USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1027 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 48 ASN : amide:sc= -4.05! C(o=-6!,f=-8.4!) USER MOD Set 1.2: A 50 SER OG : rot -69:sc= 0.721 USER MOD Set 1.3: A 111 HIS : no HD1:sc= -2.68 K(o=-6,f=-13!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 4:sc= 0.109 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0144 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0423 K(o=-0.042,f=-0.96!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 125:sc= -0.752 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 59 CYS SG : rot 163:sc= -2.33 USER MOD Single : A 60 GLN : amide:sc= -0.53 K(o=-0.53,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -110:sc= -2.09 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= -0.432 X(o=-0.43,f=-0.037) USER MOD Single : A 72 GLN : amide:sc= 0.357 K(o=0.36,f=-4.1!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.0544 K(o=-0.054,f=-2.7!) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0364 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.798 K(o=-0.8,f=-2.7!) USER MOD Single : A 95 ASN : amide:sc= -4.03! C(o=-4!,f=-5!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.937 USER MOD Single : A 109 TYR OH : rot 180:sc= -0.263 USER MOD Single : A 113 HIS : no HD1:sc= -1.45 K(o=-1.5,f=-0.3) USER MOD Single : A 114 GLN : amide:sc= -2.24 K(o=-2.2,f=-1.5!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -0.287 X(o=-0.29,f=-0.62) USER MOD Single : A 124 ASN : amide:sc= -2.31 K(o=-2.3,f=-8.5!) USER MOD Single : A 129 SER OG : rot -91:sc= 1.19 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=-0.0058) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.936 -28.750 11.949 1.00 0.00 N ATOM 2 CA GLY A 1 -25.841 -27.916 13.133 1.00 0.00 C ATOM 3 C GLY A 1 -24.631 -27.003 13.104 1.00 0.00 C ATOM 4 O GLY A 1 -24.571 -26.066 12.308 1.00 0.00 O ATOM 0 H1 GLY A 1 -26.779 -29.355 12.017 1.00 0.00 H new ATOM 0 H2 GLY A 1 -26.010 -28.147 11.105 1.00 0.00 H new ATOM 0 H3 GLY A 1 -25.087 -29.346 11.875 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.745 -27.313 13.223 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -25.792 -28.551 14.018 1.00 0.00 H new ATOM 8 N SER A 2 -23.664 -27.276 13.975 1.00 0.00 N ATOM 9 CA SER A 2 -22.453 -26.468 14.050 1.00 0.00 C ATOM 10 C SER A 2 -21.225 -27.349 14.263 1.00 0.00 C ATOM 11 O SER A 2 -21.162 -28.123 15.218 1.00 0.00 O ATOM 12 CB SER A 2 -22.564 -25.446 15.182 1.00 0.00 C ATOM 13 OG SER A 2 -23.623 -24.535 14.945 1.00 0.00 O ATOM 0 H SER A 2 -23.696 -28.050 14.638 1.00 0.00 H new ATOM 0 HA SER A 2 -22.340 -25.939 13.104 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.729 -25.963 16.127 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.625 -24.900 15.277 1.00 0.00 H new ATOM 0 HG SER A 2 -23.674 -23.893 15.684 1.00 0.00 H new ATOM 19 N SER A 3 -20.252 -27.225 13.366 1.00 0.00 N ATOM 20 CA SER A 3 -19.027 -28.012 13.453 1.00 0.00 C ATOM 21 C SER A 3 -17.836 -27.224 12.916 1.00 0.00 C ATOM 22 O SER A 3 -17.870 -26.709 11.799 1.00 0.00 O ATOM 23 CB SER A 3 -19.181 -29.320 12.674 1.00 0.00 C ATOM 24 OG SER A 3 -20.070 -30.204 13.334 1.00 0.00 O ATOM 0 H SER A 3 -20.288 -26.587 12.571 1.00 0.00 H new ATOM 0 HA SER A 3 -18.845 -28.241 14.503 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.551 -29.108 11.671 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.207 -29.796 12.560 1.00 0.00 H new ATOM 0 HG SER A 3 -20.452 -29.758 14.119 1.00 0.00 H new ATOM 30 N GLY A 4 -16.783 -27.134 13.722 1.00 0.00 N ATOM 31 CA GLY A 4 -15.595 -26.407 13.312 1.00 0.00 C ATOM 32 C GLY A 4 -14.705 -27.221 12.394 1.00 0.00 C ATOM 33 O GLY A 4 -15.066 -27.492 11.249 1.00 0.00 O ATOM 0 H GLY A 4 -16.731 -27.551 14.651 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.892 -25.489 12.805 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.029 -26.114 14.196 1.00 0.00 H new ATOM 37 N SER A 5 -13.538 -27.612 12.896 1.00 0.00 N ATOM 38 CA SER A 5 -12.592 -28.395 12.111 1.00 0.00 C ATOM 39 C SER A 5 -11.530 -29.024 13.009 1.00 0.00 C ATOM 40 O SER A 5 -11.373 -28.637 14.167 1.00 0.00 O ATOM 41 CB SER A 5 -11.925 -27.516 11.052 1.00 0.00 C ATOM 42 OG SER A 5 -11.188 -28.299 10.129 1.00 0.00 O ATOM 0 H SER A 5 -13.225 -27.399 13.843 1.00 0.00 H new ATOM 0 HA SER A 5 -13.143 -29.194 11.615 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.684 -26.941 10.521 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.262 -26.798 11.536 1.00 0.00 H new ATOM 0 HG SER A 5 -10.773 -27.714 9.462 1.00 0.00 H new ATOM 48 N SER A 6 -10.805 -29.996 12.465 1.00 0.00 N ATOM 49 CA SER A 6 -9.760 -30.681 13.217 1.00 0.00 C ATOM 50 C SER A 6 -8.380 -30.349 12.657 1.00 0.00 C ATOM 51 O SER A 6 -8.036 -30.750 11.546 1.00 0.00 O ATOM 52 CB SER A 6 -9.987 -32.194 13.182 1.00 0.00 C ATOM 53 OG SER A 6 -8.862 -32.890 13.692 1.00 0.00 O ATOM 0 H SER A 6 -10.922 -30.327 11.507 1.00 0.00 H new ATOM 0 HA SER A 6 -9.805 -30.337 14.250 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.871 -32.446 13.768 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.182 -32.512 12.158 1.00 0.00 H new ATOM 0 HG SER A 6 -9.032 -33.855 13.660 1.00 0.00 H new ATOM 59 N GLY A 7 -7.594 -29.613 13.436 1.00 0.00 N ATOM 60 CA GLY A 7 -6.261 -29.239 13.002 1.00 0.00 C ATOM 61 C GLY A 7 -5.728 -28.028 13.743 1.00 0.00 C ATOM 62 O GLY A 7 -6.487 -27.194 14.239 1.00 0.00 O ATOM 0 H GLY A 7 -7.856 -29.269 14.360 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.584 -30.080 13.152 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.276 -29.029 11.933 1.00 0.00 H new ATOM 66 N PRO A 8 -4.394 -27.920 13.828 1.00 0.00 N ATOM 67 CA PRO A 8 -3.732 -26.807 14.513 1.00 0.00 C ATOM 68 C PRO A 8 -3.888 -25.489 13.763 1.00 0.00 C ATOM 69 O PRO A 8 -4.202 -25.458 12.573 1.00 0.00 O ATOM 70 CB PRO A 8 -2.262 -27.233 14.544 1.00 0.00 C ATOM 71 CG PRO A 8 -2.113 -28.162 13.389 1.00 0.00 C ATOM 72 CD PRO A 8 -3.430 -28.877 13.260 1.00 0.00 C ATOM 0 HA PRO A 8 -4.158 -26.625 15.499 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.599 -26.373 14.449 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.012 -27.726 15.484 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -1.875 -27.615 12.477 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.300 -28.868 13.559 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -3.660 -29.111 12.221 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -3.431 -29.820 13.806 1.00 0.00 H new ATOM 80 N PRO A 9 -3.665 -24.373 14.473 1.00 0.00 N ATOM 81 CA PRO A 9 -3.775 -23.031 13.893 1.00 0.00 C ATOM 82 C PRO A 9 -2.659 -22.737 12.896 1.00 0.00 C ATOM 83 O PRO A 9 -1.493 -23.059 13.120 1.00 0.00 O ATOM 84 CB PRO A 9 -3.661 -22.108 15.109 1.00 0.00 C ATOM 85 CG PRO A 9 -2.897 -22.899 16.114 1.00 0.00 C ATOM 86 CD PRO A 9 -3.288 -24.335 15.895 1.00 0.00 C ATOM 0 HA PRO A 9 -4.700 -22.905 13.330 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -3.143 -21.183 14.857 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -4.644 -21.830 15.488 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -1.823 -22.763 15.984 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -3.138 -22.579 17.128 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -2.462 -25.013 16.110 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -4.117 -24.628 16.539 1.00 0.00 H new ATOM 94 N PRO A 10 -3.024 -22.110 11.767 1.00 0.00 N ATOM 95 CA PRO A 10 -2.067 -21.759 10.713 1.00 0.00 C ATOM 96 C PRO A 10 -1.117 -20.645 11.140 1.00 0.00 C ATOM 97 O PRO A 10 -1.117 -20.227 12.298 1.00 0.00 O ATOM 98 CB PRO A 10 -2.963 -21.286 9.565 1.00 0.00 C ATOM 99 CG PRO A 10 -4.212 -20.817 10.227 1.00 0.00 C ATOM 100 CD PRO A 10 -4.397 -21.697 11.433 1.00 0.00 C ATOM 0 HA PRO A 10 -1.422 -22.598 10.452 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.490 -20.484 8.999 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -3.167 -22.095 8.863 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.130 -19.769 10.517 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -5.064 -20.895 9.552 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -4.866 -21.158 12.256 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -5.032 -22.555 11.211 1.00 0.00 H new ATOM 108 N ALA A 11 -0.309 -20.169 10.199 1.00 0.00 N ATOM 109 CA ALA A 11 0.644 -19.103 10.478 1.00 0.00 C ATOM 110 C ALA A 11 0.423 -17.912 9.551 1.00 0.00 C ATOM 111 O ALA A 11 0.882 -17.890 8.409 1.00 0.00 O ATOM 112 CB ALA A 11 2.069 -19.620 10.345 1.00 0.00 C ATOM 0 H ALA A 11 -0.296 -20.505 9.236 1.00 0.00 H new ATOM 0 HA ALA A 11 0.485 -18.767 11.503 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.770 -18.813 10.556 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.228 -20.434 11.053 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.231 -19.985 9.331 1.00 0.00 H new ATOM 118 N PRO A 12 -0.298 -16.898 10.051 1.00 0.00 N ATOM 119 CA PRO A 12 -0.597 -15.685 9.284 1.00 0.00 C ATOM 120 C PRO A 12 0.641 -14.823 9.057 1.00 0.00 C ATOM 121 O PRO A 12 1.754 -15.214 9.409 1.00 0.00 O ATOM 122 CB PRO A 12 -1.608 -14.948 10.165 1.00 0.00 C ATOM 123 CG PRO A 12 -1.328 -15.429 11.547 1.00 0.00 C ATOM 124 CD PRO A 12 -0.877 -16.856 11.405 1.00 0.00 C ATOM 0 HA PRO A 12 -0.970 -15.915 8.286 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -1.485 -13.868 10.089 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -2.632 -15.174 9.867 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -0.558 -14.822 12.023 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -2.219 -15.361 12.172 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -0.142 -17.123 12.165 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.709 -17.553 11.508 1.00 0.00 H new ATOM 132 N ILE A 13 0.438 -13.649 8.468 1.00 0.00 N ATOM 133 CA ILE A 13 1.538 -12.732 8.196 1.00 0.00 C ATOM 134 C ILE A 13 1.355 -11.417 8.947 1.00 0.00 C ATOM 135 O ILE A 13 0.355 -10.716 8.787 1.00 0.00 O ATOM 136 CB ILE A 13 1.666 -12.437 6.690 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.597 -13.737 5.886 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.966 -11.699 6.404 1.00 0.00 C ATOM 139 CD1 ILE A 13 1.156 -13.538 4.453 1.00 0.00 C ATOM 0 H ILE A 13 -0.477 -13.311 8.170 1.00 0.00 H new ATOM 0 HA ILE A 13 2.449 -13.221 8.540 1.00 0.00 H new ATOM 0 HB ILE A 13 0.835 -11.800 6.387 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.578 -14.212 5.893 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.907 -14.423 6.378 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.042 -11.497 5.336 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.978 -10.757 6.953 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.810 -12.313 6.719 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.130 -14.501 3.943 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.162 -13.092 4.437 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.858 -12.877 3.945 1.00 0.00 H new ATOM 151 N PRO A 14 2.344 -11.071 9.784 1.00 0.00 N ATOM 152 CA PRO A 14 2.317 -9.837 10.574 1.00 0.00 C ATOM 153 C PRO A 14 2.481 -8.591 9.710 1.00 0.00 C ATOM 154 O PRO A 14 3.051 -8.651 8.620 1.00 0.00 O ATOM 155 CB PRO A 14 3.511 -9.993 11.519 1.00 0.00 C ATOM 156 CG PRO A 14 4.438 -10.917 10.807 1.00 0.00 C ATOM 157 CD PRO A 14 3.565 -11.858 10.024 1.00 0.00 C ATOM 0 HA PRO A 14 1.365 -9.704 11.087 1.00 0.00 H new ATOM 0 HB2 PRO A 14 3.986 -9.032 11.719 1.00 0.00 H new ATOM 0 HB3 PRO A 14 3.204 -10.404 12.481 1.00 0.00 H new ATOM 0 HG2 PRO A 14 5.108 -10.366 10.147 1.00 0.00 H new ATOM 0 HG3 PRO A 14 5.064 -11.462 11.513 1.00 0.00 H new ATOM 0 HD2 PRO A 14 4.038 -12.161 9.090 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.352 -12.769 10.584 1.00 0.00 H new ATOM 165 N ASP A 15 1.979 -7.464 10.203 1.00 0.00 N ATOM 166 CA ASP A 15 2.072 -6.204 9.476 1.00 0.00 C ATOM 167 C ASP A 15 3.510 -5.928 9.046 1.00 0.00 C ATOM 168 O ASP A 15 4.450 -6.531 9.566 1.00 0.00 O ATOM 169 CB ASP A 15 1.555 -5.052 10.340 1.00 0.00 C ATOM 170 CG ASP A 15 2.539 -4.655 11.423 1.00 0.00 C ATOM 171 OD1 ASP A 15 2.481 -5.244 12.522 1.00 0.00 O ATOM 172 OD2 ASP A 15 3.366 -3.754 11.172 1.00 0.00 O ATOM 0 H ASP A 15 1.504 -7.398 11.103 1.00 0.00 H new ATOM 0 HA ASP A 15 1.454 -6.283 8.582 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.349 -4.190 9.706 1.00 0.00 H new ATOM 0 HB3 ASP A 15 0.610 -5.342 10.800 1.00 0.00 H new ATOM 177 N LEU A 16 3.673 -5.016 8.095 1.00 0.00 N ATOM 178 CA LEU A 16 4.997 -4.661 7.595 1.00 0.00 C ATOM 179 C LEU A 16 5.160 -3.146 7.513 1.00 0.00 C ATOM 180 O LEU A 16 4.337 -2.453 6.915 1.00 0.00 O ATOM 181 CB LEU A 16 5.227 -5.285 6.218 1.00 0.00 C ATOM 182 CG LEU A 16 6.678 -5.613 5.864 1.00 0.00 C ATOM 183 CD1 LEU A 16 6.741 -6.794 4.908 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.368 -4.399 5.259 1.00 0.00 C ATOM 0 H LEU A 16 2.906 -4.509 7.654 1.00 0.00 H new ATOM 0 HA LEU A 16 5.739 -5.050 8.292 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.642 -6.203 6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.835 -4.604 5.463 1.00 0.00 H new ATOM 0 HG LEU A 16 7.202 -5.885 6.781 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.781 -7.012 4.668 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.286 -7.666 5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.201 -6.551 3.993 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.400 -4.652 5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.843 -4.096 4.353 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.356 -3.579 5.977 1.00 0.00 H new ATOM 196 N LYS A 17 6.229 -2.638 8.117 1.00 0.00 N ATOM 197 CA LYS A 17 6.504 -1.206 8.110 1.00 0.00 C ATOM 198 C LYS A 17 7.156 -0.783 6.798 1.00 0.00 C ATOM 199 O LYS A 17 8.176 -1.339 6.392 1.00 0.00 O ATOM 200 CB LYS A 17 7.411 -0.835 9.285 1.00 0.00 C ATOM 201 CG LYS A 17 7.949 0.584 9.214 1.00 0.00 C ATOM 202 CD LYS A 17 8.825 0.910 10.412 1.00 0.00 C ATOM 203 CE LYS A 17 10.197 0.265 10.291 1.00 0.00 C ATOM 204 NZ LYS A 17 11.089 1.026 9.374 1.00 0.00 N ATOM 0 H LYS A 17 6.920 -3.197 8.618 1.00 0.00 H new ATOM 0 HA LYS A 17 5.555 -0.679 8.210 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.856 -0.958 10.215 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.249 -1.531 9.320 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.524 0.710 8.297 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.117 1.287 9.168 1.00 0.00 H new ATOM 0 HD2 LYS A 17 8.936 1.991 10.499 1.00 0.00 H new ATOM 0 HD3 LYS A 17 8.339 0.565 11.324 1.00 0.00 H new ATOM 0 HE2 LYS A 17 10.657 0.203 11.277 1.00 0.00 H new ATOM 0 HE3 LYS A 17 10.087 -0.756 9.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 12.014 0.554 9.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 10.662 1.063 8.