USER MOD reduce.3.24.130724 H: found=0, std=0, add=533, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 530 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.025 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 26:sc= 0.369 USER MOD Single : A 8 HIS : no HD1:sc= -0.0624 X(o=-0.062,f=-0.079) USER MOD Single : A 9 GLN : amide:sc= -0.153 X(o=-0.15,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0204 USER MOD Single : A 19 THR OG1 : rot -170:sc= -0.487 USER MOD Single : A 27 MET CE :methyl -122:sc= -0.498 (180deg=-1.03) USER MOD Single : A 29 ASN : amide:sc= 1.19 K(o=1.2,f=-0.035) USER MOD Single : A 30 ASN : amide:sc= -0.043 K(o=-0.043,f=-1.3) USER MOD Single : A 32 LYS NZ :NH3+ 163:sc=-0.00486 (180deg=-0.125) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 148:sc= -0.348 (180deg=-1.56!) USER MOD Single : A 52 ASN : amide:sc= -0.0302 K(o=-0.03,f=-1.3!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 161:sc= -0.0306 (180deg=-0.27) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 32:sc= 0.709 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.924 4.022 20.922 1.00 0.00 N ATOM 2 CA GLY A 1 -3.081 4.463 21.679 1.00 0.00 C ATOM 3 C GLY A 1 -3.950 3.307 22.135 1.00 0.00 C ATOM 4 O GLY A 1 -3.556 2.532 23.006 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.362 4.848 20.633 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.340 3.396 21.513 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.239 3.505 20.076 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.748 5.029 22.549 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.675 5.141 21.066 1.00 0.00 H new ATOM 8 N SER A 2 -5.136 3.192 21.546 1.00 0.00 N ATOM 9 CA SER A 2 -6.066 2.127 21.901 1.00 0.00 C ATOM 10 C SER A 2 -6.362 1.240 20.696 1.00 0.00 C ATOM 11 O SER A 2 -6.385 0.014 20.804 1.00 0.00 O ATOM 12 CB SER A 2 -7.367 2.716 22.447 1.00 0.00 C ATOM 13 OG SER A 2 -8.018 3.508 21.468 1.00 0.00 O ATOM 0 H SER A 2 -5.475 3.824 20.821 1.00 0.00 H new ATOM 0 HA SER A 2 -5.601 1.516 22.674 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.028 1.911 22.767 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.154 3.322 23.327 1.00 0.00 H new ATOM 0 HG SER A 2 -8.848 3.872 21.841 1.00 0.00 H new ATOM 19 N SER A 3 -6.587 1.870 19.547 1.00 0.00 N ATOM 20 CA SER A 3 -6.887 1.139 18.321 1.00 0.00 C ATOM 21 C SER A 3 -5.620 0.915 17.501 1.00 0.00 C ATOM 22 O SER A 3 -5.079 1.846 16.905 1.00 0.00 O ATOM 23 CB SER A 3 -7.920 1.900 17.488 1.00 0.00 C ATOM 24 OG SER A 3 -8.274 1.172 16.325 1.00 0.00 O ATOM 0 H SER A 3 -6.567 2.884 19.440 1.00 0.00 H new ATOM 0 HA SER A 3 -7.298 0.168 18.596 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.810 2.087 18.089 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.518 2.872 17.204 1.00 0.00 H new ATOM 0 HG SER A 3 -8.936 1.679 15.811 1.00 0.00 H new ATOM 30 N GLY A 4 -5.152 -0.330 17.474 1.00 0.00 N ATOM 31 CA GLY A 4 -3.954 -0.654 16.724 1.00 0.00 C ATOM 32 C GLY A 4 -2.690 -0.198 17.424 1.00 0.00 C ATOM 33 O GLY A 4 -2.635 0.909 17.961 1.00 0.00 O ATOM 0 H GLY A 4 -5.581 -1.118 17.958 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.909 -1.731 16.565 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.008 -0.189 15.740 1.00 0.00 H new ATOM 37 N SER A 5 -1.671 -1.052 17.420 1.00 0.00 N ATOM 38 CA SER A 5 -0.403 -0.732 18.065 1.00 0.00 C ATOM 39 C SER A 5 0.667 -0.404 17.028 1.00 0.00 C ATOM 40 O SER A 5 1.387 0.587 17.154 1.00 0.00 O ATOM 41 CB SER A 5 0.059 -1.900 18.939 1.00 0.00 C ATOM 42 OG SER A 5 1.310 -1.621 19.544 1.00 0.00 O ATOM 0 H SER A 5 -1.699 -1.970 16.977 1.00 0.00 H new ATOM 0 HA SER A 5 -0.556 0.145 18.694 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.685 -2.098 19.710 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.138 -2.803 18.333 1.00 0.00 H new ATOM 0 HG SER A 5 1.582 -2.382 20.098 1.00 0.00 H new ATOM 48 N SER A 6 0.765 -1.244 16.003 1.00 0.00 N ATOM 49 CA SER A 6 1.749 -1.047 14.945 1.00 0.00 C ATOM 50 C SER A 6 1.574 0.319 14.287 1.00 0.00 C ATOM 51 O SER A 6 0.534 0.608 13.697 1.00 0.00 O ATOM 52 CB SER A 6 1.625 -2.151 13.892 1.00 0.00 C ATOM 53 OG SER A 6 0.323 -2.182 13.335 1.00 0.00 O ATOM 0 H SER A 6 0.175 -2.067 15.883 1.00 0.00 H new ATOM 0 HA SER A 6 2.741 -1.091 15.394 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.358 -1.988 13.102 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.853 -3.116 14.344 1.00 0.00 H new ATOM 0 HG SER A 6 -0.085 -1.294 13.408 1.00 0.00 H new ATOM 59 N GLY A 7 2.601 1.156 14.394 1.00 0.00 N ATOM 60 CA GLY A 7 2.542 2.481 13.807 1.00 0.00 C ATOM 61 C GLY A 7 3.144 2.526 12.416 1.00 0.00 C ATOM 62 O GLY A 7 3.696 1.534 11.938 1.00 0.00 O ATOM 0 H GLY A 7 3.473 0.940 14.877 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.503 2.809 13.761 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.070 3.184 14.451 1.00 0.00 H new ATOM 66 N HIS A 8 3.036 3.679 11.763 1.00 0.00 N ATOM 67 CA HIS A 8 3.573 3.849 10.417 1.00 0.00 C ATOM 68 C HIS A 8 5.097 3.782 10.429 1.00 0.00 C ATOM 69 O HIS A 8 5.756 4.556 11.122 1.00 0.00 O ATOM 70 CB HIS A 8 3.114 5.183 9.827 1.00 0.00 C ATOM 71 CG HIS A 8 1.654 5.453 10.023 1.00 0.00 C ATOM 72 ND1 HIS A 8 1.171 6.634 10.548 1.00 0.00 N ATOM 73 CD2 HIS A 8 0.568 4.689 9.760 1.00 0.00 C ATOM 74 CE1 HIS A 8 -0.148 6.583 10.600 1.00 0.00 C ATOM 75 NE2 HIS A 8 -0.539 5.413 10.128 1.00 0.00 N ATOM 0 H HIS A 8 2.582 4.509 12.144 1.00 0.00 H new ATOM 0 HA HIS A 8 3.196 3.037 9.796 1.00 0.00 H new ATOM 0 HB2 HIS A 8 3.689 5.989 10.282 1.00 0.00 H new ATOM 0 HB3 HIS A 8 3.338 5.195 8.760 1.00 0.00 H new ATOM 0 HD2 HIS A 8 0.572 3.695 9.339 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -0.796 7.365 10.966 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -1.506 5.098 10.050 1.00 0.00 H new ATOM 83 N GLN A 9 5.650 2.851 9.657 1.00 0.00 N ATOM 84 CA GLN A 9 7.096 2.683 9.580 1.00 0.00 C ATOM 85 C GLN A 9 7.635 3.207 8.253 1.00 0.00 C ATOM 86 O GLN A 9 8.655 3.895 8.215 1.00 0.00 O ATOM 87 CB GLN A 9 7.469 1.210 9.750 1.00 0.00 C ATOM 88 CG GLN A 9 6.860 0.302 8.693 1.00 0.00 C ATOM 89 CD GLN A 9 6.980 -1.167 9.046 1.00 0.00 C ATOM 90 OE1 GLN A 9 6.110 -1.730 9.711 1.00 0.00 O ATOM 91 NE2 GLN A 9 8.061 -1.797 8.602 1.00 0.00 N ATOM 0 H GLN A 9 5.118 2.202 9.077 1.00 0.00 H new ATOM 0 HA GLN A 9 7.547 3.260 10.387 1.00 0.00 H new ATOM 0 HB2 GLN A 9 8.554 1.113 9.719 1.00 0.00 H new ATOM 0 HB3 GLN A 9 7.147 0.874 10.735 1.00 0.00 H new ATOM 0 HG2 GLN A 9 5.808 0.556 8.564 1.00 0.00 H new ATOM 0 HG3 GLN A 9 7.351 0.483 7.737 1.00 0.00 H new ATOM 0 HE21 GLN A 9 8.757 -1.291 8.054 1.00 0.00 H new ATOM 0 HE22 GLN A 9 8.195 -2.787 8.809 1.00 0.00 H new ATOM 100 N GLU A 10 6.944 2.875 7.167 1.00 0.00 N ATOM 101 CA GLU A 10 7.355 3.311 5.837 1.00 0.00 C ATOM 102 C GLU A 10 8.785 2.870 5.539 1.00 0.00 C ATOM 103 O GLU A 10 9.596 3.652 5.039 1.00 0.00 O ATOM 104 CB GLU A 10 7.244 4.833 5.719 1.00 0.00 C ATOM 105 CG GLU A 10 7.235 5.333 4.284 1.00 0.00 C ATOM 106 CD GLU A 10 7.663 6.782 4.168 1.00 0.00 C ATOM 107 OE1 GLU A 10 8.800 7.098 4.576 1.00 0.00 O ATOM 108 OE2 GLU A 10 6.861 7.600 3.670 1.00 0.00 O ATOM 0 H GLU A 10 6.098 2.306 7.182 1.00 0.00 H new ATOM 0 HA GLU A 10 6.690 2.848 5.108 1.00 0.00 H new ATOM 0 HB2 GLU A 10 6.331 5.162 6.215 1.00 0.00 H new ATOM 0 HB3 GLU A 10 8.078 5.292 6.250 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.900 4.713 3.683 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.233 5.220 3.870 1.00 0.00 H new ATOM 115 N ILE A 11 9.087 1.614 5.848 1.00 0.00 N ATOM 116 CA ILE A 11 10.418 1.069 5.612 1.00 0.00 C ATOM 117 C ILE A 11 10.891 1.366 4.192 1.00 0.00 C ATOM 118 O ILE A 11 10.092 1.407 3.256 1.00 0.00 O ATOM 119 CB ILE A 11 10.452 -0.454 5.844 1.00 0.00 C ATOM 120 CG1 ILE A 11 11.812 -1.024 5.435 1.00 0.00 C ATOM 121 CG2 ILE A 11 9.333 -1.132 5.067 1.00 0.00 C ATOM 122 CD1 ILE A 11 12.939 -0.618 6.359 