USER MOD reduce.3.24.130724 H: found=0, std=0, add=628, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 625 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 NoAdj-H: A 24 HIS HD1 : A 24 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 50 HIS HD1 : A 50 HIS ND1 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 53 HIS HD1 : A 53 HIS ND1 : A 401 ZNZN :(H bumps) USER MOD Set 1.1: A 74 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 75 ASN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A 1 GLY N :NH3+ -128:sc= 0.0847 (180deg=0) USER MOD Single : A 2 SER OG : rot 7:sc= 0.398 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS : no HD1:sc= -0.892 K(o=-0.89,f=-2.2) USER MOD Single : A 20 THR OG1 : rot -160:sc= -0.314 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -3.4 K(o=-3.4,f=-16!) USER MOD Single : A 31 MET CE :methyl 158:sc= -0.99 (180deg=-2.38!) USER MOD Single : A 32 TYR OH : rot -76:sc= 0.441 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.97 K(o=-0.97,f=-2.3!) USER MOD Single : A 45 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0846) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -1.36 X(o=-1.4,f=-1.4) USER MOD Single : A 64 LYS NZ :NH3+ 160:sc= -0.0527 (180deg=-0.343) USER MOD Single : A 66 LYS NZ :NH3+ -130:sc= -0.905 (180deg=-3.14!) USER MOD Single : A 67 GLN : amide:sc= -1.52 X(o=-1.5,f=-1.2) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.800 12.822 21.652 1.00 0.00 N ATOM 2 CA GLY A 1 6.393 12.200 20.482 1.00 0.00 C ATOM 3 C GLY A 1 5.743 10.875 20.137 1.00 0.00 C ATOM 4 O GLY A 1 4.679 10.543 20.660 1.00 0.00 O ATOM 0 H1 GLY A 1 5.533 13.802 21.427 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.954 12.289 21.937 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.488 12.822 22.432 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.306 12.876 19.632 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.457 12.044 20.657 1.00 0.00 H new ATOM 8 N SER A 2 6.384 10.116 19.254 1.00 0.00 N ATOM 9 CA SER A 2 5.858 8.822 18.835 1.00 0.00 C ATOM 10 C SER A 2 6.988 7.889 18.408 1.00 0.00 C ATOM 11 O SER A 2 8.080 8.338 18.060 1.00 0.00 O ATOM 12 CB SER A 2 4.865 8.998 17.685 1.00 0.00 C ATOM 13 OG SER A 2 3.657 9.583 18.139 1.00 0.00 O ATOM 0 H SER A 2 7.268 10.375 18.815 1.00 0.00 H new ATOM 0 HA SER A 2 5.342 8.375 19.685 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.308 9.625 16.911 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.655 8.030 17.230 1.00 0.00 H new ATOM 0 HG SER A 2 3.756 9.854 19.076 1.00 0.00 H new ATOM 19 N SER A 3 6.717 6.589 18.438 1.00 0.00 N ATOM 20 CA SER A 3 7.710 5.591 18.058 1.00 0.00 C ATOM 21 C SER A 3 7.405 5.019 16.677 1.00 0.00 C ATOM 22 O SER A 3 8.278 4.954 15.813 1.00 0.00 O ATOM 23 CB SER A 3 7.754 4.464 19.092 1.00 0.00 C ATOM 24 OG SER A 3 8.682 4.753 20.123 1.00 0.00 O ATOM 0 H SER A 3 5.817 6.201 18.722 1.00 0.00 H new ATOM 0 HA SER A 3 8.684 6.079 18.022 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.762 4.321 19.521 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.028 3.529 18.604 1.00 0.00 H new ATOM 0 HG SER A 3 8.690 4.018 20.772 1.00 0.00 H new ATOM 30 N GLY A 4 6.158 4.605 16.478 1.00 0.00 N ATOM 31 CA GLY A 4 5.758 4.043 15.201 1.00 0.00 C ATOM 32 C GLY A 4 5.685 2.529 15.231 1.00 0.00 C ATOM 33 O GLY A 4 6.357 1.884 16.035 1.00 0.00 O ATOM 0 H GLY A 4 5.417 4.649 17.178 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.785 4.445 14.919 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.466 4.354 14.433 1.00 0.00 H new ATOM 37 N SER A 5 4.865 1.960 14.353 1.00 0.00 N ATOM 38 CA SER A 5 4.702 0.513 14.285 1.00 0.00 C ATOM 39 C SER A 5 4.620 0.042 12.836 1.00 0.00 C ATOM 40 O SER A 5 3.948 0.658 12.009 1.00 0.00 O ATOM 41 CB SER A 5 3.446 0.084 15.045 1.00 0.00 C ATOM 42 OG SER A 5 3.444 0.605 16.363 1.00 0.00 O ATOM 0 H SER A 5 4.303 2.480 13.679 1.00 0.00 H new ATOM 0 HA SER A 5 5.574 0.052 14.749 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.560 0.429 14.513 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.393 -1.004 15.081 1.00 0.00 H new ATOM 0 HG SER A 5 2.630 0.318 16.827 1.00 0.00 H new ATOM 48 N SER A 6 5.310 -1.054 12.537 1.00 0.00 N ATOM 49 CA SER A 6 5.319 -1.607 11.187 1.00 0.00 C ATOM 50 C SER A 6 5.445 -3.126 11.223 1.00 0.00 C ATOM 51 O SER A 6 5.562 -3.726 12.291 1.00 0.00 O ATOM 52 CB SER A 6 6.468 -1.007 10.375 1.00 0.00 C ATOM 53 OG SER A 6 7.723 -1.438 10.873 1.00 0.00 O ATOM 0 H SER A 6 5.870 -1.577 13.211 1.00 0.00 H new ATOM 0 HA SER A 6 4.374 -1.350 10.709 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.369 -1.297 9.329 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.413 0.081 10.410 1.00 0.00 H new ATOM 0 HG SER A 6 8.441 -1.042 10.336 1.00 0.00 H new ATOM 59 N GLY A 7 5.421 -3.744 10.046 1.00 0.00 N ATOM 60 CA GLY A 7 5.534 -5.189 9.964 1.00 0.00 C ATOM 61 C GLY A 7 5.099 -5.729 8.616 1.00 0.00 C ATOM 62 O GLY A 7 3.904 -5.845 8.341 1.00 0.00 O ATOM 0 H GLY A 7 5.325 -3.270 9.148 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.567 -5.481 10.153 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.927 -5.643 10.747 1.00 0.00 H new ATOM 66 N VAL A 8 6.071 -6.059 7.771 1.00 0.00 N ATOM 67 CA VAL A 8 5.782 -6.589 6.444 1.00 0.00 C ATOM 68 C VAL A 8 6.120 -8.073 6.359 1.00 0.00 C ATOM 69 O VAL A 8 7.177 -8.506 6.816 1.00 0.00 O ATOM 70 CB VAL A 8 6.566 -5.832 5.355 1.00 0.00 C ATOM 71 CG1 VAL A 8 6.140 -4.373 5.306 1.00 0.00 C ATOM 72 CG2 VAL A 8 8.063 -5.951 5.597 1.00 0.00 C ATOM 0 H VAL A 8 7.065 -5.969 7.982 1.00 0.00 H new ATOM 0 HA VAL A 8 4.714 -6.453 6.274 1.00 0.00 H new ATOM 0 HB VAL A 8 6.340 -6.284 4.389 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.705 -3.855 4.531 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.075 -4.312 5.081 1.00 0.00 H new ATOM 0 HG13 VAL A 8 6.334 -3.905 6.271 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.602 -5.411 4.819 1.00 0.00 H new ATOM 0 HG22 VAL A 8 8.309 -5.526 6.570 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.353 -7.002 5.576 1.00 0.00 H new ATOM 82 N GLU A 9 5.214 -8.848 5.771 1.00 0.00 N ATOM 83 CA GLU A 9 5.416 -10.285 5.627 1.00 0.00 C ATOM 84 C GLU A 9 5.596 -10.665 4.161 1.00 0.00 C ATOM 85 O GLU A 9 5.090 -10.002 3.255 1.00 0.00 O ATOM 86 CB GLU A 9 4.233 -11.051 6.222 1.00 0.00 C ATOM 87 CG GLU A 9 4.320 -11.232 7.728 1.00 0.00 C ATOM 88 CD GLU A 9 5.439 -12.169 8.139 1.00 0.00 C ATOM 89 OE1 GLU A 9 5.330 -13.381 7.859 1.00 0.00 O ATOM 90 OE2 GLU A 9 6.423 -11.690 8.741 1.00 0.00 O ATOM 0 H GLU A 9 4.334 -8.505 5.387 1.00 0.00 H new ATOM 0 HA GLU A 9 6.323 -10.554 6.168 1.00 0.00 H new ATOM 0 HB2 GLU A 9 3.311 -10.523 5.981 1.00 0.00 H new ATOM 0 HB3 GLU A 9 4.171 -12.031 5.750 1.00 0.00 H new ATOM 0 HG2 GLU A 9 4.473 -10.261 8.199 1.00 0.00 H new ATOM 0 HG3 GLU A 9 3.371 -11.620 8.099 1.00 0.00 H new ATOM 97 N PRO A 10 6.337 -11.757 3.919 1.00 0.00 N ATOM 98 CA PRO A 10 6.602 -12.250 2.565 1.00 0.00 C ATOM 99 C PRO A 10 5.355 -12.829 1.904 1.00 0.00 C ATOM 100 O PRO A 10 4.497 -13.406 2.573 1.00 0.00 O ATOM 101 CB PRO A 10 7.648 -13.345 2.785 1.00 0.00 C ATOM 102 CG PRO A 10 7.427 -13.805 4.184 1.00 0.00 C ATOM 103 CD PRO A 10 6.971 -12.595 4.951 1.00 0.00 C ATOM 0 HA PRO A 10 6.933 -11.453 1.899 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.521 -14.162 2.075 1.00 0.00 H new ATOM 0 HB3 PRO A 10 8.659 -12.960 2.650 1.00 0.00 H new ATOM 0 HG2 PRO A 10 6.678 -14.596 4.221 1.00 0.00 H new ATOM 0 HG3 PRO A 10 8.343 -14.214 4.610 1.00 0.00 H new ATOM 0 HD2 PRO A 10 6.268 -12.861 5.741 1.00 0.00 H new ATOM 0 HD3 PRO A 10 7.807 -12.083 5.427 1.00 0.00 H new ATOM 111 N VAL A 11 5.262 -12.673 0.588 1.00 0.00 N ATOM 112 CA VAL A 11 4.120 -13.182 -0.163 1.00 0.00 C ATOM 113 C VAL A 11 4.126 -14.706 -0.206 1.00 0.00 C ATOM 114 O VAL A 11 5.079 -15.335 -0.666 1.00 0.00 O ATOM 115 CB VAL A 11 4.110 -12.639 -1.605 1.00 0.00 C ATOM 116 CG1 VAL A 11 2.868 -13.112 -2.345 1.00 0.00 C ATOM 117 CG2 VAL A 11 4.193 -11.120 -1.602 1.00 0.00 C ATOM 0 H VAL A 11 5.963 -12.198 0.019 1.00 0.00 H new ATOM 0 HA VAL A 11 3.223 -12.839 0.353 1.00 0.00 H new ATOM 0 HB VAL A 11 4.984 -13.027 -2.127 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.878 -12.719 -3.362 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.857 -14.201 -2.378 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.978 -12.755 -1.827 1.00 0.00 H new ATOM 0 HG21 VAL A 11 4.185 -10.753 -2.628 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.339 -10.710 -1.063 1.00 0.00 H new ATOM 0 HG23 VAL A 11 5.115 -10.807 -1.112 1.00 0.00 H new ATOM 127 N PRO A 12 3.037 -15.315 0.284 1.00 0.00 N ATOM 128 CA PRO A 12 2.891 -16.774 0.312 1.00 0.00 C ATOM 129 C PRO A 12 2.715 -17.366 -1.082 1.00 0.00 C ATOM 130 O PRO A 12 2.840 -16.663 -2.085 1.00 0.00 O ATOM 131 CB PRO A 12 1.626 -16.988 1.147 1.00 0.00 C ATOM 132 CG PRO A 12 0.847 -15.728 0.984 1.00 0.00 C ATOM 133 CD PRO A 12 1.863 -14.628 0.848 1.00 0.00 C ATOM 0 HA PRO A 12 3.775 -17.264 0.719 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.061 -17.851 0.795 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.869 -17.171 2.194 1.00 0.00 H new ATOM 0 HG2 PRO A 12 0.205 -15.777 0.105 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.198 -15.556 1.843 1.00 0.00 H new ATOM 0 HD2 PRO A 12 1.509 -13.833 0.192 1.00 0.00 H new ATOM 0 HD3 PRO A 12 2.090 -14.169 1.810 1.00 0.00 H new ATOM 141 N ASP A 13 2.426 -18.661 -1.138 1.00 0.00 N ATOM 142 CA ASP A 13 2.231 -19.347 -2.409 1.00 0.00 C ATOM 143 C ASP A 13 0.955 -18.869 -3.096 1.00 0.00 C ATOM 144 O ASP A 13 -0.139 -19.355 -2.806 1.00 0.00 O ATOM 145 CB ASP A 13 2.172 -20.860 -2.193 1.00 0.00 C ATOM 146 CG ASP A 13 2.637 -21.637 -3.409 1.00 0.00 C ATOM 147 OD1 ASP A 13 