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 11.215 1.993 9.735 1.00 0.00 H new ATOM 218 N VAL A 18 6.560 0.205 6.138 1.00 0.00 N ATOM 219 CA VAL A 18 7.084 0.704 4.872 1.00 0.00 C ATOM 220 C VAL A 18 7.454 2.180 4.974 1.00 0.00 C ATOM 221 O VAL A 18 8.391 2.642 4.323 1.00 0.00 O ATOM 222 CB VAL A 18 6.066 0.519 3.731 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.589 -0.924 3.670 1.00 0.00 C ATOM 224 CG2 VAL A 18 4.892 1.471 3.906 1.00 0.00 C ATOM 0 H VAL A 18 5.714 0.676 6.459 1.00 0.00 H new ATOM 0 HA VAL A 18 7.978 0.123 4.649 1.00 0.00 H new ATOM 0 HB VAL A 18 6.557 0.754 2.787 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.870 -1.036 2.858 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.440 -1.582 3.494 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.114 -1.190 4.614 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.182 1.327 3.091 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.399 1.269 4.857 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.253 2.499 3.895 1.00 0.00 H new ATOM 234 N PHE A 19 6.712 2.914 5.796 1.00 0.00 N ATOM 235 CA PHE A 19 6.962 4.339 5.984 1.00 0.00 C ATOM 236 C PHE A 19 6.711 4.749 7.432 1.00 0.00 C ATOM 237 O PHE A 19 5.658 4.455 7.998 1.00 0.00 O ATOM 238 CB PHE A 19 6.073 5.162 5.049 1.00 0.00 C ATOM 239 CG PHE A 19 6.326 6.640 5.128 1.00 0.00 C ATOM 240 CD1 PHE A 19 5.627 7.428 6.028 1.00 0.00 C ATOM 241 CD2 PHE A 19 7.263 7.241 4.303 1.00 0.00 C ATOM 242 CE1 PHE A 19 5.857 8.789 6.103 1.00 0.00 C ATOM 243 CE2 PHE A 19 7.497 8.602 4.374 1.00 0.00 C ATOM 244 CZ PHE A 19 6.794 9.376 5.275 1.00 0.00 C ATOM 0 H PHE A 19 5.933 2.546 6.342 1.00 0.00 H new ATOM 0 HA PHE A 19 8.008 4.533 5.745 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.232 4.829 4.023 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.028 4.967 5.290 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.894 6.974 6.678 1.00 0.00 H new ATOM 0 HD2 PHE A 19 7.817 6.640 3.597 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.305 9.393 6.808 1.00 0.00 H new ATOM 0 HE2 PHE A 19 8.229 9.059 3.725 1.00 0.00 H new ATOM 0 HZ PHE A 19 6.976 10.439 5.333 1.00 0.00 H new ATOM 254 N GLU A 20 7.687 5.428 8.026 1.00 0.00 N ATOM 255 CA GLU A 20 7.573 5.877 9.409 1.00 0.00 C ATOM 256 C GLU A 20 8.013 7.332 9.547 1.00 0.00 C ATOM 257 O GLU A 20 9.174 7.665 9.308 1.00 0.00 O ATOM 258 CB GLU A 20 8.414 4.989 10.328 1.00 0.00 C ATOM 259 CG GLU A 20 8.228 5.292 11.805 1.00 0.00 C ATOM 260 CD GLU A 20 9.176 6.364 12.305 1.00 0.00 C ATOM 261 OE1 GLU A 20 10.403 6.189 12.152 1.00 0.00 O ATOM 262 OE2 GLU A 20 8.691 7.378 12.849 1.00 0.00 O ATOM 0 H GLU A 20 8.565 5.679 7.572 1.00 0.00 H new ATOM 0 HA GLU A 20 6.526 5.803 9.703 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.158 3.946 10.145 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.467 5.109 10.071 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.200 5.611 11.980 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.381 4.380 12.381 1.00 0.00 H new ATOM 269 N ARG A 21 7.077 8.193 9.934 1.00 0.00 N ATOM 270 CA ARG A 21 7.367 9.612 10.102 1.00 0.00 C ATOM 271 C ARG A 21 7.046 10.068 11.522 1.00 0.00 C ATOM 272 O ARG A 21 6.172 9.505 12.181 1.00 0.00 O ATOM 273 CB ARG A 21 6.568 10.440 9.095 1.00 0.00 C ATOM 274 CG ARG A 21 6.916 11.920 9.111 1.00 0.00 C ATOM 275 CD ARG A 21 5.999 12.717 8.197 1.00 0.00 C ATOM 276 NE ARG A 21 6.527 12.809 6.838 1.00 0.00 N ATOM 277 CZ ARG A 21 7.575 13.555 6.506 1.00 0.00 C ATOM 278 NH1 ARG A 21 8.205 14.268 7.429 1.00 0.00 N ATOM 279 NH2 ARG A 21 7.996 13.586 5.248 1.00 0.00 N ATOM 0 H ARG A 21 6.112 7.933 10.137 1.00 0.00 H new ATOM 0 HA ARG A 21 8.431 9.764 9.923 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.742 10.045 8.094 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.505 10.323 9.304 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.839 12.302 10.129 1.00 0.00 H new ATOM 0 HG3 ARG A 21 7.951 12.055 8.797 1.00 0.00 H new ATOM 0 HD2 ARG A 21 5.015 12.249 8.173 1.00 0.00 H new ATOM 0 HD3 ARG A 21 5.865 13.720 8.603 1.00 0.00 H new ATOM 0 HE ARG A 21 6.066 12.271 6.104 1.00 0.00 H new ATOM 0 HH11 ARG A 21 7.885 14.245 8.397 1.00 0.00 H new ATOM 0 HH12 ARG A 21 9.009 14.840 7.171 1.00 0.00 H new ATOM 0 HH21 ARG A 21 7.515 13.037 4.536 1.00 0.00 H new ATOM 0 HH22 ARG A 21 8.801 14.159 4.993 1.00 0.00 H new ATOM 293 N GLU A 22 7.759 11.089 11.986 1.00 0.00 N ATOM 294 CA GLU A 22 7.549 11.619 13.329 1.00 0.00 C ATOM 295 C GLU A 22 6.068 11.877 13.586 1.00 0.00 C ATOM 296 O GLU A 22 5.637 11.993 14.733 1.00 0.00 O ATOM 297 CB GLU A 22 8.344 12.912 13.520 1.00 0.00 C ATOM 298 CG GLU A 22 7.928 14.028 12.577 1.00 0.00 C ATOM 299 CD GLU A 22 8.493 15.376 12.983 1.00 0.00 C ATOM 300 OE1 GLU A 22 7.853 16.063 13.807 1.00 0.00 O ATOM 301 OE2 GLU A 22 9.573 15.744 12.477 1.00 0.00 O ATOM 0 H GLU A 22 8.486 11.566 11.453 1.00 0.00 H new ATOM 0 HA GLU A 22 7.900 10.876 14.045 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.224 13.253 14.548 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.404 12.702 13.375 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.261 13.788 11.567 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.840 14.088 12.549 1.00 0.00 H new ATOM 308 N GLY A 23 5.292 11.967 12.510 1.00 0.00 N ATOM 309 CA GLY A 23 3.868 12.211 12.640 1.00 0.00 C ATOM 310 C GLY A 23 3.035 11.216 11.857 1.00 0.00 C ATOM 311 O GLY A 23 2.049 10.682 12.367 1.00 0.00 O ATOM 0 H GLY A 23 5.625 11.875 11.550 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.589 12.164 13.693 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.642 13.220 12.295 1.00 0.00 H new ATOM 315 N VAL A 24 3.429 10.966 10.612 1.00 0.00 N ATOM 316 CA VAL A 24 2.712 10.029 9.757 1.00 0.00 C ATOM 317 C VAL A 24 3.254 8.613 9.916 1.00 0.00 C ATOM 318 O VAL A 24 4.448 8.418 10.140 1.00 0.00 O ATOM 319 CB VAL A 24 2.804 10.438 8.275 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.122 9.404 7.391 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.195 11.816 8.064 1.00 0.00 C ATOM 0 H VAL A 24 4.241 11.400 10.174 1.00 0.00 H new ATOM 0 HA VAL A 24 1.668 10.052 10.069 1.00 0.00 H new ATOM 0 HB VAL A 24 3.856 10.483 7.994 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.198 9.711 6.348 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.608 8.437 7.521 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.071 9.323 7.670 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.269 12.089 7.011 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.147 11.800 8.362 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.733 12.548 8.667 1.00 0.00 H new ATOM 331 N GLN A 25 2.368 7.629 9.799 1.00 0.00 N ATOM 332 CA GLN A 25 2.759 6.231 9.931 1.00 0.00 C ATOM 333 C GLN A 25 1.976 5.353 8.960 1.00 0.00 C ATOM 334 O GLN A 25 0.744 5.341 8.971 1.00 0.00 O ATOM 335 CB GLN A 25 2.534 5.749 11.366 1.00 0.00 C ATOM 336 CG GLN A 25 3.737 5.956 12.272 1.00 0.00 C ATOM 337 CD GLN A 25 3.352 6.085 13.732 1.00 0.00 C ATOM 338 OE1 GLN A 25 2.495 5.353 14.227 1.00 0.00 O ATOM 339 NE2 GLN A 25 3.987 7.019 14.432 1.00 0.00 N ATOM 0 H GLN A 25 1.376 7.774 9.613 1.00 0.00 H new ATOM 0 HA GLN A 25 3.819 6.153 9.691 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.677 6.275 11.787 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.280 4.689 11.349 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.424 5.118 12.154 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.272 6.853 11.960 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.691 7.604 13.981 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.771 7.151 15.420 1.00 0.00 H new ATOM 348 N LEU A 26 2.698 4.620 8.119 1.00 0.00 N ATOM 349 CA LEU A 26 2.071 3.739 7.140 1.00 0.00 C ATOM 350 C LEU A 26 2.390 2.278 7.440 1.00 0.00 C ATOM 351 O LEU A 26 3.525 1.934 7.765 1.00 0.00 O ATOM 352 CB LEU A 26 2.542 4.096 5.729 1.00 0.00 C ATOM 353 CG LEU A 26 1.639 3.634 4.584 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.362 4.458 4.546 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.375 3.726 3.255 1.00 0.00 C ATOM 0 H LEU A 26 3.718 4.618 8.096 1.00 0.00 H new ATOM 0 HA LEU A 26 0.991 3.876 7.202 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.649 5.179 5.666 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.533 3.668 5.579 1.00 0.00 H new ATOM 0 HG LEU A 26 1.370 2.592 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.268 4.115 3.725 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.174 4.342 5.488 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.611 5.509 4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 26 1.718 3.394 2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.674 4.759 3.075 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.261 3.092 3.285 1.00 0.00 H new ATOM 367 N ASN A 27 1.379 1.422 7.327 1.00 0.00 N ATOM 368 CA ASN A 27 1.552 -0.003 7.584 1.00 0.00 C ATOM 369 C ASN A 27 1.084 -0.832 6.392 1.00 0.00 C ATOM 370 O ASN A 27 0.187 -0.425 5.653 1.00 0.00 O ATOM 371 CB ASN A 27 0.779 -0.413 8.839 1.00 0.00 C ATOM 372 CG ASN A 27 1.400 0.139 10.107 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.208 -0.526 10.757 1.00 0.00 O ATOM 374 ND2 ASN A 27 1.026 1.362 10.466 1.00 0.00 N ATOM 0 H ASN A 27 0.432 1.690 7.059 1.00 0.00 H new ATOM 0 HA ASN A 27 2.614 -0.192 7.741 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.250 -0.062 8.759 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.741 -1.501 8.900 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.411 1.786 11.310 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.354 1.877 9.898 1.00 0.00 H new ATOM 381 N LEU A 28 1.698 -1.996 6.210 1.00 0.00 N ATOM 382 CA LEU A 28 1.344 -2.884 5.108 1.00 0.00 C ATOM 383 C LEU A 28 0.764 -4.194 5.629 1.00 0.00 C ATOM 384 O LEU A 28 1.328 -4.823 6.525 1.00 0.00 O ATOM 385 CB LEU A 28 2.573 -3.166 4.241 1.00 0.00 C ATOM 386 CG LEU A 28 2.298 -3.480 2.770 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.602 -3.611 1.999 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.471 -4.751 2.642 1.00 0.00 C ATOM 0 H LEU A 28 2.443 -2.347 6.811 1.00 0.00 H new ATOM 0 HA LEU A 28 0.585 -2.388 4.503 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.234 -2.300 4.290 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.115 -4.006 4.676 1.00 0.00 H new ATOM 0 HG LEU A 28 1.729 -2.655 2.343 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.386 -3.835 0.954 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.158 -2.676 2.063 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.198 -4.417 2.427 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.285 -4.959 1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.014 -5.585 3.086 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.521 -4.620 3.160 1.00 0.00 H new ATOM 400 N SER A 29 -0.366 -4.602 5.060 1.00 0.00 N ATOM 401 CA SER A 29 -1.025 -5.838 5.468 1.00 0.00 C ATOM 402 C SER A 29 -1.275 -6.743 4.266 1.00 0.00 C ATOM 403 O SER A 29 -1.865 -6.323 3.270 1.00 0.00 O ATOM 404 CB SER A 29 -2.348 -5.527 6.171 1.00 0.00 C ATOM 405 OG SER A 29 -2.677 -6.538 7.108 1.00 0.00 O ATOM 0 H SER A 29 -0.844 -4.095 4.315 1.00 0.00 H new ATOM 0 HA SER A 29 -0.367 -6.360 6.162 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.276 -4.565 6.679 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.144 -5.439 5.432 1.00 0.00 H new ATOM 0 HG SER A 29 -3.525 -6.315 7.545 1.00 0.00 H new ATOM 411 N PHE A 30 -0.822 -7.988 4.366 1.00 0.00 N ATOM 412 CA PHE A 30 -0.995 -8.954 3.287 1.00 0.00 C ATOM 413 C PHE A 30 -2.113 -9.940 3.614 1.00 0.00 C ATOM 414 O PHE A 30 -2.148 -10.516 4.701 1.00 0.00 O ATOM 415 CB PHE A 30 0.311 -9.711 3.038 1.00 0.00 C ATOM 416 CG PHE A 30 1.494 -8.810 2.823 1.00 0.00 C ATOM 417 CD1 PHE A 30 2.147 -8.234 3.900 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.953 -8.541 1.544 1.00 0.00 C ATOM 419 CE1 PHE A 30 3.236 -7.405 3.707 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.042 -7.713 1.344 1.00 0.00 C ATOM 421 CZ PHE A 30 3.683 -7.144 2.426 1.00 0.00 C ATOM 0 H PHE A 30 -0.332 -8.352 5.183 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.268 -8.408 2.384 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.511 -10.364 3.888 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.189 -10.352 2.165 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.801 -8.435 4.903 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.455 -8.983 0.694 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.736 -6.962 4.556 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.391 -7.512 0.342 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.533 -6.496 2.271 1.00 0.00 H new ATOM 431 N ILE A 31 -3.024 -10.127 2.665 1.00 0.00 N ATOM 432 CA ILE A 31 -4.143 -11.043 2.851 1.00 0.00 C ATOM 433 C ILE A 31 -4.128 -12.149 1.802 1.00 0.00 C ATOM 434 O ILE A 31 -4.002 -11.883 0.607 1.00 0.00 O ATOM 435 CB ILE A 31 -5.492 -10.304 2.783 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.717 -9.487 4.057 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.628 -11.295 2.576 1.00 0.00 C ATOM 438 CD1 ILE A 31 -4.752 -8.332 4.211 1.00 0.00 C ATOM 0 H ILE A 31 -3.009 -9.657 1.760 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.029 -11.484 3.841 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.472 -9.620 1.935 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.736 -9.101 4.056 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.626 -10.144 4.922 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.575 -10.758 2.530 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.472 -11.837 1.643 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.651 -12.001 3.406 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.970 -7.797 5.135 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.731 -8.713 4.244 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.859 -7.653 3.365 1.00 0.00 H new ATOM 450 N ARG A 32 -4.258 -13.391 2.258 1.00 0.00 N ATOM 451 CA ARG A 32 -4.260 -14.538 1.358 1.00 0.00 C ATOM 452 C ARG A 32 -5.563 -15.324 1.482 1.00 0.00 C ATOM 453 O ARG A 32 -5.715 -16.189 2.344 1.00 0.00 O ATOM 454 CB ARG A 32 -3.071 -15.452 1.660 1.00 0.00 C ATOM 455 CG ARG A 32 -1.728 -14.849 1.279 1.00 0.00 C ATOM 456 CD ARG A 32 -1.358 -15.177 -0.158 1.00 0.00 C ATOM 457 NE ARG A 32 -0.887 -16.552 -0.303 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.309 -17.019 -1.404 1.00 0.00 C ATOM 459 NH1 ARG A 32 -0.131 -16.226 -2.451 1.00 0.00 N ATOM 460 NH2 ARG A 32 0.093 -18.282 -1.459 1.00 0.00 N ATOM 0 H ARG A 32 -4.363 -13.628 3.244 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.175 -14.167 0.337 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.065 -15.687 2.724 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.202 -16.393 1.126 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.764 -13.767 1.409 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -0.956 -15.225 1.950 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.225 -15.022 -0.800 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.583 -14.491 -0.498 1.00 0.00 H new ATOM 0 HE ARG A 32 -1.009 -17.189 0.485 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -0.438 -15.254 -2.413 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.313 -16.588 -3.295 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -0.042 -18.896 -0.655 1.00 0.00 H new ATOM 0 HH22 ARG A 32 0.537 -18.640 -2.305 1.00 0.00 H new ATOM 474 N PRO A 33 -6.526 -15.015 0.601 1.00 0.00 N ATOM 475 CA PRO A 33 -7.832 -15.680 0.591 1.00 0.00 C ATOM 476 C PRO A 33 -7.740 -17.132 0.131 1.00 0.00 C ATOM 477 O PRO A 33 -6.913 -17.491 -0.706 1.00 0.00 O ATOM 478 CB PRO A 33 -8.644 -14.853 -0.409 1.00 0.00 C ATOM 479 CG PRO A 33 -7.626 -14.241 -1.308 1.00 0.00 C ATOM 480 CD PRO A 33 -6.414 -13.994 -0.454 1.00 0.00 C ATOM 0 HA PRO A 33 -8.274 -15.725 1.586 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.340 -15.479 -0.967 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.236 -14.090 0.096 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.389 -14.906 -2.139 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -7.995 -13.311 -1.740 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.492 -14.105 -1.024 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.413 -12.986 -0.039 1.00 0.00 H new ATOM 488 N PRO A 34 -8.610 -17.986 0.690 1.00 0.00 N ATOM 489 CA PRO A 34 -8.647 -19.412 0.352 1.00 0.00 C ATOM 490 C PRO A 34 -9.162 -19.659 -1.062 1.00 0.00 C ATOM 491 O PRO A 34 -8.627 -20.494 -1.790 1.00 0.00 O ATOM 492 CB PRO A 34 -9.615 -19.997 1.383 1.00 0.00 C ATOM 493 CG PRO A 34 -10.488 -18.855 1.773 1.00 0.00 C ATOM 494 CD PRO A 34 -9.624 -17.627 1.695 1.00 0.00 C ATOM 0 HA PRO A 34 -7.655 -19.862 0.376 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.198 -20.815 0.959 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.081 -20.399 2.244 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.345 -18.772 1.104 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.882 -18.991 2.780 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.197 -16.751 1.392 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.170 -17.393 2.658 1.00 0.00 H new ATOM 502 N GLU A 35 -10.204 -18.926 -1.444 1.00 0.00 N ATOM 503 CA GLU A 35 -10.791 -19.067 -2.771 1.00 0.00 C ATOM 504 C GLU A 35 -9.741 -18.849 -3.856 1.00 0.00 C ATOM 505 O GLU A 35 -9.701 -19.572 -4.851 1.00 0.00 O ATOM 506 CB GLU A 35 -11.941 -18.075 -2.952 1.00 