USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 968 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 31 SER OG : rot -173:sc= -1.4 USER MOD Single : A 37 HIS : no HD1:sc= -6.26! C(o=-6.3!,f=-7.5!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= -0.65 X(o=-0.65,f=-0.43) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 48 GLN : amide:sc= -2.49! C(o=-2.5!,f=-2.9!) USER MOD Single : A 50 LYS NZ :NH3+ 154:sc= -0.103 (180deg=-0.554) USER MOD Single : B 23 SER OG : rot 34:sc= 0.00439 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 37 HIS : no HD1:sc= -6.67! C(o=-6.7!,f=-10!) USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 HIS : no HD1:sc= -0.797 K(o=-0.8,f=-1.5) USER MOD Single : B 47 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : B 48 GLN : amide:sc= -5.59 X(o=-5.6,f=-5.9!) USER MOD Single : B 50 LYS NZ :NH3+ -179:sc= -2.81! (180deg=-2.83!) USER MOD Single : C 23 SER OG : rot 29:sc= 0.00602 USER MOD Single : C 31 SER OG : rot 180:sc= 0 USER MOD Single : C 37 HIS : no HD1:sc= -8.77! C(o=-8.8!,f=-13!) USER MOD Single : C 42 THR OG1 : rot 180:sc= 0 USER MOD Single : C 45 HIS : no HD1:sc= -0.055 X(o=-0.055,f=-0.05) USER MOD Single : C 47 ASN :FLIP amide:sc= -1.83 F(o=-8.6!,f=-1.8) USER MOD Single : C 48 GLN :FLIP amide:sc= -4.75! C(o=-7.4!,f=-4.7!) USER MOD Single : C 50 LYS NZ :NH3+ -126:sc= -0.0416 (180deg=-1.23) USER MOD Single : D 23 SER OG : rot 180:sc= -0.0599 USER MOD Single : D 31 SER OG : rot 180:sc= 0 USER MOD Single : D 37 HIS : no HD1:sc= -7.02! C(o=-7!,f=-11!) USER MOD Single : D 42 THR OG1 : rot -74:sc= 0.895 USER MOD Single : D 45 HIS : no HD1:sc= -0.858 X(o=-0.86,f=-1.2) USER MOD Single : D 47 ASN : amide:sc= -0.0866 X(o=-0.087,f=-0.49) USER MOD Single : D 48 GLN : amide:sc= -7.15! C(o=-7.1!,f=-12!) USER MOD Single : D 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ASP A 24 76.940 3.581 4.741 1.00 0.00 N ATOM 12 CA ASP A 24 77.941 4.289 3.952 1.00 0.00 C ATOM 13 C ASP A 24 78.711 3.303 3.079 1.00 0.00 C ATOM 14 O ASP A 24 79.909 3.097 3.263 1.00 0.00 O ATOM 15 CB ASP A 24 78.908 5.068 4.861 1.00 0.00 C ATOM 16 CG ASP A 24 78.158 5.622 6.069 1.00 0.00 C ATOM 17 OD1 ASP A 24 77.373 6.537 5.886 1.00 0.00 O ATOM 18 OD2 ASP A 24 78.378 5.120 7.159 1.00 0.00 O ATOM 0 HA ASP A 24 77.429 5.006 3.311 1.00 0.00 H new ATOM 0 HB2 ASP A 24 79.715 4.414 5.192 1.00 0.00 H new ATOM 0 HB3 ASP A 24 79.367 5.884 4.303 1.00 0.00 H new ATOM 23 N PRO A 25 78.036 2.694 2.136 1.00 0.00 N ATOM 24 CA PRO A 25 78.654 1.714 1.206 1.00 0.00 C ATOM 25 C PRO A 25 79.297 2.404 0.006 1.00 0.00 C ATOM 26 O PRO A 25 79.616 1.768 -0.990 1.00 0.00 O ATOM 27 CB PRO A 25 77.456 0.865 0.777 1.00 0.00 C ATOM 28 CG PRO A 25 76.307 1.825 0.759 1.00 0.00 C ATOM 29 CD PRO A 25 76.597 2.868 1.854 1.00 0.00 C ATOM 0 HA PRO A 25 79.459 1.138 1.662 1.00 0.00 H new ATOM 0 HB2 PRO A 25 77.616 0.419 -0.204 1.00 0.00 H new ATOM 0 HB3 PRO A 25 77.279 0.046 1.474 1.00 0.00 H new ATOM 0 HG2 PRO A 25 76.214 2.302 -0.217 1.00 0.00 H new ATOM 0 HG3 PRO A 25 75.367 1.309 0.953 1.00 0.00 H new ATOM 0 HD2 PRO A 25 76.376 3.879 1.512 1.00 0.00 H new ATOM 0 HD3 PRO A 25 75.991 2.693 2.743 1.00 0.00 H new ATOM 37 N LEU A 26 79.475 3.689 0.108 1.00 0.00 N ATOM 38 CA LEU A 26 80.075 4.454 -0.987 1.00 0.00 C ATOM 39 C LEU A 26 81.504 4.002 -1.270 1.00 0.00 C ATOM 40 O LEU A 26 81.964 4.039 -2.411 1.00 0.00 O ATOM 41 CB LEU A 26 80.037 5.956 -0.676 1.00 0.00 C ATOM 42 CG LEU A 26 80.965 6.338 0.480 1.00 0.00 C ATOM 43 CD1 LEU A 26 80.931 7.857 0.670 1.00 0.00 C ATOM 44 CD2 LEU A 26 80.506 5.659 1.777 1.00 0.00 C ATOM 0 H LEU A 26 79.221 4.242 0.926 1.00 0.00 H new ATOM 0 HA LEU A 26 79.486 4.266 -1.884 1.00 0.00 H new ATOM 0 HB2 LEU A 26 80.322 6.516 -1.567 1.00 0.00 H new ATOM 0 HB3 LEU A 26 79.016 6.247 -0.430 1.00 0.00 H new ATOM 0 HG LEU A 26 81.978 6.010 0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 26 81.590 8.136 1.492 1.00 0.00 H new ATOM 0 HD12 LEU A 26 81.266 8.346 -0.245 1.00 0.00 H new ATOM 0 HD13 LEU A 26 79.913 8.172 0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 26 81.175 5.939 2.591 1.00 0.00 H new ATOM 0 HD22 LEU A 26 79.491 5.978 2.015 1.00 0.00 H new ATOM 0 HD23 LEU A 26 80.525 4.577 1.648 1.00 0.00 H new ATOM 56 N VAL A 27 82.184 3.589 -0.248 1.00 0.00 N ATOM 57 CA VAL A 27 83.555 3.130 -0.366 1.00 0.00 C ATOM 58 C VAL A 27 83.653 1.935 -1.311 1.00 0.00 C ATOM 59 O VAL A 27 84.611 1.810 -2.073 1.00 0.00 O ATOM 60 CB VAL A 27 84.047 2.740 1.041 1.00 0.00 C ATOM 61 CG1 VAL A 27 85.586 2.804 1.110 1.00 0.00 C ATOM 62 CG2 VAL A 27 83.409 3.684 2.100 1.00 0.00 C ATOM 0 H VAL A 27 81.813 3.556 0.702 1.00 0.00 H new ATOM 0 HA VAL A 27 84.175 3.925 -0.781 1.00 0.00 H new ATOM 0 HB VAL A 27 83.742 1.716 1.254 1.00 0.00 H new ATOM 0 HG11 VAL A 27 85.917 2.526 2.110 1.00 0.00 H new ATOM 0 HG12 VAL A 27 86.012 2.114 0.382 1.00 0.00 H new ATOM 0 HG13 VAL A 27 85.918 3.818 0.887 1.00 0.00 H new ATOM 0 HG21 VAL A 27 83.759 3.405 3.094 1.00 0.00 H new ATOM 0 HG22 VAL A 27 83.697 4.714 1.890 1.00 0.00 H new ATOM 0 HG23 VAL A 27 82.323 3.595 2.060 1.00 0.00 H new ATOM 72 N VAL A 28 82.672 1.079 -1.258 1.00 0.00 N ATOM 73 CA VAL A 28 82.656 -0.099 -2.115 1.00 0.00 C ATOM 74 C VAL A 28 82.349 0.270 -3.575 1.00 0.00 C ATOM 75 O VAL A 28 82.775 -0.427 -4.494 1.00 0.00 O ATOM 76 CB VAL A 28 81.642 -1.141 -1.566 1.00 0.00 C ATOM 77 CG1 VAL A 28 80.252 -0.979 -2.214 1.00 0.00 C ATOM 78 CG2 VAL A 28 82.156 -2.566 -1.832 1.00 0.00 C ATOM 0 H VAL A 28 81.869 1.164 -0.635 1.00 0.00 H new ATOM 0 HA VAL A 28 83.650 -0.546 -2.105 1.00 0.00 H new ATOM 0 HB VAL A 28 81.545 -0.970 -0.494 1.00 0.00 H new ATOM 0 HG11 VAL A 28 79.571 -1.725 -1.805 1.00 0.00 H new ATOM 0 HG12 VAL A 28 79.867 0.019 -2.004 1.00 0.00 H new ATOM 0 HG13 VAL A 28 80.335 -1.116 -3.292 1.00 0.00 H new ATOM 0 HG21 VAL A 28 81.439 -3.290 -1.444 1.00 0.00 H new ATOM 0 HG22 VAL A 28 82.277 -2.715 -2.905 1.00 0.00 H new ATOM 0 HG23 VAL A 28 83.117 -2.705 -1.336 1.00 0.00 H new ATOM 88 N ALA A 29 81.587 1.320 -3.784 1.00 0.00 N ATOM 89 CA ALA A 29 81.205 1.708 -5.144 1.00 0.00 C ATOM 90 C ALA A 29 82.403 2.069 -6.017 1.00 0.00 C ATOM 91 O ALA A 29 82.548 1.522 -7.111 1.00 0.00 O ATOM 92 CB ALA A 29 80.250 2.901 -5.083 1.00 0.00 C ATOM 0 H ALA A 29 81.218 1.921 -3.047 1.00 0.00 H new ATOM 0 HA ALA A 29 80.721 0.844 -5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 29 79.965 3.191 -6.094 1.00 0.00 H new ATOM 0 HB2 ALA A 29 79.359 2.625 -4.520 1.00 0.00 H new ATOM 0 HB3 ALA A 29 80.745 3.739 -4.591 1.00 0.00 H new ATOM 98 N ALA A 30 83.246 2.970 -5.575 1.00 0.00 N ATOM 99 CA ALA A 30 84.385 3.338 -6.387 1.00 0.00 C ATOM 100 C ALA A 30 85.210 2.097 -6.684 1.00 0.00 C ATOM 101 O ALA A 30 85.545 1.800 -7.830 1.00 0.00 O ATOM 102 CB ALA A 30 85.222 4.323 -5.606 1.00 0.00 C ATOM 0 H ALA A 30 83.171 3.453 -4.680 1.00 0.00 H new ATOM 0 HA ALA A 30 84.056 3.783 -7.326 1.00 0.00 H new ATOM 0 HB1 ALA A 30 86.088 4.615 -6.199 1.00 0.00 H new ATOM 0 HB2 ALA A 30 84.625 5.206 -5.376 1.00 0.00 H new ATOM 0 HB3 ALA A 30 85.558 3.860 -4.678 1.00 0.00 H new ATOM 108 N SER A 31 85.508 1.394 -5.636 1.00 0.00 N ATOM 109 CA SER A 31 86.281 0.168 -5.736 1.00 0.00 C ATOM 110 C SER A 31 85.677 -0.769 -6.787 1.00 0.00 C ATOM 111 O SER A 31 86.382 -1.271 -7.662 1.00 0.00 O ATOM 112 CB SER A 31 86.289 -0.525 -4.379 1.00 0.00 C ATOM 113 OG SER A 31 87.104 -1.690 -4.447 1.00 0.00 O ATOM 0 H SER A 31 85.230 1.641 -4.686 1.00 0.00 H new ATOM 0 HA SER A 31 87.299 0.414 -6.038 1.00 0.00 H new ATOM 0 HB2 SER A 31 86.668 0.153 -3.614 1.00 0.00 H new ATOM 0 HB3 SER A 31 85.273 -0.795 -4.090 1.00 0.00 H new ATOM 0 HG SER A 31 87.023 -2.195 -3.611 1.00 0.00 H new ATOM 119 N ILE A 32 84.393 -1.008 -6.684 1.00 0.00 N ATOM 120 CA ILE A 32 83.703 -1.906 -7.615 1.00 0.00 C ATOM 121 C ILE A 32 84.024 -1.555 -9.073 1.00 0.00 C ATOM 122 O ILE A 32 84.351 -2.441 -9.864 1.00 0.00 O ATOM 123 CB ILE A 32 82.177 -1.849 -7.361 1.00 0.00 C ATOM 124 CG1 ILE A 32 81.816 -2.757 -6.177 1.00 0.00 C ATOM 125 CG2 ILE A 32 81.397 -2.318 -8.599 1.00 0.00 C ATOM 126 CD1 ILE A 32 80.380 -2.473 -5.732 1.00 0.00 C ATOM 0 H ILE A 32 83.792 -0.599 -5.968 1.00 0.00 H new ATOM 0 HA ILE A 32 84.057 -2.922 -7.440 1.00 0.00 H new ATOM 0 HB ILE A 32 81.908 -0.816 -7.141 1.00 0.00 H new ATOM 0 HG12 ILE A 32 81.918 -3.804 -6.464 1.00 0.00 H new ATOM 0 HG13 ILE A 32 82.505 -2.584 -5.350 1.00 0.00 H new ATOM 0 HG21 ILE A 32 80.327 -2.269 -8.395 1.00 0.00 H new ATOM 0 HG22 ILE A 32 81.635 -1.673 -9.445 1.00 0.00 H new ATOM 0 HG23 ILE A 32 81.674 -3.345 -8.836 1.00 0.00 H new ATOM 0 HD11 ILE A 32 80.125 -3.118 -4.891 1.00 0.00 H new ATOM 0 HD12 ILE A 32 80.293 -1.430 -5.428 1.00 0.00 H new ATOM 0 HD13 ILE A 32 79.697 -2.668 -6.559 1.00 0.00 H new ATOM 138 N ILE A 33 83.934 -0.304 -9.428 1.00 0.00 N ATOM 139 CA ILE A 33 84.228 0.083 -10.805 1.00 0.00 C ATOM 140 C ILE A 33 85.661 -0.319 -11.151 1.00 0.00 C ATOM 141 O ILE A 33 85.919 -0.909 -12.201 1.00 0.00 O ATOM 142 CB ILE A 33 84.051 1.596 -10.997 1.00 0.00 C ATOM 143 CG1 ILE A 33 82.567 1.966 -10.859 1.00 0.00 C ATOM 144 CG2 ILE A 33 84.548 1.988 -12.393 1.00 0.00 C ATOM 145 CD1 ILE A 33 82.408 3.494 -10.844 1.00 0.00 C ATOM 0 H ILE A 33 83.666 0.461 -8.808 1.00 0.00 H new ATOM 0 HA ILE A 33 83.531 -0.430 -11.468 1.00 0.00 H new ATOM 0 HB ILE A 33 84.625 2.129 -10.239 1.00 0.00 H new ATOM 0 HG12 ILE A 33 81.999 1.541 -11.686 1.00 0.00 H new ATOM 0 HG13 ILE A 33 82.161 1.540 -9.941 1.00 0.00 H new ATOM 0 HG21 ILE A 33 84.425 3.062 -12.535 1.00 0.00 H new ATOM 0 HG22 ILE A 33 85.602 1.728 -12.490 1.00 0.00 H new ATOM 0 HG23 ILE A 33 83.971 1.454 -13.148 1.00 0.00 H new ATOM 0 HD11 ILE A 33 81.353 3.749 -10.746 1.00 0.00 H new ATOM 0 HD12 ILE A 33 82.962 3.909 -10.002 1.00 0.00 H new ATOM 0 HD13 ILE A 33 82.797 3.909 -11.774 1.00 0.00 H new ATOM 157 N GLY A 34 86.569 0.021 -10.281 1.00 0.00 N ATOM 158 CA GLY A 34 87.981 -0.280 -10.496 1.00 0.00 C ATOM 159 C GLY A 34 88.194 -1.739 -10.902 1.00 0.00 C ATOM 160 O GLY A 34 88.894 -2.020 -11.873 1.00 0.00 O ATOM 0 H GLY A 34 86.369 0.509 -9.408 1.00 0.00 H new ATOM 0 HA2 GLY A 34 88.379 0.375 -11.271 1.00 0.00 H new ATOM 0 HA3 GLY A 34 88.540 -0.071 -9.584 1.00 0.00 H new ATOM 164 N ILE A 35 87.610 -2.649 -10.174 1.00 0.00 N ATOM 165 CA ILE A 35 87.763 -4.071 -10.484 1.00 0.00 C ATOM 166 C ILE A 35 87.090 -4.414 -11.812 1.00 0.00 C ATOM 167 O ILE A 35 87.632 -5.165 -12.623 1.00 0.00 O ATOM 168 CB ILE A 35 87.146 -4.919 -9.367 1.00 0.00 C ATOM 169 CG1 ILE A 35 87.717 -4.471 -8.018 1.00 0.00 C ATOM 170 CG2 ILE A 35 87.482 -6.398 -9.598 1.00 0.00 C ATOM 171 CD1 ILE A 35 87.112 -5.317 -6.897 1.00 0.00 C ATOM 0 H ILE A 35 87.024 -2.449 -9.364 1.00 0.00 H new ATOM 0 HA ILE A 35 88.828 -4.289 -10.565 1.00 0.00 H new ATOM 0 HB ILE A 35 86.064 -4.790 -9.368 1.00 0.00 H new ATOM 0 HG12 ILE A 35 88.802 -4.574 -8.019 1.00 0.00 H new ATOM 0 HG13 ILE A 35 87.497 -3.417 -7.851 1.00 0.00 H new ATOM 0 HG21 ILE A 35 87.042 -7.000 -8.802 1.00 0.00 H new ATOM 0 HG22 ILE A 35 87.079 -6.717 -10.559 1.00 0.00 H new ATOM 0 HG23 ILE A 35 88.564 -6.530 -9.597 1.00 0.00 H new ATOM 0 HD11 ILE A 35 87.520 -4.996 -5.938 1.00 0.00 H new ATOM 0 HD12 ILE A 35 86.029 -5.192 -6.891 1.00 0.00 H new ATOM 0 HD13 ILE A 35 87.355 -6.367 -7.062 1.00 0.00 H new ATOM 183 N LEU A 36 85.921 -3.878 -12.009 1.00 0.00 N ATOM 184 CA LEU A 36 85.150 -4.127 -13.224 1.00 0.00 C ATOM 185 C LEU A 36 85.976 -3.857 -14.484 1.00 0.00 C ATOM 186 O LEU A 36 85.756 -4.481 -15.521 1.00 0.00 O ATOM 187 CB LEU A 36 83.912 -3.218 -13.216 1.00 0.00 C ATOM 188 CG LEU A 36 82.972 -3.542 -14.394 1.00 0.00 C ATOM 189 CD1 LEU A 36 82.151 -4.803 -14.098 1.00 0.00 C ATOM 190 CD2 LEU A 36 82.017 -2.363 -14.613 1.00 0.00 C ATOM 0 H LEU A 36 85.463 -3.256 -11.343 1.00 0.00 H new ATOM 0 HA LEU A 36 84.857 -5.177 -13.240 1.00 0.00 H new ATOM 0 HB2 LEU A 36 83.375 -3.340 -12.275 1.00 0.00 H new ATOM 0 HB3 LEU A 36 84.224 -2.175 -13.273 1.00 0.00 H new ATOM 0 HG LEU A 36 83.573 -3.714 -15.287 1.00 0.00 H new ATOM 0 HD11 LEU A 36 81.494 -5.015 -14.941 1.00 0.00 H new ATOM 0 HD12 LEU A 36 82.823 -5.646 -13.941 1.00 0.00 H new ATOM 0 HD13 LEU A 36 81.552 -4.645 -13.201 1.00 0.00 H new ATOM 0 HD21 LEU A 36 81.349 -2.586 -15.445 1.00 0.00 H new ATOM 0 HD22 LEU A 36 81.429 -2.198 -13.710 1.00 0.00 H new ATOM 0 HD23 LEU A 36 82.593 -1.466 -14.840 1.00 0.00 H new ATOM 202 N HIS A 37 86.896 -2.935 -14.401 1.00 0.00 N ATOM 203 CA HIS A 37 87.725 -2.594 -15.558 1.00 0.00 C ATOM 204 C HIS A 37 88.749 -3.689 -15.887 1.00 0.00 C ATOM 205 O HIS A 37 89.146 -3.845 -17.040 1.00 0.00 O ATOM 206 CB HIS A 37 88.414 -1.224 -15.329 1.00 0.00 C ATOM 207 CG HIS A 37 89.806 -1.371 -14.750 1.00 0.00 C ATOM 208 ND1 HIS A 37 90.792 -2.138 -15.356 1.00 0.00 N ATOM 209 CD2 HIS A 37 90.392 -0.830 -13.632 1.00 0.00 C ATOM 210 CE1 HIS A 37 91.903 -2.040 -14.605 1.00 0.00 C ATOM 211 NE2 HIS A 37 91.715 -1.254 -13.543 1.00 0.00 N ATOM 0 H HIS A 37 87.101 -2.401 -13.556 1.00 0.00 H new ATOM 0 HA HIS A 37 87.071 -2.519 -16.427 1.00 0.00 H new ATOM 0 HB2 HIS A 37 88.471 -0.686 -16.275 1.00 0.00 H new ATOM 0 HB3 HIS A 37 87.805 -0.621 -14.656 1.00 0.00 H new ATOM 0 HD2 HIS A 37 89.901 -0.175 -12.928 1.00 0.00 H new ATOM 0 HE1 HIS A 37 92.834 -2.537 -14.833 1.00 0.00 H new ATOM 0 HE2 HIS A 37 92.395 -1.015 -12.821 1.00 0.00 H new ATOM 220 N PHE A 38 89.194 -4.399 -14.888 1.00 0.00 N ATOM 221 