772 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.717 14.094 6.445 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.924 15.492 5.679 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.303 12.895 6.128 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.945 12.204 7.360 1.00 0.00 C ATOM 1158 C VAL A 79 -6.872 13.174 8.534 1.00 0.00 C ATOM 1159 O VAL A 79 -6.270 14.245 8.450 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.593 11.478 7.224 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -5.282 10.686 8.484 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.596 10.572 6.002 1.00 0.00 C ATOM 0 H VAL A 79 -6.742 13.724 5.931 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.727 11.469 7.548 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.811 12.226 7.092 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.323 10.180 8.369 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.235 11.363 9.337 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -6.065 9.946 8.651 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.633 10.067 5.921 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.388 9.830 6.101 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.769 11.169 5.107 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.499 12.793 9.656 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.519 13.615 10.870 1.00 0.00 C ATOM 1174 C PRO A 80 -6.153 13.689 11.542 1.00 0.00 C ATOM 1175 O PRO A 80 -5.474 12.676 11.704 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.520 12.890 11.773 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.494 11.474 11.308 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.236 11.530 9.828 1.00 0.00 C ATOM 0 HA PRO A 80 -7.788 14.650 10.657 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.235 12.967 12.822 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.518 13.318 11.682 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.714 10.909 11.819 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.440 10.976 11.521 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.651 10.675 9.490 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.165 11.526 9.258 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.756 14.896 11.933 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.471 15.102 12.590 1.00 0.00 C ATOM 1188 C ALA A 81 -4.559 14.784 14.079 1.00 0.00 C ATOM 1189 O ALA A 81 -3.570 14.889 14.805 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.994 16.532 12.381 1.00 0.00 C ATOM 0 H ALA A 81 -6.306 15.746 11.806 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.748 14.421 12.141 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -3.033 16.671 12.877 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.883 16.726 11.314 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.723 17.224 12.802 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.748 14.397 14.528 1.00 0.00 N ATOM 1197 CA ARG A 82 -5.965 14.067 15.931 1.00 0.00 C ATOM 1198 C ARG A 82 -6.273 12.582 16.098 1.00 0.00 C ATOM 1199 O ARG A 82 -7.254 12.209 16.740 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.111 14.904 16.503 1.00 0.00 C ATOM 1201 CG ARG A 82 -6.859 16.401 16.446 1.00 0.00 C ATOM 1202 CD ARG A 82 -5.780 16.823 17.431 1.00 0.00 C ATOM 1203 NE ARG A 82 -6.336 17.167 18.737 1.00 0.00 N ATOM 1204 CZ ARG A 82 -5.640 17.123 19.868 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -4.367 16.752 19.852 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -6.216 17.451 21.017 1.00 0.00 N ATOM 0 H ARG A 82 -6.576 14.304 13.940 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.050 14.295 16.478 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.025 14.677 15.954 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.281 14.612 17.539 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.561 16.683 15.436 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.783 16.935 16.666 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.058 16.015 17.546 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.238 17.680 17.030 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.313 17.457 18.783 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.920 16.500 18.970 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.834 16.719 20.721 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.195 17.738 21.033 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.680 17.417 21.884 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.427 11.737 15.515 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.627 10.303 15.610 1.00 0.00 C ATOM 1222 C GLY A 83 -7.080 9.907 15.442 1.00 0.00 C ATOM 1223 O GLY A 83 -7.785 9.675 16.423 1.00 0.00 O ATOM 0 H GLY A 83 -4.607 12.021 14.979 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.028 9.805 14.848 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.268 9.953 16.578 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.531 9.831 14.193 1.00 0.00 N ATOM 1228 CA GLY A 84 -8.908 9.463 13.923 1.00 0.00 C ATOM 1229 C GLY A 84 -9.019 8.172 13.135 1.00 0.00 C ATOM 1230 O GLY A 84 -8.630 7.107 13.616 1.00 0.00 O ATOM 0 H GLY A 84 -6.967 10.018 13.364 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.444 9.357 14.866 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.394 10.266 13.369 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.552 8.265 11.922 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.715 7.095 11.066 1.00 0.00 C ATOM 1236 C LEU A 85 -8.811 7.187 9.841 1.00 0.00 C ATOM 1237 O LEU A 85 -8.981 8.048 8.976 1.00 0.00 O ATOM 1238 CB LEU A 85 -11.174 6.958 10.629 1.00 0.00 C ATOM 1239 CG LEU A 85 -12.224 7.167 11.720 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.465 8.651 11.953 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.524 6.466 11.351 1.00 0.00 C ATOM 0 H LEU A 85 -9.879 9.138 11.509 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.430 6.213 11.639 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.362 7.675 9.830 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.313 5.964 10.204 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.849 6.731 12.646 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.215 8.780 12.733 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.534 9.126 12.263 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.818 9.112 11.030 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -14.260 6.626 12.139 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.903 6.872 10.413 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.341 5.398 11.236 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.828 6.279 9.761 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.880 6.235 8.644 1.00 0.00 C ATOM 1255 C PRO A 86 -7.536 5.783 7.344 1.00 0.00 C ATOM 1256 O PRO A 86 -8.714 5.426 7.324 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.839 5.210 9.102 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.566 4.337 10.066 