USER MOD reduce.3.24.130724 H: found=0, std=0, add=927, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 924 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 61 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 64 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 58 MET CE :methyl 158:sc= -0.761 (180deg=-1.73!) USER MOD Set 2.2: A 68 LYS NZ :NH3+ 176:sc= -0.1 (180deg=-0.0691) USER MOD Set 3.1: A 8 THR OG1 : rot 140:sc= 0 USER MOD Set 3.2: A 11 MET CE :methyl 141:sc= -3.05! (180deg=-6.62!) USER MOD Single : A 1 GLY N :NH3+ -141:sc= -0.0773 (180deg=-0.886) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.125 K(o=-0.12,f=-1.2!) USER MOD Single : A 20 GLN : amide:sc= -7.26! C(o=-7.3!,f=-9.2!) USER MOD Single : A 21 LYS NZ :NH3+ 175:sc= 0.12 (180deg=0.119) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 MET CE :methyl -145:sc= -4.07! (180deg=-8.12!) USER MOD Single : A 33 GLN : amide:sc= -2.55! C(o=-2.6!,f=-3.5!) USER MOD Single : A 35 MET CE :methyl -175:sc= -6.41! (180deg=-6.86!) USER MOD Single : A 36 HIS : no HD1:sc= -2.55! C(o=-2.5!,f=-4!) USER MOD Single : A 38 THR OG1 : rot -160:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 165:sc= -9.12! (180deg=-9.55!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -1.65 USER MOD Single : A 46 MET CE :methyl -142:sc= -0.623 (180deg=-4.54!) USER MOD Single : A 52 ASN :FLIP amide:sc= -0.873 F(o=-1.6,f=-0.87) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.26) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.268 K(o=-0.27,f=-2.2) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.397 X(o=-0.4,f=-0.011) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.0102 X(o=-0.01,f=-0.15) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -39:sc= 1.07 USER MOD Single : A 97 THR OG1 : rot 180:sc=-0.00039 USER MOD Single : B 1 VAL N :NH3+ 177:sc= -0.419 (180deg=-0.448) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 SER OG : rot 180:sc=-0.00565 USER MOD Single : B 5 ASN :FLIP amide:sc= -0.844 F(o=-2.4!,f=-0.84) USER MOD Single : B 7 ASN :FLIP amide:sc= -0.776 F(o=-3.5!,f=-0.78) USER MOD Single : B 9 ASN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : B 11 LYS NZ :NH3+ -143:sc= 0.181 (180deg=-0.572!) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 114:sc= 0.0184 USER MOD Single : B 21 ASN : amide:sc= -0.262 K(o=-0.26,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.045 -18.003 -8.205 1.00 0.00 N ATOM 2 CA GLY A 1 -7.813 -17.478 -9.367 1.00 0.00 C ATOM 3 C GLY A 1 -6.915 -16.869 -10.429 1.00 0.00 C ATOM 4 O GLY A 1 -6.824 -15.646 -10.537 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.472 -18.894 -7.881 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.059 -18.174 -8.489 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.067 -17.308 -7.432 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.396 -18.286 -9.808 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.522 -16.726 -9.020 1.00 0.00 H new ATOM 10 N PRO A 2 -6.234 -17.704 -11.236 1.00 0.00 N ATOM 11 CA PRO A 2 -5.338 -17.225 -12.296 1.00 0.00 C ATOM 12 C PRO A 2 -6.042 -16.276 -13.260 1.00 0.00 C ATOM 13 O PRO A 2 -5.465 -15.281 -13.700 1.00 0.00 O ATOM 14 CB PRO A 2 -4.914 -18.507 -13.019 1.00 0.00 C ATOM 15 CG PRO A 2 -5.101 -19.590 -12.014 1.00 0.00 C ATOM 16 CD PRO A 2 -6.279 -19.178 -11.178 1.00 0.00 C ATOM 0 HA PRO A 2 -4.501 -16.655 -11.893 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.523 -18.681 -13.906 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -3.877 -18.450 -13.351 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -5.284 -20.548 -12.501 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -4.209 -19.711 -11.399 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -7.214 -19.568 -11.580 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -6.194 -19.544 -10.155 1.00 0.00 H new ATOM 24 N LEU A 3 -7.294 -16.589 -13.581 1.00 0.00 N ATOM 25 CA LEU A 3 -8.080 -15.764 -14.492 1.00 0.00 C ATOM 26 C LEU A 3 -8.514 -14.469 -13.816 1.00 0.00 C ATOM 27 O LEU A 3 -8.728 -13.453 -14.476 1.00 0.00 O ATOM 28 CB LEU A 3 -9.310 -16.535 -14.977 1.00 0.00 C ATOM 29 CG LEU A 3 -9.487 -16.580 -16.497 1.00 0.00 C ATOM 30 CD1 LEU A 3 -9.807 -17.995 -16.955 1.00 0.00 C ATOM 31 CD2 LEU A 3 -10.579 -15.615 -16.933 1.00 0.00 C ATOM 0 H LEU A 3 -7.786 -17.408 -13.224 1.00 0.00 H new ATOM 0 HA LEU A 3 -7.454 -15.514 -15.348 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -9.250 -17.557 -14.603 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -10.199 -16.085 -14.536 1.00 0.00 H new ATOM 0 HG LEU A 3 -8.551 -16.273 -16.964 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -9.930 -18.008 -18.038 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.992 -18.662 -16.674 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -10.730 -18.331 -16.482 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -10.692 -15.659 -18.016 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -11.520 -15.892 -16.458 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -10.308 -14.601 -16.638 1.00 0.00 H new ATOM 43 N GLY A 4 -8.643 -14.514 -12.493 1.00 0.00 N ATOM 44 CA GLY A 4 -9.050 -13.337 -11.745 1.00 0.00 C ATOM 45 C GLY A 4 -7.872 -12.479 -11.328 1.00 0.00 C ATOM 46 O GLY A 4 -7.226 -12.748 -10.315 1.00 0.00 O ATOM 0 H GLY A 4 -8.473 -15.344 -11.925 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.732 -12.742 -12.353 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.602 -13.647 -10.858 1.00 0.00 H new ATOM 50 N SER A 5 -7.592 -11.441 -12.112 1.00 0.00 N ATOM 51 CA SER A 5 -6.484 -10.538 -11.823 1.00 0.00 C ATOM 52 C SER A 5 -6.864 -9.504 -10.756 1.00 0.00 C ATOM 53 O SER A 5 -6.130 -9.321 -9.786 1.00 0.00 O ATOM 54 CB SER A 5 -6.022 -9.831 -13.100 1.00 0.00 C ATOM 55 OG SER A 5 -4.639 -10.038 -13.326 1.00 0.00 O ATOM 0 H SER A 5 -8.119 -11.205 -12.953 1.00 0.00 H new ATOM 0 HA SER A 5 -5.663 -11.139 -11.432 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.592 -10.202 -13.951 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.225 -8.763 -13.022 1.00 0.00 H new ATOM 0 HG SER A 5 -4.369 -9.578 -14.148 1.00 0.00 H new ATOM 61 N PRO A 6 -8.009 -8.802 -10.916 1.00 0.00 N ATOM 62 CA PRO A 6 -8.449 -7.790 -9.947 1.00 0.00 C ATOM 63 C PRO A 6 -8.625 -8.369 -8.547 1.00 0.00 C ATOM 64 O PRO A 6 -9.542 -9.151 -8.299 1.00 0.00 O ATOM 65 CB PRO A 6 -9.796 -7.306 -10.500 1.00 0.00 C ATOM 66 CG PRO A 6 -10.225 -8.357 -11.467 1.00 0.00 C ATOM 67 CD PRO A 6 -8.961 -8.931 -12.035 1.00 0.00 C ATOM 0 HA PRO A 6 -7.714 -6.992 -9.839 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -10.528 -7.184 -9.702 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -9.695 -6.338 -10.991 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -10.816 -9.127 -10.971 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -10.850 -7.933 -12.253 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -9.090 -9.970 -12.338 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -8.627 -8.381 -12.915 1.00 0.00 H new ATOM 75 N LEU A 7 -7.740 -7.974 -7.636 1.00 0.00 N ATOM 76 CA LEU A 7 -7.798 -8.448 -6.258 1.00 0.00 C ATOM 77 C LEU A 7 -8.569 -7.469 -5.380 1.00 0.00 C ATOM 78 O LEU A 7 -9.604 -7.814 -4.811 1.00 0.00 O ATOM 79 CB LEU A 7 -6.385 -8.640 -5.703 1.00 0.00 C ATOM 80 CG LEU A 7 -5.772 -10.019 -5.956 1.00 0.00 C ATOM 81 CD1 LEU A 7 -4.255 -9.928 -5.984 1.00 0.00 C ATOM 82 CD2 LEU A 7 -6.231 -11.009 -4.897 1.00 0.00 C ATOM 0 H LEU A 7 -6.975 -7.327 -7.828 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.318 -9.406 -6.251 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -5.733 -7.884 -6.140 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -6.406 -8.460 -4.628 1.00 0.00 H new ATOM 0 HG LEU A 7 -6.113 -10.376 -6.928 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -3.834 -10.917 -6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.946 -9.251 -6.780 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -3.895 -9.550 -5.027 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -5.785 -11.984 -5.093 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.920 -10.659 -3.913 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.317 -11.094 -4.925 1.00 0.00 H new ATOM 94 N THR A 8 -8.080 -6.236 -5.309 1.00 0.00 N ATOM 95 CA THR A 8 -8.717 -5.205 -4.503 1.00 0.00 C ATOM 96 C THR A 8 -9.782 -4.481 -5.313 1.00 0.00 C ATOM 97 O THR A 8 -10.804 -4.063 -4.771 1.00 0.00 O ATOM 98 CB THR A 8 -7.677 -4.208 -3.992 1.00 0.00 C ATOM 99 OG1 THR A 8 -8.277 -3.253 -3.135 1.00 0.00 O ATOM 100 CG2 THR A 8 -6.973 -3.455 -5.099 1.00 0.00 C ATOM 0 H THR A 8 -7.242 -5.927 -5.802 1.00 0.00 H new ATOM 0 HA THR A 8 -9.193 -5.683 -3.647 1.00 0.00 H new ATOM 0 HB THR A 8 -6.939 -4.808 -3.459 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.681 -3.072 -2.379 1.00 0.00 H new ATOM 0 HG21 THR A 8 -6.249 -2.765 -4.666 1.00 0.00 H new ATOM 0 HG22 THR A 8 -6.457 -4.162 -5.749 1.00 0.00 H new ATOM 0 HG23 THR A 8 -7.705 -2.895 -5.681 1.00 0.00 H new ATOM 108 N ALA A 9 -9.550 -4.358 -6.617 1.00 0.00 N ATOM 109 CA ALA A 9 -10.526 -3.741 -7.503 1.00 0.00 C ATOM 110 C ALA A 9 -11.833 -4.513 -7.433 1.00 0.00 C ATOM 111 O ALA A 9 -12.918 -3.938 -7.501 1.00 0.00 O ATOM 112 CB ALA A 9 -10.005 -3.697 -8.930 1.00 0.00 C ATOM 0 H ALA A 9 -8.698 -4.676 -7.080 1.00 0.00 H new ATOM 0 HA ALA A 9 -10.700 -2.715 -7.180 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -10.750 -3.232 -9.575 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -9.083 -3.116 -8.963 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -9.807 -4.711 -9.277 1.00 0.00 H new ATOM 118 N SER A 10 -11.710 -5.827 -7.260 1.00 0.00 N ATOM 119 CA SER A 10 -12.870 -6.689 -7.113 1.00 0.00 C ATOM 120 C SER A 10 -13.510 -6.456 -5.753 1.00 0.00 C ATOM 121 O SER A 10 -14.734 -6.464 -5.623 1.00 0.00 O ATOM 122 CB SER A 10 -12.467 -8.156 -7.266 1.00 0.00 C ATOM 123 OG SER A 10 -13.451 -8.885 -7.980 1.00 0.00 O ATOM 0 H SER A 10 -10.815 -6.314 -7.219 1.00 0.00 H new ATOM 0 HA SER A 10 -13.592 -6.449 -7.893 1.00 0.00 H new ATOM 0 HB2 SER A 10 -11.512 -8.221 -7.788 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.323 -8.601 -6.281 1.00 0.00 H new ATOM 0 HG SER A 10 -13.168 -9.819 -8.065 1.00 0.00 H new ATOM 129 N MET A 11 -12.674 -6.199 -4.747 1.00 0.00 N ATOM 130 CA MET A 11 -13.173 -5.915 -3.407 1.00 0.00 C ATOM 131 C MET A 11 -13.972 -4.623 -3.408 1.00 0.00 C ATOM 132 O MET A 11 -14.982 -4.513 -2.722 1.00 0.00 O ATOM 133 CB MET A 11 -12.029 -5.795 -2.400 1.00 0.00 C ATOM 134 CG MET A 11 -11.032 -6.941 -2.465 1.00 0.00 C ATOM 135 SD MET A 11 -10.472 -7.472 -0.835 1.00 0.00 S ATOM 136 CE MET A 11 -9.169 -6.285 -0.514 1.00 0.00 C ATOM 0 H MET A 11 -11.658 -6.182 -4.835 1.00 0.00 H new ATOM 0 HA MET A 11 -13.813 -6.747 -3.111 1.00 0.00 H new ATOM 0 HB2 MET A 11 -11.502 -4.857 -2.573 1.00 0.00 H new ATOM 0 HB3 MET A 11 -12.446 -5.745 -1.394 1.00 0.00 H new ATOM 0 HG2 MET A 11 -11.489 -7.786 -2.980 1.00 0.00 H new ATOM 0 HG3 MET A 11 -10.171 -6.634 -3.058 1.00 0.00 H new ATOM 0 HE1 MET A 11 -9.195 -5.991 0.535 1.00 0.00 H new ATOM 0 HE2 MET A 11 -8.203 -6.735 -0.741 1.00 0.00 H new ATOM 0 HE3 MET A 11 -9.315 -5.406 -1.141 1.00 0.00 H new ATOM 146 N LEU A 12 -13.506 -3.645 -4.181 1.00 0.00 N ATOM 147 CA LEU A 12 -14.184 -2.363 -4.280 1.00 0.00 C ATOM 148 C LEU A 12 -15.650 -2.575 -4.631 1.00 0.00 C ATOM 149 O LEU A 12 -16.544 -2.061 -3.958 1.00 0.00 O ATOM 150 CB LEU A 12 -13.502 -1.494 -5.342 1.00 0.00 C ATOM 151 CG LEU A 12 -12.011 -1.218 -5.106 1.00 0.00 C ATOM 152 CD1 LEU A 12 -11.473 -0.273 -6.170 1.00 0.00 C ATOM 153 CD2 LEU A 12 -11.777 -0.645 -3.714 1.00 0.00 C ATOM 0 H LEU A 12 -12.661 -3.720 -4.747 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.126 -1.853 -3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -13.616 -1.978 -6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -14.027 -0.540 -5.399 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.474 -2.164 -5.176 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.414 -0.087 -5.989 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.599 -0.724 -7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.019 0.669 -6.130 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.713 -0.458 -3.572 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -12.327 0.290 -3.608 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.124 -1.356 -2.965 1.00 0.00 H new ATOM 165 N ALA A 13 -15.886 -3.362 -5.674 1.00 0.00 N ATOM 166 CA ALA A 13 -17.240 -3.697 -6.092 1.00 0.00 C ATOM 167 C ALA A 13 -17.935 -4.552 -5.036 1.00 0.00 C ATOM 168 O ALA A 13 -19.162 -4.553 -4.931 1.00 0.00 O ATOM 169 CB ALA A 13 -17.211 -4.423 -7.429 1.00 0.00 C ATOM 0 H ALA A 13 -15.154 -3.781 -6.247 1.00 0.00 H new ATOM 0 HA ALA A 13 -17.805 -2.772 -6.207 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -18.229 -4.669 -7.732 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -16.753 -3.781 -8.182 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -16.630 -5.340 -7.332 1.00 0.00 H new ATOM 175 N SER A 14 -17.139 -5.287 -4.261 1.00 0.00 N ATOM 176 CA SER A 14 -17.671 -6.168 -3.226 1.00 0.00 C ATOM 177 C SER A 14 -17.549 -5.544 -1.838 1.00 0.00 C ATOM 178 O SER A 14 -17.653 -6.238 -0.826 1.00 0.00 O ATOM 179 CB SER A 14 -16.941 -7.512 -3.254 1.00 0.00 C ATOM 180 OG SER A 14 -17.854 -8.588 -3.386 1.00 0.00 O ATOM 0 H SER A 14 -16.121 -5.289 -4.332 1.00 0.00 H new ATOM 0 HA SER A 14 -18.730 -6.322 -3.435 1.00 0.00 H new ATOM 0 HB2 SER A 14 -16.234 -7.528 -4.083 1.00 0.00 H new ATOM 0 HB3 SER A 14 -16.362 -7.633 -2.339 1.00 0.00 H new ATOM 0 HG SER A 14 -17.361 -9.435 -3.403 