0.00 C ATOM 507 CG GLU A 35 -11.526 -16.623 -2.778 1.00 0.00 C ATOM 508 CD GLU A 35 -12.647 -15.653 -3.100 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.414 -15.926 -4.046 1.00 0.00 O ATOM 510 OE2 GLU A 35 -12.755 -14.621 -2.405 1.00 0.00 O ATOM 0 H GLU A 35 -10.658 -18.229 -0.853 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.178 -20.082 -2.863 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.369 -18.205 -3.946 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.727 -18.308 -2.234 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.197 -16.464 -1.751 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.673 -16.413 -3.423 1.00 0.00 H new ATOM 517 N ASN A 36 -8.892 -17.846 -3.657 1.00 0.00 N ATOM 518 CA ASN A 36 -7.842 -17.530 -4.619 1.00 0.00 C ATOM 519 C ASN A 36 -6.486 -17.424 -3.928 1.00 0.00 C ATOM 520 O ASN A 36 -6.129 -16.391 -3.361 1.00 0.00 O ATOM 521 CB ASN A 36 -8.161 -16.222 -5.344 1.00 0.00 C ATOM 522 CG ASN A 36 -9.030 -16.436 -6.569 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.637 -17.494 -6.735 1.00 0.00 O ATOM 524 ND2 ASN A 36 -9.092 -15.430 -7.434 1.00 0.00 N ATOM 0 H ASN A 36 -8.910 -17.238 -2.838 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.797 -18.339 -5.348 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.667 -15.543 -4.657 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.231 -15.739 -5.642 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.660 -15.516 -8.277 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.572 -14.571 -7.255 1.00 0.00 H new ATOM 531 N PRO A 37 -5.710 -18.517 -3.976 1.00 0.00 N ATOM 532 CA PRO A 37 -4.380 -18.572 -3.361 1.00 0.00 C ATOM 533 C PRO A 37 -3.366 -17.700 -4.094 1.00 0.00 C ATOM 534 O PRO A 37 -2.477 -17.114 -3.478 1.00 0.00 O ATOM 535 CB PRO A 37 -3.997 -20.049 -3.475 1.00 0.00 C ATOM 536 CG PRO A 37 -4.780 -20.555 -4.637 1.00 0.00 C ATOM 537 CD PRO A 37 -6.071 -19.784 -4.634 1.00 0.00 C ATOM 0 HA PRO A 37 -4.389 -18.198 -2.337 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.926 -20.169 -3.637 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.244 -20.594 -2.564 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.237 -20.403 -5.570 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.965 -21.625 -4.547 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.443 -19.620 -5.645 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -6.853 -20.312 -4.088 1.00 0.00 H new ATOM 545 N ALA A 38 -3.507 -17.619 -5.413 1.00 0.00 N ATOM 546 CA ALA A 38 -2.604 -16.817 -6.230 1.00 0.00 C ATOM 547 C ALA A 38 -2.948 -15.334 -6.133 1.00 0.00 C ATOM 548 O ALA A 38 -2.250 -14.487 -6.691 1.00 0.00 O ATOM 549 CB ALA A 38 -2.653 -17.278 -7.679 1.00 0.00 C ATOM 0 H ALA A 38 -4.238 -18.099 -5.939 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.591 -16.955 -5.851 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.974 -16.670 -8.277 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.352 -18.324 -7.738 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.668 -17.170 -8.061 1.00 0.00 H new ATOM 555 N LEU A 39 -4.027 -15.027 -5.421 1.00 0.00 N ATOM 556 CA LEU A 39 -4.464 -13.646 -5.252 1.00 0.00 C ATOM 557 C LEU A 39 -3.903 -13.052 -3.964 1.00 0.00 C ATOM 558 O LEU A 39 -4.022 -13.644 -2.890 1.00 0.00 O ATOM 559 CB LEU A 39 -5.992 -13.571 -5.238 1.00 0.00 C ATOM 560 CG LEU A 39 -6.594 -12.168 -5.158 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.473 -11.458 -6.498 1.00 0.00 C ATOM 562 CD2 LEU A 39 -8.050 -12.238 -4.719 1.00 0.00 C ATOM 0 H LEU A 39 -4.615 -15.716 -4.952 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.086 -13.066 -6.094 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.368 -14.055 -6.139 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.357 -14.150 -4.390 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.038 -11.596 -4.416 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.907 -10.461 -6.422 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.421 -11.376 -6.773 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.004 -12.027 -7.261 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.463 -11.231 -4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.619 -12.827 -5.438 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.112 -12.706 -3.737 1.00 0.00 H new ATOM 574 N LEU A 40 -3.293 -11.877 -4.077 1.00 0.00 N ATOM 575 CA LEU A 40 -2.715 -11.200 -2.921 1.00 0.00 C ATOM 576 C LEU A 40 -3.359 -9.833 -2.712 1.00 0.00 C ATOM 577 O LEU A 40 -3.075 -8.883 -3.443 1.00 0.00 O ATOM 578 CB LEU A 40 -1.204 -11.043 -3.100 1.00 0.00 C ATOM 579 CG LEU A 40 -0.453 -10.404 -1.931 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.316 -11.391 -0.782 1.00 0.00 C ATOM 581 CD2 LEU A 40 0.915 -9.914 -2.381 1.00 0.00 C ATOM 0 H LEU A 40 -3.186 -11.373 -4.957 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.909 -11.811 -2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.776 -12.028 -3.286 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.024 -10.444 -3.993 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.027 -9.546 -1.580 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.221 -10.919 0.041 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.306 -11.694 -0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.236 -12.268 -1.120 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.436 -9.462 -1.537 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.497 -10.755 -2.758 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.794 -9.173 -3.171 1.00 0.00 H new ATOM 593 N LEU A 41 -4.226 -9.740 -1.709 1.00 0.00 N ATOM 594 CA LEU A 41 -4.909 -8.488 -1.402 1.00 0.00 C ATOM 595 C LEU A 41 -4.107 -7.662 -0.401 1.00 0.00 C ATOM 596 O LEU A 41 -4.092 -7.961 0.793 1.00 0.00 O ATOM 597 CB LEU A 41 -6.306 -8.770 -0.846 1.00 0.00 C ATOM 598 CG LEU A 41 -7.211 -9.642 -1.716 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.417 -10.118 -0.922 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.654 -8.880 -2.957 1.00 0.00 C ATOM 0 H LEU A 41 -4.472 -10.516 -1.095 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.001 -7.916 -2.325 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.198 -9.250 0.126 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.807 -7.817 -0.677 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.643 -10.516 -2.035 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.050 -10.737 -1.558 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.081 -10.702 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.986 -9.256 -0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.297 -9.516 -3.564 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.204 -7.987 -2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.778 -8.590 -3.538 1.00 0.00 H new ATOM 612 N ILE A 42 -3.445 -6.622 -0.896 1.00 0.00 N ATOM 613 CA ILE A 42 -2.645 -5.751 -0.044 1.00 0.00 C ATOM 614 C ILE A 42 -3.466 -4.568 0.459 1.00 0.00 C ATOM 615 O ILE A 42 -4.339 -4.060 -0.245 1.00 0.00 O ATOM 616 CB ILE A 42 -1.404 -5.222 -0.788 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.384 -6.345 -0.987 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.782 -4.064 -0.022 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.655 -6.037 -2.043 1.00 0.00 C ATOM 0 H ILE A 42 -3.447 -6.362 -1.882 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.321 -6.352 0.806 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.713 -4.860 -1.769 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.119 -6.540 -0.040 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.911 -7.259 -1.262 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.094 -3.701 -0.560 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.510 -3.258 0.073 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.484 -4.403 0.970 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.345 -6.876 -2.131 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.162 -5.871 -3.001 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.208 -5.141 -1.759 1.00 0.00 H new ATOM 631 N THR A 43 -3.178 -4.133 1.681 1.00 0.00 N ATOM 632 CA THR A 43 -3.889 -3.009 2.279 1.00 0.00 C ATOM 633 C THR A 43 -2.915 -1.969 2.821 1.00 0.00 C ATOM 634 O THR A 43 -1.770 -2.285 3.143 1.00 0.00 O ATOM 635 CB THR A 43 -4.815 -3.472 3.419 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.658 -4.536 2.964 1.00 0.00 O ATOM 637 CG2 THR A 43 -5.671 -2.320 3.923 1.00 0.00 C ATOM 0 H THR A 43 -2.458 -4.541 2.276 1.00 0.00 H new ATOM 0 HA THR A 43 -4.493 -2.561 1.490 1.00 0.00 H new ATOM 0 HB THR A 43 -4.193 -3.828 4.240 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.242 -4.826 3.695 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.317 -2.671 4.728 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.027 -1.524 4.296 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.284 -1.938 3.107 1.00 0.00 H new ATOM 645 N ILE A 44 -3.378 -0.727 2.919 1.00 0.00 N ATOM 646 CA ILE A 44 -2.548 0.359 3.424 1.00 0.00 C ATOM 647 C ILE A 44 -3.247 1.105 4.556 1.00 0.00 C ATOM 648 O ILE A 44 -4.459 1.317 4.520 1.00 0.00 O ATOM 649 CB ILE A 44 -2.191 1.360 2.310 1.00 0.00 C ATOM 650 CG1 ILE A 44 -2.038 0.633 0.972 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.915 2.110 2.660 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.674 1.550 -0.175 1.00 0.00 C ATOM 0 H ILE A 44 -4.323 -0.448 2.655 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.632 -0.095 3.802 1.00 0.00 H new ATOM 0 HB ILE A 44 -3.001 2.084 2.219 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.271 -0.135 1.070 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.972 0.122 0.736 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.676 2.814 1.863 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -1.057 2.654 3.594 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -0.096 1.400 2.775 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.582 0.967 -1.092 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.452 2.303 -0.300 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.725 2.042 0.039 1.00 0.00 H new ATOM 664 N THR A 45 -2.473 1.502 5.562 1.00 0.00 N ATOM 665 CA THR A 45 -3.017 2.225 6.705 1.00 0.00 C ATOM 666 C THR A 45 -2.167 3.445 7.039 1.00 0.00 C ATOM 667 O THR A 45 -1.187 3.347 7.778 1.00 0.00 O ATOM 668 CB THR A 45 -3.110 1.321 7.949 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.922 0.177 7.664 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.694 2.083 9.129 1.00 0.00 C ATOM 0 H THR A 45 -1.468 1.335 5.608 1.00 0.00 H new ATOM 0 HA THR A 45 -4.019 2.550 6.426 1.00 0.00 H new ATOM 0 HB THR A 45 -2.103 0.995 8.210 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.975 -0.393 8.459 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.750 1.424 9.996 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.057 2.936 9.362 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.694 2.435 8.876 1.00 0.00 H new ATOM 678 N ALA A 46 -2.548 4.594 6.492 1.00 0.00 N ATOM 679 CA ALA A 46 -1.821 5.834 6.735 1.00 0.00 C ATOM 680 C ALA A 46 -2.429 6.607 7.900 1.00 0.00 C ATOM 681 O ALA A 46 -3.543 7.122 7.804 1.00 0.00 O ATOM 682 CB ALA A 46 -1.808 6.693 5.479 1.00 0.00 C ATOM 0 H ALA A 46 -3.356 4.692 5.877 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.794 5.579 6.998 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.262 7.616 5.675 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.321 6.148 4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.832 6.932 5.191 1.00 0.00 H new ATOM 688 N THR A 47 -1.690 6.685 9.003 1.00 0.00 N ATOM 689 CA THR A 47 -2.157 7.394 10.187 1.00 0.00 C ATOM 690 C THR A 47 -1.409 8.709 10.371 1.00 0.00 C ATOM 691 O THR A 47 -0.206 8.790 10.128 1.00 0.00 O ATOM 692 CB THR A 47 -1.987 6.538 11.457 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.599 6.271 11.686 1.00 0.00 O ATOM 694 CG2 THR A 47 -2.747 5.226 11.331 1.00 0.00 C ATOM 0 H THR A 47 -0.765 6.265 9.100 1.00 0.00 H new ATOM 0 HA THR A 47 -3.216 7.600 10.035 1.00 0.00 H new ATOM 0 HB THR A 47 -2.393 7.095 12.301 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.355 6.561 12.590 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.612 4.639 12.239 1.00 0.00 H new ATOM 0 HG22 THR A 47 -3.807 5.432 11.186 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.367 4.666 10.477 1.00 0.00 H new ATOM 702 N ASN A 48 -2.130 9.739 10.803 1.00 0.00 N ATOM 703 CA ASN A 48 -1.534 11.052 11.020 1.00 0.00 C ATOM 704 C ASN A 48 -1.782 11.533 12.446 1.00 0.00 C ATOM 705 O ASN A 48 -2.926 11.631 12.890 1.00 0.00 O ATOM 706 CB ASN A 48 -2.103 12.064 10.023 1.00 0.00 C ATOM 707 CG ASN A 48 -1.426 13.418 10.124 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.404 13.565 10.794 1.00 0.00 O ATOM 709 ND2 ASN A 48 -1.996 14.415 9.457 1.00 0.00 N ATOM 0 H ASN A 48 -3.128 9.689 11.010 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.458 10.965 10.866 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.987 11.677 9.011 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.172 12.181 10.199 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -1.587 15.349 9.487 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -2.843 14.247 8.914 1.00 0.00 H new ATOM 716 N PHE A 49 -0.701 11.833 13.160 1.00 0.00 N ATOM 717 CA PHE A 49 -0.801 12.303 14.536 1.00 0.00 C ATOM 718 C PHE A 49 -0.306 13.742 14.656 1.00 0.00 C ATOM 719 O PHE A 49 -0.701 14.472 15.566 1.00 0.00 O ATOM 720 CB PHE A 49 0.006 11.395 15.468 1.00 0.00 C ATOM 721 CG PHE A 49 -0.503 9.983 15.515 1.00 0.00 C ATOM 722 CD1 PHE A 49 -1.765 9.703 16.013 1.00 0.00 C ATOM 723 CD2 PHE A 49 0.281 8.935 15.062 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.235 8.404 16.059 1.00 0.00 C ATOM 725 CE2 PHE A 49 -0.183 7.633 15.104 1.00 0.00 C ATOM 726 CZ PHE A 49 -1.443 7.368 15.603 1.00 0.00 C ATOM 0 H PHE A 49 0.253 11.759 12.808 1.00 0.00 H new ATOM 0 HA PHE A 49 -1.850 12.272 14.829 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.047 11.387 15.144 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.011 11.813 16.475 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.389 10.509 16.370 1.00 0.00 H new ATOM 0 HD2 PHE A 49 1.267 9.137 14.671 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.220 8.199 16.451 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.439 6.825 14.747 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.809 6.352 15.637 1.00 0.00 H new ATOM 736 N SER A 50 0.562 14.142 13.732 1.00 0.00 N ATOM 737 CA SER A 50 1.115 15.491 13.736 1.00 0.00 C ATOM 738 C SER A 50 0.015 16.528 13.939 1.00 0.00 C ATOM 739 O SER A 50 -1.171 16.203 13.913 1.00 0.00 O ATOM 740 CB SER A 50 1.855 15.765 12.426 1.00 0.00 C ATOM 741 OG SER A 50 0.945 16.012 11.368 1.00 0.00 O ATOM 0 H SER A 50 0.897 13.551 12.971 1.00 0.00 H new ATOM 0 HA SER A 50 1.819 15.567 14.565 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.515 16.624 12.550 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.486 14.912 12.176 1.00 0.00 H new ATOM 0 HG SER A 50 0.467 15.185 11.148 1.00 0.00 H new ATOM 747 N GLU A 51 0.419 17.779 14.142 1.00 0.00 N ATOM 748 CA GLU A 51 -0.532 18.864 14.350 1.00 0.00 C ATOM 749 C GLU A 51 -0.957 19.478 13.019 1.00 0.00 C ATOM 750 O GLU A 51 -1.394 20.626 12.965 1.00 0.00 O ATOM 751 CB GLU A 51 0.079 19.941 15.250 1.00 0.00 C ATOM 752 CG GLU A 51 1.366 20.533 14.702 1.00 0.00 C ATOM 753 CD GLU A 51 1.722 21.856 15.352 1.00 0.00 C ATOM 754 OE1 GLU A 51 1.931 21.876 16.583 1.00 0.00 O ATOM 755 OE2 GLU A 51 1.793 22.872 14.628 1.00 0.00 O ATOM 0 H GLU A 51 1.398 18.065 14.167 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.415 18.451 14.838 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.648 20.741 15.390 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.275 19.513 16.233 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.181 19.826 14.856 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.267 20.676 13.626 1.00 0.00 H new ATOM 762 N GLY A 52 -0.824 18.703 11.947 1.00 0.00 N ATOM 763 CA GLY A 52 -1.197 19.187 10.631 1.00 0.00 C ATOM 764 C GLY A 52 -2.037 18.186 9.862 1.00 0.00 C