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.566 5.224 10.754 1.00 0.00 C ATOM 0 HA PRO A 86 -6.463 7.218 8.425 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.453 4.635 8.260 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.985 5.696 9.574 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -7.063 3.515 9.550 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.878 3.893 10.786 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.475 4.680 11.012 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -7.167 5.635 11.681 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.766 5.800 6.261 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.274 5.390 4.957 1.00 0.00 C ATOM 1269 C ILE A 87 -6.682 4.049 4.534 1.00 0.00 C ATOM 1270 O ILE A 87 -5.548 3.719 4.883 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.961 6.440 3.875 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.490 7.812 4.298 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.562 6.023 2.542 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.804 8.966 3.600 1.00 0.00 C ATOM 0 H ILE A 87 -5.789 6.093 6.260 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.355 5.293 5.056 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.879 6.508 3.758 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.560 7.859 4.094 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.366 7.924 5.375 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.332 6.776 1.788 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.142 5.064 2.238 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.643 5.930 2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.230 9.907 3.949 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.738 8.945 3.824 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.950 8.879 2.523 1.00 0.00 H new ATOM 1286 N THR A 88 -7.458 3.279 3.777 1.00 0.00 N ATOM 1287 CA THR A 88 -7.012 1.974 3.305 1.00 0.00 C ATOM 1288 C THR A 88 -7.424 1.744 1.855 1.00 0.00 C ATOM 1289 O THR A 88 -8.526 2.109 1.449 1.00 0.00 O ATOM 1290 CB THR A 88 -7.580 0.837 4.175 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.011 0.884 4.168 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.072 0.944 5.605 1.00 0.00 C ATOM 0 H THR A 88 -8.398 3.537 3.478 1.00 0.00 H new ATOM 0 HA THR A 88 -5.924 1.967 3.377 1.00 0.00 H new ATOM 0 HB THR A 88 -7.245 -0.112 3.757 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.365 0.157 4.722 1.00 0.00 H new ATOM 0 HG21 THR A 88 -7.487 0.130 6.200 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.984 0.880 5.610 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.381 1.899 6.030 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.530 1.137 1.081 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.802 0.858 -0.324 1.00 0.00 C ATOM 1302 C GLN A 89 -6.596 -0.621 -0.636 1.00 0.00 C ATOM 1303 O GLN A 89 -5.654 -1.244 -0.144 1.00 0.00 O ATOM 1304 CB GLN A 89 -5.901 1.711 -1.219 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.519 2.039 -2.569 1.00 0.00 C ATOM 1306 CD GLN A 89 -5.975 3.323 -3.163 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -4.773 3.586 -3.107 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -6.859 4.130 -3.738 1.00 0.00 N ATOM 0 H GLN A 89 -5.612 0.829 1.403 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.844 1.110 -0.523 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -5.664 2.641 -0.702 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -4.959 1.186 -1.378 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -6.333 1.216 -3.259 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.600 2.124 -2.459 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.846 3.872 -3.761 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -6.551 5.008 -4.156 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.481 -1.177 -1.455 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.396 -2.583 -1.833 1.00 0.00 C ATOM 1319 C LEU A 90 -6.647 -2.749 -3.151 1.00 0.00 C ATOM 1320 O LEU A 90 -6.769 -1.922 -4.055 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.797 -3.186 -1.950 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.924 -4.420 -2.844 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -8.366 -5.648 -2.141 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.377 -4.645 -3.240 1.00 0.00 C ATOM 0 H LEU A 90 -8.266 -0.676 -1.870 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.844 -3.110 -1.054 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.142 -3.449 -0.950 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.471 -2.417 -2.328 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.343 -4.249 -3.750 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.465 -6.516 -2.792 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.313 -5.487 -1.908 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.919 -5.822 -1.218 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.448 -5.527 -3.876 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.979 -4.794 -2.344 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.745 -3.775 -3.784 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.873 -3.824 -3.255 1.00 0.00 N ATOM 1337 CA PHE A 91 -5.104 -4.099 -4.464 1.00 0.00 C ATOM 1338 C PHE A 91 -5.135 -5.587 -4.801 1.00 0.00 C ATOM 1339 O PHE A 91 -4.783 -6.429 -3.975 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.657 -3.634 -4.290 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.535 -2.187 -3.905 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.573 -1.805 -2.574 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.381 -1.209 -4.874 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.461 -0.475 -2.217 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.268 0.123 -4.523 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.307 0.490 -3.193 1.00 0.00 C ATOM 0 H PHE A 91 -5.761 -4.519 -2.517 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.559 -3.548 -5.287 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.176 -4.247 -3.527 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.116 -3.801 -5.221 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.692 -2.556 -1.806 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.349 -1.491 -5.916 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.494 -0.190 -1.176 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.149 0.876 -5.288 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.217 1.530 -2.916 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.560 -5.902 -6.020 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.639 -7.288 -6.466 1.00 0.00 C ATOM 1358 C ARG A 92 -4.438 -7.648 -7.336 1.00 0.00 C ATOM 1359 O ARG A 92 -4.319 -7.184 -8.470 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.935 -7.522 -7.245 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.153 -7.717 -6.357 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.347 -8.220 -7.153 1.00 0.00 C ATOM 1363 NE ARG A 92 -10.396 -8.753 -6.287 1.00 0.00 N ATOM 1364 CZ ARG A 92 -11.307 -7.997 -5.684 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.298 -6.682 -5.852 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -12.229 -8.557 -4.912 1.00 0.00 N ATOM 0 H ARG A 92 -5.855 -5.217 -6.716 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.632 -7.929 -5.584 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.110 -6.673 -7.906 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.814 -8.400 -7.879 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.917 -8.427 -5.565 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.407 -6.774 -5.874 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.752 -7.405 -7.754 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.020 -8.995 -7.846 1.00 0.00 H new ATOM 0 HE ARG A 92 -10.431 -9.761 -6.137 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -10.591 -6.248 -6.445 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.999 -6.104 -5.388 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.239 -9.569 -4.781 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.928 -7.976 -4.449 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.551 -8.478 -6.796 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.360 -8.900 -7.522 1.00 0.00 C ATOM 1382 C ILE A 93 -2.381 -10.402 -7.785 1.00 0.00 C ATOM 1383 O ILE A 93 -2.944 -11.172 -7.006 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.075 -8.542 -6.753 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.930 -7.024 -6.636 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.140 -9.144 -7.443 1.00 0.00 C ATOM 1387 CD1 ILE A 93 0.018 -6.589 -5.541 1.00 0.00 C ATOM 0 H ILE A 93 -3.635 -8.871 -5.859 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.364 -8.367 -8.473 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.142 -8.960 -5.748 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.579 -6.626 -7.588 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.911 -6.587 -6.451 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.041 -8.882 -6.888 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.038 -10.229 -7.479 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.213 -8.753 -8.458 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.071 -5.501 -5.517 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.343 -6.956 -4.580 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.010 -6.996 -5.736 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.762 -10.813 -8.887 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.707 -12.224 -9.252 1.00 0.00 C ATOM 1401 C LEU A 94 -0.289 -12.768 -9.112 1.00 0.00 C ATOM 1402 O LEU A 94 0.633 -12.305 -9.784 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.201 -12.419 -10.687 1.00 0.00 C ATOM 1404 CG LEU A 94 -3.680 -12.774 -10.845 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.233 -12.193 -12.138 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -3.873 -14.283 -10.811 1.00 0.00 C ATOM 0 H LEU A 94 -1.292 -10.189 -9.543 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.356 -12.776 -8.572 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.006 -11.503 -11.245 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.607 -13.207 -11.151 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.230 -12.339 -10.010 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.287 -12.456 -12.234 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.129 -11.108 -12.123 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.680 -12.599 -12.985 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.931 -14.517 -10.925 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.311 -14.740 -11.625 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.515 -14.674 -9.859 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.123 -13.754 -8.237 1.00 0.00 N ATOM 1419 CA ASN A 95 1.183 -14.362 -8.010 1.00 0.00 C ATOM 1420 C ASN A 95 1.133 -15.867 -8.256 1.00 0.00 C ATOM 1421 O ASN A 95 1.735 -16.660 -7.532 1.00 0.00 O ATOM 1422 CB ASN A 95 1.658 -14.083 -6.582 1.00 0.00 C ATOM 1423 CG ASN A 95 2.990 -14.740 -6.277 1.00 0.00 C ATOM 1424 OD1 ASN A 95 3.043 -15.818 -5.685 1.00 0.00 O ATOM 1425 ND2 ASN A 95 4.076 -14.091 -6.682 1.00 0.00 N ATOM 0 H ASN A 95 -0.876 -14.149 -7.674 1.00 0.00 H new ATOM 0 HA ASN A 95 1.889 -13.920 -8.713 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.745 -13.006 -6.435 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.909 -14.442 -5.876 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.001 -14.484 -6.506 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.985 -13.200 -7.169 1.00 0.00 H new ATOM 1432 N PRO A 96 0.397 -16.271 -9.302 1.00 0.00 N ATOM 1433 CA PRO A 96 0.251 -17.683 -9.669 1.00 0.00 C ATOM 1434 C PRO A 96 1.542 -18.274 -10.224 1.00 0.00 C ATOM 1435 O PRO A 96 1.756 -19.484 -10.165 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.833 -17.658 -10.750 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.753 -16.290 -11.335 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.348 -15.381 -10.208 1.00 0.00 C ATOM 0 HA PRO A 96 0.001 -18.304 -8.809 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.656 -18.423 -11.506 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.819 -17.851 -10.327 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.025 -16.254 -12.146 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.713 -15.988 -11.754 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.272 -14.556 -10.560 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.215 -14.941 -9.716 1.00 0.00 H new ATOM 1446 N ASN A 97 2.400 -17.413 -10.761 1.00 0.00 N ATOM 1447 CA ASN A 97 3.671 -17.851 -11.326 1.00 0.00 C ATOM 1448 C ASN A 97 4.671 -18.182 -10.223 1.00 0.00 C ATOM 1449 O ASN A 97 5.831 -18.493 -10.494 1.00 0.00 O ATOM 1450 CB ASN A 97 4.245 -16.769 -12.243 1.00 0.00 C ATOM 1451 CG ASN A 97 3.730 -16.883 -13.665 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.495 -17.135 -14.596 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.426 -16.698 -13.838 1.00 0.00 N ATOM 0 H ASN A 97 2.238 -16.407 -10.817 1.00 0.00 H new ATOM 0 HA ASN A 97 3.489 -18.753 -11.910 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.990 -15.787 -11.845 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.333 -16.839 -12.247 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.021 -16.763 -14.772 1.00 0.00 H new ATOM 0 HD22 ASN A 97 1.830 -16.491 -13.037 1.00 0.00 H new ATOM 1460 N LYS A 98 4.214 -18.114 -8.977 1.00 0.00 N ATOM 1461 CA LYS A 98 5.066 -18.408 -7.831 1.00 0.00 C ATOM 1462 C LYS A 98 6.391 -17.659 -7.933 1.00 0.00 C ATOM 1463 O LYS A 98 7.460 -18.243 -7.757 1.00 0.00 O ATOM 1464 CB LYS A 98 5.325 -19.913 -7.735 1.00 0.00 C ATOM 1465 CG LYS A 98 4.128 -20.705 -7.238 1.00 0.00 C ATOM 1466 CD LYS A 98 4.406 -22.199 -7.247 1.00 0.00 C ATOM 1467 CE LYS A 98 4.234 -22.790 -8.638 1.00 0.00 C ATOM 1468 NZ LYS A 98 2.803 -22.843 -9.045 1.00 0.00 N ATOM 0 H LYS A 98 3.257 -17.857 -8.735 1.00 0.00 H new ATOM 0 HA LYS A 98 4.549 -18.076 -6.930 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.615 -20.287 -8.717 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.168 -20.086 -7.066 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.875 -20.387 -6.227 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.263 -20.491 -7.866 1.00 0.00 H new ATOM 0 HD2 LYS A 98 5.421 -22.383 -6.895 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.732 -22.700 -6.552 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.794 -22.193 -9.358 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.655 -23.795 -8.