1.00 0.00 H new ATOM 186 N ALA A 15 -17.356 -4.228 -1.792 1.00 0.00 N ATOM 187 CA ALA A 15 -17.229 -3.520 -0.524 1.00 0.00 C ATOM 188 C ALA A 15 -18.076 -2.243 -0.521 1.00 0.00 C ATOM 189 O ALA A 15 -17.552 -1.142 -0.342 1.00 0.00 O ATOM 190 CB ALA A 15 -15.771 -3.188 -0.252 1.00 0.00 C ATOM 0 H ALA A 15 -17.284 -3.633 -2.617 1.00 0.00 H new ATOM 0 HA ALA A 15 -17.597 -4.172 0.269 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.689 -2.659 0.698 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.191 -4.109 -0.206 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -15.386 -2.557 -1.053 1.00 0.00 H new ATOM 196 N PRO A 16 -19.406 -2.373 -0.715 1.00 0.00 N ATOM 197 CA PRO A 16 -20.319 -1.221 -0.773 1.00 0.00 C ATOM 198 C PRO A 16 -20.270 -0.320 0.470 1.00 0.00 C ATOM 199 O PRO A 16 -20.171 0.900 0.338 1.00 0.00 O ATOM 200 CB PRO A 16 -21.703 -1.861 -0.925 1.00 0.00 C ATOM 201 CG PRO A 16 -21.439 -3.203 -1.516 1.00 0.00 C ATOM 202 CD PRO A 16 -20.114 -3.646 -0.963 1.00 0.00 C ATOM 0 HA PRO A 16 -20.046 -0.552 -1.589 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -22.208 -1.945 0.037 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -22.346 -1.264 -1.571 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -22.227 -3.908 -1.251 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -21.410 -3.151 -2.604 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -20.234 -4.225 -0.047 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -19.574 -4.276 -1.670 1.00 0.00 H new ATOM 210 N PRO A 17 -20.367 -0.882 1.699 1.00 0.00 N ATOM 211 CA PRO A 17 -20.354 -0.074 2.927 1.00 0.00 C ATOM 212 C PRO A 17 -18.995 0.567 3.191 1.00 0.00 C ATOM 213 O PRO A 17 -18.169 0.685 2.286 1.00 0.00 O ATOM 214 CB PRO A 17 -20.691 -1.085 4.026 1.00 0.00 C ATOM 215 CG PRO A 17 -20.257 -2.398 3.477 1.00 0.00 C ATOM 216 CD PRO A 17 -20.499 -2.322 1.995 1.00 0.00 C ATOM 0 HA PRO A 17 -21.053 0.760 2.868 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -20.168 -0.851 4.953 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -21.757 -1.083 4.252 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -19.205 -2.583 3.692 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -20.823 -3.215 3.924 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -19.773 -2.915 1.439 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -21.487 -2.698 1.730 1.00 0.00 H new ATOM 224 N GLN A 18 -18.779 0.997 4.434 1.00 0.00 N ATOM 225 CA GLN A 18 -17.517 1.620 4.824 1.00 0.00 C ATOM 226 C GLN A 18 -16.412 0.575 4.928 1.00 0.00 C ATOM 227 O GLN A 18 -15.950 0.246 6.021 1.00 0.00 O ATOM 228 CB GLN A 18 -17.677 2.352 6.159 1.00 0.00 C ATOM 229 CG GLN A 18 -18.176 3.782 6.014 1.00 0.00 C ATOM 230 CD GLN A 18 -18.964 4.252 7.219 1.00 0.00 C ATOM 231 OE1 GLN A 18 -19.674 3.472 7.856 1.00 0.00 O ATOM 232 NE2 GLN A 18 -18.846 5.535 7.539 1.00 0.00 N ATOM 0 H GLN A 18 -19.463 0.925 5.187 1.00 0.00 H new ATOM 0 HA GLN A 18 -17.239 2.343 4.057 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -18.372 1.796 6.788 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -16.717 2.362 6.676 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -17.325 4.445 5.860 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -18.802 3.855 5.125 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -18.247 6.146 6.984 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -19.354 5.910 8.340 1.00 0.00 H new ATOM 241 N GLU A 19 -16.010 0.045 3.780 1.00 0.00 N ATOM 242 CA GLU A 19 -14.975 -0.976 3.723 1.00 0.00 C ATOM 243 C GLU A 19 -13.656 -0.391 3.231 1.00 0.00 C ATOM 244 O GLU A 19 -12.705 -1.125 2.969 1.00 0.00 O ATOM 245 CB GLU A 19 -15.420 -2.109 2.798 1.00 0.00 C ATOM 246 CG GLU A 19 -14.979 -3.490 3.252 1.00 0.00 C ATOM 247 CD GLU A 19 -15.819 -4.026 4.395 1.00 0.00 C ATOM 248 OE1 GLU A 19 -15.786 -3.424 5.489 1.00 0.00 O ATOM 249 OE2 GLU A 19 -16.510 -5.046 4.195 1.00 0.00 O ATOM 0 H GLU A 19 -16.389 0.309 2.870 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.820 -1.366 4.729 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.507 -2.094 2.720 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.026 -1.924 1.799 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -15.036 -4.180 2.410 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -13.935 -3.450 3.562 1.00 0.00 H new ATOM 256 N GLN A 20 -13.610 0.935 3.105 1.00 0.00 N ATOM 257 CA GLN A 20 -12.411 1.621 2.621 1.00 0.00 C ATOM 258 C GLN A 20 -11.158 1.106 3.321 1.00 0.00 C ATOM 259 O GLN A 20 -10.265 0.548 2.686 1.00 0.00 O ATOM 260 CB GLN A 20 -12.517 3.144 2.815 1.00 0.00 C ATOM 261 CG GLN A 20 -13.638 3.600 3.740 1.00 0.00 C ATOM 262 CD GLN A 20 -13.438 3.160 5.178 1.00 0.00 C ATOM 263 OE1 GLN A 20 -14.157 2.297 5.680 1.00 0.00 O ATOM 264 NE2 GLN A 20 -12.464 3.761 5.854 1.00 0.00 N ATOM 0 H GLN A 20 -14.388 1.555 3.331 1.00 0.00 H new ATOM 0 HA GLN A 20 -12.334 1.408 1.555 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -11.569 3.511 3.209 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -12.659 3.610 1.840 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -13.710 4.687 3.705 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -14.586 3.206 3.374 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -11.891 4.472 5.399 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -12.290 3.511 6.828 1.00 0.00 H new ATOM 273 N LYS A 21 -11.111 1.272 4.634 1.00 0.00 N ATOM 274 CA LYS A 21 -9.952 0.857 5.417 1.00 0.00 C ATOM 275 C LYS A 21 -9.633 -0.621 5.212 1.00 0.00 C ATOM 276 O LYS A 21 -8.499 -1.049 5.415 1.00 0.00 O ATOM 277 CB LYS A 21 -10.188 1.134 6.905 1.00 0.00 C ATOM 278 CG LYS A 21 -11.658 1.236 7.282 1.00 0.00 C ATOM 279 CD LYS A 21 -12.045 0.204 8.324 1.00 0.00 C ATOM 280 CE LYS A 21 -12.298 -1.157 7.699 1.00 0.00 C ATOM 281 NZ LYS A 21 -13.752 -1.437 7.549 1.00 0.00 N ATOM 0 H LYS A 21 -11.862 1.691 5.182 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.098 1.438 5.070 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.726 0.340 7.491 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.687 2.063 7.177 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.867 2.235 7.665 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.272 1.101 6.391 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.252 0.122 9.067 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.941 0.535 8.850 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.817 -1.203 6.722 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.841 -1.931 8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.882 -2.336 7.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.192 -1.502 8.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.200 -0.668 7.010 1.00 0.00 H new ATOM 295 N GLN A 22 -10.638 -1.403 4.839 1.00 0.00 N ATOM 296 CA GLN A 22 -10.445 -2.832 4.613 1.00 0.00 C ATOM 297 C GLN A 22 -9.682 -3.099 3.317 1.00 0.00 C ATOM 298 O GLN A 22 -8.500 -3.444 3.340 1.00 0.00 O ATOM 299 CB GLN A 22 -11.791 -3.557 4.580 1.00 0.00 C ATOM 300 CG GLN A 22 -11.688 -5.005 4.124 1.00 0.00 C ATOM 301 CD GLN A 22 -11.619 -5.978 5.284 1.00 0.00 C ATOM 302 OE1 GLN A 22 -10.544 -6.243 5.822 1.00 0.00 O ATOM 303 NE2 GLN A 22 -12.768 -6.514 5.676 1.00 0.00 N ATOM 0 H GLN A 22 -11.592 -1.075 4.687 1.00 0.00 H new ATOM 0 HA GLN A 22 -9.850 -3.215 5.442 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -12.235 -3.528 5.575 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -12.467 -3.021 3.914 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -12.549 -5.248 3.501 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -10.801 -5.124 3.502 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -13.635 -6.265 5.201 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -12.784 -7.175 6.453 1.00 0.00 H new ATOM 312 N MET A 23 -10.382 -2.981 2.193 1.00 0.00 N ATOM 313 CA MET A 23 -9.799 -3.281 0.888 1.00 0.00 C ATOM 314 C MET A 23 -8.734 -2.267 0.473 1.00 0.00 C ATOM 315 O MET A 23 -7.560 -2.403 0.817 1.00 0.00 O ATOM 316 CB MET A 23 -10.889 -3.355 -0.196 1.00 0.00 C ATOM 317 CG MET A 23 -12.229 -2.757 0.212 1.00 0.00 C ATOM 318 SD MET A 23 -12.234 -0.956 0.140 1.00 0.00 S ATOM 319 CE MET A 23 -13.667 -0.653 -0.890 1.00 0.00 C ATOM 0 H MET A 23 -11.356 -2.679 2.159 1.00 0.00 H new ATOM 0 HA MET A 23 -9.314 -4.252 0.985 1.00 0.00 H new ATOM 0 HB2 MET A 23 -10.532 -2.840 -1.088 1.00 0.00 H new ATOM 0 HB3 MET A 23 -11.040 -4.399 -0.470 1.00 0.00 H new ATOM 0 HG2 MET A 23 -13.010 -3.145 -0.441 1.00 0.00 H new ATOM 0 HG3 MET A 23 -12.472 -3.077 1.225 1.00 0.00 H new ATOM 0 HE1 MET A 23 -13.486 0.219 -1.518 1.00 0.00 H new ATOM 0 HE2 MET A 23 -13.852 -1.522 -1.521 1.00 0.00 H new ATOM 0 HE3 MET A 23 -14.537 -0.471 -0.259 1.00 0.00 H new ATOM 329 N LEU A 24 -9.154 -1.284 -0.315 1.00 0.00 N ATOM 330 CA LEU A 24 -8.253 -0.287 -0.881 1.00 0.00 C ATOM 331 C LEU A 24 -7.542 0.556 0.171 1.00 0.00 C ATOM 332 O LEU A 24 -6.753 1.437 -0.174 1.00 0.00 O ATOM 333 CB LEU A 24 -9.054 0.622 -1.827 1.00 0.00 C ATOM 334 CG LEU A 24 -9.560 1.953 -1.243 1.00 0.00 C ATOM 335 CD1 LEU A 24 -10.433 2.670 -2.259 1.00 0.00 C ATOM 336 CD2 LEU A 24 -10.329 1.743 0.048 1.00 0.00 C ATOM 0 H LEU A 24 -10.131 -1.156 -0.580 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.471 -0.823 -1.419 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -8.431 0.845 -2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.915 0.061 -2.190 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.689 2.568 -1.015 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.786 3.611 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -9.853 2.872 -3.159 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.288 2.042 -2.512 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.670 2.706 0.429 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.190 1.102 -0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.680 1.270 0.785 1.00 0.00 H new ATOM 348 N GLY A 25 -7.838 0.325 1.444 1.00 0.00 N ATOM 349 CA GLY A 25 -7.270 1.180 2.462 1.00 0.00 C ATOM 350 C GLY A 25 -7.813 2.571 2.276 1.00 0.00 C ATOM 351 O GLY A 25 -9.022 2.784 2.341 1.00 0.00 O ATOM 0 H GLY A 25 -8.446 -0.421 1.782 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -7.521 0.805 3.454 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -6.182 1.185 2.389 1.00 0.00 H new ATOM 355 N GLU A 26 -6.940 3.511 1.977 1.00 0.00 N ATOM 356 CA GLU A 26 -7.391 4.819 1.550 1.00 0.00 C ATOM 357 C GLU A 26 -7.858 4.698 0.101 1.00 0.00 C ATOM 358 O GLU A 26 -9.050 4.753 -0.200 1.00 0.00 O ATOM 359 CB GLU A 26 -6.275 5.857 1.675 1.00 0.00 C ATOM 360 CG GLU A 26 -6.508 6.872 2.782 1.00 0.00 C ATOM 361 CD GLU A 26 -6.508 6.243 4.160 1.00 0.00 C ATOM 362 OE1 GLU A 26 -5.809 5.227 4.349 1.00 0.00 O ATOM 363 OE2 GLU A 26 -7.206 6.768 5.053 1.00 0.00 O ATOM 0 H GLU A 26 -5.927 3.397 2.021 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.209 5.157 2.186 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.331 5.343 1.858 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.173 6.384 0.726 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -5.734 7.638 2.736 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.462 7.373 2.616 1.00 0.00 H new ATOM 370 N ARG A 27 -6.880 4.496 -0.776 1.00 0.00 N ATOM 371 CA ARG A 27 -7.100 4.258 -2.199 1.00 0.00 C ATOM 372 C ARG A 27 -5.851 3.592 -2.765 1.00 0.00 C ATOM 373 O ARG A 27 -5.664 3.482 -3.974 1.00 0.00 O ATOM 374 CB ARG A 27 -7.383 5.579 -2.927 1.00 0.00 C ATOM 375 CG ARG A 27 -7.673 5.431 -4.416 1.00 0.00 C ATOM 376 CD ARG A 27 -8.699 4.343 -4.691 1.00 0.00 C ATOM 377 NE ARG A 27 -9.234 4.424 -6.047 1.00 0.00 N ATOM 378 CZ ARG A 27 -10.505 4.183 -6.357 1.00 0.00 C ATOM 379 NH1 ARG A 27 -11.372 3.854 -5.408 1.00 0.00 N ATOM 380 NH2 ARG A 27 -10.911 4.276 -7.616 1.00 0.00 N ATOM 0 H ARG A 27 -5.894 4.493 -0.513 1.00 0.00 H new ATOM 0 HA ARG A 27 -7.966 3.611 -2.342 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -8.234 6.067 -2.451 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -6.525 6.240 -2.801 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.036 6.380 -4.811 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -6.748 5.199 -4.944 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -8.240 3.366 -4.540 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -9.516 4.426 -3.974 1.00 0.00 H new ATOM 0 HE ARG A 27 -8.596 4.680 -6.801 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -11.065 3.785 -4.438 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -12.346 3.670 -5.649 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -10.248 4.533 -8.348 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -11.886 4.091 -7.852 1.00 0.00 H new ATOM 394 N LEU A 28 -5.009 3.132 -1.845 1.00 0.00 N ATOM 395 CA LEU A 28 -3.696 2.588 -2.169 1.00 0.00 C ATOM 396 C LEU A 28 -3.745 1.415 -3.144 1.00 0.00 C ATOM 397 O LEU A 28 -3.414 1.567 -4.320 1.00 0.00 O ATOM 398 CB LEU A 28 -3.019 2.136 -0.872 1.00 0.00 C ATOM 399 CG LEU A 28 -2.130 3.176 -0.187 1.00 0.00 C ATOM 400 CD1 LEU A 28 -0.915 3.490 -1.044 1.00 0.00 C ATOM 401 CD2 LEU A 28 -2.921 4.438 0.114 1.00 0.00 C ATOM 0 H LEU A 28 -5.221 3.126 -0.847 1.00 0.00 H new ATOM 0 HA LEU A 28 -3.133 3.380 -2.663 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.793 1.828 -0.169 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.415 1.255 -1.088 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.779 2.761 0.758 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.296 4.232 -0.539 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.336 2.580 -1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.241 3.884 -2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.273 5.166 0.601 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.304 4.858 -0.816 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.755 4.196 0.773 1.00 0.00 H new ATOM 413 N PHE A 29 -4.080 0.238 -2.627 1.00 0.00 N ATOM 414 CA PHE A 29 -4.081 -0.995 -3.412 1.00 0.00 C ATOM 415 C PHE A 29 -4.533 -0.791 -4.867 1.00 0.00 C ATOM 416 O PHE A 29 -3.855 -1.246 -5.781 1.00 0.00 O ATOM 417 CB PHE A 29 -4.943 -2.059 -2.729 1.00 0.00 C ATOM 418 CG PHE A 29 -4.227 -3.365 -2.503 1.00 0.00 C ATOM 419 CD1 PHE A 29 -3.523 -3.978 -3.530 1.00 0.00 C ATOM 420 CD2 PHE A 29 -4.263 -3.982 -1.262 1.00 0.00 C ATOM 421 CE1 PHE A 29 -2.868 -5.176 -3.320 1.00 0.00 C ATOM 422 CE2 PHE A 29 -3.608 -5.178 -1.048 1.00 0.00 C ATOM 423 CZ PHE A 29 -2.917 -5.779 -2.081 1.00 0.00 C ATOM 0 H PHE A 29 -4.358 0.110 -1.654 1.00 0.00 H new ATOM 0 HA PHE A 29 -3.046 -1.334 -3.457 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.288 -1.673 -1.770 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -5.829 -2.241 -3.337 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -3.487 -3.513 -4.504 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -4.810 -3.521 -0.453 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -2.318 -5.640 -4.126 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -3.636 -5.643 -0.074 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.415 -6.721 -1.919 1.00 0.00 H new ATOM 433 N PRO A 30 -5.674 -0.111 -5.116 1.00 0.00 N ATOM 434 CA PRO A 30 -6.186 0.093 -6.484 1.00 0.00 C ATOM 435 C PRO A 30 -5.176 0.752 -7.424 1.00 0.00 C ATOM 436 O PRO A 30 -5.024 0.334 -8.575 1.00 0.00 O ATOM 437 CB PRO A 30 -7.390 1.013 -6.283 1.00 0.00 C ATOM 438 CG PRO A 30 -7.836 0.748 -4.891 1.00 0.00 C ATOM 439 CD PRO A 30 -6.586 0.458 -4.107 1.00 0.00 C ATOM 0 HA PRO A 30 -6.420 -0.860 -6.958 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -7.116 2.059 -6.419 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -8.180 0.794 -7.001 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.365 1.608 -4.480 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.524 -0.096 -4.855 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.175 1.362 -3.658 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -6.775 -0.244 -3.295 1.00 0.00 H new ATOM 447 N LEU A 31 -4.478 1.774 -6.936 1.00 0.00 N ATOM 448 CA LEU A 31 -3.512 2.487 -7.774 1.00 0.00 C ATOM 449 C LEU A 31 -2.296 1.617 -8.034 1.00 0.00 C ATOM 450 O LEU A 31 -1.856 1.463 -9.176 1.00 0.00 O ATOM 451 CB LEU A 31 -3.067 3.802 -7.126 1.00 0.00 C ATOM 452 CG LEU A 31 -3.916 4.276 -5.950 1.00 0.00 C ATOM 453 CD1 LEU A 31 -3.033 4.706 -4.790 1.00 0.00 C ATOM 454 CD2 LEU A 31 -4.831 5.410 -6.374 1.00 0.00 C ATOM 0 H LEU A 31 -4.559 2.124 -5.981 1.00 0.00 H new ATOM 0 HA LEU A 31 -4.007 2.718 -8.717 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.038 3.689 -6.786 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.067 4.581 -7.889 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.535 3.443 -5.618 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.658 5.040 -3.962 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.422 3.864 -4.466 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.386 5.523 -5.109 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -5.428 5.734 -5.522 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.231 6.245 -6.736 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.492 5.066 -7.170 1.00 0.00 H new ATOM 466 N ILE A 32 -1.761 1.035 -6.974 1.00 0.00 N ATOM 467 CA ILE A 32 -0.616 0.160 -7.104 1.00 0.00 C ATOM 468 C ILE A 32 -1.031 -1.150 -7.754 1.00 0.00 C ATOM 469 O ILE A 32 -0.190 -1.925 -8.196 1.00 0.00 O ATOM 470 CB ILE A 32 0.051 -0.131 -5.751 1.00 0.00 C ATOM 471 CG1 ILE A 32 -0.388 0.901 -4.706 1.00 0.00 C ATOM 472 CG2 ILE A 32 1.564 -0.130 -5.911 1.00 0.00 C ATOM 473 CD1 ILE A 32 0.247 0.710 -3.347 1.00 0.00 C ATOM 0 H ILE A 32 -2.101 1.154 -6.020 1.00 0.00 H new ATOM 0 HA ILE A 32 0.112 0.675 -7.731 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.261 -1.116 -5.404 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.145 1.899 -5.072 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.472 0.856 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.032 -0.337 -4.948 1.00 0.00 H new ATOM 0 HG22 ILE A 32 1.855 -0.898 -6.628 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.891 0.845 -6.271 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.115 1.479 -2.665 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.016 -0.273 -2.957 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.331 0.786 -3.438 1.00 0.00 H new ATOM 485 N GLN A 33 -2.338 -1.393 -7.812 1.00 0.00 N ATOM 486 CA GLN A 33 -2.852 -2.584 -8.472 1.00 0.00 C ATOM 487 C GLN A 33 -2.466 -2.526 -9.939 1.00 0.00 C ATOM 488 O GLN A 33 -2.023 -3.514 -10.523 1.00 0.00 O ATOM 489 CB GLN A 33 -4.369 -2.689 -8.317 1.00 0.00 C ATOM 490 CG GLN A 33 -4.995 -3.781 -9.172 1.00 0.00 C ATOM 491 CD GLN A 33 -6.393 -3.430 -9.647 1.00 0.00 C ATOM 492 OE1 GLN A 33 -7.215 -4.312 -9.892 1.00 0.00 O ATOM 493 NE2 GLN A 33 -6.670 -2.136 -9.789 1.00 0.00 N ATOM 0 H GLN A 33 -3.053 -0.785 -7.413 1.00 0.00 H new ATOM 0 HA GLN A 33 -2.419 -3.471 -8.009 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -4.607 -2.878 -7.270 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -4.820 -1.732 -8.578 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -4.359 -3.968 -10.037 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -5.033 -4.707 -8.599 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -5.960 -1.436 -9.575 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -7.593 -1.844 -10.112 1.00 0.00 H new ATOM 502 N ALA A 34 -2.574 -1.331 -10.507 1.00 0.00 N ATOM 503 CA ALA A 34 -2.136 -1.104 -11.874 1.00 0.00 C ATOM 504 C ALA A 34 -0.624 -1.286 -11.952 1.00 0.00 C ATOM 505 O ALA A 34 -0.086 -1.731 -12.965 1.00 0.00 O ATOM 506 CB ALA A 34 -2.539 0.287 -12.340 1.00 0.00 C ATOM 0 H ALA A 34 -2.960 -0.509 -10.043 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.617 -1.826 -12.534 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.203 0.439 -13.366 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.624 0.386 -12.296 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.080 1.035 -11.693 1.00 0.00 H new ATOM 512 N MET A 35 0.043 -0.974 -10.841 1.00 0.00 N ATOM 513 CA MET A 35 1.493 -1.120 -10.731 1.00 0.00 C ATOM 514 C MET A 35 1.842 -2.364 -9.920 1.00 0.00 C ATOM 515 O MET A 35 2.890 -2.429 -9.277 1.00 0.00 O ATOM 516 CB MET A 35 2.093 0.116 -10.062 1.00 0.00 C ATOM 517 CG MET A 35 1.435 1.408 -10.501 1.00 0.00 C ATOM 518 SD MET A 35 2.223 2.872 -9.813 1.00 0.00 S ATOM 519 CE MET A 35 0.783 3.870 -9.453 1.00 0.00 C ATOM 0 H MET A 35 -0.404 -0.615 -9.997 1.00 0.00 H new ATOM 0 HA MET A 35 1.909 -1.225 -11.733 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.000 0.017 -8.980 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.158 0.163 -10.288 1.00 0.00 H new ATOM 0 HG2 MET A 35 1.457 1.468 -11.589 1.00 0.00 H new ATOM 0 HG3 MET A 35 0.386 1.394 -10.204 1.00 0.00 H new ATOM 0 HE1 MET A 35 1.100 4.852 -9.101 1.00 0.00 H new ATOM 0 HE2 MET A 35 0.184 3.984 -10.357 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.187 3.383 -8.681 1.00 0.00 H new ATOM 529 N HIS A 36 0.941 -3.344 -9.947 1.00 0.00 N ATOM 530 CA HIS A 36 1.110 -4.572 -9.178 1.00 0.00 C ATOM 531 C HIS A 36 2.341 -5.385 -9.605 1.00 0.00 C ATOM 532 O HIS A 36 2.944 -6.045 -8.758 1.00 0.00 O ATOM 533 CB HIS A 36 -0.162 -5.423 -9.252 1.00 0.00 C ATOM 534 CG HIS A 36 -0.131 -6.505 -10.290 1.00 0.00 C ATOM 535 ND1 HIS A 36 -0.547 -6.272 -11.579 1.00 0.00 N ATOM 536 CD2 HIS A 36 0.256 -7.798 -10.177 1.00 0.00 C ATOM 537 CE1 HIS A 36 -0.397 -7.416 -12.221 1.00 0.00 C ATOM 538 NE2 HIS A 36 0.088 -8.369 -11.411 1.00 0.00 N ATOM 0 H HIS A 36 0.083 -3.309 -10.497 1.00 0.00 H new ATOM 0 HA HIS A 36 1.285 -4.277 -8.143 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -0.336 -5.878 -8.277 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -1.010 -4.768 -9.454 1.00 0.00 H new ATOM 0 HD2 HIS A 36 0.626 -8.285 -9.287 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -0.634 -7.565 -13.264 1.00 0.00 H new ATOM 0 HE2 HIS A 36 0.293 -9.335 -11.666 1.00 0.00 H new ATOM 546 N PRO A 37 2.744 -5.371 -10.906 1.00 0.00 N ATOM 547 CA PRO A 37 3.923 -6.110 -11.367 1.00 0.00 C ATOM 548 C PRO A 37 5.042 -6.115 -10.330 1.00 0.00 C ATOM 549 O PRO A 37 5.775 -7.096 -10.196 1.00 0.00 O ATOM 550 CB PRO A 37 4.338 -5.336 -12.611 1.00 0.00 C ATOM 551 CG PRO A 37 3.053 -4.844 -13.185 1.00 0.00 C ATOM 552 CD PRO A 37 2.109 -4.636 -12.023 1.00 0.00 C ATOM 0 HA PRO A 37 3.712 -7.163 -11.552 1.00 0.00 H new ATOM 0 HB2 PRO A 37 5.004 -4.510 -12.362 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.871 -5.973 -13.317 1.00 0.00 H new ATOM 0 HG2 PRO A 37 3.205 -3.913 -13.732 1.00 0.00 H new ATOM 0 HG3 PRO A 37 2.643 -5.566 -13.892 1.00 0.00 H new ATOM 0 HD2 PRO A 37 1.992 -3.578 -11.789 1.00 0.00 H new ATOM 0 HD3 PRO A 37 1.115 -5.025 -12.242 1.00 0.00 H new ATOM 560 N THR A 38 5.140 -5.026 -9.572 1.00 0.00 N ATOM 561 CA THR A 38 6.114 -4.930 -8.495 1.00 0.00 C ATOM 562 C THR A 38 5.618 -5.707 -7.277 1.00 0.00 C ATOM 563 O THR A 38 5.905 -6.896 -7.132 1.00 0.00 O ATOM 564 CB THR A 38 6.369 -3.466 -8.129 1.00 0.00 C ATOM 565 OG1 THR A 38 6.789 -2.732 -9.266 1.00 0.00 O ATOM 566 CG2 THR A 38 7.419 -3.289 -7.055 1.00 0.00 C ATOM 0 H THR A 38 4.555 -4.198 -9.686 1.00 0.00 H new ATOM 0 HA THR A 38 7.055 -5.364 -8.832 1.00 0.00 H new ATOM 0 HB THR A 38 5.418 -3.095 -7.747 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.243 -1.913 -8.977 1.00 0.00 H new ATOM 0 HG21 THR A 38 7.549 -2.227 -6.845 1.00 0.00 H new ATOM 0 HG22 THR A 38 7.101 -3.802 -6.147 1.00 0.00 H new ATOM 0 HG23 THR A 38 8.364 -3.710 -7.398 1.00 0.00 H new ATOM 574 N LEU A 39 4.853 -5.037 -6.415 1.00 0.00 N ATOM 575 CA LEU A 39 4.290 -5.684 -5.232 1.00 0.00 C ATOM 576 C LEU A 39 3.284 -4.776 -4.521 1.00 0.00 C ATOM 577 O LEU A 39 3.468 -4.431 -3.354 1.00 0.00 O ATOM 578 CB LEU A 39 5.404 -6.090 -4.265 1.00 0.00 C ATOM 579 CG LEU A 39 5.502 -7.591 -3.985 1.00 0.00 C ATOM 580 CD1 LEU A 39 6.948 -8.056 -4.065 1.00 0.00 C ATOM 581 CD2 LEU A 39 4.910 -7.918 -2.623 1.00 0.00 C ATOM 0 H LEU A 39 4.610 -4.051 -6.514 1.00 0.00 H new ATOM 0 HA LEU A 39 3.761 -6.577 -5.565 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.357 -5.748 -4.668 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.252 -5.569 -3.320 1.00 0.00 H new ATOM 0 HG LEU A 39 4.929 -8.121 -4.746 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.998 -9.126 -3.863 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.340 -7.856 -5.062 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.544 -7.519 -3.327 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.988 -8.990 -2.440 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.456 -7.377 -1.850 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.861 -7.622 -2.601 1.00 0.00 H new ATOM 593 N ALA A 40 2.212 -4.410 -5.226 1.00 0.00 N ATOM 594 CA ALA A 40 1.169 -3.549 -4.664 1.00 0.00 C ATOM 595 C ALA A 40 0.746 -4.017 -3.271 1.00 0.00 C ATOM 596 O ALA A 40 0.385 -3.208 -2.416 1.00 0.00 O ATOM 597 CB ALA A 40 -0.037 -3.517 -5.593 1.00 0.00 C ATOM 0 H ALA A 40 2.043 -4.697 -6.190 1.00 0.00 H new ATOM 0 HA ALA A 40 1.580 -2.544 -4.569 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.807 -2.874 -5.167 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.263 -3.128 -6.566 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -0.431 -4.526 -5.712 1.00 0.00 H new ATOM 603 N GLY A 41 0.808 -5.327 -3.060 1.00 0.00 N ATOM 604 CA GLY A 41 0.400 -5.920 -1.797 1.00 0.00 C ATOM 605 C GLY A 41 0.874 -5.170 -0.564 1.00 0.00 C ATOM 606 O GLY A 41 0.059 -4.650 0.194 1.00 0.00 O ATOM 0 H GLY A 41 1.139 -5.999 -3.752 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -0.688 -5.980 -1.774 1.00 0.00 H new ATOM 0 HA3 GLY A 41 0.777 -6.942 -1.752 1.00 0.00 H new ATOM 610 N LYS A 42 2.178 -5.180 -0.313 1.00 0.00 N ATOM 611 CA LYS A 42 2.720 -4.545 0.887 1.00 0.00 C ATOM 612 C LYS A 42 2.797 -3.024 0.755 1.00 0.00 C ATOM 613 O LYS A 42 2.708 -2.307 1.751 1.00 0.00 O ATOM 614 CB LYS A 42 4.105 -5.114 1.221 1.00 0.00 C ATOM 615 CG LYS A 42 4.716 -4.564 2.511 1.00 0.00 C ATOM 616 CD LYS A 42 3.679 -4.379 3.612 1.00 0.00 C ATOM 617 CE LYS A 42 3.959 -3.135 4.437 1.00 0.00 C ATOM 618 NZ LYS A 42 2.707 -2.501 4.927 1.00 0.00 N ATOM 0 H LYS A 42 2.875 -5.616 -0.916 1.00 0.00 H new ATOM 0 HA LYS A 42 2.032 -4.769 1.702 1.00 0.00 H new ATOM 0 HB2 LYS A 42 4.030 -6.198 1.302 1.00 0.00 H new ATOM 0 HB3 LYS A 42 4.781 -4.902 0.393 1.00 0.00 H new ATOM 0 HG2 LYS A 42 5.495 -5.243 2.859 1.00 0.00 H new ATOM 0 HG3 LYS A 42 5.196 -3.608 2.303 1.00 0.00 H new ATOM 0 HD2 LYS A 42 2.686 -4.307 3.169 1.00 0.00 H new ATOM 0 HD3 LYS A 42 3.676 -5.254 4.261 1.00 0.00 H new ATOM 0 HE2 LYS A 42 4.590 -3.397 5.287 1.00 0.00 H new ATOM 0 HE3 LYS A 42 4.517 -2.418 3.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 2.934 -1.821 5.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 2.239 -2.004 4.