ATOM 765 O GLY A 52 -1.508 17.241 9.276 1.00 0.00 O ATOM 0 H GLY A 52 -0.465 17.749 11.967 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.752 20.119 10.734 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.296 19.414 10.062 1.00 0.00 H new ATOM 769 N ASP A 53 -3.350 18.392 9.865 1.00 0.00 N ATOM 770 CA ASP A 53 -4.265 17.500 9.163 1.00 0.00 C ATOM 771 C ASP A 53 -3.880 17.374 7.692 1.00 0.00 C ATOM 772 O ASP A 53 -3.693 18.375 7.001 1.00 0.00 O ATOM 773 CB ASP A 53 -5.702 18.009 9.285 1.00 0.00 C ATOM 774 CG ASP A 53 -6.215 17.958 10.711 1.00 0.00 C ATOM 775 OD1 ASP A 53 -5.961 18.918 11.468 1.00 0.00 O ATOM 776 OD2 ASP A 53 -6.872 16.958 11.069 1.00 0.00 O ATOM 0 H ASP A 53 -3.804 19.169 10.346 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.197 16.514 9.624 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.753 19.035 8.920 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -6.352 17.411 8.647 1.00 0.00 H new ATOM 781 N VAL A 54 -3.762 16.137 7.220 1.00 0.00 N ATOM 782 CA VAL A 54 -3.399 15.880 5.832 1.00 0.00 C ATOM 783 C VAL A 54 -4.638 15.793 4.947 1.00 0.00 C ATOM 784 O VAL A 54 -5.705 15.373 5.394 1.00 0.00 O ATOM 785 CB VAL A 54 -2.591 14.576 5.695 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.179 14.352 4.247 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.373 14.606 6.605 1.00 0.00 C ATOM 0 H VAL A 54 -3.913 15.297 7.779 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.781 16.717 5.506 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.224 13.743 6.001 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.609 13.426 4.170 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.069 14.283 3.622 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.563 15.186 3.911 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.814 13.677 6.495 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.736 15.447 6.332 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.695 14.715 7.641 1.00 0.00 H new ATOM 797 N THR A 55 -4.488 16.192 3.688 1.00 0.00 N ATOM 798 CA THR A 55 -5.595 16.160 2.740 1.00 0.00 C ATOM 799 C THR A 55 -5.099 15.880 1.326 1.00 0.00 C ATOM 800 O THR A 55 -3.905 15.988 1.043 1.00 0.00 O ATOM 801 CB THR A 55 -6.377 17.487 2.744 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.503 18.572 2.412 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.011 17.737 4.104 1.00 0.00 C ATOM 0 H THR A 55 -3.611 16.541 3.301 1.00 0.00 H new ATOM 0 HA THR A 55 -6.259 15.355 3.056 1.00 0.00 H new ATOM 0 HB THR A 55 -7.169 17.419 1.999 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.008 19.412 2.415 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.558 18.680 4.083 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.698 16.924 4.340 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.232 17.786 4.865 1.00 0.00 H new ATOM 811 N HIS A 56 -6.022 15.522 0.439 1.00 0.00 N ATOM 812 CA HIS A 56 -5.678 15.228 -0.947 1.00 0.00 C ATOM 813 C HIS A 56 -4.544 14.211 -1.022 1.00 0.00 C ATOM 814 O HIS A 56 -3.674 14.298 -1.888 1.00 0.00 O ATOM 815 CB HIS A 56 -5.278 16.510 -1.678 1.00 0.00 C ATOM 816 CG HIS A 56 -6.439 17.251 -2.267 1.00 0.00 C ATOM 817 ND1 HIS A 56 -6.720 17.261 -3.617 1.00 0.00 N ATOM 818 CD2 HIS A 56 -7.395 18.009 -1.680 1.00 0.00 C ATOM 819 CE1 HIS A 56 -7.796 17.995 -3.835 1.00 0.00 C ATOM 820 NE2 HIS A 56 -8.226 18.460 -2.676 1.00 0.00 N ATOM 0 H HIS A 56 -7.014 15.429 0.656 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.557 14.802 -1.431 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.754 17.166 -0.983 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.575 16.261 -2.473 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.487 18.220 -0.625 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -8.248 18.183 -4.798 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -9.042 19.057 -2.542 1.00 0.00 H new ATOM 828 N PHE A 57 -4.559 13.247 -0.107 1.00 0.00 N ATOM 829 CA PHE A 57 -3.530 12.214 -0.068 1.00 0.00 C ATOM 830 C PHE A 57 -3.592 11.337 -1.315 1.00 0.00 C ATOM 831 O PHE A 57 -4.673 10.957 -1.766 1.00 0.00 O ATOM 832 CB PHE A 57 -3.692 11.350 1.185 1.00 0.00 C ATOM 833 CG PHE A 57 -2.990 10.026 1.095 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.619 9.965 0.906 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.702 8.841 1.198 1.00 0.00 C ATOM 836 CE1 PHE A 57 -0.969 8.747 0.823 1.00 0.00 C ATOM 837 CE2 PHE A 57 -3.058 7.621 1.116 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.690 7.574 0.927 1.00 0.00 C ATOM 0 H PHE A 57 -5.272 13.160 0.617 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.558 12.706 -0.039 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -3.309 11.898 2.046 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.753 11.178 1.363 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.051 10.880 0.822 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.772 8.872 1.344 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.101 8.713 0.677 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.624 6.705 1.200 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.186 6.621 0.861 1.00 0.00 H new ATOM 848 N ILE A 58 -2.426 11.021 -1.867 1.00 0.00 N ATOM 849 CA ILE A 58 -2.347 10.190 -3.061 1.00 0.00 C ATOM 850 C ILE A 58 -1.525 8.932 -2.802 1.00 0.00 C ATOM 851 O ILE A 58 -0.378 9.007 -2.359 1.00 0.00 O ATOM 852 CB ILE A 58 -1.727 10.959 -4.243 1.00 0.00 C ATOM 853 CG1 ILE A 58 -2.512 12.245 -4.510 1.00 0.00 C ATOM 854 CG2 ILE A 58 -1.696 10.083 -5.487 1.00 0.00 C ATOM 855 CD1 ILE A 58 -4.012 12.048 -4.512 1.00 0.00 C ATOM 0 H ILE A 58 -1.523 11.328 -1.506 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.368 9.908 -3.317 1.00 0.00 H new ATOM 0 HB ILE A 58 -0.702 11.227 -3.986 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.252 12.984 -3.752 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -2.206 12.655 -5.473 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.255 10.640 -6.314 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.099 9.193 -5.290 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.712 9.788 -5.749 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.504 13.001 -4.707 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -4.284 11.333 -5.289 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -4.330 11.668 -3.541 1.00 0.00 H new ATOM 867 N CYS A 59 -2.117 7.776 -3.082 1.00 0.00 N ATOM 868 CA CYS A 59 -1.440 6.501 -2.880 1.00 0.00 C ATOM 869 C CYS A 59 -1.403 5.694 -4.174 1.00 0.00 C ATOM 870 O CYS A 59 -2.440 5.266 -4.679 1.00 0.00 O ATOM 871 CB CYS A 59 -2.139 5.696 -1.783 1.00 0.00 C ATOM 872 SG CYS A 59 -1.053 4.550 -0.902 1.00 0.00 S ATOM 0 H CYS A 59 -3.065 7.696 -3.450 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.415 6.707 -2.572 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -2.579 6.387 -1.064 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.960 5.133 -2.227 1.00 0.00 H new ATOM 0 HG CYS A 59 -1.615 4.190 0.213 1.00 0.00 H new ATOM 878 N GLN A 60 -0.201 5.492 -4.705 1.00 0.00 N ATOM 879 CA GLN A 60 -0.030 4.738 -5.942 1.00 0.00 C ATOM 880 C GLN A 60 0.986 3.616 -5.759 1.00 0.00 C ATOM 881 O GLN A 60 1.724 3.587 -4.775 1.00 0.00 O ATOM 882 CB GLN A 60 0.417 5.667 -7.072 1.00 0.00 C ATOM 883 CG GLN A 60 -0.546 6.814 -7.333 1.00 0.00 C ATOM 884 CD GLN A 60 -1.821 6.361 -8.017 1.00 0.00 C ATOM 885 OE1 GLN A 60 -1.805 5.951 -9.179 1.00 0.00 O ATOM 886 NE2 GLN A 60 -2.936 6.431 -7.299 1.00 0.00 N ATOM 0 H GLN A 60 0.668 5.839 -4.299 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.991 4.295 -6.204 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.398 6.075 -6.829 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.532 5.085 -7.986 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -0.797 7.295 -6.388 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.053 7.564 -7.952 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -2.904 6.777 -6.340 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -3.824 6.139 -7.707 1.00 0.00 H new ATOM 895 N ALA A 61 1.017 2.691 -6.713 1.00 0.00 N ATOM 896 CA ALA A 61 1.943 1.567 -6.658 1.00 0.00 C ATOM 897 C ALA A 61 2.355 1.126 -8.058 1.00 0.00 C ATOM 898 O ALA A 61 1.817 1.609 -9.055 1.00 0.00 O ATOM 899 CB ALA A 61 1.319 0.406 -5.898 1.00 0.00 C ATOM 0 H ALA A 61 0.411 2.698 -7.533 1.00 0.00 H new ATOM 0 HA ALA A 61 2.840 1.892 -6.130 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.022 -0.427 -5.865 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.082 0.722 -4.882 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.406 0.090 -6.402 1.00 0.00 H new ATOM 905 N ALA A 62 3.311 0.205 -8.127 1.00 0.00 N ATOM 906 CA ALA A 62 3.793 -0.302 -9.405 1.00 0.00 C ATOM 907 C ALA A 62 4.250 -1.752 -9.284 1.00 0.00 C ATOM 908 O ALA A 62 4.932 -2.120 -8.328 1.00 0.00 O ATOM 909 CB ALA A 62 4.928 0.569 -9.925 1.00 0.00 C ATOM 0 H ALA A 62 3.767 -0.205 -7.312 1.00 0.00 H new ATOM 0 HA ALA A 62 2.967 -0.267 -10.116 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.278 0.178 -10.880 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.571 1.590 -10.059 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.749 0.563 -9.208 1.00 0.00 H new ATOM 915 N VAL A 63 3.867 -2.572 -10.258 1.00 0.00 N ATOM 916 CA VAL A 63 4.238 -3.982 -10.260 1.00 0.00 C ATOM 917 C VAL A 63 4.716 -4.422 -11.639 1.00 0.00 C ATOM 918 O VAL A 63 4.296 -3.893 -12.667 1.00 0.00 O ATOM 919 CB VAL A 63 3.057 -4.873 -9.829 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.409 -4.327 -8.566 1.00 0.00 C ATOM 921 CG2 VAL A 63 2.039 -4.988 -10.954 1.00 0.00 C ATOM 0 H VAL A 63 3.300 -2.284 -11.056 1.00 0.00 H new ATOM 0 HA VAL A 63 5.051 -4.097 -9.543 1.00 0.00 H new ATOM 0 HB VAL A 63 3.438 -5.871 -9.611 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.577 -4.969 -8.277 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.144 -4.301 -7.762 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.041 -3.318 -8.753 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.212 -5.621 -10.633 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.661 -3.997 -11.206 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.514 -5.429 -11.831 1.00 0.00 H new ATOM 931 N PRO A 64 5.617 -5.416 -11.663 1.00 0.00 N ATOM 932 CA PRO A 64 6.173 -5.951 -12.909 1.00 0.00 C ATOM 933 C PRO A 64 5.142 -6.735 -13.714 1.00 0.00 C ATOM 934 O PRO A 64 4.266 -7.391 -13.149 1.00 0.00 O ATOM 935 CB PRO A 64 7.293 -6.877 -12.430 1.00 0.00 C ATOM 936 CG PRO A 64 6.892 -7.275 -11.052 1.00 0.00 C ATOM 937 CD PRO A 64 6.163 -6.093 -10.475 1.00 0.00 C ATOM 0 HA PRO A 64 6.513 -5.159 -13.576 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.393 -7.746 -13.080 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.256 -6.366 -12.430 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.252 -8.157 -11.071 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.764 -7.528 -10.449 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.373 -6.403 -9.791 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.834 -5.442 -9.914 1.00 0.00 H new ATOM 945 N LYS A 65 5.250 -6.663 -15.036 1.00 0.00 N ATOM 946 CA LYS A 65 4.329 -7.367 -15.919 1.00 0.00 C ATOM 947 C LYS A 65 3.940 -8.720 -15.333 1.00 0.00 C ATOM 948 O LYS A 65 2.757 -9.050 -15.238 1.00 0.00 O ATOM 949 CB LYS A 65 4.961 -7.561 -17.300 1.00 0.00 C ATOM 950 CG LYS A 65 5.041 -6.282 -18.116 1.00 0.00 C ATOM 951 CD LYS A 65 5.998 -6.428 -19.288 1.00 0.00 C ATOM 952 CE LYS A 65 5.911 -5.238 -20.230 1.00 0.00 C ATOM 953 NZ LYS A 65 7.190 -5.012 -20.958 1.00 0.00 N ATOM 0 H LYS A 65 5.968 -6.123 -15.520 1.00 0.00 H new ATOM 0 HA LYS A 65 3.428 -6.761 -16.020 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.965 -7.967 -17.177 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.383 -8.301 -17.854 1.00 0.00 H new ATOM 0 HG2 LYS A 65 4.049 -6.022 -18.485 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.369 -5.462 -17.477 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.018 -6.525 -18.916 1.00 0.00 H new ATOM 0 HD3 LYS A 65 5.769 -7.343 -19.834 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.108 -5.402 -20.949 1.00 0.00 H new ATOM 0 HE3 LYS A 65 5.653 -4.344 -19.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.090 -4.192 -21.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.952 -4.830 -20.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.423 -5.855 -21.520 1.00 0.00 H new ATOM 967 N SER A 66 4.942 -9.500 -14.939 1.00 0.00 N ATOM 968 CA SER A 66 4.704 -10.818 -14.363 1.00 0.00 C ATOM 969 C SER A 66 3.455 -10.811 -13.487 1.00 0.00 C ATOM 970 O SER A 66 2.592 -11.682 -13.609 1.00 0.00 O ATOM 971 CB SER A 66 5.914 -11.265 -13.541 1.00 0.00 C ATOM 972 OG SER A 66 6.585 -10.152 -12.975 1.00 0.00 O ATOM 0 H SER A 66 5.926 -9.242 -15.008 1.00 0.00 H new ATOM 0 HA SER A 66 4.549 -11.522 -15.181 1.00 0.00 H new ATOM 0 HB2 SER A 66 5.590 -11.940 -12.749 1.00 0.00 H new ATOM 0 HB3 SER A 66 6.602 -11.824 -14.175 1.00 0.00 H new ATOM 0 HG SER A 66 7.452 -10.034 -13.416 1.00 0.00 H new ATOM 978 N LEU A 67 3.365 -9.823 -12.604 1.00 0.00 N ATOM 979 CA LEU A 67 2.221 -9.701 -11.706 1.00 0.00 C ATOM 980 C LEU A 67 1.245 -8.642 -12.209 1.00 0.00 C ATOM 981 O LEU A 67 1.520 -7.946 -13.186 1.00 0.00 O ATOM 982 CB LEU A 67 2.692 -9.349 -10.294 1.00 0.00 C ATOM 983 CG LEU A 67 3.919 -10.107 -9.787 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.549 -9.376 -8.611 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.543 -11.528 -9.394 1.00 0.00 C ATOM 0 H LEU A 67 4.070 -9.095 -12.490 1.00 0.00 H new ATOM 0 HA LEU A 67 1.705 -10.661 -11.681 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.910 -8.282 -10.261 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.868 -9.528 -9.603 1.00 0.00 H new ATOM 0 HG LEU A 67 4.651 -10.156 -10.593 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.421 -9.930 -8.263 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.855 -8.378 -8.925 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.823 -9.296 -7.802 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.429 -12.053 -9.036 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.793 -11.501 -8.604 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.138 -12.050 -10.261 1.00 0.00 H new ATOM 997 N GLN A 68 0.107 -8.525 -11.532 1.00 0.00 N ATOM 998 CA GLN A 68 -0.909 -7.549 -11.910 1.00 0.00 C ATOM 999 C GLN A 68 -1.244 -6.632 -10.738 1.00 0.00 C ATOM 1000 O GLN A 68 -0.909 -6.926 -9.590 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.173 -8.260 -12.395 1.00 0.00 C ATOM 1002 CG GLN A 68 -2.973 -7.455 -13.407 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.192 -8.200 -13.914 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -4.080 -9.300 -14.456 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -5.365 -7.604 -13.739 1.00 0.00 N ATOM 0 H GLN A 68 -0.135 -9.093 -10.720 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.510 -6.940 -12.721 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.894 -9.215 -12.841 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.807 -8.482 -11.537 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -3.289 -6.517 -12.951 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.332 -7.199 -14.250 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -5.411 -6.692 -13.285 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -6.221 -8.058 -14.059 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.908 -5.521 -11.035 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.290 -4.559 -10.006 1.00 0.00 C ATOM 1016 C LEU A 69 -3.661 -3.960 -10.303 1.00 0.00 C ATOM 1017 O LEU A 69 -3.963 -3.615 -11.444 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.244 -3.447 -9.907 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.485 -2.394 -8.825 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -1.718 -3.057 -7.477 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.312 -1.427 -8.751 1.00 0.00 C ATOM 0 H LEU A 69 -2.193 -5.263 -11.980 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.343 -5.085 -9.053 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.271 -3.905 -9.730 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.187 -2.942 -10.871 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.379 -1.829 -9.088 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.888 -2.292 -6.720 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.591 -3.707 -7.537 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.843 -3.648 -7.206 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.501 -0.685 -7.976 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.598 -1.977 -8.513 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.192 -0.926 -9.712 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.484 -3.837 -9.266 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.822 -3.278 -9.416 1.00 0.00 C ATOM 1035 C GLN A 70 -6.070 -2.178 -8.389 1.00 0.00 C ATOM 1036 O GLN A 70 -6.059 -2.426 -7.183 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.876 -4.376 -9.269 1.00 0.00 C ATOM 1038 CG GLN A 70 -8.301 -3.882 -9.461 1.00 0.00 C ATOM 1039 CD GLN A 70 -9.266 -5.001 -9.798 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -10.318 -5.138 -9.173 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -8.913 -5.809 -10.791 1.00 0.00 N ATOM 0 H GLN A 70 -4.248 -4.117 -8.314 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.897 -2.843 -10.413 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.672 -5.163 -9.995 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.786 -4.824 -8.279 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.634 -3.382 -8.551 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.320 -3.139 -10.258 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -8.032 -5.659 -11.282 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.523 -6.580 -11.063 1.00 0.00 H new ATOM 1050 N LEU A 71 -6.293 -0.962 -8.875 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.544 0.178 -8.000 1.00 0.00 C ATOM 1052 C LEU A 71 -8.020 0.264 -7.627 1.00 0.00 C ATOM 1053 O LEU A 71 -8.859 0.619 -8.454 1.00 0.00 O ATOM 1054 CB LEU A 71 -6.102 1.475 -8.679 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.935 2.689 -7.765 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.903 3.650 -8.335 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -7.270 3.394 -7.565 1.00 0.00 C ATOM 0 H LEU A 71 -6.305 -0.740 -9.870 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.965 0.037 -7.087 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.153 1.292 -9.183 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.831 1.724 -9.451 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.580 2.342 -6.794 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.798 4.508 -7.670 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.943 3.142 -8.425 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.227 3.991 -9.318 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.132 4.256 -6.912 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.653 3.727 -8.529 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.981 2.704 -7.111 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.329 -0.063 -6.376 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.704 -0.021 -5.893 1.00 0.00 C ATOM 1071 C GLN A 72 -10.052 1.364 -5.358 1.00 0.00 C ATOM 1072 O GLN A 72 -9.169 2.132 -4.975 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.915 -1.070 -4.800 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.358 -1.180 -4.332 1.00 0.00 C ATOM 1075 CD GLN A 72 -12.308 -1.551 -5.453 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -13.003 -0.696 -6.002 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -12.343 -2.833 -5.800 1.00 0.00 N ATOM 0 H GLN A 72 -7.646 -0.360 -5.679 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.363 -0.242 -6.732 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.587 -2.041 -5.172 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.283 -0.826 -3.947 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.424 -1.929 -3.542 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.668 -0.230 -3.897 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.750 -3.508 -5.318 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -12.963 -3.142 -6.548 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.343 1.677 -5.335 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.807 2.970 -4.846 1.00 0.00 C ATOM 1088 C ALA A 73 -11.342 3.214 -3.415 1.00 0.00 C ATOM 1089 O ALA A 73 -11.462 2.354 -2.542 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.324 3.053 -4.932 1.00 0.00 C ATOM 0 H ALA A 73 -12.086 1.053 -5.649 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.375 3.746 -5.478 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.657 4.023 -4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.637 2.932 -5.969 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.767 2.263 -4.325 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.796 4.414 -3.165 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.302 4.799 -1.840 1.00 0.00 C ATOM 1098 C PRO A 74 -11.431 4.994 -0.834 1.00 0.00 C ATOM 1099 O PRO A 74 -12.559 4.554 -1.059 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.583 6.125 -2.101 1.00 0.00 C ATOM 1101 CG PRO A 74 -10.236 6.676 -3.321 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.621 5.487 -4.158 1.00 0.00 C ATOM 0 HA PRO A 74 -9.663 4.031 -1.404 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.687 6.805 -1.255 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.515 5.972 -2.258 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -11.112 7.270 -3.060 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -9.556 7.332 -3.865 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -11.538 5.670 -4.718 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.847 5.240 -4.885 1.00 0.00 H new ATOM 1110 N SER A 75 -11.121 5.656 0.276 1.00 0.00 N ATOM 1111 CA SER A 75 -12.109 5.907 1.318 1.00 0.00 C ATOM 1112 C SER A 75 -12.322 7.405 1.516 1.00 0.00 C ATOM 1113 O SER A 75 -13.412 7.846 1.878 1.00 0.00 O ATOM 1114 CB SER A 75 -11.668 5.264 2.634 1.00 0.00 C ATOM 1115 OG SER A 75 -12.729 5.245 3.573 1.00 0.00 O ATOM 0 H SER A 75 -10.193 6.028 0.477 1.00 0.00 H new ATOM 0 HA SER A 75 -13.053 5.462 1.004 1.00 0.00 H new ATOM 0 HB2 SER A 75 -11.325 4.246 2.448 1.00 0.00 H new ATOM 0 HB3 SER A 75 -10.823 5.815 3.046 1.00 0.00 H new ATOM 0 HG SER A 75 -12.422 4.828 4.405 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.270 8.182 1.277 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.361 9.622 1.435 1.00 0.00 C ATOM 1123 C GLY A 76 -10.007 10.300 1.360 1.00 0.00 C ATOM 1124 O GLY A 76 -9.031 9.816 1.930 1.00 0.00 O ATOM 0 H GLY A 76 -10.357 7.840 0.977 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.011 10.029 0.661 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.826 9.851 2.394 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.948 11.424 0.653 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.703 12.168 0.503 1.00 0.00 C ATOM 1130 C ASN A 77 -8.494 13.121 1.676 1.00 0.00 C ATOM 1131 O ASN A 77 -8.143 14.286 1.490 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.708 12.952 -0.811 1.00 0.00 C ATOM 1133 CG ASN A 77 -9.340 12.172 -1.947 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -10.542 11.909 -1.941 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -8.529 11.799 -2.931 1.00 0.00 N ATOM 0 H ASN A 77 -10.748 11.839 0.175 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.881 11.452 0.488 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.250 13.887 -0.671 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.684 13.213 -1.079 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.897 11.272 -3.723 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.538 12.039 -2.894 1.00 0.00 H new ATOM 1142 N THR A 78 -8.712 12.616 2.887 1.00 0.00 N ATOM 1143 CA THR A 78 -8.549 13.421 4.091 1.00 0.00 C ATOM 1144 C THR A 78 -8.200 12.550 5.292 1.00 0.00 C ATOM 1145 O THR A 78 -8.854 11.539 5.550 1.00 0.00 O ATOM 1146 CB THR A 78 -9.825 14.224 4.407 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.143 15.090 3.312 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.647 15.046 5.675 1.00 0.00 C ATOM 0 H THR A 78 -9.002 11.653 3.059 1.00 0.00 H new ATOM 0 HA THR A 78 -7.730 14.115 3.899 1.00 0.00 H new ATOM 0 HB THR A 78 -10.642 13.519 4.561 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.956 15.596 3.520 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.561 15.604 5.878 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.434 14.382 6.512 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.818 15.742 5.544 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.165 12.948 6.025 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.730 12.203 7.201 1.00 0.00 C ATOM 1158 C VAL A 79 -6.672 13.103 8.430 1.00 0.00 C ATOM 1159 O VAL A 79 -5.967 14.112 8.459 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.346 11.564 6.980 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -4.931 10.755 8.199 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.353 10.696 5.731 1.00 0.00 C ATOM 0 H VAL A 79 -6.612 13.782 5.825 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.464 11.414 7.366 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.616 12.361 6.837 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -3.951 10.311 8.025 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -4.884 11.408 9.070 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.661 9.965 8.377 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.367 10.253 5.590 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.094 9.905 5.842 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.603 11.308 4.864 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.430 12.730 9.472 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.482 13.489 10.725 1.00 0.00 C ATOM 1174 C PRO A 80 -6.180 13.396 11.514 1.00 0.00 C ATOM 1175 O PRO A 80 -5.631 12.310 11.699 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.623 12.823 11.497 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.687 11.436 10.955 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.294 11.539 9.508 1.00 0.00 C ATOM 0 HA PRO A 80 -7.633 14.554 10.550 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.427 12.821 12.569 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.565 13.351 11.346 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -8.012 10.774 11.497 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.690 11.022 11.059 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.764 10.648 9.171 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.165 11.655 8.863 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.690 14.542 11.976 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.454 14.589 12.747 1.00 0.00 C ATOM 1188 C ALA A 81 -4.724 14.372 14.232 1.00 0.00 C ATOM 1189 O ALA A 81 -3.822 14.494 15.061 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.744 15.917 12.526 1.00 0.00 C ATOM 0 H ALA A 81 -6.130 15.450 11.830 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.808 13.782 12.401 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.823 15.938 13.108 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.508 16.032 11.468 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.392 16.734 12.844 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.971 14.050 14.561 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.359 13.818 15.947 1.00 0.00 C ATOM 1198 C ARG A 82 -6.612 12.335 16.199 1.00 0.00 C ATOM 1199 O ARG A 82 -7.551 11.966 16.904 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.613 14.626 16.289 1.00 0.00 C ATOM 1201 CG ARG A 82 -7.394 16.130 16.264 1.00 0.00 C ATOM 1202 CD ARG A 82 -7.561 16.694 14.862 1.00 0.00 C ATOM 1203 NE ARG A 82 -8.966 16.791 14.475 1.00 0.00 N ATOM 1204 CZ ARG A 82 -9.801 17.701 14.963 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -9.375 18.588 15.851 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -11.066 17.726 14.561 1.00 0.00 N ATOM 0 H ARG A 82 -6.729 13.944 13.887 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.539 14.143 16.588 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.403 14.371 15.583 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.964 14.335 17.279 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -8.101 16.613 16.938 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.394 16.359 16.633 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -7.102 17.681 14.811 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.032 16.060 14.151 1.00 0.00 H new ATOM 0 HE ARG A 82 -9.325 16.123 13.793 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.403 18.573 16.161 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.019 19.286 16.224 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -11.397 17.046 13.877 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.707 18.425 14.936 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.768 11.488 15.618 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.918 10.055 15.791 1.00 0.00 C ATOM 1222 C GLY A 83 -7.284 9.559 15.363 1.00 0.00 C ATOM 1223 O GLY A 83 -7.898 8.741 16.048 1.00 0.00 O ATOM 0 H GLY A 83 -4.983 11.769 15.030 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.151 9.540 15.213 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.754 9.799 16.838 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.764 10.056 14.227 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.065 9.648 13.729 1.00 0.00 C ATOM 1229 C GLY A 84 -9.017 8.316 13.007 1.00 0.00 C ATOM 1230 O GLY A 84 -8.592 7.308 13.575 1.00 0.00 O ATOM 0 H GLY A 84 -7.275 10.734 13.643 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.765 9.581 14.562 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.447 10.412 13.052 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.456 8.309 11.753 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.463 7.089 10.953 1.00 0.00 C ATOM 1236 C LEU A 85 -8.604 7.253 9.703 1.00 0.00 C ATOM 1237 O LEU A 85 -8.857 8.109 8.854 1.00 0.00 O ATOM 1238 CB LEU A 85 -10.895 6.724 10.557 1.00 0.00 C ATOM 1239 CG LEU A 85 -11.906 6.636 11.701 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.473 8.010 12.020 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.023 5.663 11.352 1.00 0.00 C ATOM 0 H LEU A 85 -9.811 9.133 11.269 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.043 6.285 11.557 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.252 7.463 9.839 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.875 5.764 10.042 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.391 6.264 12.587 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.190 7.927 12.836 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.664 8.678 12.315 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.972 8.411 11.138 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.733 5.613 12.177 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.535 6.005 10.453 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.602 4.673 11.176 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.566 6.413 9.584 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.650 6.444 8.439 1.00 0.00 C ATOM 1255 C PRO A 86 -7.313 5.962 7.153 1.00 0.00 C ATOM 1256 O PRO A 86 -8.398 5.380 7.184 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.531 5.486 8.855 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.169 4.557 9.829 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.205 5.369 10.557 1.00 0.00 C ATOM 0 HA PRO A 86 -6.306 7.455 8.219 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.133 4.946 7.996 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.698 6.023 9.308 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.626 3.709 9.318 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.432 4.152 10.523 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.068 4.763 10.835 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -6.806 5.797 11.477 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.655 