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.694 -23.496 -9.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.227 -23.176 -8.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.487 -21.893 -9.327 1.00 0.00 H new ATOM 1482 N ALA A 99 6.313 -16.363 -8.216 1.00 0.00 N ATOM 1483 CA ALA A 99 7.506 -15.534 -8.337 1.00 0.00 C ATOM 1484 C ALA A 99 7.469 -14.371 -7.352 1.00 0.00 C ATOM 1485 O ALA A 99 6.753 -13.387 -7.542 1.00 0.00 O ATOM 1486 CB ALA A 99 7.648 -15.018 -9.761 1.00 0.00 C ATOM 0 H ALA A 99 5.436 -15.864 -8.366 1.00 0.00 H new ATOM 0 HA ALA A 99 8.372 -16.151 -8.098 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.543 -14.400 -9.837 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.730 -15.861 -10.447 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.773 -14.422 -10.021 1.00 0.00 H new ATOM 1492 N PRO A 100 8.257 -14.484 -6.272 1.00 0.00 N ATOM 1493 CA PRO A 100 8.331 -13.450 -5.235 1.00 0.00 C ATOM 1494 C PRO A 100 9.022 -12.183 -5.728 1.00 0.00 C ATOM 1495 O PRO A 100 10.228 -12.012 -5.548 1.00 0.00 O ATOM 1496 CB PRO A 100 9.157 -14.115 -4.131 1.00 0.00 C ATOM 1497 CG PRO A 100 9.978 -15.138 -4.836 1.00 0.00 C ATOM 1498 CD PRO A 100 9.136 -15.629 -5.981 1.00 0.00 C ATOM 0 HA PRO A 100 7.342 -13.126 -4.910 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.786 -13.389 -3.616 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.516 -14.573 -3.378 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.913 -14.708 -5.196 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.241 -15.957 -4.166 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.747 -15.896 -6.843 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.564 -16.516 -5.708 1.00 0.00 H new ATOM 1506 N LEU A 101 8.250 -11.298 -6.349 1.00 0.00 N ATOM 1507 CA LEU A 101 8.788 -10.045 -6.868 1.00 0.00 C ATOM 1508 C LEU A 101 8.692 -8.938 -5.823 1.00 0.00 C ATOM 1509 O LEU A 101 8.277 -9.175 -4.689 1.00 0.00 O ATOM 1510 CB LEU A 101 8.039 -9.632 -8.136 1.00 0.00 C ATOM 1511 CG LEU A 101 8.601 -10.168 -9.453 1.00 0.00 C ATOM 1512 CD1 LEU A 101 9.766 -9.311 -9.923 1.00 0.00 C ATOM 1513 CD2 LEU A 101 9.033 -11.619 -9.297 1.00 0.00 C ATOM 0 H LEU A 101 7.250 -11.425 -6.505 1.00 0.00 H new ATOM 0 HA LEU A 101 9.839 -10.201 -7.110 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.004 -9.961 -8.046 1.00 0.00 H new ATOM 0 HB3 LEU A 101 8.024 -8.543 -8.187 1.00 0.00 H new ATOM 0 HG LEU A 101 7.815 -10.123 -10.207 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.154 -9.707 -10.862 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.426 -8.286 -10.074 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.554 -9.324 -9.170 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.430 -11.984 -10.244 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.803 -11.689 -8.529 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.175 -12.225 -9.006 1.00 0.00 H new ATOM 1525 N ARG A 102 9.078 -7.728 -6.214 1.00 0.00 N ATOM 1526 CA ARG A 102 9.035 -6.583 -5.312 1.00 0.00 C ATOM 1527 C ARG A 102 7.854 -5.675 -5.642 1.00 0.00 C ATOM 1528 O ARG A 102 7.147 -5.891 -6.627 1.00 0.00 O ATOM 1529 CB ARG A 102 10.341 -5.791 -5.396 1.00 0.00 C ATOM 1530 CG ARG A 102 11.452 -6.354 -4.524 1.00 0.00 C ATOM 1531 CD ARG A 102 12.280 -7.385 -5.274 1.00 0.00 C ATOM 1532 NE ARG A 102 12.860 -8.380 -4.375 1.00 0.00 N ATOM 1533 CZ ARG A 102 13.532 -9.446 -4.795 1.00 0.00 C ATOM 1534 NH1 ARG A 102 13.708 -9.655 -6.092 1.00 0.00 N ATOM 1535 NH2 ARG A 102 14.030 -10.306 -3.916 1.00 0.00 N ATOM 0 H ARG A 102 9.424 -7.515 -7.150 1.00 0.00 H new ATOM 0 HA ARG A 102 8.910 -6.957 -4.296 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.678 -5.772 -6.432 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.149 -4.758 -5.104 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.097 -5.543 -4.186 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.021 -6.810 -3.633 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.654 -7.885 -6.013 1.00 0.00 H new ATOM 0 HD3 ARG A 102 13.077 -6.882 -5.821 1.00 0.00 H new ATOM 0 HE ARG A 102 12.743 -8.249 -3.370 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.327 -8.996 -6.771 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.225 -10.475 -6.411 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.897 -10.149 -2.917 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.546 -11.124 -4.239 1.00 0.00 H new ATOM 1549 N LEU A 103 7.647 -4.658 -4.813 1.00 0.00 N ATOM 1550 CA LEU A 103 6.552 -3.716 -5.016 1.00 0.00 C ATOM 1551 C LEU A 103 7.024 -2.280 -4.811 1.00 0.00 C ATOM 1552 O LEU A 103 7.909 -2.016 -3.998 1.00 0.00 O ATOM 1553 CB LEU A 103 5.400 -4.028 -4.058 1.00 0.00 C ATOM 1554 CG LEU A 103 4.293 -2.977 -3.975 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.593 -2.831 -5.317 1.00 0.00 C ATOM 1556 CD2 LEU A 103 3.294 -3.340 -2.886 1.00 0.00 C ATOM 0 H LEU A 103 8.223 -4.465 -3.994 1.00 0.00 H new ATOM 0 HA LEU A 103 6.201 -3.821 -6.043 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.952 -4.976 -4.357 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.813 -4.171 -3.060 1.00 0.00 H new ATOM 0 HG LEU A 103 4.746 -2.019 -3.720 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.808 -2.079 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.316 -2.524 -6.073 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.152 -3.786 -5.603 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.513 -2.581 -2.841 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.847 -4.308 -3.111 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.806 -3.391 -1.925 1.00 0.00 H new ATOM 1568 N LYS A 104 6.424 -1.354 -5.553 1.00 0.00 N ATOM 1569 CA LYS A 104 6.780 0.056 -5.451 1.00 0.00 C ATOM 1570 C LYS A 104 5.617 0.871 -4.894 1.00 0.00 C ATOM 1571 O LYS A 104 4.474 0.716 -5.326 1.00 0.00 O ATOM 1572 CB LYS A 104 7.187 0.600 -6.822 1.00 0.00 C ATOM 1573 CG LYS A 104 7.621 2.056 -6.794 1.00 0.00 C ATOM 1574 CD LYS A 104 7.375 2.737 -8.130 1.00 0.00 C ATOM 1575 CE LYS A 104 8.558 2.565 -9.070 1.00 0.00 C ATOM 1576 NZ LYS A 104 8.507 1.265 -9.794 1.00 0.00 N ATOM 0 H LYS A 104 5.689 -1.555 -6.231 1.00 0.00 H new ATOM 0 HA LYS A 104 7.624 0.144 -4.767 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.003 -0.006 -7.217 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.348 0.493 -7.510 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.078 2.584 -6.010 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.680 2.116 -6.543 1.00 0.00 H new ATOM 0 HD2 LYS A 104 6.479 2.322 -8.592 1.00 0.00 H new ATOM 0 HD3 LYS A 104 7.188 3.799 -7.969 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.570 3.382 -9.791 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.486 2.628 -8.