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 2.071 -3.233 5.302 1.00 0.00 H new ATOM 632 N ILE A 43 2.967 -2.533 -0.466 1.00 0.00 N ATOM 633 CA ILE A 43 3.082 -1.094 -0.693 1.00 0.00 C ATOM 634 C ILE A 43 1.902 -0.338 -0.084 1.00 0.00 C ATOM 635 O ILE A 43 2.096 0.608 0.679 1.00 0.00 O ATOM 636 CB ILE A 43 3.192 -0.749 -2.188 1.00 0.00 C ATOM 637 CG1 ILE A 43 4.270 -1.604 -2.855 1.00 0.00 C ATOM 638 CG2 ILE A 43 3.504 0.729 -2.362 1.00 0.00 C ATOM 639 CD1 ILE A 43 4.278 -1.494 -4.363 1.00 0.00 C ATOM 0 H ILE A 43 3.028 -3.103 -1.310 1.00 0.00 H new ATOM 0 HA ILE A 43 4.002 -0.780 -0.200 1.00 0.00 H new ATOM 0 HB ILE A 43 2.237 -0.964 -2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 43 5.246 -1.308 -2.472 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.120 -2.647 -2.575 1.00 0.00 H new ATOM 0 HG21 ILE A 43 3.580 0.962 -3.424 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.707 1.324 -1.916 1.00 0.00 H new ATOM 0 HG23 ILE A 43 4.449 0.962 -1.871 1.00 0.00 H new ATOM 0 HD11 ILE A 43 5.067 -2.126 -4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.315 -1.818 -4.757 1.00 0.00 H new ATOM 0 HD13 ILE A 43 4.458 -0.458 -4.651 1.00 0.00 H new ATOM 651 N THR A 44 0.683 -0.760 -0.415 1.00 0.00 N ATOM 652 CA THR A 44 -0.514 -0.129 0.129 1.00 0.00 C ATOM 653 C THR A 44 -0.390 0.025 1.641 1.00 0.00 C ATOM 654 O THR A 44 -0.649 1.094 2.192 1.00 0.00 O ATOM 655 CB THR A 44 -1.754 -0.961 -0.212 1.00 0.00 C ATOM 656 OG1 THR A 44 -2.916 -0.399 0.368 1.00 0.00 O ATOM 657 CG2 THR A 44 -1.665 -2.392 0.261 1.00 0.00 C ATOM 0 H THR A 44 0.500 -1.533 -1.055 1.00 0.00 H new ATOM 0 HA THR A 44 -0.619 0.859 -0.318 1.00 0.00 H new ATOM 0 HB THR A 44 -1.809 -0.952 -1.301 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.695 -0.946 0.135 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.576 -2.923 -0.014 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.808 -2.877 -0.206 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.547 -2.410 1.344 1.00 0.00 H new ATOM 665 N GLY A 45 0.056 -1.044 2.293 1.00 0.00 N ATOM 666 CA GLY A 45 0.213 -1.041 3.737 1.00 0.00 C ATOM 667 C GLY A 45 1.028 0.127 4.261 1.00 0.00 C ATOM 668 O GLY A 45 0.541 0.911 5.074 1.00 0.00 O ATOM 0 H GLY A 45 0.314 -1.921 1.842 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -0.773 -1.021 4.201 1.00 0.00 H new ATOM 0 HA3 GLY A 45 0.690 -1.972 4.043 1.00 0.00 H new ATOM 672 N MET A 46 2.281 0.223 3.828 1.00 0.00 N ATOM 673 CA MET A 46 3.166 1.286 4.298 1.00 0.00 C ATOM 674 C MET A 46 2.560 2.667 4.057 1.00 0.00 C ATOM 675 O MET A 46 2.471 3.481 4.976 1.00 0.00 O ATOM 676 CB MET A 46 4.543 1.194 3.626 1.00 0.00 C ATOM 677 CG MET A 46 4.557 0.393 2.333 1.00 0.00 C ATOM 678 SD MET A 46 5.699 -1.003 2.392 1.00 0.00 S ATOM 679 CE MET A 46 7.228 -0.182 2.834 1.00 0.00 C ATOM 0 H MET A 46 2.706 -0.417 3.157 1.00 0.00 H new ATOM 0 HA MET A 46 3.290 1.149 5.372 1.00 0.00 H new ATOM 0 HB2 MET A 46 4.901 2.202 3.419 1.00 0.00 H new ATOM 0 HB3 MET A 46 5.247 0.744 4.326 1.00 0.00 H new ATOM 0 HG2 MET A 46 3.552 0.026 2.127 1.00 0.00 H new ATOM 0 HG3 MET A 46 4.833 1.049 1.507 1.00 0.00 H new ATOM 0 HE1 MET A 46 8.057 -0.644 2.298 1.00 0.00 H new ATOM 0 HE2 MET A 46 7.165 0.873 2.566 1.00 0.00 H new ATOM 0 HE3 MET A 46 7.393 -0.274 3.907 1.00 0.00 H new ATOM 689 N LEU A 47 2.157 2.933 2.818 1.00 0.00 N ATOM 690 CA LEU A 47 1.584 4.230 2.465 1.00 0.00 C ATOM 691 C LEU A 47 0.113 4.332 2.864 1.00 0.00 C ATOM 692 O LEU A 47 -0.563 5.300 2.515 1.00 0.00 O ATOM 693 CB LEU A 47 1.736 4.489 0.962 1.00 0.00 C ATOM 694 CG LEU A 47 3.179 4.522 0.438 1.00 0.00 C ATOM 695 CD1 LEU A 47 4.109 5.204 1.432 1.00 0.00 C ATOM 696 CD2 LEU A 47 3.668 3.116 0.133 1.00 0.00 C ATOM 0 H LEU A 47 2.216 2.272 2.044 1.00 0.00 H new ATOM 0 HA LEU A 47 2.133 4.989 3.022 1.00 0.00 H new ATOM 0 HB2 LEU A 47 1.189 3.716 0.421 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.260 5.441 0.725 1.00 0.00 H new ATOM 0 HG LEU A 47 3.187 5.102 -0.485 1.00 0.00 H new ATOM 0 HD11 LEU A 47 5.124 5.213 1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.776 6.228 1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 47 4.094 4.660 2.376 1.00 0.00 H new ATOM 0 HD21 LEU A 47 4.692 3.159 -0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.636 2.514 1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.027 2.664 -0.624 1.00 0.00 H new ATOM 708 N LEU A 48 -0.381 3.337 3.598 1.00 0.00 N ATOM 709 CA LEU A 48 -1.773 3.342 4.044 1.00 0.00 C ATOM 710 C LEU A 48 -2.016 4.481 5.031 1.00 0.00 C ATOM 711 O LEU A 48 -3.158 4.849 5.303 1.00 0.00 O ATOM 712 CB LEU A 48 -2.139 2.001 4.692 1.00 0.00 C ATOM 713 CG LEU A 48 -3.514 1.430 4.322 1.00 0.00 C ATOM 714 CD1 LEU A 48 -4.533 2.537 4.114 1.00 0.00 C ATOM 715 CD2 LEU A 48 -3.415 0.567 3.078 1.00 0.00 C ATOM 0 H LEU A 48 0.157 2.523 3.895 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.407 3.493 3.170 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.378 1.269 4.421 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.096 2.119 5.775 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.852 0.812 5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.497 2.100 3.853 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.634 3.116 5.032 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.201 3.191 3.307 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.400 0.171 2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.047 1.168 2.247 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.727 -0.259 3.262 1.00 0.00 H new ATOM 727 N GLU A 49 -0.931 5.047 5.550 1.00 0.00 N ATOM 728 CA GLU A 49 -1.024 6.151 6.498 1.00 0.00 C ATOM 729 C GLU A 49 -1.285 7.469 5.773 1.00 0.00 C ATOM 730 O GLU A 49 -1.042 8.548 6.315 1.00 0.00 O ATOM 731 CB GLU A 49 0.261 6.249 7.321 1.00 0.00 C ATOM 732 CG GLU A 49 0.566 4.991 8.116 1.00 0.00 C ATOM 733 CD GLU A 49 0.531 5.226 9.614 1.00 0.00 C ATOM 734 OE1 GLU A 49 1.151 6.206 10.076 1.00 0.00 O ATOM 735 OE2 GLU A 49 -0.120 4.431 10.324 1.00 0.00 O ATOM 0 H GLU A 49 0.023 4.759 5.330 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.861 5.957 7.168 1.00 0.00 H new ATOM 0 HB2 GLU A 49 1.096 6.459 6.653 1.00 0.00 H new ATOM 0 HB3 GLU A 49 0.181 7.093 8.007 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.156 4.217 7.856 1.00 0.00 H new ATOM 0 HG3 GLU A 49 1.550 4.616 7.833 1.00 0.00 H new ATOM 742 N ILE A 50 -1.793 7.369 4.549 1.00 0.00 N ATOM 743 CA ILE A 50 -2.091 8.545 3.741 1.00 0.00 C ATOM 744 C ILE A 50 -3.464 9.119 4.104 1.00 0.00 C ATOM 745 O ILE A 50 -4.284 8.442 4.724 1.00 0.00 O ATOM 746 CB ILE A 50 -2.021 8.208 2.233 1.00 0.00 C ATOM 747 CG1 ILE A 50 -1.108 9.201 1.511 1.00 0.00 C ATOM 748 CG2 ILE A 50 -3.403 8.190 1.593 1.00 0.00 C ATOM 749 CD1 ILE A 50 -0.611 8.699 0.173 1.00 0.00 C ATOM 0 H ILE A 50 -2.007 6.482 4.094 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.337 9.303 3.955 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.604 7.206 2.136 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.647 10.136 1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.252 9.425 2.147 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.310 7.949 0.534 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.021 7.438 2.083 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.868 9.170 1.703 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.030 9.453 -0.283 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.044 7.779 0.317 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.461 8.502 -0.480 1.00 0.00 H new ATOM 761 N ASP A 51 -3.694 10.376 3.735 1.00 0.00 N ATOM 762 CA ASP A 51 -4.949 11.052 4.050 1.00 0.00 C ATOM 763 C ASP A 51 -6.122 10.456 3.281 1.00 0.00 C ATOM 764 O ASP A 51 -5.945 9.862 2.218 1.00 0.00 O ATOM 765 CB ASP A 51 -4.836 12.540 3.722 1.00 0.00 C ATOM 766 CG ASP A 51 -4.137 13.325 4.816 1.00 0.00 C ATOM 767 OD1 ASP A 51 -3.220 12.767 5.454 1.00 0.00 O ATOM 768 OD2 ASP A 51 -4.507 14.498 5.033 1.00 0.00 O ATOM 0 H ASP A 51 -3.027 10.948 3.217 1.00 0.00 H new ATOM 0 HA ASP A 51 -5.136 10.916 5.115 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -4.290 12.662 2.786 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -5.833 12.951 3.565 1.00 0.00 H new ATOM 773 N ASN A 52 -7.325 10.650 3.815 1.00 0.00 N ATOM 774 CA ASN A 52 -8.538 10.172 3.165 1.00 0.00 C ATOM 775 C ASN A 52 -8.983 11.160 2.091 1.00 0.00 C ATOM 776 O ASN A 52 -9.562 10.776 1.074 1.00 0.00 O ATOM 777 CB ASN A 52 -9.655 9.968 4.193 1.00 0.00 C ATOM 778 CG ASN A 52 -9.626 8.586 4.817 1.00 0.00 C ATOM 779 OD1 ASN A 52 -10.176 7.601 4.113 1.00 0.00 O flip ATOM 780 ND2 ASN A 52 -9.120 8.405 5.925 1.00 0.00 N flip ATOM 0 H ASN A 52 -7.484 11.136 4.698 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.324 9.213 2.694 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -9.564 10.719 4.978 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -10.620 10.125 3.712 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -8.708 9.189 6.432 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -9.112 7.471 6.336 1.00 0.00 H new ATOM 787 N SER A 53 -8.705 12.438 2.319 1.00 0.00 N ATOM 788 CA SER A 53 -9.033 13.469 1.345 1.00 0.00 C ATOM 789 C SER A 53 -8.065 13.397 0.173 1.00 0.00 C ATOM 790 O SER A 53 -8.418 13.695 -0.969 1.00 0.00 O ATOM 791 CB SER A 53 -8.983 14.856 1.991 1.00 0.00 C ATOM 792 OG SER A 53 -8.561 15.838 1.061 1.00 0.00 O ATOM 0 H SER A 53 -8.255 12.783 3.167 1.00 0.00 H new ATOM 0 HA SER A 53 -10.046 13.298 0.981 1.00 0.00 H new ATOM 0 HB2 SER A 53 -9.969 15.116 2.377 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.302 14.840 2.842 1.00 0.00 H new ATOM 0 HG SER A 53 -8.539 16.715 1.498 1.00 0.00 H new ATOM 798 N GLU A 54 -6.843 12.970 0.465 1.00 0.00 N ATOM 799 CA GLU A 54 -5.821 12.828 -0.557 1.00 0.00 C ATOM 800 C GLU A 54 -6.035 11.542 -1.349 1.00 0.00 C ATOM 801 O GLU A 54 -5.640 11.447 -2.510 1.00 0.00 O ATOM 802 CB GLU A 54 -4.424 12.849 0.080 1.00 0.00 C ATOM 803 CG GLU A 54 -3.789 11.477 0.252 1.00 0.00 C ATOM 804 CD GLU A 54 -2.566 11.292 -0.621 1.00 0.00 C ATOM 805 OE1 GLU A 54 -1.554 11.982 -0.378 1.00 0.00 O ATOM 806 OE2 GLU A 54 -2.618 10.457 -1.548 1.00 0.00 O ATOM 0 H GLU A 54 -6.538 12.716 1.405 1.00 0.00 H new ATOM 0 HA GLU A 54 -5.897 13.669 -1.246 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -3.767 13.465 -0.535 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -4.491 13.330 1.056 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.511 11.337 1.297 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.523 10.708 0.012 1.00 0.00 H new ATOM 813 N LEU A 55 -6.675 10.558 -0.718 1.00 0.00 N ATOM 814 CA LEU A 55 -6.938 9.279 -1.368 1.00 0.00 C ATOM 815 C LEU A 55 -7.820 9.471 -2.597 1.00 0.00 C ATOM 816 O LEU A 55 -7.500 8.983 -3.682 1.00 0.00 O ATOM 817 CB LEU A 55 -7.571 8.281 -0.380 1.00 0.00 C ATOM 818 CG LEU A 55 -9.104 8.300 -0.260 1.00 0.00 C ATOM 819 CD1 LEU A 55 -9.758 7.486 -1.368 1.00 0.00 C ATOM 820 CD2 LEU A 55 -9.533 7.767 1.096 1.00 0.00 C ATOM 0 H LEU A 55 -7.019 10.624 0.240 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.987 8.862 -1.698 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.266 7.276 -0.671 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.151 8.469 0.608 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.432 9.335 -0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.841 7.520 -1.254 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -9.482 7.902 -2.337 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.419 6.452 -1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -10.621 7.786 1.167 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.180 6.742 1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.107 8.389 1.883 1.00 0.00 H new ATOM 832 N LEU A 56 -8.919 10.197 -2.429 1.00 0.00 N ATOM 833 CA LEU A 56 -9.835 10.448 -3.534 1.00 0.00 C ATOM 834 C LEU A 56 -9.145 11.240 -4.635 1.00 0.00 C ATOM 835 O LEU A 56 -9.350 10.986 -5.820 1.00 0.00 O ATOM 836 CB LEU A 56 -11.073 11.201 -3.052 1.00 0.00 C ATOM 837 CG LEU A 56 -10.794 12.425 -2.182 1.00 0.00 C ATOM 838 CD1 LEU A 56 -10.912 13.701 -3.002 1.00 0.00 C ATOM 839 CD2 LEU A 56 -11.744 12.462 -0.995 1.00 0.00 C ATOM 0 H LEU A 56 -9.196 10.620 -1.543 1.00 0.00 H new ATOM 0 HA LEU A 56 -10.146 9.484 -3.936 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -11.647 11.518 -3.923 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -11.702 10.511 -2.489 1.00 0.00 H new ATOM 0 HG LEU A 56 -9.774 12.354 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.710 14.563 -2.366 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -10.191 13.676 -3.819 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -11.920 13.780 -3.410 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -11.531 13.340 -0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.772 12.509 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -11.610 11.563 -0.394 1.00 0.00 H new ATOM 851 N HIS A 57 -8.316 12.196 -4.233 1.00 0.00 N ATOM 852 CA HIS A 57 -7.589 13.022 -5.190 1.00 0.00 C ATOM 853 C HIS A 57 -6.647 12.173 -6.039 1.00 0.00 C ATOM 854 O HIS A 57 -6.224 12.591 -7.116 1.00 0.00 O ATOM 855 CB HIS A 57 -6.797 14.106 -4.457 1.00 0.00 C ATOM 856 CG HIS A 57 -6.432 15.269 -5.325 1.00 0.00 C ATOM 857 ND1 HIS A 57 -7.343 15.832 -6.187 1.00 0.00 N ATOM 858 CD2 HIS A 57 -5.255 15.932 -5.429 1.00 0.00 C ATOM 859 CE1 HIS A 57 -6.706 16.819 -6.792 1.00 0.00 C ATOM 860 NE2 HIS A 57 -5.439 16.916 -6.364 1.00 0.00 N ATOM 0 H HIS A 57 -8.131 12.418 -3.255 1.00 0.00 H new ATOM 0 HA HIS A 57 -8.316 13.495 -5.851 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -7.384 14.464 -3.611 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -5.886 13.667 -4.050 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -4.348 15.725 -4.881 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -7.149 17.465 -7.536 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -4.744 17.594 -6.676 1.00 0.00 H new ATOM 868 N MET A 58 -6.312 10.985 -5.542 1.00 0.00 N ATOM 869 CA MET A 58 -5.417 10.076 -6.257 1.00 0.00 C ATOM 870 C MET A 58 -6.141 9.382 -7.403 1.00 0.00 C ATOM 871 O MET A 58 -5.667 9.388 -8.540 1.00 0.00 O ATOM 872 CB MET A 58 -4.842 9.034 -5.296 1.00 0.00 C ATOM 873 CG MET A 58 -3.991 9.635 -4.191 1.00 0.00 C ATOM 874 SD MET A 58 -2.314 10.016 -4.730 1.00 0.00 S ATOM 875 CE MET A 58 -2.504 11.722 -5.243 1.00 0.00 C ATOM 0 H MET A 58 -6.646 10.628 -4.647 1.00 0.00 H new ATOM 0 HA MET A 58 -4.602 10.667 -6.675 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.662 8.473 -4.848 1.00 0.00 H new ATOM 0 HB3 MET A 58 -4.240 8.323 -5.861 1.00 0.00 H new ATOM 0 HG2 MET A 58 -4.467 10.546 -3.827 1.00 0.00 H new ATOM 0 HG3 MET A 58 -3.949 8.940 -3.352 1.00 0.00 H new ATOM 0 HE1 MET A 58 -1.533 12.216 -5.229 1.00 0.00 H new ATOM 0 HE2 MET A 58 -2.913 11.755 -6.253 1.00 0.00 H new ATOM 0 HE3 MET A 58 -3.182 12.234 -4.560 1.00 0.00 H new ATOM 885 N LEU A 59 -7.288 8.782 -7.103 1.00 0.00 N ATOM 886 CA LEU A 59 -8.077 8.100 -8.122 1.00 0.00 C ATOM 887 C LEU A 59 -8.581 9.095 -9.158 1.00 0.00 C ATOM 888 O LEU A 59 -9.099 8.709 -10.206 1.00 0.00 O ATOM 889 CB LEU A 59 -9.252 7.353 -7.486 1.00 0.00 C ATOM 890 CG LEU A 59 -10.209 8.222 -6.667 1.00 0.00 C ATOM 891 CD1 LEU A 59 -11.339 8.736 -7.544 1.00 0.00 C ATOM 892 CD2 LEU A 59 -10.758 7.441 -5.484 1.00 0.00 C ATOM 0 H LEU A 59 -7.691 8.754 -6.166 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.436 7.372 -8.620 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -9.819 6.861 -8.276 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -8.857 6.568 -6.841 1.00 0.00 H new ATOM 0 HG LEU A 59 -9.657 9.079 -6.282 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.011 9.352 -6.947 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -10.926 9.333 -8.357 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.891 7.892 -7.957 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.437 8.075 -4.913 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.297 6.565 -5.845 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -9.935 7.123 -4.845 1.00 0.00 H new ATOM 904 N GLU A 60 -8.420 10.379 -8.857 1.00 0.00 N ATOM 905 CA GLU A 60 -8.847 11.435 -9.763 1.00 0.00 C ATOM 906 C GLU A 60 -7.642 12.095 -10.431 1.00 0.00 C ATOM 907 O GLU A 60 -7.793 12.908 -11.343 1.00 0.00 O ATOM 908 CB GLU A 60 -9.680 12.479 -9.005 1.00 0.00 C ATOM 909 CG GLU A 60 -8.871 13.650 -8.464 1.00 0.00 C ATOM 910 CD GLU A 60 -9.301 14.977 -9.058 1.00 0.00 C ATOM 911 OE1 GLU A 60 -10.344 15.511 -8.625 1.00 0.00 O ATOM 912 OE2 GLU A 60 -8.595 15.483 -9.955 1.00 0.00 O ATOM 0 H GLU A 60 -7.996 10.712 -7.991 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.467 10.991 -10.542 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.453 12.863 -9.670 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.188 11.989 -8.175 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.976 13.690 -7.380 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -7.814 13.486 -8.676 1.00 0.00 H new ATOM 919 N SER A 61 -6.447 11.737 -9.968 1.00 0.00 N ATOM 920 CA SER A 61 -5.215 12.299 -10.510 1.00 0.00 C ATOM 921 C SER A 61 -4.290 11.203 -11.028 1.00 0.00 C ATOM 922 O SER A 61 -3.333 10.824 -10.355 1.00 0.00 O ATOM 923 CB SER A 61 -4.484 13.116 -9.441 1.00 0.00 C ATOM 924 OG SER A 61 -4.974 14.444 -9.386 1.00 0.00 O ATOM 0 H SER A 61 -6.307 11.060 -9.218 1.00 0.00 H new ATOM 0 HA SER A 61 -5.488 12.949 -11.342 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.607 12.640 -8.468 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.416 13.129 -9.657 1.00 0.00 H new ATOM 0 HG SER A 61 -4.491 14.942 -8.694 1.00 0.00 H new ATOM 930 N PRO A 62 -4.545 10.684 -12.239 1.00 0.00 N ATOM 931 CA PRO A 62 -3.701 9.645 -12.836 1.00 0.00 C ATOM 932 C PRO A 62 -2.244 10.084 -12.922 1.00 0.00 C ATOM 933 O PRO A 62 -1.329 9.269 -12.820 1.00 0.00 O ATOM 934 CB PRO A 62 -4.290 9.457 -14.238 1.00 0.00 C ATOM 935 CG PRO A 62 -5.688 9.964 -14.138 1.00 0.00 C ATOM 936 CD PRO A 62 -5.654 11.075 -13.128 1.00 0.00 C ATOM 0 HA PRO A 62 -3.697 8.729 -12.245 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -3.721 10.012 -14.983 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -4.270 8.409 -14.538 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -6.042 10.325 -15.104 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -6.369 9.172 -13.825 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -5.473 12.042 -13.598 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -6.596 11.156 -12.586 1.00 0.00 H new ATOM 944 N GLU A 63 -2.041 11.384 -13.124 1.00 0.00 N ATOM 945 CA GLU A 63 -0.700 11.950 -13.234 1.00 0.00 C ATOM 946 C GLU A 63 -0.042 12.124 -11.868 1.00 0.00 C ATOM 947 O GLU A 63 1.098 11.705 -11.662 1.00 0.00 O ATOM 948 CB GLU A 63 -0.759 13.299 -13.954 1.00 0.00 C ATOM 949 CG GLU A 63 -1.652 13.295 -15.184 1.00 0.00 C ATOM 950 CD GLU A 63 -0.934 13.780 -16.428 1.00 0.00 C ATOM 951 OE1 GLU A 63 -0.492 14.948 -16.441 1.00 0.00 O ATOM 952 OE2 GLU A 63 -0.813 12.991 -17.389 1.00 0.00 O ATOM 0 H GLU A 63 -2.793 12.068 -13.215 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.094 11.250 -13.810 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.117 14.057 -13.258 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.250 13.588 -14.249 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.024 12.285 -15.355 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.520 13.928 -15.000 1.00 0.00 H new ATOM 959 N SER A 64 -0.749 12.775 -10.948 1.00 0.00 N ATOM 960 CA SER A 64 -0.210 13.047 -9.619 1.00 0.00 C ATOM 961 C SER A 64 -0.067 11.770 -8.801 1.00 0.00 C ATOM 962 O SER A 64 0.998 11.485 -8.253 1.00 0.00 O ATOM 963 CB SER A 64 -1.114 14.034 -8.878 1.00 0.00 C ATOM 964 OG SER A 64 -1.320 15.211 -9.640 1.00 0.00 O ATOM 0 H SER A 64 -1.696 13.124 -11.098 1.00 0.00 H new ATOM 0 HA SER A 64 0.782 13.481 -9.746 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.074 13.563 -8.665 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.666 14.292 -7.919 1.00 0.00 H new ATOM 0 HG SER A 64 -1.902 15.824 -9.144 1.00 0.00 H new ATOM 970 N LEU A 65 -1.150 11.010 -8.722 1.00 0.00 N ATOM 971 CA LEU A 65 -1.172 9.776 -7.949 1.00 0.00 C ATOM 972 C LEU A 65 -0.097 8.801 -8.426 1.00 0.00 C ATOM 973 O LEU A 65 0.757 8.391 -7.642 1.00 0.00 O ATOM 974 CB LEU A 65 -2.574 9.147 -8.031 1.00 0.00 C ATOM 975 CG LEU A 65 -2.708 7.654 -7.679 1.00 0.00 C ATOM 976 CD1 LEU A 65 -2.539 6.799 -8.922 1.00 0.00 C ATOM 977 CD2 LEU A 65 -1.735 7.228 -6.588 1.00 0.00 C ATOM 0 H LEU A 65 -2.031 11.228 -9.187 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.949 10.008 -6.908 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.233 9.709 -7.369 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.946 9.287 -9.046 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.712 7.502 -7.282 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -2.637 5.747 -8.656 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.306 7.061 -9.651 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -1.553 6.974 -9.353 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.868 6.167 -6.375 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.713 7.405 -6.923 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.926 7.806 -5.684 1.00 0.00 H new ATOM 989 N ARG A 66 -0.154 8.407 -9.694 1.00 0.00 N ATOM 990 CA ARG A 66 0.805 7.443 -10.224 1.00 0.00 C ATOM 991 C ARG A 66 2.237 7.851 -9.889 1.00 0.00 C ATOM 992 O ARG A 66 3.094 7.000 -9.660 1.00 0.00 O ATOM 993 CB ARG A 66 0.642 7.286 -11.735 1.00 0.00 C ATOM 994 CG ARG A 66 1.112 5.934 -12.251 1.00 0.00 C ATOM 995 CD ARG A 66 2.402 6.057 -13.043 1.00 0.00 C ATOM 996 NE ARG A 66 2.181 5.905 -14.479 1.00 0.00 N ATOM 997 CZ ARG A 66 2.950 5.164 -15.270 1.00 0.00 C ATOM 998 NH1 ARG A 66 3.988 4.508 -14.768 1.00 0.00 N ATOM 999 NH2 ARG A 66 2.682 5.077 -16.565 1.00 0.00 N ATOM 0 H ARG A 66 -0.846 8.736 -10.368 1.00 0.00 H new ATOM 0 HA ARG A 66 0.602 6.482 -9.751 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.407 7.423 -11.997 1.00 0.00 H new ATOM 0 HB3 ARG A 66 1.202 8.074 -12.238 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.263 5.256 -11.411 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.338 5.495 -12.880 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.856 7.028 -12.847 1.00 0.00 H new ATOM 0 HD3 ARG A 66 3.109 5.300 -12.703 1.00 0.00 H new ATOM 0 HE ARG A 66 1.391 6.396 -14.899 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.198 4.571 -13.772 1.00 0.00 H new ATOM 0 HH12 ARG A 66 4.576 3.940 -15.378 1.00 0.00 H new ATOM 0 HH21 ARG A 66 1.885 5.579 -16.956 1.00 0.00 H new ATOM 0 HH22 ARG A 66 3.273 4.508 -17.171 1.00 0.00 H new ATOM 1013 N SER A 67 2.482 9.158 -9.843 1.00 0.00 N ATOM 1014 CA SER A 67 3.802 9.674 -9.496 1.00 0.00 C ATOM 1015 C SER A 67 4.114 9.384 -8.032 1.00 0.00 C ATOM 1016 O SER A 67 5.238 9.026 -7.678 1.00 0.00 O ATOM 1017 CB SER A 67 3.866 11.180 -9.751 1.00 0.00 C ATOM 1018 OG SER A 67 5.208 11.632 -9.810 1.00 0.00 O ATOM 0 H SER A 67 1.786 9.877 -10.041 1.00 0.00 H new ATOM 0 HA SER A 67 4.543 9.177 -10.122 1.00 0.00 H new ATOM 0 HB2 SER A 67 3.359 11.415 -10.687 1.00 0.00 H new ATOM 0 HB3 SER A 67 3.336 11.709 -8.959 1.00 0.00 H new ATOM 0 HG SER A 67 5.221 12.598 -9.975 1.00 0.00 H new ATOM 1024 N LYS A 68 3.097 9.519 -7.190 1.00 0.00 N ATOM 1025 CA LYS A 68 3.242 9.257 -5.769 1.00 0.00 C ATOM 1026 C LYS A 68 3.528 7.781 -5.527 1.00 0.00 C ATOM 1027 O LYS A 68 4.569 7.423 -4.977 1.00 0.00 O ATOM 1028 CB LYS A 68 1.975 9.675 -5.023 1.00 0.00 C ATOM 1029 CG LYS A 68 2.191 9.872 -3.533 1.00 0.00 C ATOM 1030 CD LYS A 68 1.721 11.243 -3.078 1.00 0.00 C ATOM 1031 CE LYS A 68 0.223 11.260 -2.823 1.00 0.00 C ATOM 1032 NZ LYS A 68 -0.336 12.638 -2.891 1.00 0.00 N ATOM 0 H LYS A 68 2.161 9.810 -7.471 1.00 0.00 H new ATOM 0 HA LYS A 68 4.082 9.841 -5.393 1.00 0.00 H new ATOM 0 HB2 LYS A 68 1.598 10.602 -5.454 1.00 0.00 H new ATOM 0 HB3 LYS A 68 1.206 8.917 -5.174 1.00 0.00 H new ATOM 0 HG2 LYS A 68 1.654 9.101 -2.981 1.00 0.00 H new ATOM 0 HG3 LYS A 68 3.249 9.753 -3.299 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.250 11.527 -2.168 1.00 0.00 H new ATOM 0 HD3 LYS A 68 1.971 11.985 -3.836 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.277 10.629 -3.557 1.00 0.00 H new ATOM 0 HE3 LYS A 68 0.017 10.833 -1.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -1.369 12.599 -2.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.073 13.217 -2.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.103 13.062 -3.812 1.00 0.00 H new ATOM 1046 N VAL A 69 2.611 6.925 -5.968 1.00 0.00 N ATOM 1047 CA VAL A 69 2.781 5.485 -5.818 1.00 0.00 C ATOM 1048 C VAL A 69 4.008 5.008 -6.590 1.00 0.00 C ATOM 1049 O VAL A 69 4.562 3.949 -6.303 1.00 0.00 O ATOM 1050 CB VAL A 69 1.526 4.712 -6.274 1.00 0.00 C ATOM 1051 CG1 VAL A 69 1.814 3.225 -6.414 1.00 0.00 C ATOM 1052 CG2 VAL A 69 0.387 4.936 -5.294 1.00 0.00 C ATOM 0 H VAL A 69 1.746 7.203 -6.431 1.00 0.00 H new ATOM 0 HA VAL A 69 2.929 5.281 -4.758 1.00 0.00 H new ATOM 0 HB VAL A 69 1.234 5.092 -7.253 1.00 0.00 H new ATOM 0 HG11 VAL A 69 0.910 2.708 -6.737 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.601 3.075 -7.153 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.137 2.825 -5.453 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -0.493 4.385 -5.627 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.683 4.584 -4.306 1.00 0.00 H new ATOM 0 HG23 VAL A 69 0.153 5.999 -5.245 1.00 0.00 H new ATOM 1062 N ASP A 70 4.461 5.818 -7.546 1.00 0.00 N ATOM 1063 CA ASP A 70 5.671 5.496 -8.291 1.00 0.00 C ATOM 1064 C ASP A 70 6.812 5.269 -7.310 1.00 0.00 C ATOM 1065 O ASP A 70 7.503 4.251 -7.357 1.00 0.00 O ATOM 1066 CB ASP A 70 6.028 6.624 -9.257 1.00 0.00 C ATOM 1067 CG ASP A 70 7.384 6.425 -9.907 1.00 0.00 C ATOM 1068 OD1 ASP A 70 7.552 5.427 -10.639 1.00 0.00 O ATOM 1069 OD2 ASP A 70 8.279 7.267 -9.682 1.00 0.00 O ATOM 0 H ASP A 70 4.012 6.692 -7.819 1.00 0.00 H new ATOM 0 HA ASP A 70 5.500 4.592 -8.875 1.00 0.00 H new ATOM 0 HB2 ASP A 70 5.264 6.690 -10.031 1.00 0.00 H new ATOM 0 HB3 ASP A 70 6.022 7.573 -8.721 1.00 0.00 H new ATOM 1074 N GLU A 71 6.960 6.204 -6.379 1.00 0.00 N ATOM 1075 CA GLU A 71 7.963 6.081 -5.332 1.00 0.00 C ATOM 1076 C GLU A 71 7.583 4.953 -4.382 1.00 0.00 C ATOM 1077 O GLU A 71 8.444 4.337 -3.756 1.00 0.00 O ATOM 1078 CB GLU A 71 8.089 7.393 -4.556 1.00 0.00 C ATOM 1079 CG GLU A 71 9.336 7.469 -3.690 1.00 0.00 C ATOM 1080 CD GLU A 71 9.705 8.893 -3.321 1.00 0.00 C ATOM 1081 OE1 GLU A 71 8.789 9.679 -2.998 1.00 0.00 O ATOM 1082 OE2 GLU A 71 10.909 9.221 -3.352 1.00 0.00 O ATOM 0 H GLU A 71 6.398 7.054 -6.329 1.00 0.00 H new ATOM 0 HA GLU A 71 8.924 5.855 -5.794 1.00 0.00 H new ATOM 0 HB2 GLU A 71 8.095 8.224 -5.262 1.00 0.00 H new ATOM 0 HB3 GLU A 71 7.210 7.518 -3.924 1.00 0.00 H new ATOM 0 HG2 GLU A 71 9.177 6.891 -2.779 1.00 0.00 H new ATOM 0 HG3 GLU A 71 10.170 7.007 -4.219 1.00 0.00 H new ATOM 1089 N ALA A 72 6.282 4.686 -4.293 1.00 0.00 N ATOM 1090 CA ALA A 72 5.765 3.633 -3.426 1.00 0.00 C ATOM 1091 C ALA A 72 6.264 2.260 -3.868 1.00 0.00 C ATOM 1092 O ALA A 72 6.732 1.475 -3.047 1.00 0.00 O ATOM 1093 CB ALA A 72 4.247 3.675 -3.394 1.00 0.00 C ATOM 0 H ALA A 72 5.564 5.188 -4.815 1.00 0.00 H new ATOM 0 HA ALA A 72 6.137 3.809 -2.417 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.875 2.884 -2.743 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.918 4.642 -3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.858 3.529 -4.402 1.00 0.00 H new ATOM 1099 N VAL A 73 6.178 1.974 -5.166 1.00 0.00 N ATOM 1100 CA VAL A 73 6.675 0.705 -5.683 1.00 0.00 C ATOM 1101 C VAL