CA PHE A 38 90.207 -5.434 -15.095 1.00 0.00 C ATOM 222 C PHE A 38 89.803 -6.438 -16.179 1.00 0.00 C ATOM 223 O PHE A 38 90.584 -6.714 -17.089 1.00 0.00 O ATOM 224 CB PHE A 38 90.472 -6.173 -13.783 1.00 0.00 C ATOM 225 CG PHE A 38 91.585 -7.173 -13.992 1.00 0.00 C ATOM 226 CD1 PHE A 38 92.919 -6.776 -13.836 1.00 0.00 C ATOM 227 CD2 PHE A 38 91.284 -8.494 -14.344 1.00 0.00 C ATOM 228 CE1 PHE A 38 93.950 -7.700 -14.032 1.00 0.00 C ATOM 229 CE2 PHE A 38 92.317 -9.417 -14.541 1.00 0.00 C ATOM 230 CZ PHE A 38 93.650 -9.021 -14.385 1.00 0.00 C ATOM 0 H PHE A 38 88.883 -4.292 -13.922 1.00 0.00 H new ATOM 0 HA PHE A 38 91.115 -4.934 -15.433 1.00 0.00 H new ATOM 0 HB2 PHE A 38 90.746 -5.464 -13.001 1.00 0.00 H new ATOM 0 HB3 PHE A 38 89.568 -6.682 -13.449 1.00 0.00 H new ATOM 0 HD1 PHE A 38 93.151 -5.757 -13.564 1.00 0.00 H new ATOM 0 HD2 PHE A 38 90.255 -8.800 -14.463 1.00 0.00 H new ATOM 0 HE1 PHE A 38 94.979 -7.394 -13.911 1.00 0.00 H new ATOM 0 HE2 PHE A 38 92.085 -10.436 -14.814 1.00 0.00 H new ATOM 0 HZ PHE A 38 94.447 -9.734 -14.537 1.00 0.00 H new ATOM 240 N ILE A 39 88.619 -6.980 -16.086 1.00 0.00 N ATOM 241 CA ILE A 39 88.168 -7.956 -17.078 1.00 0.00 C ATOM 242 C ILE A 39 88.257 -7.371 -18.488 1.00 0.00 C ATOM 243 O ILE A 39 88.521 -8.088 -19.452 1.00 0.00 O ATOM 244 CB ILE A 39 86.719 -8.385 -16.782 1.00 0.00 C ATOM 245 CG1 ILE A 39 86.672 -9.228 -15.498 1.00 0.00 C ATOM 246 CG2 ILE A 39 86.182 -9.228 -17.945 1.00 0.00 C ATOM 247 CD1 ILE A 39 86.947 -8.356 -14.268 1.00 0.00 C ATOM 0 H ILE A 39 87.946 -6.775 -15.348 1.00 0.00 H new ATOM 0 HA ILE A 39 88.818 -8.829 -17.019 1.00 0.00 H new ATOM 0 HB ILE A 39 86.108 -7.491 -16.657 1.00 0.00 H new ATOM 0 HG12 ILE A 39 85.695 -9.701 -15.403 1.00 0.00 H new ATOM 0 HG13 ILE A 39 87.410 -10.028 -15.555 1.00 0.00 H new ATOM 0 HG21 ILE A 39 85.156 -9.530 -17.732 1.00 0.00 H new ATOM 0 HG22 ILE A 39 86.204 -8.639 -18.862 1.00 0.00 H new ATOM 0 HG23 ILE A 39 86.803 -10.115 -18.069 1.00 0.00 H new ATOM 0 HD11 ILE A 39 86.909 -8.972 -13.370 1.00 0.00 H new ATOM 0 HD12 ILE A 39 87.935 -7.903 -14.356 1.00 0.00 H new ATOM 0 HD13 ILE A 39 86.193 -7.572 -14.202 1.00 0.00 H new ATOM 259 N ALA A 40 88.053 -6.089 -18.594 1.00 0.00 N ATOM 260 CA ALA A 40 88.132 -5.420 -19.886 1.00 0.00 C ATOM 261 C ALA A 40 89.582 -5.293 -20.348 1.00 0.00 C ATOM 262 O ALA A 40 89.863 -5.219 -21.541 1.00 0.00 O ATOM 263 CB ALA A 40 87.479 -4.040 -19.805 1.00 0.00 C ATOM 0 H ALA A 40 87.830 -5.476 -17.810 1.00 0.00 H new ATOM 0 HA ALA A 40 87.595 -6.024 -20.617 1.00 0.00 H new ATOM 0 HB1 ALA A 40 87.544 -3.549 -20.776 1.00 0.00 H new ATOM 0 HB2 ALA A 40 86.432 -4.149 -19.523 1.00 0.00 H new ATOM 0 HB3 ALA A 40 87.995 -3.437 -19.058 1.00 0.00 H new ATOM 269 N TRP A 41 90.476 -5.209 -19.405 1.00 0.00 N ATOM 270 CA TRP A 41 91.892 -5.029 -19.697 1.00 0.00 C ATOM 271 C TRP A 41 92.486 -6.186 -20.498 1.00 0.00 C ATOM 272 O TRP A 41 93.156 -5.972 -21.509 1.00 0.00 O ATOM 273 CB TRP A 41 92.631 -4.905 -18.364 1.00 0.00 C ATOM 274 CG TRP A 41 94.008 -4.391 -18.593 1.00 0.00 C ATOM 275 CD1 TRP A 41 94.988 -5.060 -19.239 1.00 0.00 C ATOM 276 CD2 TRP A 41 94.576 -3.119 -18.179 1.00 0.00 C ATOM 277 NE1 TRP A 41 96.123 -4.266 -19.265 1.00 0.00 N ATOM 278 CE2 TRP A 41 95.918 -3.060 -18.618 1.00 0.00 C ATOM 279 CE3 TRP A 41 94.059 -2.017 -17.472 1.00 0.00 C ATOM 280 CZ2 TRP A 41 96.719 -1.944 -18.366 1.00 0.00 C ATOM 281 CZ3 TRP A 41 94.864 -0.897 -17.214 1.00 0.00 C ATOM 282 CH2 TRP A 41 96.190 -0.861 -17.661 1.00 0.00 C ATOM 0 H TRP A 41 90.257 -5.262 -18.410 1.00 0.00 H new ATOM 0 HA TRP A 41 92.004 -4.134 -20.310 1.00 0.00 H new ATOM 0 HB2 TRP A 41 92.089 -4.233 -17.699 1.00 0.00 H new ATOM 0 HB3 TRP A 41 92.674 -5.876 -17.870 1.00 0.00 H new ATOM 0 HD1 TRP A 41 94.901 -6.049 -19.664 1.00 0.00 H new ATOM 0 HE1 TRP A 41 97.002 -4.537 -19.707 1.00 0.00 H new ATOM 0 HE3 TRP A 41 93.036 -2.034 -17.126 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 97.741 -1.919 -18.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 94.458 -0.058 -16.668 1.00 0.00 H new ATOM 0 HH2 TRP A 41 96.804 0.005 -17.461 1.00 0.00 H new ATOM 293 N THR A 42 92.282 -7.378 -20.030 1.00 0.00 N ATOM 294 CA THR A 42 92.841 -8.562 -20.682 1.00 0.00 C ATOM 295 C THR A 42 92.565 -8.602 -22.188 1.00 0.00 C ATOM 296 O THR A 42 93.456 -8.945 -22.964 1.00 0.00 O ATOM 297 CB THR A 42 92.281 -9.828 -20.029 1.00 0.00 C ATOM 298 OG1 THR A 42 92.373 -10.910 -20.945 1.00 0.00 O ATOM 299 CG2 THR A 42 90.819 -9.600 -19.655 1.00 0.00 C ATOM 0 H THR A 42 91.731 -7.576 -19.195 1.00 0.00 H new ATOM 0 HA THR A 42 93.922 -8.511 -20.553 1.00 0.00 H new ATOM 0 HB THR A 42 92.854 -10.061 -19.131 1.00 0.00 H new ATOM 0 HG1 THR A 42 92.016 -11.722 -20.529 1.00 0.00 H new ATOM 0 HG21 THR A 42 90.418 -10.500 -19.190 1.00 0.00 H new ATOM 0 HG22 THR A 42 90.748 -8.767 -18.955 1.00 0.00 H new ATOM 0 HG23 THR A 42 90.246 -9.369 -20.553 1.00 0.00 H new ATOM 307 N ILE A 43 91.363 -8.298 -22.605 1.00 0.00 N ATOM 308 CA ILE A 43 91.056 -8.363 -24.034 1.00 0.00 C ATOM 309 C ILE A 43 91.886 -7.361 -24.846 1.00 0.00 C ATOM 310 O ILE A 43 92.368 -7.691 -25.927 1.00 0.00 O ATOM 311 CB ILE A 43 89.558 -8.151 -24.294 1.00 0.00 C ATOM 312 CG1 ILE A 43 89.060 -6.905 -23.561 1.00 0.00 C ATOM 313 CG2 ILE A 43 88.778 -9.371 -23.798 1.00 0.00 C ATOM 314 CD1 ILE A 43 87.693 -6.502 -24.120 1.00 0.00 C ATOM 0 H ILE A 43 90.591 -8.009 -22.004 1.00 0.00 H new ATOM 0 HA ILE A 43 91.326 -9.365 -24.367 1.00 0.00 H new ATOM 0 HB ILE A 43 89.403 -8.019 -25.365 1.00 0.00 H new ATOM 0 HG12 ILE A 43 88.984 -7.104 -22.492 1.00 0.00 H new ATOM 0 HG13 ILE A 43 89.771 -6.088 -23.684 1.00 0.00 H new ATOM 0 HG21 ILE A 43 87.714 -9.222 -23.982 1.00 0.00 H new ATOM 0 HG22 ILE A 43 89.117 -10.260 -24.329 1.00 0.00 H new ATOM 0 HG23 ILE A 43 88.947 -9.501 -22.729 1.00 0.00 H new ATOM 0 HD11 ILE A 43 87.335 -5.614 -23.600 1.00 0.00 H new ATOM 0 HD12 ILE A 43 87.784 -6.287 -25.185 1.00 0.00 H new ATOM 0 HD13 ILE A 43 86.985 -7.318 -23.974 1.00 0.00 H new ATOM 326 N GLY A 44 92.049 -6.167 -24.344 1.00 0.00 N ATOM 327 CA GLY A 44 92.823 -5.151 -25.061 1.00 0.00 C ATOM 328 C GLY A 44 94.275 -5.593 -25.254 1.00 0.00 C ATOM 329 O GLY A 44 94.900 -5.291 -26.270 1.00 0.00 O ATOM 0 H GLY A 44 91.666 -5.861 -23.450 1.00 0.00 H new ATOM 0 HA2 GLY A 44 92.366 -4.961 -26.032 1.00 0.00 H new ATOM 0 HA3 GLY A 44 92.797 -4.213 -24.507 1.00 0.00 H new ATOM 333 N HIS A 45 94.790 -6.285 -24.279 1.00 0.00 N ATOM 334 CA HIS A 45 96.170 -6.764 -24.320 1.00 0.00 C ATOM 335 C HIS A 45 96.483 -7.466 -25.643 1.00 0.00 C ATOM 336 O HIS A 45 97.640 -7.523 -26.062 1.00 0.00 O ATOM 337 CB HIS A 45 96.419 -7.720 -23.155 1.00 0.00 C ATOM 338 CG HIS A 45 97.878 -8.082 -23.110 1.00 0.00 C ATOM 339 ND1 HIS A 45 98.317 -9.397 -23.126 1.00 0.00 N ATOM 340 CD2 HIS A 45 99.011 -7.309 -23.049 1.00 0.00 C ATOM 341 CE1 HIS A 45 99.662 -9.375 -23.077 1.00 0.00 C ATOM 342 NE2 HIS A 45 100.135 -8.127 -23.027 1.00 0.00 N ATOM 0 H HIS A 45 94.282 -6.540 -23.432 1.00 0.00 H new ATOM 0 HA HIS A 45 96.829 -5.900 -24.236 1.00 0.00 H new ATOM 0 HB2 HIS A 45 96.120 -7.253 -22.217 1.00 0.00 H new ATOM 0 HB3 HIS A 45 95.813 -8.619 -23.272 1.00 0.00 H new ATOM 0 HD2 HIS A 45 99.027 -6.229 -23.022 1.00 0.00 H new ATOM 0 HE1 HIS A 45 100.283 -10.259 -23.078 1.00 0.00 H new ATOM 0 HE2 HIS A 45 101.112 -7.836 -22.982 1.00 0.00 H new ATOM 351 N LEU A 46 95.481 -8.031 -26.258 1.00 0.00 N ATOM 352 CA LEU A 46 95.677 -8.776 -27.502 1.00 0.00 C ATOM 353 C LEU A 46 96.576 -8.015 -28.482 1.00 0.00 C ATOM 354 O LEU A 46 97.290 -8.632 -29.274 1.00 0.00 O ATOM 355 CB LEU A 46 94.300 -9.065 -28.147 1.00 0.00 C ATOM 356 CG LEU A 46 93.844 -7.875 -29.039 1.00 0.00 C ATOM 357 CD1 LEU A 46 94.472 -7.970 -30.459 1.00 0.00 C ATOM 358 CD2 LEU A 46 92.306 -7.851 -29.156 1.00 0.00 C ATOM 0 H LEU A 46 94.516 -7.998 -25.930 1.00 0.00 H new ATOM 0 HA LEU A 46 96.178 -9.715 -27.266 1.00 0.00 H new ATOM 0 HB2 LEU A 46 94.358 -9.973 -28.747 1.00 0.00 H new ATOM 0 HB3 LEU A 46 93.560 -9.245 -27.368 1.00 0.00 H new ATOM 0 HG LEU A 46 94.185 -6.954 -28.567 1.00 0.00 H new ATOM 0 HD11 LEU A 46 94.137 -7.126 -31.062 1.00 0.00 H new ATOM 0 HD12 LEU A 46 95.559 -7.950 -30.378 1.00 0.00 H new ATOM 0 HD13 LEU A 46 94.161 -8.901 -30.933 1.00 0.00 H new ATOM 0 HD21 LEU A 46 92.002 -7.013 -29.783 1.00 0.00 H new ATOM 0 HD22 LEU A 46 91.961 -8.783 -29.603 1.00 0.00 H new ATOM 0 HD23 LEU A 46 91.867 -7.740 -28.164 1.00 0.00 H new ATOM 370 N ASN A 47 96.549 -6.713 -28.434 1.00 0.00 N ATOM 371 CA ASN A 47 97.386 -5.930 -29.340 1.00 0.00 C ATOM 372 C ASN A 47 98.865 -6.236 -29.091 1.00 0.00 C ATOM 373 O ASN A 47 99.608 -6.555 -30.019 1.00 0.00 O ATOM 374 CB ASN A 47 97.134 -4.436 -29.130 1.00 0.00 C ATOM 375 CG ASN A 47 95.715 -4.080 -29.555 1.00 0.00 C ATOM 376 OD1 ASN A 47 95.264 -4.489 -30.625 1.00 0.00 O ATOM 377 ND2 ASN A 47 94.978 -3.337 -28.775 1.00 0.00 N ATOM 0 H ASN A 47 95.972 -6.166 -27.794 1.00 0.00 H new ATOM 0 HA ASN A 47 97.131 -6.198 -30.365 1.00 0.00 H new ATOM 0 HB2 ASN A 47 97.284 -4.178 -28.082 1.00 0.00 H new ATOM 0 HB3 ASN A 47 97.852 -3.853 -29.707 1.00 0.00 H new ATOM 0 HD21 ASN A 47 94.027 -3.094 -29.052 1.00 0.00 H new ATOM 0 HD22 ASN A 47 95.353 -2.999 -27.889 1.00 0.00 H new ATOM 384 N GLN A 48 99.274 -6.135 -27.854 1.00 0.00 N ATOM 385 CA GLN A 48 100.662 -6.398 -27.485 1.00 0.00 C ATOM 386 C GLN A 48 101.156 -7.687 -28.137 1.00 0.00 C ATOM 387 O GLN A 48 102.216 -7.709 -28.761 1.00 0.00 O ATOM 388 CB GLN A 48 100.779 -6.509 -25.959 1.00 0.00 C ATOM 389 CG GLN A 48 102.234 -6.291 -25.527 1.00 0.00 C ATOM 390 CD GLN A 48 103.117 -7.412 -26.066 1.00 0.00 C ATOM 391 OE1 GLN A 48 102.838 -8.589 -25.839 1.00 0.00 O ATOM 392 NE2 GLN A 48 104.174 -7.115 -26.772 1.00 0.00 N ATOM 0 H GLN A 48 98.672 -5.872 -27.074 1.00 0.00 H new ATOM 0 HA GLN A 48 101.280 -5.572 -27.838 1.00 0.00 H new ATOM 0 HB2 GLN A 48 100.135 -5.770 -25.482 1.00 0.00 H new ATOM 0 HB3 GLN A 48 100.437 -7.490 -25.630 1.00 0.00 H new ATOM 0 HG2 GLN A 48 102.590 -5.329 -25.895 1.00 0.00 H new ATOM 0 HG3 GLN A 48 102.297 -6.259 -24.439 1.00 0.00 H new ATOM 0 HE21 GLN A 48 104.404 -6.139 -26.960 1.00 0.00 H new ATOM 0 HE22 GLN A 48 104.770 -7.859 -27.136 1.00 0.00 H new ATOM 401 N ILE A 49 100.401 -8.741 -27.983 1.00 0.00 N ATOM 402 CA ILE A 49 100.779 -10.028 -28.555 1.00 0.00 C ATOM 403 C ILE A 49 101.130 -9.873 -30.031 1.00 0.00 C ATOM 404 O ILE A 49 102.174 -10.343 -30.482 1.00 0.00 O ATOM 405 CB ILE A 49 99.622 -11.020 -28.410 1.00 0.00 C ATOM 406 CG1 ILE A 49 99.099 -11.002 -26.966 1.00 0.00 C ATOM 407 CG2 ILE A 49 100.105 -12.428 -28.763 1.00 0.00 C ATOM 408 CD1 ILE A 49 100.253 -11.199 -25.978 1.00 0.00 C ATOM 0 H ILE A 49 99.520 -8.746 -27.469 1.00 0.00 H new ATOM 0 HA ILE A 49 101.652 -10.402 -28.020 1.00 0.00 H new ATOM 0 HB ILE A 49 98.817 -10.733 -29.087 1.00 0.00 H new ATOM 0 HG12 ILE A 49 98.598 -10.055 -26.766 1.00 0.00 H new ATOM 0 HG13 ILE A 49 98.358 -11.790 -26.831 1.00 0.00 H new ATOM 0 HG21 ILE A 49 99.280 -13.132 -28.659 1.00 0.00 H new ATOM 0 HG22 ILE A 49 100.466 -12.442 -29.791 1.00 0.00 H new ATOM 0 HG23 ILE A 49 100.914 -12.715 -28.090 1.00 0.00 H new ATOM 0 HD11 ILE A 49 99.866 -11.184 -24.959 1.00 0.00 H new ATOM 0 HD12 ILE A 49 100.736 -12.158 -26.169 1.00 0.00 H new ATOM 0 HD13 ILE A 49 100.979 -10.396 -26.102 1.00 0.00 H new ATOM 420 N LYS A 50 100.267 -9.225 -30.764 1.00 0.00 N ATOM 421 CA LYS A 50 100.498 -9.018 -32.190 1.00 0.00 C ATOM 422 C LYS A 50 101.559 -7.938 -32.404 1.00 0.00 C ATOM 423 O LYS A 50 102.676 -8.229 -32.834 1.00 0.00 O ATOM 424 CB LYS A 50 99.180 -8.614 -32.878 1.00 0.00 C ATOM 425 CG LYS A 50 99.178 -9.077 -34.342 1.00 0.00 C ATOM 426 CD LYS A 50 100.342 -8.429 -35.095 1.00 0.00 C ATOM 427 CE LYS A 50 100.145 -8.620 -36.600 1.00 0.00 C ATOM 428 NZ LYS A 50 99.001 -7.784 -37.062 1.00 0.00 N ATOM 0 H LYS A 50 99.397 -8.828 -30.411 1.00 0.00 H new ATOM 0 HA LYS A 50 100.858 -9.948 -32.630 1.00 0.00 H new ATOM 0 HB2 LYS A 50 98.336 -9.056 -32.349 1.00 0.00 H new ATOM 0 HB3 LYS A 50 99.055 -7.532 -32.832 1.00 0.00 H new ATOM 0 HG2 LYS A 50 99.262 -10.163 -34.389 1.00 0.00 H new ATOM 0 HG3 LYS A 50 98.233 -8.810 -34.816 1.00 0.00 H new ATOM 0 HD2 LYS A 50 100.397 -7.367 -34.857 1.00 0.00 H new ATOM 0 HD3 LYS A 50 101.286 -8.875 -34.781 1.00 0.00 H new ATOM 0 HE2 LYS A 50 101.053 -8.340 -37.135 1.00 0.00 H new ATOM 0 HE3 LYS A 50 99.955 -9.670 -36.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 99.123 -7.555 -38.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 98.113 -8.309 -36.