3.375 -21.061 -4.235 1.00 0.00 O ATOM 148 OD2 ASP A 13 2.263 -22.822 -3.534 1.00 0.00 O ATOM 0 H ASP A 13 2.322 -19.257 -0.317 1.00 0.00 H new ATOM 0 HA ASP A 13 3.078 -19.112 -3.053 1.00 0.00 H new ATOM 0 HB2 ASP A 13 2.792 -21.126 -1.337 1.00 0.00 H new ATOM 0 HB3 ASP A 13 1.150 -21.150 -1.949 1.00 0.00 H new ATOM 153 N THR A 14 1.103 -17.912 -4.007 1.00 0.00 N ATOM 154 CA THR A 14 -0.037 -17.366 -4.733 1.00 0.00 C ATOM 155 C THR A 14 0.417 -16.423 -5.841 1.00 0.00 C ATOM 156 O THR A 14 1.458 -15.774 -5.729 1.00 0.00 O ATOM 157 CB THR A 14 -0.993 -16.610 -3.791 1.00 0.00 C ATOM 158 OG1 THR A 14 -2.135 -16.146 -4.520 1.00 0.00 O ATOM 159 CG2 THR A 14 -0.289 -15.430 -3.137 1.00 0.00 C ATOM 0 H THR A 14 2.001 -17.499 -4.259 1.00 0.00 H new ATOM 0 HA THR A 14 -0.565 -18.212 -5.173 1.00 0.00 H new ATOM 0 HB THR A 14 -1.316 -17.298 -3.010 1.00 0.00 H new ATOM 0 HG1 THR A 14 -2.738 -15.668 -3.913 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.984 -14.912 -2.477 1.00 0.00 H new ATOM 0 HG22 THR A 14 0.562 -15.789 -2.558 1.00 0.00 H new ATOM 0 HG23 THR A 14 0.060 -14.742 -3.907 1.00 0.00 H new ATOM 167 N HIS A 15 -0.370 -16.350 -6.910 1.00 0.00 N ATOM 168 CA HIS A 15 -0.048 -15.484 -8.038 1.00 0.00 C ATOM 169 C HIS A 15 -1.275 -15.258 -8.916 1.00 0.00 C ATOM 170 O HIS A 15 -1.817 -16.198 -9.499 1.00 0.00 O ATOM 171 CB HIS A 15 1.083 -16.092 -8.869 1.00 0.00 C ATOM 172 CG HIS A 15 0.672 -17.310 -9.639 1.00 0.00 C ATOM 173 ND1 HIS A 15 -0.111 -18.311 -9.104 1.00 0.00 N ATOM 174 CD2 HIS A 15 0.939 -17.683 -10.913 1.00 0.00 C ATOM 175 CE1 HIS A 15 -0.306 -19.248 -10.014 1.00 0.00 C ATOM 176 NE2 HIS A 15 0.320 -18.891 -11.121 1.00 0.00 N ATOM 0 H HIS A 15 -1.235 -16.880 -7.018 1.00 0.00 H new ATOM 0 HA HIS A 15 0.278 -14.521 -7.644 1.00 0.00 H new ATOM 0 HB2 HIS A 15 1.456 -15.341 -9.565 1.00 0.00 H new ATOM 0 HB3 HIS A 15 1.910 -16.352 -8.208 1.00 0.00 H new ATOM 0 HD2 HIS A 15 1.529 -17.133 -11.631 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -0.880 -20.153 -9.876 1.00 0.00 H new ATOM 0 HE2 HIS A 15 0.340 -19.426 -11.989 1.00 0.00 H new ATOM 184 N LEU A 16 -1.709 -14.006 -9.006 1.00 0.00 N ATOM 185 CA LEU A 16 -2.874 -13.655 -9.812 1.00 0.00 C ATOM 186 C LEU A 16 -2.469 -12.803 -11.010 1.00 0.00 C ATOM 187 O LEU A 16 -2.417 -11.576 -10.923 1.00 0.00 O ATOM 188 CB LEU A 16 -3.901 -12.906 -8.962 1.00 0.00 C ATOM 189 CG LEU A 16 -3.334 -11.928 -7.932 1.00 0.00 C ATOM 190 CD1 LEU A 16 -4.401 -10.938 -7.491 1.00 0.00 C ATOM 191 CD2 LEU A 16 -2.775 -12.681 -6.733 1.00 0.00 C ATOM 0 H LEU A 16 -1.272 -13.216 -8.531 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.322 -14.578 -10.180 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.564 -12.356 -9.630 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.514 -13.640 -8.438 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.521 -11.371 -8.398 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.979 -10.250 -6.758 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -4.755 -10.375 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.235 -11.478 -7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.376 -11.969 -6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.569 -13.264 -6.267 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.979 -13.349 -7.062 1.00 0.00 H new ATOM 203 N ARG A 17 -2.186 -13.461 -12.130 1.00 0.00 N ATOM 204 CA ARG A 17 -1.787 -12.764 -13.346 1.00 0.00 C ATOM 205 C ARG A 17 -2.969 -12.616 -14.300 1.00 0.00 C ATOM 206 O ARG A 17 -2.790 -12.465 -15.508 1.00 0.00 O ATOM 207 CB ARG A 17 -0.649 -13.514 -14.040 1.00 0.00 C ATOM 208 CG ARG A 17 -1.069 -14.854 -14.622 1.00 0.00 C ATOM 209 CD ARG A 17 -0.106 -15.317 -15.705 1.00 0.00 C ATOM 210 NE ARG A 17 -0.763 -16.166 -16.695 1.00 0.00 N ATOM 211 CZ ARG A 17 -0.115 -17.031 -17.467 1.00 0.00 C ATOM 212 NH1 ARG A 17 1.200 -17.161 -17.364 1.00 0.00 N ATOM 213 NH2 ARG A 17 -0.783 -17.769 -18.344 1.00 0.00 N ATOM 0 H ARG A 17 -2.226 -14.476 -12.220 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.440 -11.769 -13.067 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -0.248 -12.890 -14.839 1.00 0.00 H new ATOM 0 HB3 ARG A 17 0.158 -13.675 -13.325 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.111 -15.600 -13.828 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.074 -14.773 -15.037 1.00 0.00 H new ATOM 0 HD2 ARG A 17 0.326 -14.448 -16.202 1.00 0.00 H new ATOM 0 HD3 ARG A 17 0.718 -15.865 -15.247 1.00 0.00 H new ATOM 0 HE ARG A 17 -1.775 -16.091 -16.799 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.717 -16.596 -16.690 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.695 -17.826 -17.958 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.795 -17.672 -18.426 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -0.284 -18.433 -18.936 1.00 0.00 H new ATOM 227 N GLY A 18 -4.178 -12.661 -13.748 1.00 0.00 N ATOM 228 CA GLY A 18 -5.371 -12.532 -14.564 1.00 0.00 C ATOM 229 C GLY A 18 -6.630 -12.391 -13.731 1.00 0.00 C ATOM 230 O GLY A 18 -7.626 -13.071 -13.980 1.00 0.00 O ATOM 0 H GLY A 18 -4.352 -12.784 -12.751 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.270 -11.663 -15.215 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.462 -13.405 -15.210 1.00 0.00 H new ATOM 234 N ILE A 19 -6.586 -11.507 -12.740 1.00 0.00 N ATOM 235 CA ILE A 19 -7.732 -11.280 -11.868 1.00 0.00 C ATOM 236 C ILE A 19 -7.861 -9.806 -11.502 1.00 0.00 C ATOM 237 O ILE A 19 -6.862 -9.098 -11.367 1.00 0.00 O ATOM 238 CB ILE A 19 -7.629 -12.112 -10.576 1.00 0.00 C ATOM 239 CG1 ILE A 19 -7.324 -13.574 -10.907 1.00 0.00 C ATOM 240 CG2 ILE A 19 -8.917 -12.003 -9.772 1.00 0.00 C ATOM 241 CD1 ILE A 19 -6.965 -14.405 -9.696 1.00 0.00 C ATOM 0 H ILE A 19 -5.769 -10.936 -12.521 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.617 -11.592 -12.422 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.812 -11.718 -9.972 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -8.192 -14.016 -11.397 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.501 -13.612 -11.621 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.829 -12.596 -8.862 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.095 -10.960 -9.510 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.751 -12.374 -10.368 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.761 -15.430 -10.006 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.079 -13.988 -9.218 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -7.796 -14.397 -8.990 1.00 0.00 H new ATOM 253 N THR A 20 -9.098 -9.347 -11.341 1.00 0.00 N ATOM 254 CA THR A 20 -9.359 -7.957 -10.989 1.00 0.00 C ATOM 255 C THR A 20 -8.369 -7.460 -9.941 1.00 0.00 C ATOM 256 O THR A 20 -7.696 -8.254 -9.283 1.00 0.00 O ATOM 257 CB THR A 20 -10.791 -7.772 -10.454 1.00 0.00 C ATOM 258 OG1 THR A 20 -10.999 -8.607 -9.310 1.00 0.00 O ATOM 259 CG2 THR A 20 -11.817 -8.108 -11.526 1.00 0.00 C ATOM 0 H THR A 20 -9.936 -9.919 -11.449 1.00 0.00 H new ATOM 0 HA THR A 20 -9.242 -7.373 -11.902 1.00 0.00 H new ATOM 0 HB THR A 20 -10.916 -6.728 -10.168 1.00 0.00 H new ATOM 0 HG1 THR A 20 -11.960 -8.734 -9.168 1.00 0.00 H new ATOM 0 HG21 THR A 20 -12.821 -7.970 -11.125 1.00 0.00 H new ATOM 0 HG22 THR A 20 -11.675 -7.451 -12.384 1.00 0.00 H new ATOM 0 HG23 THR A 20 -11.691 -9.145 -11.838 1.00 0.00 H new ATOM 267 N CYS A 21 -8.285 -6.143 -9.791 1.00 0.00 N ATOM 268 CA CYS A 21 -7.378 -5.539 -8.823 1.00 0.00 C ATOM 269 C CYS A 21 -7.830 -5.834 -7.396 1.00 0.00 C ATOM 270 O CYS A 21 -9.028 -5.892 -7.112 1.00 0.00 O ATOM 271 CB CYS A 21 -7.297 -4.027 -9.042 1.00 0.00 C ATOM 272 SG CYS A 21 -6.597 -3.108 -7.634 1.00 0.00 S ATOM 0 H CYS A 21 -8.835 -5.473 -10.328 1.00 0.00 H new ATOM 0 HA CYS A 21 -6.389 -5.974 -8.969 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -6.692 -3.831 -9.927 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -8.297 -3.647 -9.249 1.00 0.00 H new ATOM 277 N LEU A 22 -6.866 -6.019 -6.502 1.00 0.00 N ATOM 278 CA LEU A 22 -7.164 -6.308 -5.103 1.00 0.00 C ATOM 279 C LEU A 22 -8.138 -5.283 -4.531 1.00 0.00 C ATOM 280 O LEU A 22 -9.292 -5.602 -4.244 1.00 0.00 O ATOM 281 CB LEU A 22 -5.876 -6.319 -4.278 1.00 0.00 C ATOM 282 CG LEU A 22 -4.952 -7.520 -4.492 1.00 0.00 C ATOM 283 CD1 LEU A 22 -3.540 -7.196 -4.030 1.00 0.00 C ATOM 284 CD2 LEU A 22 -5.488 -8.742 -3.761 1.00 0.00 C ATOM 0 H LEU A 22 -5.871 -5.974 -6.720 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.629 -7.292 -5.052 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.317 -5.411 -4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.144 -6.276 -3.222 1.00 0.00 H new ATOM 0 HG LEU A 22 -4.920 -7.745 -5.558 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.897 -8.062 -4.190 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.156 -6.349 -4.599 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.553 -6.945 -2.969 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.818 -9.586 -3.924 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.550 -8.529 -2.694 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.480 -8.987 -4.141 1.00 0.00 H new ATOM 296 N ASP A 23 -7.666 -4.051 -4.372 1.00 0.00 N ATOM 297 CA ASP A 23 -8.497 -2.978 -3.837 1.00 0.00 C ATOM 298 C ASP A 23 -9.776 -2.824 -4.653 1.00 0.00 C ATOM 299 O ASP A 23 -10.864 -2.663 -4.098 1.00 0.00 O ATOM 300 CB ASP A 23 -7.720 -1.660 -3.828 1.00 0.00 C ATOM 301 CG ASP A 23 -6.725 -1.582 -2.688 1.00 0.00 C ATOM 302 OD1 ASP A 23 -6.020 -2.585 -2.446 1.00 0.00 O ATOM 303 OD2 ASP A 23 -6.651 -0.519 -2.036 1.00 0.00 O ATOM 0 H ASP A 23 -6.713 -3.771 -4.606 1.00 0.00 H new ATOM 0 HA ASP A 23 -8.770 -3.237 -2.814 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -7.193 -1.546 -4.775 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.421 -0.829 -3.752 1.00 