1.00 0.00 C ATOM 0 H ILE A 11 8.428 0.955 6.262 1.00 0.00 H new ATOM 0 HA ILE A 11 11.087 1.552 6.324 1.00 0.00 H new ATOM 0 HB ILE A 11 10.302 -0.649 6.906 1.00 0.00 H new ATOM 0 HG12 ILE A 11 11.748 -2.112 5.409 1.00 0.00 H new ATOM 0 HG13 ILE A 11 12.046 -0.694 4.423 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.369 -2.207 5.240 1.00 0.00 H new ATOM 0 HG22 ILE A 11 8.371 -0.743 5.401 1.00 0.00 H new ATOM 0 HG23 ILE A 11 9.456 -0.932 4.003 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.873 -1.058 6.009 1.00 0.00 H new ATOM 0 HD12 ILE A 11 13.030 0.468 6.367 1.00 0.00 H new ATOM 0 HD13 ILE A 11 12.727 -0.972 7.368 1.00 0.00 H new ATOM 134 N LYS A 12 12.194 1.572 4.040 1.00 0.00 N ATOM 135 CA LYS A 12 12.776 1.863 2.735 1.00 0.00 C ATOM 136 C LYS A 12 12.485 0.738 1.747 1.00 0.00 C ATOM 137 O LYS A 12 12.649 -0.438 2.065 1.00 0.00 O ATOM 138 CB LYS A 12 14.287 2.068 2.861 1.00 0.00 C ATOM 139 CG LYS A 12 15.059 0.780 3.088 1.00 0.00 C ATOM 140 CD LYS A 12 16.558 1.024 3.114 1.00 0.00 C ATOM 141 CE LYS A 12 17.307 -0.169 3.688 1.00 0.00 C ATOM 142 NZ LYS A 12 17.318 -1.322 2.747 1.00 0.00 N ATOM 0 H LYS A 12 12.868 1.543 4.805 1.00 0.00 H new ATOM 0 HA LYS A 12 12.322 2.780 2.359 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.657 2.548 1.955 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.485 2.751 3.687 1.00 0.00 H new ATOM 0 HG2 LYS A 12 14.747 0.329 4.030 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.819 0.067 2.299 1.00 0.00 H new ATOM 0 HD2 LYS A 12 16.912 1.225 2.103 1.00 0.00 H new ATOM 0 HD3 LYS A 12 16.773 1.911 3.710 1.00 0.00 H new ATOM 0 HE2 LYS A 12 18.332 0.122 3.918 1.00 0.00 H new ATOM 0 HE3 LYS A 12 16.843 -0.471 4.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 17.838 -2.115 3.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 16.341 -1.617 2.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 17.783 -1.042 1.860 1.00 0.00 H new ATOM 156 N GLY A 13 12.054 1.109 0.545 1.00 0.00 N ATOM 157 CA GLY A 13 11.749 0.118 -0.472 1.00 0.00 C ATOM 158 C GLY A 13 12.280 0.508 -1.837 1.00 0.00 C ATOM 159 O GLY A 13 11.517 0.915 -2.714 1.00 0.00 O ATOM 0 H GLY A 13 11.911 2.077 0.257 1.00 0.00 H new ATOM 0 HA2 GLY A 13 12.176 -0.842 -0.180 1.00 0.00 H new ATOM 0 HA3 GLY A 13 10.669 -0.018 -0.531 1.00 0.00 H new ATOM 163 N ARG A 14 13.591 0.384 -2.019 1.00 0.00 N ATOM 164 CA ARG A 14 14.223 0.728 -3.286 1.00 0.00 C ATOM 165 C ARG A 14 13.614 -0.074 -4.433 1.00 0.00 C ATOM 166 O ARG A 14 13.130 0.493 -5.413 1.00 0.00 O ATOM 167 CB ARG A 14 15.729 0.473 -3.215 1.00 0.00 C ATOM 168 CG ARG A 14 16.534 1.298 -4.207 1.00 0.00 C ATOM 169 CD ARG A 14 16.813 2.693 -3.672 1.00 0.00 C ATOM 170 NE ARG A 14 17.966 2.716 -2.776 1.00 0.00 N ATOM 171 CZ ARG A 14 19.222 2.589 -3.190 1.00 0.00 C ATOM 172 NH1 ARG A 14 19.485 2.431 -4.479 1.00 0.00 N ATOM 173 NH2 ARG A 14 20.217 2.619 -2.312 1.00 0.00 N ATOM 0 H ARG A 14 14.236 0.048 -1.304 1.00 0.00 H new ATOM 0 HA ARG A 14 14.049 1.788 -3.474 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.079 0.691 -2.206 1.00 0.00 H new ATOM 0 HB3 ARG A 14 15.919 -0.585 -3.397 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.476 0.794 -4.421 1.00 0.00 H new ATOM 0 HG3 ARG A 14 15.990 1.370 -5.149 1.00 0.00 H new ATOM 0 HD2 ARG A 14 16.989 3.372 -4.506 1.00 0.00 H new ATOM 0 HD3 ARG A 14 15.934 3.060 -3.141 1.00 0.00 H new ATOM 0 HE ARG A 14 17.798 2.836 -1.777 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.722 2.407 -5.156 1.00 0.00 H new ATOM 0 HH12 ARG A 14 20.450 2.334 -4.794 1.00 0.00 H new ATOM 0 HH21 ARG A 14 20.017 2.740 -1.319 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.181 2.521 -2.630 1.00 0.00 H new ATOM 187 N LYS A 15 13.642 -1.396 -4.303 1.00 0.00 N ATOM 188 CA LYS A 15 13.092 -2.277 -5.327 1.00 0.00 C ATOM 189 C LYS A 15 12.102 -3.265 -4.720 1.00 0.00 C ATOM 190 O LYS A 15 12.445 -4.415 -4.444 1.00 0.00 O ATOM 191 CB LYS A 15 14.218 -3.036 -6.034 1.00 0.00 C ATOM 192 CG LYS A 15 14.974 -2.196 -7.048 1.00 0.00 C ATOM 193 CD LYS A 15 14.197 -2.056 -8.346 1.00 0.00 C ATOM 194 CE LYS A 15 14.357 -3.286 -9.227 1.00 0.00 C ATOM 195 NZ LYS A 15 15.650 -3.273 -9.966 1.00 0.00 N ATOM 0 H LYS A 15 14.040 -1.881 -3.499 1.00 0.00 H new ATOM 0 HA LYS A 15 12.564 -1.661 -6.055 1.00 0.00 H new ATOM 0 HB2 LYS A 15 14.920 -3.407 -5.287 1.00 0.00 H new ATOM 0 HB3 LYS A 15 13.798 -3.907 -6.537 1.00 0.00 H new ATOM 0 HG2 LYS A 15 15.168 -1.208 -6.631 1.00 0.00 H new ATOM 0 HG3 LYS A 15 15.943 -2.653 -7.250 1.00 0.00 H new ATOM 0 HD2 LYS A 15 13.141 -1.901 -8.124 1.00 0.00 H new ATOM 0 HD3 LYS A 15 14.543 -1.174 -8.885 1.00 0.00 H new ATOM 0 HE2 LYS A 15 14.299 -4.184 -8.612 1.00 0.00 H new ATOM 0 HE3 LYS A 15 13.532 -3.333 -9.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 15.722 -4.127 -10.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 15.695 -2.429 -10.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 16.438 -3.253 -9.287 1.00 0.00 H new ATOM 209 N THR A 16 10.869 -2.810 -4.515 1.00 0.00 N ATOM 210 CA THR A 16 9.828 -3.654 -3.941 1.00 0.00 C ATOM 211 C THR A 16 9.728 -4.984 -4.680 1.00 0.00 C ATOM 212 O THR A 16 9.983 -5.057 -5.883 1.00 0.00 O ATOM 213 CB THR A 16 8.456 -2.956 -3.976 1.00 0.00 C ATOM 214 OG1 THR A 16 8.595 -1.583 -3.592 1.00 0.00 O ATOM 215 CG2 THR A 16 7.472 -3.650 -3.047 1.00 0.00 C ATOM 0 H THR A 16 10.567 -1.862 -4.738 1.00 0.00 H new ATOM 0 HA THR A 16 10.107 -3.838 -2.904 1.00 0.00 H new ATOM 0 HB THR A 16 8.071 -3.011 -4.994 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.718 -1.146 -3.618 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.510 -3.139 -3.089 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.346 -4.687 -3.359 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.854 -3.622 -2.026 1.00 0.00 H new ATOM 223 N LEU A 17 9.356 -6.032 -3.954 1.00 0.00 N ATOM 224 CA LEU A 17 9.221 -7.360 -4.542 1.00 0.00 C ATOM 225 C LEU A 17 7.797 -7.596 -5.033 1.00 0.00 C ATOM 226 O LEU A 17 6.893 -7.861 -4.240 1.00 0.00 O ATOM 227 CB LEU A 17 9.607 -8.433 -3.521 1.00 0.00 C ATOM 228 CG LEU A 17 10.085 -9.766 -4.097 1.00 0.00 C ATOM 229 CD1 LEU A 17 9.210 -10.185 -5.269 1.00 0.00 C ATOM 230 CD2 LEU A 17 11.542 -9.671 -4.523 1.00 0.00 C ATOM 0 H LEU A 17 9.143 -5.988 -2.958 1.00 0.00 H new ATOM 0 HA LEU A 17 9.894 -7.422 -5.397 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.395 -8.032 -2.883 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.745 -8.624 -2.882 1.00 0.00 H new ATOM 0 HG LEU A 17 10.004 -10.526 -3.320 1.00 0.00 H new ATOM 0 HD11 LEU A 17 9.565 -11.136 -5.666 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.179 -10.295 -4.932 1.00 0.00 H new ATOM 0 HD13 LEU A 17 9.258 -9.425 -6.049 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.865 -10.629 -4.931 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.649 -8.898 -5.284 1.00 0.00 H new ATOM 0 HD23 LEU A 17 12.158 -9.418 -3.660 1.00 0.00 H new ATOM 242 N ALA A 18 7.604 -7.503 -6.345 1.00 0.00 N ATOM 243 CA ALA A 18 6.291 -7.710 -6.941 1.00 0.00 C ATOM 244 C ALA A 18 6.367 -7.675 -8.463 1.00 0.00 C ATOM 245 O ALA A 18 7.290 -7.092 -9.036 1.00 0.00 O ATOM 246 CB ALA A 18 5.310 -6.664 -6.434 1.00 0.00 C ATOM 0 H ALA A 18 8.342 -7.285 -7.015 1.00 0.00 H new ATOM 0 HA ALA A 18 5.936 -8.697 -6.645 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.333 -6.831 -6.888 1.00 0.00 H new ATOM 0 HB2 ALA A 18 5.224 -6.741 -5.350 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.668 -5.670 -6.700 1.00 0.00 H new ATOM 252 N THR A 19 5.393 -8.301 -9.116 1.00 0.00 N ATOM 253 CA THR A 19 5.351 -8.341 -10.572 1.00 0.00 C ATOM 254 C THR A 19 5.279 -6.937 -11.160 1.00 0.00 C ATOM 255 O THR A 19 4.914 -5.974 -10.485 1.00 0.00 O ATOM 256 CB THR A 19 4.146 -9.159 -11.077 1.00 0.00 C ATOM 257 OG1 THR A 19 3.068 -9.073 -10.138 1.00 0.00 O ATOM 258 CG2 THR A 19 4.530 -10.616 -11.283 1.00 0.00 C ATOM 