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 98.968 -6.904 -36.508 1.00 0.00 H new ATOM 442 N ARG A 51 101.209 -6.717 -32.106 1.00 0.00 N ATOM 443 CA ARG A 51 102.139 -5.605 -32.271 1.00 0.00 C ATOM 444 C ARG A 51 103.239 -5.665 -31.215 1.00 0.00 C ATOM 445 O ARG A 51 102.965 -5.834 -30.026 1.00 0.00 O ATOM 446 CB ARG A 51 101.388 -4.276 -32.158 1.00 0.00 C ATOM 447 CG ARG A 51 102.352 -3.119 -32.427 1.00 0.00 C ATOM 448 CD ARG A 51 101.579 -1.799 -32.420 1.00 0.00 C ATOM 449 NE ARG A 51 102.444 -0.705 -32.845 1.00 0.00 N ATOM 450 CZ ARG A 51 101.977 0.502 -33.006 1.00 0.00 C ATOM 451 NH1 ARG A 51 100.714 0.748 -32.787 1.00 0.00 N ATOM 452 NH2 ARG A 51 102.773 1.464 -33.387 1.00 0.00 N ATOM 0 H ARG A 51 100.291 -6.455 -31.747 1.00 0.00 H new ATOM 0 HA ARG A 51 102.596 -5.680 -33.258 1.00 0.00 H new ATOM 0 HB2 ARG A 51 100.564 -4.250 -32.871 1.00 0.00 H new ATOM 0 HB3 ARG A 51 100.952 -4.176 -31.164 1.00 0.00 H new ATOM 0 HG2 ARG A 51 103.134 -3.099 -31.668 1.00 0.00 H new ATOM 0 HG3 ARG A 51 102.845 -3.259 -33.389 1.00 0.00 H new ATOM 0 HD2 ARG A 51 100.718 -1.870 -33.084 1.00 0.00 H new ATOM 0 HD3 ARG A 51 101.194 -1.600 -31.420 1.00 0.00 H new ATOM 0 HE ARG A 51 103.432 -0.887 -33.020 1.00 0.00 H new ATOM 0 HH11 ARG A 51 100.092 -0.004 -32.490 1.00 0.00 H new ATOM 0 HH12 ARG A 51 100.349 1.692 -32.913 1.00 0.00 H new ATOM 0 HH21 ARG A 51 103.760 1.272 -33.559 1.00 0.00 H new ATOM 0 HH22 ARG A 51 102.408 2.408 -33.513 1.00 0.00 H new ATOM 466 N GLY A 52 104.463 -5.528 -31.649 1.00 0.00 N ATOM 467 CA GLY A 52 105.597 -5.568 -30.733 1.00 0.00 C ATOM 468 C GLY A 52 105.461 -4.504 -29.650 1.00 0.00 C ATOM 0 H GLY A 52 104.712 -5.387 -32.628 1.00 0.00 H new ATOM 0 HA2 GLY A 52 105.663 -6.554 -30.273 1.00 0.00 H new ATOM 0 HA3 GLY A 52 106.523 -5.412 -31.287 1.00 0.00 H new ATOM 473 N SER B 23 87.573 16.970 4.327 1.00 0.00 N ATOM 474 CA SER B 23 86.467 17.963 4.244 1.00 0.00 C ATOM 475 C SER B 23 85.581 17.637 3.045 1.00 0.00 C ATOM 476 O SER B 23 84.359 17.770 3.110 1.00 0.00 O ATOM 477 CB SER B 23 87.056 19.367 4.090 1.00 0.00 C ATOM 478 OG SER B 23 87.652 19.764 5.317 1.00 0.00 O ATOM 0 HA SER B 23 85.868 17.923 5.154 1.00 0.00 H new ATOM 0 HB2 SER B 23 87.798 19.377 3.292 1.00 0.00 H new ATOM 0 HB3 SER B 23 86.275 20.072 3.807 1.00 0.00 H new ATOM 0 HG SER B 23 88.036 18.980 5.763 1.00 0.00 H new ATOM 483 N ASP B 24 86.197 17.226 1.963 1.00 0.00 N ATOM 484 CA ASP B 24 85.468 16.889 0.740 1.00 0.00 C ATOM 485 C ASP B 24 85.425 15.366 0.554 1.00 0.00 C ATOM 486 O ASP B 24 86.474 14.748 0.384 1.00 0.00 O ATOM 487 CB ASP B 24 86.179 17.520 -0.459 1.00 0.00 C ATOM 488 CG ASP B 24 86.051 19.038 -0.401 1.00 0.00 C ATOM 489 OD1 ASP B 24 85.126 19.511 0.240 1.00 0.00 O ATOM 490 OD2 ASP B 24 86.879 19.707 -0.998 1.00 0.00 O ATOM 0 H ASP B 24 87.208 17.113 1.894 1.00 0.00 H new ATOM 0 HA ASP B 24 84.449 17.270 0.815 1.00 0.00 H new ATOM 0 HB2 ASP B 24 87.231 17.235 -0.460 1.00 0.00 H new ATOM 0 HB3 ASP B 24 85.747 17.145 -1.387 1.00 0.00 H new ATOM 495 N PRO B 25 84.262 14.740 0.581 1.00 0.00 N ATOM 496 CA PRO B 25 84.152 13.259 0.408 1.00 0.00 C ATOM 497 C PRO B 25 85.090 12.718 -0.668 1.00 0.00 C ATOM 498 O PRO B 25 84.690 12.525 -1.818 1.00 0.00 O ATOM 499 CB PRO B 25 82.685 13.064 0.028 1.00 0.00 C ATOM 500 CG PRO B 25 81.966 14.154 0.753 1.00 0.00 C ATOM 501 CD PRO B 25 82.928 15.350 0.776 1.00 0.00 C ATOM 0 HA PRO B 25 84.444 12.714 1.306 1.00 0.00 H new ATOM 0 HB2 PRO B 25 82.540 13.141 -1.050 1.00 0.00 H new ATOM 0 HB3 PRO B 25 82.324 12.081 0.329 1.00 0.00 H new ATOM 0 HG2 PRO B 25 81.035 14.411 0.248 1.00 0.00 H new ATOM 0 HG3 PRO B 25 81.704 13.844 1.765 1.00 0.00 H new ATOM 0 HD2 PRO B 25 82.696 16.064 -0.014 1.00 0.00 H new ATOM 0 HD3 PRO B 25 82.870 15.890 1.721 1.00 0.00 H new ATOM 509 N LEU B 26 86.310 12.458 -0.280 1.00 0.00 N ATOM 510 CA LEU B 26 87.308 11.909 -1.196 1.00 0.00 C ATOM 511 C LEU B 26 86.851 10.549 -1.702 1.00 0.00 C ATOM 512 O LEU B 26 87.033 10.211 -2.872 1.00 0.00 O ATOM 513 CB LEU B 26 88.643 11.739 -0.454 1.00 0.00 C ATOM 514 CG LEU B 26 89.377 13.092 -0.334 1.00 0.00 C ATOM 515 CD1 LEU B 26 90.295 13.071 0.892 1.00 0.00 C ATOM 516 CD2 LEU B 26 90.208 13.357 -1.598 1.00 0.00 C ATOM 0 H LEU B 26 86.651 12.615 0.669 1.00 0.00 H new ATOM 0 HA LEU B 26 87.432 12.590 -2.038 1.00 0.00 H new ATOM 0 HB2 LEU B 26 88.463 11.328 0.539 1.00 0.00 H new ATOM 0 HB3 LEU B 26 89.272 11.024 -0.985 1.00 0.00 H new ATOM 0 HG LEU B 26 88.640 13.887 -0.223 1.00 0.00 H new ATOM 0 HD11 LEU B 26 90.813 14.027 0.975 1.00 0.00 H new ATOM 0 HD12 LEU B 26 89.700 12.901 1.789 1.00 0.00 H new ATOM 0 HD13 LEU B 26 91.027 12.270 0.785 1.00 0.00 H new ATOM 0 HD21 LEU B 26 90.721 14.314 -1.502 1.00 0.00 H new ATOM 0 HD22 LEU B 26 90.943 12.562 -1.723 1.00 0.00 H new ATOM 0 HD23 LEU B 26 89.550 13.384 -2.467 1.00 0.00 H new ATOM 528 N VAL B 27 86.291 9.779 -0.815 1.00 0.00 N ATOM 529 CA VAL B 27 85.835 8.444 -1.157 1.00 0.00 C ATOM 530 C VAL B 27 84.814 8.478 -2.284 1.00 0.00 C ATOM 531 O VAL B 27 84.921 7.725 -3.251 1.00 0.00 O ATOM 532 CB VAL B 27 85.198 7.785 0.064 1.00 0.00 C ATOM 533 CG1 VAL B 27 84.898 6.317 -0.245 1.00 0.00 C ATOM 534 CG2 VAL B 27 86.146 7.875 1.261 1.00 0.00 C ATOM 0 H VAL B 27 86.134 10.045 0.157 1.00 0.00 H new ATOM 0 HA VAL B 27 86.702 7.872 -1.487 1.00 0.00 H new ATOM 0 HB VAL B 27 84.270 8.303 0.306 1.00 0.00 H new ATOM 0 HG11 VAL B 27 84.443 5.847 0.627 1.00 0.00 H new ATOM 0 HG12 VAL B 27 84.211 6.256 -1.089 1.00 0.00 H new ATOM 0 HG13 VAL B 27 85.825 5.801 -0.493 1.00 0.00 H new ATOM 0 HG21 VAL B 27 85.684 7.402 2.128 1.00 0.00 H new ATOM 0 HG22 VAL B 27 87.080 7.365 1.025 1.00 0.00 H new ATOM 0 HG23 VAL B 27 86.351 8.922 1.485 1.00 0.00 H new ATOM 544 N VAL B 28 83.845 9.340 -2.168 1.00 0.00 N ATOM 545 CA VAL B 28 82.809 9.477 -3.186 1.00 0.00 C ATOM 546 C VAL B 28 83.371 10.144 -4.447 1.00 0.00 C ATOM 547 O VAL B 28 82.842 9.977 -5.546 1.00 0.00 O ATOM 548 CB VAL B 28 81.622 10.286 -2.582 1.00 0.00 C ATOM 549 CG1 VAL B 28 81.519 11.698 -3.184 1.00 0.00 C ATOM 550 CG2 VAL B 28 80.298 9.551 -2.818 1.00 0.00 C ATOM 0 H VAL B 28 83.739 9.971 -1.374 1.00 0.00 H new ATOM 0 HA VAL B 28 82.449 8.493 -3.487 1.00 0.00 H new ATOM 0 HB VAL B 28 81.816 10.379 -1.513 1.00 0.00 H new ATOM 0 HG11 VAL B 28 80.678 12.225 -2.734 1.00 0.00 H new ATOM 0 HG12 VAL B 28 82.440 12.246 -2.985 1.00 0.00 H new ATOM 0 HG13 VAL B 28 81.366 11.624 -4.261 1.00 0.00 H new ATOM 0 HG21 VAL B 28 79.479 10.130 -2.390 1.00 0.00 H new ATOM 0 HG22 VAL B 28 80.135 9.429 -3.889 1.00 0.00 H new ATOM 0 HG23 VAL B 28 80.336 8.571 -2.343 1.00 0.00 H new ATOM 560 N ALA B 29 84.409 10.907 -4.260 1.00 0.00 N ATOM 561 CA ALA B 29 85.035 11.633 -5.354 1.00 0.00 C ATOM 562 C ALA B 29 85.663 10.704 -6.394 1.00 0.00 C ATOM 563 O ALA B 29 85.734 11.060 -7.563 1.00 0.00 O ATOM 564 CB ALA B 29 86.107 12.570 -4.797 1.00 0.00 C ATOM 0 H ALA B 29 84.852 11.051 -3.353 1.00 0.00 H new ATOM 0 HA ALA B 29 84.251 12.201 -5.856 1.00 0.00 H new ATOM 0 HB1 ALA B 29 86.576 13.114 -5.617 1.00 0.00 H new ATOM 0 HB2 ALA B 29 85.648 13.278 -4.107 1.00 0.00 H new ATOM 0 HB3 ALA B 29 86.862 11.987 -4.270 1.00 0.00 H new ATOM 570 N ALA B 30 86.118 9.545 -5.993 1.00 0.00 N ATOM 571 CA ALA B 30 86.723 8.647 -6.976 1.00 0.00 C ATOM 572 C ALA B 30 85.666 8.019 -7.890 1.00 0.00 C ATOM 573 O ALA B 30 85.785 8.071 -9.115 1.00 0.00 O ATOM 574 CB ALA B 30 87.516 7.572 -6.283 1.00 0.00 C ATOM 0 H ALA B 30 86.090 9.199 -5.034 1.00 0.00 H new ATOM 0 HA ALA B 30 87.393 9.240 -7.599 1.00 0.00 H new ATOM 0 HB1 ALA B 30 87.961 6.911 -7.027 1.00 0.00 H new ATOM 0 HB2 ALA B 30 88.305 8.029 -5.686 1.00 0.00 H new ATOM 0 HB3 ALA B 30 86.857 6.996 -5.633 1.00 0.00 H new ATOM 580 N SER B 31 84.667 7.420 -7.298 1.00 0.00 N ATOM 581 CA SER B 31 83.601 6.758 -8.060 1.00 0.00 C ATOM 582 C SER B 31 83.060 7.634 -9.197 1.00 0.00 C ATOM 583 O SER B 31 82.556 7.119 -10.194 1.00 0.00 O ATOM 584 CB SER B 31 82.448 6.407 -7.124 1.00 0.00 C ATOM 585 OG SER B 31 81.321 6.015 -7.895 1.00 0.00 O ATOM 0 H SER B 31 84.555 7.368 -6.286 1.00 0.00 H new ATOM 0 HA SER B 31 84.034 5.861 -8.503 1.00 0.00 H new ATOM 0 HB2 SER B 31 82.742 5.600 -6.452 1.00 0.00 H new ATOM 0 HB3 SER B 31 82.196 7.265 -6.501 1.00 0.00 H new ATOM 0 HG SER B 31 80.579 5.787 -7.297 1.00 0.00 H new ATOM 591 N ILE B 32 83.159 8.921 -9.042 1.00 0.00 N ATOM 592 CA ILE B 32 82.660 9.828 -10.079 1.00 0.00 C ATOM 593 C ILE B 32 83.498 9.688 -11.363 1.00 0.00 C ATOM 594 O ILE B 32 82.952 9.637 -12.465 1.00 0.00 O ATOM 595 CB ILE B 32 82.634 11.291 -9.569 1.00 0.00 C ATOM 596 CG1 ILE B 32 81.500 12.060 -10.262 1.00 0.00 C ATOM 597 CG2 ILE B 32 83.962 11.997 -9.856 1.00 0.00 C ATOM 598 CD1 ILE B 32 81.490 13.509 -9.774 1.00 0.00 C ATOM 0 H ILE B 32 83.571 9.378 -8.228 1.00 0.00 H new ATOM 0 HA ILE B 32 81.633 9.551 -10.319 1.00 0.00 H new ATOM 0 HB ILE B 32 82.472 11.271 -8.491 1.00 0.00 H new ATOM 0 HG12 ILE B 32 81.635 12.031 -11.343 1.00 0.00 H new ATOM 0 HG13 ILE B 32 80.542 11.587 -10.047 1.00 0.00 H new ATOM 0 HG21 ILE B 32 83.916 13.022 -9.488 1.00 0.00 H new ATOM 0 HG22 ILE B 32 84.772 11.467 -9.354 1.00 0.00 H new ATOM 0 HG23 ILE B 32 84.145 12.005 -10.931 1.00 0.00 H new ATOM 0 HD11 ILE B 32 80.685 14.053 -10.267 1.00 0.00 H new ATOM 0 HD12 ILE B 32 81.334 13.529 -8.695 1.00 0.00 H new ATOM 0 HD13 ILE B 32 82.444 13.979 -10.011 1.00 0.00 H new ATOM 610 N ILE B 33 84.792 9.578 -11.204 1.00 0.00 N ATOM 611 CA ILE B 33 85.709 9.382 -12.333 1.00 0.00 C ATOM 612 C ILE B 33 85.619 7.943 -12.856 1.00 0.00 C ATOM 613 O ILE B 33 85.933 7.662 -14.012 1.00 0.00 O ATOM 614 CB ILE B 33 87.154 9.699 -11.908 1.00 0.00 C ATOM 615 CG1 ILE B 33 87.312 11.211 -11.700 1.00 0.00 C ATOM 616 CG2 ILE B 33 88.128 9.243 -13.001 1.00 0.00 C ATOM 617 CD1 ILE B 33 88.610 11.490 -10.937 1.00 0.00 C ATOM 0 H ILE B 33 85.254 9.620 -10.296 1.00 0.00 H new ATOM 0 HA ILE B 33 85.419 10.062 -13.134 1.00 0.00 H new ATOM 0 HB ILE B 33 87.373 9.174 -10.978 1.00 0.00 H new ATOM 0 HG12 ILE B 33 87.327 11.721 -12.663 1.00 0.00 H new ATOM 0 HG13 ILE B 33 86.460 11.603 -11.145 1.00 0.00 H new ATOM 0 HG21 ILE B 33 89.150 9.470 -12.696 1.00 0.00 H new ATOM 0 HG22 ILE B 33 88.025 8.169 -13.155 1.00 0.00 H new ATOM 0 HG23 ILE B 33 87.903 9.766 -13.930 1.00 0.00 H new ATOM 0 HD11 ILE B 33 88.722 12.564 -10.790 1.00 0.00 H new ATOM 0 HD12 ILE B 33 88.577 10.992 -9.968 1.00 0.00 H new ATOM 0 HD13 ILE B 33 89.457 11.112 -11.510 1.00 0.00 H new ATOM 629 N GLY B 34 85.222 7.062 -11.982 1.00 0.00 N ATOM 630 CA GLY B 34 85.114 5.640 -12.309 1.00 0.00 C ATOM 631 C GLY B 34 84.271 5.398 -13.561 1.00 0.00 C ATOM 632 O GLY B 34 84.688 4.679 -14.469 1.00 0.00 O ATOM 0 H GLY B 34 84.962 7.292 -11.023 1.00 0.00 H new ATOM 0 HA2 GLY B 34 86.111 5.227 -12.459 1.00 0.00 H new ATOM 0 HA3 GLY B 34 84.672 5.108 -11.467 1.00 0.00 H new ATOM 636 N ILE B 35 83.103 5.973 -13.595 1.00 0.00 N ATOM 637 CA ILE B 35 82.202 5.798 -14.735 1.00 0.00 C ATOM 638 C ILE B 35 82.721 6.527 -15.979 1.00 0.00 C ATOM 639 O ILE B 35 82.463 6.098 -17.104 1.00 0.00 O ATOM 640 CB ILE B 35 80.792 6.282 -14.349 1.00 0.00 C ATOM 641 CG1 ILE B 35 79.953 6.561 -15.606 1.00 0.00 C ATOM 642 CG2 ILE B 35 80.905 7.550 -13.506 1.00 0.00 C ATOM 643 CD1 ILE B 35 78.473 6.663 -15.227 1.00 0.00 C ATOM 0 H ILE B 35 82.738 6.571 -12.853 1.00 0.00 H new ATOM 0 HA ILE B 35 82.157 4.739 -14.989 1.00 0.00 H new ATOM 0 HB ILE B 35 80.296 5.502 -13.772 1.00 0.00 H new ATOM 0 HG12 ILE B 35 80.282 7.487 -16.077 1.00 0.00 H new ATOM 0 HG13 ILE B 35 80.097 5.764 -16.336 1.00 0.00 H new ATOM 0 HG21 ILE B 35 79.908 7.895 -13.232 1.00 0.00 H new ATOM 0 HG22 ILE B 35 81.477 7.337 -12.603 1.00 0.00 H new ATOM 0 HG23 ILE B 35 81.411 8.325 -14.081 1.00 0.00 H new ATOM 0 HD11 ILE B 35 77.881 6.861 -16.121 1.00 0.00 H new ATOM 0 HD12 ILE B 35 78.147 5.725 -14.776 1.00 0.00 H new ATOM 0 HD13 ILE B 35 78.335 7.475 -14.514 1.00 0.00 H new ATOM 655 N LEU B 36 83.427 7.606 -15.783 1.00 0.00 N ATOM 656 CA LEU B 36 83.958 8.366 -16.915 1.00 0.00 C ATOM 657 C LEU B 36 84.896 7.487 -17.741 1.00 0.00 C ATOM 658 O LEU B 36 84.779 7.403 -18.963 1.00 0.00 O ATOM 659 CB LEU B 36 84.722 9.592 -16.391 1.00 0.00 C ATOM 660 CG LEU B 36 85.124 10.523 -17.555 1.00 0.00 C ATOM 661 CD1 LEU B 36 83.956 11.453 -17.915 1.00 0.00 C ATOM 662 CD2 LEU B 36 86.336 11.373 -17.140 1.00 0.00 C ATOM 0 H LEU B 36 83.654 7.988 -14.865 1.00 0.00 H new ATOM 0 HA LEU B 36 83.133 8.693 -17.548 1.00 0.00 H new ATOM 0 HB2 LEU B 36 84.101 10.137 -15.680 1.00 0.00 H new ATOM 0 HB3 LEU B 36 85.613 9.269 -15.853 1.00 0.00 H new ATOM 0 HG LEU B 36 85.379 9.913 -18.422 1.00 0.00 H new ATOM 0 HD11 LEU B 36 84.250 12.105 -18.737 1.00 0.00 H new ATOM 0 HD12 LEU B 36 83.095 10.856 -18.216 1.00 0.00 H new ATOM 0 HD13 LEU B 36 83.692 12.059 -17.048 1.00 0.00 H new ATOM 0 HD21 LEU B 36 86.619 12.030 -17.963 1.00 0.00 H new ATOM 0 HD22 LEU B 36 86.077 11.974 -16.268 1.00 0.00 H new ATOM 0 HD23 LEU B 36 87.172 10.719 -16.894 1.00 0.00 H new ATOM 674 N HIS B 37 85.819 6.868 -17.069 1.00 0.00 N ATOM 675 CA HIS B 37 86.790 6.013 -17.744 1.00 0.00 C ATOM 676 C HIS B 37 86.096 4.836 -18.426 1.00 0.00 C ATOM 677 O HIS B 37 86.581 4.320 -19.431 1.00 0.00 O ATOM 678 CB HIS B 37 87.876 5.529 -16.759 1.00 0.00 C ATOM 679 CG HIS B 37 87.432 4.318 -15.966 1.00 0.00 C ATOM 680 ND1 HIS B 37 86.871 3.193 -16.556 1.00 0.00 N ATOM 681 CD2 HIS B 37 87.508 4.032 -14.625 1.00 0.00 C ATOM 682 CE1 HIS B 37 86.637 2.296 -15.582 1.00 0.00 C ATOM 683 NE2 HIS B 37 87.008 2.758 -14.386 1.00 0.00 N ATOM 0 H HIS B 37 85.933 6.929 -16.057 1.00 0.00 H new ATOM 0 HA HIS B 37 87.283 6.602 -18.517 1.00 0.00 H new ATOM 0 HB2 HIS B 37 88.783 5.286 -17.312 1.00 0.00 H new ATOM 0 HB3 HIS B 37 88.128 6.338 -16.073 1.00 0.00 H new ATOM 0 HD2 HIS B 37 87.898 4.698 -13.869 1.00 0.00 H new ATOM 0 HE1 HIS B 37 86.202 1.321 -15.747 1.00 0.00 H new ATOM 0 HE2 HIS B 37 86.939 2.278 -13.488 1.00 0.00 H new ATOM 692 N PHE B 38 84.993 4.415 -17.872 1.00 0.00 N ATOM 693 CA PHE B 38 84.251 3.283 -18.422 1.00 0.00 C ATOM 694 C PHE B 38 83.629 3.593 -19.787 1.00 0.00 C ATOM 695 O PHE B 38 83.675 2.763 -20.693 1.00 0.00 O ATOM 696 CB PHE B 38 83.147 2.867 -17.448 1.00 0.00 C ATOM 697 CG PHE B 38 82.509 1.588 -17.933 1.00 0.00 