0.00 H new ATOM 308 N HIS A 24 -9.639 -2.872 -5.975 1.00 0.00 N ATOM 309 CA HIS A 24 -10.785 -2.737 -6.868 1.00 0.00 C ATOM 310 C HIS A 24 -11.008 -4.020 -7.662 1.00 0.00 C ATOM 311 O HIS A 24 -10.321 -4.276 -8.651 1.00 0.00 O ATOM 312 CB HIS A 24 -10.578 -1.561 -7.822 1.00 0.00 C ATOM 313 CG HIS A 24 -10.001 -0.348 -7.161 1.00 0.00 C ATOM 314 ND1 HIS A 24 -8.648 -0.087 -7.115 1.00 0.00 N ATOM 315 CD2 HIS A 24 -10.603 0.681 -6.519 1.00 0.00 C ATOM 316 CE1 HIS A 24 -8.442 1.048 -6.471 1.00 0.00 C ATOM 317 NE2 HIS A 24 -9.612 1.534 -6.100 1.00 0.00 N ATOM 0 H HIS A 24 -8.746 -3.003 -6.451 1.00 0.00 H new ATOM 0 HA HIS A 24 -11.670 -2.549 -6.260 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -9.918 -1.872 -8.631 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -11.534 -1.298 -8.274 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -11.665 0.807 -6.365 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -7.480 1.501 -6.281 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -9.756 2.403 -5.585 1.00 0.00 H new ATOM 325 N GLU A 25 -11.972 -4.823 -7.223 1.00 0.00 N ATOM 326 CA GLU A 25 -12.284 -6.080 -7.893 1.00 0.00 C ATOM 327 C GLU A 25 -13.176 -5.842 -9.108 1.00 0.00 C ATOM 328 O GLU A 25 -14.080 -6.627 -9.390 1.00 0.00 O ATOM 329 CB GLU A 25 -12.970 -7.045 -6.923 1.00 0.00 C ATOM 330 CG GLU A 25 -14.366 -6.606 -6.515 1.00 0.00 C ATOM 331 CD GLU A 25 -15.281 -7.778 -6.213 1.00 0.00 C ATOM 332 OE1 GLU A 25 -15.802 -8.386 -7.171 1.00 0.00 O ATOM 333 OE2 GLU A 25 -15.474 -8.086 -5.019 1.00 0.00 O ATOM 0 H GLU A 25 -12.550 -4.625 -6.406 1.00 0.00 H new ATOM 0 HA GLU A 25 -11.348 -6.523 -8.233 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -13.028 -8.031 -7.385 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -12.355 -7.147 -6.029 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -14.299 -5.966 -5.635 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -14.802 -6.006 -7.313 1.00 0.00 H new ATOM 340 N ASN A 26 -12.914 -4.753 -9.823 1.00 0.00 N ATOM 341 CA ASN A 26 -13.693 -4.410 -11.007 1.00 0.00 C ATOM 342 C ASN A 26 -12.780 -4.041 -12.172 1.00 0.00 C ATOM 343 O ASN A 26 -13.030 -4.424 -13.314 1.00 0.00 O ATOM 344 CB ASN A 26 -14.642 -3.249 -10.700 1.00 0.00 C ATOM 345 CG ASN A 26 -15.840 -3.682 -9.878 1.00 0.00 C ATOM 346 OD1 ASN A 26 -16.650 -4.495 -10.322 1.00 0.00 O ATOM 347 ND2 ASN A 26 -15.957 -3.140 -8.671 1.00 0.00 N ATOM 0 H ASN A 26 -12.168 -4.093 -9.603 1.00 0.00 H new ATOM 0 HA ASN A 26 -14.279 -5.284 -11.291 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.098 -2.472 -10.163 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.987 -2.809 -11.635 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -16.742 -3.394 -8.072 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -15.261 -2.470 -8.343 1.00 0.00 H new ATOM 354 N GLU A 27 -11.720 -3.296 -11.873 1.00 0.00 N ATOM 355 CA GLU A 27 -10.770 -2.875 -12.895 1.00 0.00 C ATOM 356 C GLU A 27 -9.601 -3.852 -12.986 1.00 0.00 C ATOM 357 O GLU A 27 -8.863 -4.047 -12.019 1.00 0.00 O ATOM 358 CB GLU A 27 -10.251 -1.468 -12.593 1.00 0.00 C ATOM 359 CG GLU A 27 -11.338 -0.406 -12.591 1.00 0.00 C ATOM 360 CD GLU A 27 -11.758 0.002 -13.990 1.00 0.00 C ATOM 361 OE1 GLU A 27 -10.970 0.694 -14.668 1.00 0.00 O ATOM 362 OE2 GLU A 27 -12.875 -0.371 -14.406 1.00 0.00 O ATOM 0 H GLU A 27 -11.498 -2.972 -10.932 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.288 -2.864 -13.854 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.757 -1.473 -11.621 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.496 -1.202 -13.333 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.207 -0.782 -12.050 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -10.982 0.472 -12.052 1.00 0.00 H new ATOM 369 N LYS A 28 -9.438 -4.463 -14.154 1.00 0.00 N ATOM 370 CA LYS A 28 -8.359 -5.419 -14.374 1.00 0.00 C ATOM 371 C LYS A 28 -7.000 -4.729 -14.313 1.00 0.00 C ATOM 372 O LYS A 28 -6.693 -3.867 -15.137 1.00 0.00 O ATOM 373 CB LYS A 28 -8.531 -6.112 -15.727 1.00 0.00 C ATOM 374 CG LYS A 28 -9.706 -7.074 -15.773 1.00 0.00 C ATOM 375 CD LYS A 28 -9.310 -8.461 -15.296 1.00 0.00 C ATOM 376 CE LYS A 28 -10.532 -9.321 -15.010 1.00 0.00 C ATOM 377 NZ LYS A 28 -11.098 -9.911 -16.255 1.00 0.00 N ATOM 0 H LYS A 28 -10.040 -4.313 -14.964 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.403 -6.167 -13.582 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -8.662 -5.354 -16.500 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.617 -6.656 -15.966 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -10.515 -6.692 -15.151 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -10.089 -7.134 -16.792 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.692 -8.945 -16.053 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.703 -8.378 -14.394 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -10.260 -10.120 -14.320 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -11.293 -8.718 -14.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.929 -10.490 -16.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.381 -9.148 -16.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.380 -10.507 -16.714 1.00 0.00 H new ATOM 391 N VAL A 29 -6.188 -5.116 -13.334 1.00 0.00 N ATOM 392 CA VAL A 29 -4.860 -4.536 -13.168 1.00 0.00 C ATOM 393 C VAL A 29 -4.240 -4.188 -14.517 1.00 0.00 C ATOM 394 O VAL A 29 -4.216 -5.010 -15.431 1.00 0.00 O ATOM 395 CB VAL A 29 -3.919 -5.495 -12.416 1.00 0.00 C ATOM 396 CG1 VAL A 29 -4.085 -5.336 -10.912 1.00 0.00 C ATOM 397 CG2 VAL A 29 -4.175 -6.934 -12.839 1.00 0.00 C ATOM 0 H VAL A 29 -6.426 -5.828 -12.644 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.983 -3.625 -12.582 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.890 -5.242 -12.673 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.412 -6.022 -10.397 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.847 -4.311 -10.626 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.115 -5.561 -10.634 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.501 -7.598 -12.297 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -5.207 -7.202 -12.613 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -4.000 -7.035 -13.910 1.00 0.00 H new ATOM 407 N ASN A 30 -3.739 -2.962 -14.633 1.00 0.00 N ATOM 408 CA ASN A 30 -3.119 -2.504 -15.871 1.00 0.00 C ATOM 409 C ASN A 30 -1.701 -2.001 -15.614 1.00 0.00 C ATOM 410 O ASN A 30 -0.863 -1.993 -16.515 1.00 0.00 O ATOM 411 CB ASN A 30 -3.959 -1.394 -16.506 1.00 0.00 C ATOM 412 CG ASN A 30 -4.132 -0.201 -15.587 1.00 0.00 C ATOM 413 OD1 ASN A 30 -3.881 -0.289 -14.384 1.00 0.00 O ATOM 414 ND2 ASN A 30 -4.564 0.922 -16.149 1.00 0.00 N ATOM 0 H ASN A 30 -3.750 -2.269 -13.885 1.00 0.00 H new ATOM 0 HA ASN A 30 -3.068 -3.349 -16.558 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.486 -1.069 -17.433 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -4.939 -1.790 -16.770 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -4.700 1.757 -15.580 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.759 0.949 -17.150 1.00 0.00 H new ATOM 421 N MET A 31 -1.442 -1.583 -14.380 1.00 0.00 N ATOM 422 CA MET A 31 -0.125 -1.080 -14.005 1.00 0.00 C ATOM 423 C MET A 31 0.539 -2.002 -12.988 1.00 0.00 C ATOM 424 O MET A 31 -0.084 -2.934 -12.481 1.00 0.00 O ATOM 425 CB MET A 31 -0.241 0.334 -13.430 1.00 0.00 C ATOM 426 CG MET A 31 -0.122 1.428 -14.479 1.00 0.00 C ATOM 427 SD MET A 31 -1.713 1.871 -15.202 1.00 0.00 S ATOM 428 CE MET A 31 -2.328 3.030 -13.983 1.00 0.00 C ATOM 0 H MET A 31 -2.126 -1.582 -13.623 1.00 0.00 H new ATOM 0 HA MET A 31 0.495 -1.051 -14.901 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.200 0.433 -12.921 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.535 0.477 -12.678 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.326 2.313 -14.027 1.00 0.00 H new ATOM 0 HG3 MET A 31 0.552 1.097 -15.269 1.00 0.00 H new ATOM 0 HE1 MET A 31 -3.079 3.675 -14.440 1.00 0.00 H new ATOM 0 HE2 MET A 31 -2.776 2.482 -13.154 1.00 0.00 H new ATOM 0 HE3 MET A 31 -1.504 3.639 -13.612 1.00 0.00 H new ATOM 438 N TYR A 32 1.808 -1.736 -12.695 1.00 0.00 N ATOM 439 CA TYR A 32 2.557 -2.544 -11.741 1.00 0.00 C ATOM 440 C TYR A 32 3.423 -1.665 -10.844 1.00 0.00 C ATOM 441 O TYR A 32 4.358 -1.012 -11.310 1.00 0.00 O ATOM 442 CB TYR A 32 3.433 -3.559 -12.478 1.00 0.00 C ATOM 443 CG TYR A 32 4.623 -4.030 -11.672 1.00 0.00 C ATOM 444 CD1 TYR A 32 4.456 -4.873 -10.580 1.00 0.00 C ATOM 445 CD2 TYR A 32 5.912 -3.632 -12.002 1.00 0.00 C ATOM 446 CE1 TYR A 32 5.540 -5.306 -9.840 1.00 0.00 C ATOM 447 CE2 TYR A 32 7.002 -4.061 -11.269 1.00 0.00 C ATOM 448 CZ TYR A 32 6.811 -4.897 -10.189 1.00 0.00 C ATOM 449 OH TYR A 32 7.893 -5.326 -9.455 1.00 0.00 O ATOM 0 H TYR A 32 2.338 -0.967 -13.105 1.00 0.00 H new ATOM 0 HA TYR A 32 1.842 -3.077 -11.115 1.00 0.00 H new ATOM 0 HB2 TYR A 32 2.825 -4.422 -12.750 1.00 0.00 H new ATOM 0 HB3 TYR A 32 3.788 -3.113 -13.407 1.00 0.00 H new ATOM 0 HD1 TYR A 32 3.463 -5.195 -10.305 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.065 -2.976 -12.846 1.00 0.00 H new ATOM 0 HE1 TYR A 32 5.393 -5.961 -8.994 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.998 -3.743 -11.540 1.00 0.00 H new ATOM 0 HH TYR A 32 7.928 -4.836 -8.607 1.00 0.00 H new ATOM 459 N CYS A 33 3.106 -1.653 -9.554 1.00 0.00 N ATOM 460 CA CYS A 33 3.853 -0.856 -8.589 1.00 0.00 C ATOM 461 C CYS A 33 5.226 -1.466 -8.326 1.00 0.00 C ATOM 462 O CYS A 33 5.336 -2.626 -7.928 1.00 0.00 O ATOM 463 CB CYS A 33 3.073 -0.741 -7.278 1.00 0.00 C ATOM 464 SG CYS A 33 3.536 0.697 -6.261 1.00 0.00 S ATOM 0 H CYS A 33 2.335 -2.187 -9.152 1.00 0.00 H new ATOM 0 HA CYS A 33 3.993 0.140 -9.009 1.00 0.00 H new ATOM 0 HB2 CYS A 33 2.008 -0.684 -7.505 1.00 0.00 H new ATOM 0 HB3 