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.131 1.306 -10.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.822 0.502 -9.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.532 1.078 -10.103 1.00 0.00 H new ATOM 1590 N LEU A 105 5.916 1.740 -3.935 1.00 0.00 N ATOM 1591 CA LEU A 105 4.895 2.581 -3.319 1.00 0.00 C ATOM 1592 C LEU A 105 5.233 4.059 -3.489 1.00 0.00 C ATOM 1593 O LEU A 105 6.339 4.494 -3.169 1.00 0.00 O ATOM 1594 CB LEU A 105 4.757 2.245 -1.833 1.00 0.00 C ATOM 1595 CG LEU A 105 4.127 0.891 -1.507 1.00 0.00 C ATOM 1596 CD1 LEU A 105 4.322 0.552 -0.037 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.648 0.891 -1.865 1.00 0.00 C ATOM 0 H LEU A 105 6.857 1.881 -3.567 1.00 0.00 H new ATOM 0 HA LEU A 105 3.947 2.384 -3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.747 2.281 -1.379 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.161 3.024 -1.359 1.00 0.00 H new ATOM 0 HG LEU A 105 4.625 0.127 -2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.867 -0.415 0.177 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.388 0.510 0.188 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.851 1.318 0.579 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.216 -0.081 -1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.136 1.666 -1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.532 1.088 -2.931 1.00 0.00 H new ATOM 1609 N ARG A 106 4.271 4.826 -3.992 1.00 0.00 N ATOM 1610 CA ARG A 106 4.466 6.256 -4.203 1.00 0.00 C ATOM 1611 C ARG A 106 3.506 7.069 -3.340 1.00 0.00 C ATOM 1612 O ARG A 106 2.292 6.862 -3.380 1.00 0.00 O ATOM 1613 CB ARG A 106 4.266 6.607 -5.678 1.00 0.00 C ATOM 1614 CG ARG A 106 4.103 8.096 -5.933 1.00 0.00 C ATOM 1615 CD ARG A 106 4.566 8.477 -7.331 1.00 0.00 C ATOM 1616 NE ARG A 106 4.058 9.784 -7.739 1.00 0.00 N ATOM 1617 CZ ARG A 106 4.294 10.325 -8.929 1.00 0.00 C ATOM 1618 NH1 ARG A 106 5.025 9.675 -9.823 1.00 0.00 N ATOM 1619 NH2 ARG A 106 3.798 11.519 -9.226 1.00 0.00 N ATOM 0 H ARG A 106 3.349 4.482 -4.261 1.00 0.00 H new ATOM 0 HA ARG A 106 5.487 6.505 -3.913 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.119 6.241 -6.249 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.385 6.085 -6.051 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.057 8.375 -5.806 1.00 0.00 H new ATOM 0 HG3 ARG A 106 4.675 8.657 -5.194 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.656 8.486 -7.362 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.233 7.721 -8.042 1.00 0.00 H new ATOM 0 HE ARG A 106 3.491 10.310 -7.074 1.00 0.00 H new ATOM 0 HH11 ARG A 106 5.408 8.757 -9.598 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.205 10.093 -10.736 1.00 0.00 H new ATOM 0 HH21 ARG A 106 3.235 12.022 -8.540 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.980 11.934 -10.140 1.00 0.00 H new ATOM 1633 N LEU A 107 4.056 7.992 -2.561 1.00 0.00 N ATOM 1634 CA LEU A 107 3.249 8.837 -1.687 1.00 0.00 C ATOM 1635 C LEU A 107 3.396 10.308 -2.063 1.00 0.00 C ATOM 1636 O LEU A 107 4.505 10.796 -2.285 1.00 0.00 O ATOM 1637 CB LEU A 107 3.654 8.629 -0.227 1.00 0.00 C ATOM 1638 CG LEU A 107 3.663 7.182 0.268 1.00 0.00 C ATOM 1639 CD1 LEU A 107 4.402 7.076 1.593 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.242 6.657 0.404 1.00 0.00 C ATOM 0 H LEU A 107 5.058 8.175 -2.516 1.00 0.00 H new ATOM 0 HA LEU A 107 2.204 8.552 -1.812 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.651 9.047 -0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.974 9.203 0.403 1.00 0.00 H new ATOM 0 HG LEU A 107 4.187 6.570 -0.466 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.398 6.039 1.930 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.431 7.412 1.464 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.907 7.701 2.337 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.267 5.626 0.757 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.694 7.272 1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.745 6.696 -0.565 1.00 0.00 H new ATOM 1652 N THR A 108 2.270 11.011 -2.132 1.00 0.00 N ATOM 1653 CA THR A 108 2.273 12.427 -2.480 1.00 0.00 C ATOM 1654 C THR A 108 1.086 13.150 -1.854 1.00 0.00 C ATOM 1655 O THR A 108 -0.053 12.988 -2.291 1.00 0.00 O ATOM 1656 CB THR A 108 2.236 12.630 -4.006 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.372 11.659 -4.609 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.631 12.513 -4.602 1.00 0.00 C ATOM 0 H THR A 108 1.344 10.623 -1.952 1.00 0.00 H new ATOM 0 HA THR A 108 3.199 12.847 -2.087 1.00 0.00 H new ATOM 0 HB THR A 108 1.854 13.631 -4.207 1.00 0.00 H new ATOM 0 HG1 THR A 108 1.353 11.796 -5.579 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.579 12.660 -5.681 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.279 13.272 -4.163 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.036 11.523 -4.390 1.00 0.00 H new ATOM 1666 N TYR A 109 1.360 13.947 -0.828 1.00 0.00 N ATOM 1667 CA TYR A 109 0.314 14.694 -0.139 1.00 0.00 C ATOM 1668 C TYR A 109 0.826 16.058 0.314 1.00 0.00 C ATOM 1669 O TYR A 109 1.976 16.417 0.060 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.198 13.904 1.065 1.00 0.00 C ATOM 1671 CG TYR A 109 0.866 13.626 2.104 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.995 12.882 1.788 1.00 0.00 C ATOM 1673 CD2 TYR A 109 0.740 14.107 3.401 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.969 12.625 2.733 1.00 0.00 C ATOM 1675 CE2 TYR A 109 1.710 13.856 4.353 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.822 13.115 4.014 1.00 0.00 C ATOM 1677 OH TYR A 109 3.790 12.862 4.959 1.00 0.00 O ATOM 0 H TYR A 109 2.298 14.093 -0.455 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.507 14.849 -0.839 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -1.014 14.457 1.531 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.612 12.957 0.718 1.00 0.00 H new ATOM 0 HD1 TYR A 109 2.114 12.498 0.786 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -0.131 14.687 3.670 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.841 12.044 2.470 1.00 0.00 H new ATOM 0 HE2 TYR A 109 1.597 14.238 5.357 1.00 0.00 H new ATOM 0 HH TYR A 109 3.535 13.278 5.809 1.00 0.00 H new ATOM 1687 N ASP A 110 -0.035 16.813 0.986 1.00 0.00 N ATOM 1688 CA ASP A 110 0.329 18.137 1.477 1.00 0.00 C ATOM 1689 C ASP A 110 0.245 18.194 2.999 1.00 0.00 C ATOM 1690 O ASP A 110 -0.844 18.184 3.573 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.584 19.200 0.864 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.442 19.285 -0.643 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.681 19.077 -1.146 