6.208 6.026 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.180 5.797 4.730 1.00 0.00 C ATOM 1269 C ILE A 87 -6.694 4.401 4.356 1.00 0.00 C ATOM 1270 O ILE A 87 -5.573 4.012 4.688 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.775 6.784 3.619 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.282 8.190 3.946 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.314 6.320 2.275 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.573 9.282 3.176 1.00 0.00 C ATOM 0 H ILE A 87 -5.757 6.690 5.984 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.266 5.789 4.819 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.687 6.815 3.560 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.350 8.241 3.733 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.161 8.372 5.014 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.019 7.028 1.501 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -6.908 5.336 2.040 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.402 6.263 2.319 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.984 10.251 3.458 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.508 9.258 3.407 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.716 9.125 2.107 1.00 0.00 H new ATOM 1286 N THR A 88 -7.543 3.650 3.662 1.00 0.00 N ATOM 1287 CA THR A 88 -7.200 2.297 3.242 1.00 0.00 C ATOM 1288 C THR A 88 -7.561 2.068 1.779 1.00 0.00 C ATOM 1289 O THR A 88 -8.635 2.464 1.326 1.00 0.00 O ATOM 1290 CB THR A 88 -7.915 1.243 4.107 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.333 1.417 4.021 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.474 1.345 5.560 1.00 0.00 C ATOM 0 H THR A 88 -8.474 3.956 3.379 1.00 0.00 H new ATOM 0 HA THR A 88 -6.123 2.190 3.368 1.00 0.00 H new ATOM 0 HB THR A 88 -7.647 0.256 3.731 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.780 0.741 4.573 1.00 0.00 H new ATOM 0 HG21 THR A 88 -7.993 0.590 6.151 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.398 1.182 5.626 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.715 2.336 5.945 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.659 1.425 1.045 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.884 1.143 -0.368 1.00 0.00 C ATOM 1302 C GLN A 89 -6.602 -0.323 -0.682 1.00 0.00 C ATOM 1303 O GLN A 89 -5.570 -0.866 -0.286 1.00 0.00 O ATOM 1304 CB GLN A 89 -6.002 2.041 -1.236 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.645 3.375 -1.581 1.00 0.00 C ATOM 1306 CD GLN A 89 -6.113 3.961 -2.874 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -4.933 4.297 -2.978 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -6.984 4.089 -3.869 1.00 0.00 N ATOM 0 H GLN A 89 -5.766 1.089 1.405 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.931 1.349 -0.591 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -5.061 2.224 -0.716 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -5.759 1.515 -2.159 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.724 3.244 -1.663 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.470 4.080 -0.768 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.953 3.798 -3.739 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -6.684 4.479 -4.763 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.526 -0.958 -1.394 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.378 -2.362 -1.761 1.00 0.00 C ATOM 1319 C LEU A 90 -6.634 -2.503 -3.086 1.00 0.00 C ATOM 1320 O LEU A 90 -6.850 -1.727 -4.016 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.749 -3.032 -1.859 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.810 -4.320 -2.681 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -7.992 -5.417 -2.016 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.253 -4.767 -2.867 1.00 0.00 C ATOM 0 H LEU A 90 -8.386 -0.523 -1.729 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.795 -2.855 -0.983 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.096 -3.252 -0.850 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.451 -2.317 -2.289 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.383 -4.121 -3.664 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.047 -6.326 -2.615 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.953 -5.098 -1.936 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.389 -5.614 -1.020 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.277 -5.685 -3.454 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.706 -4.948 -1.892 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.811 -3.989 -3.388 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.759 -3.500 -3.164 1.00 0.00 N ATOM 1337 CA PHE A 91 -4.984 -3.744 -4.375 1.00 0.00 C ATOM 1338 C PHE A 91 -4.846 -5.240 -4.640 1.00 0.00 C ATOM 1339 O PHE A 91 -4.311 -5.980 -3.815 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.599 -3.105 -4.257 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.640 -1.642 -3.920 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.828 -1.224 -2.612 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.492 -0.684 -4.910 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.867 0.122 -2.299 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.530 0.663 -4.603 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.717 1.066 -3.295 1.00 0.00 C ATOM 0 H PHE A 91 -5.569 -4.152 -2.403 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.514 -3.292 -5.213 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.030 -3.630 -3.490 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.065 -3.238 -5.198 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.945 -1.958 -1.829 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.345 -0.994 -5.934 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -4.015 0.435 -1.276 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.414 1.399 -5.384 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.746 2.118 -3.052 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.332 -5.677 -5.797 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.265 -7.085 -6.171 1.00 0.00 C ATOM 1358 C ARG A 92 -4.032 -7.362 -7.025 1.00 0.00 C ATOM 1359 O ARG A 92 -3.698 -6.585 -7.921 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.528 -7.493 -6.932 1.00 0.00 C ATOM 1361 CG ARG A 92 -7.658 -7.962 -6.029 1.00 0.00 C ATOM 1362 CD ARG A 92 -8.868 -8.406 -6.837 1.00 0.00 C ATOM 1363 NE ARG A 92 -8.487 -9.200 -8.001 1.00 0.00 N ATOM 1364 CZ ARG A 92 -9.246 -9.326 -9.085 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -10.419 -8.712 -9.152 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -8.830 -10.067 -10.104 1.00 0.00 N ATOM 0 H ARG A 92 -5.776 -5.077 -6.492 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.193 -7.675 -5.257 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.875 -6.646 -7.524 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.279 -8.290 -7.632 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.310 -8.788 -5.408 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.945 -7.155 -5.355 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.534 -8.990 -6.202 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.427 -7.529 -7.164 1.00 0.00 H new ATOM 0 HE ARG A 92 -7.590 -9.684 -7.982 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -10.741 -8.141 -8.371 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -10.999 -8.810 -9.985 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -7.928 -10.540 -10.056 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -9.413 -10.164 -10.936 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.359 -8.472 -6.742 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.164 -8.852 -7.485 1.00 0.00 C ATOM 1382 C ILE A 93 -2.155 -10.346 -7.787 1.00 0.00 C ATOM 1383 O ILE A 93 -2.475 -11.167 -6.925 1.00 0.00 O ATOM 1384 CB ILE A 93 -0.882 -8.488 -6.712 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.763 -6.970 -6.563 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.341 -9.054 -7.418 1.00 0.00 C ATOM 1387 CD1 ILE A 93 0.061 -6.542 -5.370 1.00 0.00 C ATOM 0 H ILE A 93 -3.621 -9.124 -6.003 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.185 -8.295 -8.422 1.00 0.00 H new ATOM 0 HB ILE A 93 -0.939 -8.928 -5.716 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.317 -6.558 -7.468 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.762 -6.542 -6.476 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.239 -8.788 -6.860 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.258 -10.139 -7.476 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.404 -8.640 -8.425 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.102 -5.454 -5.328 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.395 -6.924 -4.457 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.071 -6.940 -5.464 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.785 -10.694 -9.014 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.733 -12.091 -9.431 1.00 0.00 C ATOM 1401 C LEU A 94 -0.293 -12.594 -9.469 1.00 0.00 C ATOM 1402 O LEU A 94 0.551 -12.035 -10.168 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.380 -12.259 -10.806 1.00 0.00 C ATOM 1404 CG LEU A 94 -3.891 -12.495 -10.812 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.234 -13.782 -10.078 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.618 -11.313 -10.187 1.00 0.00 C ATOM 0 H LEU A 94 -1.516 -10.028 -9.738 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.287 -12.683 -8.702 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.169 -11.367 -11.396 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.900 -13.097 -11.312 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.219 -12.593 -11.847 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.313 -13.933 -10.093 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.743 -14.623 -10.569 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.891 -13.714 -9.045 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.692 -11.498 -10.200 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.284 -11.184 -9.157 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.399 -10.409 -10.756 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.021 -13.654 -8.715 1.00 0.00 N ATOM 1419 CA ASN A 95 1.316 -14.233 -8.664 1.00 0.00 C ATOM 1420 C ASN A 95 1.278 -15.720 -9.004 1.00 0.00 C ATOM 1421 O ASN A 95 1.886 -16.552 -8.330 1.00 0.00 O ATOM 1422 CB ASN A 95 1.930 -14.031 -7.277 1.00 0.00 C ATOM 1423 CG ASN A 95 3.446 -14.019 -7.311 1.00 0.00 C ATOM 1424 OD1 ASN A 95 4.072 -12.965 -7.197 1.00 0.00 O ATOM 1425 ND2 ASN A 95 4.043 -15.194 -7.470 1.00 0.00 N ATOM 0 H ASN A 95 -0.709 -14.129 -8.131 1.00 0.00 H new ATOM 0 HA ASN A 95 1.933 -13.724 -9.405 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.571 -13.091 -6.858 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.591 -14.826 -6.613 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.061 -15.249 -7.502 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.484 -16.042 -7.560 1.00 0.00 H new ATOM 1432 N PRO A 96 0.547 -16.063 -10.075 1.00 0.00 N ATOM 1433 CA PRO A 96 0.413 -17.450 -10.530 1.00 0.00 C ATOM 1434 C PRO A 96 1.710 -17.996 -11.118 1.00 0.00 C ATOM 1435 O PRO A 96 1.916 -19.207 -11.174 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.669 -17.367 -11.609 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.600 -15.964 -12.107 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.204 -15.124 -10.925 1.00 0.00 C ATOM 0 HA PRO A 96 0.166 -18.125 -9.710 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.484 -18.081 -12.411 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.654 -17.594 -11.201 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.128 -15.871 -12.913 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.562 -15.645 -12.508 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.409 -14.274 -11.224 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.075 -14.722 -10.408 1.00 0.00 H new ATOM 1446 N ASN A 97 2.582 -17.093 -11.555 1.00 0.00 N ATOM 1447 CA ASN A 97 3.860 -17.484 -12.139 1.00 0.00 C ATOM 1448 C ASN A 97 4.833 -17.945 -11.058 1.00 0.00 C ATOM 1449 O ASN A 97 5.994 -18.245 -11.339 1.00 0.00 O ATOM 1450 CB ASN A 97 4.465 -16.318 -12.922 1.00 0.00 C ATOM 1451 CG ASN A 97 3.877 -16.189 -14.314 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.490 -16.602 -15.299 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.683 -15.614 -14.401 1.00 0.00 N ATOM 0 H ASN A 97 2.427 -16.086 -11.516 1.00 0.00 H new ATOM 0 HA ASN A 97 3.681 -18.316 -12.820 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.299 -15.391 -12.373 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.544 -16.455 -12.998 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.237 -15.500 -15.311 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.212 -15.287 -13.558 1.00 0.00 H new ATOM 1460 N LYS A 98 4.352 -18.000 -9.821 1.00 0.00 N ATOM 1461 CA LYS A 98 5.178 -18.426 -8.697 1.00 0.00 C ATOM 1462 C LYS A 98 6.481 -17.634 -8.647 1.00 0.00 C ATOM 1463 O LYS A 98 7.547 -18.191 -8.387 1.00 0.00 O ATOM 1464 CB LYS A 98 5.482 -19.922 -8.799 1.00 0.00 C ATOM 1465 CG LYS A 98 4.283 -20.808 -8.506 1.00 0.00 C ATOM 1466 CD LYS A 98 4.635 -22.281 -8.626 1.00 0.00 C ATOM 1467 CE LYS A 98 3.415 -23.165 -8.416 1.00 0.00 C ATOM 1468 NZ LYS A 98 3.551 -24.473 -9.115 1.00 0.00 N ATOM 0 H LYS A 98 3.394 -17.755 -9.571 1.00 0.00 H new ATOM 0 HA LYS A 98 4.623 -18.236 -7.779 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.849 -20.142 -9.801 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.284 -20.169 -8.104 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.914 -20.602 -7.501 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.475 -20.569 -9.197 1.00 0.00 H new ATOM 0 HD2 LYS A 98 5.061 -22.475 -9.610 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.400 -22.534 -7.892 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.270 -23.337 -7.349 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.526 -22.650 -8.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.700 -25.046 -8.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.664 -24.311 -10.