CYS A 33 3.227 -1.649 -6.695 1.00 0.00 H new ATOM 469 N VAL A 34 6.272 -0.677 -8.550 1.00 0.00 N ATOM 470 CA VAL A 34 7.638 -1.138 -8.336 1.00 0.00 C ATOM 471 C VAL A 34 7.952 -1.253 -6.848 1.00 0.00 C ATOM 472 O VAL A 34 8.240 -2.340 -6.346 1.00 0.00 O ATOM 473 CB VAL A 34 8.660 -0.192 -8.993 1.00 0.00 C ATOM 474 CG1 VAL A 34 10.068 -0.754 -8.866 1.00 0.00 C ATOM 475 CG2 VAL A 34 8.302 0.048 -10.452 1.00 0.00 C ATOM 0 H VAL A 34 6.199 0.285 -8.880 1.00 0.00 H new ATOM 0 HA VAL A 34 7.716 -2.122 -8.799 1.00 0.00 H new ATOM 0 HB VAL A 34 8.629 0.765 -8.473 1.00 0.00 H new ATOM 0 HG11 VAL A 34 10.776 -0.071 -9.336 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.320 -0.869 -7.812 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.118 -1.725 -9.359 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.035 0.719 -10.901 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.303 -0.901 -10.988 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.312 0.499 -10.514 1.00 0.00 H new ATOM 485 N SER A 35 7.895 -0.125 -6.148 1.00 0.00 N ATOM 486 CA SER A 35 8.176 -0.099 -4.717 1.00 0.00 C ATOM 487 C SER A 35 7.387 -1.181 -3.988 1.00 0.00 C ATOM 488 O SER A 35 7.954 -1.992 -3.255 1.00 0.00 O ATOM 489 CB SER A 35 7.838 1.275 -4.135 1.00 0.00 C ATOM 490 OG SER A 35 8.788 2.247 -4.537 1.00 0.00 O ATOM 0 H SER A 35 7.657 0.783 -6.548 1.00 0.00 H new ATOM 0 HA SER A 35 9.239 -0.294 -4.577 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.843 1.577 -4.462 1.00 0.00 H new ATOM 0 HB3 SER A 35 7.812 1.216 -3.047 1.00 0.00 H new ATOM 0 HG SER A 35 8.549 3.117 -4.153 1.00 0.00 H new ATOM 496 N ASP A 36 6.074 -1.188 -4.194 1.00 0.00 N ATOM 497 CA ASP A 36 5.205 -2.170 -3.558 1.00 0.00 C ATOM 498 C ASP A 36 5.307 -3.521 -4.259 1.00 0.00 C ATOM 499 O ASP A 36 4.814 -4.531 -3.757 1.00 0.00 O ATOM 500 CB ASP A 36 3.755 -1.684 -3.569 1.00 0.00 C ATOM 501 CG ASP A 36 3.499 -0.603 -2.537 1.00 0.00 C ATOM 502 OD1 ASP A 36 3.815 -0.830 -1.351 1.00 0.00 O ATOM 503 OD2 ASP A 36 2.981 0.469 -2.916 1.00 0.00 O ATOM 0 H ASP A 36 5.589 -0.524 -4.797 1.00 0.00 H new ATOM 0 HA ASP A 36 5.531 -2.291 -2.525 1.00 0.00 H new ATOM 0 HB2 ASP A 36 3.511 -1.301 -4.560 1.00 0.00 H new ATOM 0 HB3 ASP A 36 3.091 -2.527 -3.380 1.00 0.00 H new ATOM 508 N ASP A 37 5.948 -3.531 -5.423 1.00 0.00 N ATOM 509 CA ASP A 37 6.114 -4.757 -6.194 1.00 0.00 C ATOM 510 C ASP A 37 4.812 -5.550 -6.242 1.00 0.00 C ATOM 511 O ASP A 37 4.808 -6.766 -6.058 1.00 0.00 O ATOM 512 CB ASP A 37 7.227 -5.616 -5.592 1.00 0.00 C ATOM 513 CG ASP A 37 8.606 -5.041 -5.850 1.00 0.00 C ATOM 514 OD1 ASP A 37 9.095 -5.163 -6.993 1.00 0.00 O ATOM 515 OD2 ASP A 37 9.196 -4.470 -4.909 1.00 0.00 O ATOM 0 H ASP A 37 6.361 -2.703 -5.853 1.00 0.00 H new ATOM 0 HA ASP A 37 6.388 -4.482 -7.213 1.00 0.00 H new ATOM 0 HB2 ASP A 37 7.070 -5.708 -4.517 1.00 0.00 H new ATOM 0 HB3 ASP A 37 7.172 -6.621 -6.009 1.00 0.00 H new ATOM 520 N GLN A 38 3.708 -4.851 -6.489 1.00 0.00 N ATOM 521 CA GLN A 38 2.399 -5.490 -6.559 1.00 0.00 C ATOM 522 C GLN A 38 1.619 -5.002 -7.775 1.00 0.00 C ATOM 523 O GLN A 38 1.925 -3.952 -8.341 1.00 0.00 O ATOM 524 CB GLN A 38 1.604 -5.213 -5.282 1.00 0.00 C ATOM 525 CG GLN A 38 0.495 -6.220 -5.026 1.00 0.00 C ATOM 526 CD GLN A 38 0.958 -7.654 -5.192 1.00 0.00 C ATOM 527 OE1 GLN A 38 2.136 -7.963 -5.009 1.00 0.00 O ATOM 528 NE2 GLN A 38 0.031 -8.539 -5.540 1.00 0.00 N ATOM 0 H GLN A 38 3.694 -3.843 -6.644 1.00 0.00 H new ATOM 0 HA GLN A 38 2.552 -6.565 -6.657 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.286 -5.212 -4.432 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.170 -4.215 -5.343 1.00 0.00 H new ATOM 0 HG2 GLN A 38 0.110 -6.081 -4.016 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -0.331 -6.027 -5.711 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -0.933 -8.239 -5.681 1.00 0.00 H new ATOM 0 HE22 GLN A 38 0.283 -9.519 -5.666 1.00 0.00 H new ATOM 537 N LEU A 39 0.610 -5.769 -8.172 1.00 0.00 N ATOM 538 CA LEU A 39 -0.215 -5.415 -9.321 1.00 0.00 C ATOM 539 C LEU A 39 -1.295 -4.412 -8.928 1.00 0.00 C ATOM 540 O LEU A 39 -1.959 -4.570 -7.902 1.00 0.00 O ATOM 541 CB LEU A 39 -0.859 -6.667 -9.918 1.00 0.00 C ATOM 542 CG LEU A 39 0.005 -7.466 -10.894 1.00 0.00 C ATOM 543 CD1 LEU A 39 -0.671 -8.780 -11.254 1.00 0.00 C ATOM 544 CD2 LEU A 39 0.289 -6.649 -12.146 1.00 0.00 C ATOM 0 H LEU A 39 0.343 -6.641 -7.715 1.00 0.00 H new ATOM 0 HA LEU A 39 0.429 -4.953 -10.070 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.152 -7.326 -9.100 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -1.773 -6.371 -10.432 1.00 0.00 H new ATOM 0 HG LEU A 39 0.954 -7.692 -10.408 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -0.041 -9.335 -11.949 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.822 -9.371 -10.351 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.635 -8.577 -11.720 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.905 -7.233 -12.830 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.651 -6.392 -12.634 1.00 0.00 H new ATOM 0 HD23 LEU A 39 0.817 -5.735 -11.872 1.00 0.00 H new ATOM 556 N ILE A 40 -1.468 -3.383 -9.750 1.00 0.00 N ATOM 557 CA ILE A 40 -2.470 -2.357 -9.489 1.00 0.00 C ATOM 558 C ILE A 40 -3.260 -2.026 -10.751 1.00 0.00 C ATOM 559 O ILE A 40 -2.929 -2.490 -11.843 1.00 0.00 O ATOM 560 CB ILE A 40 -1.827 -1.067 -8.947 1.00 0.00 C ATOM 561 CG1 ILE A 40 -0.886 -0.462 -9.991 1.00 0.00 C ATOM 562 CG2 ILE A 40 -1.078 -1.351 -7.653 1.00 0.00 C ATOM 563 CD1 ILE A 40 -0.583 1.001 -9.756 1.00 0.00 C ATOM 0 H ILE A 40 -0.927 -3.237 -10.603 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.146 -2.761 -8.735 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.617 -0.346 -8.736 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.049 -1.022 -9.994 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.330 -0.578 -10.980 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.629 -0.429 -7.283 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.772 -1.741 -6.909 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.295 -2.086 -7.840 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.089 1.363 -10.534 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.510 1.573 -9.783 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -0.110 1.123 -8.782 1.00 0.00 H new ATOM 575 N CYS A 41 -4.305 -1.221 -10.594 1.00 0.00 N ATOM 576 CA CYS A 41 -5.142 -0.826 -11.720 1.00 0.00 C ATOM 577 C CYS A 41 -5.048 0.677 -11.967 1.00 0.00 C ATOM 578 O CYS A 41 -4.272 1.376 -11.317 1.00 0.00 O ATOM 579 CB CYS A 41 -6.597 -1.222 -11.464 1.00 0.00 C ATOM 580 SG CYS A 41 -7.433 -0.209 -10.202 1.00 0.00 S ATOM 0 H CYS A 41 -4.593 -0.829 -9.697 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.782 -1.345 -12.608 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -7.152 -1.149 -12.399 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -6.629 -2.267 -11.155 1.00 0.00 H new ATOM 585 N ALA A 42 -5.846 1.167 -12.910 1.00 0.00 N ATOM 586 CA ALA A 42 -5.856 2.587 -13.241 1.00 0.00 C ATOM 587 C ALA A 42 -6.151 3.436 -12.010 1.00 0.00 C ATOM 588 O ALA A 42 -5.373 4.321 -11.652 1.00 0.00 O ATOM 589 CB ALA A 42 -6.876 2.867 -14.335 1.00 0.00 C ATOM 0 H ALA A 42 -6.494 0.602 -13.458 1.00 0.00 H new ATOM 0 HA ALA A 42 -4.865 2.856 -13.606 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -6.873 3.931 -14.572 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.619 2.296 -15.227 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -7.868 2.575 -13.991 1.00 0.00 H new ATOM 595 N LEU A 43 -7.279 3.161 -11.365 1.00 0.00 N ATOM 596 CA LEU A 43 -7.678 3.901 -10.172 1.00 0.00 C ATOM 597 C LEU A 43 -6.526 3.991 -9.177 1.00 0.00 C ATOM 598 O LEU A 43 -6.110 5.084 -8.790 1.00 0.00 O ATOM 599 CB LEU A 43 -8.886 3.232 -9.513 1.00 0.00 C ATOM 600 CG LEU A 43 -10.223 3.398 -10.236 1.00 0.00 C ATOM 601 CD1 LEU A 43 -11.205 2.324 -9.794 1.00 0.00 C ATOM 602 CD2 LEU A 43 -10.797 4.785 -9.984 1.00 0.00 C ATOM 0 H LEU A 43 -7.934 2.432 -11.647 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.951 4.912 -10.475 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.678 2.166 -9.416 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.990 3.629 -8.503 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.052 3.287 -11.307 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.151 2.458 -10.319 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.797 1.340 -10.026 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.372 2.403 -8.720 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -11.749 4.885 -10.506 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.953 4.925 -8.914 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.101 5.539 -10.351 1.00 0.00 H new ATOM 614 N CYS A 44 -6.013 2.836 -8.767 1.00 0.00 N ATOM 615 CA CYS A 44 -4.908 2.784 -7.818 1.00 0.00 C ATOM 616 C CYS A 44 -3.954 3.956 -8.028 1.00 0.00 C ATOM 617 O CYS A 44 -3.435 4.529 -7.070 1.00 0.00 O ATOM 618 CB CYS A 44 -4.149 1.463 -7.960 1.00 0.00 C ATOM 619 SG CYS A 44 -4.988 0.037 -7.197 1.00 0.00 S ATOM 0 H CYS A 44 -6.345 1.923 -9.077 1.00 0.00 H new ATOM 0 HA CYS A 44 -5.322 2.852 -6.812 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -3.996 1.257 -9.019 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -3.162 1.573 -7.511 1.00 0.00 H new ATOM 624 N LYS A 45 -3.728 4.309 -9.289 1.00 0.00 N ATOM 625 CA LYS A 45 -2.838 5.413 -9.628 1.00 0.00 C ATOM 626 C LYS A 45 -3.620 6.714 -9.781 1.00 0.00 C ATOM 627 O LYS A 45 -3.367 7.689 -9.072 1.00 0.00 O ATOM 628 CB LYS A 45 -2.080 5.107 -10.921 1.00 0.00 C ATOM 629 CG LYS A 45 -1.298 6.291 -11.463 1.00 0.00 C ATOM 630 CD LYS A 45 0.100 6.354 -10.871 1.00 0.00 C ATOM 631 CE LYS A 45 1.074 7.043 -11.814 1.00 0.00 C ATOM 632 NZ LYS A 45 0.617 8.412 -12.181 1.00 0.00 N ATOM 0 H LYS A 45 -4.150 3.846 -10.094 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.122 5.532 -8.815 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -1.393 4.280 -10.742 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -2.790 4.774 -11.678 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -1.231 6.218 -12.549 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -1.831 7.214 -11.238 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.071 6.889 -9.922 1.00 0.00 H new ATOM 0 HD3 LYS A 45 0.451 5.345 -10.657 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.055 7.102 -11.343 1.00 0.00 H new ATOM 0 HE3 LYS A 45 1.190 6.444 -12.