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -1.455 19.561 -1.320 1.00 0.00 O ATOM 0 H ASP A 110 -0.991 16.531 1.204 1.00 0.00 H new ATOM 0 HA ASP A 110 1.358 18.337 1.180 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.620 18.974 1.116 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.353 20.170 1.303 1.00 0.00 H new ATOM 1699 N HIS A 111 1.404 18.252 3.648 1.00 0.00 N ATOM 1700 CA HIS A 111 1.462 18.309 5.105 1.00 0.00 C ATOM 1701 C HIS A 111 2.053 19.636 5.573 1.00 0.00 C ATOM 1702 O HIS A 111 3.070 20.093 5.050 1.00 0.00 O ATOM 1703 CB HIS A 111 2.293 17.147 5.650 1.00 0.00 C ATOM 1704 CG HIS A 111 1.924 16.750 7.046 1.00 0.00 C ATOM 1705 ND1 HIS A 111 2.760 16.023 7.867 1.00 0.00 N ATOM 1706 CD2 HIS A 111 0.802 16.984 7.766 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.167 15.826 9.031 1.00 0.00 C ATOM 1708 NE2 HIS A 111 0.978 16.400 8.996 1.00 0.00 N ATOM 0 H HIS A 111 2.315 18.261 3.189 1.00 0.00 H new ATOM 0 HA HIS A 111 0.445 18.229 5.488 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.173 16.286 4.993 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.347 17.422 5.626 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -0.070 17.529 7.435 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.584 15.287 9.869 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.301 16.408 9.759 1.00 0.00 H new ATOM 1716 N PHE A 112 1.409 20.250 6.560 1.00 0.00 N ATOM 1717 CA PHE A 112 1.870 21.525 7.097 1.00 0.00 C ATOM 1718 C PHE A 112 2.081 22.541 5.979 1.00 0.00 C ATOM 1719 O PHE A 112 3.153 23.137 5.860 1.00 0.00 O ATOM 1720 CB PHE A 112 3.171 21.333 7.879 1.00 0.00 C ATOM 1721 CG PHE A 112 2.991 20.573 9.163 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.467 21.196 10.284 1.00 0.00 C ATOM 1723 CD2 PHE A 112 3.347 19.237 9.248 1.00 0.00 C ATOM 1724 CE1 PHE A 112 2.302 20.500 11.466 1.00 0.00 C ATOM 1725 CE2 PHE A 112 3.184 18.536 10.428 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.659 19.168 11.538 1.00 0.00 C ATOM 0 H PHE A 112 0.566 19.885 7.004 1.00 0.00 H new ATOM 0 HA PHE A 112 1.102 21.906 7.771 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.889 20.805 7.251 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.600 22.310 8.101 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.184 22.237 10.233 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.757 18.737 8.382 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.894 20.998 12.333 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.467 17.495 10.482 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.528 18.622 12.460 1.00 0.00 H new ATOM 1736 N HIS A 113 1.052 22.735 5.160 1.00 0.00 N ATOM 1737 CA HIS A 113 1.124 23.679 4.051 1.00 0.00 C ATOM 1738 C HIS A 113 2.408 23.481 3.251 1.00 0.00 C ATOM 1739 O HIS A 113 3.085 24.447 2.900 1.00 0.00 O ATOM 1740 CB HIS A 113 1.049 25.115 4.570 1.00 0.00 C ATOM 1741 CG HIS A 113 -0.193 25.404 5.357 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -1.260 26.111 4.845 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -0.535 25.074 6.624 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -2.204 26.206 5.765 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -1.789 25.584 6.853 1.00 0.00 N ATOM 0 H HIS A 113 0.158 22.251 5.244 1.00 0.00 H new ATOM 0 HA HIS A 113 0.275 23.494 3.393 1.00 0.00 H new ATOM 0 HB2 HIS A 113 1.920 25.312 5.195 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.101 25.801 3.725 1.00 0.00 H new ATOM 0 HD2 HIS A 113 0.066 24.514 7.325 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -3.153 26.707 5.647 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -2.315 25.497 7.723 1.00 0.00 H new ATOM 1753 N GLN A 114 2.736 22.225 2.969 1.00 0.00 N ATOM 1754 CA GLN A 114 3.940 21.901 2.212 1.00 0.00 C ATOM 1755 C GLN A 114 3.733 20.646 1.371 1.00 0.00 C ATOM 1756 O GLN A 114 2.955 19.765 1.734 1.00 0.00 O ATOM 1757 CB GLN A 114 5.125 21.706 3.159 1.00 0.00 C ATOM 1758 CG GLN A 114 5.852 22.997 3.500 1.00 0.00 C ATOM 1759 CD GLN A 114 6.744 23.479 2.373 1.00 0.00 C ATOM 1760 OE1 GLN A 114 6.617 23.036 1.232 1.00 0.00 O ATOM 1761 NE2 GLN A 114 7.655 24.393 2.689 1.00 0.00 N ATOM 0 H GLN A 114 2.185 21.415 3.253 1.00 0.00 H new ATOM 0 HA GLN A 114 4.153 22.734 1.541 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.770 21.244 4.081 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.831 21.010 2.705 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.121 23.770 3.736 1.00 0.00 H new ATOM 0 HG3 GLN A 114 6.454 22.845 4.395 1.00 0.00 H new ATOM 0 HE21 GLN A 114 7.725 24.733 3.648 1.00 0.00 H new ATOM 0 HE22 GLN A 114 8.284 24.755 1.972 1.00 0.00 H new ATOM 1770 N SER A 115 4.436 20.573 0.245 1.00 0.00 N ATOM 1771 CA SER A 115 4.326 19.427 -0.651 1.00 0.00 C ATOM 1772 C SER A 115 5.263 18.305 -0.215 1.00 0.00 C ATOM 1773 O SER A 115 6.469 18.508 -0.074 1.00 0.00 O ATOM 1774 CB SER A 115 4.645 19.844 -2.088 1.00 0.00 C ATOM 1775 OG SER A 115 3.792 20.892 -2.516 1.00 0.00 O ATOM 0 H SER A 115 5.087 21.293 -0.068 1.00 0.00 H new ATOM 0 HA SER A 115 3.301 19.059 -0.606 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.684 20.167 -2.154 1.00 0.00 H new ATOM 0 HB3 SER A 115 4.534 18.987 -2.752 1.00 0.00 H new ATOM 0 HG SER A 115 4.017 21.142 -3.437 1.00 0.00 H new ATOM 1781 N VAL A 116 4.699 17.120 -0.003 1.00 0.00 N ATOM 1782 CA VAL A 116 5.483 15.964 0.415 1.00 0.00 C ATOM 1783 C VAL A 116 5.398 14.841 -0.612 1.00 0.00 C ATOM 1784 O VAL A 116 4.335 14.256 -0.818 1.00 0.00 O ATOM 1785 CB VAL A 116 5.013 15.432 1.782 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.911 14.298 2.252 1.00 0.00 C ATOM 1787 CG2 VAL A 116 4.978 16.556 2.807 1.00 0.00 C ATOM 0 H VAL A 116 3.702 16.936 -0.114 1.00 0.00 H new ATOM 0 HA VAL A 116 6.517 16.297 0.499 1.00 0.00 H new ATOM 0 HB VAL A 116 4.002 15.040 1.672 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.563 13.935 3.219 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.880 13.485 1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.935 14.660 2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.644 16.163 3.767 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.976 16.980 2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.289 17.332 2.473 1.00 0.00 H new ATOM 1797 N GLN A 117 6.524 14.545 -1.252 1.00 0.00 N ATOM 1798 CA GLN A 117 6.576 13.491 -2.258 1.00 0.00 C ATOM 1799 C GLN A 117 7.792 12.595 -2.046 1.00 0.00 C ATOM 1800 O GLN A 117 8.932 13.044 -2.155 1.00 0.00 O ATOM 1801 CB GLN A 117 6.614 14.098 -3.662 1.00 0.00 C ATOM 1802 CG GLN A 117 7.084 13.127 -4.732 1.00 0.00 C ATOM 1803 CD GLN A 117 7.293 13.796 -6.077 1.00 0.00 C ATOM 1804 OE1 GLN A 117 6.334 14.108 -6.783 1.00 0.00 O ATOM 1805 NE2 GLN A 117 8.551 14.020 -6.437 1.00 0.00 N ATOM 0 H GLN A 117 7.412 15.020 -1.092 1.00 0.00 H new ATOM 0 HA GLN A 117 5.677 12.883 -2.157 1.00 0.00 H new ATOM 0 HB2 GLN A 117 5.618 14.456 -3.921 1.00 0.00 H new ATOM 0 HB3 GLN A 117 7.273 14.966 -3.656 