C ATOM 698 CD1 PHE B 38 81.559 1.626 -18.961 1.00 0.00 C ATOM 699 CD2 PHE B 38 82.872 0.363 -17.360 1.00 0.00 C ATOM 700 CE1 PHE B 38 80.972 0.440 -19.415 1.00 0.00 C ATOM 701 CE2 PHE B 38 82.284 -0.823 -17.814 1.00 0.00 C ATOM 702 CZ PHE B 38 81.335 -0.785 -18.842 1.00 0.00 C ATOM 0 H PHE B 38 84.577 4.830 -17.039 1.00 0.00 H new ATOM 0 HA PHE B 38 84.965 2.471 -18.562 1.00 0.00 H new ATOM 0 HB2 PHE B 38 83.562 2.724 -16.450 1.00 0.00 H new ATOM 0 HB3 PHE B 38 82.397 3.655 -17.372 1.00 0.00 H new ATOM 0 HD1 PHE B 38 81.279 2.571 -19.403 1.00 0.00 H new ATOM 0 HD2 PHE B 38 83.606 0.333 -16.568 1.00 0.00 H new ATOM 0 HE1 PHE B 38 80.239 0.469 -20.207 1.00 0.00 H new ATOM 0 HE2 PHE B 38 82.563 -1.768 -17.371 1.00 0.00 H new ATOM 0 HZ PHE B 38 80.883 -1.701 -19.193 1.00 0.00 H new ATOM 712 N ILE B 39 83.026 4.745 -19.925 1.00 0.00 N ATOM 713 CA ILE B 39 82.377 5.095 -21.192 1.00 0.00 C ATOM 714 C ILE B 39 83.389 5.290 -22.319 1.00 0.00 C ATOM 715 O ILE B 39 83.141 4.885 -23.450 1.00 0.00 O ATOM 716 CB ILE B 39 81.518 6.354 -21.032 1.00 0.00 C ATOM 717 CG1 ILE B 39 82.326 7.460 -20.352 1.00 0.00 C ATOM 718 CG2 ILE B 39 80.291 6.031 -20.176 1.00 0.00 C ATOM 719 CD1 ILE B 39 81.557 8.780 -20.446 1.00 0.00 C ATOM 0 H ILE B 39 82.963 5.457 -19.197 1.00 0.00 H new ATOM 0 HA ILE B 39 81.735 4.257 -21.464 1.00 0.00 H new ATOM 0 HB ILE B 39 81.203 6.693 -22.019 1.00 0.00 H new ATOM 0 HG12 ILE B 39 82.506 7.205 -19.308 1.00 0.00 H new ATOM 0 HG13 ILE B 39 83.301 7.559 -20.829 1.00 0.00 H new ATOM 0 HG21 ILE B 39 79.680 6.927 -20.063 1.00 0.00 H new ATOM 0 HG22 ILE B 39 79.704 5.251 -20.661 1.00 0.00 H new ATOM 0 HG23 ILE B 39 80.613 5.685 -19.194 1.00 0.00 H new ATOM 0 HD11 ILE B 39 82.131 9.570 -19.962 1.00 0.00 H new ATOM 0 HD12 ILE B 39 81.399 9.035 -21.494 1.00 0.00 H new ATOM 0 HD13 ILE B 39 80.592 8.675 -19.949 1.00 0.00 H new ATOM 731 N ALA B 40 84.504 5.889 -22.023 1.00 0.00 N ATOM 732 CA ALA B 40 85.529 6.100 -23.041 1.00 0.00 C ATOM 733 C ALA B 40 86.189 4.774 -23.409 1.00 0.00 C ATOM 734 O ALA B 40 86.689 4.599 -24.519 1.00 0.00 O ATOM 735 CB ALA B 40 86.588 7.074 -22.524 1.00 0.00 C ATOM 0 H ALA B 40 84.740 6.243 -21.096 1.00 0.00 H new ATOM 0 HA ALA B 40 85.056 6.520 -23.929 1.00 0.00 H new ATOM 0 HB1 ALA B 40 87.348 7.225 -23.290 1.00 0.00 H new ATOM 0 HB2 ALA B 40 86.119 8.028 -22.285 1.00 0.00 H new ATOM 0 HB3 ALA B 40 87.053 6.664 -21.628 1.00 0.00 H new ATOM 741 N TRP B 41 86.211 3.878 -22.461 1.00 0.00 N ATOM 742 CA TRP B 41 86.837 2.575 -22.637 1.00 0.00 C ATOM 743 C TRP B 41 86.384 1.871 -23.910 1.00 0.00 C ATOM 744 O TRP B 41 87.211 1.395 -24.687 1.00 0.00 O ATOM 745 CB TRP B 41 86.473 1.705 -21.436 1.00 0.00 C ATOM 746 CG TRP B 41 87.287 0.455 -21.429 1.00 0.00 C ATOM 747 CD1 TRP B 41 87.228 -0.526 -22.362 1.00 0.00 C ATOM 748 CD2 TRP B 41 88.261 0.019 -20.439 1.00 0.00 C ATOM 749 NE1 TRP B 41 88.122 -1.518 -22.020 1.00 0.00 N ATOM 750 CE2 TRP B 41 88.777 -1.230 -20.843 1.00 0.00 C ATOM 751 CE3 TRP B 41 88.749 0.582 -19.244 1.00 0.00 C ATOM 752 CZ2 TRP B 41 89.736 -1.897 -20.094 1.00 0.00 C ATOM 753 CZ3 TRP B 41 89.715 -0.097 -18.482 1.00 0.00 C ATOM 754 CH2 TRP B 41 90.208 -1.338 -18.911 1.00 0.00 C ATOM 0 H TRP B 41 85.798 4.021 -21.539 1.00 0.00 H new ATOM 0 HA TRP B 41 87.913 2.728 -22.717 1.00 0.00 H new ATOM 0 HB2 TRP B 41 86.641 2.260 -20.513 1.00 0.00 H new ATOM 0 HB3 TRP B 41 85.413 1.455 -21.469 1.00 0.00 H new ATOM 0 HD1 TRP B 41 86.586 -0.530 -23.231 1.00 0.00 H new ATOM 0 HE1 TRP B 41 88.279 -2.362 -22.571 1.00 0.00 H new ATOM 0 HE3 TRP B 41 88.379 1.541 -18.911 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 90.116 -2.851 -20.430 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 90.079 0.338 -17.563 1.00 0.00 H new ATOM 0 HH2 TRP B 41 90.951 -1.858 -18.325 1.00 0.00 H new ATOM 765 N THR B 42 85.102 1.770 -24.099 1.00 0.00 N ATOM 766 CA THR B 42 84.576 1.068 -25.266 1.00 0.00 C ATOM 767 C THR B 42 85.242 1.549 -26.556 1.00 0.00 C ATOM 768 O THR B 42 85.425 0.767 -27.489 1.00 0.00 O ATOM 769 CB THR B 42 83.057 1.257 -25.364 1.00 0.00 C ATOM 770 OG1 THR B 42 82.654 1.147 -26.721 1.00 0.00 O ATOM 771 CG2 THR B 42 82.675 2.634 -24.826 1.00 0.00 C ATOM 0 H THR B 42 84.394 2.156 -23.475 1.00 0.00 H new ATOM 0 HA THR B 42 84.800 0.009 -25.141 1.00 0.00 H new ATOM 0 HB THR B 42 82.557 0.489 -24.773 1.00 0.00 H new ATOM 0 HG1 THR B 42 81.683 1.266 -26.785 1.00 0.00 H new ATOM 0 HG21 THR B 42 81.595 2.766 -24.897 1.00 0.00 H new ATOM 0 HG22 THR B 42 82.983 2.716 -23.784 1.00 0.00 H new ATOM 0 HG23 THR B 42 83.174 3.405 -25.413 1.00 0.00 H new ATOM 779 N ILE B 43 85.571 2.808 -26.621 1.00 0.00 N ATOM 780 CA ILE B 43 86.183 3.366 -27.826 1.00 0.00 C ATOM 781 C ILE B 43 87.354 2.495 -28.310 1.00 0.00 C ATOM 782 O ILE B 43 87.486 2.238 -29.505 1.00 0.00 O ATOM 783 CB ILE B 43 86.636 4.821 -27.537 1.00 0.00 C ATOM 784 CG1 ILE B 43 86.526 5.687 -28.801 1.00 0.00 C ATOM 785 CG2 ILE B 43 88.085 4.867 -27.037 1.00 0.00 C ATOM 786 CD1 ILE B 43 86.830 7.146 -28.442 1.00 0.00 C ATOM 0 H ILE B 43 85.432 3.478 -25.864 1.00 0.00 H new ATOM 0 HA ILE B 43 85.448 3.378 -28.631 1.00 0.00 H new ATOM 0 HB ILE B 43 85.977 5.212 -26.762 1.00 0.00 H new ATOM 0 HG12 ILE B 43 87.224 5.334 -29.560 1.00 0.00 H new ATOM 0 HG13 ILE B 43 85.526 5.606 -29.226 1.00 0.00 H new ATOM 0 HG21 ILE B 43 88.371 5.901 -26.844 1.00 0.00 H new ATOM 0 HG22 ILE B 43 88.171 4.289 -26.117 1.00 0.00 H new ATOM 0 HG23 ILE B 43 88.745 4.444 -27.794 1.00 0.00 H new ATOM 0 HD11 ILE B 43 86.753 7.764 -29.336 1.00 0.00 H new ATOM 0 HD12 ILE B 43 86.114 7.494 -27.697 1.00 0.00 H new ATOM 0 HD13 ILE B 43 87.839 7.218 -28.037 1.00 0.00 H new ATOM 798 N GLY B 44 88.180 2.047 -27.401 1.00 0.00 N ATOM 799 CA GLY B 44 89.322 1.205 -27.769 1.00 0.00 C ATOM 800 C GLY B 44 88.869 0.037 -28.643 1.00 0.00 C ATOM 801 O GLY B 44 89.507 -0.300 -29.640 1.00 0.00 O ATOM 0 H GLY B 44 88.097 2.241 -26.403 1.00 0.00 H new ATOM 0 HA2 GLY B 44 90.062 1.800 -28.303 1.00 0.00 H new ATOM 0 HA3 GLY B 44 89.807 0.826 -26.869 1.00 0.00 H new ATOM 805 N HIS B 45 87.828 -0.608 -28.210 1.00 0.00 N ATOM 806 CA HIS B 45 87.303 -1.801 -28.860 1.00 0.00 C ATOM 807 C HIS B 45 87.290 -1.723 -30.386 1.00 0.00 C ATOM 808 O HIS B 45 87.296 -2.764 -31.039 1.00 0.00 O ATOM 809 CB HIS B 45 85.894 -2.070 -28.348 1.00 0.00 C ATOM 810 CG HIS B 45 85.411 -3.389 -28.885 1.00 0.00 C ATOM 811 ND1 HIS B 45 84.763 -3.497 -30.105 1.00 0.00 N ATOM 812 CD2 HIS B 45 85.475 -4.666 -28.380 1.00 0.00 C ATOM 813 CE1 HIS B 45 84.465 -4.796 -30.292 1.00 0.00 C ATOM 814 NE2 HIS B 45 84.879 -5.552 -29.271 1.00 0.00 N ATOM 0 H HIS B 45 87.301 -0.327 -27.383 1.00 0.00 H new ATOM 0 HA HIS B 45 87.978 -2.618 -28.605 1.00 0.00 H new ATOM 0 HB2 HIS B 45 85.888 -2.084 -27.258 1.00 0.00 H new ATOM 0 HB3 HIS B 45 85.223 -1.270 -28.660 1.00 0.00 H new ATOM 0 HD2 HIS B 45 85.920 -4.940 -27.435 1.00 0.00 H new ATOM 0 HE1 HIS B 45 83.953 -5.181 -31.162 1.00 0.00 H new ATOM 0 HE2 HIS B 45 84.779 -6.562 -29.167 1.00 0.00 H new ATOM 823 N LEU B 46 87.307 -0.548 -30.965 1.00 0.00 N ATOM 824 CA LEU B 46 87.344 -0.493 -32.437 1.00 0.00 C ATOM 825 C LEU B 46 88.470 -1.430 -32.914 1.00 0.00 C ATOM 826 O LEU B 46 88.281 -2.273 -33.790 1.00 0.00 O ATOM 827 CB LEU B 46 87.527 0.960 -32.966 1.00 0.00 C ATOM 828 CG LEU B 46 88.933 1.541 -32.642 1.00 0.00 C ATOM 829 CD1 LEU B 46 89.895 1.329 -33.825 1.00 0.00 C ATOM 830 CD2 LEU B 46 88.834 3.054 -32.385 1.00 0.00 C ATOM 0 H LEU B 46 87.297 0.352 -30.484 1.00 0.00 H new ATOM 0 HA LEU B 46 86.389 -0.827 -32.843 1.00 0.00 H new ATOM 0 HB2 LEU B 46 87.373 0.972 -34.045 1.00 0.00 H new ATOM 0 HB3 LEU B 46 86.763 1.602 -32.527 1.00 0.00 H new ATOM 0 HG LEU B 46 89.308 1.025 -31.758 1.00 0.00 H new ATOM 0 HD11 LEU B 46 90.873 1.743 -33.578 1.00 0.00 H new ATOM 0 HD12 LEU B 46 89.993 0.263 -34.028 1.00 0.00 H new ATOM 0 HD13 LEU B 46 89.501 1.832 -34.709 1.00 0.00 H new ATOM 0 HD21 LEU B 46 89.824 3.450 -32.159 1.00 0.00 H new ATOM 0 HD22 LEU B 46 88.439 3.549 -33.272 1.00 0.00 H new ATOM 0 HD23 LEU B 46 88.169 3.237 -31.541 1.00 0.00 H new ATOM 842 N ASN B 47 89.613 -1.247 -32.321 1.00 0.00 N ATOM 843 CA ASN B 47 90.799 -2.042 -32.644 1.00 0.00 C ATOM 844 C ASN B 47 90.501 -3.551 -32.601 1.00 0.00 C ATOM 845 O ASN B 47 90.831 -4.278 -33.537 1.00 0.00 O ATOM 846 CB ASN B 47 91.920 -1.717 -31.656 1.00 0.00 C ATOM 847 CG ASN B 47 92.386 -0.278 -31.854 1.00 0.00 C ATOM 848 OD1 ASN B 47 92.755 0.109 -32.962 1.00 0.00 O ATOM 849 ND2 ASN B 47 92.392 0.541 -30.838 1.00 0.00 N ATOM 0 H ASN B 47 89.767 -0.546 -31.597 1.00 0.00 H new ATOM 0 HA ASN B 47 91.106 -1.787 -33.658 1.00 0.00 H new ATOM 0 HB2 ASN B 47 91.568 -1.857 -30.634 1.00 0.00 H new ATOM 0 HB3 ASN B 47 92.755 -2.402 -31.802 1.00 0.00 H new ATOM 0 HD21 ASN B 47 92.703 1.505 -30.961 1.00 0.00 H new ATOM 0 HD22 ASN B 47 92.086 0.218 -29.920 1.00 0.00 H new ATOM 856 N GLN B 48 89.906 -4.007 -31.525 1.00 0.00 N ATOM 857 CA GLN B 48 89.589 -5.431 -31.356 1.00 0.00 C ATOM 858 C GLN B 48 89.144 -6.095 -32.661 1.00 0.00 C ATOM 859 O GLN B 48 89.976 -6.469 -33.490 1.00 0.00 O ATOM 860 CB GLN B 48 88.487 -5.610 -30.305 1.00 0.00 C ATOM 861 CG GLN B 48 88.982 -5.139 -28.933 1.00 0.00 C ATOM 862 CD GLN B 48 89.842 -6.216 -28.278 1.00 0.00 C ATOM 863 OE1 GLN B 48 90.857 -5.906 -27.653 1.00 0.00 O ATOM 864 NE2 GLN B 48 89.492 -7.470 -28.378 1.00 0.00 N ATOM 0 H GLN B 48 89.624 -3.419 -30.740 1.00 0.00 H new ATOM 0 HA GLN B 48 90.508 -5.916 -31.029 1.00 0.00 H new ATOM 0 HB2 GLN B 48 87.602 -5.043 -30.595 1.00 0.00 H new ATOM 0 HB3 GLN B 48 88.191 -6.658 -30.253 1.00 0.00 H new ATOM 0 HG2 GLN B 48 89.559 -4.221 -29.043 1.00 0.00 H new ATOM 0 HG3 GLN B 48 88.131 -4.905 -28.293 1.00 0.00 H new ATOM 0 HE21 GLN B 48 88.651 -7.725 -28.896 1.00 0.00 H new ATOM 0 HE22 GLN B 48 90.059 -8.195 -27.938 1.00 0.00 H new ATOM 873 N ILE B 49 87.850 -6.275 -32.807 1.00 0.00 N ATOM 874 CA ILE B 49 87.282 -6.936 -33.988 1.00 0.00 C ATOM 875 C ILE B 49 88.096 -6.655 -35.251 1.00 0.00 C ATOM 876 O ILE B 49 88.529 -7.584 -35.932 1.00 0.00 O ATOM 877 CB ILE B 49 85.825 -6.496 -34.195 1.00 0.00 C ATOM 878 CG1 ILE B 49 85.216 -7.290 -35.358 1.00 0.00 C ATOM 879 CG2 ILE B 49 85.762 -4.994 -34.503 1.00 0.00 C ATOM 880 CD1 ILE B 49 83.704 -7.060 -35.399 1.00 0.00 C ATOM 0 H ILE B 49 87.156 -5.974 -32.123 1.00 0.00 H new ATOM 0 HA ILE B 49 87.316 -8.010 -33.806 1.00 0.00 H new ATOM 0 HB ILE B 49 85.260 -6.689 -33.283 1.00 0.00 H new ATOM 0 HG12 ILE B 49 85.667 -6.979 -36.300 1.00 0.00 H new ATOM 0 HG13 ILE B 49 85.430 -8.352 -35.238 1.00 0.00 H new ATOM 0 HG21 ILE B 49 84.724 -4.695 -34.648 1.00 0.00 H new ATOM 0 HG22 ILE B 49 86.188 -4.434 -33.671 1.00 0.00 H new ATOM 0 HG23 ILE B 49 86.329 -4.784 -35.410 1.00 0.00 H new ATOM 0 HD11 ILE B 49 83.272 -7.624 -36.226 1.00 0.00 H new ATOM 0 HD12 ILE B 49 83.260 -7.393 -34.461 1.00 0.00 H new ATOM 0 HD13 ILE B 49 83.501 -5.998 -35.540 1.00 0.00 H new ATOM 892 N LYS B 50 88.301 -5.403 -35.557 1.00 0.00 N ATOM 893 CA LYS B 50 89.068 -5.036 -36.745 1.00 0.00 C ATOM 894 C LYS B 50 90.330 -5.891 -36.859 1.00 0.00 C ATOM 895 O LYS B 50 90.579 -6.510 -37.893 1.00 0.00 O ATOM 896 CB LYS B 50 89.451 -3.553 -36.675 1.00 0.00 C ATOM 897 CG LYS B 50 88.217 -2.674 -36.970 1.00 0.00 C ATOM 898 CD LYS B 50 88.058 -2.456 -38.492 1.00 0.00 C ATOM 899 CE LYS B 50 88.838 -1.208 -38.935 1.00 0.00 C ATOM 900 NZ LYS B 50 90.095 -1.088 -38.144 1.00 0.00 N ATOM 0 H LYS B 50 87.955 -4.614 -35.011 1.00 0.00 H new ATOM 0 HA LYS B 50 88.450 -5.212 -37.626 1.00 0.00 H new ATOM 0 HB2 LYS B 50 89.848 -3.318 -35.687 1.00 0.00 H new ATOM 0 HB3 LYS B 50 90.241 -3.339 -37.395 1.00 0.00 H new ATOM 0 HG2 LYS B 50 87.321 -3.148 -36.569 1.00 0.00 H new ATOM 0 HG3 LYS B 50 88.320 -1.712 -36.468 1.00 0.00 H new ATOM 0 HD2 LYS B 50 88.421 -3.331 -39.032 1.00 0.00 H new ATOM 0 HD3 LYS B 50 87.003 -2.342 -38.742 1.00 0.00 H new ATOM 0 HE2 LYS B 50 89.072 -1.273 -39.998 1.00 0.00 H new ATOM 0 HE3 LYS B 50 88.225 -0.317 -38.797 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 90.609 -0.233 -38.