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.354 8.886 -12.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -0.256 8.348 -12.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 0.434 8.960 -11.316 1.00 0.00 H new ATOM 646 N LEU A 46 -4.572 6.721 -10.708 1.00 0.00 N ATOM 647 CA LEU A 46 -5.392 7.903 -10.952 1.00 0.00 C ATOM 648 C LEU A 46 -5.575 8.713 -9.673 1.00 0.00 C ATOM 649 O LEU A 46 -5.111 9.849 -9.574 1.00 0.00 O ATOM 650 CB LEU A 46 -6.757 7.493 -11.509 1.00 0.00 C ATOM 651 CG LEU A 46 -6.860 7.399 -13.032 1.00 0.00 C ATOM 652 CD1 LEU A 46 -6.243 8.626 -13.685 1.00 0.00 C ATOM 653 CD2 LEU A 46 -6.187 6.130 -13.534 1.00 0.00 C ATOM 0 H LEU A 46 -4.795 5.923 -11.302 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.879 8.527 -11.684 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.023 6.524 -11.086 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.500 8.209 -11.158 1.00 0.00 H new ATOM 0 HG LEU A 46 -7.915 7.359 -13.305 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.325 8.542 -14.769 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.769 9.520 -13.350 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -5.192 8.697 -13.405 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.270 6.079 -14.620 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.135 6.140 -13.250 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.674 5.261 -13.092 1.00 0.00 H new ATOM 665 N VAL A 47 -6.252 8.121 -8.695 1.00 0.00 N ATOM 666 CA VAL A 47 -6.493 8.787 -7.420 1.00 0.00 C ATOM 667 C VAL A 47 -5.999 7.937 -6.254 1.00 0.00 C ATOM 668 O VAL A 47 -5.657 8.458 -5.194 1.00 0.00 O ATOM 669 CB VAL A 47 -7.989 9.093 -7.220 1.00 0.00 C ATOM 670 CG1 VAL A 47 -8.480 10.070 -8.278 1.00 0.00 C ATOM 671 CG2 VAL A 47 -8.803 7.808 -7.250 1.00 0.00 C ATOM 0 H VAL A 47 -6.644 7.181 -8.761 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.938 9.725 -7.443 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.121 9.557 -6.243 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -9.539 10.274 -8.121 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -7.916 11.000 -8.204 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.337 9.637 -9.268 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.858 8.042 -7.107 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -8.668 7.314 -8.212 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.467 7.146 -6.452 1.00 0.00 H new ATOM 681 N GLY A 48 -5.964 6.624 -6.459 1.00 0.00 N ATOM 682 CA GLY A 48 -5.510 5.722 -5.417 1.00 0.00 C ATOM 683 C GLY A 48 -4.240 6.205 -4.745 1.00 0.00 C ATOM 684 O GLY A 48 -3.619 7.168 -5.196 1.00 0.00 O ATOM 0 H GLY A 48 -6.242 6.169 -7.328 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -6.295 5.613 -4.668 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -5.338 4.734 -5.845 1.00 0.00 H new ATOM 688 N ARG A 49 -3.853 5.536 -3.664 1.00 0.00 N ATOM 689 CA ARG A 49 -2.650 5.904 -2.927 1.00 0.00 C ATOM 690 C ARG A 49 -1.402 5.668 -3.772 1.00 0.00 C ATOM 691 O ARG A 49 -0.330 6.199 -3.478 1.00 0.00 O ATOM 692 CB ARG A 49 -2.558 5.105 -1.627 1.00 0.00 C ATOM 693 CG ARG A 49 -1.137 4.942 -1.111 1.00 0.00 C ATOM 694 CD ARG A 49 -1.115 4.679 0.386 1.00 0.00 C ATOM 695 NE ARG A 49 -1.244 5.910 1.161 1.00 0.00 N ATOM 696 CZ ARG A 49 -1.582 5.938 2.445 1.00 0.00 C ATOM 697 NH1 ARG A 49 -1.822 4.808 3.096 1.00 0.00 N ATOM 698 NH2 ARG A 49 -1.679 7.098 3.082 1.00 0.00 N ATOM 0 H ARG A 49 -4.355 4.736 -3.279 1.00 0.00 H new ATOM 0 HA ARG A 49 -2.711 6.966 -2.688 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -3.158 5.600 -0.863 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -2.993 4.118 -1.785 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -0.651 4.118 -1.633 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -0.563 5.842 -1.332 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -1.927 4.000 0.647 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -0.184 4.179 0.652 1.00 0.00 H new ATOM 0 HE ARG A 49 -1.065 6.797 0.690 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -1.747 3.914 2.611 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -2.081 4.833 4.082 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -1.494 7.970 2.585 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -1.939 7.118 4.068 1.00 0.00 H new ATOM 712 N HIS A 50 -1.547 4.867 -4.823 1.00 0.00 N ATOM 713 CA HIS A 50 -0.432 4.560 -5.711 1.00 0.00 C ATOM 714 C HIS A 50 -0.247 5.661 -6.751 1.00 0.00 C ATOM 715 O HIS A 50 0.023 5.384 -7.920 1.00 0.00 O ATOM 716 CB HIS A 50 -0.660 3.218 -6.406 1.00 0.00 C ATOM 717 CG HIS A 50 -0.810 2.069 -5.457 1.00 0.00 C ATOM 718 ND1 HIS A 50 0.254 1.310 -5.020 1.00 0.00 N ATOM 719 CD2 HIS A 50 -1.909 1.553 -4.859 1.00 0.00 C ATOM 720 CE1 HIS A 50 -0.184 0.375 -4.195 1.00 0.00 C ATOM 721 NE2 HIS A 50 -1.493 0.501 -4.080 1.00 0.00 N ATOM 0 H HIS A 50 -2.426 4.419 -5.080 1.00 0.00 H new ATOM 0 HA HIS A 50 0.474 4.498 -5.108 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -1.555 3.286 -7.025 1.00 0.00 H new ATOM 0 HB3 HIS A 50 0.177 3.018 -7.076 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -2.924 1.903 -4.973 1.00 0.00 H new ATOM 0 HE1 HIS A 50 0.425 -0.366 -3.699 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -2.097 -0.087 -3.506 1.00 0.00 H new ATOM 729 N ARG A 51 -0.394 6.908 -6.319 1.00 0.00 N ATOM 730 CA ARG A 51 -0.246 8.050 -7.213 1.00 0.00 C ATOM 731 C ARG A 51 1.206 8.519 -7.260 1.00 0.00 C ATOM 732 O ARG A 51 1.701 8.933 -8.308 1.00 0.00 O ATOM 733 CB ARG A 51 -1.150 9.199 -6.763 1.00 0.00 C ATOM 734 CG ARG A 51 -1.368 10.257 -7.832 1.00 0.00 C ATOM 735 CD ARG A 51 -2.467 11.230 -7.436 1.00 0.00 C ATOM 736 NE ARG A 51 -1.950 12.354 -6.659 1.00 0.00 N ATOM 737 CZ ARG A 51 -1.365 13.416 -7.202 1.00 0.00 C ATOM 738 NH1 ARG A 51 -1.224 13.498 -8.518 1.00 0.00 N ATOM 739 NH2 ARG A 51 -0.921 14.398 -6.429 1.00 0.00 N ATOM 0 H ARG A 51 -0.616 7.154 -5.354 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.541 7.736 -8.214 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.116 8.794 -6.463 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -0.714 9.669 -5.882 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.440 10.803 -8.000 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -1.629 9.775 -8.774 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.959 11.606 -8.333 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -3.224 10.704 -6.854 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.043 12.322 -5.644 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -1.565 12.745 -9.115 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -0.775 14.314 -8.933 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.028 14.338 -5.416 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.472 15.213 -6.847 1.00 0.00 H new ATOM 753 N ASP A 52 1.881 8.450 -6.118 1.00 0.00 N ATOM 754 CA ASP A 52 3.276 8.867 -6.028 1.00 0.00 C ATOM 755 C ASP A 52 4.208 7.744 -6.472 1.00 0.00 C ATOM 756 O ASP A 52 5.140 7.965 -7.245 1.00 0.00 O ATOM 757 CB ASP A 52 3.613 9.291 -4.598 1.00 0.00 C ATOM 758 CG ASP A 52 4.742 10.300 -4.544 1.00 0.00 C ATOM 759 OD1 ASP A 52 4.521 11.460 -4.951 1.00 0.00 O ATOM 760 OD2 ASP A 52 5.847 9.930 -4.094 1.00 0.00 O ATOM 0 H ASP A 52 1.485 8.109 -5.242 1.00 0.00 H new ATOM 0 HA ASP A 52 3.419 9.718 -6.694 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.726 9.718 -4.130 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.888 8.411 -4.017 1.00 0.00 H new ATOM 765 N HIS A 53 3.950 6.537 -5.977 1.00 0.00 N ATOM 766 CA HIS A 53 4.767 5.379 -6.322 1.00 0.00 C ATOM 767 C HIS A 53 5.073 5.356 -7.816 1.00 0.00 C ATOM 768 O HIS A 53 4.309 5.885 -8.623 1.00 0.00 O ATOM 769 CB HIS A 53 4.056 4.088 -5.915 1.00 0.00 C ATOM 770 CG HIS A 53 3.824 3.972 -4.440 1.00 0.00 C ATOM 771 ND1 HIS A 53 3.067 2.967 -3.874 1.00 0.00 N ATOM 772 CD2 HIS A 53 4.254 4.740 -3.412 1.00 0.00 C ATOM 773 CE1 HIS A 53 3.041 3.124 -2.563 1.00 0.00 C ATOM 774 NE2 HIS A 53 3.754 4.193 -2.257 1.00 0.00 N ATOM 0 H HIS A 53 3.182 6.336 -5.336 1.00 0.00 H new ATOM 0 HA HIS A 53 5.708 5.454 -5.778 1.00 0.00 H new ATOM 0 HB2 HIS A 53 3.097 4.033 -6.431 1.00 0.00 H new ATOM 0 HB3 HIS A 53 4.648 3.236 -6.250 1.00 0.00 H new ATOM 0 HD2 HIS A 53 4.875 5.620 -3.487 1.00 0.00 H new ATOM 0 HE1 HIS A 53 2.525 2.487 -1.860 1.00 0.00 H new ATOM 0 HE2 HIS A 53 3.908 4.553 -1.315 1.00 0.00 H new ATOM 782 N GLN A 54 6.194 4.740 -8.177 1.00 0.00 N ATOM 783 CA GLN A 54 6.601 4.650 -9.574 1.00 0.00 C ATOM 784 C GLN A 54 5.956 3.445 -10.252 1.00 0.00 C ATOM 785 O GLN A 54 6.439 2.320 -10.131 1.00 0.00 O ATOM 786 CB GLN A 54 8.124 4.554 -9.679 1.00 0.00 C ATOM 787 CG GLN A 54 8.628 4.412 -11.106 1.00 0.00 C ATOM 788 CD GLN A 54 10.138 4.310 -11.184 1.00 0.00 C ATOM 789 OE1 GLN A 54 10.857 5.017 -10.478 1.00 0.00 O ATOM 790 NE2 GLN A 54 10.628 3.427 -12.046 1.00 0.00 N ATOM 0 H GLN A 54 6.837 4.296 -7.521 1.00 0.00 H new ATOM 0 HA GLN A 54 6.265 5.554 -10.083 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.567 5.444 -9.233 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.467 