0 H THR A 19 4.622 -8.788 -8.659 1.00 0.00 H new ATOM 0 HA THR A 19 6.272 -8.822 -10.901 1.00 0.00 H new ATOM 0 HB THR A 19 3.828 -8.744 -12.034 1.00 0.00 H new ATOM 0 HG1 THR A 19 2.369 -9.715 -10.382 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.664 -11.174 -11.639 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.331 -10.681 -12.019 1.00 0.00 H new ATOM 0 HG23 THR A 19 4.870 -11.040 -10.338 1.00 0.00 H new ATOM 266 N PRO A 20 5.634 -6.814 -12.447 1.00 0.00 N ATOM 267 CA PRO A 20 5.617 -5.531 -13.154 1.00 0.00 C ATOM 268 C PRO A 20 4.200 -5.020 -13.395 1.00 0.00 C ATOM 269 O PRO A 20 3.932 -3.825 -13.274 1.00 0.00 O ATOM 270 CB PRO A 20 6.303 -5.849 -14.484 1.00 0.00 C ATOM 271 CG PRO A 20 6.082 -7.308 -14.685 1.00 0.00 C ATOM 272 CD PRO A 20 6.079 -7.919 -13.312 1.00 0.00 C ATOM 0 HA PRO A 20 6.109 -4.745 -12.582 1.00 0.00 H new ATOM 0 HB2 PRO A 20 5.874 -5.268 -15.300 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.366 -5.611 -14.448 1.00 0.00 H new ATOM 0 HG2 PRO A 20 5.137 -7.493 -15.196 1.00 0.00 H new ATOM 0 HG3 PRO A 20 6.869 -7.740 -15.303 1.00 0.00 H new ATOM 0 HD2 PRO A 20 5.403 -8.772 -13.253 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.069 -8.277 -13.029 1.00 0.00 H new ATOM 280 N ALA A 21 3.297 -5.933 -13.737 1.00 0.00 N ATOM 281 CA ALA A 21 1.907 -5.576 -13.991 1.00 0.00 C ATOM 282 C ALA A 21 1.236 -5.045 -12.728 1.00 0.00 C ATOM 283 O ALA A 21 0.357 -4.186 -12.794 1.00 0.00 O ATOM 284 CB ALA A 21 1.144 -6.775 -14.533 1.00 0.00 C ATOM 0 H ALA A 21 3.504 -6.926 -13.845 1.00 0.00 H new ATOM 0 HA ALA A 21 1.893 -4.783 -14.739 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.107 -6.493 -14.718 1.00 0.00 H new ATOM 0 HB2 ALA A 21 1.602 -7.107 -15.465 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.175 -7.586 -13.805 1.00 0.00 H new ATOM 290 N VAL A 22 1.655 -5.565 -11.579 1.00 0.00 N ATOM 291 CA VAL A 22 1.095 -5.144 -10.300 1.00 0.00 C ATOM 292 C VAL A 22 1.706 -3.826 -9.840 1.00 0.00 C ATOM 293 O VAL A 22 1.014 -2.965 -9.295 1.00 0.00 O ATOM 294 CB VAL A 22 1.320 -6.209 -9.211 1.00 0.00 C ATOM 295 CG1 VAL A 22 0.819 -5.710 -7.864 1.00 0.00 C ATOM 296 CG2 VAL A 22 0.637 -7.514 -9.593 1.00 0.00 C ATOM 0 H VAL A 22 2.380 -6.279 -11.507 1.00 0.00 H new ATOM 0 HA VAL A 22 0.024 -5.011 -10.452 1.00 0.00 H new ATOM 0 HB VAL A 22 2.390 -6.397 -9.127 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.986 -6.476 -7.107 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.358 -4.804 -7.588 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.247 -5.492 -7.930 1.00 0.00 H new ATOM 0 HG21 VAL A 22 0.806 -8.255 -8.812 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.434 -7.345 -9.707 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.049 -7.878 -10.534 1.00 0.00 H new ATOM 306 N ARG A 23 3.008 -3.673 -10.063 1.00 0.00 N ATOM 307 CA ARG A 23 3.713 -2.458 -9.670 1.00 0.00 C ATOM 308 C ARG A 23 3.009 -1.220 -10.217 1.00 0.00 C ATOM 309 O ARG A 23 3.090 -0.140 -9.633 1.00 0.00 O ATOM 310 CB ARG A 23 5.158 -2.498 -10.171 1.00 0.00 C ATOM 311 CG ARG A 23 6.067 -3.382 -9.332 1.00 0.00 C ATOM 312 CD ARG A 23 7.391 -3.645 -10.035 1.00 0.00 C ATOM 313 NE ARG A 23 8.227 -4.585 -9.293 1.00 0.00 N ATOM 314 CZ ARG A 23 9.319 -5.151 -9.795 1.00 0.00 C ATOM 315 NH1 ARG A 23 9.704 -4.874 -11.033 1.00 0.00 N ATOM 316 NH2 ARG A 23 10.027 -5.996 -9.058 1.00 0.00 N ATOM 0 H ARG A 23 3.595 -4.375 -10.513 1.00 0.00 H new ATOM 0 HA ARG A 23 3.713 -2.404 -8.581 1.00 0.00 H new ATOM 0 HB2 ARG A 23 5.167 -2.855 -11.201 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.559 -1.484 -10.181 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.253 -2.905 -8.370 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.568 -4.329 -9.127 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.200 -4.040 -11.033 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.927 -2.705 -10.162 1.00 0.00 H new ATOM 0 HE ARG A 23 7.958 -4.820 -8.338 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.161 -4.225 -11.603 1.00 0.00 H new ATOM 0 HH12 ARG A 23 10.543 -5.310 -11.416 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.733 -6.212 -8.105 1.00 0.00 H new ATOM 0 HH22 ARG A 23 10.865 -6.430 -9.444 1.00 0.00 H new ATOM 330 N ARG A 24 2.318 -1.386 -11.340 1.00 0.00 N ATOM 331 CA ARG A 24 1.601 -0.281 -11.966 1.00 0.00 C ATOM 332 C ARG A 24 0.257 -0.048 -11.282 1.00 0.00 C ATOM 333 O ARG A 24 -0.169 1.093 -11.099 1.00 0.00 O ATOM 334 CB ARG A 24 1.387 -0.563 -13.455 1.00 0.00 C ATOM 335 CG ARG A 24 0.172 0.140 -14.038 1.00 0.00 C ATOM 336 CD ARG A 24 0.260 0.239 -15.553 1.00 0.00 C ATOM 337 NE ARG A 24 -1.059 0.235 -16.179 1.00 0.00 N ATOM 338 CZ ARG A 24 -1.250 0.317 -17.491 1.00 0.00 C ATOM 339 NH1 ARG A 24 -0.211 0.408 -18.312 1.00 0.00 N ATOM 340 NH2 ARG A 24 -2.481 0.308 -17.986 1.00 0.00 N ATOM 0 H ARG A 24 2.239 -2.274 -11.835 1.00 0.00 H new ATOM 0 HA ARG A 24 2.205 0.620 -11.857 1.00 0.00 H new ATOM 0 HB2 ARG A 24 2.275 -0.254 -14.006 1.00 0.00 H new ATOM 0 HB3 ARG A 24 1.280 -1.638 -13.601 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.732 -0.402 -13.759 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.089 1.139 -13.611 1.00 0.00 H new ATOM 0 HD2 ARG A 24 0.788 1.152 -15.827 1.00 0.00 H new ATOM 0 HD3 ARG A 24 0.846 -0.596 -15.937 1.00 0.00 H new ATOM 0 HE ARG A 24 -1.879 0.165 -15.576 1.00 0.00 H new ATOM 0 HH11 ARG A 24 0.737 0.415 -17.936 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -0.361 0.471 -19.319 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -3.282 0.238 -17.359 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -2.626 0.371 -18.994 1.00 0.00 H new ATOM 354 N LEU A 25 -0.407 -1.136 -10.908 1.00 0.00 N ATOM 355 CA LEU A 25 -1.703 -1.051 -10.245 1.00 0.00 C ATOM 356 C LEU A 25 -1.662 -0.050 -9.094 1.00 0.00 C ATOM 357 O LEU A 25 -2.700 0.430 -8.639 1.00 0.00 O ATOM 358 CB LEU A 25 -2.123 -2.427 -9.725 1.00 0.00 C ATOM 359 CG LEU A 25 -3.627 -2.656 -9.571 1.00 0.00 C ATOM 360 CD1 LEU A 25 -4.333 -2.475 -10.906 1.00 0.00 C ATOM 361 CD2 LEU A 25 -3.900 -4.041 -9.004 1.00 0.00 C ATOM 0 H LEU A 25 -0.069 -2.087 -11.053 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.435 -0.706 -10.975 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.728 -3.185 -10.401 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.650 -2.587 -8.756 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.019 -1.916 -8.873 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.402 -2.642 -10.778 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.165 -1.462 -11.272 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.938 -3.191 -11.626 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.975 -4.187 -8.901 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.494 -4.796 -9.677 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.426 -4.134 -8.027 1.00 0.00 H new ATOM 373 N ALA A 26 -0.456 0.262 -8.632 1.00 0.00 N ATOM 374 CA ALA A 26 -0.279 1.208 -7.538 1.00 0.00 C ATOM 375 C ALA A 26 -0.076 2.625 -8.066 1.00 0.00 C ATOM 376 O ALA A 26 -0.736 3.563 -7.619 1.00 0.00 O ATOM 377 CB ALA A 26 0.898 0.795 -6.667 1.00 0.00 C ATOM 0 H ALA A 26 0.413 -0.127 -8.998 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.185 1.199 -6.933 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.018 1.511 -5.854 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.714 -0.196 -6.253 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.806 0.774 -7.269 1.00 0.00 H new ATOM 383 N MET A 27 0.839 2.772 -9.017 1.00 0.00 N ATOM 384 CA MET A 27 1.128 4.075 -9.605 1.00 0.00 C ATOM 385 C MET A 27 -0.140 4.710 -10.168 1.00 0.00 C ATOM 386 O MET A 27 -0.274 5.932 -10.191 1.00 0.00 O ATOM 387 CB MET A 27 2.178 3.939 -10.709 1.00 0.00 C ATOM 388 CG MET A 27 1.607 3.467 -12.036 1.00 0.00 C ATOM 389 SD MET A 27 2.759 3.688 -13.406 1.00 0.00 S ATOM 390 CE MET A 27 4.068 2.561 -12.931 1.00 