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 89.864 -1.023 -37.132 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 90.691 -1.924 -38.310 1.00 0.00 H new ATOM 914 N ARG B 51 91.105 -5.920 -35.808 1.00 0.00 N ATOM 915 CA ARG B 51 92.338 -6.704 -35.795 1.00 0.00 C ATOM 916 C ARG B 51 92.043 -8.164 -35.460 1.00 0.00 C ATOM 917 O ARG B 51 92.869 -9.045 -35.701 1.00 0.00 O ATOM 918 CB ARG B 51 93.310 -6.129 -34.762 1.00 0.00 C ATOM 919 CG ARG B 51 93.871 -4.800 -35.274 1.00 0.00 C ATOM 920 CD ARG B 51 94.805 -4.197 -34.224 1.00 0.00 C ATOM 921 NE ARG B 51 95.394 -2.960 -34.727 1.00 0.00 N ATOM 922 CZ ARG B 51 96.361 -2.982 -35.603 1.00 0.00 C ATOM 923 NH1 ARG B 51 96.816 -4.123 -36.044 1.00 0.00 N ATOM 924 NH2 ARG B 51 96.873 -1.864 -36.039 1.00 0.00 N ATOM 0 H ARG B 51 90.915 -5.414 -34.943 1.00 0.00 H new ATOM 0 HA ARG B 51 92.788 -6.655 -36.786 1.00 0.00 H new ATOM 0 HB2 ARG B 51 92.799 -5.978 -33.811 1.00 0.00 H new ATOM 0 HB3 ARG B 51 94.122 -6.833 -34.580 1.00 0.00 H new ATOM 0 HG2 ARG B 51 94.411 -4.958 -36.208 1.00 0.00 H new ATOM 0 HG3 ARG B 51 93.056 -4.109 -35.490 1.00 0.00 H new ATOM 0 HD2 ARG B 51 94.252 -3.999 -33.306 1.00 0.00 H new ATOM 0 HD3 ARG B 51 95.592 -4.909 -33.975 1.00 0.00 H new ATOM 0 HE ARG B 51 95.044 -2.064 -34.388 1.00 0.00 H new ATOM 0 HH11 ARG B 51 96.416 -4.997 -35.704 1.00 0.00 H new ATOM 0 HH12 ARG B 51 97.572 -4.140 -36.729 1.00 0.00 H new ATOM 0 HH21 ARG B 51 96.517 -0.972 -35.695 1.00 0.00 H new ATOM 0 HH22 ARG B 51 97.629 -1.882 -36.724 1.00 0.00 H new ATOM 938 N GLY B 52 90.883 -8.409 -34.915 1.00 0.00 N ATOM 939 CA GLY B 52 90.492 -9.766 -34.552 1.00 0.00 C ATOM 940 C GLY B 52 89.257 -9.757 -33.658 1.00 0.00 C ATOM 0 H GLY B 52 90.184 -7.695 -34.708 1.00 0.00 H new ATOM 0 HA2 GLY B 52 90.289 -10.343 -35.454 1.00 0.00 H new ATOM 0 HA3 GLY B 52 91.315 -10.260 -34.036 1.00 0.00 H new ATOM 945 N SER C 23 94.658 10.230 10.453 1.00 0.00 N ATOM 946 CA SER C 23 94.478 8.870 11.033 1.00 0.00 C ATOM 947 C SER C 23 93.939 7.929 9.960 1.00 0.00 C ATOM 948 O SER C 23 93.576 6.789 10.248 1.00 0.00 O ATOM 949 CB SER C 23 93.496 8.944 12.204 1.00 0.00 C ATOM 950 OG SER C 23 94.116 9.614 13.295 1.00 0.00 O ATOM 0 HA SER C 23 95.436 8.493 11.392 1.00 0.00 H new ATOM 0 HB2 SER C 23 92.592 9.474 11.903 1.00 0.00 H new ATOM 0 HB3 SER C 23 93.193 7.941 12.503 1.00 0.00 H new ATOM 0 HG SER C 23 94.782 10.247 12.954 1.00 0.00 H new ATOM 955 N ASP C 24 93.889 8.404 8.745 1.00 0.00 N ATOM 956 CA ASP C 24 93.391 7.597 7.639 1.00 0.00 C ATOM 957 C ASP C 24 93.769 8.232 6.302 1.00 0.00 C ATOM 958 O ASP C 24 92.903 8.545 5.486 1.00 0.00 O ATOM 959 CB ASP C 24 91.870 7.464 7.734 1.00 0.00 C ATOM 960 CG ASP C 24 91.224 8.845 7.748 1.00 0.00 C ATOM 961 OD1 ASP C 24 91.844 9.764 8.256 1.00 0.00 O ATOM 962 OD2 ASP C 24 90.117 8.963 7.249 1.00 0.00 O ATOM 0 H ASP C 24 94.185 9.345 8.485 1.00 0.00 H new ATOM 0 HA ASP C 24 93.845 6.608 7.699 1.00 0.00 H new ATOM 0 HB2 ASP C 24 91.494 6.887 6.889 1.00 0.00 H new ATOM 0 HB3 ASP C 24 91.600 6.919 8.638 1.00 0.00 H new ATOM 967 N PRO C 25 95.043 8.425 6.070 1.00 0.00 N ATOM 968 CA PRO C 25 95.553 9.038 4.806 1.00 0.00 C ATOM 969 C PRO C 25 95.457 8.073 3.622 1.00 0.00 C ATOM 970 O PRO C 25 95.790 8.425 2.491 1.00 0.00 O ATOM 971 CB PRO C 25 97.012 9.373 5.142 1.00 0.00 C ATOM 972 CG PRO C 25 97.406 8.364 6.171 1.00 0.00 C ATOM 973 CD PRO C 25 96.143 8.080 6.991 1.00 0.00 C ATOM 0 HA PRO C 25 94.974 9.909 4.498 1.00 0.00 H new ATOM 0 HB2 PRO C 25 97.647 9.306 4.259 1.00 0.00 H new ATOM 0 HB3 PRO C 25 97.107 10.388 5.527 1.00 0.00 H new ATOM 0 HG2 PRO C 25 97.779 7.454 5.702 1.00 0.00 H new ATOM 0 HG3 PRO C 25 98.205 8.746 6.806 1.00 0.00 H new ATOM 0 HD2 PRO C 25 96.093 7.036 7.301 1.00 0.00 H new ATOM 0 HD3 PRO C 25 96.110 8.684 7.898 1.00 0.00 H new ATOM 981 N LEU C 26 95.012 6.877 3.888 1.00 0.00 N ATOM 982 CA LEU C 26 94.877 5.865 2.843 1.00 0.00 C ATOM 983 C LEU C 26 93.849 6.301 1.797 1.00 0.00 C ATOM 984 O LEU C 26 94.016 6.058 0.602 1.00 0.00 O ATOM 985 CB LEU C 26 94.419 4.537 3.462 1.00 0.00 C ATOM 986 CG LEU C 26 95.598 3.833 4.139 1.00 0.00 C ATOM 987 CD1 LEU C 26 96.230 4.765 5.179 1.00 0.00 C ATOM 988 CD2 LEU C 26 95.093 2.559 4.830 1.00 0.00 C ATOM 0 H LEU C 26 94.732 6.565 4.818 1.00 0.00 H new ATOM 0 HA LEU C 26 95.847 5.741 2.362 1.00 0.00 H new ATOM 0 HB2 LEU C 26 93.629 4.720 4.190 1.00 0.00 H new ATOM 0 HB3 LEU C 26 93.997 3.894 2.690 1.00 0.00 H new ATOM 0 HG LEU C 26 96.347 3.574 3.391 1.00 0.00 H new ATOM 0 HD11 LEU C 26 97.069 4.260 5.658 1.00 0.00 H new ATOM 0 HD12 LEU C 26 96.585 5.671 4.688 1.00 0.00 H new ATOM 0 HD13 LEU C 26 95.487 5.028 5.932 1.00 0.00 H new ATOM 0 HD21 LEU C 26 95.928 2.052 5.314 1.00 0.00 H new ATOM 0 HD22 LEU C 26 94.345 2.823 5.578 1.00 0.00 H new ATOM 0 HD23 LEU C 26 94.647 1.896 4.089 1.00 0.00 H new ATOM 1000 N VAL C 27 92.795 6.909 2.260 1.00 0.00 N ATOM 1001 CA VAL C 27 91.710 7.359 1.392 1.00 0.00 C ATOM 1002 C VAL C 27 92.159 8.406 0.371 1.00 0.00 C ATOM 1003 O VAL C 27 91.848 8.300 -0.816 1.00 0.00 O ATOM 1004 CB VAL C 27 90.608 7.974 2.263 1.00 0.00 C ATOM 1005 CG1 VAL C 27 89.513 8.569 1.378 1.00 0.00 C ATOM 1006 CG2 VAL C 27 90.004 6.901 3.173 1.00 0.00 C ATOM 0 H VAL C 27 92.650 7.114 3.249 1.00 0.00 H new ATOM 0 HA VAL C 27 91.355 6.490 0.839 1.00 0.00 H new ATOM 0 HB VAL C 27 91.043 8.764 2.876 1.00 0.00 H new ATOM 0 HG11 VAL C 27 88.734 9.004 2.005 1.00 0.00 H new ATOM 0 HG12 VAL C 27 89.941 9.344 0.741 1.00 0.00 H new ATOM 0 HG13 VAL C 27 89.082 7.785 0.756 1.00 0.00 H new ATOM 0 HG21 VAL C 27 89.222 7.345 3.789 1.00 0.00 H new ATOM 0 HG22 VAL C 27 89.578 6.105 2.563 1.00 0.00 H new ATOM 0 HG23 VAL C 27 90.782 6.489 3.816 1.00 0.00 H new ATOM 1016 N VAL C 28 92.856 9.404 0.834 1.00 0.00 N ATOM 1017 CA VAL C 28 93.317 10.474 -0.048 1.00 0.00 C ATOM 1018 C VAL C 28 94.463 10.022 -0.953 1.00 0.00 C ATOM 1019 O VAL C 28 94.525 10.399 -2.120 1.00 0.00 O ATOM 1020 CB VAL C 28 93.730 11.708 0.783 1.00 0.00 C ATOM 1021 CG1 VAL C 28 95.170 11.560 1.288 1.00 0.00 C ATOM 1022 CG2 VAL C 28 93.622 12.974 -0.080 1.00 0.00 C ATOM 0 H VAL C 28 93.124 9.512 1.812 1.00 0.00 H new ATOM 0 HA VAL C 28 92.486 10.745 -0.699 1.00 0.00 H new ATOM 0 HB VAL C 28 93.061 11.788 1.640 1.00 0.00 H new ATOM 0 HG11 VAL C 28 95.443 12.439 1.871 1.00 0.00 H new ATOM 0 HG12 VAL C 28 95.246 10.671 1.914 1.00 0.00 H new ATOM 0 HG13 VAL C 28 95.846 11.464 0.438 1.00 0.00 H new ATOM 0 HG21 VAL C 28 93.914 13.843 0.510 1.00 0.00 H new ATOM 0 HG22 VAL C 28 94.281 12.883 -0.943 1.00 0.00 H new ATOM 0 HG23 VAL C 28 92.594 13.096 -0.420 1.00 0.00 H new ATOM 1032 N ALA C 29 95.364 9.254 -0.412 1.00 0.00 N ATOM 1033 CA ALA C 29 96.522 8.789 -1.164 1.00 0.00 C ATOM 1034 C ALA C 29 96.170 7.760 -2.235 1.00 0.00 C ATOM 1035 O ALA C 29 96.880 7.651 -3.236 1.00 0.00 O ATOM 1036 CB ALA C 29 97.540 8.172 -0.203 1.00 0.00 C ATOM 0 H ALA C 29 95.329 8.928 0.554 1.00 0.00 H new ATOM 0 HA ALA C 29 96.936 9.660 -1.672 1.00 0.00 H new ATOM 0 HB1 ALA C 29 98.407 7.824 -0.765 1.00 0.00 H new ATOM 0 HB2 ALA C 29 97.856 8.921 0.523 1.00 0.00 H new ATOM 0 HB3 ALA C 29 97.084 7.331 0.319 1.00 0.00 H new ATOM 1042 N ALA C 30 95.120 7.003 -2.044 1.00 0.00 N ATOM 1043 CA ALA C 30 94.767 5.998 -3.027 1.00 0.00 C ATOM 1044 C ALA C 30 94.185 6.627 -4.292 1.00 0.00 C ATOM 1045 O ALA C 30 94.541 6.230 -5.402 1.00 0.00 O ATOM 1046 CB ALA C 30 93.804 4.989 -2.415 1.00 0.00 C ATOM 0 H ALA C 30 94.502 7.057 -1.235 1.00 0.00 H new ATOM 0 HA ALA C 30 95.676 5.475 -3.325 1.00 0.00 H new ATOM 0 HB1 ALA C 30 93.543 4.237 -3.160 1.00 0.00 H new ATOM 0 HB2 ALA C 30 94.278 4.505 -1.561 1.00 0.00 H new ATOM 0 HB3 ALA C 30 92.900 5.502 -2.086 1.00 0.00 H new ATOM 1052 N SER C 31 93.304 7.586 -4.139 1.00 0.00 N ATOM 1053 CA SER C 31 92.692 8.240 -5.295 1.00 0.00 C ATOM 1054 C SER C 31 93.684 9.142 -6.036 1.00 0.00 C ATOM 1055 O SER C 31 93.572 9.329 -7.248 1.00 0.00 O ATOM 1056 CB SER C 31 91.493 9.071 -4.836 1.00 0.00 C ATOM 1057 OG SER C 31 90.836 9.616 -5.972 1.00 0.00 O ATOM 0 H SER C 31 92.989 7.937 -3.235 1.00 0.00 H new ATOM 0 HA SER C 31 92.371 7.460 -5.986 1.00 0.00 H new ATOM 0 HB2 SER C 31 90.802 8.450 -4.266 1.00 0.00 H new ATOM 0 HB3 SER C 31 91.823 9.871 -4.174 1.00 0.00 H new ATOM 0 HG SER C 31 90.066 10.148 -5.681 1.00 0.00 H new ATOM 1063 N ILE C 32 94.616 9.708 -5.316 1.00 0.00 N ATOM 1064 CA ILE C 32 95.597 10.611 -5.921 1.00 0.00 C ATOM 1065 C ILE C 32 96.200 9.981 -7.178 1.00 0.00 C ATOM 1066 O ILE C 32 96.481 10.679 -8.149 1.00 0.00 O ATOM 1067 CB ILE C 32 96.696 10.950 -4.885 1.00 0.00 C ATOM 1068 CG1 ILE C 32 96.198 12.072 -3.942 1.00 0.00 C ATOM 1069 CG2 ILE C 32 97.996 11.392 -5.579 1.00 0.00 C ATOM 1070 CD1 ILE C 32 96.418 13.463 -4.563 1.00 0.00 C ATOM 0 H ILE C 32 94.728 9.569 -4.312 1.00 0.00 H new ATOM 0 HA ILE C 32 95.101 11.535 -6.219 1.00 0.00 H new ATOM 0 HB ILE C 32 96.908 10.051 -4.306 1.00 0.00 H new ATOM 0 HG12 ILE C 32 95.138 11.929 -3.731 1.00 0.00 H new ATOM 0 HG13 ILE C 32 96.724 12.009 -2.989 1.00 0.00 H new ATOM 0 HG21 ILE C 32 98.750 11.624 -4.826 1.00 0.00 H new ATOM 0 HG22 ILE C 32 98.358 10.588 -6.220 1.00 0.00 H new ATOM 0 HG23 ILE C 32 97.803 12.278 -6.183 1.00 0.00 H new ATOM 0 HD11 ILE C 32 96.058 14.229 -3.876 1.00 0.00 H new ATOM 0 HD12 ILE C 32 97.481 13.614 -4.750 1.00 0.00 H new ATOM 0 HD13 ILE C 32 95.871 13.532 -5.503 1.00 0.00 H new ATOM 1082 N ILE C 33 96.399 8.696 -7.162 1.00 0.00 N ATOM 1083 CA ILE C 33 96.964 8.022 -8.323 1.00 0.00 C ATOM 1084 C ILE C 33 95.999 8.100 -9.508 1.00 0.00 C ATOM 1085 O ILE C 33 96.398 8.389 -10.636 1.00 0.00 O ATOM 1086 CB ILE C 33 97.236 6.550 -7.978 1.00 0.00 C ATOM 1087 CG1 ILE C 33 98.403 6.467 -6.991 1.00 0.00 C ATOM 1088 CG2 ILE C 33 97.584 5.763 -9.247 1.00 0.00 C ATOM 1089 CD1 ILE C 33 98.480 5.055 -6.405 1.00 0.00 C ATOM 0 H ILE C 33 96.185 8.087 -6.372 1.00 0.00 H new ATOM 0 HA ILE C 33 97.897 8.515 -8.597 1.00 0.00 H new ATOM 0 HB ILE C 33 96.341 6.119 -7.529 1.00 0.00 H new ATOM 0 HG12 ILE C 33 99.337 6.714 -7.495 1.00 0.00 H new ATOM 0 HG13 ILE C 33 98.270 7.196 -6.192 1.00 0.00 H new ATOM 0 HG21 ILE C 33 97.774 4.721 -8.988 1.00 0.00 H new ATOM 0 HG22 ILE C 33 96.751 5.816 -9.948 1.00 0.00 H new ATOM 0 HG23 ILE C 33 98.474 6.191 -9.708 1.00 0.00 H new ATOM 0 HD11 ILE C 33 99.311 4.997 -5.702 1.00 0.00 H new ATOM 0 HD12 ILE C 33 97.550 4.825 -5.886 1.00 0.00 H new ATOM 0 HD13 ILE C 33 98.634 4.335 -7.209 1.00 0.00 H new ATOM 1101 N GLY C 34 94.765 7.779 -9.246 1.00 0.00 N ATOM 1102 CA GLY C 34 93.742 7.735 -10.287 1.00 0.00 C ATOM 1103 C GLY C 34 93.719 8.976 -11.188 1.00 0.00 C ATOM 1104 O GLY C 34 93.709 8.847 -12.412 1.00 0.00 O ATOM 0 H GLY C 34 94.426 7.539 -8.314 1.00 0.00 H new ATOM 0 HA2 GLY C 34 93.904 6.852 -10.905 1.00 0.00 H new ATOM 0 HA3 GLY C 34 92.765 7.620 -9.818 1.00 0.00 H new ATOM 1108 N ILE C 35 93.692 10.147 -10.613 1.00 0.00 N ATOM 1109 CA ILE C 35 93.645 11.371 -11.417 1.00 0.00 C ATOM 1110 C ILE C 35 94.775 11.404 -12.453 1.00 0.00 C ATOM 1111 O ILE C 35 94.634 12.004 -13.518 1.00 0.00 O ATOM 1112 CB ILE C 35 93.737 12.608 -10.511 1.00 0.00 C ATOM 1113 CG1 ILE C 35 94.830 12.390 -9.463 1.00 0.00 C ATOM 1114 CG2 ILE C 35 92.396 12.838 -9.806 1.00 0.00 C ATOM 1115 CD1 ILE C 35 95.195 13.728 -8.816 1.00 0.00 C ATOM 0 H ILE C 35 93.701 10.296 -9.604 1.00 0.00 H new ATOM 0 HA ILE C 35 92.693 11.381 -11.948 1.00 0.00 H new ATOM 0 HB ILE C 35 93.978 13.480 -11.118 1.00 0.00 H new ATOM 0 HG12 ILE C 35 94.485 11.689 -8.703 1.00 0.00 H new ATOM 0 HG13 ILE C 35 95.711 11.947 -9.928 1.00 0.00 H new ATOM 0 HG21 ILE C 35 92.468 13.717 -9.165 1.00 0.00 H new ATOM 0 HG22 ILE C 35 91.616 12.995 -10.551 1.00 0.00 H new ATOM 0 HG23 ILE C 35 92.149 11.966 -9.200 1.00 0.00 H new ATOM 0 HD11 ILE C 35 95.974 13.571 -8.070 1.00 0.00 H new ATOM 0 HD12 ILE C 35 95.558 14.415 -9.581 1.00 0.00 H new ATOM 0 HD13 ILE C 35 94.313 14.153 -8.336 1.00 0.00 H new ATOM 1127 N LEU C 36 95.875 10.780 -12.134 1.00 0.00 N ATOM 1128 CA LEU C 36 97.028 10.754 -13.035 1.00 0.00 C ATOM 1129 C LEU C 36 96.749 9.916 -14.293 1.00 0.00 C ATOM 1130 O LEU C 36 97.360 10.139 -15.337 1.00 0.00 O ATOM 1131 CB LEU C 36 98.285 10.246 -12.269 1.00 0.00 C ATOM 1132 CG LEU C 36 98.610 8.765 -12.593 1.00 0.00 C ATOM 1133 CD1 LEU C 36 99.265 8.627 -13.996 1.00 0.00 C ATOM 1134 CD2 LEU C 36 99.560 8.211 -11.516 1.00 0.00 C ATOM 0 H LEU C 36 96.012 10.277 -11.257 1.00 0.00 H new ATOM 0 HA LEU C 36 97.221 11.770 -13.379 1.00 0.00 H new ATOM 0 HB2 LEU C 36 99.142 10.869 -12.527 1.00 0.00 H new ATOM 0 HB3 LEU C 36 98.123 10.354 -11.197 1.00 0.00 H new ATOM 0 HG LEU C 36 97.680 8.197 -12.600 1.00 0.00 H new ATOM 0 HD11 LEU C 36 99.481 7.577 -14.195 1.00 0.00 H new ATOM 0 HD12 LEU C 36 98.582 9.007 -14.756 1.00 0.00 H new ATOM 0 HD13 LEU C 36 100.192 9.200 -14.023 1.00 0.00 H new ATOM 0 HD21 LEU C 36 99.793 7.169 -11.737 1.00 0.00 H new ATOM 0 HD22 LEU C 36 100.480 8.795 -11.507 1.00 0.00 H new ATOM 0 HD23 LEU C 36 99.080 8.276 -10.539 1.00 0.00 H new ATOM 1146 N HIS C 37 95.867 8.960 -14.184 1.00 0.00 N ATOM 1147 CA HIS C 37 95.558 8.094 -15.322 1.00 0.00 C ATOM 1148 C HIS C 37 94.791 8.828 -16.424 1.00 0.00 C ATOM 1149 O HIS C 37 94.891 8.467 -17.597 1.00 0.00 O ATOM 1150 CB HIS C 37 94.775 6.850 -14.860 1.00 0.00 C ATOM 1151 CG HIS C 37 93.331 7.173 -14.543 1.00 0.00 C ATOM 1152 ND1 HIS C 37 92.538 7.984 -15.344 1.00 0.00 N ATOM 1153 CD2 HIS C 37 92.519 6.766 -13.513 1.00 0.00 C ATOM 1154 CE1 HIS C 37 91.316 8.040 -14.784 1.00 0.00 C ATOM 1155 NE2 HIS C 37 91.251 7.315 -13.666 1.00 0.00 N ATOM 0 H HIS C 37 95.346 8.751 -13.332 1.00 0.00 H new ATOM 0 HA HIS C 37 96.510 7.779 -15.748 1.00 0.00 H new ATOM 0 HB2 HIS C 37 94.813 6.088 -15.638 1.00 0.00 H new ATOM 0 HB3 HIS C 37 95.254 6.428 -13.977 1.00 0.00 H new ATOM 0 HD2 HIS C 37 92.821 6.116 -12.705 1.00 0.00 H new ATOM 0 HE1 HIS C 37 90.489 8.603 -15.190 1.00 0.00 H new ATOM 0 HE2 HIS C 37 90.444 7.190 -13.055 1.00 0.00 H new ATOM 1164 N PHE C 38 94.020 9.814 -16.057 1.00 0.00 N ATOM 1165 CA PHE C 38 93.225 10.547 -17.041 1.00 0.00 C ATOM 1166 C PHE C 38 94.100 11.237 -18.089 1.00 0.00 C ATOM 1167 O PHE C 38 93.822 11.151 -19.285 1.00 0.00 O ATOM 1168 CB PHE C 38 92.350 11.594 -16.350 1.00 0.00 C ATOM 1169 CG PHE C 38 91.467 12.256 -17.384 1.00 0.00 C ATOM 1170 CD1 PHE C 38 90.218 11.703 -17.701 1.00 0.00 C ATOM 1171 CD2 PHE C 38 91.901 13.419 -18.032 1.00 0.00 C ATOM 1172 CE1 PHE C 38 89.408 12.314 -18.664 1.00 0.00 C ATOM 1173 CE2 PHE C 38 91.089 14.029 -18.995 1.00 0.00 C ATOM 1174 CZ PHE C 38 89.842 13.477 -19.311 1.00 0.00 C ATOM 0 H PHE C 38 93.916 10.137 -15.095 1.00 0.00 H new ATOM 0 HA PHE C 38 92.597 9.815 -17.549 1.00 0.00 H new ATOM 0 HB2 PHE C 38 91.740 11.125 -15.578 1.00 0.00 H new ATOM 0 HB3 PHE