3.700 -9.095 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.184 3.525 -11.557 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.295 5.269 -11.692 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.995 2.861 -12.612 1.00 0.00 H new ATOM 0 HE22 GLN A 54 11.637 3.314 -12.142 1.00 0.00 H new ATOM 799 N VAL A 55 4.861 3.690 -10.965 1.00 0.00 N ATOM 800 CA VAL A 55 4.150 2.625 -11.663 1.00 0.00 C ATOM 801 C VAL A 55 4.684 2.445 -13.079 1.00 0.00 C ATOM 802 O VAL A 55 5.054 3.413 -13.742 1.00 0.00 O ATOM 803 CB VAL A 55 2.638 2.909 -11.728 1.00 0.00 C ATOM 804 CG1 VAL A 55 2.028 2.879 -10.335 1.00 0.00 C ATOM 805 CG2 VAL A 55 2.376 4.246 -12.405 1.00 0.00 C ATOM 0 H VAL A 55 4.447 4.616 -11.074 1.00 0.00 H new ATOM 0 HA VAL A 55 4.316 1.709 -11.096 1.00 0.00 H new ATOM 0 HB VAL A 55 2.165 2.127 -12.322 1.00 0.00 H new ATOM 0 HG11 VAL A 55 0.959 3.082 -10.401 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.184 1.896 -9.891 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.503 3.638 -9.713 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.302 4.431 -12.442 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.862 5.041 -11.840 1.00 0.00 H new ATOM 0 HG23 VAL A 55 2.776 4.225 -13.419 1.00 0.00 H new ATOM 815 N ALA A 56 4.721 1.198 -13.538 1.00 0.00 N ATOM 816 CA ALA A 56 5.207 0.890 -14.877 1.00 0.00 C ATOM 817 C ALA A 56 4.138 0.177 -15.698 1.00 0.00 C ATOM 818 O ALA A 56 3.840 -0.994 -15.463 1.00 0.00 O ATOM 819 CB ALA A 56 6.468 0.043 -14.799 1.00 0.00 C ATOM 0 H ALA A 56 4.420 0.384 -13.001 1.00 0.00 H new ATOM 0 HA ALA A 56 5.444 1.830 -15.376 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.820 -0.179 -15.806 1.00 0.00 H new ATOM 0 HB2 ALA A 56 7.240 0.589 -14.257 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.249 -0.889 -14.277 1.00 0.00 H new ATOM 825 N SER A 57 3.565 0.890 -16.662 1.00 0.00 N ATOM 826 CA SER A 57 2.526 0.326 -17.516 1.00 0.00 C ATOM 827 C SER A 57 2.983 -0.995 -18.127 1.00 0.00 C ATOM 828 O SER A 57 4.176 -1.217 -18.335 1.00 0.00 O ATOM 829 CB SER A 57 2.156 1.313 -18.625 1.00 0.00 C ATOM 830 OG SER A 57 1.192 2.248 -18.175 1.00 0.00 O ATOM 0 H SER A 57 3.803 1.860 -16.871 1.00 0.00 H new ATOM 0 HA SER A 57 1.647 0.137 -16.900 1.00 0.00 H new ATOM 0 HB2 SER A 57 3.049 1.840 -18.960 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.766 0.769 -19.485 1.00 0.00 H new ATOM 0 HG SER A 57 0.974 2.868 -18.902 1.00 0.00 H new ATOM 836 N LEU A 58 2.025 -1.870 -18.412 1.00 0.00 N ATOM 837 CA LEU A 58 2.327 -3.171 -18.999 1.00 0.00 C ATOM 838 C LEU A 58 2.012 -3.181 -20.491 1.00 0.00 C ATOM 839 O LEU A 58 0.966 -3.672 -20.912 1.00 0.00 O ATOM 840 CB LEU A 58 1.531 -4.269 -18.291 1.00 0.00 C ATOM 841 CG LEU A 58 1.439 -4.157 -16.769 1.00 0.00 C ATOM 842 CD1 LEU A 58 0.502 -5.217 -16.211 1.00 0.00 C ATOM 843 CD2 LEU A 58 2.820 -4.280 -16.141 1.00 0.00 C ATOM 0 H LEU A 58 1.033 -1.702 -18.246 1.00 0.00 H new ATOM 0 HA LEU A 58 3.392 -3.362 -18.870 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.519 -4.275 -18.696 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.979 -5.231 -18.538 1.00 0.00 H new ATOM 0 HG LEU A 58 1.034 -3.176 -16.520 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.449 -5.122 -15.126 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.493 -5.083 -16.636 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.877 -6.207 -16.470 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.736 -4.198 -15.057 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.252 -5.247 -16.399 1.00 0.00 H new ATOM 0 HD23 LEU A 58 3.463 -3.483 -16.516 1.00 0.00 H new ATOM 855 N ASN A 59 2.927 -2.636 -21.287 1.00 0.00 N ATOM 856 CA ASN A 59 2.748 -2.584 -22.734 1.00 0.00 C ATOM 857 C ASN A 59 1.279 -2.385 -23.093 1.00 0.00 C ATOM 858 O ASN A 59 0.760 -3.028 -24.006 1.00 0.00 O ATOM 859 CB ASN A 59 3.274 -3.867 -23.380 1.00 0.00 C ATOM 860 CG ASN A 59 2.701 -5.115 -22.737 1.00 0.00 C ATOM 861 OD1 ASN A 59 1.505 -5.386 -22.840 1.00 0.00 O ATOM 862 ND2 ASN A 59 3.555 -5.882 -22.069 1.00 0.00 N ATOM 0 H ASN A 59 3.799 -2.224 -20.955 1.00 0.00 H new ATOM 0 HA ASN A 59 3.315 -1.735 -23.115 1.00 0.00 H new ATOM 0 HB2 ASN A 59 3.028 -3.863 -24.442 1.00 0.00 H new ATOM 0 HB3 ASN A 59 4.361 -3.889 -23.305 1.00 0.00 H new ATOM 0 HD21 ASN A 59 3.227 -6.735 -21.615 1.00 0.00 H new ATOM 0 HD22 ASN A 59 4.539 -5.618 -22.010 1.00 0.00 H new ATOM 869 N ASP A 60 0.615 -1.490 -22.370 1.00 0.00 N ATOM 870 CA ASP A 60 -0.794 -1.205 -22.613 1.00 0.00 C ATOM 871 C ASP A 60 -0.980 -0.476 -23.941 1.00 0.00 C ATOM 872 O ASP A 60 -0.010 -0.047 -24.566 1.00 0.00 O ATOM 873 CB ASP A 60 -1.371 -0.366 -21.472 1.00 0.00 C ATOM 874 CG ASP A 60 -1.700 -1.200 -20.250 1.00 0.00 C ATOM 875 OD1 ASP A 60 -2.044 -2.389 -20.417 1.00 0.00 O ATOM 876 OD2 ASP A 60 -1.614 -0.664 -19.125 1.00 0.00 O ATOM 0 H ASP A 60 1.030 -0.949 -21.611 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.328 -2.154 -22.662 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -0.656 0.409 -21.197 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -2.273 0.140 -21.817 1.00 0.00 H new ATOM 881 N ARG A 61 -2.232 -0.341 -24.366 1.00 0.00 N ATOM 882 CA ARG A 61 -2.544 0.334 -25.620 1.00 0.00 C ATOM 883 C ARG A 61 -3.672 1.344 -25.428 1.00 0.00 C ATOM 884 O ARG A 61 -4.661 1.064 -24.750 1.00 0.00 O ATOM 885 CB ARG A 61 -2.936 -0.688 -26.689 1.00 0.00 C ATOM 886 CG ARG A 61 -2.566 -0.264 -28.101 1.00 0.00 C ATOM 887 CD ARG A 61 -3.551 0.754 -28.653 1.00 0.00 C ATOM 888 NE ARG A 61 -3.666 0.673 -30.107 1.00 0.00 N ATOM 889 CZ ARG A 61 -4.191 -0.367 -30.746 1.00 0.00 C ATOM 890 NH1 ARG A 61 -4.648 -1.407 -30.062 1.00 0.00 N ATOM 891 NH2 ARG A 61 -4.260 -0.367 -32.071 1.00 0.00 N ATOM 0 H ARG A 61 -3.046 -0.690 -23.861 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.653 0.869 -25.948 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -2.452 -1.639 -26.466 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -4.011 -0.858 -26.640 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -1.562 0.161 -28.103 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -2.543 -1.139 -28.751 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.530 0.592 -28.202 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -3.232 1.757 -28.370 1.00 0.00 H new ATOM 0 HE ARG A 61 -3.325 1.458 -30.662 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -4.597 -1.410 -29.043 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -5.051 -2.204 -30.555 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -3.910 0.432 -32.600 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -4.663 -1.166 -32.561 1.00 0.00 H new ATOM 905 N PHE A 62 -3.515 2.519 -26.029 1.00 0.00 N ATOM 906 CA PHE A 62 -4.519 3.571 -25.924 1.00 0.00 C ATOM 907 C PHE A 62 -4.673 4.032 -24.477 1.00 0.00 C ATOM 908 O PHE A 62 -5.788 4.216 -23.989 1.00 0.00 O ATOM 909 CB PHE A 62 -5.865 3.077 -26.459 1.00 0.00 C ATOM 910 CG PHE A 62 -6.713 4.169 -27.047 1.00 0.00 C ATOM 911 CD1 PHE A 62 -6.473 4.637 -28.329 1.00 0.00 C ATOM 912 CD2 PHE A 62 -7.751 4.726 -26.317 1.00 0.00 C ATOM 913 CE1 PHE A 62 -7.251 5.642 -28.871 1.00 0.00 C ATOM 914 CE2 PHE A 62 -8.533 5.731 -26.855 1.00 0.00 C ATOM 915 CZ PHE A 62 -8.283 6.189 -28.134 1.00 0.00 C ATOM 0 H PHE A 62 -2.702 2.766 -26.594 1.00 0.00 H new ATOM 0 HA PHE A 62 -4.186 4.418 -26.524 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -5.688 2.316 -27.219 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -6.415 2.597 -25.649 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -5.669 4.211 -28.911 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -7.951 4.371 -25.317 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -7.052 6.000 -29.870 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -9.339 6.158 -26.276 1.00 0.00 H new ATOM 0 HZ PHE A 62 -8.893 6.973 -28.557 1.00 0.00 H new ATOM 925 N GLU A 63 -3.545 4.217 -23.798 1.00 0.00 N ATOM 926 CA GLU A 63 -3.555 4.655 -22.407 1.00 0.00 C ATOM 927 C GLU A 63 -3.518 6.178 -22.317 1.00 0.00 C ATOM 928 O GLU A 63 -2.553 6.759 -21.818 1.00 0.00 O ATOM 929 CB GLU A 63 -2.365 4.059 -21.653 1.00 0.00 C ATOM 930 CG GLU A 63 -1.022 4.368 -22.294 1.00 0.00 C ATOM 931 CD GLU A 63 0.136 4.207 -21.328 1.00 0.00 C ATOM 932 OE1 GLU A 63 0.078 4.799 -20.230 1.00 0.00 O ATOM 933 OE2 GLU A 63 1.099 3.490 -21.670 1.00 0.00 O ATOM 0 H GLU A 63 -2.614 4.071 -24.188 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.479 4.303 -21.948 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.366 4.438 -20.631 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.489 2.978 -21.592 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.871 3.709 -23.149 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.032 5.389 -22.676 1.00 0.00 H new ATOM 940 N LYS A 64 -4.575 6.820 -22.802 1.00 0.00 N ATOM 941 CA LYS A 64 -4.666 8.275 -22.777 1.00 0.00 C ATOM 942 C LYS A 64 -6.014 8.726 -22.223 1.00 0.00 C ATOM 943 O LYS A 64 -6.380 9.897 -22.331 1.00 0.00 O ATOM 944 CB LYS A 64 -4.464 8.844 -24.183 1.00 0.00 C ATOM 945 CG LYS A 64 -5.367 8.214 -25.229 1.00 0.00 C ATOM 946 CD LYS A 64 -6.672 8.979 -25.373 1.00 0.00 C ATOM 947 CE LYS A 64 -6.515 10.184 -26.288 1.00 0.00 C ATOM 948 NZ LYS A 64 -6.284 9.779 -27.702 1.00 0.00 N ATOM 0 H LYS A 64 -5.382 6.355 -23.218 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.880 8.652 -22.123 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -4.643 9.919 -24.160 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -3.425 8.700 -24.478 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -4.851 8.189 -26.189 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -5.578 7.181 -24.954 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -7.441 8.317 -25.771 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -7.012 9.308 -24.391 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -7.410 10.804 -26.229 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -5.681 10.795 -25.