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.017 12.664 -4.412 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.351 12.327 -4.838 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.315 13.744 -5.820 1.00 0.00 H new ATOM 0 HE22 GLN A 117 8.754 14.468 -7.331 1.00 0.00 H new ATOM 1814 N GLU A 118 7.539 11.325 -1.742 1.00 0.00 N ATOM 1815 CA GLU A 118 8.614 10.367 -1.514 1.00 0.00 C ATOM 1816 C GLU A 118 8.288 9.021 -2.153 1.00 0.00 C ATOM 1817 O GLU A 118 7.261 8.411 -1.852 1.00 0.00 O ATOM 1818 CB GLU A 118 8.855 10.186 -0.013 1.00 0.00 C ATOM 1819 CG GLU A 118 8.999 11.497 0.742 1.00 0.00 C ATOM 1820 CD GLU A 118 9.904 11.376 1.953 1.00 0.00 C ATOM 1821 OE1 GLU A 118 9.519 10.680 2.915 1.00 0.00 O ATOM 1822 OE2 GLU A 118 10.999 11.977 1.936 1.00 0.00 O ATOM 0 H GLU A 118 6.600 10.937 -1.648 1.00 0.00 H new ATOM 0 HA GLU A 118 9.520 10.759 -1.976 1.00 0.00 H new ATOM 0 HB2 GLU A 118 8.027 9.620 0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.757 9.591 0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.397 12.257 0.070 1.00 0.00 H new ATOM 0 HG3 GLU A 118 8.014 11.838 1.061 1.00 0.00 H new ATOM 1829 N ILE A 119 9.168 8.564 -3.038 1.00 0.00 N ATOM 1830 CA ILE A 119 8.974 7.290 -3.719 1.00 0.00 C ATOM 1831 C ILE A 119 10.019 6.269 -3.284 1.00 0.00 C ATOM 1832 O ILE A 119 11.221 6.533 -3.339 1.00 0.00 O ATOM 1833 CB ILE A 119 9.039 7.455 -5.249 1.00 0.00 C ATOM 1834 CG1 ILE A 119 7.912 8.369 -5.734 1.00 0.00 C ATOM 1835 CG2 ILE A 119 8.959 6.097 -5.932 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.220 9.067 -7.040 1.00 0.00 C ATOM 0 H ILE A 119 10.022 9.057 -3.300 1.00 0.00 H new ATOM 0 HA ILE A 119 7.983 6.931 -3.442 1.00 0.00 H new ATOM 0 HB ILE A 119 9.992 7.916 -5.510 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.003 7.780 -5.852 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.709 9.119 -4.970 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.006 6.230 -7.013 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.793 5.476 -5.606 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.020 5.611 -5.667 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.377 9.698 -7.323 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.111 9.683 -6.922 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.394 8.323 -7.818 1.00 0.00 H new ATOM 1848 N PHE A 120 9.554 5.101 -2.854 1.00 0.00 N ATOM 1849 CA PHE A 120 10.449 4.038 -2.410 1.00 0.00 C ATOM 1850 C PHE A 120 9.876 2.666 -2.752 1.00 0.00 C ATOM 1851 O PHE A 120 8.694 2.538 -3.068 1.00 0.00 O ATOM 1852 CB PHE A 120 10.689 4.142 -0.902 1.00 0.00 C ATOM 1853 CG PHE A 120 9.424 4.152 -0.093 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.732 2.976 0.151 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.926 5.337 0.424 1.00 0.00 C ATOM 1856 CE1 PHE A 120 7.568 2.981 0.895 1.00 0.00 C ATOM 1857 CE2 PHE A 120 7.762 5.348 1.170 1.00 0.00 C ATOM 1858 CZ PHE A 120 7.082 4.170 1.405 1.00 0.00 C ATOM 0 H PHE A 120 8.563 4.866 -2.803 1.00 0.00 H new ATOM 0 HA PHE A 120 11.399 4.155 -2.931 1.00 0.00 H new ATOM 0 HB2 PHE A 120 11.309 3.304 -0.582 1.00 0.00 H new ATOM 0 HB3 PHE A 120 11.251 5.052 -0.694 1.00 0.00 H new ATOM 0 HD1 PHE A 120 9.107 2.044 -0.245 1.00 0.00 H new ATOM 0 HD2 PHE A 120 9.453 6.262 0.242 1.00 0.00 H new ATOM 0 HE1 PHE A 120 7.039 2.057 1.078 1.00 0.00 H new ATOM 0 HE2 PHE A 120 7.385 6.278 1.569 1.00 0.00 H new ATOM 0 HZ PHE A 120 6.172 4.177 1.986 1.00 0.00 H new ATOM 1868 N GLU A 121 10.724 1.644 -2.686 1.00 0.00 N ATOM 1869 CA GLU A 121 10.302 0.282 -2.991 1.00 0.00 C ATOM 1870 C GLU A 121 10.454 -0.620 -1.769 1.00 0.00 C ATOM 1871 O GLU A 121 11.467 -0.573 -1.071 1.00 0.00 O ATOM 1872 CB GLU A 121 11.117 -0.279 -4.158 1.00 0.00 C ATOM 1873 CG GLU A 121 10.721 0.295 -5.508 1.00 0.00 C ATOM 1874 CD GLU A 121 11.188 -0.564 -6.667 1.00 0.00 C ATOM 1875 OE1 GLU A 121 12.337 -0.376 -7.119 1.00 0.00 O ATOM 1876 OE2 GLU A 121 10.406 -1.424 -7.122 1.00 0.00 O ATOM 0 H GLU A 121 11.706 1.733 -2.424 1.00 0.00 H new ATOM 0 HA GLU A 121 9.249 0.309 -3.273 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.174 -0.077 -3.983 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.000 -1.362 -4.185 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.637 0.398 -5.551 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.141 1.296 -5.610 1.00 0.00 H new ATOM 1883 N VAL A 122 9.440 -1.442 -1.518 1.00 0.00 N ATOM 1884 CA VAL A 122 9.460 -2.356 -0.382 1.00 0.00 C ATOM 1885 C VAL A 122 10.330 -3.574 -0.672 1.00 0.00 C ATOM 1886 O VAL A 122 9.891 -4.522 -1.322 1.00 0.00 O ATOM 1887 CB VAL A 122 8.040 -2.828 -0.016 1.00 0.00 C ATOM 1888 CG1 VAL A 122 8.078 -3.743 1.198 1.00 0.00 C ATOM 1889 CG2 VAL A 122 7.131 -1.634 0.235 1.00 0.00 C ATOM 0 H VAL A 122 8.594 -1.494 -2.086 1.00 0.00 H new ATOM 0 HA VAL A 122 9.880 -1.805 0.460 1.00 0.00 H new ATOM 0 HB VAL A 122 7.636 -3.394 -0.855 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.066 -4.066 1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.694 -4.615 0.978 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.501 -3.205 2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.132 -1.985 0.492 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.530 -1.040 1.057 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.079 -1.020 -0.664 1.00 0.00 H new ATOM 1899 N ASN A 123 11.566 -3.541 -0.185 1.00 0.00 N ATOM 1900 CA ASN A 123 12.498 -4.643 -0.392 1.00 0.00 C ATOM 1901 C ASN A 123 12.603 -5.510 0.859 1.00 0.00 C ATOM 1902 O ASN A 123 13.600 -6.199 1.068 1.00 0.00 O ATOM 1903 CB ASN A 123 13.880 -4.106 -0.770 1.00 0.00 C ATOM 1904 CG ASN A 123 14.375 -3.049 0.200 1.00 0.00 C ATOM 1905 OD1 ASN A 123 14.727 -3.353 1.339 1.00 0.00 O ATOM 1906 ND2 ASN A 123 14.402 -1.800 -0.250 1.00 0.00 N ATOM 0 H ASN A 123 11.945 -2.763 0.355 1.00 0.00 H new ATOM 0 HA ASN A 123 12.118 -5.258 -1.208 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.592 -4.931 -0.799 1.00 0.00 H new ATOM 0 HB3 ASN A 123 13.841 -3.684 -1.774 1.00 0.00 H new ATOM 0 HD21 ASN A 123 14.724 -1.046 0.357 1.00 0.00 H new ATOM 0 HD22 ASN A 123 14.101 -1.594 -1.202 1.00 0.00 H new ATOM 1913 N ASN A 124 11.564 -5.470 1.688 1.00 0.00 N ATOM 1914 CA ASN A 124 11.539 -6.252 2.919 1.00 0.00 C ATOM 1915 C ASN A 124 10.251 -7.064 3.021 1.00 0.00 C ATOM 1916 O ASN A 124 9.822 -7.434 4.115 1.00 0.00 O ATOM 1917 CB ASN A 124 11.673 -5.332 4.135 1.00 0.00 C ATOM 1918 CG ASN A 124 10.551 -4.315 4.216 1.00 0.00 C ATOM 1919 OD1 ASN A 124 9.500 -4.482 3.597 1.00 0.00 O ATOM 1920 ND2 ASN A 124 10.770 -3.253 4.983 1.00 0.00 N ATOM 0 H ASN A 124 10.730 -4.905 1.530 1.00 0.00 H new ATOM 0 HA ASN A 124 12.382 -6.942 2.899 1.00 0.00 H new ATOM 0 HB2 ASN A 124 11.681 -5.934 5.044 1.00 0.00 H new ATOM 0 HB3 ASN A 124 12.629 -4.811 4.090 1.00 0.00 H new ATOM 0 HD21 ASN A 124 10.052 -2.535 5.077 1.00 0.00 H new ATOM 0 HD22 ASN A 124 11.656 -3.156 5.478 1.00 0.00 H new ATOM 1927 N LEU A 125 9.640 -7.339 1.874 1.00 0.00 N ATOM 1928 CA LEU A 125 8.401 -8.108 