C 38 92.973 12.338 -15.855 1.00 0.00 H new ATOM 0 HD1 PHE C 38 89.882 10.806 -17.202 1.00 0.00 H new ATOM 0 HD2 PHE C 38 92.863 13.846 -17.789 1.00 0.00 H new ATOM 0 HE1 PHE C 38 88.446 11.888 -18.909 1.00 0.00 H new ATOM 0 HE2 PHE C 38 91.425 14.926 -19.494 1.00 0.00 H new ATOM 0 HZ PHE C 38 89.215 13.948 -20.054 1.00 0.00 H new ATOM 1184 N ILE C 39 95.121 11.920 -17.651 1.00 0.00 N ATOM 1185 CA ILE C 39 95.998 12.631 -18.580 1.00 0.00 C ATOM 1186 C ILE C 39 96.737 11.656 -19.498 1.00 0.00 C ATOM 1187 O ILE C 39 97.067 11.991 -20.632 1.00 0.00 O ATOM 1188 CB ILE C 39 96.999 13.501 -17.802 1.00 0.00 C ATOM 1189 CG1 ILE C 39 97.984 14.182 -18.768 1.00 0.00 C ATOM 1190 CG2 ILE C 39 97.779 12.639 -16.809 1.00 0.00 C ATOM 1191 CD1 ILE C 39 97.221 14.990 -19.825 1.00 0.00 C ATOM 0 H ILE C 39 95.377 12.008 -16.668 1.00 0.00 H new ATOM 0 HA ILE C 39 95.381 13.276 -19.205 1.00 0.00 H new ATOM 0 HB ILE C 39 96.442 14.267 -17.262 1.00 0.00 H new ATOM 0 HG12 ILE C 39 98.654 14.838 -18.212 1.00 0.00 H new ATOM 0 HG13 ILE C 39 98.606 13.430 -19.254 1.00 0.00 H new ATOM 0 HG21 ILE C 39 98.486 13.263 -16.262 1.00 0.00 H new ATOM 0 HG22 ILE C 39 97.086 12.175 -16.107 1.00 0.00 H new ATOM 0 HG23 ILE C 39 98.322 11.863 -17.349 1.00 0.00 H new ATOM 0 HD11 ILE C 39 97.931 15.466 -20.501 1.00 0.00 H new ATOM 0 HD12 ILE C 39 96.570 14.324 -20.392 1.00 0.00 H new ATOM 0 HD13 ILE C 39 96.619 15.755 -19.334 1.00 0.00 H new ATOM 1203 N ALA C 40 96.988 10.471 -19.017 1.00 0.00 N ATOM 1204 CA ALA C 40 97.677 9.473 -19.826 1.00 0.00 C ATOM 1205 C ALA C 40 96.754 8.941 -20.923 1.00 0.00 C ATOM 1206 O ALA C 40 97.192 8.633 -22.029 1.00 0.00 O ATOM 1207 CB ALA C 40 98.160 8.324 -18.936 1.00 0.00 C ATOM 0 H ALA C 40 96.733 10.163 -18.079 1.00 0.00 H new ATOM 0 HA ALA C 40 98.539 9.942 -20.300 1.00 0.00 H new ATOM 0 HB1 ALA C 40 98.674 7.582 -19.547 1.00 0.00 H new ATOM 0 HB2 ALA C 40 98.846 8.711 -18.182 1.00 0.00 H new ATOM 0 HB3 ALA C 40 97.305 7.860 -18.445 1.00 0.00 H new ATOM 1213 N TRP C 41 95.498 8.816 -20.587 1.00 0.00 N ATOM 1214 CA TRP C 41 94.483 8.291 -21.498 1.00 0.00 C ATOM 1215 C TRP C 41 94.510 8.972 -22.867 1.00 0.00 C ATOM 1216 O TRP C 41 94.522 8.306 -23.901 1.00 0.00 O ATOM 1217 CB TRP C 41 93.115 8.525 -20.853 1.00 0.00 C ATOM 1218 CG TRP C 41 92.037 7.827 -21.614 1.00 0.00 C ATOM 1219 CD1 TRP C 41 91.625 8.138 -22.866 1.00 0.00 C ATOM 1220 CD2 TRP C 41 91.204 6.719 -21.173 1.00 0.00 C ATOM 1221 NE1 TRP C 41 90.600 7.280 -23.223 1.00 0.00 N ATOM 1222 CE2 TRP C 41 90.304 6.388 -22.210 1.00 0.00 C ATOM 1223 CE3 TRP C 41 91.149 5.974 -19.982 1.00 0.00 C ATOM 1224 CZ2 TRP C 41 89.379 5.354 -22.070 1.00 0.00 C ATOM 1225 CZ3 TRP C 41 90.220 4.935 -19.837 1.00 0.00 C ATOM 1226 CH2 TRP C 41 89.336 4.626 -20.878 1.00 0.00 C ATOM 0 H TRP C 41 95.135 9.074 -19.669 1.00 0.00 H new ATOM 0 HA TRP C 41 94.684 7.233 -21.663 1.00 0.00 H new ATOM 0 HB2 TRP C 41 93.128 8.167 -19.824 1.00 0.00 H new ATOM 0 HB3 TRP C 41 92.905 9.594 -20.816 1.00 0.00 H new ATOM 0 HD1 TRP C 41 92.030 8.926 -23.484 1.00 0.00 H new ATOM 0 HE1 TRP C 41 90.122 7.303 -24.124 1.00 0.00 H new ATOM 0 HE3 TRP C 41 91.827 6.204 -19.174 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 88.701 5.118 -22.877 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 90.186 4.370 -18.917 1.00 0.00 H new ATOM 0 HH2 TRP C 41 88.621 3.825 -20.760 1.00 0.00 H new ATOM 1237 N THR C 42 94.485 10.271 -22.863 1.00 0.00 N ATOM 1238 CA THR C 42 94.467 11.042 -24.105 1.00 0.00 C ATOM 1239 C THR C 42 95.610 10.664 -25.050 1.00 0.00 C ATOM 1240 O THR C 42 95.491 10.835 -26.261 1.00 0.00 O ATOM 1241 CB THR C 42 94.520 12.543 -23.801 1.00 0.00 C ATOM 1242 OG1 THR C 42 94.952 13.243 -24.960 1.00 0.00 O ATOM 1243 CG2 THR C 42 95.494 12.802 -22.657 1.00 0.00 C ATOM 0 H THR C 42 94.476 10.838 -22.015 1.00 0.00 H new ATOM 0 HA THR C 42 93.533 10.800 -24.612 1.00 0.00 H new ATOM 0 HB THR C 42 93.527 12.890 -23.513 1.00 0.00 H new ATOM 0 HG1 THR C 42 94.985 14.204 -24.769 1.00 0.00 H new ATOM 0 HG21 THR C 42 95.529 13.870 -22.444 1.00 0.00 H new ATOM 0 HG22 THR C 42 95.162 12.265 -21.768 1.00 0.00 H new ATOM 0 HG23 THR C 42 96.488 12.456 -22.940 1.00 0.00 H new ATOM 1251 N ILE C 43 96.705 10.187 -24.521 1.00 0.00 N ATOM 1252 CA ILE C 43 97.848 9.831 -25.363 1.00 0.00 C ATOM 1253 C ILE C 43 97.491 8.703 -26.350 1.00 0.00 C ATOM 1254 O ILE C 43 97.790 8.797 -27.540 1.00 0.00 O ATOM 1255 CB ILE C 43 99.049 9.445 -24.453 1.00 0.00 C ATOM 1256 CG1 ILE C 43 100.375 9.896 -25.085 1.00 0.00 C ATOM 1257 CG2 ILE C 43 99.110 7.928 -24.207 1.00 0.00 C ATOM 1258 CD1 ILE C 43 101.521 9.621 -24.107 1.00 0.00 C ATOM 0 H ILE C 43 96.843 10.032 -23.522 1.00 0.00 H new ATOM 0 HA ILE C 43 98.129 10.692 -25.970 1.00 0.00 H new ATOM 0 HB ILE C 43 98.900 9.952 -23.500 1.00 0.00 H new ATOM 0 HG12 ILE C 43 100.545 9.364 -26.021 1.00 0.00 H new ATOM 0 HG13 ILE C 43 100.334 10.958 -25.325 1.00 0.00 H new ATOM 0 HG21 ILE C 43 99.962 7.697 -23.567 1.00 0.00 H new ATOM 0 HG22 ILE C 43 98.191 7.601 -23.720 1.00 0.00 H new ATOM 0 HG23 ILE C 43 99.220 7.409 -25.159 1.00 0.00 H new ATOM 0 HD11 ILE C 43 102.464 9.940 -24.552 1.00 0.00 H new ATOM 0 HD12 ILE C 43 101.351 10.173 -23.183 1.00 0.00 H new ATOM 0 HD13 ILE C 43 101.565 8.554 -23.889 1.00 0.00 H new ATOM 1270 N GLY C 44 96.876 7.661 -25.857 1.00 0.00 N ATOM 1271 CA GLY C 44 96.495 6.524 -26.696 1.00 0.00 C ATOM 1272 C GLY C 44 95.541 6.949 -27.809 1.00 0.00 C ATOM 1273 O GLY C 44 95.491 6.332 -28.873 1.00 0.00 O ATOM 0 H GLY C 44 96.621 7.563 -24.874 1.00 0.00 H new ATOM 0 HA2 GLY C 44 97.388 6.076 -27.131 1.00 0.00 H new ATOM 0 HA3 GLY C 44 96.021 5.759 -26.081 1.00 0.00 H new ATOM 1277 N HIS C 45 94.789 7.974 -27.545 1.00 0.00 N ATOM 1278 CA HIS C 45 93.816 8.474 -28.506 1.00 0.00 C ATOM 1279 C HIS C 45 94.437 8.634 -29.894 1.00 0.00 C ATOM 1280 O HIS C 45 93.728 8.594 -30.900 1.00 0.00 O ATOM 1281 CB HIS C 45 93.257 9.814 -28.035 1.00 0.00 C ATOM 1282 CG HIS C 45 92.134 10.226 -28.944 1.00 0.00 C ATOM 1283 ND1 HIS C 45 92.298 11.177 -29.939 1.00 0.00 N ATOM 1284 CD2 HIS C 45 90.826 9.817 -29.029 1.00 0.00 C ATOM 1285 CE1 HIS C 45 91.119 11.309 -30.573 1.00 0.00 C ATOM 1286 NE2 HIS C 45 90.187 10.502 -30.057 1.00 0.00 N ATOM 0 H HIS C 45 94.821 8.494 -26.668 1.00 0.00 H new ATOM 0 HA HIS C 45 93.008 7.745 -28.575 1.00 0.00 H new ATOM 0 HB2 HIS C 45 92.899 9.732 -27.009 1.00 0.00 H new ATOM 0 HB3 HIS C 45 94.041 10.571 -28.040 1.00 0.00 H new ATOM 0 HD2 HIS C 45 90.364 9.076 -28.394 1.00 0.00 H new ATOM 0 HE1 HIS C 45 90.947 11.984 -31.398 1.00 0.00 H new ATOM 0 HE2 HIS C 45 89.216 10.409 -30.353 1.00 0.00 H new ATOM 1295 N LEU C 46 95.723 8.868 -29.948 1.00 0.00 N ATOM 1296 CA LEU C 46 96.382 9.095 -31.234 1.00 0.00 C ATOM 1297 C LEU C 46 95.921 8.078 -32.282 1.00 0.00 C ATOM 1298 O LEU C 46 95.809 8.416 -33.459 1.00 0.00 O ATOM 1299 CB LEU C 46 97.918 9.044 -31.069 1.00 0.00 C ATOM 1300 CG LEU C 46 98.436 7.579 -30.953 1.00 0.00 C ATOM 1301 CD1 LEU C 46 98.904 7.045 -32.321 1.00 0.00 C ATOM 1302 CD2 LEU C 46 99.631 7.525 -29.990 1.00 0.00 C ATOM 0 H LEU C 46 96.338 8.909 -29.136 1.00 0.00 H new ATOM 0 HA LEU C 46 96.100 10.088 -31.585 1.00 0.00 H new ATOM 0 HB2 LEU C 46 98.392 9.531 -31.921 1.00 0.00 H new ATOM 0 HB3 LEU C 46 98.207 9.604 -30.180 1.00 0.00 H new ATOM 0 HG LEU C 46 97.613 6.966 -30.585 1.00 0.00 H new ATOM 0 HD11 LEU C 46 99.260 6.021 -32.209 1.00 0.00 H new ATOM 0 HD12 LEU C 46 98.071 7.065 -33.024 1.00 0.00 H new ATOM 0 HD13 LEU C 46 99.712 7.671 -32.699 1.00 0.00 H new ATOM 0 HD21 LEU C 46 99.990 6.499 -29.912 1.00 0.00 H new ATOM 0 HD22 LEU C 46 100.431 8.161 -30.367 1.00 0.00 H new ATOM 0 HD23 LEU C 46 99.321 7.877 -29.006 1.00 0.00 H new ATOM 1314 N ASN C 47 95.653 6.865 -31.881 1.00 0.00 N ATOM 1315 CA ASN C 47 95.201 5.862 -32.845 1.00 0.00 C ATOM 1316 C ASN C 47 93.836 6.254 -33.433 1.00 0.00 C ATOM 1317 O ASN C 47 93.665 6.296 -34.651 1.00 0.00 O ATOM 1318 CB ASN C 47 95.086 4.496 -32.160 1.00 0.00 C ATOM 1319 CG ASN C 47 96.475 3.917 -31.906 1.00 0.00 C ATOM 1320 OD1 ASN C 47 97.491 4.721 -31.762 1.00 0.00 O flip ATOM 1321 ND2 ASN C 47 96.635 2.698 -31.836 1.00 0.00 N flip ATOM 0 H ASN C 47 95.733 6.538 -30.918 1.00 0.00 H new ATOM 0 HA ASN C 47 95.931 5.807 -33.653 1.00 0.00 H new ATOM 0 HB2 ASN C 47 94.548 4.598 -31.217 1.00 0.00 H new ATOM 0 HB3 ASN C 47 94.508 3.815 -32.785 1.00 0.00 H new ATOM 0 HD21 ASN C 47 95.838 2.072 -31.949 1.00 0.00 H new ATOM 0 HD22 ASN C 47 97.565 2.315 -31.665 1.00 0.00 H new ATOM 1328 N GLN C 48 92.888 6.533 -32.573 1.00 0.00 N ATOM 1329 CA GLN C 48 91.545 6.918 -33.002 1.00 0.00 C ATOM 1330 C GLN C 48 91.588 7.980 -34.104 1.00 0.00 C ATOM 1331 O GLN C 48 91.049 7.777 -35.191 1.00 0.00 O ATOM 1332 CB GLN C 48 90.759 7.466 -31.801 1.00 0.00 C ATOM 1333 CG GLN C 48 90.288 6.311 -30.915 1.00 0.00 C ATOM 1334 CD GLN C 48 91.488 5.563 -30.344 1.00 0.00 C ATOM 1335 OE1 GLN C 48 92.112 4.686 -31.083 1.00 0.00 O flip ATOM 1336 NE2 GLN C 48 91.869 5.784 -29.195 1.00 0.00 N flip ATOM 0 H GLN C 48 93.013 6.503 -31.561 1.00 0.00 H new ATOM 0 HA GLN C 48 91.054 6.031 -33.403 1.00 0.00 H new ATOM 0 HB2 GLN C 48 91.387 8.146 -31.224 1.00 0.00 H new ATOM 0 HB3 GLN C 48 89.901 8.042 -32.149 1.00 0.00 H new ATOM 0 HG2 GLN C 48 89.669 6.694 -30.104 1.00 0.00 H new ATOM 0 HG3 GLN C 48 89.667 5.628 -31.495 1.00 0.00 H new ATOM 0 HE21 GLN C 48 91.381 6.469 -28.619 1.00 0.00 H new ATOM 0 HE22 GLN C 48 92.673 5.282 -28.819 1.00 0.00 H new ATOM 1345 N ILE C 49 92.202 9.097 -33.814 1.00 0.00 N ATOM 1346 CA ILE C 49 92.282 10.187 -34.785 1.00 0.00 C ATOM 1347 C ILE C 49 93.038 9.760 -36.039 1.00 0.00 C ATOM 1348 O ILE C 49 92.742 10.230 -37.138 1.00 0.00 O ATOM 1349 CB ILE C 49 92.978 11.399 -34.162 1.00 0.00 C ATOM 1350 CG1 ILE C 49 93.081 12.520 -35.201 1.00 0.00 C ATOM 1351 CG2 ILE C 49 94.378 10.999 -33.703 1.00 0.00 C ATOM 1352 CD1 ILE C 49 93.524 13.816 -34.518 1.00 0.00 C ATOM 0 H ILE C 49 92.656 9.288 -32.921 1.00 0.00 H new ATOM 0 HA ILE C 49 91.263 10.452 -35.068 1.00 0.00 H new ATOM 0 HB ILE C 49 92.401 11.750 -33.307 1.00 0.00 H new ATOM 0 HG12 ILE C 49 93.794 12.245 -35.978 1.00 0.00 H new ATOM 0 HG13 ILE C 49 92.118 12.666 -35.690 1.00 0.00 H new ATOM 0 HG21 ILE C 49 94.875 11.861 -33.259 1.00 0.00 H new ATOM 0 HG22 ILE C 49 94.304 10.202 -32.963 1.00 0.00 H new ATOM 0 HG23 ILE C 49 94.955 10.648 -34.559 1.00 0.00 H new ATOM 0 HD11 ILE C 49 93.596 14.612 -35.259 1.00 0.00 H new ATOM 0 HD12 ILE C 49 92.795 14.094 -33.757 1.00 0.00 H new ATOM 0 HD13 ILE C 49 94.497 13.666 -34.050 1.00 0.00 H new ATOM 1364 N LYS C 50 93.997 8.892 -35.880 1.00 0.00 N ATOM 1365 CA LYS C 50 94.779 8.429 -37.020 1.00 0.00 C ATOM 1366 C LYS C 50 93.890 7.673 -38.004 1.00 0.00 C ATOM 1367 O LYS C 50 93.992 7.859 -39.216 1.00 0.00 O ATOM 1368 CB LYS C 50 95.911 7.513 -36.542 1.00 0.00 C ATOM 1369 CG LYS C 50 96.918 7.272 -37.686 1.00 0.00 C ATOM 1370 CD LYS C 50 97.988 8.371 -37.687 1.00 0.00 C ATOM 1371 CE LYS C 50 98.974 8.125 -38.832 1.00 0.00 C ATOM 1372 NZ LYS C 50 100.096 9.102 -38.739 1.00 0.00 N ATOM 0 H LYS C 50 94.264 8.486 -34.983 1.00 0.00 H new ATOM 0 HA LYS C 50 95.205 9.297 -37.523 1.00 0.00 H new ATOM 0 HB2 LYS C 50 96.419 7.964 -35.689 1.00 0.00 H new ATOM 0 HB3 LYS C 50 95.501 6.562 -36.202 1.00 0.00 H new ATOM 0 HG2 LYS C 50 97.388 6.296 -37.567 1.00 0.00 H new ATOM 0 HG3 LYS C 50 96.397 7.260 -38.643 1.00 0.00 H new ATOM 0 HD2 LYS C 50 97.520 9.349 -37.800 1.00 0.00 H new ATOM 0 HD3 LYS C 50 98.516 8.379 -36.734 1.00 0.00 H new ATOM 0 HE2 LYS C 50 99.359 7.107 -38.782 1.00 0.00 H new ATOM 0 HE3 LYS C 50 98.467 8.227 -39.791 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 100.194 9.605 -39.644 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 99.898 9.787 -37.982 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 100.980 8.597 -38.527 1.00 0.00 H new ATOM 1386 N ARG C 51 93.036 6.835 -37.482 1.00 0.00 N ATOM 1387 CA ARG C 51 92.134 6.056 -38.324 1.00 0.00 C ATOM 1388 C ARG C 51 91.276 6.978 -39.182 1.00 0.00 C ATOM 1389 O ARG C 51 90.615 7.884 -38.671 1.00 0.00 O ATOM 1390 CB ARG C 51 91.233 5.174 -37.447 1.00 0.00 C ATOM 1391 CG ARG C 51 90.345 4.254 -38.326 1.00 0.00 C ATOM 1392 CD ARG C 51 88.925 4.825 -38.447 1.00 0.00 C ATOM 1393 NE ARG C 51 88.256 4.795 -37.151 1.00 0.00 N ATOM 1394 CZ ARG C 51 87.054 5.280 -37.000 1.00 0.00 C ATOM 1395 NH1 ARG C 51 86.428 5.803 -38.019 1.00 0.00 N ATOM 1396 NH2 ARG C 51 86.477 5.242 -35.830 1.00 0.00 N ATOM 0 H ARG C 51 92.937 6.666 -36.481 1.00 0.00 H new ATOM 0 HA ARG C 51 92.730 5.422 -38.980 1.00 0.00 H new ATOM 0 HB2 ARG C 51 91.847 4.567 -36.781 1.00 0.00 H new ATOM 0 HB3 ARG C 51 90.603 5.802 -36.817 1.00 0.00 H new ATOM 0 HG2 ARG C 51 90.787 4.152 -39.317 1.00 0.00 H new ATOM 0 HG3 ARG C 51 90.305 3.255 -37.891 1.00 0.00 H new ATOM 0 HD2 ARG C 51 88.968 5.849 -38.818 1.00 0.00 H new ATOM 0 HD3 ARG C 51 88.353 4.246 -39.173 1.00 0.00 H new ATOM 0 HE ARG C 51 88.736 4.388 -36.349 1.00 0.00 H new ATOM 0 HH11 ARG C 51 86.878 5.833 -38.934 1.00 0.00 H new ATOM 0 HH12 ARG C 51 85.488 6.182 -37.901 1.00 0.00 H new ATOM 0 HH21 ARG C 51 86.966 4.833 -35.033 1.00 0.00 H new ATOM 0 HH22 ARG C 51 85.537 5.621 -35.712 1.00 0.00 H new ATOM 1410 N GLY C 52 91.289 6.745 -40.465 1.00 0.00 N ATOM 1411 CA GLY C 52 90.507 7.558 -41.388 1.00 0.00 C ATOM 1412 C GLY C 52 91.084 8.965 -41.497 1.00 0.00 C ATOM 0 H GLY C 52 91.829 6.001 -40.907 1.00 0.00 H new ATOM 0 HA2 GLY C 52 90.495 7.089 -42.372 1.00 0.00 H new ATOM 0 HA3 GLY C 52 89.473 7.610 -41.047 1.00 0.00 H new ATOM 1417 N SER D 23 86.221 -2.562 11.278 1.00 0.00 N ATOM 1418 CA SER D 23 85.573 -3.004 10.011 1.00 0.00 C ATOM 1419 C SER D 23 86.626 -3.614 9.091 1.00 0.00 C ATOM 1420 O SER D 23 87.815 -3.612 9.407 1.00 0.00 O ATOM 1421 CB SER D 23 84.914 -1.803 9.333 1.00 0.00 C ATOM 1422 OG SER D 23 84.071 -2.262 8.284 1.00 0.00 O ATOM 0 HA SER D 23 84.811 -3.753 10.227 1.00 0.00 H new ATOM 0 HB2 SER D 23 84.334 -1.234 10.059 1.00 0.00 H new ATOM 0 HB3 SER D 23 85.675 -1.131 8.936 1.00 0.00 H new ATOM 0 HG SER D 23 83.645 -1.495 7.847 1.00 0.00 H new ATOM 1427 N ASP D 24 86.188 -4.129 7.972 1.00 0.00 N ATOM 1428 CA ASP D 24 87.098 -4.743 7.013 1.00 0.00 C ATOM 1429 C ASP D 24 87.773 -3.658 6.163 1.00 0.00 C ATOM 1430 O ASP D 24 87.080 -2.960 5.435 1.00 0.00 O ATOM 1431 CB ASP D 24 86.314 -5.683 6.096 1.00 0.00 C ATOM 1432 CG ASP D 24 87.276 -6.494 5.234 1.00 0.00 C ATOM 1433 OD1 ASP D 24 87.946 -5.896 4.408 1.00 0.00 O ATOM 1434 OD2 ASP D 24 87.330 -7.698 5.413 1.00 0.00 O ATOM 0 H ASP D 24 85.207 -4.140 7.693 1.00 0.00 H new ATOM 0 HA ASP D 24 87.860 -5.304 7.554 1.00 0.00 H new ATOM 0 HB2 ASP D 24 85.694 -6.353 6.692 1.00 0.00 H new ATOM 0 HB3 ASP D 24 85.641 -5.107 5.461 1.00 0.00 H new ATOM 1439 N PRO D 25 89.084 -3.491 6.238 1.00 0.00 N ATOM 1440 CA PRO D 25 89.825 -2.453 5.439 1.00 0.00 C ATOM 1441 C PRO D 25 89.374 -2.349 3.976 1.00 0.00 C ATOM 1442 O PRO D 25 90.115 -2.710 3.063 1.00 0.00 O ATOM 1443 CB PRO D 25 91.278 -2.928 5.527 1.00 0.00 C ATOM 1444 CG PRO D 25 91.377 -3.589 6.860 1.00 0.00 C ATOM 1445 CD PRO D 25 90.017 -4.256 7.098 1.00 0.00 C ATOM 0 HA PRO D 25 89.650 -1.451 5.831 1.00 0.00 H new ATOM 0 HB2 PRO D 25 91.518 -3.622 4.721 1.00 0.00 H new ATOM 0 HB3 PRO D 25 91.974 -2.093 5.446 1.00 0.00 H new ATOM 0 HG2 PRO D 25 92.181 -4.325 6.873 1.00 0.00 H new ATOM 0 HG3 PRO D 25 91.598 -2.862 7.641 1.00 0.00 H new ATOM 0 HD2 PRO D 25 90.037 -5.311 6.825 1.00 0.00 H new ATOM 0 HD3 PRO D 25 89.726 -4.204 8.147 1.00 0.00 H new ATOM 1453 N LEU D 26 88.184 -1.858 3.765 1.00 0.00 N ATOM 1454 CA LEU D 26 87.661 -1.705 2.409 1.00 0.00 C ATOM 1455 C LEU D 26 88.531 -0.721 1.618 1.00 0.00 C ATOM 1456 O LEU D 26 88.835 -0.947 0.447 1.00 0.00 O ATOM 1457 CB LEU D 26 86.197 -1.197 2.469 1.00 0.00 C ATOM 1458 CG LEU D 26 85.205 -2.340 2.202 1.00 0.00 C ATOM 1459 CD1 LEU D 26 85.259 -3.347 3.350 1.00 0.00 C ATOM 1460 CD2 LEU D 26 83.791 -1.768 2.094 1.00 0.00 C ATOM 0 H LEU D 26 87.549 -1.554 4.503 1.00 0.00 H new ATOM 0 HA LEU D 26 87.682 -2.671 1.905 1.00 0.00 H new ATOM 0 HB2 LEU D 26 86.000 -0.761 3.448 1.00 0.00 H new ATOM 0 HB3 LEU D 26 86.052 -0.406 1.733 1.00 0.00 H new ATOM 0 HG LEU D 26 85.471 -2.840 1.271 1.00 0.00 H new ATOM 0 HD11 LEU D 26 84.554 -4.156 3.158 1.00 0.00 H new ATOM 0 HD12 LEU D 26 86.267 -3.755 3.429 1.00 0.00 H new ATOM 0 HD13 LEU D 26 84.994 -2.850 4.283 1.00 0.00 H new ATOM 0 HD21 LEU D 26 83.085 -2.577 1.905 1.00 0.00 H new ATOM 0 HD22 LEU D 26 83.529 -1.268 3.026 1.00 0.00 H new ATOM 0 HD23 LEU D 26 83.750 -1.051 1.274 1.00 0.00 H new ATOM 1472 N VAL D 27 88.894 0.361 2.252 1.00 0.00 N ATOM 1473 CA VAL D 27 89.699 1.391 1.602 1.00 0.00 C ATOM 1474 C VAL D 27 91.030 0.853 1.058 1.00 0.00 C ATOM 1475 O VAL D 27 91.351 1.087 -0.106 1.00 0.00 O ATOM 1476 CB VAL D 27 89.978 2.524 2.600 1.00 0.00 C ATOM 1477 CG1 VAL D 27 90.977 3.526 2.003 1.00 0.00 C ATOM 1478 CG2 VAL D 27 88.667 3.247 2.915 1.00 0.00 C ATOM 0 H VAL D 27 88.650 0.564 3.221 1.00 0.00 H new ATOM 0 HA VAL D 27 89.127 1.757 0.750 1.00 0.00 H new ATOM 0 HB VAL D 27 90.402 2.101 3.510 1.00 0.00 H new ATOM 0 HG11 VAL D 27 91.165 4.324 2.721 1.00 0.00 H new ATOM 0 HG12 VAL D 27 91.912 3.015 1.775 1.00 0.00 H new ATOM 0 HG13 VAL D 27 90.563 3.951 1.089 1.00 0.00 H new ATOM 0 HG21 VAL D 27 88.857 4.053 3.623 1.00 0.00 H new ATOM 0 HG22 VAL D 27 88.250 3.661 1.997 1.00 0.00 H new ATOM 0 HG23 VAL D 27 87.958 2.542 3.349 1.00 0.00 H new ATOM 1488 N VAL D 28 91.796 0.159 1.862 1.00 0.00 N ATOM 1489 CA VAL D 28 93.081 -0.375 1.405 1.00 0.00 C ATOM 1490 C VAL D 28 92.911 -1.562 0.454 1.00 0.00 C ATOM 1491 O VAL D 28 93.776 -1.833 -0.379 1.00 0.00 O ATOM 1492 CB VAL D 28 93.932 -0.787 2.619 1.00 0.00 C ATOM 1493 CG1 VAL D 28 93.480 -2.152 3.147 1.00 0.00 C ATOM 1494 CG2 VAL D 28 95.409 -0.862 2.217 1.00 0.00 C ATOM 0 H VAL D 28 91.566 -0.055 2.832 1.00 0.00 H new ATOM 0 HA VAL D 28 93.587 0.414 0.848 1.00 0.00 H new ATOM 0 HB VAL D 28 93.804 -0.041 3.403 1.00 0.00 H new ATOM 0 HG11 VAL D 28 94.091 -2.430 4.006 1.00 0.00 H new ATOM 0 HG12 VAL D 28 92.434 -2.097 3.448 1.00 0.00 H new ATOM 0 HG13 VAL D 28 93.593 -2.901 2.363 1.00 0.00 H new ATOM 0 HG21 VAL D 28 96.007 -1.154 3.080 1.00 0.00 H new ATOM 0 HG22 VAL D 28 95.533 -1.599 1.424 1.00 0.00 H new ATOM 0 HG23 VAL D 28 95.739 0.114 1.861 1.00 0.00 H new ATOM 1504 N ALA D 29 91.823 -2.265 0.602 1.00 0.00 N ATOM 1505 CA ALA D 29 91.562 -3.438 -0.226 1.00 0.00 C ATOM 1506 C ALA D 29 91.418 -3.063 -1.697 1.00 0.00 C ATOM 1507 O ALA D 29 91.915 -3.765 -2.575 1.00 0.00 O ATOM 1508 CB ALA D 29 90.286 -4.134 0.251 1.00 0.00 C ATOM 0 H ALA D 29 91.095 -2.056 1.285 1.00 0.00 H new ATOM 0 HA ALA D 29 92.413 -4.113 -0.129 1.00 0.00 H new ATOM 0 HB1 ALA D 29 90.095 -5.009 -0.370 1.00 0.00 H new ATOM 0 HB2 ALA D 29 90.407 -4.445 1.289 1.00 0.00 H new ATOM 0 HB3 ALA D 29 89.445 -3.445 0.175 1.00 0.00 H new ATOM 1514 N ALA D 30 90.747 -1.977 -1.955 1.00 0.00 N ATOM 1515 CA ALA D 30 90.566 -1.548 -3.330 1.00 0.00 C ATOM 1516 C ALA D 30 91.879 -1.004 -3.897 1.00 0.00 C ATOM 1517 O ALA D 30 92.327 -1.414 -4.968 1.00 0.00 O ATOM 1518 CB ALA D 30 89.490 -0.489 -3.380 1.00 0.00 C ATOM 0 H ALA D 30 90.319 -1.375 -1.251 1.00 0.00 H new ATOM 0 HA ALA D 30 90.263 -2.400 -3.939 1.00 0.00 H new ATOM 0 HB1 ALA D 30 89.349 -0.162 -4.410 1.00 0.00 H new ATOM 0 HB2 ALA D 30 88.556 -0.901 -2.999 1.00 0.00 H new ATOM 0 HB3 ALA D 30 89.788 0.362 -2.767 1.00 0.00 H new ATOM 1524 N SER D 31 92.458 -0.078 -3.184 1.00 0.00 N ATOM 1525 CA SER D 31 93.706 0.563 -3.594 1.00 0.00 C ATOM 1526 C SER D 31 94.789 -0.446 -3.982 1.00 0.00 C ATOM 1527 O SER D 31 95.580 -0.199 -4.892 1.00 0.00 O ATOM 1528 CB SER D 31 94.216 1.408 -2.433 1.00 0.00 C ATOM 1529 OG SER D 31 95.375 2.123 -2.840 1.00 0.00 O ATOM 0 H SER D 31 92.088 0.264 -2.297 1.00 0.00 H new ATOM 0 HA SER D 31 93.495 1.170 -4.475 1.00 0.00 H new ATOM 0 HB2 SER D 31 93.442 2.103 -2.108 1.00 0.00 H new ATOM 0 HB3 SER D 31 94.450 0.770 -1.580 1.00 0.00 H new ATOM 0 HG SER D 31 95.702 2.668 -2.094 1.00 0.00 H new ATOM 1535 N ILE D 32 94.832 -1.544 -3.288 1.00 0.00 N ATOM 1536 CA ILE D 32 95.846 -2.561 -3.560 1.00 0.00 C ATOM 1537 C ILE D 32 95.854 -2.927 -5.049 1.00 0.00 C ATOM 1538 O ILE D 32 96.910 -3.162 -5.633 1.00 0.00 O ATOM 1539 CB ILE D 32 95.601 -3.804 -2.669 1.00 0.00 C ATOM 1540 CG1 ILE D 32 96.932 -4.499 -2.326 1.00 0.00 C ATOM 1541 CG2 ILE D 32 94.674 -4.805 -3.369 1.00 0.00 C ATOM 1542 CD1 ILE D 32 97.720 -4.822 -3.600 1.00 0.00 C ATOM 0 H ILE D 32 94.188 -1.773 -2.531 1.00 0.00 H new ATOM 0 HA ILE D 32 96.830 -2.160 -3.316 1.00 0.00 H new ATOM 0 HB ILE D 32 95.126 -3.461 -1.750 1.00 0.00 H new ATOM 0 HG12 ILE D 32 97.527 -3.856 -1.678 1.00 0.00 H new ATOM 0 HG13 ILE D 32 96.736 -5.417 -1.771 1.00 0.00 H new ATOM 0 HG21 ILE D 32 94.517 -5.669 -2.723 1.00 0.00 H new ATOM 0 HG22 ILE D 32 93.716 -4.329 -3.577 1.00 0.00 H new ATOM 0 HG23 ILE D 32 95.129 -5.129 -4.305 1.00 0.00 H new ATOM 0 HD11 ILE D 32 98.656 -5.312 -3.334 1.00 0.00 H new ATOM 0 HD12 ILE D 32 97.131 -5.484 -4.234 1.00 0.00 H new ATOM 0 HD13 ILE D 32 97.934 -3.899 -4.139 1.00 0.00 H new ATOM 1554 N ILE D 33 94.700 -2.959 -5.655 1.00 0.00 N ATOM 1555 CA ILE D 33 94.620 -3.287 -7.073 1.00 0.00 C ATOM 1556 C ILE D 33 95.187 -2.147 -7.924 1.00 0.00 C ATOM 1557 O ILE D 33 95.725 -2.386 -9.005 1.00 0.00 O ATOM 1558 CB ILE D 33 93.166 -3.579 -7.478 1.00 0.00 C ATOM 1559 CG1 ILE D 33 92.737 -4.921 -6.873 1.00 0.00 C ATOM 1560 CG2 ILE D 33 93.054 -3.655 -9.007 1.00 0.00 C ATOM 1561 CD1 ILE D 33 91.232 -5.120 -7.058 1.00 0.00 C ATOM 0 H ILE D 33 93.805 -2.766 -5.206 1.00 0.00 H new ATOM 0 HA ILE D 33 95.217 -4.181 -7.249 1.00 0.00 H new ATOM 0 HB ILE D 33 92.521 -2.780 -7.111 1.00 0.00 H new ATOM 0 HG12 ILE D 33 93.281 -5.735 -7.351 1.00 0.00 H new ATOM 0 HG13 ILE D 33 92.988 -4.948 -5.813 1.00 0.00 H new ATOM 0 HG21 ILE D 33 92.021 -3.862 -9.286 1.00 0.00 H new ATOM 0 HG22 ILE D 33 93.364 -2.705 -9.442 1.00 0.00 H new ATOM 0 HG23 ILE D 33 93.697 -4.452 -9.380 1.00 0.00 H new ATOM 0 HD11 ILE D 33 90.935 -6.076 -6.626 1.00 0.00 H new ATOM 0 HD12 ILE D 33 90.694 -4.314 -6.559 1.00 0.00 H new ATOM 0 HD13 ILE D 33 90.992 -5.113 -8.121 1.00 0.00 H new ATOM 1573 N GLY D 34 95.007 -0.931 -7.482 1.00 0.00 N ATOM 1574 CA GLY D 34 95.435 0.232 -8.253 1.00 0.00 C ATOM 1575 C GLY D 34 96.847 0.116 -8.828 1.00 0.00 C ATOM 1576 O GLY D 34 97.051 0.412 -10.006 1.00 0.00 O ATOM 0 H GLY D 34 94.566 -0.708 -6.590 1.00 0.00 H new ATOM 0 HA2 GLY D 34 94.733 0.390 -9.072 1.00 0.00 H new ATOM 0 HA3 GLY D 34 95.385 1.115 -7.616 1.00 0.00 H new ATOM 1580 N ILE D 35 97.806 -0.280 -8.042 1.00 0.00 N ATOM 1581 CA ILE D 35 99.168 -0.379 -8.565 1.00 0.00 C ATOM 1582 C ILE D 35 99.236 -1.350 -9.745 1.00 0.00 C ATOM 1583 O ILE D 35 100.071 -1.198 -10.636 1.00 0.00 O ATOM 1584 CB ILE D 35 100.147 -0.813 -7.470 1.00 0.00 C ATOM 1585 CG1 ILE D 35 99.678 -2.123 -6.840 1.00 0.00 C ATOM 1586 CG2 ILE D 35 100.217 0.273 -6.393 1.00 0.00 C ATOM 1587 CD1 ILE D 35 100.801 -2.700 -5.975 1.00 0.00 C ATOM 0 H ILE D 35 97.693 -0.537 -7.061 1.00 0.00 H new ATOM 0 HA ILE D 35 99.457 0.612 -8.916 1.00 0.00 H new ATOM 0 HB ILE D 35 101.134 -0.961 -7.909 1.00 0.00 H new ATOM 0 HG12 ILE D 35 98.789 -1.950 -6.234 1.00 0.00 H new ATOM 0 HG13 ILE D 35 99.400 -2.835 -7.618 1.00 0.00 H new ATOM 0 HG21 ILE D 35 100.913 -0.033 -5.612 1.00 0.00 H new ATOM 0 HG22 ILE D 35 100.560 1.206 -6.839 1.00 0.00 H new ATOM 0 HG23 ILE D 35 99.228 0.420 -5.960 1.00 0.00 H new ATOM 0 HD11 ILE D 35 100.469 -3.635 -5.524 1.00 0.00 H new ATOM 0 HD12 ILE D 35 101.678 -2.887 -6.595 1.00 0.00 H new ATOM 0 HD13 ILE D 35 101.057 -1.989 -5.189 1.00 0.00 H new ATOM 1599 N LEU D 36 98.371 -2.329 -9.747 1.00 0.00 N ATOM 1600 CA LEU D 36 98.347 -3.316 -10.825 1.00 0.00 C ATOM 1601 C LEU D 36 98.049 -2.646 -12.170 1.00 0.00 C ATOM 1602 O LEU D 36 98.759 -2.857 -13.153 1.00 0.00 O ATOM 1603 CB LEU D 36 97.264 -4.362 -10.526 1.00 0.00 C ATOM 1604 CG LEU D 36 97.428 -5.592 -11.443 1.00 0.00 C ATOM 1605 CD1 LEU D 36 98.465 -6.561 -10.856 1.00 0.00 C ATOM 1606 CD2 LEU D 36 96.080 -6.319 -11.573 1.00 0.00 C ATOM 0 H LEU D 36 97.669 -2.475 -9.021 1.00 0.00 H new ATOM 0 HA LEU D 36 99.325 -3.793 -10.885 1.00 0.00 H new ATOM 0 HB2 LEU D 36 97.326 -4.669 -9.482 1.00 0.00 H new ATOM 0 HB3 LEU D 36 96.277 -3.923 -10.671 1.00 0.00 H new ATOM 0 HG LEU D 36 97.766 -5.255 -12.423 1.00 0.00 H new ATOM 0 HD11 LEU D 36 98.570 -7.424 -11.514 1.00 0.00 H new ATOM 0 HD12 LEU D 36 99.426 -6.055 -10.766 1.00 0.00 H new ATOM 0 HD13 LEU D 36 98.136 -6.893 -9.871 1.00 0.00 H new ATOM 0 HD21 LEU D 36 96.196 -7.188 -12.221 1.00 0.00 H new ATOM 0 HD22 LEU D 36 95.745 -6.643 -10.588 1.00 0.00 H new ATOM 0 HD23 LEU D 36 95.342 -5.642 -12.003 1.00 0.00 H new ATOM 1618 N HIS D 37 97.003 -1.868 -12.199 1.00 0.00 N ATOM 1619 CA HIS D 37 96.611 -1.189 -13.435 1.00 0.00 C ATOM 1620 C HIS D 37 97.667 -0.176 -13.860 1.00 0.00 C ATOM 1621 O HIS D 37 97.831 0.097 -15.047 1.00 0.00 O ATOM 1622 CB HIS D 37 95.236 -0.511 -13.291 1.00 0.00 C ATOM 1623 CG HIS D 37 95.319 0.758 -12.473 1.00 0.00 C ATOM 1624 ND1 HIS D 37 96.302 1.720 -12.659 1.00 0.00 N ATOM 1625 CD2 HIS D 37 94.517 1.240 -11.469 1.00 0.00 C ATOM 1626 CE1 HIS D 37 96.069 2.717 -11.787 1.00 0.00 C ATOM 1627 NE2 HIS D 37 94.993 2.475 -11.036 1.00 0.00 N ATOM 0 H HIS D 37 96.402 -1.680 -11.397 1.00 0.00 H new ATOM 0 HA HIS D 37 96.531 -1.947 -14.214 1.00 0.00 H new ATOM 0 HB2 HIS D 37 94.839 -0.281 -14.280 1.00 0.00 H new ATOM 0 HB3 HIS D 37 94.537 -1.202 -12.820 1.00 0.00 H new ATOM 0 HD2 HIS D 37 93.647 0.737 -11.074 1.00 0.00 H new ATOM 0 HE1 HIS D 37 96.678 3.605 -11.705 1.00 0.00 H new ATOM 0 HE2 HIS D 37 94.603 3.067 -10.303 1.00 0.00 H new ATOM 1636 N PHE D 38 98.358 0.376 -12.903 1.00 0.00 N ATOM 1637 CA PHE D 38 99.387 1.370 -13.187 1.00 0.00 C ATOM 1638 C PHE D 38 100.580 0.763 -13.929 1.00 0.00 C ATOM 1639 O PHE D 38 101.067 1.332 -14.905 1.00 0.00 O ATOM 1640 CB PHE D 38 99.872 1.998 -11.878 1.00 0.00 C ATOM 1641 CG PHE D 38 100.989 2.972 -12.170 1.00 0.00 C ATOM 1642 CD1 PHE D 38 100.694 4.309 -12.460 1.00 0.00 C ATOM 1643 CD2 PHE D 38 102.318 2.534 -12.157 1.00 0.00 C ATOM 1644 CE1 PHE D 38 101.730 5.209 -12.735 1.00 0.00 C ATOM 1645 CE2 PHE D 38 103.354 3.433 -12.433 1.00 0.00 C ATOM 1646 CZ PHE D 38 103.061 4.771 -12.721 1.00 0.00 C ATOM 0 H PHE D 38 98.236 0.162 -11.913 1.00 0.00 H new ATOM 0 HA PHE D 38 98.942 2.130 -13.830 1.00 0.00 H new ATOM 0 HB2 PHE D 38 99.048 2.511 -11.381 1.00 0.00 H new ATOM 0 HB3 PHE D 38 100.221 1.222 -11.197 1.00 0.00 H new ATOM 0 HD1 PHE D 38 99.668 4.646 -12.472 1.00 0.00 H new ATOM 0 HD2 PHE D 38 102.544 1.502 -11.934 1.00 0.00 H new ATOM 0 HE1 PHE D 38 101.504 6.241 -12.958 1.00 0.00 H new ATOM 0 HE2 PHE D 38 104.380 3.095 -12.424 1.00 