0.00 C ATOM 0 H MET A 27 1.394 2.005 -9.398 1.00 0.00 H new ATOM 0 HA MET A 27 1.519 4.722 -8.820 1.00 0.00 H new ATOM 0 HB2 MET A 27 2.666 4.902 -10.855 1.00 0.00 H new ATOM 0 HB3 MET A 27 2.947 3.238 -10.384 1.00 0.00 H new ATOM 0 HG2 MET A 27 1.339 2.413 -11.958 1.00 0.00 H new ATOM 0 HG3 MET A 27 0.688 4.014 -12.247 1.00 0.00 H new ATOM 0 HE1 MET A 27 5.007 3.108 -12.847 1.00 0.00 H new ATOM 0 HE2 MET A 27 3.826 2.107 -11.970 1.00 0.00 H new ATOM 0 HE3 MET A 27 4.169 1.781 -13.686 1.00 0.00 H new ATOM 400 N GLU A 28 -1.066 3.870 -10.622 1.00 0.00 N ATOM 401 CA GLU A 28 -2.321 4.350 -11.185 1.00 0.00 C ATOM 402 C GLU A 28 -3.304 4.728 -10.081 1.00 0.00 C ATOM 403 O GLU A 28 -4.098 5.656 -10.233 1.00 0.00 O ATOM 404 CB GLU A 28 -2.941 3.285 -12.092 1.00 0.00 C ATOM 405 CG GLU A 28 -2.145 3.030 -13.362 1.00 0.00 C ATOM 406 CD GLU A 28 -2.524 3.973 -14.486 1.00 0.00 C ATOM 407 OE1 GLU A 28 -3.733 4.093 -14.778 1.00 0.00 O ATOM 408 OE2 GLU A 28 -1.612 4.592 -15.074 1.00 0.00 O ATOM 0 H GLU A 28 -0.970 2.855 -10.610 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.106 5.240 -11.777 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.030 2.352 -11.535 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -3.951 3.593 -12.362 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.082 3.135 -13.147 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.304 2.002 -13.686 1.00 0.00 H new ATOM 415 N ASN A 29 -3.245 4.002 -8.971 1.00 0.00 N ATOM 416 CA ASN A 29 -4.131 4.259 -7.841 1.00 0.00 C ATOM 417 C ASN A 29 -3.385 4.973 -6.717 1.00 0.00 C ATOM 418 O ASN A 29 -3.860 5.032 -5.583 1.00 0.00 O ATOM 419 CB ASN A 29 -4.724 2.948 -7.321 1.00 0.00 C ATOM 420 CG ASN A 29 -5.739 2.354 -8.279 1.00 0.00 C ATOM 421 OD1 ASN A 29 -6.866 2.839 -8.385 1.00 0.00 O ATOM 422 ND2 ASN A 29 -5.344 1.298 -8.981 1.00 0.00 N ATOM 0 H ASN A 29 -2.593 3.231 -8.829 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.939 4.904 -8.185 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -3.921 2.230 -7.155 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -5.199 3.124 -6.356 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -5.984 0.855 -9.640 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -4.400 0.930 -8.861 1.00 0.00 H new ATOM 429 N ASN A 30 -2.215 5.513 -7.040 1.00 0.00 N ATOM 430 CA ASN A 30 -1.404 6.223 -6.058 1.00 0.00 C ATOM 431 C ASN A 30 -1.290 5.422 -4.765 1.00 0.00 C ATOM 432 O ASN A 30 -1.495 5.954 -3.673 1.00 0.00 O ATOM 433 CB ASN A 30 -2.005 7.599 -5.767 1.00 0.00 C ATOM 434 CG ASN A 30 -2.177 8.432 -7.022 1.00 0.00 C ATOM 435 OD1 ASN A 30 -1.646 8.097 -8.081 1.00 0.00 O ATOM 436 ND2 ASN A 30 -2.923 9.525 -6.910 1.00 0.00 N ATOM 0 H ASN A 30 -1.807 5.473 -7.974 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.405 6.351 -6.474 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.973 7.474 -5.282 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -1.363 8.132 -5.066 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -3.075 10.124 -7.721 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.344 9.765 -6.013 1.00 0.00 H new ATOM 443 N ILE A 31 -0.962 4.140 -4.895 1.00 0.00 N ATOM 444 CA ILE A 31 -0.821 3.266 -3.737 1.00 0.00 C ATOM 445 C ILE A 31 0.647 3.072 -3.373 1.00 0.00 C ATOM 446 O ILE A 31 1.509 2.981 -4.247 1.00 0.00 O ATOM 447 CB ILE A 31 -1.462 1.889 -3.989 1.00 0.00 C ATOM 448 CG1 ILE A 31 -2.981 2.025 -4.110 1.00 0.00 C ATOM 449 CG2 ILE A 31 -1.099 0.923 -2.871 1.00 0.00 C ATOM 450 CD1 ILE A 31 -3.677 0.730 -4.466 1.00 0.00 C ATOM 0 H ILE A 31 -0.789 3.684 -5.791 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.338 3.751 -2.909 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.075 1.490 -4.927 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.381 2.395 -3.166 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.211 2.773 -4.869 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.560 -0.046 -3.064 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.016 0.808 -2.827 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -1.461 1.314 -1.920 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.751 0.901 -4.535 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.305 0.369 -5.425 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -3.477 -0.014 -3.695 1.00 0.00 H new ATOM 462 N LYS A 32 0.926 3.007 -2.075 1.00 0.00 N ATOM 463 CA LYS A 32 2.288 2.820 -1.592 1.00 0.00 C ATOM 464 C LYS A 32 2.616 1.337 -1.449 1.00 0.00 C ATOM 465 O LYS A 32 2.355 0.731 -0.409 1.00 0.00 O ATOM 466 CB LYS A 32 2.477 3.527 -0.248 1.00 0.00 C ATOM 467 CG LYS A 32 2.484 5.042 -0.353 1.00 0.00 C ATOM 468 CD LYS A 32 1.086 5.618 -0.208 1.00 0.00 C ATOM 469 CE LYS A 32 0.739 5.882 1.249 1.00 0.00 C ATOM 470 NZ LYS A 32 1.469 7.063 1.787 1.00 0.00 N ATOM 0 H LYS A 32 0.225 3.081 -1.338 1.00 0.00 H new ATOM 0 HA LYS A 32 2.969 3.256 -2.323 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.679 3.222 0.429 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.416 3.198 0.197 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.132 5.458 0.419 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.903 5.339 -1.315 1.00 0.00 H new ATOM 0 HD2 LYS A 32 1.014 6.547 -0.774 1.00 0.00 H new ATOM 0 HD3 LYS A 32 0.360 4.926 -0.636 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -0.335 6.045 1.343 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.981 5.002 1.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 1.009 7.386 2.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.454 6.799 1.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 1.454 7.830 1.085 1.00 0.00 H new ATOM 484 N LEU A 33 3.190 0.759 -2.498 1.00 0.00 N ATOM 485 CA LEU A 33 3.555 -0.654 -2.489 1.00 0.00 C ATOM 486 C LEU A 33 3.996 -1.092 -1.097 1.00 0.00 C ATOM 487 O LEU A 33 3.400 -1.990 -0.499 1.00 0.00 O ATOM 488 CB LEU A 33 4.674 -0.918 -3.498 1.00 0.00 C ATOM 489 CG LEU A 33 4.228 -1.311 -4.906 1.00 0.00 C ATOM 490 CD1 LEU A 33 5.435 -1.582 -5.791 1.00 0.00 C ATOM 491 CD2 LEU A 33 3.317 -2.528 -4.858 1.00 0.00 C ATOM 0 H LEU A 33 3.413 1.246 -3.366 1.00 0.00 H new ATOM 0 HA LEU A 33 2.676 -1.234 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.290 -0.021 -3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.310 -1.711 -3.105 1.00 0.00 H new ATOM 0 HG LEU A 33 3.667 -0.480 -5.334 1.00 0.00 H new ATOM 0 HD11 LEU A 33 5.099 -1.860 -6.790 1.00 0.00 H new ATOM 0 HD12 LEU A 33 6.050 -0.684 -5.852 1.00 0.00 H new ATOM 0 HD13 LEU A 33 6.022 -2.396 -5.366 1.00 0.00 H new ATOM 0 HD21 LEU A 33 3.010 -2.793 -5.870 1.00 0.00 H new ATOM 0 HD22 LEU A 33 3.852 -3.366 -4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.435 -2.299 -4.259 1.00 0.00 H new ATOM 503 N SER A 34 5.042 -0.453 -0.582 1.00 0.00 N ATOM 504 CA SER A 34 5.563 -0.778 0.740 1.00 0.00 C ATOM 505 C SER A 34 4.430 -0.923 1.750 1.00 0.00 C ATOM 506 O SER A 34 4.441 -1.827 2.586 1.00 0.00 O ATOM 507 CB SER A 34 6.542 0.302 1.205 1.00 0.00 C ATOM 508 OG SER A 34 7.192 -0.081 2.404 1.00 0.00 O ATOM 0 H SER A 34 5.545 0.294 -1.061 1.00 0.00 H new ATOM 0 HA SER A 34 6.089 -1.730 0.672 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.284 0.484 0.427 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.007 1.239 1.361 1.00 0.00 H new ATOM 0 HG SER A 34 7.813 0.625 2.679 1.00 0.00 H new ATOM 514 N GLU A 35 3.453 -0.027 1.666 1.00 0.00 N ATOM 515 CA GLU A 35 2.311 -0.054 2.574 1.00 0.00 C ATOM 516 C GLU A 35 1.426 -1.266 2.299 1.00 0.00 C ATOM 517 O GLU A 35 0.878 -1.871 3.221 1.00 0.00 O ATOM 518 CB GLU A 35 1.492 1.231 2.438 1.00 0.00 C ATOM 519 CG GLU A 35 2.256 2.484 2.833 1.00 0.00 C ATOM 520 CD GLU A 35 2.784 2.422 4.253 1.00 0.00 C ATOM 521 OE1 GLU A 35 3.860 1.824 4.459 1.00 0.00 O ATOM 522 OE2 GLU A 35 2.122 2.971 5.158 1.00 0.00 O ATOM 0 H GLU A 35 3.428 0.727 0.979 1.00 0.00 H new ATOM 0 HA GLU A 35 2.691 -0.127 3.593 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.156 