A 73 8.166 0.588 -5.388 1.00 0.00 C ATOM 1102 O VAL A 73 8.693 -0.507 -5.187 1.00 0.00 O ATOM 1103 CB VAL A 73 6.432 0.544 -7.202 1.00 0.00 C ATOM 1104 CG1 VAL A 73 5.008 0.944 -7.572 1.00 0.00 C ATOM 1105 CG2 VAL A 73 7.447 1.343 -8.008 1.00 0.00 C ATOM 0 H VAL A 73 5.775 2.595 -5.868 1.00 0.00 H new ATOM 0 HA VAL A 73 6.122 -0.090 -5.183 1.00 0.00 H new ATOM 0 HB VAL A 73 6.562 -0.509 -7.450 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.863 0.822 -8.645 1.00 0.00 H new ATOM 0 HG12 VAL A 73 4.301 0.311 -7.036 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.840 1.986 -7.300 1.00 0.00 H new ATOM 0 HG21 VAL A 73 7.252 1.211 -9.072 1.00 0.00 H new ATOM 0 HG22 VAL A 73 7.364 2.399 -7.752 1.00 0.00 H new ATOM 0 HG23 VAL A 73 8.453 0.992 -7.777 1.00 0.00 H new ATOM 1115 N ALA A 74 8.826 1.741 -5.318 1.00 0.00 N ATOM 1116 CA ALA A 74 10.251 1.798 -5.019 1.00 0.00 C ATOM 1117 C ALA A 74 10.522 1.422 -3.564 1.00 0.00 C ATOM 1118 O ALA A 74 11.493 0.724 -3.271 1.00 0.00 O ATOM 1119 CB ALA A 74 10.804 3.184 -5.321 1.00 0.00 C ATOM 0 H ALA A 74 8.392 2.652 -5.465 1.00 0.00 H new ATOM 0 HA ALA A 74 10.758 1.073 -5.656 1.00 0.00 H new ATOM 0 HB1 ALA A 74 11.869 3.209 -5.092 1.00 0.00 H new ATOM 0 HB2 ALA A 74 10.654 3.414 -6.376 1.00 0.00 H new ATOM 0 HB3 ALA A 74 10.285 3.924 -4.712 1.00 0.00 H new ATOM 1125 N VAL A 75 9.663 1.887 -2.653 1.00 0.00 N ATOM 1126 CA VAL A 75 9.816 1.566 -1.235 1.00 0.00 C ATOM 1127 C VAL A 75 9.856 0.053 -1.049 1.00 0.00 C ATOM 1128 O VAL A 75 10.592 -0.465 -0.210 1.00 0.00 O ATOM 1129 CB VAL A 75 8.689 2.176 -0.363 1.00 0.00 C ATOM 1130 CG1 VAL A 75 8.218 3.500 -0.941 1.00 0.00 C ATOM 1131 CG2 VAL A 75 7.519 1.211 -0.208 1.00 0.00 C ATOM 0 H VAL A 75 8.863 2.481 -2.870 1.00 0.00 H new ATOM 0 HA VAL A 75 10.755 2.008 -0.902 1.00 0.00 H new ATOM 0 HB VAL A 75 9.102 2.359 0.629 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.427 3.910 -0.313 1.00 0.00 H new ATOM 0 HG12 VAL A 75 9.053 4.200 -0.976 1.00 0.00 H new ATOM 0 HG13 VAL A 75 7.835 3.341 -1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 75 6.747 1.671 0.409 1.00 0.00 H new ATOM 0 HG22 VAL A 75 7.107 0.978 -1.190 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.865 0.293 0.268 1.00 0.00 H new ATOM 1141 N LEU A 76 9.079 -0.645 -1.872 1.00 0.00 N ATOM 1142 CA LEU A 76 9.047 -2.099 -1.850 1.00 0.00 C ATOM 1143 C LEU A 76 10.365 -2.650 -2.371 1.00 0.00 C ATOM 1144 O LEU A 76 10.964 -3.536 -1.764 1.00 0.00 O ATOM 1145 CB LEU A 76 7.883 -2.612 -2.706 1.00 0.00 C ATOM 1146 CG LEU A 76 7.685 -4.133 -2.721 1.00 0.00 C ATOM 1147 CD1 LEU A 76 8.603 -4.786 -3.743 1.00 0.00 C ATOM 1148 CD2 LEU A 76 7.905 -4.730 -1.337 1.00 0.00 C ATOM 0 H LEU A 76 8.461 -0.222 -2.565 1.00 0.00 H new ATOM 0 HA LEU A 76 8.902 -2.438 -0.824 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.963 -2.148 -2.350 1.00 0.00 H new ATOM 0 HB3 LEU A 76 8.034 -2.274 -3.731 1.00 0.00 H new ATOM 0 HG LEU A 76 6.654 -4.333 -3.011 1.00 0.00 H new ATOM 0 HD11 LEU A 76 8.446 -5.865 -3.737 1.00 0.00 H new ATOM 0 HD12 LEU A 76 8.381 -4.393 -4.735 1.00 0.00 H new ATOM 0 HD13 LEU A 76 9.641 -4.569 -3.491 1.00 0.00 H new ATOM 0 HD21 LEU A 76 7.758 -5.809 -1.379 1.00 0.00 H new ATOM 0 HD22 LEU A 76 8.921 -4.515 -1.005 1.00 0.00 H new ATOM 0 HD23 LEU A 76 7.194 -4.294 -0.635 1.00 0.00 H new ATOM 1160 N GLN A 77 10.810 -2.106 -3.499 1.00 0.00 N ATOM 1161 CA GLN A 77 12.075 -2.510 -4.098 1.00 0.00 C ATOM 1162 C GLN A 77 13.195 -2.435 -3.065 1.00 0.00 C ATOM 1163 O GLN A 77 14.095 -3.274 -3.044 1.00 0.00 O ATOM 1164 CB GLN A 77 12.405 -1.617 -5.298 1.00 0.00 C ATOM 1165 CG GLN A 77 11.754 -2.069 -6.597 1.00 0.00 C ATOM 1166 CD GLN A 77 12.351 -3.355 -7.136 1.00 0.00 C ATOM 1167 OE1 GLN A 77 13.207 -3.973 -6.502 1.00 0.00 O ATOM 1168 NE2 GLN A 77 11.905 -3.763 -8.319 1.00 0.00 N ATOM 0 H GLN A 77 10.311 -1.383 -4.017 1.00 0.00 H new ATOM 0 HA GLN A 77 11.983 -3.540 -4.443 1.00 0.00 H new ATOM 0 HB2 GLN A 77 12.087 -0.598 -5.079 1.00 0.00 H new ATOM 0 HB3 GLN A 77 13.486 -1.592 -5.434 1.00 0.00 H new ATOM 0 HG2 GLN A 77 10.686 -2.210 -6.433 1.00 0.00 H new ATOM 0 HG3 GLN A 77 11.861 -1.283 -7.344 1.00 0.00 H new ATOM 0 HE21 GLN A 77 11.195 -3.221 -8.811 1.00 0.00 H new ATOM 0 HE22 GLN A 77 12.273 -4.618 -8.735 1.00 0.00 H new ATOM 1177 N ALA A 78 13.116 -1.428 -2.199 1.00 0.00 N ATOM 1178 CA ALA A 78 14.097 -1.251 -1.135 1.00 0.00 C ATOM 1179 C ALA A 78 13.778 -2.161 0.047 1.00 0.00 C ATOM 1180 O ALA A 78 14.669 -2.554 0.800 1.00 0.00 O ATOM 1181 CB ALA A 78 14.140 0.205 -0.692 1.00 0.00 C ATOM 0 H ALA A 78 12.381 -0.721 -2.214 1.00 0.00 H new ATOM 0 HA ALA A 78 15.079 -1.525 -1.521 1.00 0.00 H new ATOM 0 HB1 ALA A 78 14.877 0.322 0.103 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.416 0.835 -1.538 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.158 0.502 -0.323 1.00 0.00 H new ATOM 1187 N HIS A 79 12.497 -2.489 0.204 1.00 0.00 N ATOM 1188 CA HIS A 79 12.055 -3.364 1.285 1.00 0.00 C ATOM 1189 C HIS A 79 12.649 -4.758 1.120 1.00 0.00 C ATOM 1190 O HIS A 79 13.139 -5.352 2.079 1.00 0.00 O ATOM 1191 CB HIS A 79 10.524 -3.444 1.313 1.00 0.00 C ATOM 1192 CG HIS A 79 9.988 -4.470 2.264 1.00 0.00 C ATOM 1193 ND1 HIS A 79 10.010 -4.268 3.625 1.00 0.00 N ATOM 1194 CD2 HIS A 79 9.430 -5.679 2.005 1.00 0.00 C ATOM 1195 CE1 HIS A 79 9.470 -5.350 4.159 1.00 0.00 C ATOM 1196 NE2 HIS A 79 9.105 -6.231 3.217 1.00 0.00 N ATOM 0 H HIS A 79 11.747 -2.161 -0.405 1.00 0.00 H new ATOM 0 HA HIS A 79 12.403 -2.946 2.230 1.00 0.00 H new ATOM 0 HB2 HIS A 79 10.124 -2.467 1.584 1.00 0.00 H new ATOM 0 HB3 HIS A 79 10.163 -3.669 0.309 1.00 0.00 H new ATOM 0 HD2 HIS A 79 9.272 -6.121 1.032 1.00 0.00 H new ATOM 0 HE1 HIS A 79 9.339 -5.505 5.220 1.00 0.00 H new ATOM 0 HE2 HIS A 79 8.668 -7.140 3.372 1.00 0.00 H new ATOM 1204 N GLN A 80 12.612 -5.265 -0.109 1.00 0.00 N ATOM 1205 CA GLN A 80 13.152 -6.584 -0.412 1.00 0.00 C ATOM 1206 C GLN A 80 14.666 -6.602 -0.240 1.00 0.00 C ATOM 1207 O GLN A 80 15.273 -7.663 -0.098 1.00 0.00 O ATOM 1208 CB GLN A 80 12.786 -6.987 -1.841 1.00 0.00 C ATOM 1209 CG GLN A 80 12.083 -8.330 -1.937 1.00 0.00 C ATOM 1210 CD GLN A 80 11.660 -8.667 -3.354 1.00 0.00 C ATOM 1211 OE1 GLN A 80 12.065 -8.004 -4.309 1.00 0.00 O ATOM 1212 NE2 GLN A 80 10.840 -9.701 -3.497 1.00 0.00 N ATOM 0 H GLN A 80 12.212 -4.780 -0.912 1.00 0.00 H new ATOM 0 HA GLN A 80 12.716 -7.300 0.285 1.00 0.00 H new ATOM 0 HB2 GLN A 80 12.143 -6.219 -2.272 1.00 0.00 H new ATOM 0 HB3 GLN A 80 13.694 -7.018 -2.444 1.00 0.00 H new ATOM 0 HG2 GLN A 80 12.746 -9.111 -1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 80 11.205 -8.323 -1.291 1.00 0.00 H new ATOM 0 HE21 GLN A 80 10.529 -10.223 -2.677 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.521 -9.974 -4.426 1.00 0.00 H new ATOM 1221 N ALA A 81 15.272 -5.417 -0.260 1.00 0.00 N ATOM 1222 CA ALA A 81 16.716 -5.293 -0.106 1.00 0.00 C ATOM 1223 C ALA A 81 17.146 -5.629 1.319 1.00 0.00 C ATOM 1224 O ALA A 81 17.837 -6.620 1.551 1.00 0.00 O ATOM 1225 CB ALA A 81 17.168 -3.890 -0.480 1.00 0.00 C ATOM 0 H ALA A 81 14.784 -4.530 -0.381 1.00 0.00 H new ATOM 0 HA ALA A 81 17.192 -6.006 -0.779 1.00 0.00 H new ATOM 0 HB1 ALA A 81 18.249 -3.812 -0.360 1.00 0.00 H new ATOM 0 HB2 ALA A 81 16.902 -3.687 -1.517 1.00 0.00 H new ATOM 0 HB3 ALA A 81 16.678 -3.165 0.169 1.00 0.00 H new ATOM 1231 N LYS A 82 16.728 -4.796 2.269 1.00 0.00 N ATOM 1232 CA LYS A 82 17.071 -5.002 3.671 1.00 0.00 C ATOM 1233 C LYS A 82 16.443 -6.285 4.207 1.00 0.00 C ATOM 1234 O LYS A 82 16.869 -6.813 5.235 1.00 0.00 O ATOM 1235 CB LYS A 82 16.609 -3.808 4.510 1.00 0.00 C ATOM 1236 CG LYS A 82 17.293 -2.502 4.139 1.00 0.00 C ATOM 1237 CD LYS A 82 16.588 -1.308 4.762 1.00 0.00 C ATOM 1238 CE LYS A 82 16.662 -0.084 3.864 1.00 0.00 C ATOM 1239 NZ LYS A 82 17.107 1.126 4.609 1.00 0.00 N ATOM 0 H LYS A 82 16.152 -3.973 2.092 1.00 0.00 H new ATOM 0 HA LYS A 82 18.155 -5.094 3.742 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.532 -3.689 4.395 1.00 0.00 H new ATOM 0 HB3 LYS A 82 16.796 -4.020 5.563 1.00 0.00 H new ATOM 0 HG2 LYS A 82 18.331 -2.527 4.470 1.00 0.00 H new ATOM 0 HG3 LYS A 82 17.307 -2.393 3.055 1.00 0.00 H new ATOM 0 HD2 LYS A 82 15.544 -1.559 4.951 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.041 -1.080 5.727 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.351 -0.278 3.042 1.00 0.00 H new ATOM 0 HE3 LYS A 82 15.683 0.102 3.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 17.144 1.939 3.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 16.436 1.327 5.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 18.052 0.959 5.010 1.00 0.00 H new ATOM 1253 N GLU A 83 15.429 -6.782 3.505 1.00 0.00 N ATOM 1254 CA GLU A 83 14.741 -8.002 3.911 1.00 0.00 C ATOM 1255 C GLU A 83 15.552 -9.238 3.539 1.00 0.00 C ATOM 1256 O GLU A 83 15.763 -10.127 4.364 1.00 0.00 O ATOM 1257 CB GLU A 83 13.358 -8.072 3.260 1.00 0.00 C ATOM 1258 CG GLU A 83 12.435 -9.097 3.900 1.00 0.00 C ATOM 1259 CD GLU A 83 11.708 -9.946 2.875 1.00 0.00 C ATOM 1260 OE1 GLU A 83 11.156 -9.372 1.913 1.00 0.00 O ATOM 1261 OE2 GLU A 83 11.691 -11.184 3.034 1.00 0.00 O ATOM 0 H GLU A 83 15.066 -6.358 2.652 1.00 0.00 H new ATOM 0 HA GLU A 83 14.627 -7.979 4.995 1.00 0.00 H new ATOM 0 HB2 GLU A 83 12.890 -7.089 3.315 1.00 0.00 H new ATOM 0 HB3 GLU A 83 13.475 -8.311 2.203 1.00 0.00 H new ATOM 0 HG2 GLU A 83 13.016 -9.745 4.556 1.00 0.00 H new ATOM 0 HG3 GLU A 83 11.705 -8.583 4.525 1.00 0.00 H new ATOM 1268 N ALA A 84 16.000 -9.291 2.288 1.00 0.00 N ATOM 1269 CA ALA A 84 16.786 -10.420 1.802 1.00 0.00 C ATOM 1270 C ALA A 84 18.240 -10.310 2.244 1.00 0.00 C ATOM 1271 O ALA A 84 19.014 -11.258 2.109 1.00 0.00 O ATOM 1272 CB ALA A 84 16.699 -10.511 0.286 1.00 0.00 C ATOM 0 H ALA A 84 15.832 -8.564 1.592 1.00 0.00 H new ATOM 0 HA ALA A 84 16.371 -11.330 2.234 1.00 0.00 H new ATOM 0 HB1 ALA A 84 17.290 -11.358 -0.062 1.00 0.00 H new ATOM 0 HB2 ALA A 84 15.659 -10.648 -0.011 1.00 0.00 H new ATOM 0 HB3 ALA A 84 17.085 -9.593 -0.156 1.00 0.00 H new ATOM 1278 N ALA A 85 18.607 -9.147 2.775 1.00 0.00 N ATOM 1279 CA ALA A 85 19.969 -8.913 3.239 1.00 0.00 C ATOM 1280 C ALA A 85 20.164 -9.436 4.658 1.00 0.00 C ATOM 1281 O ALA A 85 21.169 -9.143 5.305 1.00 0.00 O ATOM 1282 CB ALA A 85 20.304 -7.430 3.170 1.00 0.00 C ATOM 0 H ALA A 85 17.979 -8.352 2.894 1.00 0.00 H new ATOM 0 HA ALA A 85 20.648 -9.458 2.583 1.00 0.00 H new ATOM 0 HB1 ALA A 85 21.324 -7.271 3.520 1.00 0.00 H new ATOM 0 HB2 ALA A 85 20.215 -7.084 2.140 1.00 0.00 H new ATOM 0 HB3 ALA A 85 19.613 -6.871 3.801 1.00 0.00 H new ATOM 1288 N GLN A 86 19.195 -10.212 5.136 1.00 0.00 N ATOM 1289 CA GLN A 86 19.260 -10.776 6.479 1.00 0.00 C ATOM 1290 C GLN A 86 20.142 -12.020 6.503 1.00 0.00 C ATOM 1291 O GLN A 86 20.443 -12.601 5.460 1.00 0.00 O ATOM 1292 CB GLN A 86 17.853 -11.114 6.984 1.00 0.00 C ATOM 1293 CG GLN A 86 17.308 -12.433 6.458 1.00 0.00 C ATOM 1294 CD GLN A 86 16.030 -12.855 7.154 1.00 0.00 C ATOM 1295 OE1 GLN A 86 15.037 -13.190 6.508 1.00 0.00 O ATOM 1296 NE2 GLN A 86 16.047 -12.842 8.482 1.00 0.00 N ATOM 0 H GLN A 86 18.356 -10.464 4.613 1.00 0.00 H new ATOM 0 HA GLN A 86 19.701 -10.030 7.140 1.00 0.00 H new ATOM 0 HB2 GLN A 86 17.867 -11.147 8.073 1.00 0.00 H new ATOM 0 HB3 GLN A 86 17.173 -10.312 6.698 1.00 0.00 H new ATOM 0 HG2 GLN A 86 17.122 -12.344 5.388 1.00 0.00 H new ATOM 0 HG3 GLN A 86 18.061 -13.210 6.587 1.00 0.00 H new ATOM 0 HE21 GLN A 86 16.891 -12.557 8.978 1.00 0.00 H new ATOM 0 HE22 GLN A 86 15.216 -13.117 9.005 1.00 0.00 H new ATOM 1305 N LYS A 87 20.556 -12.423 7.700 1.00 0.00 N ATOM 1306 CA LYS A 87 21.409 -13.596 7.859 1.00 0.00 C ATOM 1307 C LYS A 87 20.577 -14.872 7.925 1.00 0.00 C ATOM 1308 O LYS A 87 19.355 -14.837 7.777 1.00 0.00 O ATOM 1309 CB LYS A 87 22.259 -13.464 9.124 1.00 0.00 C ATOM 1310 CG LYS A 87 23.013 -12.147 9.215 1.00 0.00 C ATOM 1311 CD LYS A 87 23.797 -12.042 10.513 1.00 0.00 C ATOM 1312 CE LYS A 87 25.062 -11.216 10.336 1.00 0.00 C ATOM 1313 NZ LYS A 87 24.962 -9.896 11.017 1.00 0.00 N ATOM 0 H LYS A 87 20.315 -11.955 8.574 1.00 0.00 H new ATOM 0 HA LYS A 87 22.065 -13.657 6.990 1.00 0.00 H new ATOM 0 HB2 LYS A 87 21.614 -13.565 9.997 1.00 0.00 H new ATOM 0 HB3 LYS A 87 22.974 -14.286 9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 87 23.694 -12.058 8.369 1.00 0.00 H new ATOM 0 HG3 LYS A 87 22.309 -11.318 9.146 1.00 0.00 H new ATOM 0 HD2 LYS A 87 23.171 -11.590 11.282 1.00 0.00 H new ATOM 0 HD3 LYS A 87 24.059 -13.041 10.862 1.00 0.00 H new ATOM 0 HE2 LYS A 87 25.914 -11.767 10.735 1.00 0.00 H new ATOM 0 HE3 LYS A 87 25.250 -11.063 9.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 25.844 -9.363 10.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 24.165 -9.360 10.