0.00 H new ATOM 0 HZ PHE D 38 103.861 5.466 -12.932 1.00 0.00 H new ATOM 1656 N ILE D 39 101.058 -0.352 -13.455 1.00 0.00 N ATOM 1657 CA ILE D 39 102.215 -0.998 -14.068 1.00 0.00 C ATOM 1658 C ILE D 39 101.924 -1.454 -15.494 1.00 0.00 C ATOM 1659 O ILE D 39 102.751 -1.282 -16.388 1.00 0.00 O ATOM 1660 CB ILE D 39 102.643 -2.199 -13.226 1.00 0.00 C ATOM 1661 CG1 ILE D 39 103.038 -1.715 -11.830 1.00 0.00 C ATOM 1662 CG2 ILE D 39 103.839 -2.890 -13.885 1.00 0.00 C ATOM 1663 CD1 ILE D 39 103.160 -2.916 -10.891 1.00 0.00 C ATOM 0 H ILE D 39 100.675 -0.843 -12.647 1.00 0.00 H new ATOM 0 HA ILE D 39 103.019 -0.263 -14.109 1.00 0.00 H new ATOM 0 HB ILE D 39 101.817 -2.907 -13.151 1.00 0.00 H new ATOM 0 HG12 ILE D 39 103.985 -1.176 -11.874 1.00 0.00 H new ATOM 0 HG13 ILE D 39 102.292 -1.017 -11.450 1.00 0.00 H new ATOM 0 HG21 ILE D 39 104.142 -3.746 -13.282 1.00 0.00 H new ATOM 0 HG22 ILE D 39 103.559 -3.229 -14.882 1.00 0.00 H new ATOM 0 HG23 ILE D 39 104.669 -2.187 -13.960 1.00 0.00 H new ATOM 0 HD11 ILE D 39 103.442 -2.572 -9.896 1.00 0.00 H new ATOM 0 HD12 ILE D 39 102.203 -3.435 -10.838 1.00 0.00 H new ATOM 0 HD13 ILE D 39 103.922 -3.597 -11.269 1.00 0.00 H new ATOM 1675 N ALA D 40 100.772 -2.027 -15.702 1.00 0.00 N ATOM 1676 CA ALA D 40 100.404 -2.502 -17.028 1.00 0.00 C ATOM 1677 C ALA D 40 100.140 -1.328 -17.962 1.00 0.00 C ATOM 1678 O ALA D 40 100.329 -1.429 -19.173 1.00 0.00 O ATOM 1679 CB ALA D 40 99.161 -3.390 -16.935 1.00 0.00 C ATOM 0 H ALA D 40 100.067 -2.181 -14.981 1.00 0.00 H new ATOM 0 HA ALA D 40 101.231 -3.085 -17.433 1.00 0.00 H new ATOM 0 HB1 ALA D 40 98.890 -3.742 -17.930 1.00 0.00 H new ATOM 0 HB2 ALA D 40 99.372 -4.245 -16.292 1.00 0.00 H new ATOM 0 HB3 ALA D 40 98.334 -2.816 -16.516 1.00 0.00 H new ATOM 1685 N TRP D 41 99.697 -0.238 -17.399 1.00 0.00 N ATOM 1686 CA TRP D 41 99.392 0.951 -18.184 1.00 0.00 C ATOM 1687 C TRP D 41 100.579 1.353 -19.045 1.00 0.00 C ATOM 1688 O TRP D 41 100.429 1.619 -20.238 1.00 0.00 O ATOM 1689 CB TRP D 41 99.033 2.106 -17.245 1.00 0.00 C ATOM 1690 CG TRP D 41 98.600 3.305 -18.032 1.00 0.00 C ATOM 1691 CD1 TRP D 41 99.391 4.033 -18.862 1.00 0.00 C ATOM 1692 CD2 TRP D 41 97.291 3.945 -18.058 1.00 0.00 C ATOM 1693 NE1 TRP D 41 98.642 5.056 -19.408 1.00 0.00 N ATOM 1694 CE2 TRP D 41 97.346 5.046 -18.940 1.00 0.00 C ATOM 1695 CE3 TRP D 41 96.070 3.676 -17.412 1.00 0.00 C ATOM 1696 CZ2 TRP D 41 96.236 5.851 -19.173 1.00 0.00 C ATOM 1697 CZ3 TRP D 41 94.950 4.493 -17.642 1.00 0.00 C ATOM 1698 CH2 TRP D 41 95.037 5.579 -18.525 1.00 0.00 C ATOM 0 H TRP D 41 99.535 -0.137 -16.397 1.00 0.00 H new ATOM 0 HA TRP D 41 98.549 0.725 -18.837 1.00 0.00 H new ATOM 0 HB2 TRP D 41 98.235 1.799 -16.570 1.00 0.00 H new ATOM 0 HB3 TRP D 41 99.893 2.361 -16.626 1.00 0.00 H new ATOM 0 HD1 TRP D 41 100.435 3.843 -19.062 1.00 0.00 H new ATOM 0 HE1 TRP D 41 99.004 5.736 -20.076 1.00 0.00 H new ATOM 0 HE3 TRP D 41 95.993 2.837 -16.736 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 96.306 6.685 -19.856 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 94.019 4.284 -17.137 1.00 0.00 H new ATOM 0 HH2 TRP D 41 94.173 6.203 -18.701 1.00 0.00 H new ATOM 1709 N THR D 42 101.729 1.423 -18.443 1.00 0.00 N ATOM 1710 CA THR D 42 102.926 1.827 -19.163 1.00 0.00 C ATOM 1711 C THR D 42 103.066 1.048 -20.466 1.00 0.00 C ATOM 1712 O THR D 42 103.459 1.608 -21.490 1.00 0.00 O ATOM 1713 CB THR D 42 104.162 1.603 -18.289 1.00 0.00 C ATOM 1714 OG1 THR D 42 104.133 0.287 -17.755 1.00 0.00 O ATOM 1715 CG2 THR D 42 104.164 2.621 -17.148 1.00 0.00 C ATOM 0 H THR D 42 101.876 1.208 -17.457 1.00 0.00 H new ATOM 0 HA THR D 42 102.839 2.887 -19.403 1.00 0.00 H new ATOM 0 HB THR D 42 105.063 1.728 -18.889 1.00 0.00 H new ATOM 0 HG1 THR D 42 103.460 0.237 -17.044 1.00 0.00 H new ATOM 0 HG21 THR D 42 105.043 2.465 -16.523 1.00 0.00 H new ATOM 0 HG22 THR D 42 104.186 3.630 -17.560 1.00 0.00 H new ATOM 0 HG23 THR D 42 103.264 2.495 -16.546 1.00 0.00 H new ATOM 1723 N ILE D 43 102.775 -0.222 -20.423 1.00 0.00 N ATOM 1724 CA ILE D 43 102.901 -1.059 -21.610 1.00 0.00 C ATOM 1725 C ILE D 43 102.207 -0.412 -22.819 1.00 0.00 C ATOM 1726 O ILE D 43 102.668 -0.558 -23.945 1.00 0.00 O ATOM 1727 CB ILE D 43 102.332 -2.474 -21.309 1.00 0.00 C ATOM 1728 CG1 ILE D 43 103.167 -3.548 -22.025 1.00 0.00 C ATOM 1729 CG2 ILE D 43 100.867 -2.597 -21.761 1.00 0.00 C ATOM 1730 CD1 ILE D 43 102.653 -4.935 -21.634 1.00 0.00 C ATOM 0 H ILE D 43 102.449 -0.710 -19.589 1.00 0.00 H new ATOM 0 HA ILE D 43 103.955 -1.158 -21.868 1.00 0.00 H new ATOM 0 HB ILE D 43 102.381 -2.623 -20.230 1.00 0.00 H new ATOM 0 HG12 ILE D 43 103.102 -3.415 -23.105 1.00 0.00 H new ATOM 0 HG13 ILE D 43 104.218 -3.448 -21.754 1.00 0.00 H new ATOM 0 HG21 ILE D 43 100.500 -3.598 -21.536 1.00 0.00 H new ATOM 0 HG22 ILE D 43 100.260 -1.861 -21.233 1.00 0.00 H new ATOM 0 HG23 ILE D 43 100.801 -2.419 -22.834 1.00 0.00 H new ATOM 0 HD11 ILE D 43 103.244 -5.698 -22.141 1.00 0.00 H new ATOM 0 HD12 ILE D 43 102.741 -5.065 -20.555 1.00 0.00 H new ATOM 0 HD13 ILE D 43 101.608 -5.032 -21.927 1.00 0.00 H new ATOM 1742 N GLY D 44 101.130 0.294 -22.593 1.00 0.00 N ATOM 1743 CA GLY D 44 100.423 0.943 -23.700 1.00 0.00 C ATOM 1744 C GLY D 44 101.387 1.772 -24.537 1.00 0.00 C ATOM 1745 O GLY D 44 101.383 1.697 -25.767 1.00 0.00 O ATOM 0 H GLY D 44 100.717 0.441 -21.672 1.00 0.00 H new ATOM 0 HA2 GLY D 44 99.945 0.189 -24.326 1.00 0.00 H new ATOM 0 HA3 GLY D 44 99.631 1.581 -23.309 1.00 0.00 H new ATOM 1749 N HIS D 45 102.169 2.579 -23.879 1.00 0.00 N ATOM 1750 CA HIS D 45 103.106 3.464 -24.557 1.00 0.00 C ATOM 1751 C HIS D 45 103.826 2.740 -25.692 1.00 0.00 C ATOM 1752 O HIS D 45 104.323 3.374 -26.621 1.00 0.00 O ATOM 1753 CB HIS D 45 104.131 4.000 -23.557 1.00 0.00 C ATOM 1754 CG HIS D 45 105.105 4.909 -24.261 1.00 0.00 C ATOM 1755 ND1 HIS D 45 106.310 4.450 -24.771 1.00 0.00 N ATOM 1756 CD2 HIS D 45 105.068 6.254 -24.543 1.00 0.00 C ATOM 1757 CE1 HIS D 45 106.943 5.501 -25.325 1.00 0.00 C ATOM 1758 NE2 HIS D 45 106.230 6.624 -25.214 1.00 0.00 N ATOM 0 H HIS D 45 102.184 2.651 -22.862 1.00 0.00 H new ATOM 0 HA HIS D 45 102.541 4.293 -24.983 1.00 0.00 H new ATOM 0 HB2 HIS D 45 103.624 4.543 -22.759 1.00 0.00 H new ATOM 0 HB3 HIS D 45 104.665 3.172 -23.090 1.00 0.00 H new ATOM 0 HD2 HIS D 45 104.260 6.922 -24.283 1.00 0.00 H new ATOM 0 HE1 HIS D 45 107.910 5.443 -25.802 1.00 0.00 H new ATOM 0 HE2 HIS D 45 106.483 7.554 -25.549 1.00 0.00 H new ATOM 1767 N LEU D 46 103.913 1.446 -25.617 1.00 0.00 N ATOM 1768 CA LEU D 46 104.611 0.696 -26.651 1.00 0.00 C ATOM 1769 C LEU D 46 104.206 1.147 -28.059 1.00 0.00 C ATOM 1770 O LEU D 46 105.008 1.022 -28.983 1.00 0.00 O ATOM 1771 CB LEU D 46 104.361 -0.827 -26.494 1.00 0.00 C ATOM 1772 CG LEU D 46 103.019 -1.257 -27.162 1.00 0.00 C ATOM 1773 CD1 LEU D 46 103.263 -1.734 -28.615 1.00 0.00 C ATOM 1774 CD2 LEU D 46 102.368 -2.403 -26.354 1.00 0.00 C ATOM 0 H LEU D 46 103.519 0.881 -24.865 1.00 0.00 H new ATOM 0 HA LEU D 46 105.675 0.899 -26.525 1.00 0.00 H new ATOM 0 HB2 LEU D 46 105.186 -1.380 -26.943 1.00 0.00 H new ATOM 0 HB3 LEU D 46 104.341 -1.087 -25.436 1.00 0.00 H new ATOM 0 HG LEU D 46 102.353 -0.394 -27.176 1.00 0.00 H new ATOM 0 HD11 LEU D 46 102.315 -2.030 -29.065 1.00 0.00 H new ATOM 0 HD12 LEU D 46 103.702 -0.923 -29.195 1.00 0.00 H new ATOM 0 HD13 LEU D 46 103.943 -2.586 -28.609 1.00 0.00 H new ATOM 0 HD21 LEU D 46 101.431 -2.696 -26.828 1.00 0.00 H new ATOM 0 HD22 LEU D 46 103.044 -3.258 -26.326 1.00 0.00 H new ATOM 0 HD23 LEU D 46 102.169 -2.064 -25.337 1.00 0.00 H new ATOM 1786 N ASN D 47 103.012 1.671 -28.253 1.00 0.00 N ATOM 1787 CA ASN D 47 102.599 2.125 -29.591 1.00 0.00 C ATOM 1788 C ASN D 47 103.291 3.428 -30.045 1.00 0.00 C ATOM 1789 O ASN D 47 103.464 3.649 -31.244 1.00 0.00 O ATOM 1790 CB ASN D 47 101.087 2.345 -29.608 1.00 0.00 C ATOM 1791 CG ASN D 47 100.374 1.156 -28.972 1.00 0.00 C ATOM 1792 OD1 ASN D 47 100.584 0.015 -29.381 1.00 0.00 O ATOM 1793 ND2 ASN D 47 99.540 1.359 -27.989 1.00 0.00 N ATOM 0 H ASN D 47 102.312 1.797 -27.522 1.00 0.00 H new ATOM 0 HA ASN D 47 102.899 1.342 -30.287 1.00 0.00 H new ATOM 0 HB2 ASN D 47 100.839 3.258 -29.067 1.00 0.00 H new ATOM 0 HB3 ASN D 47 100.743 2.478 -30.634 1.00 0.00 H new ATOM 0 HD21 ASN D 47 99.059 0.570 -27.557 1.00 0.00 H new ATOM 0 HD22 ASN D 47 99.369 2.307 -27.653 1.00 0.00 H new ATOM 1800 N GLN D 48 103.672 4.273 -29.115 1.00 0.00 N ATOM 1801 CA GLN D 48 104.328 5.532 -29.463 1.00 0.00 C ATOM 1802 C GLN D 48 105.664 5.267 -30.146 1.00 0.00 C ATOM 1803 O GLN D 48 105.925 5.767 -31.240 1.00 0.00 O ATOM 1804 CB GLN D 48 104.564 6.383 -28.209 1.00 0.00 C ATOM 1805 CG GLN D 48 103.330 6.348 -27.306 1.00 0.00 C ATOM 1806 CD GLN D 48 102.080 6.694 -28.098 1.00 0.00 C ATOM 1807 OE1 GLN D 48 102.125 7.540 -28.988 1.00 0.00 O ATOM 1808 NE2 GLN D 48 100.961 6.082 -27.820 1.00 0.00 N ATOM 0 H GLN D 48 103.544 4.121 -28.114 1.00 0.00 H new ATOM 0 HA GLN D 48 103.673 6.073 -30.146 1.00 0.00 H new ATOM 0 HB2 GLN D 48 105.432 6.010 -27.665 1.00 0.00 H new ATOM 0 HB3 GLN D 48 104.785 7.411 -28.495 1.00 0.00 H new ATOM 0 HG2 GLN D 48 103.224 5.358 -26.863 1.00 0.00 H new ATOM 0 HG3 GLN D 48 103.454 7.053 -26.484 1.00 0.00 H new ATOM 0 HE21 GLN D 48 100.933 5.381 -27.079 1.00 0.00 H new ATOM 0 HE22 GLN D 48 100.114 6.305 -28.343 1.00 0.00 H new ATOM 1817 N ILE D 49 106.493 4.491 -29.500 1.00 0.00 N ATOM 1818 CA ILE D 49 107.807 4.164 -30.043 1.00 0.00 C ATOM 1819 C ILE D 49 107.705 3.812 -31.525 1.00 0.00 C ATOM 1820 O ILE D 49 107.901 4.667 -32.388 1.00 0.00 O ATOM 1821 CB ILE D 49 108.406 2.989 -29.269 1.00 0.00 C ATOM 1822 CG1 ILE D 49 108.541 3.375 -27.794 1.00 0.00 C ATOM 1823 CG2 ILE D 49 109.785 2.653 -29.838 1.00 0.00 C ATOM 1824 CD1 ILE D 49 108.868 2.131 -26.965 1.00 0.00 C ATOM 0 H ILE D 49 106.291 4.067 -28.594 1.00 0.00 H new ATOM 0 HA ILE D 49 108.454 5.035 -29.939 1.00 0.00 H new ATOM 0 HB ILE D 49 107.756 2.119 -29.362 1.00 0.00 H new ATOM 0 HG12 ILE D 49 109.326 4.121 -27.673 1.00 0.00 H new ATOM 0 HG13 ILE D 49 107.615 3.827 -27.440 1.00 0.00 H new ATOM 0 HG21 ILE D 49 110.212 1.815 -29.286 1.00 0.00 H new ATOM 0 HG22 ILE D 49 109.689 2.383 -30.890 1.00 0.00 H new ATOM 0 HG23 ILE D 49 110.439 3.520 -29.744 1.00 0.00 H new ATOM 0 HD11 ILE D 49 108.964 2.408 -25.915 1.00 0.00 H new ATOM 0 HD12 ILE D 49 108.068 1.399 -27.076 1.00 0.00 H new ATOM 0 HD13 ILE D 49 109.806 1.698 -27.313 1.00 0.00 H new ATOM 1836 N LYS D 50 107.407 2.574 -31.809 1.00 0.00 N ATOM 1837 CA LYS D 50 107.288 2.127 -33.191 1.00 0.00 C ATOM 1838 C LYS D 50 106.405 3.085 -33.987 1.00 0.00 C ATOM 1839 O LYS D 50 106.771 3.519 -35.079 1.00 0.00 O ATOM 1840 CB LYS D 50 106.682 0.719 -33.233 1.00 0.00 C ATOM 1841 CG LYS D 50 106.817 0.121 -34.648 1.00 0.00 C ATOM 1842 CD LYS D 50 108.183 -0.558 -34.809 1.00 0.00 C ATOM 1843 CE LYS D 50 108.250 -1.247 -36.172 1.00 0.00 C ATOM 1844 NZ LYS D 50 109.546 -1.972 -36.297 1.00 0.00 N ATOM 0 H LYS D 50 107.240 1.849 -31.111 1.00 0.00 H new ATOM 0 HA LYS D 50 108.283 2.109 -33.637 1.00 0.00 H new ATOM 0 HB2 LYS D 50 107.185 0.077 -32.510 1.00 0.00 H new ATOM 0 HB3 LYS D 50 105.631 0.759 -32.946 1.00 0.00 H new ATOM 0 HG2 LYS D 50 106.021 -0.602 -34.822 1.00 0.00 H new ATOM 0 HG3 LYS D 50 106.703 0.907 -35.395 1.00 0.00 H new ATOM 0 HD2 LYS D 50 108.981 0.180 -34.723 1.00 0.00 H new ATOM 0 HD3 LYS D 50 108.335 -1.287 -34.013 1.00 0.00 H new ATOM 0 HE2 LYS D 50 107.419 -1.944 -36.281 1.00 0.00 H new ATOM 0 HE3 LYS D 50 108.155 -0.510 -36.969 1.00 0.00 H new ATOM 0 HZ1 LYS D 50 109.593 -2.441 -37.224 1.00 0.00 H new ATOM 0 HZ2 LYS D 50 110.332 -1.296 -36.211 1.00 0.00 H new ATOM 0 HZ3 LYS D 50 109.619 -2.685 -35.544 1.00 0.00 H new ATOM 1858 N ARG D 51 105.263 3.405 -33.440 1.00 0.00 N ATOM 1859 CA ARG D 51 104.334 4.314 -34.106 1.00 0.00 C ATOM 1860 C ARG D 51 103.827 3.695 -35.408 1.00 0.00 C ATOM 1861 O ARG D 51 102.657 3.326 -35.516 1.00 0.00 O ATOM 1862 CB ARG D 51 105.036 5.656 -34.391 1.00 0.00 C ATOM 1863 CG ARG D 51 104.013 6.801 -34.420 1.00 0.00 C ATOM 1864 CD ARG D 51 103.033 6.597 -35.577 1.00 0.00 C ATOM 1865 NE ARG D 51 102.311 7.835 -35.848 1.00 0.00 N ATOM 1866 CZ ARG D 51 102.875 8.818 -36.494 1.00 0.00 C ATOM 1867 NH1 ARG D 51 104.104 8.702 -36.916 1.00 0.00 N ATOM 1868 NH2 ARG D 51 102.210 9.918 -36.719 1.00 0.00 N ATOM 0 H ARG D 51 104.943 3.057 -32.536 1.00 0.00 H new ATOM 0 HA ARG D 51 103.479 4.490 -33.453 1.00 0.00 H new ATOM 0 HB2 ARG D 51 105.787 5.850 -33.625 1.00 0.00 H new ATOM 0 HB3 ARG D 51 105.560 5.604 -35.345 1.00 0.00 H new ATOM 0 HG2 ARG D 51 103.471 6.839 -33.475 1.00 0.00 H new ATOM 0 HG3 ARG D 51 104.527 7.756 -34.531 1.00 0.00 H new ATOM 0 HD2 ARG D 51 103.573 6.279 -36.469 1.00 0.00 H new ATOM 0 HD3 ARG D 51 102.328 5.803 -35.331 1.00 0.00 H new ATOM 0 HE ARG D 51 101.348 7.934 -35.527 1.00 0.00 H new ATOM 0 HH11 ARG D 51 104.624 7.842 -36.741 1.00 0.00 H new ATOM 0 HH12 ARG D 51 104.545 9.471 -37.421 1.00 0.00 H new ATOM 0 HH21 ARG D 51 101.249 10.009 -36.390 1.00 0.00 H new ATOM 0 HH22 ARG D 51 102.651 10.686 -37.224 1.00 0.00 H new ATOM 1882 N GLY D 52 104.697 3.587 -36.374 1.00 0.00 N ATOM 1883 CA GLY D 52 104.326 3.011 -37.663 1.00 0.00 C ATOM 1884 C GLY D 52 103.153 3.766 -38.279 1.00 0.00 C ATOM 0 H GLY D 52 105.670 3.886 -36.306 1.00 0.00 H new ATOM 0 HA2 GLY D 52 105.180 3.043 -38.340 1.00 0.00 H new ATOM 0 HA3 GLY D 52 104.061 1.962 -37.534 1.00 0.00 H new