1.330 1.406 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.599 1.150 3.057 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.089 2.629 2.146 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.603 3.351 2.730 1.00 0.00 H new ATOM 529 N VAL A 36 1.290 -1.615 1.024 1.00 0.00 N ATOM 530 CA VAL A 36 0.473 -2.754 0.625 1.00 0.00 C ATOM 531 C VAL A 36 0.922 -4.028 1.334 1.00 0.00 C ATOM 532 O VAL A 36 2.076 -4.441 1.218 1.00 0.00 O ATOM 533 CB VAL A 36 0.528 -2.981 -0.898 1.00 0.00 C ATOM 534 CG1 VAL A 36 -0.390 -4.124 -1.301 1.00 0.00 C ATOM 535 CG2 VAL A 36 0.160 -1.704 -1.638 1.00 0.00 C ATOM 0 H VAL A 36 1.736 -1.124 0.249 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.553 -2.523 0.913 1.00 0.00 H new ATOM 0 HB VAL A 36 1.547 -3.253 -1.172 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -0.338 -4.269 -2.380 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.077 -5.038 -0.796 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.415 -3.885 -1.016 1.00 0.00 H new ATOM 0 HG21 VAL A 36 0.204 -1.881 -2.713 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.850 -1.401 -1.361 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.862 -0.914 -1.372 1.00 0.00 H new ATOM 545 N VAL A 37 0.002 -4.646 2.068 1.00 0.00 N ATOM 546 CA VAL A 37 0.302 -5.874 2.794 1.00 0.00 C ATOM 547 C VAL A 37 0.582 -7.026 1.835 1.00 0.00 C ATOM 548 O VAL A 37 -0.342 -7.656 1.320 1.00 0.00 O ATOM 549 CB VAL A 37 -0.854 -6.269 3.731 1.00 0.00 C ATOM 550 CG1 VAL A 37 -0.545 -7.580 4.437 1.00 0.00 C ATOM 551 CG2 VAL A 37 -1.125 -5.161 4.738 1.00 0.00 C ATOM 0 H VAL A 37 -0.957 -4.316 2.175 1.00 0.00 H new ATOM 0 HA VAL A 37 1.193 -5.679 3.391 1.00 0.00 H new ATOM 0 HB VAL A 37 -1.753 -6.411 3.131 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.373 -7.843 5.095 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -0.405 -8.368 3.697 1.00 0.00 H new ATOM 0 HG13 VAL A 37 0.365 -7.470 5.026 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.945 -5.457 5.392 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -0.230 -4.985 5.335 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -1.394 -4.247 4.209 1.00 0.00 H new ATOM 561 N GLY A 38 1.862 -7.296 1.598 1.00 0.00 N ATOM 562 CA GLY A 38 2.240 -8.372 0.702 1.00 0.00 C ATOM 563 C GLY A 38 1.798 -9.731 1.208 1.00 0.00 C ATOM 564 O GLY A 38 1.828 -9.993 2.410 1.00 0.00 O ATOM 0 H GLY A 38 2.644 -6.788 2.011 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.802 -8.193 -0.280 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.322 -8.370 0.573 1.00 0.00 H new ATOM 568 N SER A 39 1.384 -10.597 0.289 1.00 0.00 N ATOM 569 CA SER A 39 0.928 -11.934 0.649 1.00 0.00 C ATOM 570 C SER A 39 2.017 -12.970 0.383 1.00 0.00 C ATOM 571 O SER A 39 2.257 -13.857 1.200 1.00 0.00 O ATOM 572 CB SER A 39 -0.335 -12.293 -0.135 1.00 0.00 C ATOM 573 OG SER A 39 -0.972 -13.434 0.416 1.00 0.00 O ATOM 0 H SER A 39 1.355 -10.397 -0.711 1.00 0.00 H new ATOM 0 HA SER A 39 0.699 -11.938 1.715 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.024 -11.449 -0.126 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.078 -12.484 -1.177 1.00 0.00 H new ATOM 0 HG SER A 39 -1.777 -13.641 -0.103 1.00 0.00 H new ATOM 579 N GLY A 40 2.672 -12.848 -0.767 1.00 0.00 N ATOM 580 CA GLY A 40 3.728 -13.778 -1.122 1.00 0.00 C ATOM 581 C GLY A 40 4.643 -14.090 0.046 1.00 0.00 C ATOM 582 O GLY A 40 4.670 -13.358 1.036 1.00 0.00 O ATOM 0 H GLY A 40 2.490 -12.122 -1.460 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.285 -14.703 -1.489 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.316 -13.360 -1.939 1.00 0.00 H new ATOM 586 N LYS A 41 5.394 -15.180 -0.067 1.00 0.00 N ATOM 587 CA LYS A 41 6.315 -15.587 0.988 1.00 0.00 C ATOM 588 C LYS A 41 7.435 -14.566 1.157 1.00 0.00 C ATOM 589 O LYS A 41 7.628 -14.017 2.242 1.00 0.00 O ATOM 590 CB LYS A 41 6.908 -16.962 0.671 1.00 0.00 C ATOM 591 CG LYS A 41 5.900 -18.094 0.759 1.00 0.00 C ATOM 592 CD LYS A 41 6.574 -19.416 1.088 1.00 0.00 C ATOM 593 CE LYS A 41 5.554 -20.529 1.279 1.00 0.00 C ATOM 594 NZ LYS A 41 5.048 -20.583 2.679 1.00 0.00 N ATOM 0 H LYS A 41 5.383 -15.798 -0.879 1.00 0.00 H new ATOM 0 HA LYS A 41 5.756 -15.644 1.922 1.00 0.00 H new ATOM 0 HB2 LYS A 41 7.333 -16.942 -0.333 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.728 -17.162 1.361 1.00 0.00 H new ATOM 0 HG2 LYS A 41 5.158 -17.863 1.523 1.00 0.00 H new ATOM 0 HG3 LYS A 41 5.367 -18.182 -0.188 1.00 0.00 H new ATOM 0 HD2 LYS A 41 7.262 -19.685 0.286 1.00 0.00 H new ATOM 0 HD3 LYS A 41 7.169 -19.307 1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 41 4.718 -20.377 0.596 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.007 -21.486 1.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 4.356 -21.354 2.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 5.842 -20.754 3.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 4.593 -19.679 2.919 1.00 0.00 H new ATOM 608 N ASP A 42 8.168 -14.314 0.078 1.00 0.00 N ATOM 609 CA ASP A 42 9.267 -13.356 0.106 1.00 0.00 C ATOM 610 C ASP A 42 8.745 -11.927 -0.006 1.00 0.00 C ATOM 611 O ASP A 42 9.168 -11.168 -0.877 1.00 0.00 O ATOM 612 CB ASP A 42 10.252 -13.643 -1.027 1.00 0.00 C ATOM 613 CG ASP A 42 11.191 -14.789 -0.702 1.00 0.00 C ATOM 614 OD1 ASP A 42 10.833 -15.949 -0.992 1.00 0.00 O ATOM 615 OD2 ASP A 42 12.283 -14.525 -0.158 1.00 0.00 O ATOM 0 H ASP A 42 8.021 -14.760 -0.827 1.00 0.00 H new ATOM 0 HA ASP A 42 9.783 -13.461 1.060 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.698 -13.878 -1.936 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.836 -12.746 -1.233 1.00 0.00 H new ATOM 620 N GLY A 43 7.821 -11.568 0.880 1.00 0.00 N ATOM 621 CA GLY A 43 7.255 -10.231 0.861 1.00 0.00 C ATOM 622 C GLY A 43 6.753 -9.832 -0.512 1.00 0.00 C ATOM 623 O GLY A 43 6.521 -8.653 -0.777 1.00 0.00 O ATOM 0 H GLY A 43 7.454 -12.178 1.610 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.433 -10.178 1.574 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.009 -9.516 1.190 1.00 0.00 H new ATOM 627 N ARG A 44 6.588 -10.818 -1.388 1.00 0.00 N ATOM 628 CA ARG A 44 6.114 -10.564 -2.744 1.00 0.00 C ATOM 629 C ARG A 44 4.652 -10.125 -2.735 1.00 0.00 C ATOM 630 O ARG A 44 3.775 -10.866 -2.291 1.00 0.00 O ATOM 631 CB ARG A 44 6.276 -11.816 -3.607 1.00 0.00 C ATOM 632 CG ARG A 44 5.877 -11.610 -5.060 1.00 0.00 C ATOM 633 CD ARG A 44 6.581 -12.599 -5.975 1.00 0.00 C ATOM 634 NE ARG A 44 6.617 -12.133 -7.359 1.00 0.00 N ATOM 635 CZ ARG A 44 7.206 -12.801 -8.345 1.00 0.00 C ATOM 636 NH1 ARG A 44 7.805 -13.958 -8.100 1.00 0.00 N ATOM 637 NH2 ARG A 44 7.196 -12.312 -9.579 1.00 0.00 N ATOM 0 H ARG A 44 6.775 -11.800 -1.183 1.00 0.00 H new ATOM 0 HA ARG A 44 6.715 -9.759 -3.167 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.315 -12.143 -3.567 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.673 -12.619 -3.184 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.798 -11.723 -5.162 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.121 -10.592 -5.365 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.599 -12.760 -5.620 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.071 -13.561 -5.929 1.00 0.00 H new ATOM 0 HE ARG A 44 6.165 -11.246 -7.581 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.814 -14.337 -7.153 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.257 -14.469 -8.858 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.736 -11.422 -9.771 1.00 0.00 H new ATOM 0 HH22 ARG A 44 7.649 -12.826 -10.335 1.00 0.00 H new ATOM 651 N ILE A 45 4.400 -8.917 -3.227 1.00 0.00 N ATOM 652 CA ILE A 45 3.046 -8.381 -3.276 1.00 0.00 C ATOM 653 C ILE A 45 2.299 -8.884 -4.506 1.00 0.00 C ATOM 654 O ILE A 45 2.758 -8.719 -5.636 1.00 0.00 O ATOM 655 CB ILE A 45 3.050 -6.840 -3.287 1.00 0.00 C ATOM 656 CG1 ILE A 45 3.757 -6.301 -2.042 1.00 0.00 C ATOM 657 CG2 ILE A 45 1.627 -6.307 -3.367 