1.833 1.00 0.00 C ATOM 1929 C LEU A 125 8.554 -9.428 2.583 1.00 0.00 C ATOM 1930 O LEU A 125 9.646 -9.988 2.687 1.00 0.00 O ATOM 1931 CB LEU A 125 7.992 -8.377 0.384 1.00 0.00 C ATOM 1932 CG LEU A 125 7.921 -7.154 -0.531 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.899 -7.580 -1.991 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.698 -6.311 -0.201 1.00 0.00 C ATOM 0 H LEU A 125 9.982 -7.041 0.960 1.00 0.00 H new ATOM 0 HA LEU A 125 7.623 -7.522 2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.698 -9.087 -0.046 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.015 -8.861 0.387 1.00 0.00 H new ATOM 0 HG LEU A 125 8.811 -6.547 -0.364 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.848 -6.696 -2.627 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.805 -8.141 -2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.028 -8.209 -2.173 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.664 -5.445 -0.862 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.797 -6.908 -0.338 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.756 -5.975 0.834 1.00 0.00 H new ATOM 1946 N PRO A 126 7.435 -9.938 3.118 1.00 0.00 N ATOM 1947 CA PRO A 126 7.418 -11.199 3.865 1.00 0.00 C ATOM 1948 C PRO A 126 7.659 -12.408 2.967 1.00 0.00 C ATOM 1949 O PRO A 126 7.373 -12.372 1.770 1.00 0.00 O ATOM 1950 CB PRO A 126 6.007 -11.244 4.455 1.00 0.00 C ATOM 1951 CG PRO A 126 5.185 -10.408 3.535 1.00 0.00 C ATOM 1952 CD PRO A 126 6.099 -9.325 3.033 1.00 0.00 C ATOM 0 HA PRO A 126 8.209 -11.239 4.614 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.631 -12.266 4.504 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.990 -10.849 5.471 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.795 -11.004 2.710 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.326 -9.984 4.055 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.855 -9.035 2.011 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.030 -8.426 3.645 1.00 0.00 H new ATOM 1960 N VAL A 127 8.185 -13.479 3.553 1.00 0.00 N ATOM 1961 CA VAL A 127 8.463 -14.700 2.806 1.00 0.00 C ATOM 1962 C VAL A 127 7.215 -15.568 2.689 1.00 0.00 C ATOM 1963 O VAL A 127 7.243 -16.633 2.073 1.00 0.00 O ATOM 1964 CB VAL A 127 9.585 -15.521 3.468 1.00 0.00 C ATOM 1965 CG1 VAL A 127 9.102 -16.129 4.776 1.00 0.00 C ATOM 1966 CG2 VAL A 127 10.085 -16.601 2.521 1.00 0.00 C ATOM 0 H VAL A 127 8.427 -13.526 4.543 1.00 0.00 H new ATOM 0 HA VAL A 127 8.786 -14.395 1.811 1.00 0.00 H new ATOM 0 HB VAL A 127 10.417 -14.853 3.691 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.909 -16.705 5.229 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.798 -15.334 5.456 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.253 -16.784 4.581 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.878 -17.171 3.005 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.263 -17.269 2.264 1.00 0.00 H new ATOM 0 HG23 VAL A 127 10.474 -16.138 1.614 1.00 0.00 H new ATOM 1976 N GLU A 128 6.120 -15.105 3.285 1.00 0.00 N ATOM 1977 CA GLU A 128 4.862 -15.840 3.247 1.00 0.00 C ATOM 1978 C GLU A 128 3.982 -15.355 2.098 1.00 0.00 C ATOM 1979 O GLU A 128 3.178 -16.113 1.555 1.00 0.00 O ATOM 1980 CB GLU A 128 4.116 -15.687 4.574 1.00 0.00 C ATOM 1981 CG GLU A 128 4.658 -16.573 5.683 1.00 0.00 C ATOM 1982 CD GLU A 128 4.287 -18.031 5.499 1.00 0.00 C ATOM 1983 OE1 GLU A 128 3.191 -18.427 5.948 1.00 0.00 O ATOM 1984 OE2 GLU A 128 5.092 -18.777 4.904 1.00 0.00 O ATOM 0 H GLU A 128 6.079 -14.225 3.799 1.00 0.00 H new ATOM 0 HA GLU A 128 5.092 -16.893 3.086 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.170 -14.646 4.893 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.062 -15.919 4.418 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.743 -16.480 5.719 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.276 -16.223 6.642 1.00 0.00 H new ATOM 1991 N SER A 129 4.141 -14.087 1.734 1.00 0.00 N ATOM 1992 CA SER A 129 3.359 -13.498 0.653 1.00 0.00 C ATOM 1993 C SER A 129 3.311 -14.432 -0.553 1.00 0.00 C ATOM 1994 O SER A 129 2.383 -14.373 -1.361 1.00 0.00 O ATOM 1995 CB SER A 129 3.950 -12.148 0.243 1.00 0.00 C ATOM 1996 OG SER A 129 5.356 -12.234 0.086 1.00 0.00 O ATOM 0 H SER A 129 4.804 -13.447 2.172 1.00 0.00 H new ATOM 0 HA SER A 129 2.342 -13.346 1.015 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.496 -11.817 -0.691 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.710 -11.398 0.997 1.00 0.00 H new ATOM 0 HG SER A 129 5.787 -12.186 0.965 1.00 0.00 H new ATOM 2002 N TRP A 130 4.316 -15.292 -0.668 1.00 0.00 N ATOM 2003 CA TRP A 130 4.389 -16.239 -1.775 1.00 0.00 C ATOM 2004 C TRP A 130 4.360 -17.675 -1.266 1.00 0.00 C ATOM 2005 O TRP A 130 3.954 -18.589 -1.984 1.00 0.00 O ATOM 2006 CB TRP A 130 5.660 -16.001 -2.593 1.00 0.00 C ATOM 2007 CG TRP A 130 6.919 -16.178 -1.800 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.687 -15.192 -1.250 1.00 0.00 C ATOM 2009 CD2 TRP A 130 7.557 -17.417 -1.471 1.00 0.00 C ATOM 2010 NE1 TRP A 130 8.764 -15.744 -0.598 1.00 0.00 N ATOM 2011 CE2 TRP A 130 8.706 -17.107 -0.719 1.00 0.00 C ATOM 2012 CE3 TRP A 130 7.267 -18.758 -1.737 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 9.565 -18.089 -0.232 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 8.120 -19.732 -1.253 1.00 0.00 C ATOM 2015 CH2 TRP A 130 9.257 -19.394 -0.507 1.00 0.00 C ATOM 0 H TRP A 130 5.092 -15.353 -0.009 1.00 0.00 H new ATOM 0 HA TRP A 130 3.519 -16.082 -2.413 1.00 0.00 H new ATOM 0 HB2 TRP A 130 5.673 -16.688 -3.439 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.636 -14.991 -3.002 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.479 -14.134 -1.317 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.489 -15.223 -0.104 1.00 0.00 H new ATOM 0 HE3 TRP A 130 6.392 -19.028 -2.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 10.443 -17.830 0.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 7.906 -20.772 -1.453 1.00 0.00 H new ATOM 0 HH2 TRP A 130 9.903 -20.179 -0.142 1.00 0.00 H new ATOM 2026 N GLN A 131 4.792 -17.867 -0.024 1.00 0.00 N ATOM 2027 CA GLN A 131 4.814 -19.194 0.580 1.00 0.00 C ATOM 2028 C GLN A 131 3.511 -19.479 1.319 1.00 0.00 C ATOM 2029 O GLN A 131 3.370 -19.157 2.499 1.00 0.00 O ATOM 2030 CB GLN A 131 5.997 -19.320 1.542 1.00 0.00 C ATOM 2031 CG GLN A 131 6.214 -20.733 2.058 1.00 0.00 C ATOM 2032 CD GLN A 131 7.191 -20.788 3.216 1.00 0.00 C ATOM 2033 OE1 GLN A 131 6.867 -21.289 4.294 1.00 0.00 O ATOM 2034 NE2 GLN A 131 8.395 -20.273 3.000 1.00 0.00 N ATOM 0 H GLN A 131 5.131 -17.121 0.583 1.00 0.00 H new ATOM 0 HA GLN A 131 4.924 -19.927 -0.219 1.00 0.00 H new ATOM 0 HB2 GLN A 131 6.903 -18.984 1.037 1.00 0.00 H new ATOM 0 HB3 GLN A 131 5.838 -18.653 2.389 1.00 0.00 H new ATOM 0 HG2 GLN A 131 5.258 -21.151 2.374 1.00 0.00 H new ATOM 0 HG3 GLN A 131 6.583 -21.359 1.246 1.00 0.00 H new ATOM 0 HE21 GLN A 131 8.621 -19.868 2.092 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.094 -20.282 3.742 1.00 0.00 H new TER 2043 GLN A 131