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -6.516 10.573 -28.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.286 9.516 -27.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -6.889 8.965 -27.933 1.00 0.00 H new ATOM 962 N LEU A 65 -6.748 7.791 -21.630 1.00 0.00 N ATOM 963 CA LEU A 65 -8.055 8.093 -21.057 1.00 0.00 C ATOM 964 C LEU A 65 -7.911 8.827 -19.728 1.00 0.00 C ATOM 965 O LEU A 65 -6.908 8.680 -19.030 1.00 0.00 O ATOM 966 CB LEU A 65 -8.856 6.805 -20.857 1.00 0.00 C ATOM 967 CG LEU A 65 -9.740 6.376 -22.029 1.00 0.00 C ATOM 968 CD1 LEU A 65 -10.792 7.434 -22.320 1.00 0.00 C ATOM 969 CD2 LEU A 65 -8.893 6.108 -23.265 1.00 0.00 C ATOM 0 H LEU A 65 -6.460 6.817 -21.533 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.588 8.741 -21.753 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.158 5.997 -20.639 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.487 6.926 -19.977 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.250 5.453 -21.755 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.411 7.111 -23.157 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.418 7.577 -21.439 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.302 8.374 -22.573 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.538 5.804 -24.089 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.355 7.015 -23.541 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.179 5.313 -23.051 1.00 0.00 H new ATOM 981 N LYS A 66 -8.922 9.618 -19.382 1.00 0.00 N ATOM 982 CA LYS A 66 -8.911 10.373 -18.135 1.00 0.00 C ATOM 983 C LYS A 66 -10.257 11.050 -17.897 1.00 0.00 C ATOM 984 O LYS A 66 -10.947 11.427 -18.844 1.00 0.00 O ATOM 985 CB LYS A 66 -7.797 11.423 -18.161 1.00 0.00 C ATOM 986 CG LYS A 66 -7.568 12.098 -16.819 1.00 0.00 C ATOM 987 CD LYS A 66 -6.356 13.015 -16.857 1.00 0.00 C ATOM 988 CE LYS A 66 -6.627 14.263 -17.684 1.00 0.00 C ATOM 989 NZ LYS A 66 -6.458 14.010 -19.141 1.00 0.00 N ATOM 0 H LYS A 66 -9.759 9.752 -19.949 1.00 0.00 H new ATOM 0 HA LYS A 66 -8.726 9.675 -17.318 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -6.870 10.949 -18.483 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -8.042 12.182 -18.904 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.452 12.673 -16.544 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -7.428 11.340 -16.048 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -6.084 13.302 -15.841 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -5.505 12.478 -17.275 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -7.641 14.613 -17.491 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -5.950 15.059 -17.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -5.844 14.742 -19.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -6.025 13.075 -19.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -7.387 14.036 -19.608 1.00 0.00 H new ATOM 1003 N GLN A 67 -10.622 11.201 -16.628 1.00 0.00 N ATOM 1004 CA GLN A 67 -11.885 11.834 -16.268 1.00 0.00 C ATOM 1005 C GLN A 67 -11.666 12.946 -15.248 1.00 0.00 C ATOM 1006 O GLN A 67 -10.544 13.176 -14.795 1.00 0.00 O ATOM 1007 CB GLN A 67 -12.858 10.795 -15.705 1.00 0.00 C ATOM 1008 CG GLN A 67 -12.308 10.030 -14.512 1.00 0.00 C ATOM 1009 CD GLN A 67 -13.388 9.299 -13.739 1.00 0.00 C ATOM 1010 OE1 GLN A 67 -14.271 8.673 -14.326 1.00 0.00 O ATOM 1011 NE2 GLN A 67 -13.323 9.375 -12.415 1.00 0.00 N ATOM 0 H GLN A 67 -10.062 10.894 -15.833 1.00 0.00 H new ATOM 0 HA GLN A 67 -12.312 12.272 -17.170 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -13.781 11.295 -15.411 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -13.116 10.087 -16.492 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -11.564 9.312 -14.857 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -11.796 10.724 -13.845 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -12.573 9.905 -11.971 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -14.023 8.903 -11.842 1.00 0.00 H new ATOM 1020 N THR A 68 -12.744 13.636 -14.890 1.00 0.00 N ATOM 1021 CA THR A 68 -12.669 14.726 -13.925 1.00 0.00 C ATOM 1022 C THR A 68 -13.594 14.475 -12.740 1.00 0.00 C ATOM 1023 O THR A 68 -13.625 15.255 -11.787 1.00 0.00 O ATOM 1024 CB THR A 68 -13.036 16.075 -14.572 1.00 0.00 C ATOM 1025 OG1 THR A 68 -14.182 15.918 -15.416 1.00 0.00 O ATOM 1026 CG2 THR A 68 -11.872 16.620 -15.385 1.00 0.00 C ATOM 0 H THR A 68 -13.680 13.459 -15.254 1.00 0.00 H new ATOM 0 HA THR A 68 -11.638 14.768 -13.575 1.00 0.00 H new ATOM 0 HB THR A 68 -13.266 16.784 -13.776 1.00 0.00 H new ATOM 0 HG1 THR A 68 -14.410 16.780 -15.822 1.00 0.00 H new ATOM 0 HG21 THR A 68 -12.155 17.573 -15.832 1.00 0.00 H new ATOM 0 HG22 THR A 68 -11.010 16.766 -14.734 1.00 0.00 H new ATOM 0 HG23 THR A 68 -11.615 15.912 -16.173 1.00 0.00 H new ATOM 1034 N LEU A 69 -14.346 13.382 -12.803 1.00 0.00 N ATOM 1035 CA LEU A 69 -15.272 13.027 -11.733 1.00 0.00 C ATOM 1036 C LEU A 69 -15.709 11.571 -11.852 1.00 0.00 C ATOM 1037 O LEU A 69 -15.470 10.922 -12.870 1.00 0.00 O ATOM 1038 CB LEU A 69 -16.497 13.943 -11.768 1.00 0.00 C ATOM 1039 CG LEU A 69 -17.147 14.144 -13.137 1.00 0.00 C ATOM 1040 CD1 LEU A 69 -17.838 12.867 -13.592 1.00 0.00 C ATOM 1041 CD2 LEU A 69 -18.135 15.300 -13.095 1.00 0.00 C ATOM 0 H LEU A 69 -14.333 12.726 -13.584 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.756 13.156 -10.782 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.247 13.539 -11.088 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.207 14.919 -11.379 1.00 0.00 H new ATOM 0 HG LEU A 69 -16.365 14.387 -13.856 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -18.295 13.029 -14.568 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.106 12.063 -13.663 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -18.609 12.594 -12.871 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -18.587 15.428 -14.078 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.913 15.087 -12.362 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -17.613 16.215 -12.814 1.00 0.00 H new ATOM 1053 N GLU A 70 -16.353 11.064 -10.805 1.00 0.00 N ATOM 1054 CA GLU A 70 -16.825 9.684 -10.793 1.00 0.00 C ATOM 1055 C GLU A 70 -17.908 9.471 -11.846 1.00 0.00 C ATOM 1056 O GLU A 70 -18.779 10.318 -12.036 1.00 0.00 O ATOM 1057 CB GLU A 70 -17.364 9.318 -9.409 1.00 0.00 C ATOM 1058 CG GLU A 70 -18.037 7.957 -9.359 1.00 0.00 C ATOM 1059 CD GLU A 70 -17.047 6.823 -9.173 1.00 0.00 C ATOM 1060 OE1 GLU A 70 -16.215 6.608 -10.079 1.00 0.00 O ATOM 1061 OE2 GLU A 70 -17.104 6.152 -8.121 1.00 0.00 O ATOM 0 H GLU A 70 -16.560 11.588 -9.955 1.00 0.00 H new ATOM 0 HA GLU A 70 -15.981 9.036 -11.029 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -16.543 9.335 -8.692 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -18.078 10.079 -9.093 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -18.758 7.942 -8.542 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -18.596 7.798 -10.281 1.00 0.00 H new ATOM 1068 N MET A 71 -17.845 8.332 -12.529 1.00 0.00 N ATOM 1069 CA MET A 71 -18.820 8.006 -13.562 1.00 0.00 C ATOM 1070 C MET A 71 -20.203 8.533 -13.191 1.00 0.00 C ATOM 1071 O MET A 71 -20.914 7.926 -12.392 1.00 0.00 O ATOM 1072 CB MET A 71 -18.880 6.493 -13.779 1.00 0.00 C ATOM 1073 CG MET A 71 -17.549 5.885 -14.193 1.00 0.00 C ATOM 1074 SD MET A 71 -16.856 6.668 -15.662 1.00 0.00 S ATOM 1075 CE MET A 71 -17.082 5.369 -16.876 1.00 0.00 C ATOM 0 H MET A 71 -17.129 7.620 -12.385 1.00 0.00 H new ATOM 0 HA MET A 71 -18.504 8.486 -14.488 1.00 0.00 H new ATOM 0 HB2 MET A 71 -19.218 6.015 -12.859 1.00 0.00 H new ATOM 0 HB3 MET A 71 -19.624 6.273 -14.544 1.00 0.00 H new ATOM 0 HG2 MET A 71 -16.841 5.975 -13.369 1.00 0.00 H new ATOM 0 HG3 MET A 71 -17.684 4.820 -14.383 1.00 0.00 H new ATOM 0 HE1 MET A 71 -16.701 5.703 -17.841 1.00 0.00 H new ATOM 0 HE2 MET A 71 -16.540 4.478 -16.560 1.00 0.00 H new ATOM 0 HE3 MET A 71 -18.143 5.136 -16.966 1.00 0.00 H new ATOM 1085 N ASN A 72 -20.576 9.666 -13.777 1.00 0.00 N ATOM 1086 CA ASN A 72 -21.874 10.275 -13.506 1.00 0.00 C ATOM 1087 C ASN A 72 -22.134 11.444 -14.451 1.00 0.00 C ATOM 1088 O ASN A 72 -21.544 12.515 -14.308 1.00 0.00 O ATOM 1089 CB ASN A 72 -21.943 10.753 -12.054 1.00 0.00 C ATOM 1090 CG ASN A 72 -23.277 11.392 -11.719 1.00 0.00 C ATOM 1091 OD1 ASN A 72 -24.321 10.744 -11.782 1.00 0.00 O ATOM 1092 ND2 ASN A 72 -23.247 12.670 -11.360 1.00 0.00 N ATOM 0 H ASN A 72 -19.999 10.181 -14.442 1.00 0.00 H new ATOM 0 HA ASN A 72 -22.643 9.520 -13.670 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -21.770 9.908 -11.387 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -21.143 11.471 -11.872 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -24.113 13.154 -11.123 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -22.358 13.168 -11.322 1.00 0.00 H new ATOM 1099 N LEU A 73 -23.021 11.231 -15.416 1.00 0.00 N ATOM 1100 CA LEU A 73 -23.361 12.266 -16.386 1.00 0.00 C ATOM 1101 C LEU A 73 -24.871 12.478 -16.450 1.00 0.00 C ATOM 1102 O LEU A 73 -25.593 11.694 -17.066 1.00 0.00 O ATOM 1103 CB LEU A 73 -22.828 11.892 -17.769 1.00 0.00 C ATOM 1104 CG LEU A 73 -21.346 12.176 -18.017 1.00 0.00 C ATOM 1105 CD1 LEU A 73 -21.102 13.672 -18.140 1.00 0.00 C ATOM 1106 CD2 LEU A 73 -20.496 11.586 -16.901 1.00 0.00 C ATOM 0 H LEU A 73 -23.518 10.350 -15.548 1.00 0.00 H new ATOM 0 HA LEU A 73 -22.895 13.197 -16.064 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -23.005 10.828 -17.929 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -23.410 12.429 -18.518 1.00 0.00 H new ATOM 0 HG LEU A 73 -21.058 