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 24.808 -10.041 12.035 1.00 0.00 H new ATOM 1327 N ALA A 88 21.248 -15.998 8.149 1.00 0.00 N ATOM 1328 CA ALA A 88 20.573 -17.288 8.235 1.00 0.00 C ATOM 1329 C ALA A 88 20.011 -17.521 9.633 1.00 0.00 C ATOM 1330 O ALA A 88 19.527 -18.611 9.944 1.00 0.00 O ATOM 1331 CB ALA A 88 21.527 -18.410 7.851 1.00 0.00 C ATOM 0 H ALA A 88 22.259 -16.043 8.274 1.00 0.00 H new ATOM 0 HA ALA A 88 19.738 -17.282 7.534 1.00 0.00 H new ATOM 0 HB1 ALA A 88 21.010 -19.367 7.920 1.00 0.00 H new ATOM 0 HB2 ALA A 88 21.875 -18.258 6.829 1.00 0.00 H new ATOM 0 HB3 ALA A 88 22.381 -18.410 8.529 1.00 0.00 H new ATOM 1337 N VAL A 89 20.077 -16.493 10.473 1.00 0.00 N ATOM 1338 CA VAL A 89 19.573 -16.586 11.839 1.00 0.00 C ATOM 1339 C VAL A 89 18.053 -16.483 11.869 1.00 0.00 C ATOM 1340 O VAL A 89 17.459 -15.689 11.139 1.00 0.00 O ATOM 1341 CB VAL A 89 20.169 -15.486 12.738 1.00 0.00 C ATOM 1342 CG1 VAL A 89 19.907 -15.795 14.204 1.00 0.00 C ATOM 1343 CG2 VAL A 89 21.658 -15.327 12.476 1.00 0.00 C ATOM 0 H VAL A 89 20.475 -15.585 10.232 1.00 0.00 H new ATOM 0 HA VAL A 89 19.878 -17.560 12.223 1.00 0.00 H new ATOM 0 HB VAL A 89 19.681 -14.542 12.496 1.00 0.00 H new ATOM 0 HG11 VAL A 89 20.335 -15.007 14.824 1.00 0.00 H new ATOM 0 HG12 VAL A 89 18.832 -15.850 14.378 1.00 0.00 H new ATOM 0 HG13 VAL A 89 20.366 -16.750 14.462 1.00 0.00 H new ATOM 0 HG21 VAL A 89 22.059 -14.545 13.121 1.00 0.00 H new ATOM 0 HG22 VAL A 89 22.167 -16.268 12.686 1.00 0.00 H new ATOM 0 HG23 VAL A 89 21.817 -15.054 11.433 1.00 0.00 H new ATOM 1353 N ASN A 90 17.426 -17.290 12.720 1.00 0.00 N ATOM 1354 CA ASN A 90 15.974 -17.288 12.849 1.00 0.00 C ATOM 1355 C ASN A 90 15.519 -16.216 13.833 1.00 0.00 C ATOM 1356 O ASN A 90 15.343 -16.484 15.022 1.00 0.00 O ATOM 1357 CB ASN A 90 15.479 -18.661 13.304 1.00 0.00 C ATOM 1358 CG ASN A 90 14.420 -19.231 12.381 1.00 0.00 C ATOM 1359 OD1 ASN A 90 13.504 -18.526 11.959 1.00 0.00 O ATOM 1360 ND2 ASN A 90 14.540 -20.515 12.062 1.00 0.00 N ATOM 0 H ASN A 90 17.902 -17.954 13.331 1.00 0.00 H new ATOM 0 HA ASN A 90 15.546 -17.063 11.872 1.00 0.00 H new ATOM 0 HB2 ASN A 90 16.322 -19.350 13.353 1.00 0.00 H new ATOM 0 HB3 ASN A 90 15.073 -18.582 14.312 1.00 0.00 H new ATOM 0 HD21 ASN A 90 13.857 -20.953 11.444 1.00 0.00 H new ATOM 0 HD22 ASN A 90 15.316 -21.063 12.435 1.00 0.00 H new ATOM 1367 N SER A 91 15.333 -15.000 13.329 1.00 0.00 N ATOM 1368 CA SER A 91 14.900 -13.886 14.165 1.00 0.00 C ATOM 1369 C SER A 91 13.395 -13.937 14.401 1.00 0.00 C ATOM 1370 O SER A 91 12.713 -14.850 13.934 1.00 0.00 O ATOM 1371 CB SER A 91 15.281 -12.555 13.512 1.00 0.00 C ATOM 1372 OG SER A 91 16.686 -12.440 13.368 1.00 0.00 O ATOM 0 H SER A 91 15.475 -14.761 12.348 1.00 0.00 H new ATOM 0 HA SER A 91 15.403 -13.968 15.128 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.805 -12.477 12.535 1.00 0.00 H new ATOM 0 HB3 SER A 91 14.906 -11.729 14.117 1.00 0.00 H new ATOM 0 HG SER A 91 16.903 -11.582 12.947 1.00 0.00 H new ATOM 1378 N ALA A 92 12.881 -12.951 15.132 1.00 0.00 N ATOM 1379 CA ALA A 92 11.456 -12.885 15.431 1.00 0.00 C ATOM 1380 C ALA A 92 10.640 -12.655 14.164 1.00 0.00 C ATOM 1381 O ALA A 92 10.555 -11.534 13.662 1.00 0.00 O ATOM 1382 CB ALA A 92 11.179 -11.786 16.446 1.00 0.00 C ATOM 0 H ALA A 92 13.431 -12.188 15.527 1.00 0.00 H new ATOM 0 HA ALA A 92 11.155 -13.842 15.858 1.00 0.00 H new ATOM 0 HB1 ALA A 92 10.111 -11.749 16.659 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.726 -11.994 17.366 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.502 -10.827 16.041 1.00 0.00 H new ATOM 1388 N THR A 93 10.039 -13.725 13.650 1.00 0.00 N ATOM 1389 CA THR A 93 9.230 -13.642 12.440 1.00 0.00 C ATOM 1390 C THR A 93 7.751 -13.844 12.760 1.00 0.00 C ATOM 1391 O THR A 93 6.956 -14.185 11.885 1.00 0.00 O ATOM 1392 CB THR A 93 9.695 -14.686 11.421 1.00 0.00 C ATOM 1393 OG1 THR A 93 8.947 -14.588 10.222 1.00 0.00 O ATOM 1394 CG2 THR A 93 9.577 -16.109 11.924 1.00 0.00 C ATOM 0 H THR A 93 10.098 -14.660 14.054 1.00 0.00 H new ATOM 0 HA THR A 93 9.356 -12.647 12.013 1.00 0.00 H new ATOM 0 HB THR A 93 10.748 -14.467 11.246 1.00 0.00 H new ATOM 0 HG1 THR A 93 8.009 -14.400 10.436 1.00 0.00 H new ATOM 0 HG21 THR A 93 9.923 -16.797 11.153 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.187 -16.230 12.819 1.00 0.00 H new ATOM 0 HG23 THR A 93 8.536 -16.325 12.163 1.00 0.00 H new ATOM 1402 N GLY A 94 7.390 -13.629 14.022 1.00 0.00 N ATOM 1403 CA GLY A 94 6.010 -13.793 14.438 1.00 0.00 C ATOM 1404 C GLY A 94 5.293 -12.468 14.612 1.00 0.00 C ATOM 1405 O GLY A 94 5.450 -11.557 13.799 1.00 0.00 O ATOM 0 H GLY A 94 8.030 -13.344 14.764 1.00 0.00 H new ATOM 0 HA2 GLY A 94 5.480 -14.394 13.699 1.00 0.00 H new ATOM 0 HA3 GLY A 94 5.981 -14.344 15.378 1.00 0.00 H new ATOM 1409 N VAL A 95 4.503 -12.361 15.676 1.00 0.00 N ATOM 1410 CA VAL A 95 3.758 -11.138 15.957 1.00 0.00 C ATOM 1411 C VAL A 95 4.622 -10.132 16.718 1.00 0.00 C ATOM 1412 O VAL A 95 5.274 -10.483 17.702 1.00 0.00 O ATOM 1413 CB VAL A 95 2.480 -11.432 16.770 1.00 0.00 C ATOM 1414 CG1 VAL A 95 2.813 -12.229 18.022 1.00 0.00 C ATOM 1415 CG2 VAL A 95 1.757 -10.141 17.124 1.00 0.00 C ATOM 0 H VAL A 95 4.362 -13.106 16.358 1.00 0.00 H new ATOM 0 HA VAL A 95 3.472 -10.710 14.996 1.00 0.00 H new ATOM 0 HB VAL A 95 1.812 -12.033 16.153 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.899 -12.426 18.582 1.00 0.00 H new ATOM 0 HG12 VAL A 95 3.276 -13.174 17.739 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.503 -11.658 18.644 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.859 -10.372 17.697 1.00 0.00 H new ATOM 0 HG22 VAL A 95 2.414 -9.507 17.719 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.479 -9.617 16.209 1.00 0.00 H new ATOM 1425 N PRO A 96 4.639 -8.861 16.271 1.00 0.00 N ATOM 1426 CA PRO A 96 5.429 -7.807 16.921 1.00 0.00 C ATOM 1427 C PRO A 96 4.887 -7.449 18.301 1.00 0.00 C ATOM 1428 O PRO A 96 3.945 -8.073 18.791 1.00 0.00 O ATOM 1429 CB PRO A 96 5.290 -6.619 15.967 1.00 0.00 C ATOM 1430 CG PRO A 96 4.010 -6.859 15.246 1.00 0.00 C ATOM 1431 CD PRO A 96 3.894 -8.351 15.104 1.00 0.00 C ATOM 0 HA PRO A 96 6.461 -8.115 17.090 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.267 -5.675 16.511 1.00 0.00 H new ATOM 0 HB3 PRO A 96 6.130 -6.567 15.275 1.00 0.00 H new ATOM 0 HG2 PRO A 96 3.166 -6.452 15.802 1.00 0.00 H new ATOM 0 HG3 PRO A 96 4.013 -6.372 14.271 1.00 0.00 H new ATOM 0 HD2 PRO A 96 2.854 -8.677 15.117 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.326 -8.701 14.166 1.00 0.00 H new ATOM 1439 N THR A 97 5.489 -6.440 18.925 1.00 0.00 N ATOM 1440 CA THR A 97 5.067 -6.000 20.249 1.00 0.00 C ATOM 1441 C THR A 97 3.875 -5.052 20.155 1.00 0.00 C ATOM 1442 O THR A 97 4.040 -3.833 20.090 1.00 0.00 O ATOM 1443 CB THR A 97 6.228 -5.319 20.981 1.00 0.00 C ATOM 1444 OG1 THR A 97 5.752 -4.576 22.090 1.00 0.00 O ATOM 1445 CG2 THR A 97 7.027 -4.379 20.105 1.00 0.00 C ATOM 0 H THR A 97 6.270 -5.913 18.534 1.00 0.00 H new ATOM 0 HA THR A 97 4.761 -6.879 20.816 1.00 0.00 H new ATOM 0 HB THR A 97 6.883 -6.131 21.298 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.507 -4.149 22.546 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.832 -3.933 20.689 1.00 0.00 H new ATOM 0 HG22 THR A 97 7.451 -4.934 19.268 1.00 0.00 H new ATOM 0 HG23 THR A 97 6.375 -3.592 19.726 1.00 0.00 H new ATOM 1453 N VAL A 98 2.674 -5.622 20.146 1.00 0.00 N ATOM 1454 CA VAL A 98 1.451 -4.830 20.059 1.00 0.00 C ATOM 1455 C VAL A 98 0.443 -5.263 21.120 1.00 0.00 C ATOM 1456 O VAL A 98 0.422 -4.636 22.199 1.00 0.00 O ATOM 1457 CB VAL A 98 0.794 -4.942 18.666 1.00 0.00 C ATOM 1458 CG1 VAL A 98 0.796 -3.591 17.966 1.00 0.00 C ATOM 1459 CG2 VAL A 98 1.494 -5.992 17.817 1.00 0.00 C ATOM 1460 OXT VAL A 98 -0.206 -6.310 20.921 1.00 0.00 O ATOM 0 H VAL A 98 2.521 -6.629 20.198 1.00 0.00 H new ATOM 0 HA VAL A 98 1.737 -3.792 20.229 1.00 0.00 H new ATOM 0 HB VAL A 98 -0.241 -5.257 18.802 1.00 0.00 H new ATOM 0 HG11 VAL A 98 0.329 -3.688 16.986 1.00 0.00 H new ATOM 0 HG12 VAL A 98 0.238 -2.871 18.564 1.00 0.00 H new ATOM 0 HG13 VAL A 98 1.823 -3.245 17.846 1.00 0.00 H new ATOM 0 HG21 VAL A 98 1.012 -6.051 16.841 1.00 0.00 H new ATOM 0 HG22 VAL A 98 2.541 -5.717 17.689 1.00 0.00 H new ATOM 0 HG23 VAL A 98 1.431 -6.961 18.312 1.00 0.00 H new TER 1470 VAL A 98 ATOM 1471 N VAL B 1 13.056 0.642 12.420 1.00 0.00 N ATOM 1472 CA VAL B 1 12.238 0.089 11.310 1.00 0.00 C ATOM 1473 C VAL B 1 12.800 0.506 9.955 1.00 0.00 C ATOM 1474 O VAL B 1 13.885 1.082 9.873 1.00 0.00 O ATOM 1475 CB VAL B 1 10.769 0.547 11.408 1.00 0.00 C ATOM 1476 CG1 VAL B 1 10.101 -0.061 12.631 1.00 0.00 C ATOM 1477 CG2 VAL B 1 10.680 2.065 11.442 1.00 0.00 C ATOM 0 H1 VAL B 1 12.624 0.386 13.331 1.00 0.00 H new ATOM 0 H2 VAL B 1 14.018 0.250 12.371 1.00 0.00 H new ATOM 0 H3 VAL B 1 13.100 1.678 12.336 1.00 0.00 H new ATOM 0 HA VAL B 1 12.277 -0.997 11.400 1.00 0.00 H new ATOM 0 HB VAL B 1 10.240 0.197 10.521 1.00 0.00 H new ATOM 0 HG11 VAL B 1 9.065 0.273 12.684 1.00 0.00 H new ATOM 0 HG12 VAL B 1 10.128 -1.148 12.558 1.00 0.00 H new ATOM 0 HG13 VAL B 1 10.630 0.255 13.530 1.00 0.00 H new ATOM 0 HG21 VAL B 1 9.635 2.367 11.511 1.00 0.00 H new ATOM 0 HG22 VAL B 1 11.225 2.442 12.308 1.00 0.00 H new ATOM 0 HG23 VAL B 1 11.117 2.476 10.532 1.00 0.00 H new ATOM 1489 N VAL B 2 12.056 0.206 8.892 1.00 0.00 N ATOM 1490 CA VAL B 2 12.482 0.549 7.540 1.00 0.00 C ATOM 1491 C VAL B 2 12.160 2.003 7.215 1.00 0.00 C ATOM 1492 O VAL B 2 11.048 2.473 7.456 1.00 0.00 O ATOM 1493 CB VAL B 2 11.813 -0.359 6.489 1.00 0.00 C ATOM 1494 CG1 VAL B 2 12.500 -0.212 5.140 1.00 0.00 C ATOM 1495 CG2 VAL B 2 11.827 -1.809 6.947 1.00 0.00 C ATOM 0 H VAL B 2 11.157 -0.273 8.942 1.00 0.00 H new ATOM 0 HA VAL B 2 13.561 0.400 7.503 1.00 0.00 H new ATOM 0 HB VAL B 2 10.774 -0.048 6.378 1.00 0.00 H new ATOM 0 HG11 VAL B 2 12.014 -0.861 4.411 1.00 0.00 H new ATOM 0 HG12 VAL B 2 12.431 0.824 4.807 1.00 0.00 H new ATOM 0 HG13 VAL B 2 13.549 -0.494 5.233 1.00 0.00 H new ATOM 0 HG21 VAL B 2 11.350 -2.434 6.192 1.00 0.00 H new ATOM 0 HG22 VAL B 2 12.857 -2.135 7.091 1.00 0.00 H new ATOM 0 HG23 VAL B 2 11.284 -1.899 7.888 1.00 0.00 H new ATOM 1505 N LYS B 3 13.139 2.711 6.663 1.00 0.00 N ATOM 1506 CA LYS B 3 12.962 4.112 6.301 1.00 0.00 C ATOM 1507 C LYS B 3 12.377 4.242 4.898 1.00 0.00 C ATOM 1508 O LYS B 3 13.049 3.958 3.907 1.00 0.00 O ATOM 1509 CB LYS B 3 14.299 4.854 6.381 1.00 0.00 C ATOM 1510 CG LYS B 3 15.006 4.688 7.717 1.00 0.00 C ATOM 1511 CD LYS B 3 15.138 6.015 8.446 1.00 0.00 C ATOM 1512 CE LYS B 3 15.136 5.823 9.954 1.00 0.00 C ATOM 1513 NZ LYS B 3 13.994 6.526 10.601 1.00 0.00 N ATOM 0 H LYS B 3 14.065 2.337 6.456 1.00 0.00 H new ATOM 0 HA LYS B 3 12.264 4.559 7.008 1.00 0.00 H new ATOM 0 HB2 LYS B 3 14.953 4.495 5.586 1.00 0.00 H new ATOM 0 HB3 LYS B 3 14.128 5.915 6.199 1.00 0.00 H new ATOM 0 HG2 LYS B 3 14.452 3.984 8.338 1.00 0.00 H new ATOM 0 HG3 LYS B 3 15.996 4.260 7.556 1.00 0.00 H new ATOM 0 HD2 LYS B 3 16.061 6.508 8.142 1.00 0.00 H new ATOM 0 HD3 LYS B 3 14.316 6.672 8.160 1.00 0.00 H new ATOM 0 HE2 LYS B 3 15.085 4.759 10.185 1.00 0.00 H new ATOM 0 HE3 LYS B 3 16.073 6.194 10.369 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 14.028 6.371 11.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 14.056 7.545 10.403 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 13.099 6.154 10.224 1.00 0.00 H new ATOM 1527 N SER B 4 11.120 4.668 4.824 1.00 0.00 N ATOM 1528 CA SER B 4 10.443 4.835 3.543 1.00 0.00 C ATOM 1529 C SER B 4 10.743 6.204 2.944 1.00 0.00 C ATOM 1530 O SER B 4 11.413 7.031 3.562 1.00 0.00 O ATOM 1531 CB SER B 4 8.933 4.656 3.711 1.00 0.00 C ATOM 1532 OG SER B 4 8.293 4.510 2.456 1.00 0.00 O ATOM 0 H SER B 4 10.550 4.904 5.636 1.00 0.00 H new ATOM 0 HA SER B 4 10.817 4.071 2.861 1.00 0.00 H new ATOM 0 HB2 SER B 4 8.734 3.780 4.328 1.00 0.00 H new ATOM 0 HB3 SER B 4 8.518 5.516 4.236 1.00 0.00 H new ATOM 0 HG SER B 4 7.329 4.395 2.592 1.00 0.00 H new ATOM 1538 N ASN B 5 10.242 6.436 1.734 1.00 0.00 N ATOM 1539 CA ASN B 5 10.460 7.703 1.047 1.00 0.00 C ATOM 1540 C ASN B 5 9.178 8.530 1.006 1.00 0.00 C ATOM 1541 O ASN B 5 9.183 9.716 1.335 1.00 0.00 O ATOM 1542 CB ASN B 5 10.964 7.453 -0.377 1.00 0.00 C ATOM 1543 CG ASN B 5 11.596 6.083 -0.537 1.00 0.00 C ATOM 1544 OD1 ASN B 5 11.018 5.263 -1.407 1.00 0.00 O flip ATOM 1545 ND2 ASN B 5 12.592 5.767 0.113 1.00 0.00 N flip ATOM 0 H ASN B 5 9.683 5.763 1.210 1.00 0.00 H new ATOM 0 HA ASN B 5 11.214 8.263 1.601 1.00 0.00 H new ATOM 0 HB2 ASN B 5 10.133 7.550 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN B 5 11.693 8.219 -0.641 1.00 0.00 H new ATOM 0 HD21 ASN B 5 13.003 6.429 0.771 1.00 0.00 H new ATOM 0 HD22 ASN B 5 13.006 4.843 -0.006 1.00 0.00 H new ATOM 1552 N LEU B 6 8.084 7.894 0.600 1.00 0.00 N ATOM 1553 CA LEU B 6 6.793 8.569 0.516 1.00 0.00 C ATOM 1554 C LEU B 6 6.268 8.912 1.906 1.00 0.00 C ATOM 1555 O LEU B 6 6.305 10.069 2.325 1.00 0.00 O ATOM 1556 CB LEU B 6 5.786 7.685 -0.226 1.00 0.00 C ATOM 1557 CG LEU B 6 4.874 8.415 -1.218 1.00 0.00 C ATOM 1558 CD1 LEU B 6 5.689 9.285 -2.167 1.00 0.00 C ATOM 1559 CD2 LEU B 6 4.040 7.414 -2.001 1.00 0.00 C ATOM 0 H LEU B 6 8.065 6.912 0.324 1.00 0.00 H new ATOM 0 HA LEU B 6 6.927 9.499 -0.037 1.00 0.00 H new ATOM 0 HB2 LEU B 6 6.335 6.912 -0.764 1.00 0.00 H new ATOM 0 HB3 LEU B 6 5.162 7.179 0.510 1.00 0.00 H new ATOM 0 HG LEU B 6 4.205 9.064 -0.653 1.00 0.00 H new ATOM 0 HD11 LEU B 6 5.019 9.793 -2.861 1.00 0.00 H new ATOM 0 HD12 LEU B 6 6.246 10.026 -1.594 1.00 0.00 H new ATOM 0 HD13 LEU B 6 6.385 8.660 -2.726 1.00 0.00 H new ATOM 0 HD21 LEU B 6 3.397 7.946 -2.702 1.00 0.00 H new ATOM 0 HD22 LEU B 6 4.699 6.743 -2.551 1.00 0.00 H new ATOM 0 HD23 LEU B 6 3.425 6.835 -1.312 1.00 0.00 H new ATOM 1571 N ASN B 7 5.785 7.899 2.621 1.00 0.00 N ATOM 1572 CA ASN B 7 5.268 8.094 3.972 1.00 0.00 C ATOM 1573 C ASN B 7 6.363 7.857 5.008 1.00 0.00 C ATOM 1574 O ASN B 7 7.097 6.872 4.927 1.00 0.00 O ATOM 1575 CB ASN B 7 4.103 7.144 4.243 1.00 0.00 C ATOM 1576 CG ASN B 7 3.020 7.782 5.090 1.00 0.00 C ATOM 1577 OD1 ASN B 7 3.087 7.566 6.399 1.00 0.00 O flip ATOM 1578 ND2 ASN B 7 2.132 8.463 4.575 1.00 0.00 N flip ATOM 0 H ASN B 7 5.741 6.936 2.288 1.00 0.00 H new ATOM 0 HA ASN B 7 4.919 9.124 4.050 1.00 0.00 H new ATOM 0 HB2 ASN B 7 3.675 6.820 3.295 1.00 0.00 H new ATOM 0 HB3 ASN B 7 4.475 6.252 4.746 1.00 0.00 H new ATOM 0 HD21 ASN B 7 2.118 8.604 3.565 1.00 0.00 H new ATOM 0 HD22 ASN B 7 1.411 8.886 5.159 1.00 