1.00 0.00 C ATOM 658 CD1 ILE A 45 4.175 -4.852 -2.163 1.00 0.00 C ATOM 0 H ILE A 45 5.115 -8.291 -3.597 1.00 0.00 H new ATOM 0 HA ILE A 45 2.537 -8.729 -2.377 1.00 0.00 H new ATOM 0 HB ILE A 45 3.595 -6.499 -4.167 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.095 -6.409 -1.183 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.639 -6.910 -1.843 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.647 -5.217 -3.374 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.154 -6.667 -4.281 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.059 -6.654 -2.504 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.670 -4.538 -1.244 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.862 -4.740 -3.001 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.294 -4.232 -2.331 1.00 0.00 H new ATOM 670 N LEU A 46 1.143 -9.500 -4.279 1.00 0.00 N ATOM 671 CA LEU A 46 0.330 -10.027 -5.368 1.00 0.00 C ATOM 672 C LEU A 46 -0.747 -9.028 -5.777 1.00 0.00 C ATOM 673 O LEU A 46 -1.210 -8.229 -4.962 1.00 0.00 O ATOM 674 CB LEU A 46 -0.317 -11.350 -4.954 1.00 0.00 C ATOM 675 CG LEU A 46 0.616 -12.385 -4.325 1.00 0.00 C ATOM 676 CD1 LEU A 46 -0.074 -13.737 -4.229 1.00 0.00 C ATOM 677 CD2 LEU A 46 1.905 -12.498 -5.126 1.00 0.00 C ATOM 0 H LEU A 46 0.749 -9.646 -3.350 1.00 0.00 H new ATOM 0 HA LEU A 46 0.982 -10.200 -6.224 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.117 -11.134 -4.246 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -0.781 -11.796 -5.834 1.00 0.00 H new ATOM 0 HG LEU A 46 0.866 -12.055 -3.317 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.605 -14.461 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.968 -13.646 -3.612 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.354 -14.074 -5.227 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.557 -13.239 -4.664 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.674 -12.804 -6.146 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.409 -11.532 -5.143 1.00 0.00 H new ATOM 689 N LYS A 47 -1.146 -9.079 -7.043 1.00 0.00 N ATOM 690 CA LYS A 47 -2.171 -8.181 -7.561 1.00 0.00 C ATOM 691 C LYS A 47 -3.286 -7.982 -6.539 1.00 0.00 C ATOM 692 O LYS A 47 -3.754 -6.863 -6.328 1.00 0.00 O ATOM 693 CB LYS A 47 -2.754 -8.736 -8.863 1.00 0.00 C ATOM 694 CG LYS A 47 -4.097 -8.131 -9.235 1.00 0.00 C ATOM 695 CD LYS A 47 -4.554 -8.590 -10.610 1.00 0.00 C ATOM 696 CE LYS A 47 -4.050 -7.660 -11.703 1.00 0.00 C ATOM 697 NZ LYS A 47 -2.629 -7.933 -12.052 1.00 0.00 N ATOM 0 H LYS A 47 -0.774 -9.734 -7.731 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.706 -7.216 -7.760 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.047 -8.557 -9.673 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.865 -9.816 -8.770 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.842 -8.412 -8.491 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.024 -7.044 -9.219 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.193 -9.601 -10.796 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.643 -8.630 -10.638 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.671 -7.774 -12.592 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.151 -6.626 -11.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.474 -7.728 -13.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.008 -7.329 -11.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.411 -8.932 -11.864 1.00 0.00 H new ATOM 711 N GLU A 48 -3.705 -9.073 -5.905 1.00 0.00 N ATOM 712 CA GLU A 48 -4.763 -9.015 -4.904 1.00 0.00 C ATOM 713 C GLU A 48 -4.470 -7.938 -3.863 1.00 0.00 C ATOM 714 O GLU A 48 -5.246 -6.996 -3.694 1.00 0.00 O ATOM 715 CB GLU A 48 -4.921 -10.373 -4.217 1.00 0.00 C ATOM 716 CG GLU A 48 -4.837 -11.552 -5.173 1.00 0.00 C ATOM 717 CD GLU A 48 -3.418 -12.052 -5.360 1.00 0.00 C ATOM 718 OE1 GLU A 48 -2.828 -12.542 -4.374 1.00 0.00 O ATOM 719 OE2 GLU A 48 -2.897 -11.956 -6.490 1.00 0.00 O ATOM 0 H GLU A 48 -3.328 -10.007 -6.067 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.694 -8.762 -5.412 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.148 -10.478 -3.455 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.881 -10.401 -3.702 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -5.458 -12.365 -4.797 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.246 -11.260 -6.140 1.00 0.00 H new ATOM 726 N ASP A 49 -3.348 -8.084 -3.169 1.00 0.00 N ATOM 727 CA ASP A 49 -2.952 -7.125 -2.145 1.00 0.00 C ATOM 728 C ASP A 49 -3.371 -5.711 -2.534 1.00 0.00 C ATOM 729 O ASP A 49 -3.941 -4.977 -1.726 1.00 0.00 O ATOM 730 CB ASP A 49 -1.439 -7.179 -1.924 1.00 0.00 C ATOM 731 CG ASP A 49 -0.916 -8.600 -1.840 1.00 0.00 C ATOM 732 OD1 ASP A 49 -1.743 -9.535 -1.808 1.00 0.00 O ATOM 733 OD2 ASP A 49 0.320 -8.776 -1.806 1.00 0.00 O ATOM 0 H ASP A 49 -2.696 -8.858 -3.297 1.00 0.00 H new ATOM 0 HA ASP A 49 -3.457 -7.392 -1.217 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -0.937 -6.658 -2.739 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -1.190 -6.648 -1.005 1.00 0.00 H new ATOM 738 N ILE A 50 -3.083 -5.334 -3.776 1.00 0.00 N ATOM 739 CA ILE A 50 -3.431 -4.008 -4.272 1.00 0.00 C ATOM 740 C ILE A 50 -4.931 -3.756 -4.163 1.00 0.00 C ATOM 741 O ILE A 50 -5.370 -2.870 -3.430 1.00 0.00 O ATOM 742 CB ILE A 50 -2.996 -3.823 -5.738 1.00 0.00 C ATOM 743 CG1 ILE A 50 -1.474 -3.925 -5.858 1.00 0.00 C ATOM 744 CG2 ILE A 50 -3.487 -2.487 -6.272 1.00 0.00 C ATOM 745 CD1 ILE A 50 -0.751 -2.654 -5.467 1.00 0.00 C ATOM 0 H ILE A 50 -2.610 -5.928 -4.457 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.898 -3.289 -3.650 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.443 -4.617 -6.337 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.122 -4.742 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.215 -4.180 -6.886 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.171 -2.371 -7.309 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.575 -2.451 -6.218 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.067 -1.679 -5.673 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.324 -2.798 -5.576 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.075 -1.838 -6.113 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.981 -2.409 -4.430 1.00 0.00 H new ATOM 757 N LEU A 51 -5.712 -4.542 -4.895 1.00 0.00 N ATOM 758 CA LEU A 51 -7.164 -4.406 -4.879 1.00 0.00 C ATOM 759 C LEU A 51 -7.704 -4.501 -3.456 1.00 0.00 C ATOM 760 O LEU A 51 -8.779 -3.984 -3.154 1.00 0.00 O ATOM 761 CB LEU A 51 -7.807 -5.484 -5.755 1.00 0.00 C ATOM 762 CG LEU A 51 -7.418 -5.469 -7.233 1.00 0.00 C ATOM 763 CD1 LEU A 51 -7.519 -6.865 -7.827 1.00 0.00 C ATOM 764 CD2 LEU A 51 -8.294 -4.493 -8.005 1.00 0.00 C ATOM 0 H LEU A 51 -5.364 -5.280 -5.507 1.00 0.00 H new ATOM 0 HA LEU A 51 -7.417 -3.424 -5.279 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.550 -6.460 -5.342 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -8.890 -5.383 -5.684 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.383 -5.138 -7.313 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -7.238 -6.834 -8.880 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -6.848 -7.537 -7.292 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -8.543 -7.226 -7.735 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.003 -4.495 -9.055 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.338 -4.793 -7.917 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.169 -3.490 -7.596 1.00 0.00 H new ATOM 776 N ASN A 52 -6.952 -5.165 -2.586 1.00 0.00 N ATOM 777 CA ASN A 52 -7.354 -5.326 -1.193 1.00 0.00 C ATOM 778 C ASN A 52 -6.910 -4.131 -0.357 1.00 0.00 C ATOM 779 O ASN A 52 -7.469 -3.862 0.707 1.00 0.00 O ATOM 780 CB ASN A 52 -6.765 -6.615 -0.616 1.00 0.00 C ATOM 781 CG ASN A 52 -7.495 -7.853 -1.100 1.00 0.00 C ATOM 782 OD1 ASN A 52 -8.699 -7.818 -1.351 1.00 0.00 O ATOM 783 ND2 ASN A 52 -6.766 -8.955 -1.234 1.00 0.00 N ATOM 0 H ASN A 52 -6.060 -5.601 -2.820 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.442 -5.385 -1.159 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -5.713 -6.686 -0.892 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -6.807 -6.575 0.472 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -7.202 -9.819 -1.557 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -5.770 -8.938 -1.014 1.00 0.00 H new ATOM 790 N TYR A 53 -5.902 -3.417 -0.844 1.00 0.00 N ATOM 791 CA TYR A 53 -5.381 -2.250 -0.141 1.00 0.00 C ATOM 792 C TYR A 53 -6.274 -1.034 -0.367 1.00 0.00 C ATOM 793 O TYR A 53 -6.321 -0.121 0.460 1.00 0.00 O ATOM 794 CB TYR A 53 -3.956 -1.944 -0.603 1.00 0.00 C ATOM 795 CG TYR A 53 -3.468 -0.572 -0.196 1.00 0.00 C ATOM 796 CD1 TYR A 53 -3.893 0.566 -0.868 1.00 0.00 C ATOM 797 CD2 TYR A 53 -2.581 -0.414 0.862 1.00 0.00 C ATOM 798 CE1 TYR A 53 -3.450 1.821 -0.500 1.00 0.00 C ATOM 799 CE2 TYR A 53 -2.134 0.836 1.239 1.00 0.00 C ATOM 800 CZ TYR A 53 -2.571 1.951 0.555 1.00 0.00 C ATOM 801 OH TYR A 53 -2.126 3.200 0.925 1.00 0.00 O ATOM 0 H TYR A 53 -5.429 -3.626 -1.723 1.00 0.00 H new ATOM 0 HA TYR A 53 -5.369 -2.476 0.925 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.281 -2.696 -0.194 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -3.909 -2.030 -1.689 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -4.583 0.468 -1.693 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -2.235 -1.285 1.399 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -3.790 2.696 -1.035 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -1.446 0.940 2.065 1.00 0.00 H new ATOM 0 HH TYR A 53 -1.514 3.117 1.686 1.00 0.00 H new ATOM 811 N LEU A 54 -6.979 -1.028 -1.492 1.00 0.00 N ATOM 812 CA LEU A 54 -7.872 0.076 -1.830 1.00 0.00 C ATOM 813 C LEU A 54 -9.199 -0.053 -1.089 1.00 0.00 C ATOM 814 O LEU A 54 -9.686 0.911 -0.497 1.00 0.00 O ATOM 815 CB LEU A 54 -8.119 0.115 -3.338 1.00 0.00 C ATOM 816 CG LEU A 54 -6.947 0.592 -4.197 1.00 0.00 C ATOM 817 CD1 LEU A 54 -7.129 0.150 -5.642 1.00 0.00 C ATOM 818 CD2 LEU A 54 -6.805 2.104 -4.114 1.00 0.00 C ATOM 0 H LEU A 54 -6.950 -1.775 -2.186 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.393 1.006 -1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.401 -0.886 -3.666 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -8.973 0.765 -3.530 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.033 0.140 -3.813 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.286 0.498 -6.238 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.180 -0.938 -5.686 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.052 0.573 -6.038 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -5.966 2.425 -4.731 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.720 2.576 -4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.627 2.396 -3.079 1.00 0.00 H new ATOM 830 N GLU A 55 -9.779 -1.248 -1.125 1.00 0.00 N ATOM 831 CA GLU A 55 -11.050 -1.502 -0.456 1.00 0.00 C ATOM 832 C GLU A 55 -11.004 -1.028 0.994 1.00 0.00 C ATOM 833 O GLU A 55 -12.031 -0.681 1.578 1.00 0.00 O ATOM 834 CB GLU A 55 -11.390 -2.992 -0.508 1.00 0.00 C ATOM 835 CG GLU A 55 -10.453 -3.859 0.316 1.00 0.00 C ATOM 836 CD GLU A 55 -11.045 -5.219 0.634 1.00 0.00 C ATOM 837 OE1 GLU A 55 -11.131 -6.059 -0.286 1.00 0.00 O ATOM 838 OE2 GLU A 55 -11.421 -5.443 1.804 1.00 0.00 O ATOM 0 H GLU A 55 -9.389 -2.056 -1.610 1.00 0.00 H new ATOM 0 HA GLU A 55 -11.826 -0.943 -0.979 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -12.411 -3.136 -0.153 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.363 -3.326 -1.545 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.517 -3.992 -0.226 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -10.213 -3.345 1.247 1.00 0.00 H new ATOM 845 N LYS A 56 -9.807 -1.020 1.570 1.00 0.00 N ATOM 846 CA LYS A 56 -9.625 -0.590 2.951 1.00 0.00 C ATOM 847 C LYS A 56 -9.694 0.930 3.061 1.00 0.00 C ATOM 848 O LYS A 56 -10.178 1.468 4.058 1.00 0.00 O ATOM 849 CB LYS A 56 -8.284 -1.091 3.491 1.00 0.00 C ATOM 850 CG LYS A 56 -8.230 -2.596 3.686 1.00 0.00 C ATOM 851 CD LYS A 56 -7.099 -2.998 4.616 1.00 0.00 C ATOM 852 CE LYS A 56 -7.460 -2.749 6.073 1.00 0.00 C ATOM 853 NZ LYS A 56 -8.521 -3.678 6.548 1.00 0.00 N ATOM 0 H LYS A 56 -8.948 -1.307 1.101 1.00 0.00 H new ATOM 0 HA LYS A 56 -10.431 -1.017 3.547 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -7.492 -0.794 2.804 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -8.080 -0.602 4.444 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.179 -2.945 4.094 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -8.099 -3.084 2.720 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.867 -4.053 4.473 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -6.200 -2.436 4.362 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -6.571 -2.866 6.693 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -7.798 -1.720 6.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -8.517 -3.708 7.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -9.448 -3.345 6.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -8.341 -4.631 6.174 1.00 0.00 H new ATOM 867 N GLN A 57 -9.207 1.617 2.032 1.00 0.00 N ATOM 868 CA GLN A 57 -9.215 3.074 2.014 1.00 0.00 C ATOM 869 C GLN A 57 -10.595 3.607 1.641 1.00 0.00 C ATOM 870 O GLN A 57 -11.185 4.402 2.374 1.00 0.00 O ATOM 871 CB GLN A 57 -8.169 3.598 1.029 1.00 0.00 C ATOM 872 CG GLN A 57 -6.847 2.850 1.090 1.00 0.00 C ATOM 873 CD GLN A 57 -5.897 3.423 2.122 1.00 0.00 C ATOM 874 OE1 GLN A 57 -5.690 2.838 3.186 1.00 0.00 O ATOM 875 NE2 GLN A 57 -5.314 4.575 1.815 1.00 0.00 N ATOM 0 H GLN A 57 -8.802 1.187 1.200 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.969 3.426 3.016 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -8.569 3.530 0.017 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.989 4.654 1.231 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.038 1.802 1.320 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -6.372 2.879 0.109 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -5.514 5.026 0.922 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -4.666 5.010 2.472 1.00 0.00 H new ATOM 884 N THR A 58 -11.103 3.165 0.495 1.00 0.00 N ATOM 885 CA THR A 58 -12.413 3.598 0.023 1.00 0.00 C ATOM 886 C THR A 58 -13.369 3.824 1.188 1.00 0.00 C ATOM 887 O THR A 58 -13.750 2.883 1.882 1.00 0.00 O ATOM 888 CB THR A 58 -13.030 2.570 -0.943 1.00 0.00 C ATOM 889 OG1 THR A 58 -13.204 1.315 -0.276 1.00 0.00 O ATOM 890 CG2 THR A 58 -12.150 2.381 -2.169 1.00 0.00 C ATOM 0 H THR A 58 -10.628 2.508 -0.123 1.00 0.00 H new ATOM 0 HA THR A 58 -12.264 4.538 -0.508 1.00 0.00 H new ATOM 0 HB THR A 58 -14.000 2.947 -1.268 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.394 1.472 0.672 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.607 1.650 -2.836 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.044 3.332 -2.691 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.167 2.025 -1.860 1.00 0.00 H new ATOM 898 N GLY A 59 -13.756 5.079 1.395 1.00 0.00 N ATOM 899 CA GLY A 59 -14.668 5.406 2.477 1.00 0.00 C ATOM 900 C GLY A 59 -14.020 6.275 3.537 1.00 0.00 C ATOM 901 O GLY A 59 -14.620 7.241 4.007 1.00 0.00 O ATOM 0 H GLY A 59 -13.455 5.875 0.833 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -15.539 5.921 2.071 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -15.028 4.485 2.936 1.00 0.00 H new ATOM 905 N ALA A 60 -12.794 5.930 3.916 1.00 0.00 N ATOM 906 CA ALA A 60 -12.066 6.686 4.927 1.00 0.00 C ATOM 907 C ALA A 60 -12.094 8.180 4.621 1.00 0.00 C ATOM 908 O ALA A 60 -11.299 8.674 3.822 1.00 0.00 O ATOM 909 CB ALA A 60 -10.630 6.192 5.023 1.00 0.00 C ATOM 0 H ALA A 60 -12.284 5.132 3.538 1.00 0.00 H new ATOM 0 HA ALA A 60 -12.558 6.529 5.887 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -10.098 6.766 5.782 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.626 5.137 5.296 