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.385 -24.977 -8.750 1.00 0.00 H new ATOM 1482 N ALA A 99 6.386 -16.332 -8.898 1.00 0.00 N ATOM 1483 CA ALA A 99 7.557 -15.464 -8.878 1.00 0.00 C ATOM 1484 C ALA A 99 7.452 -14.426 -7.766 1.00 0.00 C ATOM 1485 O ALA A 99 6.713 -13.446 -7.866 1.00 0.00 O ATOM 1486 CB ALA A 99 7.730 -14.780 -10.226 1.00 0.00 C ATOM 0 H ALA A 99 5.511 -15.856 -9.117 1.00 0.00 H new ATOM 0 HA ALA A 99 8.433 -16.082 -8.681 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.608 -14.135 -10.197 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.859 -15.534 -11.003 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.847 -14.180 -10.446 1.00 0.00 H new ATOM 1492 N PRO A 100 8.207 -14.643 -6.679 1.00 0.00 N ATOM 1493 CA PRO A 100 8.215 -13.737 -5.527 1.00 0.00 C ATOM 1494 C PRO A 100 8.882 -12.402 -5.844 1.00 0.00 C ATOM 1495 O PRO A 100 10.062 -12.202 -5.554 1.00 0.00 O ATOM 1496 CB PRO A 100 9.025 -14.503 -4.479 1.00 0.00 C ATOM 1497 CG PRO A 100 9.900 -15.415 -5.268 1.00 0.00 C ATOM 1498 CD PRO A 100 9.111 -15.790 -6.491 1.00 0.00 C ATOM 0 HA PRO A 100 7.206 -13.481 -5.203 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.614 -13.825 -3.861 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.374 -15.062 -3.807 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.833 -14.921 -5.541 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.165 -16.299 -4.689 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.757 -15.938 -7.356 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.558 -16.718 -6.344 1.00 0.00 H new ATOM 1506 N LEU A 101 8.120 -11.492 -6.440 1.00 0.00 N ATOM 1507 CA LEU A 101 8.637 -10.176 -6.796 1.00 0.00 C ATOM 1508 C LEU A 101 8.368 -9.166 -5.685 1.00 0.00 C ATOM 1509 O LEU A 101 7.859 -9.520 -4.622 1.00 0.00 O ATOM 1510 CB LEU A 101 8.004 -9.694 -8.103 1.00 0.00 C ATOM 1511 CG LEU A 101 8.706 -10.130 -9.390 1.00 0.00 C ATOM 1512 CD1 LEU A 101 7.702 -10.269 -10.524 1.00 0.00 C ATOM 1513 CD2 LEU A 101 9.801 -9.142 -9.762 1.00 0.00 C ATOM 0 H LEU A 101 7.142 -11.642 -6.687 1.00 0.00 H new ATOM 0 HA LEU A 101 9.715 -10.261 -6.931 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.974 -10.049 -8.137 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.966 -8.605 -8.085 1.00 0.00 H new ATOM 0 HG LEU A 101 9.167 -11.103 -9.218 1.00 0.00 H new ATOM 0 HD11 LEU A 101 8.219 -10.580 -11.432 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.954 -11.016 -10.258 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.212 -9.311 -10.696 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.289 -9.469 -10.680 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.364 -8.155 -9.915 1.00 0.00 H new ATOM 0 HD23 LEU A 101 10.535 -9.093 -8.958 1.00 0.00 H new ATOM 1525 N ARG A 102 8.712 -7.908 -5.940 1.00 0.00 N ATOM 1526 CA ARG A 102 8.506 -6.847 -4.962 1.00 0.00 C ATOM 1527 C ARG A 102 7.387 -5.908 -5.404 1.00 0.00 C ATOM 1528 O ARG A 102 6.834 -6.055 -6.495 1.00 0.00 O ATOM 1529 CB ARG A 102 9.799 -6.055 -4.757 1.00 0.00 C ATOM 1530 CG ARG A 102 10.260 -5.310 -5.999 1.00 0.00 C ATOM 1531 CD ARG A 102 11.771 -5.142 -6.019 1.00 0.00 C ATOM 1532 NE ARG A 102 12.248 -4.623 -7.299 1.00 0.00 N ATOM 1533 CZ ARG A 102 13.420 -4.019 -7.456 1.00 0.00 C ATOM 1534 NH1 ARG A 102 14.232 -3.860 -6.420 1.00 0.00 N ATOM 1535 NH2 ARG A 102 13.783 -3.574 -8.652 1.00 0.00 N ATOM 0 H ARG A 102 9.135 -7.599 -6.815 1.00 0.00 H new ATOM 0 HA ARG A 102 8.217 -7.309 -4.018 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.652 -5.340 -3.948 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.587 -6.738 -4.440 1.00 0.00 H new ATOM 0 HG2 ARG A 102 9.941 -5.852 -6.889 1.00 0.00 H new ATOM 0 HG3 ARG A 102 9.783 -4.330 -6.035 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.071 -4.465 -5.219 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.245 -6.103 -5.818 1.00 0.00 H new ATOM 0 HE ARG A 102 11.648 -4.731 -8.117 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.957 -4.202 -5.499 1.00 0.00 H new ATOM 0 HH12 ARG A 102 15.132 -3.396 -6.544 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.162 -3.696 -9.452 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.683 -3.110 -8.772 1.00 0.00 H new ATOM 1549 N LEU A 103 7.059 -4.944 -4.551 1.00 0.00 N ATOM 1550 CA LEU A 103 6.005 -3.982 -4.853 1.00 0.00 C ATOM 1551 C LEU A 103 6.468 -2.558 -4.559 1.00 0.00 C ATOM 1552 O LEU A 103 7.060 -2.290 -3.513 1.00 0.00 O ATOM 1553 CB LEU A 103 4.748 -4.300 -4.042 1.00 0.00 C ATOM 1554 CG LEU A 103 3.670 -3.215 -4.021 1.00 0.00 C ATOM 1555 CD1 LEU A 103 2.693 -3.412 -5.169 1.00 0.00 C ATOM 1556 CD2 LEU A 103 2.937 -3.218 -2.688 1.00 0.00 C ATOM 0 H LEU A 103 7.508 -4.808 -3.645 1.00 0.00 H new ATOM 0 HA LEU A 103 5.772 -4.057 -5.915 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.307 -5.215 -4.437 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.046 -4.508 -3.014 1.00 0.00 H new ATOM 0 HG LEU A 103 4.154 -2.246 -4.145 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.933 -2.631 -5.138 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.229 -3.359 -6.116 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.215 -4.387 -5.077 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.174 -2.440 -2.691 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.465 -4.189 -2.534 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.646 -3.028 -1.882 1.00 0.00 H new ATOM 1568 N LYS A 104 6.191 -1.648 -5.487 1.00 0.00 N ATOM 1569 CA LYS A 104 6.575 -0.251 -5.326 1.00 0.00 C ATOM 1570 C LYS A 104 5.442 0.557 -4.701 1.00 0.00 C ATOM 1571 O LYS A 104 4.273 0.375 -5.045 1.00 0.00 O ATOM 1572 CB LYS A 104 6.959 0.353 -6.680 1.00 0.00 C ATOM 1573 CG LYS A 104 7.388 1.807 -6.597 1.00 0.00 C ATOM 1574 CD LYS A 104 7.656 2.388 -7.975 1.00 0.00 C ATOM 1575 CE LYS A 104 8.567 3.604 -7.900 1.00 0.00 C ATOM 1576 NZ LYS A 104 8.466 4.450 -9.122 1.00 0.00 N ATOM 0 H LYS A 104 5.702 -1.853 -6.358 1.00 0.00 H new ATOM 0 HA LYS A 104 7.436 -0.212 -4.659 1.00 0.00 H new ATOM 0 HB2 LYS A 104 7.770 -0.232 -7.113 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.110 0.271 -7.359 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.611 2.389 -6.100 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.287 1.888 -5.986 1.00 0.00 H new ATOM 0 HD2 LYS A 104 8.113 1.628 -8.609 1.00 0.00 H new ATOM 0 HD3 LYS A 104 6.712 2.668 -8.443 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.307 4.199 -7.024 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.599 3.277 -7.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.102 5.268 -9.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.738 3.890 -9.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.487 4.783 -9.234 1.00 0.00 H new ATOM 1590 N LEU A 105 5.795 1.449 -3.783 1.00 0.00 N ATOM 1591 CA LEU A 105 4.807 2.286 -3.110 1.00 0.00 C ATOM 1592 C LEU A 105 5.127 3.765 -3.300 1.00 0.00 C ATOM 1593 O LEU A 105 6.103 4.275 -2.751 1.00 0.00 O ATOM 1594 CB LEU A 105 4.756 1.951 -1.619 1.00 0.00 C ATOM 1595 CG LEU A 105 3.795 0.833 -1.214 1.00 0.00 C ATOM 1596 CD1 LEU A 105 3.795 0.649 0.296 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.390 1.130 -1.717 1.00 0.00 C ATOM 0 H LEU A 105 6.757 1.612 -3.487 1.00 0.00 H new ATOM 0 HA LEU A 105 3.833 2.084 -3.555 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.759 1.675 -1.295 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.482 2.854 -1.074 1.00 0.00 H new ATOM 0 HG LEU A 105 4.135 -0.096 -1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.105 -0.151 0.565 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.799 0.390 0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.480 1.576 0.775 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.719 0.324 -1.420 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.041 2.069 -1.288 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.402 1.210 -2.804 1.00 0.00 H new ATOM 1609 N ARG A 106 4.296 4.449 -4.080 1.00 0.00 N ATOM 1610 CA ARG A 106 4.489 5.871 -4.341 1.00 0.00 C ATOM 1611 C ARG A 106 3.554 6.714 -3.480 1.00 0.00 C ATOM 1612 O ARG A 106 2.336 6.530 -3.503 1.00 0.00 O ATOM 1613 CB ARG A 106 4.251 6.176 -5.821 1.00 0.00 C ATOM 1614 CG ARG A 106 5.052 7.360 -6.336 1.00 0.00 C ATOM 1615 CD ARG A 106 4.535 8.672 -5.765 1.00 0.00 C ATOM 1616 NE ARG A 106 4.764 9.792 -6.674 1.00 0.00 N ATOM 1617 CZ ARG A 106 4.120 9.948 -7.825 1.00 0.00 C ATOM 1618 NH1 ARG A 106 3.212 9.061 -8.206 1.00 0.00 N ATOM 1619 NH2 ARG A 106 4.384 10.994 -8.598 1.00 0.00 N ATOM 0 H ARG A 106 3.483 4.042 -4.542 1.00 0.00 H new ATOM 0 HA ARG A 106 5.518 6.125 -4.085 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.503 5.294 -6.410 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.190 6.371 -5.977 1.00 0.00 H new ATOM 0 HG2 ARG A 106 6.102 7.234 -6.070 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.001 7.390 -7.424 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.468 8.583 -5.561 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.026 8.872 -4.813 1.00 0.00 H new ATOM 0 HE ARG A 106 5.457 10.493 -6.410 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.006 8.256 -7.615 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.719 9.184 -9.091 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.082 11.679 -8.308 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.889 11.113 -9.482 1.00 0.00 H new ATOM 1633 N LEU A 107 4.131 7.639 -2.721 1.00 0.00 N ATOM 1634 CA LEU A 107 3.350 8.512 -1.851 1.00 0.00 C ATOM 1635 C LEU A 107 3.503 9.972 -2.265 1.00 0.00 C ATOM 1636 O LEU A 107 4.614 10.448 -2.501 1.00 0.00 O ATOM 1637 CB LEU A 107 3.783 8.334 -0.395 1.00 0.00 C ATOM 1638 CG LEU A 107 3.421 6.997 0.254 1.00 0.00 C ATOM 1639 CD1 LEU A 107 3.489 7.104 1.770 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.036 6.547 -0.188 1.00 0.00 C ATOM 0 H LEU A 107 5.137 7.804 -2.690 1.00 0.00 H new ATOM 0 HA LEU A 107 2.300 8.235 -1.947 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.864 8.461 -0.340 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.338 9.134 0.196 1.00 0.00 H new ATOM 0 HG LEU A 107 4.145 6.250 -0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.228 6.144 2.215 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.500 7.381 2.070 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.788 7.865 2.113 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.795 5.594 0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.299 7.294 0.107 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.020 6.430 -1.272 1.00 0.00 H new ATOM 1652 N THR A 108 2.381 10.680 -2.348 1.00 0.00 N ATOM 1653 CA THR A 108 2.390 12.086 -2.731 1.00 0.00 C ATOM 1654 C THR A 108 1.217 12.833 -2.108 1.00 0.00 C ATOM 1655 O THR A 108 0.063 12.618 -2.480 1.00 0.00 O ATOM 1656 CB THR A 108 2.336 12.251 -4.261 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.376 11.346 -4.818 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.700 11.996 -4.882 1.00 0.00 C ATOM 0 H THR A 108 1.454 10.302 -2.155 1.00 0.00 H new ATOM 0 HA THR A 108 3.324 12.509 -2.360 1.00 0.00 H new ATOM 0 HB THR A 108 2.040 13.276 -4.483 1.00 0.00 H new ATOM 0 HG1 THR A 108 1.347 11.458 -5.791 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.636 12.119 -5.963 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.422 12.706 -4.478 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.021 10.980 -4.650 1.00 0.00 H new ATOM 1666 N TYR A 109 1.519 13.712 -1.159 1.00 0.00 N ATOM 1667 CA TYR A 109 0.488 14.491 -0.482 1.00 0.00 C ATOM 1668 C TYR A 109 1.050 15.817 0.021 1.00 0.00 C ATOM 1669 O TYR A 109 2.221 16.130 -0.194 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.098 13.696 0.686 1.00 0.00 C ATOM 1671 CG TYR A 109 0.919 13.345 1.749 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.793 12.278 1.577 1.00 0.00 C ATOM 1673 CD2 TYR A 109 1.004 14.078 2.926 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.722 11.953 2.546 1.00 0.00 C ATOM 1675 CE2 TYR A 109 1.931 13.762 3.899 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.788 12.698 3.705 1.00 0.00 C ATOM 1677 OH TYR A 109 3.712 12.379 4.673 1.00 0.00 O ATOM 0 H TYR A 109 2.469 13.903 -0.841 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.303 14.702 -1.201 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -0.902 14.274 1.141 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.543 12.778 0.303 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.745 11.693 0.670 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.333 14.910 3.083 1.00 0.00 H new ATOM 0 HE1 TYR A 109 3.393 11.120 2.397 1.00 0.00 H new ATOM 0 HE2 TYR A 109 1.985 14.344 4.807 1.00 0.00 H new ATOM 0 HH TYR A 109 3.627 13.002 5.424 1.00 0.00 H new ATOM 1687 N ASP A 110 0.205 16.592 0.693 1.00 0.00 N ATOM 1688 CA ASP A 110 0.616 17.884 1.230 1.00 0.00 C ATOM 1689 C ASP A 110 0.520 17.896 2.753 1.00 0.00 C ATOM 1690 O ASP A 110 -0.481 17.464 3.325 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.247 19.002 0.644 1.00 0.00 C ATOM 1692 CG ASP A 110 0.449 20.348 0.674 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.729 20.845 1.785 1.00 0.00 O ATOM 1694 OD2 ASP A 110 0.712 20.905 -0.412 1.00 0.00 O ATOM 0 H ASP A 110 -0.768 16.348 0.879 1.00 0.00 H new ATOM 0 HA ASP A 110 1.655 18.052 0.948 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.508 18.754 -0.385 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -1.181 19.067 1.203 1.00 0.00 H new ATOM 1699 N HIS A 111 1.567 18.391 3.403 1.00 0.00 N ATOM 1700 CA HIS A 111 1.601 18.459 4.860 1.00 0.00 C ATOM 1701 C HIS A 111 2.112 19.818 5.329 1.00 0.00 C ATOM 1702 O HIS A 111 3.079 20.351 4.785 1.00 0.00 O ATOM 1703 CB HIS A 111 2.486 17.346 5.422 1.00 0.00 C ATOM 1704 CG HIS A 111 2.119 16.935 6.815 1.00 0.00 C ATOM 1705 ND1 HIS A 111 2.897 16.092 7.581 1.00 0.00 N ATOM 1706 CD2 HIS A 111 1.050 17.258 7.581 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.321 15.913 8.756 1.00 0.00 C ATOM 1708 NE2 HIS A 111 1.200 16.609 8.782 1.00 0.00 N ATOM 0 H HIS A 111 2.404 18.751 2.945 1.00 0.00 H new ATOM 0 HA HIS A 111 0.584 18.326 5.230 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.423 16.477 4.767 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.524 17.678 5.412 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.232 17.905 7.300 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.703 15.301 9.560 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.550 16.657 9.567 1.00 0.00 H new ATOM 1716 N PHE A 112 1.455 20.373 6.343 1.00 0.00 N ATOM 1717 CA PHE A 112 1.842 21.671 6.884 1.00 0.00 C ATOM 1718 C PHE A 112 2.065 22.683 5.764 1.00 0.00 C ATOM 1719 O PHE A 112 3.096 23.355 5.716 1.00 0.00 O ATOM 1720 CB PHE A 112 3.111 21.537 7.728 1.00 0.00 C ATOM 1721 CG PHE A 112 2.884 20.860 9.049 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.739 19.484 9.121 1.00 0.00 C ATOM 1723 CD2 PHE A 112 2.816 21.600 10.219 1.00 0.00 C ATOM 1724 CE1 PHE A 112 2.531 18.858 10.336 1.00 0.00 C ATOM 1725 CE2 PHE A 112 2.608 20.979 11.436 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.464 19.606 11.494 1.00 0.00 C ATOM 0 H PHE A 112 0.653 19.945 6.806 1.00 0.00 H new ATOM 0 HA PHE A 112 1.030 22.030 7.516 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.855 20.975 7.164 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.527 22.529 7.904 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.789 18.894 8.218 1.00 0.00 H new ATOM 0 HD2 PHE A 112 2.927 22.674 10.179 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.421 17.784 10.379 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.558 21.566 12.341 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.299 19.119 12.444 1.00 0.00 H new ATOM 1736 N HIS A 113 1.092 22.785 4.864 1.00 0.00 N ATOM 1737 CA HIS A 113 1.182 23.715 3.744 1.00 0.00 C ATOM 1738 C HIS A 113 2.498 23.536 2.993 1.00 0.00 C ATOM 1739 O HIS A 113 3.195 24.508 2.703 1.00 0.00 O ATOM 1740 CB HIS A 113 1.056 25.156 4.239 1.00 0.00 C ATOM 1741 CG HIS A 113 -0.084 25.367 5.186 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -1.100 26.269 4.952 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -0.366 24.785 6.375 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -1.958 26.234 5.957 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -1.535 25.340 6.834 1.00 0.00 N ATOM 0 H HIS A 113 0.233 22.236 4.888 1.00 0.00 H new ATOM 0 HA HIS A 113 0.361 23.501 3.059 1.00 0.00 H new ATOM 0 HB2 HIS A 113 1.985 25.445 4.731 1.00 0.00 H new ATOM 0 HB3 HIS A 113 0.932 25.817 3.381 1.00 0.00 H new ATOM 0 HD2 HIS A 113 0.220 24.025 6.871 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -2.852 26.833 6.046 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -2.001 25.101 7.709 1.00 0.00 H new ATOM 1753 N GLN A 114 2.832 22.287 2.684 1.00 0.00 N ATOM 1754 CA GLN A 114 4.065 21.981 1.969 1.00 0.00 C ATOM 1755 C GLN A 114 3.915 20.706 1.146 1.00 0.00 C ATOM 1756 O GLN A 114 3.047 19.877 1.419 1.00 0.00 O ATOM 1757 CB GLN A 114 5.227 21.833 2.952 1.00 0.00 C ATOM 1758 CG GLN A 114 5.737 23.159 3.495 1.00 0.00 C ATOM 1759 CD GLN A 114 6.200 24.099 2.400 1.00 0.00 C ATOM 1760 OE1 GLN A 114 5.387 24.690 1.688 1.00 0.00 O ATOM 1761 NE2 GLN A 114 7.512 24.242 2.258 1.00 0.00 N ATOM 0 H GLN A 114 2.266 21.471 2.918 1.00 0.00 H new ATOM 0 HA GLN A 114 4.276 22.808 1.290 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.909 21.207 3.786 1.00 0.00 H new ATOM 0 HB3 GLN A 114 6.047 21.313 2.457 1.00 0.00 H new ATOM 0 HG2 GLN A 114 4.946 23.640 4.071 1.00 0.00 H new ATOM 0 HG3 GLN A 114 6.563 22.973 4.182 1.00 0.00 H new ATOM 0 HE21 GLN A 114 8.150 23.733 2.870 1.00 0.00 H new ATOM 0 HE22 GLN A 114 7.882 24.861 1.537 1.00 0.00 H new ATOM 1770 N SER A 115 4.767 20.555 0.136 1.00 0.00 N ATOM 1771 CA SER A 115 4.726 19.383 -0.730 1.00 0.00 C ATOM 1772 C SER A 115 5.469 18.212 -0.094 1.00 0.00 C ATOM 1773 O SER A 115 6.629 18.337 0.300 1.00 0.00 O ATOM 1774 CB SER A 115 5.337 19.708 -2.094 1.00 0.00 C ATOM 1775 OG SER A 115 4.485 20.556 -2.845 1.00 0.00 O ATOM 0 H SER A 115 5.494 21.230 -0.102 