0.00 H new ATOM 1585 N PRO B 8 6.482 8.746 6.008 1.00 0.00 N ATOM 1586 CA PRO B 8 7.492 8.612 7.056 1.00 0.00 C ATOM 1587 C PRO B 8 7.081 7.615 8.135 1.00 0.00 C ATOM 1588 O PRO B 8 7.846 7.328 9.055 1.00 0.00 O ATOM 1589 CB PRO B 8 7.576 10.024 7.630 1.00 0.00 C ATOM 1590 CG PRO B 8 6.202 10.575 7.455 1.00 0.00 C ATOM 1591 CD PRO B 8 5.653 9.953 6.195 1.00 0.00 C ATOM 0 HA PRO B 8 8.439 8.232 6.673 1.00 0.00 H new ATOM 0 HB2 PRO B 8 7.868 10.010 8.680 1.00 0.00 H new ATOM 0 HB3 PRO B 8 8.316 10.625 7.101 1.00 0.00 H new ATOM 0 HG2 PRO B 8 5.574 10.334 8.313 1.00 0.00 H new ATOM 0 HG3 PRO B 8 6.226 11.662 7.373 1.00 0.00 H new ATOM 0 HD2 PRO B 8 4.598 9.701 6.300 1.00 0.00 H new ATOM 0 HD3 PRO B 8 5.736 10.631 5.345 1.00 0.00 H new ATOM 1599 N ASN B 9 5.862 7.095 8.015 1.00 0.00 N ATOM 1600 CA ASN B 9 5.345 6.128 8.978 1.00 0.00 C ATOM 1601 C ASN B 9 4.926 4.837 8.280 1.00 0.00 C ATOM 1602 O ASN B 9 3.800 4.371 8.441 1.00 0.00 O ATOM 1603 CB ASN B 9 4.156 6.721 9.737 1.00 0.00 C ATOM 1604 CG ASN B 9 4.441 8.114 10.263 1.00 0.00 C ATOM 1605 OD1 ASN B 9 3.833 9.091 9.825 1.00 0.00 O ATOM 1606 ND2 ASN B 9 5.371 8.213 11.205 1.00 0.00 N ATOM 0 H ASN B 9 5.215 7.327 7.261 1.00 0.00 H new ATOM 0 HA ASN B 9 6.140 5.895 9.686 1.00 0.00 H new ATOM 0 HB2 ASN B 9 3.289 6.755 9.078 1.00 0.00 H new ATOM 0 HB3 ASN B 9 3.898 6.067 10.570 1.00 0.00 H new ATOM 0 HD21 ASN B 9 5.607 9.126 11.595 1.00 0.00 H new ATOM 0 HD22 ASN B 9 5.850 7.377 11.539 1.00 0.00 H new ATOM 1613 N ALA B 10 5.823 4.292 7.467 1.00 0.00 N ATOM 1614 CA ALA B 10 5.551 3.061 6.733 1.00 0.00 C ATOM 1615 C ALA B 10 5.269 1.884 7.669 1.00 0.00 C ATOM 1616 O ALA B 10 6.193 1.214 8.129 1.00 0.00 O ATOM 1617 CB ALA B 10 6.717 2.733 5.812 1.00 0.00 C ATOM 0 H ALA B 10 6.749 4.685 7.299 1.00 0.00 H new ATOM 0 HA ALA B 10 4.653 3.226 6.137 1.00 0.00 H new ATOM 0 HB1 ALA B 10 6.504 1.812 5.269 1.00 0.00 H new ATOM 0 HB2 ALA B 10 6.861 3.548 5.103 1.00 0.00 H new ATOM 0 HB3 ALA B 10 7.623 2.603 6.404 1.00 0.00 H new ATOM 1623 N LYS B 11 3.987 1.613 7.920 1.00 0.00 N ATOM 1624 CA LYS B 11 3.595 0.477 8.756 1.00 0.00 C ATOM 1625 C LYS B 11 2.739 -0.503 7.958 1.00 0.00 C ATOM 1626 O LYS B 11 2.239 -0.170 6.885 1.00 0.00 O ATOM 1627 CB LYS B 11 2.832 0.935 10.005 1.00 0.00 C ATOM 1628 CG LYS B 11 2.325 2.365 9.937 1.00 0.00 C ATOM 1629 CD LYS B 11 2.916 3.217 11.049 1.00 0.00 C ATOM 1630 CE LYS B 11 1.997 3.273 12.259 1.00 0.00 C ATOM 1631 NZ LYS B 11 1.638 4.673 12.617 1.00 0.00 N ATOM 0 H LYS B 11 3.206 2.161 7.559 1.00 0.00 H new ATOM 0 HA LYS B 11 4.508 -0.023 9.079 1.00 0.00 H new ATOM 0 HB2 LYS B 11 1.984 0.268 10.164 1.00 0.00 H new ATOM 0 HB3 LYS B 11 3.484 0.834 10.873 1.00 0.00 H new ATOM 0 HG2 LYS B 11 2.581 2.798 8.970 1.00 0.00 H new ATOM 0 HG3 LYS B 11 1.238 2.371 10.011 1.00 0.00 H new ATOM 0 HD2 LYS B 11 3.883 2.811 11.344 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.094 4.227 10.679 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.089 2.707 12.052 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.485 2.794 13.108 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 1.590 4.765 13.652 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 2.360 5.323 12.244 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 0.713 4.910 12.205 1.00 0.00 H new ATOM 1645 N GLU B 12 2.578 -1.714 8.485 1.00 0.00 N ATOM 1646 CA GLU B 12 1.793 -2.743 7.810 1.00 0.00 C ATOM 1647 C GLU B 12 0.334 -2.320 7.664 1.00 0.00 C ATOM 1648 O GLU B 12 -0.132 -1.414 8.357 1.00 0.00 O ATOM 1649 CB GLU B 12 1.878 -4.064 8.574 1.00 0.00 C ATOM 1650 CG GLU B 12 2.258 -5.249 7.699 1.00 0.00 C ATOM 1651 CD GLU B 12 1.117 -5.714 6.817 1.00 0.00 C ATOM 1652 OE1 GLU B 12 0.207 -6.396 7.334 1.00 0.00 O ATOM 1653 OE2 GLU B 12 1.132 -5.397 5.609 1.00 0.00 O ATOM 0 H GLU B 12 2.980 -2.006 9.376 1.00 0.00 H new ATOM 0 HA GLU B 12 2.210 -2.879 6.812 1.00 0.00 H new ATOM 0 HB2 GLU B 12 2.611 -3.965 9.375 1.00 0.00 H new ATOM 0 HB3 GLU B 12 0.916 -4.264 9.045 1.00 0.00 H new ATOM 0 HG2 GLU B 12 3.108 -4.976 7.073 1.00 0.00 H new ATOM 0 HG3 GLU B 12 2.582 -6.075 8.333 1.00 0.00 H new ATOM 1660 N PHE B 13 -0.382 -2.983 6.758 1.00 0.00 N ATOM 1661 CA PHE B 13 -1.790 -2.678 6.523 1.00 0.00 C ATOM 1662 C PHE B 13 -2.680 -3.495 7.450 1.00 0.00 C ATOM 1663 O PHE B 13 -2.930 -4.676 7.210 1.00 0.00 O ATOM 1664 CB PHE B 13 -2.163 -2.956 5.058 1.00 0.00 C ATOM 1665 CG PHE B 13 -3.532 -2.465 4.645 1.00 0.00 C ATOM 1666 CD1 PHE B 13 -4.341 -1.745 5.517 1.00 0.00 C ATOM 1667 CD2 PHE B 13 -4.006 -2.726 3.366 1.00 0.00 C ATOM 1668 CE1 PHE B 13 -5.590 -1.303 5.123 1.00 0.00 C ATOM 1669 CE2 PHE B 13 -5.253 -2.283 2.970 1.00 0.00 C ATOM 1670 CZ PHE B 13 -6.045 -1.574 3.848 1.00 0.00 C ATOM 0 H PHE B 13 -0.010 -3.734 6.176 1.00 0.00 H new ATOM 0 HA PHE B 13 -1.947 -1.620 6.732 1.00 0.00 H new ATOM 0 HB2 PHE B 13 -1.417 -2.491 4.414 1.00 0.00 H new ATOM 0 HB3 PHE B 13 -2.110 -4.031 4.883 1.00 0.00 H new ATOM 0 HD1 PHE B 13 -3.989 -1.528 6.515 1.00 0.00 H new ATOM 0 HD2 PHE B 13 -3.392 -3.282 2.673 1.00 0.00 H new ATOM 0 HE1 PHE B 13 -6.209 -0.747 5.811 1.00 0.00 H new ATOM 0 HE2 PHE B 13 -5.608 -2.492 1.972 1.00 0.00 H new ATOM 0 HZ PHE B 13 -7.021 -1.231 3.538 1.00 0.00 H new ATOM 1680 N VAL B 14 -3.172 -2.846 8.497 1.00 0.00 N ATOM 1681 CA VAL B 14 -4.063 -3.494 9.448 1.00 0.00 C ATOM 1682 C VAL B 14 -5.475 -2.933 9.304 1.00 0.00 C ATOM 1683 O VAL B 14 -5.793 -1.880 9.859 1.00 0.00 O ATOM 1684 CB VAL B 14 -3.579 -3.303 10.897 1.00 0.00 C ATOM 1685 CG1 VAL B 14 -4.428 -4.121 11.858 1.00 0.00 C ATOM 1686 CG2 VAL B 14 -2.109 -3.677 11.022 1.00 0.00 C ATOM 0 H VAL B 14 -2.968 -1.869 8.709 1.00 0.00 H new ATOM 0 HA VAL B 14 -4.065 -4.561 9.228 1.00 0.00 H new ATOM 0 HB VAL B 14 -3.687 -2.251 11.160 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -4.070 -3.972 12.877 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -5.467 -3.800 11.788 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -4.356 -5.177 11.599 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -1.784 -3.536 12.053 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -1.974 -4.721 10.739 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -1.515 -3.043 10.364 1.00 0.00 H new ATOM 1696 N PRO B 15 -6.328 -3.606 8.507 1.00 0.00 N ATOM 1697 CA PRO B 15 -7.701 -3.159 8.250 1.00 0.00 C ATOM 1698 C PRO B 15 -8.509 -2.954 9.526 1.00 0.00 C ATOM 1699 O PRO B 15 -7.975 -3.005 10.635 1.00 0.00 O ATOM 1700 CB PRO B 15 -8.311 -4.290 7.408 1.00 0.00 C ATOM 1701 CG PRO B 15 -7.380 -5.446 7.560 1.00 0.00 C ATOM 1702 CD PRO B 15 -6.022 -4.854 7.791 1.00 0.00 C ATOM 0 HA PRO B 15 -7.711 -2.189 7.753 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -9.312 -4.543 7.757 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -8.403 -3.995 6.363 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -7.677 -6.079 8.396 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -7.386 -6.072 6.668 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -5.388 -5.515 8.382 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -5.499 -4.665 6.854 1.00 0.00 H new ATOM 1710 N GLY B 16 -9.809 -2.755 9.354 1.00 0.00 N ATOM 1711 CA GLY B 16 -10.687 -2.530 10.489 1.00 0.00 C ATOM 1712 C GLY B 16 -10.729 -1.073 10.906 1.00 0.00 C ATOM 1713 O GLY B 16 -11.796 -0.538 11.207 1.00 0.00 O ATOM 0 H GLY B 16 -10.274 -2.745 8.446 1.00 0.00 H new ATOM 0 HA2 GLY B 16 -11.694 -2.862 10.238 1.00 0.00 H new ATOM 0 HA3 GLY B 16 -10.352 -3.137 11.330 1.00 0.00 H new ATOM 1717 N VAL B 17 -9.567 -0.428 10.926 1.00 0.00 N ATOM 1718 CA VAL B 17 -9.483 0.983 11.286 1.00 0.00 C ATOM 1719 C VAL B 17 -8.979 1.824 10.117 1.00 0.00 C ATOM 1720 O VAL B 17 -8.207 1.346 9.284 1.00 0.00 O ATOM 1721 CB VAL B 17 -8.562 1.198 12.501 1.00 0.00 C ATOM 1722 CG1 VAL B 17 -9.160 0.550 13.741 1.00 0.00 C ATOM 1723 CG2 VAL B 17 -7.170 0.649 12.223 1.00 0.00 C ATOM 0 H VAL B 17 -8.671 -0.859 10.697 1.00 0.00 H new ATOM 0 HA VAL B 17 -10.492 1.303 11.545 1.00 0.00 H new ATOM 0 HB VAL B 17 -8.473 2.269 12.682 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -8.497 0.711 14.591 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -10.133 0.994 13.950 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -9.279 -0.520 13.571 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -6.535 0.811 13.094 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -7.235 -0.419 12.015 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -6.742 1.161 11.361 1.00 0.00 H new ATOM 1733 N LYS B 18 -9.415 3.079 10.065 1.00 0.00 N ATOM 1734 CA LYS B 18 -8.997 3.991 9.005 1.00 0.00 C ATOM 1735 C LYS B 18 -7.546 4.414 9.202 1.00 0.00 C ATOM 1736 O LYS B 18 -7.254 5.325 9.977 1.00 0.00 O ATOM 1737 CB LYS B 18 -9.902 5.227 8.980 1.00 0.00 C ATOM 1738 CG LYS B 18 -11.370 4.904 8.747 1.00 0.00 C ATOM 1739 CD LYS B 18 -12.262 5.585 9.774 1.00 0.00 C ATOM 1740 CE LYS B 18 -13.703 5.668 9.295 1.00 0.00 C ATOM 1741 NZ LYS B 18 -14.646 5.032 10.256 1.00 0.00 N ATOM 0 H LYS B 18 -10.057 3.488 10.744 1.00 0.00 H new ATOM 0 HA LYS B 18 -9.082 3.469 8.052 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.802 5.759 9.926 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.559 5.902 8.196 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.659 5.222 7.745 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -11.518 3.825 8.794 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -12.221 5.035 10.714 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -11.886 6.588 9.975 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -13.979 6.713 9.154 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -13.791 5.181 8.324 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -15.617 5.110 9.892 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -14.399 4.028 10.372 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -14.581 5.513 11.176 1.00 0.00 H new ATOM 1755 N TYR B 19 -6.638 3.741 8.501 1.00 0.00 N ATOM 1756 CA TYR B 19 -5.215 4.043 8.605 1.00 0.00 C ATOM 1757 C TYR B 19 -4.919 5.443 8.077 1.00 0.00 C ATOM 1758 O TYR B 19 -5.089 5.718 6.889 1.00 0.00 O ATOM 1759 CB TYR B 19 -4.396 3.006 7.832 1.00 0.00 C ATOM 1760 CG TYR B 19 -3.390 2.264 8.684 1.00 0.00 C ATOM 1761 CD1 TYR B 19 -3.800 1.500 9.771 1.00 0.00 C ATOM 1762 CD2 TYR B 19 -2.032 2.322 8.399 1.00 0.00 C ATOM 1763 CE1 TYR B 19 -2.884 0.820 10.551 1.00 0.00 C ATOM 1764 CE2 TYR B 19 -1.109 1.643 9.174 1.00 0.00 C ATOM 1765 CZ TYR B 19 -1.541 0.894 10.249 1.00 0.00 C ATOM 1766 OH TYR B 19 -0.626 0.217 11.022 1.00 0.00 O ATOM 0 H TYR B 19 -6.863 2.984 7.856 1.00 0.00 H new ATOM 0 HA TYR B 19 -4.934 4.005 9.657 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -5.076 2.285 7.378 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -3.871 3.505 7.018 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -4.851 1.437 10.010 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -1.691 2.907 7.558 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -3.219 0.233 11.394 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -0.056 1.699 8.939 1.00 0.00 H new ATOM 0 HH TYR B 19 -0.204 -0.488 10.487 1.00 0.00 H new ATOM 1776 N GLY B 20 -4.486 6.328 8.970 1.00 0.00 N ATOM 1777 CA GLY B 20 -4.182 7.692 8.577 1.00 0.00 C ATOM 1778 C GLY B 20 -5.415 8.574 8.552 1.00 0.00 C ATOM 1779 O GLY B 20 -6.001 8.804 7.493 1.00 0.00 O ATOM 0 H GLY B 20 -4.340 6.125 9.959 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -3.452 8.112 9.268 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -3.721 7.689 7.589 1.00 0.00 H new ATOM 1783 N ASN B 21 -5.810 9.068 9.722 1.00 0.00 N ATOM 1784 CA ASN B 21 -6.983 9.928 9.833 1.00 0.00 C ATOM 1785 C ASN B 21 -6.587 11.400 9.828 1.00 0.00 C ATOM 1786 O ASN B 21 -5.402 11.734 9.875 1.00 0.00 O ATOM 1787 CB ASN B 21 -7.758 9.601 11.113 1.00 0.00 C ATOM 1788 CG ASN B 21 -6.870 9.584 12.343 1.00 0.00 C ATOM 1789 OD1 ASN B 21 -5.783 10.163 12.348 1.00 0.00 O ATOM 1790 ND2 ASN B 21 -7.332 8.922 13.397 1.00 0.00 N ATOM 0 H ASN B 21 -5.335 8.887 10.606 1.00 0.00 H new ATOM 0 HA ASN B 21 -7.621 9.742 8.969 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -8.551 10.336 11.252 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -8.240 8.629 11.004 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -6.781 8.879 14.254 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -8.238 8.456 13.350 1.00 0.00 H new ATOM 1797 N ILE B 22 -7.584 12.276 9.774 1.00 0.00 N ATOM 1798 CA ILE B 22 -7.342 13.714 9.764 1.00 0.00 C ATOM 1799 C ILE B 22 -8.038 14.395 10.938 1.00 0.00 C ATOM 1800 O ILE B 22 -7.595 15.495 11.331 1.00 0.00 O ATOM 1801 CB ILE B 22 -7.822 14.358 8.450 1.00 0.00 C ATOM 1802 CG1 ILE B 22 -9.315 14.093 8.242 1.00 0.00 C ATOM 1803 CG2 ILE B 22 -7.017 13.828 7.274 1.00 0.00 C ATOM 1804 CD1 ILE B 22 -10.142 15.355 8.125 1.00 0.00 C ATOM 1805 OXT ILE B 22 -9.021 13.823 11.454 1.00 0.00 O ATOM 0 H ILE B 22 -8.569 12.015 9.736 1.00 0.00 H new ATOM 0 HA ILE B 22 -6.265 13.854 9.852 1.00 0.00 H new ATOM 0 HB ILE B 22 -7.668 15.435 8.514 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -9.448 13.496 7.340 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -9.690 13.498 9.075 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -7.369 14.293 6.353 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -5.963 14.063 7.419 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -7.142 12.747 7.205 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -11.190 15.091 7.979 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -10.039 15.943 9.037 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -9.794 15.941 7.274 1.00 0.00 H new TER 1817 ILE B 22