11.703 -18.956 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -20.042 13.854 -18.316 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -21.682 14.068 -18.974 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -21.407 14.167 -17.218 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -19.444 11.798 -17.094 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -20.787 12.030 -15.949 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -20.647 10.507 -16.860 1.00 0.00 H new ATOM 1118 N THR A 74 -25.342 13.544 -15.810 1.00 0.00 N ATOM 1119 CA THR A 74 -26.764 13.860 -15.795 1.00 0.00 C ATOM 1120 C THR A 74 -27.118 14.856 -16.894 1.00 0.00 C ATOM 1121 O THR A 74 -27.907 15.776 -16.680 1.00 0.00 O ATOM 1122 CB THR A 74 -27.197 14.438 -14.435 1.00 0.00 C ATOM 1123 OG1 THR A 74 -26.495 15.659 -14.176 1.00 0.00 O ATOM 1124 CG2 THR A 74 -26.928 13.445 -13.315 1.00 0.00 C ATOM 0 H THR A 74 -24.758 14.203 -15.295 1.00 0.00 H new ATOM 0 HA THR A 74 -27.297 12.925 -15.970 1.00 0.00 H new ATOM 0 HB THR A 74 -28.268 14.636 -14.474 1.00 0.00 H new ATOM 0 HG1 THR A 74 -26.777 16.021 -13.310 1.00 0.00 H new ATOM 0 HG21 THR A 74 -27.242 13.875 -12.364 1.00 0.00 H new ATOM 0 HG22 THR A 74 -27.487 12.528 -13.500 1.00 0.00 H new ATOM 0 HG23 THR A 74 -25.862 13.219 -13.277 1.00 0.00 H new ATOM 1132 N ASN A 75 -26.529 14.667 -18.070 1.00 0.00 N ATOM 1133 CA ASN A 75 -26.783 15.549 -19.203 1.00 0.00 C ATOM 1134 C ASN A 75 -26.090 15.034 -20.461 1.00 0.00 C ATOM 1135 O ASN A 75 -25.048 14.381 -20.386 1.00 0.00 O ATOM 1136 CB ASN A 75 -26.303 16.968 -18.888 1.00 0.00 C ATOM 1137 CG ASN A 75 -24.844 17.006 -18.475 1.00 0.00 C ATOM 1138 OD1 ASN A 75 -24.584 16.748 -17.199 1.00 0.00 O flip ATOM 1139 ND2 ASN A 75 -23.962 17.265 -19.294 1.00 0.00 N flip ATOM 0 H ASN A 75 -25.872 13.911 -18.263 1.00 0.00 H new ATOM 0 HA ASN A 75 -27.858 15.567 -19.384 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -26.446 17.600 -19.764 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -26.915 17.387 -18.089 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -24.208 17.457 -20.265 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -22.985 17.288 -19.001 1.00 0.00 H new ATOM 1146 N LEU A 76 -26.675 15.331 -21.616 1.00 0.00 N ATOM 1147 CA LEU A 76 -26.114 14.898 -22.891 1.00 0.00 C ATOM 1148 C LEU A 76 -25.815 16.095 -23.788 1.00 0.00 C ATOM 1149 O LEU A 76 -24.795 16.128 -24.477 1.00 0.00 O ATOM 1150 CB LEU A 76 -27.080 13.945 -23.598 1.00 0.00 C ATOM 1151 CG LEU A 76 -26.441 12.898 -24.511 1.00 0.00 C ATOM 1152 CD1 LEU A 76 -27.480 11.887 -24.972 1.00 0.00 C ATOM 1153 CD2 LEU A 76 -25.777 13.566 -25.706 1.00 0.00 C ATOM 0 H LEU A 76 -27.537 15.870 -21.696 1.00 0.00 H new ATOM 0 HA LEU A 76 -25.179 14.375 -22.690 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -27.668 13.427 -22.840 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -27.776 14.539 -24.191 1.00 0.00 H new ATOM 0 HG LEU A 76 -25.675 12.369 -23.945 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -27.007 11.150 -25.621 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -27.909 11.385 -24.105 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -28.269 12.401 -25.521 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -25.328 12.806 -26.345 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -26.524 14.122 -26.274 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -25.003 14.250 -25.357 1.00 0.00 H new ATOM 1165 N VAL A 77 -26.709 17.078 -23.773 1.00 0.00 N ATOM 1166 CA VAL A 77 -26.539 18.279 -24.583 1.00 0.00 C ATOM 1167 C VAL A 77 -26.168 19.477 -23.717 1.00 0.00 C ATOM 1168 O VAL A 77 -26.196 19.402 -22.488 1.00 0.00 O ATOM 1169 CB VAL A 77 -27.819 18.608 -25.374 1.00 0.00 C ATOM 1170 CG1 VAL A 77 -28.187 17.456 -26.297 1.00 0.00 C ATOM 1171 CG2 VAL A 77 -28.964 18.929 -24.426 1.00 0.00 C ATOM 0 H VAL A 77 -27.559 17.067 -23.209 1.00 0.00 H new ATOM 0 HA VAL A 77 -25.729 18.076 -25.284 1.00 0.00 H new ATOM 0 HB VAL A 77 -27.629 19.488 -25.988 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -29.094 17.706 -26.848 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -27.373 17.279 -27.000 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -28.358 16.556 -25.706 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -29.860 19.159 -25.002 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -29.156 18.070 -23.784 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -28.697 19.789 -23.811 1.00 0.00 H new ATOM 1181 N LYS A 78 -25.819 20.583 -24.366 1.00 0.00 N ATOM 1182 CA LYS A 78 -25.443 21.800 -23.656 1.00 0.00 C ATOM 1183 C LYS A 78 -25.937 23.038 -24.399 1.00 0.00 C ATOM 1184 O LYS A 78 -26.250 22.976 -25.588 1.00 0.00 O ATOM 1185 CB LYS A 78 -23.924 21.867 -23.486 1.00 0.00 C ATOM 1186 CG LYS A 78 -23.412 21.086 -22.288 1.00 0.00 C ATOM 1187 CD LYS A 78 -23.597 21.863 -20.995 1.00 0.00 C ATOM 1188 CE LYS A 78 -22.739 21.294 -19.875 1.00 0.00 C ATOM 1189 NZ LYS A 78 -23.146 21.820 -18.543 1.00 0.00 N ATOM 0 H LYS A 78 -25.789 20.662 -25.383 1.00 0.00 H new ATOM 0 HA LYS A 78 -25.912 21.777 -22.672 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -23.448 21.484 -24.389 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -23.624 22.910 -23.385 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -23.940 20.135 -22.220 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -22.356 20.856 -22.427 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -23.338 22.909 -21.158 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -24.646 21.837 -20.700 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -22.816 20.207 -19.875 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -21.693 21.540 -20.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -22.538 21.409 -17.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -23.049 22.855 -18.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -24.137 21.564 -18.357 1.00 0.00 H new ATOM 1203 N SER A 79 -26.003 24.161 -23.691 1.00 0.00 N ATOM 1204 CA SER A 79 -26.461 25.412 -24.284 1.00 0.00 C ATOM 1205 C SER A 79 -25.295 26.374 -24.489 1.00 0.00 C ATOM 1206 O SER A 79 -24.380 26.442 -23.669 1.00 0.00 O ATOM 1207 CB SER A 79 -27.524 26.062 -23.396 1.00 0.00 C ATOM 1208 OG SER A 79 -28.396 26.877 -24.159 1.00 0.00 O ATOM 0 H SER A 79 -25.745 24.230 -22.707 1.00 0.00 H new ATOM 0 HA SER A 79 -26.899 25.187 -25.257 1.00 0.00 H new ATOM 0 HB2 SER A 79 -28.098 25.289 -22.885 1.00 0.00 H new ATOM 0 HB3 SER A 79 -27.041 26.663 -22.625 1.00 0.00 H new ATOM 0 HG SER A 79 -29.067 27.280 -23.569 1.00 0.00 H new ATOM 1214 N GLY A 80 -25.336 27.118 -25.590 1.00 0.00 N ATOM 1215 CA GLY A 80 -24.278 28.067 -25.885 1.00 0.00 C ATOM 1216 C GLY A 80 -24.635 28.998 -27.026 1.00 0.00 C ATOM 1217 O GLY A 80 -24.047 28.945 -28.106 1.00 0.00 O ATOM 0 H GLY A 80 -26.083 27.081 -26.283 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -24.064 28.656 -24.993 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -23.367 27.524 -26.135 1.00 0.00 H new ATOM 1221 N PRO A 81 -25.623 29.875 -26.793 1.00 0.00 N ATOM 1222 CA PRO A 81 -26.081 30.837 -27.799 1.00 0.00 C ATOM 1223 C PRO A 81 -25.048 31.925 -28.073 1.00 0.00 C ATOM 1224 O PRO A 81 -24.007 31.984 -27.420 1.00 0.00 O ATOM 1225 CB PRO A 81 -27.338 31.441 -27.167 1.00 0.00 C ATOM 1226 CG PRO A 81 -27.142 31.273 -25.700 1.00 0.00 C ATOM 1227 CD PRO A 81 -26.369 29.994 -25.529 1.00 0.00 C ATOM 0 HA PRO A 81 -26.258 30.363 -28.764 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -27.449 32.492 -27.434 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -28.238 30.929 -27.508 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -26.596 32.118 -25.280 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -28.100 31.223 -25.182 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -25.700 30.041 -24.670 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -27.031 29.142 -25.371 1.00 0.00 H new ATOM 1235 N SER A 82 -25.344 32.785 -29.043 1.00 0.00 N ATOM 1236 CA SER A 82 -24.439 33.869 -29.406 1.00 0.00 C ATOM 1237 C SER A 82 -25.213 35.057 -29.970 1.00 0.00 C ATOM 1238 O SER A 82 -26.428 34.990 -30.151 1.00 0.00 O ATOM 1239 CB SER A 82 -23.411 33.383 -30.429 1.00 0.00 C ATOM 1240 OG SER A 82 -22.532 32.431 -29.856 1.00 0.00 O ATOM 0 H SER A 82 -26.203 32.752 -29.591 1.00 0.00 H new ATOM 0 HA SER A 82 -23.918 34.192 -28.504 1.00 0.00 H new ATOM 0 HB2 SER A 82 -23.924 32.941 -31.283 1.00 0.00 H new ATOM 0 HB3 SER A 82 -22.839 34.231 -30.805 1.00 0.00 H new ATOM 0 HG SER A 82 -21.886 32.135 -30.531 1.00 0.00 H new ATOM 1246 N SER A 83 -24.498 36.143 -30.246 1.00 0.00 N ATOM 1247 CA SER A 83 -25.117 37.348 -30.786 1.00 0.00 C ATOM 1248 C SER A 83 -24.139 38.109 -31.676 1.00 0.00 C ATOM 1249 O SER A 83 -22.962 37.761 -31.763 1.00 0.00 O ATOM 1250 CB SER A 83 -25.599 38.252 -29.650 1.00 0.00 C ATOM 1251 OG SER A 83 -24.516 38.944 -29.054 1.00 0.00 O ATOM 0 H SER A 83 -23.490 36.213 -30.105 1.00 0.00 H new ATOM 0 HA SER A 83 -25.973 37.047 -31.390 1.00 0.00 H new ATOM 0 HB2 SER A 83 -26.325 38.969 -30.034 1.00 0.00 H new ATOM 0 HB3 SER A 83 -26.111 37.653 -28.897 1.00 0.00 H new ATOM 0 HG SER A 83 -24.851 39.516 -28.332 1.00 0.00 H new ATOM 1257 N GLY A 84 -24.636 39.150 -32.337 1.00 0.00 N ATOM 1258 CA GLY A 84 -23.794 39.944 -33.212 1.00 0.00 C ATOM 1259 C GLY A 84 -23.820 41.418 -32.861 1.00 0.00 C ATOM 1260 O GLY A 84 -23.841 41.751 -31.677 1.00 0.00 O ATOM 0 H GLY A 84 -25.607 39.458 -32.282 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -22.769 39.578 -33.155 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -24.122 39.813 -34.243 1.00 0.00 H new TER 1264 GLY A 84 HETATM 1265 ZN ZN A 201 -6.867 -0.761 -7.999 1.00 0.00 ZN HETATM 1266 ZN ZN A 401 2.257 1.309 -4.575 1.00 0.00 ZN