1.00 0.00 H new ATOM 0 HA SER A 115 3.682 19.099 -0.866 1.00 0.00 H new ATOM 0 HB2 SER A 115 6.305 20.189 -1.957 1.00 0.00 H new ATOM 0 HB3 SER A 115 5.515 18.785 -2.646 1.00 0.00 H new ATOM 0 HG SER A 115 4.899 20.751 -3.712 1.00 0.00 H new ATOM 1781 N VAL A 116 4.792 17.072 0.003 1.00 0.00 N ATOM 1782 CA VAL A 116 5.387 15.877 0.590 1.00 0.00 C ATOM 1783 C VAL A 116 5.473 14.748 -0.430 1.00 0.00 C ATOM 1784 O VAL A 116 4.466 14.124 -0.766 1.00 0.00 O ATOM 1785 CB VAL A 116 4.583 15.391 1.811 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.156 14.087 2.343 1.00 0.00 C ATOM 1787 CG2 VAL A 116 4.565 16.458 2.895 1.00 0.00 C ATOM 0 H VAL A 116 3.831 16.951 -0.317 1.00 0.00 H new ATOM 0 HA VAL A 116 6.392 16.150 0.911 1.00 0.00 H new ATOM 0 HB VAL A 116 3.555 15.206 1.498 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.575 13.759 3.205 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.111 13.325 1.565 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.193 14.240 2.641 1.00 0.00 H new ATOM 0 HG21 VAL A 116 3.993 16.098 3.750 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.586 16.676 3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.103 17.365 2.505 1.00 0.00 H new ATOM 1797 N GLN A 117 6.681 14.490 -0.920 1.00 0.00 N ATOM 1798 CA GLN A 117 6.898 13.435 -1.903 1.00 0.00 C ATOM 1799 C GLN A 117 7.956 12.449 -1.419 1.00 0.00 C ATOM 1800 O GLN A 117 9.107 12.821 -1.195 1.00 0.00 O ATOM 1801 CB GLN A 117 7.321 14.038 -3.244 1.00 0.00 C ATOM 1802 CG GLN A 117 7.465 13.010 -4.354 1.00 0.00 C ATOM 1803 CD GLN A 117 8.476 13.424 -5.405 1.00 0.00 C ATOM 1804 OE1 GLN A 117 8.149 14.150 -6.345 1.00 0.00 O ATOM 1805 NE2 GLN A 117 9.712 12.965 -5.252 1.00 0.00 N ATOM 0 H GLN A 117 7.525 14.997 -0.652 1.00 0.00 H new ATOM 0 HA GLN A 117 5.959 12.897 -2.034 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.587 14.785 -3.545 1.00 0.00 H new ATOM 0 HB3 GLN A 117 8.270 14.558 -3.116 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.765 12.055 -3.923 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.496 12.855 -4.829 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.939 12.366 -4.458 1.00 0.00 H new ATOM 0 HE22 GLN A 117 10.435 13.211 -5.928 1.00 0.00 H new ATOM 1814 N GLU A 118 7.557 11.191 -1.259 1.00 0.00 N ATOM 1815 CA GLU A 118 8.471 10.152 -0.801 1.00 0.00 C ATOM 1816 C GLU A 118 8.147 8.813 -1.456 1.00 0.00 C ATOM 1817 O GLU A 118 7.063 8.262 -1.262 1.00 0.00 O ATOM 1818 CB GLU A 118 8.403 10.017 0.722 1.00 0.00 C ATOM 1819 CG GLU A 118 8.693 11.312 1.462 1.00 0.00 C ATOM 1820 CD GLU A 118 9.260 11.077 2.848 1.00 0.00 C ATOM 1821 OE1 GLU A 118 10.372 10.516 2.946 1.00 0.00 O ATOM 1822 OE2 GLU A 118 8.593 11.454 3.834 1.00 0.00 O ATOM 0 H GLU A 118 6.607 10.867 -1.440 1.00 0.00 H new ATOM 0 HA GLU A 118 9.482 10.442 -1.089 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.411 9.662 1.003 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.116 9.258 1.043 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.397 11.908 0.882 1.00 0.00 H new ATOM 0 HG3 GLU A 118 7.775 11.893 1.543 1.00 0.00 H new ATOM 1829 N ILE A 119 9.093 8.297 -2.234 1.00 0.00 N ATOM 1830 CA ILE A 119 8.908 7.023 -2.918 1.00 0.00 C ATOM 1831 C ILE A 119 9.845 5.958 -2.358 1.00 0.00 C ATOM 1832 O ILE A 119 11.034 6.207 -2.153 1.00 0.00 O ATOM 1833 CB ILE A 119 9.149 7.158 -4.433 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.127 8.115 -5.051 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.078 5.794 -5.104 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.521 9.571 -4.941 1.00 0.00 C ATOM 0 H ILE A 119 9.995 8.741 -2.406 1.00 0.00 H new ATOM 0 HA ILE A 119 7.875 6.720 -2.748 1.00 0.00 H new ATOM 0 HB ILE A 119 10.146 7.569 -4.592 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.993 7.861 -6.103 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.163 7.970 -4.563 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.250 5.906 -6.174 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.840 5.140 -4.680 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.093 5.358 -4.939 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.751 10.192 -5.399 1.00 0.00 H new ATOM 0 HD12 ILE A 119 8.627 9.841 -3.890 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.469 9.731 -5.454 1.00 0.00 H new ATOM 1848 N PHE A 120 9.303 4.770 -2.114 1.00 0.00 N ATOM 1849 CA PHE A 120 10.090 3.665 -1.579 1.00 0.00 C ATOM 1850 C PHE A 120 9.614 2.332 -2.149 1.00 0.00 C ATOM 1851 O PHE A 120 8.479 2.212 -2.609 1.00 0.00 O ATOM 1852 CB PHE A 120 10.002 3.641 -0.052 1.00 0.00 C ATOM 1853 CG PHE A 120 8.600 3.783 0.470 1.00 0.00 C ATOM 1854 CD1 PHE A 120 7.765 2.681 0.559 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.118 5.018 0.870 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.475 2.808 1.039 1.00 0.00 C ATOM 1857 CE2 PHE A 120 6.829 5.152 1.351 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.006 4.045 1.434 1.00 0.00 C ATOM 0 H PHE A 120 8.321 4.547 -2.278 1.00 0.00 H new ATOM 0 HA PHE A 120 11.129 3.815 -1.874 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.424 2.705 0.314 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.615 4.447 0.352 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.126 1.711 0.250 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.757 5.887 0.805 1.00 0.00 H new ATOM 0 HE1 PHE A 120 5.835 1.941 1.105 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.466 6.120 1.661 1.00 0.00 H new ATOM 0 HZ PHE A 120 4.998 4.147 1.807 1.00 0.00 H new ATOM 1868 N GLU A 121 10.491 1.334 -2.115 1.00 0.00 N ATOM 1869 CA GLU A 121 10.161 0.009 -2.629 1.00 0.00 C ATOM 1870 C GLU A 121 10.308 -1.049 -1.540 1.00 0.00 C ATOM 1871 O GLU A 121 11.394 -1.247 -0.993 1.00 0.00 O ATOM 1872 CB GLU A 121 11.059 -0.338 -3.819 1.00 0.00 C ATOM 1873 CG GLU A 121 10.956 0.650 -4.968 1.00 0.00 C ATOM 1874 CD GLU A 121 11.550 0.111 -6.255 1.00 0.00 C ATOM 1875 OE1 GLU A 121 12.781 -0.096 -6.298 1.00 0.00 O ATOM 1876 OE2 GLU A 121 10.786 -0.102 -7.219 1.00 0.00 O ATOM 0 H GLU A 121 11.435 1.417 -1.737 1.00 0.00 H new ATOM 0 HA GLU A 121 9.122 0.023 -2.959 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.094 -0.383 -3.481 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.799 -1.332 -4.182 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.908 0.902 -5.133 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.467 1.574 -4.695 1.00 0.00 H new ATOM 1883 N VAL A 122 9.208 -1.727 -1.229 1.00 0.00 N ATOM 1884 CA VAL A 122 9.213 -2.766 -0.206 1.00 0.00 C ATOM 1885 C VAL A 122 9.956 -4.008 -0.688 1.00 0.00 C ATOM 1886 O VAL A 122 9.410 -4.820 -1.433 1.00 0.00 O ATOM 1887 CB VAL A 122 7.781 -3.163 0.198 1.00 0.00 C ATOM 1888 CG1 VAL A 122 7.795 -3.983 1.479 1.00 0.00 C ATOM 1889 CG2 VAL A 122 6.911 -1.925 0.357 1.00 0.00 C ATOM 0 H VAL A 122 8.301 -1.575 -1.671 1.00 0.00 H new ATOM 0 HA VAL A 122 9.726 -2.353 0.662 1.00 0.00 H new ATOM 0 HB VAL A 122 7.356 -3.779 -0.594 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.774 -4.254 1.749 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.382 -4.888 1.325 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.238 -3.395 2.283 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.902 -2.223 0.643 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.332 -1.282 1.130 1.00 0.00 H new ATOM 0 HG23 VAL A 122 6.875 -1.382 -0.587 1.00 0.00 H new ATOM 1899 N ASN A 123 11.205 -4.147 -0.256 1.00 0.00 N ATOM 1900 CA ASN A 123 12.024 -5.291 -0.643 1.00 0.00 C ATOM 1901 C ASN A 123 12.162 -6.277 0.512 1.00 0.00 C ATOM 1902 O ASN A 123 12.769 -7.337 0.367 1.00 0.00 O ATOM 1903 CB ASN A 123 13.408 -4.823 -1.097 1.00 0.00 C ATOM 1904 CG ASN A 123 13.958 -3.712 -0.223 1.00 0.00 C ATOM 1905 OD1 ASN A 123 14.206 -3.909 0.967 1.00 0.00 O ATOM 1906 ND2 ASN A 123 14.151 -2.537 -0.811 1.00 0.00 N ATOM 0 H ASN A 123 11.672 -3.483 0.361 1.00 0.00 H new ATOM 0 HA ASN A 123 11.529 -5.797 -1.472 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.097 -5.668 -1.083 1.00 0.00 H new ATOM 0 HB3 ASN A 123 13.351 -4.476 -2.129 1.00 0.00 H new ATOM 0 HD21 ASN A 123 14.519 -1.752 -0.274 1.00 0.00 H new ATOM 0 HD22 ASN A 123 13.931 -2.419 -1.800 1.00 0.00 H new ATOM 1913 N ASN A 124 11.592 -5.921 1.659 1.00 0.00 N ATOM 1914 CA ASN A 124 11.651 -6.775 2.839 1.00 0.00 C ATOM 1915 C ASN A 124 10.340 -7.531 3.029 1.00 0.00 C ATOM 1916 O ASN A 124 9.900 -7.760 4.157 1.00 0.00 O ATOM 1917 CB ASN A 124 11.955 -5.939 4.084 1.00 0.00 C ATOM 1918 CG ASN A 124 10.821 -4.996 4.439 1.00 0.00 C ATOM 1919 OD1 ASN A 124 10.050 -4.581 3.573 1.00 0.00 O ATOM 1920 ND2 ASN A 124 10.715 -4.653 5.717 1.00 0.00 N ATOM 0 H ASN A 124 11.084 -5.047 1.796 1.00 0.00 H new ATOM 0 HA ASN A 124 12.451 -7.501 2.692 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.148 -6.604 4.926 1.00 0.00 H new ATOM 0 HB3 ASN A 124 12.865 -5.362 3.918 1.00 0.00 H new ATOM 0 HD21 ASN A 124 9.972 -4.021 6.016 1.00 0.00 H new ATOM 0 HD22 ASN A 124 11.377 -5.021 6.400 1.00 0.00 H new ATOM 1927 N LEU A 125 9.720 -7.918 1.920 1.00 0.00 N ATOM 1928 CA LEU A 125 8.459 -8.651 1.963 1.00 0.00 C ATOM 1929 C LEU A 125 8.651 -10.029 2.588 1.00 0.00 C ATOM 1930 O LEU A 125 9.733 -10.614 2.540 1.00 0.00 O ATOM 1931 CB LEU A 125 7.881 -8.793 0.553 1.00 0.00 C ATOM 1932 CG LEU A 125 7.526 -7.489 -0.162 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.400 -7.719 -1.660 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.238 -6.907 0.400 1.00 0.00 C ATOM 0 H LEU A 125 10.070 -7.736 0.979 1.00 0.00 H new ATOM 0 HA LEU A 125 7.760 -8.087 2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.601 -9.336 -0.060 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.983 -9.408 0.610 1.00 0.00 H new ATOM 0 HG LEU A 125 8.330 -6.773 0.008 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.147 -6.780 -2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.347 -8.091 -2.052 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.616 -8.452 -1.851 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.000 -5.979 -0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.425 -7.620 0.260 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.364 -6.704 1.464 1.00 0.00 H new ATOM 1946 N PRO A 126 7.576 -10.561 3.188 1.00 0.00 N ATOM 1947 CA PRO A 126 7.600 -11.878 3.832 1.00 0.00 C ATOM 1948 C PRO A 126 7.722 -13.015 2.823 1.00 0.00 C ATOM 1949 O PRO A 126 7.398 -12.851 1.646 1.00 0.00 O ATOM 1950 CB PRO A 126 6.251 -11.945 4.552 1.00 0.00 C ATOM 1951 CG PRO A 126 5.366 -11.024 3.785 1.00 0.00 C ATOM 1952 CD PRO A 126 6.254 -9.919 3.283 1.00 0.00 C ATOM 0 HA PRO A 126 8.458 -11.992 4.494 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.855 -12.961 4.558 1.00 0.00 H new ATOM 0 HB3 PRO A 126 6.341 -11.632 5.592 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.885 -11.545 2.957 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.571 -10.629 4.418 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.920 -9.542 2.316 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.267 -9.071 3.968 1.00 0.00 H new ATOM 1960 N VAL A 127 8.192 -14.167 3.290 1.00 0.00 N ATOM 1961 CA VAL A 127 8.355 -15.332 2.428 1.00 0.00 C ATOM 1962 C VAL A 127 7.048 -16.106 2.298 1.00 0.00 C ATOM 1963 O VAL A 127 6.754 -16.672 1.245 1.00 0.00 O ATOM 1964 CB VAL A 127 9.448 -16.276 2.963 1.00 0.00 C ATOM 1965 CG1 VAL A 127 9.037 -16.863 4.305 1.00 0.00 C ATOM 1966 CG2 VAL A 127 9.738 -17.379 1.956 1.00 0.00 C ATOM 0 H VAL A 127 8.467 -14.319 4.261 1.00 0.00 H new ATOM 0 HA VAL A 127 8.653 -14.962 1.447 1.00 0.00 H new ATOM 0 HB VAL A 127 10.361 -15.700 3.110 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.822 -17.527 4.667 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.884 -16.057 5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.111 -17.426 4.188 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.513 -18.037 2.350 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.830 -17.955 1.775 1.00 0.00 H new ATOM 0 HG23 VAL A 127 10.079 -16.937 1.020 1.00 0.00 H new ATOM 1976 N GLU A 128 6.269 -16.126 3.374 1.00 0.00 N ATOM 1977 CA GLU A 128 4.993 -16.832 3.379 1.00 0.00 C ATOM 1978 C GLU A 128 4.110 -16.369 2.223 1.00 0.00 C ATOM 1979 O GLU A 128 3.355 -17.155 1.651 1.00 0.00 O ATOM 1980 CB GLU A 128 4.268 -16.612 4.708 1.00 0.00 C ATOM 1981 CG GLU A 128 3.322 -17.742 5.080 1.00 0.00 C ATOM 1982 CD GLU A 128 1.947 -17.579 4.463 1.00 0.00 C ATOM 1983 OE1 GLU A 128 1.383 -16.469 4.555 1.00 0.00 O ATOM 1984 OE2 GLU A 128 1.435 -18.562 3.888 1.00 0.00 O ATOM 0 H GLU A 128 6.498 -15.662 4.253 1.00 0.00 H new ATOM 0 HA GLU A 128 5.196 -17.896 3.256 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.007 -16.493 5.500 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.705 -15.680 4.655 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.751 -18.691 4.757 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.226 -17.788 6.165 1.00 0.00 H new ATOM 1991 N SER A 129 4.211 -15.087 1.886 1.00 0.00 N ATOM 1992 CA SER A 129 3.419 -14.517 0.802 1.00 0.00 C ATOM 1993 C SER A 129 3.414 -15.442 -0.411 1.00 0.00 C ATOM 1994 O SER A 129 2.362 -15.919 -0.836 1.00 0.00 O ATOM 1995 CB SER A 129 3.968 -13.145 0.409 1.00 0.00 C ATOM 1996 OG SER A 129 5.370 -13.194 0.210 1.00 0.00 O ATOM 0 H SER A 129 4.833 -14.424 2.348 1.00 0.00 H new ATOM 0 HA SER A 129 2.394 -14.403 1.154 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.480 -12.802 -0.503 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.733 -12.419 1.188 1.00 0.00 H new ATOM 0 HG SER A 129 5.827 -12.991 1.053 1.00 0.00 H new ATOM 2002 N TRP A 130 4.596 -15.690 -0.962 1.00 0.00 N ATOM 2003 CA TRP A 130 4.729 -16.558 -2.127 1.00 0.00 C ATOM 2004 C TRP A 130 4.801 -18.023 -1.709 1.00 0.00 C ATOM 2005 O TRP A 130 4.119 -18.874 -2.281 1.00 0.00 O ATOM 2006 CB TRP A 130 5.976 -16.182 -2.929 1.00 0.00 C ATOM 2007 CG TRP A 130 7.254 -16.410 -2.182 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.982 -15.477 -1.499 1.00 0.00 C ATOM 2009 CD2 TRP A 130 7.957 -17.650 -2.043 1.00 0.00 C ATOM 2010 NE1 TRP A 130 9.094 -16.062 -0.944 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.102 -17.395 -1.263 1.00 0.00 C ATOM 2012 CE3 TRP A 130 7.730 -18.950 -2.500 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.015 -18.393 -0.932 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 8.637 -19.940 -2.171 1.00 0.00 C ATOM 2015 CH2 TRP A 130 9.767 -19.657 -1.393 1.00 0.00 C ATOM 0 H TRP A 130 5.476 -15.303 -0.622 1.00 0.00 H new ATOM 0 HA TRP A 130 3.848 -16.421 -2.754 1.00 0.00 H new ATOM 0 HB2 TRP A 130 5.994 -16.762 -3.852 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.913 -15.132 -3.214 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.721 -14.433 -1.409 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.799 -15.582 -0.385 1.00 0.00 H new ATOM 0 HE3 TRP A 130 6.861 -19.178 -3.100 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 10.887 -18.177 -0.333 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 8.472 -20.949 -2.520 1.00 0.00 H new ATOM 0 HH2 TRP A 130 10.456 -20.453 -1.152 1.00 0.00 H new ATOM 2026 N GLN A 131 5.629 -18.309 -0.710 1.00 0.00 N ATOM 2027 CA GLN A 131 5.789 -19.672 -0.218 1.00 0.00 C ATOM 2028 C GLN A 131 4.444 -20.266 0.187 1.00 0.00 C ATOM 2029 O GLN A 131 3.480 -19.539 0.431 1.00 0.00 O ATOM 2030 CB GLN A 131 6.750 -19.697 0.973 1.00 0.00 C ATOM 2031 CG GLN A 131 7.004 -21.092 1.520 1.00 0.00 C ATOM 2032 CD GLN A 131 8.237 -21.159 2.398 1.00 0.00 C ATOM 2033 OE1 GLN A 131 8.428 -20.326 3.285 1.00 0.00 O ATOM 2034 NE2 GLN A 131 9.084 -22.153 2.156 1.00 0.00 N ATOM 0 H GLN A 131 6.199 -17.616 -0.226 1.00 0.00 H new ATOM 0 HA GLN A 131 6.204 -20.276 -1.024 1.00 0.00 H new ATOM 0 HB2 GLN A 131 7.700 -19.255 0.672 1.00 0.00 H new ATOM 0 HB3 GLN A 131 6.345 -19.072 1.769 1.00 0.00 H new ATOM 0 HG2 GLN A 131 6.136 -21.417 2.094 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.116 -21.789 0.689 1.00 0.00 H new ATOM 0 HE21 GLN A 131 8.887 -22.821 1.411 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.932 -22.248 2.715 1.00 0.00 H new TER 2043 GLN A 131