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -10.136 6.319 4.060 1.00 0.00 H new ATOM 915 N ILE A 61 -13.013 8.893 5.262 1.00 0.00 N ATOM 916 CA ILE A 61 -13.144 10.330 5.058 1.00 0.00 C ATOM 917 C ILE A 61 -12.887 10.705 3.603 1.00 0.00 C ATOM 918 O ILE A 61 -12.118 11.622 3.312 1.00 0.00 O ATOM 919 CB ILE A 61 -12.172 11.117 5.958 1.00 0.00 C ATOM 920 CG1 ILE A 61 -12.013 10.416 7.309 1.00 0.00 C ATOM 921 CG2 ILE A 61 -12.663 12.543 6.149 1.00 0.00 C ATOM 922 CD1 ILE A 61 -10.838 10.922 8.117 1.00 0.00 C ATOM 0 H ILE A 61 -13.678 8.499 5.927 1.00 0.00 H new ATOM 0 HA ILE A 61 -14.168 10.594 5.323 1.00 0.00 H new ATOM 0 HB ILE A 61 -11.197 11.152 5.471 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.927 10.549 7.888 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -11.895 9.345 7.142 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.965 13.086 6.787 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -12.729 13.038 5.180 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -13.647 12.529 6.617 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -10.786 10.381 9.062 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -9.916 10.764 7.557 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -10.964 11.986 8.315 1.00 0.00 H new ATOM 934 N LEU A 62 -13.539 9.991 2.691 1.00 0.00 N ATOM 935 CA LEU A 62 -13.384 10.249 1.264 1.00 0.00 C ATOM 936 C LEU A 62 -14.041 11.568 0.874 1.00 0.00 C ATOM 937 O LEU A 62 -15.072 11.961 1.420 1.00 0.00 O ATOM 938 CB LEU A 62 -13.989 9.104 0.450 1.00 0.00 C ATOM 939 CG LEU A 62 -15.509 9.129 0.284 1.00 0.00 C ATOM 940 CD1 LEU A 62 -15.952 8.090 -0.733 1.00 0.00 C ATOM 941 CD2 LEU A 62 -16.195 8.895 1.622 1.00 0.00 C ATOM 0 H LEU A 62 -14.180 9.229 2.915 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.318 10.318 1.046 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -13.535 9.110 -0.541 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -13.711 8.162 0.923 1.00 0.00 H new ATOM 0 HG LEU A 62 -15.799 10.113 -0.083 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -17.036 8.123 -0.838 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -15.488 8.303 -1.696 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -15.650 7.099 -0.396 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -17.276 8.916 1.485 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -15.898 7.924 2.018 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -15.903 9.677 2.322 1.00 0.00 H new ATOM 953 N PRO A 63 -13.434 12.269 -0.095 1.00 0.00 N ATOM 954 CA PRO A 63 -13.944 13.554 -0.582 1.00 0.00 C ATOM 955 C PRO A 63 -15.241 13.402 -1.369 1.00 0.00 C ATOM 956 O PRO A 63 -15.479 12.390 -2.030 1.00 0.00 O ATOM 957 CB PRO A 63 -12.822 14.061 -1.491 1.00 0.00 C ATOM 958 CG PRO A 63 -12.112 12.830 -1.938 1.00 0.00 C ATOM 959 CD PRO A 63 -12.202 11.862 -0.791 1.00 0.00 C ATOM 0 HA PRO A 63 -14.186 14.232 0.236 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -13.221 14.618 -2.339 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -12.151 14.733 -0.955 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.574 12.417 -2.835 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -11.073 13.047 -2.185 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -12.260 10.831 -1.139 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.331 11.930 -0.139 1.00 0.00 H new ATOM 967 N PRO A 64 -16.100 14.430 -1.302 1.00 0.00 N ATOM 968 CA PRO A 64 -17.388 14.434 -2.003 1.00 0.00 C ATOM 969 C PRO A 64 -17.223 14.545 -3.515 1.00 0.00 C ATOM 970 O PRO A 64 -16.110 14.701 -4.017 1.00 0.00 O ATOM 971 CB PRO A 64 -18.090 15.675 -1.449 1.00 0.00 C ATOM 972 CG PRO A 64 -16.984 16.572 -1.010 1.00 0.00 C ATOM 973 CD PRO A 64 -15.882 15.667 -0.533 1.00 0.00 C ATOM 0 HA PRO A 64 -17.942 13.509 -1.844 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -18.709 16.152 -2.209 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -18.747 15.420 -0.617 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -16.643 17.202 -1.831 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -17.315 17.238 -0.213 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.898 16.094 -0.729 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -15.944 15.489 0.541 1.00 0.00 H new ATOM 981 N SER A 65 -18.337 14.464 -4.235 1.00 0.00 N ATOM 982 CA SER A 65 -18.315 14.552 -5.689 1.00 0.00 C ATOM 983 C SER A 65 -17.967 15.966 -6.143 1.00 0.00 C ATOM 984 O SER A 65 -18.183 16.934 -5.416 1.00 0.00 O ATOM 985 CB SER A 65 -19.670 14.139 -6.267 1.00 0.00 C ATOM 986 OG SER A 65 -19.745 12.735 -6.438 1.00 0.00 O ATOM 0 H SER A 65 -19.266 14.337 -3.834 1.00 0.00 H new ATOM 0 HA SER A 65 -17.548 13.871 -6.057 1.00 0.00 H new ATOM 0 HB2 SER A 65 -20.468 14.471 -5.603 1.00 0.00 H new ATOM 0 HB3 SER A 65 -19.826 14.634 -7.225 1.00 0.00 H new ATOM 0 HG SER A 65 -20.621 12.497 -6.807 1.00 0.00 H new ATOM 992 N GLY A 66 -17.423 16.077 -7.352 1.00 0.00 N ATOM 993 CA GLY A 66 -17.053 17.375 -7.883 1.00 0.00 C ATOM 994 C GLY A 66 -18.202 18.364 -7.853 1.00 0.00 C ATOM 995 O GLY A 66 -18.448 19.032 -6.849 1.00 0.00 O ATOM 0 H GLY A 66 -17.232 15.290 -7.973 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.218 17.775 -7.307 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -16.705 17.258 -8.909 1.00 0.00 H new ATOM 999 N PRO A 67 -18.926 18.468 -8.978 1.00 0.00 N ATOM 1000 CA PRO A 67 -20.066 19.381 -9.102 1.00 0.00 C ATOM 1001 C PRO A 67 -21.257 18.938 -8.259 1.00 0.00 C ATOM 1002 O PRO A 67 -22.112 18.185 -8.723 1.00 0.00 O ATOM 1003 CB PRO A 67 -20.411 19.315 -10.592 1.00 0.00 C ATOM 1004 CG PRO A 67 -19.912 17.985 -11.038 1.00 0.00 C ATOM 1005 CD PRO A 67 -18.687 17.703 -10.213 1.00 0.00 C ATOM 0 HA PRO A 67 -19.826 20.384 -8.750 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.485 19.410 -10.754 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -19.933 20.123 -11.145 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -20.668 17.215 -10.889 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -19.672 17.995 -12.101 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -18.575 16.638 -10.011 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -17.778 18.029 -10.718 1.00 0.00 H new ATOM 1013 N SER A 68 -21.307 19.413 -7.019 1.00 0.00 N ATOM 1014 CA SER A 68 -22.393 19.063 -6.110 1.00 0.00 C ATOM 1015 C SER A 68 -22.760 20.248 -5.221 1.00 0.00 C ATOM 1016 O SER A 68 -21.911 21.074 -4.887 1.00 0.00 O ATOM 1017 CB SER A 68 -21.996 17.866 -5.245 1.00 0.00 C ATOM 1018 OG SER A 68 -23.109 17.368 -4.522 1.00 0.00 O ATOM 0 H SER A 68 -20.609 20.041 -6.620 1.00 0.00 H new ATOM 0 HA SER A 68 -23.264 18.797 -6.709 1.00 0.00 H new ATOM 0 HB2 SER A 68 -21.586 17.077 -5.876 1.00 0.00 H new ATOM 0 HB3 SER A 68 -21.209 18.160 -4.550 1.00 0.00 H new ATOM 0 HG SER A 68 -22.830 16.602 -3.978 1.00 0.00 H new ATOM 1024 N SER A 69 -24.032 20.323 -4.843 1.00 0.00 N ATOM 1025 CA SER A 69 -24.514 21.408 -3.996 1.00 0.00 C ATOM 1026 C SER A 69 -23.878 21.340 -2.610 1.00 0.00 C ATOM 1027 O SER A 69 -23.440 22.353 -2.066 1.00 0.00 O ATOM 1028 CB SER A 69 -26.038 21.350 -3.873 1.00 0.00 C ATOM 1029 OG SER A 69 -26.664 21.945 -4.997 1.00 0.00 O ATOM 0 H SER A 69 -24.747 19.646 -5.110 1.00 0.00 H new ATOM 0 HA SER A 69 -24.230 22.352 -4.461 1.00 0.00 H new ATOM 0 HB2 SER A 69 -26.359 20.312 -3.781 1.00 0.00 H new ATOM 0 HB3 SER A 69 -26.352 21.863 -2.964 1.00 0.00 H new ATOM 0 HG SER A 69 -27.637 21.893 -4.895 1.00 0.00 H new ATOM 1035 N GLY A 70 -23.833 20.137 -2.046 1.00 0.00 N ATOM 1036 CA GLY A 70 -23.250 19.958 -0.729 1.00 0.00 C ATOM 1037 C GLY A 70 -24.279 19.563 0.311 1.00 0.00 C ATOM 1038 O GLY A 70 -24.738 20.400 1.089 1.00 0.00 O ATOM 0 H GLY A 70 -24.189 19.284 -2.477 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -22.476 19.192 -0.779 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -22.764 20.884 -0.421 1.00 0.00 H new TER 1042 GLY A 70